X2JG37_DROME Loading...

Ubiquitin carboxyl-terminal hydrolase

AlphaFold DB , UniProt , Accession X2JG37, Species DROME (Drosophila melanogaster, Fruit fly), Gene Usp2, Length 950 aa.

						>X2JG37_DROME|X2JG37|Usp2
MMLDIKKTRGFHKIPQASKLQSTTKTSSVVATSASSQNEVPSPGGSAGSKVGATNPVRAANQRFFLVSSYKDPTFLKAECDLAHAHVTTSKVKTTLQPHRRSRAGEDSRNNNYNTSRAPTLINMRRPSLFNGNQQPTTTNSTTINNTTSRNTTSNTSNGVLKYSVRSTTATATSTSTRNYGKLKPLNNNQTTAGVAMMNGHTNNNNNNTRNSSNINNGGNNNMQRQQQQHDDISFIDSDDPPATGGPEAGISTTKTSICYFKPITPPLQLRHEQNQVQQQEEQPQPSSSKSASHRYPRPKSTIIASAHSNFAASFEKFSGGLYRQTNGETNIESKTSSNARRYGIDSLSIKASIEKFNNLSGQKRQNPGSGSGIGPGSATASGLGGGRLSVASRSNHGSQAGGSSSNLQQRYSSDLDNIRVAAGYSSSLTRAAYRTTATMNSVSTPVAVTSELGGPISGDGGETATAMGQPTSKVTVRGAHSNRQPIECDSVVLTNKASKDATTAATPTVATATATHTPATSSVSTVTVTAAAPNSASDSVSRSLARSPISSTLARSGTGSSSTARSVLPPMTPTSSRYWDRDSGTSRSSIGTSSALNSSSLKHNSDDGYKTASSSRDEKSEGLCGLRNIGNTCFMNSVIQCLSHTQELTRFLRSHHGSRSLSTKDQQILHEFAKLIQEMWTANVHTVTPMELKRAFSTKHRMYSDYNQQDAQEFLRFFLDSLHSALNSGVKGETLNIDDNLSDNKKADLTWEWYTRHENSLVRDLFVGQLKSTLKCTTCGNTSVTFDPFWDLSVPLPSSSRCKLEACLDLFIREEVLDGDEMPTCAKCKTRRKCTKSFTIQRFPKYLVIHLKRFSETRWSKLSNIVEFPTSDSELNMGSYGANSNSNVHYSLYAISNHMGSTAGGHYVALCKHPVSRKWHEFNDNIVSDALSENHLVSSSAYILFYERT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31	Very low	32.6	Very low	228 Å²	228	145.6 Å²	145.6	100%	1.123	72%	0.717	S	S	*	*				0	116.4	0	-72.9	167	178	0	0	106.6
2	M	28.4	Very low	32.3	Very low	154 Å²	154	143.9 Å²	143.9	76%	0.759	71%	0.705	S	S	*	*				74.7	99	103.6	-72.7	171.2	70.5	0	0	111.9
3	L	33.9	Very low	32	Very low	139 Å²	139	144.4 Å²	144.4	73%	0.728	70%	0.701	S	S	*	*				125.9	155.3	84.9	-79.5	171.3	0	0	0	104.6
4	D	34.7	Very low	31.9	Very low	92 Å²	92	144.1 Å²	144.1	49%	0.492	70%	0.703	S	S	.	*			cis	-149.9	150.9	-10.9	-129.1	22.5	0	0	0	107	K6	D4-K6 IonicContact OD2-NZ 3.36Å; D4-K6 PolarHBondContact OD2-NZ 3.36Å
5	I	38	Very low	32.5	Very low	102 Å²	102	141.4 Å²	141.4	52%	0.523	70%	0.701	S	S	.	*				52.9	136.3	77.6	-47.2	-175.3	0	0	0	112.3	K7	I5-K7 HydrophobicContact CG2-CD 4.06Å; I5-K7 HydrophobicContact CG2-CG 4.2Å
6	K	33.4	Very low	32.2	Very low	167 Å²	167	143.8 Å²	143.8	73%	0.726	71%	0.709	S	S	*	*			cis	-117.1	152.4	21.3	-82.9	83	-163	161	0	111.4	D4	D4-K6 IonicContact OD2-NZ 3.36Å; D4-K6 PolarHBondContact OD2-NZ 3.36Å
7	K	36.9	Very low	32	Very low	163 Å²	163	140.7 Å²	140.7	71%	0.709	71%	0.712	S	S	*	*			cis	71.3	150.6	41.4	-65.5	-169.1	176.3	173.4	0	113.8	I5	I5-K7 HydrophobicContact CG2-CD 4.06Å; I5-K7 HydrophobicContact CG2-CG 4.2Å
8	T	35.8	Very low	31.7	Very low	103 Å²	103	139.1 Å²	139.1	63%	0.632	72%	0.715	S	S	*	*			cis	-174.2	159.7	-20.2	35.1	0	0	0	0	106.2
9	R	32.1	Very low	31.5	Very low	228 Å²	228	141.8 Å²	141.8	86%	0.86	72%	0.722	S	S	*	*				165.8	157.4	93.1	-105.1	156.6	178.4	174.3	-3.7	107.5
10	G	27.5	Very low	31.2	Very low	58 Å²	58	142.7 Å²	142.7	60%	0.598	73%	0.727	S	S	*	*			cis	-155.4	160.5	-3	0	0	0	0	0	111.4
11	F	27.4	Very low	31	Very low	168 Å²	168	145.1 Å²	145.1	74%	0.737	74%	0.736	S	S	*	*				69.1	132.8	96.3	-76.8	-125.3	0	0	0	113.6
12	H	29	Very low	30.7	Very low	125 Å²	125	139.2 Å²	139.2	58%	0.579	72%	0.717	S	S	*	*			cis	-160.6	134.7	3.5	-122.5	18.7	0	0	0	109.9
13	K	27.7	Very low	30.6	Very low	150 Å²	150	138.8 Å²	138.8	65%	0.652	72%	0.723	S	S	*	*				79.4	123.6	103.8	-87.9	-170.9	-179.9	164.4	0	120.1
14	I	30.3	Very low	30.3	Very low	141 Å²	141	138.3 Å²	138.3	72%	0.723	73%	0.726	S	S	*	*				72.5	142.3	128.6	-67.7	179.6	0	0	0	119.5
15	P	42.1	Very low	29.9	Very low	103 Å²	103	143.3 Å²	143.3	67%	0.669	74%	0.743	S	S	*	*			cis	-145.3	-158.4	-29.8	44.6	-23.1	0	0	0	114.1
16	Q	26.9	Very low	29.4	Very low	180 Å²	180	143.8 Å²	143.8	84%	0.841	75%	0.752	S	S	*	*			trans	40.8	129.5	153	-68.2	178.4	1.3	0	0	121.1
17	A	28.3	Very low	29.1	Very low	91 Å²	91	141.2 Å²	141.2	75%	0.752	75%	0.754	S	S	*	*			cis	87.3	116.7	42.5	0	0	0	0	0	116.4
18	S	27.7	Very low	28.6	Very low	111 Å²	111	138.3 Å²	138.3	78%	0.776	75%	0.754	S	S	*	*			trans	157.9	150.3	133.2	60.1	0	0	0	0	115.7
19	K	27.3	Very low	28.3	Very low	191 Å²	191	139.9 Å²	139.9	83%	0.83	76%	0.764	S	S	*	*			trans	61.1	134.4	158.6	-67.7	171.5	-179.1	177.3	0	119.1
20	L	25.5	Very low	27.9	Very low	159 Å²	159	135.7 Å²	135.7	83%	0.832	76%	0.763	S	S	*	*				73.5	101.6	53.6	-90.5	165.1	0	0	0	115.3
21	Q	26.5	Very low	27.9	Very low	194 Å²	194	137.2 Å²	137.2	91%	0.907	77%	0.77	S	S	*	*				-178.6	174.1	111.5	-99.5	178.5	-5	0	0	112.8
22	S	26.4	Very low	27.8	Very low	105 Å²	105	135.5 Å²	135.5	73%	0.734	77%	0.774	S	S	*	*			trans	-113.8	168.1	-171.7	58	0	0	0	0	113.3
23	T	25.5	Very low	27.9	Very low	145 Å²	145	134.8 Å²	134.8	89%	0.89	78%	0.783	S	S	*	*			trans	-164.8	170.8	143.4	5.7	0	0	0	0	112
24	T	26.8	Very low	28	Very low	128 Å²	128	131.7 Å²	131.7	79%	0.785	79%	0.785	S	S	*	*			trans	-123.1	159.6	-164.6	49	0	0	0	0	113.9
25	K	27	Very low	27.9	Very low	197 Å²	197	130.7 Å²	130.7	86%	0.857	79%	0.791	S	S	*	*			trans	165.3	156.6	153.2	-94.3	160.3	-177.4	-178.7	0	109.9
26	T	27	Very low	27.2	Very low	113 Å²	113	131.5 Å²	131.5	69%	0.693	80%	0.799	S	S	*	*			cis	-178.8	162.1	-38.3	24.5	0	0	0	0	107.2
27	S	27.3	Very low	27.3	Very low	112 Å²	112	131 Å²	131	78%	0.783	80%	0.796	S	S	*	*			trans	67.1	153.2	165.2	23.9	0	0	0	0	117.7
28	S	27.7	Very low	27.3	Very low	102 Å²	102	131.8 Å²	131.8	71%	0.713	79%	0.788	S	S	*	*			cis	-166.1	136.4	-9.6	43.8	0	0	0	0	114.1
29	V	27.5	Very low	27.3	Very low	136 Å²	136	134.6 Å²	134.6	82%	0.824	79%	0.789	S	S	*	*			trans	43.6	128.5	132.5	-169.1	0	0	0	0	121.8
30	V	24.6	Very low	27.5	Very low	140 Å²	140	131.3 Å²	131.3	85%	0.848	79%	0.785	S	S	*	*				179	155.3	123	151.3	0	0	0	0	109.6
31	A	28.1	Very low	28.2	Very low	91 Å²	91	129.7 Å²	129.7	75%	0.752	78%	0.783	S	S	*	*			trans	-154.1	159.7	-172.8	0	0	0	0	0	115.4
32	T	25.5	Very low	28.4	Very low	132 Å²	132	125.7 Å²	125.7	81%	0.81	78%	0.777	S	S	*	*			trans	-164.9	129.8	164.3	35.9	0	0	0	0	107.6
33	S	30.7	Very low	29.1	Very low	109 Å²	109	127.1 Å²	127.1	76%	0.762	78%	0.784	S	S	*	*			cis	80.9	131.9	49.4	75.6	0	0	0	0	113.8
34	A	28.8	Very low	29.1	Very low	85 Å²	85	124.2 Å²	124.2	70%	0.702	78%	0.782	S	S	*	*			cis	-164.2	170.8	2.7	0	0	0	0	0	113.6
35	S	29.6	Very low	29	Very low	121 Å²	121	121.9 Å²	121.9	85%	0.846	78%	0.784	S	S	*	*			trans	43.9	156.6	151.4	52.7	0	0	0	0	122.3
36	S	26.2	Very low	28.9	Very low	119 Å²	119	118.1 Å²	118.1	83%	0.832	78%	0.782	S	S	*	*			cis	-144.8	-146.9	27.7	59.8	0	0	0	0	114.9
37	Q	29.2	Very low	28.9	Very low	169 Å²	169	117.7 Å²	117.7	79%	0.79	79%	0.791	S	S	*	*			trans	-150.8	167	-138.3	-122.8	-174	-21.8	0	0	118
38	N	29.4	Very low	28.8	Very low	108 Å²	108	116.1 Å²	116.1	58%	0.578	79%	0.792	S	S	*	*			trans	72.5	154.5	153.3	-68.2	20.5	0	0	0	119.8
39	E	27.1	Very low	28.6	Very low	170 Å²	170	116.8 Å²	116.8	79%	0.794	80%	0.796	S	S	*	*			cis	-158.5	-175.3	-17.2	-116.7	173.4	142.9	0	0	112.2
40	V	30.3	Very low	28.5	Very low	123 Å²	123	119.6 Å²	119.6	75%	0.745	80%	0.798	S	S	*	*			trans	-115.2	160.8	-178.5	-153.8	0	0	0	0	110.9
41	P	41	Very low	28.6	Very low	124 Å²	124	119.9 Å²	119.9	81%	0.805	80%	0.799	S	S	*	*				-148	164.5	114	38.3	-23.5	0	0	0	116.4
42	S	30.2	Very low	28.6	Very low	110 Å²	110	118.8 Å²	118.8	77%	0.769	80%	0.797	S	S	*	*			trans	-134.3	152.4	167.7	-55.5	0	0	0	0	110.1
43	P	42.6	Very low	28.6	Very low	136 Å²	136	117.6 Å²	117.6	88%	0.883	80%	0.8	S	S	*	*			trans	-149.6	164.9	131.4	37.6	-22.1	0	0	0	115.5
44	G	24.5	Very low	28.7	Very low	83 Å²	83	118.8 Å²	118.8	86%	0.856	80%	0.803	S	S	*	*			trans	136.9	129	157.5	0	0	0	0	0	117.3
45	G	24.1	Very low	28.9	Very low	79 Å²	79	120.6 Å²	120.6	81%	0.814	80%	0.801	S	S	*	*			trans	-121	-169	163.8	0	0	0	0	0	110.8
46	S	26	Very low	29	Very low	118 Å²	118	120 Å²	120	83%	0.825	79%	0.794	S	S	*	*			cis	-165.3	168.4	4.8	60.3	0	0	0	0	112.3
47	A	27	Very low	29.3	Very low	105 Å²	105	119.3 Å²	119.3	87%	0.868	79%	0.785	S	S	*	*			trans	63.2	138.8	158.1	0	0	0	0	0	122.1
48	G	23.7	Very low	29.6	Very low	78 Å²	78	122.9 Å²	122.9	80%	0.804	79%	0.791	S	S	*	*			trans	146.7	88.7	156.2	0	0	0	0	0	120.1
49	S	25.2	Very low	29.7	Very low	116 Å²	116	121.8 Å²	121.8	81%	0.811	80%	0.797	S	S	*	*			trans	43.2	106.9	149	-67	0	0	0	0	124.5
50	K	25.1	Very low	29.8	Very low	196 Å²	196	117.6 Å²	117.6	85%	0.852	79%	0.792	S	S	*	*				60.9	121.7	120.8	-79.7	-175.7	176.8	177.2	0	123.9
51	V	27.3	Very low	29.7	Very low	146 Å²	146	118.8 Å²	118.8	89%	0.885	79%	0.794	S	S	*	*			trans	83	118.6	140.2	179.6	0	0	0	0	118.8
52	G	26.2	Very low	29.2	Very low	68 Å²	68	121.3 Å²	121.3	70%	0.701	80%	0.795	S	S	*	*			trans	175.9	54.9	174	0	0	0	0	0	111.9	T54	G52-T54 PolarHBondContact O-N 3.38Å
53	A	27.2	Very low	29.2	Very low	107 Å²	107	126.2 Å²	126.2	88%	0.884	80%	0.796	S	S	*	*			trans	-80.7	102.8	-165.3	0	0	0	0	0	113.9
54	T	32	Very low	28.3	Very low	134 Å²	134	128.5 Å²	128.5	82%	0.822	79%	0.793	S	S	*	*			trans	-95	139.4	165.3	51	0	0	0	0	111	G52 P56	G52-T54 PolarHBondContact O-N 3.38Å; T54-P56 WeakPolarHBondContact O-CD 3.19Å
55	N	32.3	Very low	28.3	Very low	123 Å²	123	133 Å²	133	66%	0.658	79%	0.789	S	S	*	*			trans	-74.2	118.3	-167.4	-175.2	-10.5	0	0	0	112.5	V57	N55-V57 VanDerWaalsContact C-N 3.26Å; N55-V57 PolarHBondContact O-N 3Å; N55-V57 VanDerWaalsContact OD1-CG2 3.27Å; N55-V57 WeakPolarHBondContact OD1-CG2 3.26Å; N55-V57 PolarHBondContact OD1-N 3.4Å
56	P	33.3	Very low	28.4	Very low	108 Å²	108	132 Å²	132	70%	0.701	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-74.7	-6.9	-172.2	30.4	-36.8	0	0	0	115.1	T54 R58 A59	T54-P56 WeakPolarHBondContact O-CD 3.19Å; P56-R58 PolarHBondContact O-N 2.72Å; P56-A59 PolarHBondContact O-N 2.89Å
57	V	31.7	Very low	28.4	Very low	104 Å²	104	130.5 Å²	130.5	63%	0.63	75%	0.75	S	S	*	*	G	3₁₀ helix	trans	-57.8	-18	-179.7	172.2	0	0	0	0	113.3	N55	N55-V57 VanDerWaalsContact C-N 3.26Å; N55-V57 PolarHBondContact O-N 3Å; N55-V57 VanDerWaalsContact OD1-CG2 3.27Å; N55-V57 WeakPolarHBondContact OD1-CG2 3.26Å; N55-V57 PolarHBondContact OD1-N 3.4Å
58	R	35.8	Very low	28.3	Very low	244 Å²	244	128.7 Å²	128.7	92%	0.921	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-83.9	-6.9	-173.6	-153.9	169.2	-174	165.1	2.5	115.8	P56	P56-R58 PolarHBondContact O-N 2.72Å
59	A	30.2	Very low	28.6	Very low	86 Å²	86	129.2 Å²	129.2	71%	0.711	72%	0.723	S	S	*	*	S	Bend	trans	-105.9	-11.2	-168.7	0	0	0	0	0	116.3	P56	P56-A59 PolarHBondContact O-N 2.89Å
60	A	29.9	Very low	28.7	Very low	82 Å²	82	130.3 Å²	130.3	68%	0.678	71%	0.71	S	S	*	*	S	Bend	trans	-99	-22.6	-169.4	0	0	0	0	0	115.5	Q62	A60-Q62 PolarHBondContact O-N 3.04Å
61	N	29.1	Very low	29	Very low	147 Å²	147	127.1 Å²	127.1	79%	0.786	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	26.4	-167.3	-64.8	6.4	0	0	0	114.9
62	Q	30.2	Very low	29.3	Very low	177 Å²	177	124.5 Å²	124.5	83%	0.827	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.5	9.7	-169	-83.5	-166.2	-23.4	0	0	115.9	A60	A60-Q62 PolarHBondContact O-N 3.04Å
63	R	29.6	Very low	29.8	Very low	214 Å²	214	126.6 Å²	126.6	81%	0.808	68%	0.679	S	S	*	*	S	Bend	trans	-142.1	143.9	176.2	-63.7	-172.3	176.4	179.7	-1.5	112.6
64	F	24.5	Very low	30.6	Very low	184 Å²	184	126.5 Å²	126.5	81%	0.807	67%	0.667	S	S	*	*			trans	72.5	62.8	169.8	-46	-69.3	0	0	0	118.3
65	F	24.4	Very low	30.8	Very low	176 Å²	176	124.9 Å²	124.9	77%	0.772	65%	0.649	S	S	*	*				-106.2	109.2	123.5	-89.6	-89.3	0	0	0	105.9
66	L	26.5	Very low	31.1	Very low	60 Å²	60	123.8 Å²	123.8	31%	0.314	64%	0.642	S	S	.	*			trans	-169.5	163.2	167.6	-82.3	-159.1	0	0	0	113.4	D821	L66-D821 HydrophobicContact CD1-CB 4.16Å; L66-D821 VanDerWaalsContact CD1-CG 3.47Å; L66-D821 WeakPolarHBondContact CD1-O 3.49Å; L66-D821 HydrophobicContact CD2-CB 3.66Å; L66-D821 WeakPolarHBondContact CD2-O 3.12Å; L66-D821 HydrophobicContact CG-CB 4.32Å
67	V	24.7	Very low	31.5	Very low	85 Å²	85	125.5 Å²	125.5	52%	0.515	64%	0.639	S	S	.	*			trans	73.9	109.2	177.5	-157.6	0	0	0	0	114.8	R832	V67-R832 HydrophobicContact CG1-CG 4.38Å
68	S	24.9	Very low	32.1	Very low	68 Å²	68	123.4 Å²	123.4	48%	0.476	63%	0.632	S	S	.	*			trans	-102.9	137.6	160.7	-174.5	0	0	0	0	111.2	T825	S68-T825 PolarHBondContact O-N 3.35Å
69	S	29.6	Very low	32.4	Very low	88 Å²	88	116.2 Å²	116.2	62%	0.615	61%	0.609	S	S	*	*	S	Bend	trans	54	77.5	154.9	-60.3	0	0	0	0	119.2
70	Y	28.8	Very low	32.9	Very low	139 Å²	139	115.7 Å²	115.7	55%	0.545	60%	0.6	S	S	.	*				175.1	112.1	128.5	-106.4	-74.2	0	0	0	109.8	A827	Y70-A827 HydrophobicContact CD2-CB 4.4Å; Y70-A827 HydrophobicContact CE2-CB 3.6Å
71	K	31.4	Very low	33.6	Very low	130 Å²	130	116.4 Å²	116.4	57%	0.565	59%	0.592	S	S	*	*			trans	-143.7	142.1	156.4	-90.8	-160.2	174.5	-173.3	0	108.7	F75 E79	K71-F75 HydrophobicContact CD-CD1 4.08Å; K71-F75 VanDerWaalsContact NZ-CE1 3.34Å; K71-E79 IonicContact NZ-OE1 2.61Å; K71-E79 IonicContact NZ-OE2 2.75Å; K71-E79 PolarHBondContact NZ-OE2 3.35Å
72	D	33.1	Very low	34.3	Very low	91 Å²	91	114.4 Å²	114.4	49%	0.487	58%	0.581	S	S	.	*			trans	-73.5	137.8	178.6	-169.8	-63.1	0	0	0	110.6	T74 F75	D72-T74 PolarHBondContact O-N 3.26Å; D72-T74 VanDerWaalsContact O-N 3.16Å; D72-T74 WeakPolarHBondContact OD1-CB 3.31Å; D72-T74 WeakPolarHBondContact OD1-CG2 3.31Å; D72-T74 PolarHBondContact OD1-N 2.98Å; D72-T74 PolarHBondContact OD1-OG1 3.33Å; D72-F75 PolarHBondContact O-N 2.68Å; D72-F75 VanDerWaalsContact O-N 3.1Å
73	P	36.5	Very low	34.8	Very low	112 Å²	112	108.6 Å²	108.6	73%	0.727	56%	0.563	S	S	*	*	H	α-helix	trans	-61.8	-20.4	179.7	25.7	-35.4	0	0	0	114.1
74	T	43.9	Very low	35.4	Very low	104 Å²	104	104.9 Å²	104.9	64%	0.638	56%	0.555	S	S	*	*	H	α-helix	trans	-69.7	-31.9	174.4	60.1	0	0	0	0	112.9	D72 K77	D72-T74 PolarHBondContact O-N 3.26Å; D72-T74 VanDerWaalsContact O-N 3.16Å; D72-T74 WeakPolarHBondContact OD1-CB 3.31Å; D72-T74 WeakPolarHBondContact OD1-CG2 3.31Å; D72-T74 PolarHBondContact OD1-N 2.98Å; D72-T74 PolarHBondContact OD1-OG1 3.33Å; T74-K77 PolarHBondContact O-N 3.01Å
75	F	36.5	Very low	36.3	Very low	101 Å²	101	98.2 Å²	98.2	44%	0.443	53%	0.533	S	S	.	.	H	α-helix	trans	-70.6	-38	-174	-166.4	-93.5	0	0	0	112.9	K71 D72 K77 A78 E79	K71-F75 HydrophobicContact CD-CD1 4.08Å; K71-F75 VanDerWaalsContact NZ-CE1 3.34Å; D72-F75 PolarHBondContact O-N 2.68Å; D72-F75 VanDerWaalsContact O-N 3.1Å; F75-K77 VanDerWaalsContact C-N 3.25Å; F75-K77 PolarHBondContact O-N 2.85Å; F75-A78 PolarHBondContact O-N 3.44Å; F75-E79 HydrophobicContact CD1-CG 4.22Å; F75-E79 HydrophobicContact CE1-CG 3.78Å; F75-E79 VanDerWaalsContact CE1-OE2 3.28Å; F75-E79 WeakPolarHBondContact CE1-OE2 3.32Å; F75-E79 HydrophobicContact CZ-CG 4.45Å; F75-E79 PolarHBondContact O-N 3.14Å; F75-E79 VanDerWaalsContact O-N 3.16Å
76	L	38.3	Very low	37.1	Very low	100 Å²	100	96 Å²	96	52%	0.524	53%	0.525	S	S	.	.	H	α-helix	trans	-65.2	-28.1	-179.3	-85.2	165.8	0	0	0	112.9	C80	L76-C80 WeakPolarHBondContact O-CB 3.19Å; L76-C80 PolarHBondContact O-N 3.21Å; L76-C80 VanDerWaalsContact O-N 3.08Å
77	K	41.7	Very low	37.9	Very low	143 Å²	143	98.8 Å²	98.8	62%	0.622	55%	0.545	S	S	*	.	H	α-helix	trans	-68.8	-44.2	174.9	-168.9	171.5	-179.1	-176.5	0	111.2	T74 F75 E79 C80 D81	T74-K77 PolarHBondContact O-N 3.01Å; F75-K77 VanDerWaalsContact C-N 3.25Å; F75-K77 PolarHBondContact O-N 2.85Å; K77-E79 PolarHBondContact O-N 3.25Å; K77-C80 PolarHBondContact O-N 3.07Å; K77-D81 WeakPolarHBondContact CG-OD2 3.39Å; K77-D81 WeakPolarHBondContact O-CB 3.13Å; K77-D81 VanDerWaalsContact O-CG 3.26Å; K77-D81 PolarHBondContact O-N 2.99Å
78	A	43.7	Very low	38.6	Very low	60 Å²	60	99.8 Å²	99.8	50%	0.496	55%	0.551	S	S	.	*	H	α-helix	trans	-62.1	-42.5	177	0	0	0	0	0	112.9	F75 L82	F75-A78 PolarHBondContact O-N 3.44Å; A78-L82 VanDerWaalsContact O-CB 3.25Å; A78-L82 WeakPolarHBondContact O-CB 3.12Å; A78-L82 PolarHBondContact O-N 2.93Å
79	E	41.9	Very low	39.1	Very low	93 Å²	93	101.6 Å²	101.6	44%	0.435	56%	0.559	S	S	.	*	H	α-helix	trans	-66.2	-37.6	174.8	-78.6	-174.7	139.5	0	0	112.4	K71 F75 K77 A83	K71-E79 IonicContact NZ-OE1 2.61Å; K71-E79 IonicContact NZ-OE2 2.75Å; K71-E79 PolarHBondContact NZ-OE2 3.35Å; F75-E79 HydrophobicContact CD1-CG 4.22Å; F75-E79 HydrophobicContact CE1-CG 3.78Å; F75-E79 VanDerWaalsContact CE1-OE2 3.28Å; F75-E79 WeakPolarHBondContact CE1-OE2 3.32Å; F75-E79 HydrophobicContact CZ-CG 4.45Å; F75-E79 PolarHBondContact O-N 3.14Å; F75-E79 VanDerWaalsContact O-N 3.16Å; K77-E79 PolarHBondContact O-N 3.25Å; E79-A83 VanDerWaalsContact O-CB 3.31Å; E79-A83 WeakPolarHBondContact O-CB 3.29Å; E79-A83 PolarHBondContact O-N 3.29Å
80	C	41.6	Very low	39.5	Very low	76 Å²	76	101.8 Å²	101.8	51%	0.514	56%	0.56	S	S	.	*	H	α-helix	trans	-66.7	-43.8	174.6	-82.5	0	0	0	0	113.1	L76 K77 A83 H84	L76-C80 WeakPolarHBondContact O-CB 3.19Å; L76-C80 PolarHBondContact O-N 3.21Å; L76-C80 VanDerWaalsContact O-N 3.08Å; K77-C80 PolarHBondContact O-N 3.07Å; C80-A83 PolarHBondContact O-N 2.93Å; C80-H84 PolarHBondContact O-N 2.87Å
81	D	43.9	Very low	39.8	Very low	96 Å²	96	104.8 Å²	104.8	51%	0.513	58%	0.576	S	S	.	*	H	α-helix	trans	-67.3	-38.1	179.4	-67.4	-20.6	0	0	0	110.6	K77 H84 A85	K77-D81 WeakPolarHBondContact CG-OD2 3.39Å; K77-D81 WeakPolarHBondContact O-CB 3.13Å; K77-D81 VanDerWaalsContact O-CG 3.26Å; K77-D81 PolarHBondContact O-N 2.99Å; D81-H84 PolarHBondContact O-N 3.36Å; D81-A85 PolarHBondContact O-N 2.66Å
82	L	43.5	Very low	39.7	Very low	106 Å²	106	105 Å²	105	56%	0.555	59%	0.588	S	S	*	*	H	α-helix	trans	-68.9	-37.3	174.5	-161.3	74.1	0	0	0	112.6	A78 H84 A85 H86	A78-L82 VanDerWaalsContact O-CB 3.25Å; A78-L82 WeakPolarHBondContact O-CB 3.12Å; A78-L82 PolarHBondContact O-N 2.93Å; L82-H84 VanDerWaalsContact C-N 3.33Å; L82-A85 WeakPolarHBondContact O-CB 3.38Å; L82-A85 PolarHBondContact O-N 2.77Å; L82-H86 PolarHBondContact O-CD2 2.96Å; L82-H86 PolarHBondContact O-N 2.65Å
83	A	40.8	Very low	39.4	Very low	55 Å²	55	109.7 Å²	109.7	46%	0.455	60%	0.604	S	S	.	*	H	α-helix	trans	-64.1	-38.3	172.4	0	0	0	0	0	111.8	E79 C80 H86 V87	E79-A83 VanDerWaalsContact O-CB 3.31Å; E79-A83 WeakPolarHBondContact O-CB 3.29Å; E79-A83 PolarHBondContact O-N 3.29Å; C80-A83 PolarHBondContact O-N 2.93Å; A83-H86 PolarHBondContact O-N 3.13Å; A83-V87 WeakPolarHBondContact O-CG2 3.23Å; A83-V87 PolarHBondContact O-N 2.76Å; A83-V87 VanDerWaalsContact O-N 3.14Å
84	H	42.4	Very low	39	Very low	136 Å²	136	109.8 Å²	109.8	63%	0.63	60%	0.603	S	S	*	*	H	α-helix	trans	-64.1	-39	171.6	-101.6	-88.1	0	0	0	112.5	C80 D81 L82 V87 T88	C80-H84 PolarHBondContact O-N 2.87Å; D81-H84 PolarHBondContact O-N 3.36Å; L82-H84 VanDerWaalsContact C-N 3.33Å; H84-V87 PolarHBondContact O-N 3.03Å; H84-T88 WeakPolarHBondContact O-CG2 3.44Å; H84-T88 PolarHBondContact O-N 2.9Å; H84-T88 VanDerWaalsContact O-N 3.08Å; H84-T88 PolarHBondContact O-OG1 2.72Å
85	A	43.9	Very low	38.3	Very low	44 Å²	44	110.2 Å²	110.2	36%	0.364	61%	0.605	S	S	.	*	H	α-helix	trans	-60.9	-45.4	173.5	0	0	0	0	0	112.1	D81 L82 V87 T88 T89	D81-A85 PolarHBondContact O-N 2.66Å; L82-A85 WeakPolarHBondContact O-CB 3.38Å; L82-A85 PolarHBondContact O-N 2.77Å; A85-V87 PolarHBondContact O-N 2.78Å; A85-T88 WeakPolarHBondContact CA-OG1 3.33Å; A85-T88 PolarHBondContact O-N 2.78Å; A85-T88 PolarHBondContact O-OG1 3.2Å; A85-T89 PolarHBondContact O-N 3.23Å; A85-T89 VanDerWaalsContact O-N 3.09Å; A85-T89 PolarHBondContact O-OG1 3.23Å
86	H	40.7	Very low	37.9	Very low	128 Å²	128	113.4 Å²	113.4	59%	0.593	63%	0.626	S	S	*	*	H	α-helix	trans	-67.2	-31.9	179	-83.1	-69.6	0	0	0	114.3	L82 A83 T89	L82-H86 PolarHBondContact O-CD2 2.96Å; L82-H86 PolarHBondContact O-N 2.65Å; A83-H86 PolarHBondContact O-N 3.13Å; H86-T89 PolarHBondContact O-OG1 3.36Å; H86-T89 VanDerWaalsContact O-OG1 3.05Å
87	V	43	Very low	37.3	Very low	120 Å²	120	115.9 Å²	115.9	73%	0.727	64%	0.635	S	S	*	*	H	α-helix	trans	-74.2	-31.6	174	174.2	0	0	0	0	111.9	A83 H84 A85	A83-V87 WeakPolarHBondContact O-CG2 3.23Å; A83-V87 PolarHBondContact O-N 2.76Å; A83-V87 VanDerWaalsContact O-N 3.14Å; H84-V87 PolarHBondContact O-N 3.03Å; A85-V87 PolarHBondContact O-N 2.78Å
88	T	40.3	Very low	37	Very low	106 Å²	106	114.4 Å²	114.4	65%	0.65	64%	0.64	S	S	*	*	H	α-helix	trans	-81.8	-19.7	-179.5	46.9	0	0	0	0	114.1	H84 A85 S90	H84-T88 WeakPolarHBondContact O-CG2 3.44Å; H84-T88 PolarHBondContact O-N 2.9Å; H84-T88 VanDerWaalsContact O-N 3.08Å; H84-T88 PolarHBondContact O-OG1 2.72Å; A85-T88 WeakPolarHBondContact CA-OG1 3.33Å; A85-T88 PolarHBondContact O-N 2.78Å; A85-T88 PolarHBondContact O-OG1 3.2Å; T88-S90 VanDerWaalsContact C-N 3.29Å; T88-S90 PolarHBondContact O-N 2.65Å
89	T	35.5	Very low	36.3	Very low	106 Å²	106	118.9 Å²	118.9	65%	0.65	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-6.9	176.1	42.7	0	0	0	0	115.5	A85 H86	A85-T89 PolarHBondContact O-N 3.23Å; A85-T89 VanDerWaalsContact O-N 3.09Å; A85-T89 PolarHBondContact O-OG1 3.23Å; H86-T89 PolarHBondContact O-OG1 3.36Å; H86-T89 VanDerWaalsContact O-OG1 3.05Å
90	S	38	Very low	35.5	Very low	91 Å²	91	125 Å²	125	64%	0.636	67%	0.67	S	S	*	*	S	Bend	trans	-116.9	47.4	-169.6	-60.7	0	0	0	0	115.4	T88	T88-S90 VanDerWaalsContact C-N 3.29Å; T88-S90 PolarHBondContact O-N 2.65Å
91	K	34.6	Very low	34.7	Very low	202 Å²	202	133 Å²	133	88%	0.878	69%	0.689	S	S	*	*			trans	-165	74.5	162.1	-114.9	159.6	-171.5	174.1	0	115.8
92	V	28.9	Very low	33.9	Very low	134 Å²	134	133.8 Å²	133.8	81%	0.812	70%	0.702	S	S	*	*			trans	-141.1	150.6	166	179	0	0	0	0	109.2
93	K	27.9	Very low	33.1	Very low	190 Å²	190	140.1 Å²	140.1	83%	0.826	72%	0.719	S	S	*	*			trans	69.8	142.7	-178.6	-84	174.8	-179	178.9	0	114.8
94	T	27.3	Very low	32.3	Very low	115 Å²	115	142.4 Å²	142.4	71%	0.706	74%	0.738	S	S	*	*			cis	-142.3	119.8	2.9	-51.6	0	0	0	0	107.9
95	T	29.7	Very low	31.6	Very low	112 Å²	112	139 Å²	139	69%	0.687	74%	0.738	S	S	*	*				60.7	116.9	84.4	-30.7	0	0	0	0	116.3
96	L	28	Very low	30.9	Very low	169 Å²	169	145.4 Å²	145.4	89%	0.885	76%	0.761	S	S	*	*				176.6	165.2	114.8	-95.8	168.9	0	0	0	114.6
97	Q	25.3	Very low	30.2	Very low	152 Å²	152	146.2 Å²	146.2	71%	0.71	77%	0.77	S	S	*	*			trans	-112.9	170.2	-180	-149.3	-162.8	90.7	0	0	109.3	H99	Q97-H99 VanDerWaalsContact OE1-N 3.08Å
98	P	36.4	Very low	29.7	Very low	112 Å²	112	145.3 Å²	145.3	73%	0.727	77%	0.769	S	S	*	*				-156.2	145.7	91.6	39.4	-19.7	0	0	0	118.9
99	H	27.7	Very low	29.3	Very low	153 Å²	153	151.8 Å²	151.8	71%	0.708	78%	0.781	S	S	*	*			trans	63.5	126.7	135.4	-81.2	-36.6	0	0	0	126.6	Q97	Q97-H99 VanDerWaalsContact OE1-N 3.08Å
100	R	26.2	Very low	28.9	Very low	223 Å²	223	153.3 Å²	153.3	84%	0.842	79%	0.785	S	S	*	*				107.9	120.9	129.4	-84.3	178.9	-178.1	-154	1.9	120.3
101	R	25.5	Very low	28.4	Very low	244 Å²	244	155 Å²	155	92%	0.921	79%	0.788	S	S	*	*			trans	-5.1	151.2	146.2	-54.7	175.6	173.4	172.8	-3.4	117
102	S	26.5	Very low	28.1	Very low	112 Å²	112	151.3 Å²	151.3	78%	0.783	78%	0.777	S	S	*	*			cis	-164.1	162	34.5	50.9	0	0	0	0	116.3
103	R	26.1	Very low	28	Very low	239 Å²	239	154.5 Å²	154.5	90%	0.902	78%	0.776	S	S	*	*			trans	24.9	123.8	147.3	-89.4	-178.6	165.9	158.1	-6.2	121.5
104	A	25.1	Very low	27.8	Very low	103 Å²	103	151.8 Å²	151.8	85%	0.851	77%	0.771	S	S	*	*				49.6	151.1	110.1	0	0	0	0	0	122.6
105	G	27.2	Very low	28.2	Very low	63 Å²	63	153.1 Å²	153.1	65%	0.649	78%	0.779	S	S	*	*			trans	120.8	88	-178.8	0	0	0	0	0	109.8
106	E	28.3	Very low	28	Very low	179 Å²	179	152.9 Å²	152.9	84%	0.836	78%	0.782	S	S	*	*				84.7	137.8	62.3	-68.2	-179.7	139.3	0	0	114.3
107	D	27.4	Very low	27.9	Very low	146 Å²	146	155.9 Å²	155.9	78%	0.781	78%	0.781	S	S	*	*			trans	58.8	133	156.5	-66.4	-1.9	0	0	0	120.5
108	S	32	Very low	28	Very low	101 Å²	101	152.8 Å²	152.8	71%	0.706	78%	0.782	S	S	*	*				-162.1	160.6	64.5	-69.2	0	0	0	0	116.4
109	R	32.5	Very low	28.4	Very low	241 Å²	241	153.3 Å²	153.3	91%	0.909	79%	0.785	S	S	*	*			trans	80.2	62.8	156.8	-70.7	160.2	-168.7	175.5	3.8	118.5
110	N	26.5	Very low	28.5	Very low	138 Å²	138	151.7 Å²	151.7	74%	0.738	79%	0.786	S	S	*	*			trans	-51.9	140.6	138.9	177.4	29.8	0	0	0	112.8
111	N	28.3	Very low	28.6	Very low	127 Å²	127	148 Å²	148	68%	0.679	78%	0.782	S	S	*	*				176.8	140.1	123.4	-97.3	-14.5	0	0	0	116.6
112	N	27.4	Very low	28.5	Very low	124 Å²	124	142.7 Å²	142.7	66%	0.663	77%	0.771	S	S	*	*			trans	65.2	113.3	143.2	-74.3	0.1	0	0	0	124.6
113	Y	27.3	Very low	28.5	Very low	201 Å²	201	143.5 Å²	143.5	79%	0.788	77%	0.767	S	S	*	*				67.8	131	121.6	-87.2	-89.1	0	0	0	124.3
114	N	24.2	Very low	28.2	Very low	134 Å²	134	139.2 Å²	139.2	72%	0.717	76%	0.759	S	S	*	*			trans	56.9	114.8	146.7	-77.8	-0.6	0	0	0	122.4
115	T	33.9	Very low	28.1	Very low	143 Å²	143	144.3 Å²	144.3	88%	0.877	76%	0.756	S	S	*	*			trans	-52.9	123.6	156.4	49.1	0	0	0	0	114.2
116	S	26.2	Very low	28	Very low	107 Å²	107	152.4 Å²	152.4	75%	0.748	77%	0.767	S	S	*	*			trans	-170.8	156.7	158	73.5	0	0	0	0	108.8
117	R	26.2	Very low	28.3	Very low	231 Å²	231	149.1 Å²	149.1	87%	0.872	76%	0.761	S	S	*	*			cis	-162.8	151.7	-11.5	-130.2	179.5	168.6	169.4	-5.3	110.7
118	A	27.1	Very low	28.1	Very low	87 Å²	87	146.8 Å²	146.8	72%	0.719	76%	0.756	S	S	*	*			trans	74.5	163.1	132.6	0	0	0	0	0	120.3
119	P	45.6	Very low	27.9	Very low	123 Å²	123	149 Å²	149	80%	0.799	76%	0.759	S	S	*	*			cis	-118.2	155.9	-0.6	39.4	-26.8	0	0	0	116.3
120	T	29.5	Very low	27.6	Very low	119 Å²	119	146.4 Å²	146.4	73%	0.73	76%	0.755	S	S	*	*			trans	-71.5	161.7	157.1	46.7	0	0	0	0	111.9
121	L	26.9	Very low	27.7	Very low	145 Å²	145	147.1 Å²	147.1	76%	0.759	76%	0.759	S	S	*	*				165.1	135	119.1	-85.4	168.1	0	0	0	113.6
122	I	24.5	Very low	27.7	Very low	134 Å²	134	143.5 Å²	143.5	69%	0.687	75%	0.752	S	S	*	*			trans	63.1	149.5	137.5	-67.9	177.2	0	0	0	122
123	N	25.9	Very low	27.8	Very low	129 Å²	129	144.5 Å²	144.5	69%	0.69	76%	0.757	S	S	*	*			trans	68.5	141.1	173.4	-70.9	-22.7	0	0	0	117
124	M	21.1	Very low	28.1	Very low	149 Å²	149	141.8 Å²	141.8	73%	0.734	75%	0.751	S	S	*	*			cis	93	103.3	26.6	-70.1	-144.5	-75.4	0	0	117
125	R	22.6	Very low	28.7	Very low	210 Å²	210	143.5 Å²	143.5	79%	0.792	76%	0.755	S	S	*	*			trans	69.7	112.3	140.2	-64.8	179.1	171	-176.3	-1.4	121.4
126	R	25.5	Very low	29.5	Very low	232 Å²	232	142 Å²	142	88%	0.875	75%	0.748	S	S	*	*			trans	69.3	170.6	134.5	-66	-178.2	177.4	-173.7	-2	116.9
127	P	33.5	Very low	29.8	Very low	110 Å²	110	142.4 Å²	142.4	71%	0.714	75%	0.746	S	S	*	*			cis	-109.7	164.4	-6.8	16	9.2	0	0	0	112.7
128	S	24.4	Very low	30.1	Very low	98 Å²	98	136.6 Å²	136.6	69%	0.685	74%	0.736	S	S	*	*				32.6	136.3	86.8	65.4	0	0	0	0	115.7
129	L	27.7	Very low	30.4	Very low	147 Å²	147	137.7 Å²	137.7	77%	0.77	73%	0.734	S	S	*	*				-160.1	139.4	67.1	-79.7	165.9	0	0	0	109.8
130	F	25.8	Very low	29.7	Very low	186 Å²	186	138.8 Å²	138.8	82%	0.816	73%	0.733	S	S	*	*				79.7	111.2	77.5	-133.6	-87.6	0	0	0	114.3
131	N	28.9	Very low	29.7	Very low	154 Å²	154	137.9 Å²	137.9	82%	0.824	73%	0.732	S	S	*	*				-166.5	138.5	108.4	-156.1	12.7	0	0	0	113.5
132	G	27.8	Very low	29.8	Very low	51 Å²	51	137.4 Å²	137.4	53%	0.526	74%	0.735	S	S	.	*			trans	64.3	-168.6	179.8	0	0	0	0	0	115.7
133	N	29.4	Very low	30.1	Very low	144 Å²	144	136.6 Å²	136.6	77%	0.77	74%	0.736	S	S	*	*			cis	-175.4	151.7	-29.4	-95.6	-5.6	0	0	0	106.6
134	Q	32.8	Very low	30.2	Very low	144 Å²	144	138.3 Å²	138.3	67%	0.673	74%	0.744	S	S	*	*			cis	-152.4	131.2	-16	-111.7	164.9	-59.9	0	0	105.8
135	Q	37.5	Very low	30.5	Very low	171 Å²	171	137.6 Å²	137.6	80%	0.799	74%	0.743	S	S	*	*				61.3	141.4	97.5	-71.6	-156	-25.3	0	0	117
136	P	50	Low	30.6	Very low	112 Å²	112	134.5 Å²	134.5	73%	0.727	74%	0.742	S	S	*	*			cis	-111.5	-157.8	-6.5	42.6	-28.8	0	0	0	110
137	T	33.8	Very low	30.7	Very low	114 Å²	114	129 Å²	129	70%	0.699	74%	0.735	S	S	*	*			cis	-171.4	153.3	-16.9	16.4	0	0	0	0	105.2
138	T	32	Very low	30.4	Very low	109 Å²	109	129.4 Å²	129.4	67%	0.669	74%	0.736	S	S	*	*			cis	-166.7	117.1	-18.8	18.6	0	0	0	0	106
139	T	33.6	Very low	30.6	Very low	111 Å²	111	128.8 Å²	128.8	68%	0.681	73%	0.731	S	S	*	*				58.8	141.7	98.1	66.1	0	0	0	0	117.7
140	N	31.3	Very low	30.8	Very low	145 Å²	145	132.3 Å²	132.3	78%	0.775	73%	0.734	S	S	*	*			cis	-169.3	172.7	-14.5	-108.5	-8.4	0	0	0	112.5
141	S	28.4	Very low	30.9	Very low	101 Å²	101	130.5 Å²	130.5	71%	0.706	73%	0.733	S	S	*	*			trans	-36	167.1	157.3	-41.6	0	0	0	0	116.2
142	T	28.4	Very low	30.9	Very low	134 Å²	134	128.1 Å²	128.1	82%	0.822	72%	0.724	S	S	*	*				-174.3	159.9	66	-49.6	0	0	0	0	114
143	T	31.9	Very low	31.1	Very low	117 Å²	117	131.6 Å²	131.6	72%	0.718	74%	0.735	S	S	*	*			trans	-58.7	155.6	172.8	-38.2	0	0	0	0	116.5
144	I	27.6	Very low	31.3	Very low	165 Å²	165	129.6 Å²	129.6	85%	0.846	73%	0.733	S	S	*	*			trans	-154.3	167.5	149.4	-110.3	159.7	0	0	0	111.7
145	N	27.2	Very low	31.2	Very low	134 Å²	134	130.1 Å²	130.1	72%	0.717	74%	0.74	S	S	*	*			trans	-92.3	178.4	-166.1	-57	-42.8	0	0	0	116
146	N	26.1	Very low	31.1	Very low	145 Å²	145	128 Å²	128	78%	0.775	74%	0.739	S	S	*	*			trans	92.2	113.7	139.9	-82.1	5.4	0	0	0	122.8
147	T	25.8	Very low	30.4	Very low	117 Å²	117	127.6 Å²	127.6	72%	0.718	74%	0.739	S	S	*	*				64	145.7	127.2	-10.5	0	0	0	0	123.7
148	T	28.1	Very low	30.4	Very low	119 Å²	119	130 Å²	130	73%	0.73	75%	0.748	S	S	*	*			trans	78.2	92.3	148.4	-43.9	0	0	0	0	120.7
149	S	28.4	Very low	30.4	Very low	84 Å²	84	128.4 Å²	128.4	59%	0.587	75%	0.752	S	S	*	*				28.3	120.4	117.2	167.6	0	0	0	0	121.3
150	R	31.7	Very low	30.2	Very low	222 Å²	222	129.8 Å²	129.8	84%	0.838	76%	0.76	S	S	*	*			trans	65.8	130.4	142.1	-63.4	173.6	-178.2	175.8	0.9	120.6
151	N	28.2	Very low	30.2	Very low	147 Å²	147	129.5 Å²	129.5	79%	0.786	76%	0.758	S	S	*	*				-161.7	135.8	116.3	-89.2	-16.4	0	0	0	106.8
152	T	29.3	Very low	30.5	Very low	105 Å²	105	133 Å²	133	64%	0.644	76%	0.761	S	S	*	*				69.6	140.3	57.4	72.1	0	0	0	0	112.5
153	T	32.6	Very low	30.6	Very low	123 Å²	123	137.6 Å²	137.6	76%	0.755	76%	0.764	S	S	*	*			cis	-164.3	175.4	9.7	-6.3	0	0	0	0	112.1
154	S	33	Very low	30.4	Very low	103 Å²	103	137.1 Å²	137.1	72%	0.72	77%	0.766	S	S	*	*			trans	76.6	155.8	150.9	80.5	0	0	0	0	118.5
155	N	30.5	Very low	30.6	Very low	154 Å²	154	135 Å²	135	82%	0.824	76%	0.76	S	S	*	*			cis	-146.2	176.3	1	-135.2	-1.4	0	0	0	114
156	T	35.4	Very low	30.8	Very low	127 Å²	127	139.2 Å²	139.2	78%	0.779	77%	0.766	S	S	*	*			trans	-108.2	162.8	-166.2	52.1	0	0	0	0	116
157	S	35.8	Very low	31	Very low	103 Å²	103	136.8 Å²	136.8	72%	0.72	76%	0.76	S	S	*	*			trans	-167.5	142.8	132.2	39.2	0	0	0	0	113.4
158	N	33.1	Very low	31.2	Very low	166 Å²	166	137.5 Å²	137.5	89%	0.888	77%	0.765	S	S	*	*			trans	36.1	126.3	153.7	-48	-18.7	0	0	0	119.8
159	G	31.5	Very low	31.3	Very low	74 Å²	74	138.4 Å²	138.4	76%	0.763	77%	0.77	S	S	*	*			cis	-177.9	-155	5.4	0	0	0	0	0	109.3
160	V	30.1	Very low	31.7	Very low	141 Å²	141	138.8 Å²	138.8	86%	0.855	78%	0.779	S	S	*	*			cis	-139.3	-105.3	-4.3	-169.3	0	0	0	0	110.2
161	L	31.8	Very low	31.6	Very low	138 Å²	138	135.2 Å²	135.2	72%	0.723	78%	0.782	S	S	*	*			trans	-146.8	131.1	-171.9	-70.8	171.9	0	0	0	116.3
162	K	34	Very low	31.9	Very low	176 Å²	176	132 Å²	132	77%	0.765	78%	0.776	S	S	*	*				37.1	133.1	126	-52.9	178.9	-174.2	173.9	0	122.2
163	Y	30.1	Very low	31.9	Very low	230 Å²	230	133.4 Å²	133.4	90%	0.902	79%	0.785	S	S	*	*				-162.4	-166.4	104.3	-115.9	-79	0	0	0	111.8
164	S	29	Very low	31.8	Very low	107 Å²	107	131.7 Å²	131.7	75%	0.748	78%	0.777	S	S	*	*			trans	-151.7	-173.1	-165.7	-175.6	0	0	0	0	112.1
165	V	31.5	Very low	31.6	Very low	121 Å²	121	132.9 Å²	132.9	73%	0.733	78%	0.78	S	S	*	*			trans	96.5	97.5	158.9	-172.7	0	0	0	0	119.7
166	R	30.5	Very low	31.5	Very low	221 Å²	221	130 Å²	130	83%	0.834	77%	0.772	S	S	*	*				63.5	112.7	117.5	-162.5	-176.6	-173.1	-170.7	4	123.4
167	S	30.6	Very low	31.2	Very low	94 Å²	94	129.4 Å²	129.4	66%	0.657	77%	0.769	S	S	*	*			trans	67.6	158.3	135.6	-55.3	0	0	0	0	123.5
168	T	30.5	Very low	31	Very low	133 Å²	133	136.1 Å²	136.1	82%	0.816	78%	0.778	S	S	*	*			trans	67.3	154.4	164.1	36	0	0	0	0	116.5
169	T	29.6	Very low	31	Very low	137 Å²	137	135.4 Å²	135.4	84%	0.84	77%	0.774	S	S	*	*			cis	-145.8	-179.8	10.4	-19.6	0	0	0	0	110.9
170	A	36.8	Very low	31	Very low	93 Å²	93	143.4 Å²	143.4	77%	0.769	78%	0.783	S	S	*	*			trans	-108.7	158.1	174.7	0	0	0	0	0	112.7
171	T	30.3	Very low	31	Very low	146 Å²	146	139.9 Å²	139.9	90%	0.896	78%	0.775	S	S	*	*			trans	-149.5	144.3	170.5	-21.5	0	0	0	0	111.9
172	A	33.4	Very low	31	Very low	81 Å²	81	142.8 Å²	142.8	67%	0.669	78%	0.782	S	S	*	*			trans	-100.8	-176.9	162.5	0	0	0	0	0	109
173	T	30.3	Very low	30.8	Very low	134 Å²	134	141.9 Å²	141.9	82%	0.822	79%	0.785	S	S	*	*			cis	-150.5	-151	9.9	-26.6	0	0	0	0	106.2
174	S	30	Very low	31.2	Very low	86 Å²	86	140.1 Å²	140.1	60%	0.601	78%	0.782	S	S	*	*			cis	-168.4	173.3	-7.6	40.4	0	0	0	0	108.7
175	T	28.1	Very low	32	Very low	128 Å²	128	140 Å²	140	79%	0.785	78%	0.779	S	S	*	*			trans	67	151.3	155.4	37.6	0	0	0	0	117.8
176	S	29.2	Very low	31.9	Very low	93 Å²	93	141.9 Å²	141.9	65%	0.65	78%	0.784	S	S	*	*			cis	-155.3	153	1.6	-133.4	0	0	0	0	114.5
177	T	29.7	Very low	32	Very low	115 Å²	115	137.3 Å²	137.3	71%	0.706	78%	0.776	S	S	*	*			trans	31.3	130.7	147.3	60.6	0	0	0	0	122.7
178	R	30.5	Very low	32.2	Very low	244 Å²	244	139 Å²	139	92%	0.921	78%	0.778	S	S	*	*				-171.5	155.4	93.9	-105.5	-177.7	176.5	170.5	0.2	114.1
179	N	32.8	Very low	32.3	Very low	151 Å²	151	138.4 Å²	138.4	81%	0.807	77%	0.77	S	S	*	*			trans	-97.4	151.1	173	-86.7	-23	0	0	0	111.8
180	Y	31.9	Very low	32.4	Very low	242 Å²	242	139.2 Å²	139.2	95%	0.949	76%	0.764	S	S	*	*			trans	165.1	146.2	141.4	-83.8	-58.8	0	0	0	107.1
181	G	30	Very low	32.3	Very low	67 Å²	67	141 Å²	141	69%	0.691	77%	0.765	S	S	*	*			cis	151.6	142.4	-7.1	0	0	0	0	0	112.2
182	K	31.9	Very low	32.4	Very low	199 Å²	199	140 Å²	140	87%	0.865	76%	0.759	S	S	*	*			trans	78.5	133.6	164	-86.1	-177.1	174.9	-178.9	0	122.2
183	L	29.2	Very low	32.4	Very low	158 Å²	158	140.8 Å²	140.8	83%	0.827	77%	0.766	S	S	*	*			trans	82.4	121.4	139.7	-67	166.1	0	0	0	123
184	K	38.6	Very low	32.5	Very low	192 Å²	192	137.8 Å²	137.8	84%	0.835	76%	0.762	S	S	*	*			trans	-84.7	164.1	142	-55.5	-179.9	176	-178.1	0	108.7
185	P	47.2	Very low	32.9	Very low	106 Å²	106	140.6 Å²	140.6	69%	0.688	78%	0.775	S	S	*	*				-156.6	168.2	90.2	41.9	-23.9	0	0	0	117.1
186	L	29.6	Very low	33.4	Very low	160 Å²	160	138.6 Å²	138.6	84%	0.838	77%	0.772	S	S	*	*			trans	57.5	148.7	155.3	-61.8	156.4	0	0	0	118.9
187	N	32.2	Very low	33.5	Very low	125 Å²	125	142.6 Å²	142.6	67%	0.668	78%	0.782	S	S	*	*			cis	114.3	145.2	6.3	-169.1	51.7	0	0	0	114.7
188	N	34	Very low	33.8	Very low	130 Å²	130	144.9 Å²	144.9	70%	0.695	79%	0.787	S	S	*	*			trans	70.2	155.2	174.4	-78.9	2.5	0	0	0	118.6
189	N	32.3	Very low	33.9	Very low	119 Å²	119	140.2 Å²	140.2	64%	0.636	78%	0.78	S	S	*	*			cis	-169.9	164.3	-32.1	-146.8	-6.3	0	0	0	112.5
190	Q	33.2	Very low	33.6	Very low	155 Å²	155	135.9 Å²	135.9	72%	0.724	77%	0.771	S	S	*	*			trans	69.7	161	143.9	-85.9	171.8	-4.2	0	0	126.2
191	T	32.8	Very low	33.7	Very low	129 Å²	129	132.1 Å²	132.1	79%	0.791	76%	0.762	S	S	*	*			trans	77.1	155.6	161.8	50.9	0	0	0	0	122
192	T	33.6	Very low	33.8	Very low	125 Å²	125	134.3 Å²	134.3	77%	0.767	76%	0.761	S	S	*	*			cis	-175.8	144.9	-39.7	-94.9	0	0	0	0	112.5
193	A	33.8	Very low	33.8	Very low	99 Å²	99	131.7 Å²	131.7	82%	0.818	76%	0.757	S	S	*	*			trans	63.7	160.9	164.8	0	0	0	0	0	118.8
194	G	32.1	Very low	33.8	Very low	71 Å²	71	130.2 Å²	130.2	73%	0.732	75%	0.75	S	S	*	*			cis	150.5	167.1	-2.1	0	0	0	0	0	111.7
195	V	39	Very low	33.3	Very low	144 Å²	144	127.1 Å²	127.1	87%	0.873	74%	0.743	S	S	*	*			cis	-161.8	171.1	-10.5	-157.9	0	0	0	0	108.8
196	A	37.9	Very low	32.5	Very low	87 Å²	87	127.7 Å²	127.7	72%	0.719	74%	0.74	S	S	*	*			trans	90.1	151.2	157.4	0	0	0	0	0	119.2
197	M	30.7	Very low	32.6	Very low	176 Å²	176	126 Å²	126	87%	0.867	73%	0.732	S	S	*	*			cis	-134.5	176.8	14.1	-76.8	-173	175.3	0	0	115.3
198	M	37	Very low	32.4	Very low	164 Å²	164	126.2 Å²	126.2	81%	0.808	73%	0.733	S	S	*	*			trans	-31.2	158.1	172.8	-74.8	71.6	167.9	0	0	118.3
199	N	32	Very low	32.1	Very low	146 Å²	146	127.4 Å²	127.4	78%	0.781	75%	0.745	S	S	*	*			cis	-158.4	-173.6	13	-128.5	-22	0	0	0	110.1
200	G	27.1	Very low	32.1	Very low	59 Å²	59	132 Å²	132	61%	0.608	75%	0.753	S	S	*	*			cis	165.1	165.1	-3.6	0	0	0	0	0	114.8
201	H	33.4	Very low	31.8	Very low	164 Å²	164	131.8 Å²	131.8	76%	0.759	76%	0.757	S	S	*	*			trans	54.5	91.6	158.1	-75.6	84.6	0	0	0	124.4
202	T	32.5	Very low	31.6	Very low	112 Å²	112	129.9 Å²	129.9	69%	0.687	75%	0.749	S	S	*	*				56.2	131.3	119.4	56.7	0	0	0	0	125.5
203	N	30.5	Very low	31.3	Very low	145 Å²	145	128.7 Å²	128.7	78%	0.775	75%	0.746	S	S	*	*			trans	88.6	109.7	132.4	-86.3	-1.3	0	0	0	124.2
204	N	29.7	Very low	31	Very low	126 Å²	126	130.8 Å²	130.8	67%	0.674	74%	0.743	S	S	*	*				77	117.4	106.9	-145.3	18.5	0	0	0	122.2
205	N	29.3	Very low	31	Very low	128 Å²	128	133.1 Å²	133.1	68%	0.684	74%	0.738	S	S	*	*			trans	69	141.9	138.7	-93.5	-7.8	0	0	0	125
206	N	30.2	Very low	30.6	Very low	118 Å²	118	132.5 Å²	132.5	63%	0.631	73%	0.729	S	S	*	*			trans	75.8	110	139.7	-76.4	-3.5	0	0	0	122.8
207	N	30.8	Very low	30.3	Very low	125 Å²	125	135.6 Å²	135.6	67%	0.668	73%	0.734	S	S	*	*				110.1	125.8	110.4	-80.1	-14	0	0	0	120.8
208	N	29	Very low	30.1	Very low	128 Å²	128	130.5 Å²	130.5	68%	0.684	73%	0.726	S	S	*	*			trans	55.4	104.1	139.3	-65.2	-18.1	0	0	0	120
209	T	26.2	Very low	29.9	Very low	155 Å²	155	126 Å²	126	95%	0.951	72%	0.723	S	S	*	*				-123.3	98	108.4	-41.9	0	0	0	0	110.5
210	R	33.6	Very low	29.9	Very low	216 Å²	216	125.8 Å²	125.8	82%	0.815	72%	0.721	S	S	*	*			trans	-122.5	113.9	162.1	-103.1	-169.7	177.6	-175.7	1	108.2
211	N	26.9	Very low	30.2	Very low	151 Å²	151	130.1 Å²	130.1	81%	0.807	73%	0.731	S	S	*	*			trans	-153.4	127.6	140.4	-94.8	-25.1	0	0	0	106.6
212	S	27.5	Very low	30	Very low	89 Å²	89	128.7 Å²	128.7	62%	0.622	73%	0.729	S	S	*	*				83.2	98.4	50.3	-59	0	0	0	0	112.3
213	S	28.4	Very low	29.7	Very low	100 Å²	100	131.6 Å²	131.6	70%	0.699	74%	0.736	S	S	*	*			trans	63	124.1	135.5	68.3	0	0	0	0	121
214	N	27.9	Very low	29.6	Very low	142 Å²	142	132 Å²	132	76%	0.759	73%	0.734	S	S	*	*				108.9	145.1	112.3	-96.3	2.3	0	0	0	121.8
215	I	30.9	Very low	29.6	Very low	120 Å²	120	136.6 Å²	136.6	62%	0.615	74%	0.742	S	S	*	*			trans	91.2	102.2	135.7	-79.5	167.2	0	0	0	120.3
216	N	31.7	Very low	29.5	Very low	131 Å²	131	138 Å²	138	70%	0.701	74%	0.744	S	S	*	*				65.7	-172.2	127.4	-49.4	-2.4	0	0	0	116.8
217	N	31.9	Very low	29.4	Very low	153 Å²	153	138.5 Å²	138.5	82%	0.818	74%	0.743	S	S	*	*			cis	-156	170.1	8.3	-150.1	-1.5	0	0	0	115
218	G	26.6	Very low	29.3	Very low	68 Å²	68	140 Å²	140	70%	0.701	75%	0.745	S	S	*	*			trans	140.6	106.9	171.8	0	0	0	0	0	111.2
219	G	32.1	Very low	29.2	Very low	71 Å²	71	140.9 Å²	140.9	73%	0.732	75%	0.745	S	S	*	*			cis	81.3	134.3	14.1	0	0	0	0	0	110.8
220	N	32.6	Very low	29.3	Very low	141 Å²	141	140.9 Å²	140.9	75%	0.754	73%	0.734	S	S	*	*			cis	-152.8	163.1	11	-150.6	44.6	0	0	0	108.6
221	N	31.6	Very low	29	Very low	150 Å²	150	136.4 Å²	136.4	80%	0.802	73%	0.726	S	S	*	*				177	174.6	90.3	-94.1	-36.4	0	0	0	112
222	N	29.4	Very low	29	Very low	134 Å²	134	136.1 Å²	136.1	72%	0.717	73%	0.725	S	S	*	*			trans	-144.1	139.5	-166.6	173.5	34.6	0	0	0	112
223	M	27.2	Very low	29.2	Very low	173 Å²	173	139.5 Å²	139.5	85%	0.852	73%	0.734	S	S	*	*			trans	-176.6	143	156	-99	-175.8	-69.3	0	0	106.8
224	Q	29.1	Very low	29.1	Very low	154 Å²	154	138.9 Å²	138.9	72%	0.72	73%	0.73	S	S	*	*			cis	117.2	93	7.7	-173.5	166.2	-8.2	0	0	113.4
225	R	28.5	Very low	29.2	Very low	222 Å²	222	140.5 Å²	140.5	84%	0.838	73%	0.731	S	S	*	*			trans	55.2	147.3	151.5	-81.9	-170.6	173.9	-128.9	-1.5	122.4
226	Q	26.6	Very low	29.2	Very low	157 Å²	157	140.7 Å²	140.7	73%	0.734	73%	0.732	S	S	*	*			trans	102.5	140	142.6	-89.3	-178.6	-65.4	0	0	122.4
227	Q	28.5	Very low	29.1	Very low	129 Å²	129	141.3 Å²	141.3	60%	0.603	74%	0.735	S	S	*	*			trans	65.9	125.4	155.3	-108.4	74.1	4.3	0	0	121.9
228	Q	29.3	Very low	29	Very low	155 Å²	155	138.2 Å²	138.2	72%	0.724	73%	0.726	S	S	*	*			trans	68.7	158.1	141.2	-72.7	164.8	2.3	0	0	117.8
229	Q	27.7	Very low	29.2	Very low	147 Å²	147	143 Å²	143	69%	0.687	74%	0.735	S	S	*	*			cis	-150.8	154.2	1.2	-130.1	162.1	87.8	0	0	108.6
230	H	27	Very low	29.2	Very low	155 Å²	155	147.4 Å²	147.4	72%	0.718	74%	0.742	S	S	*	*			trans	41.6	149.4	130.4	-81.9	-104.7	0	0	0	122
231	D	27.2	Very low	30.7	Very low	122 Å²	122	145.5 Å²	145.5	65%	0.652	74%	0.737	S	S	*	*			cis	-146.6	166	20.4	-80.1	-59	0	0	0	113.2
232	D	27.9	Very low	31.6	Very low	145 Å²	145	144.1 Å²	144.1	78%	0.775	74%	0.736	S	S	*	*			trans	42.4	148.4	141.2	-60.2	-9.4	0	0	0	122.3
233	I	30.7	Very low	31.8	Very low	160 Å²	160	141.5 Å²	141.5	82%	0.821	73%	0.734	S	S	*	*			cis	-140.9	156.5	40	-74.3	171.9	0	0	0	112.7
234	S	27.6	Very low	32.2	Very low	87 Å²	87	140.2 Å²	140.2	61%	0.608	74%	0.736	S	S	*	*			trans	-76.9	162.7	-177.9	54.6	0	0	0	0	117.1
235	F	29.7	Very low	32.3	Very low	177 Å²	177	137 Å²	137	78%	0.776	74%	0.744	S	S	*	*				172	124	128.3	-106.7	-102.3	0	0	0	106.4
236	I	30.1	Very low	32.3	Very low	124 Å²	124	130 Å²	130	64%	0.636	74%	0.741	S	S	*	*				65.7	120.6	65.7	-63.6	169.8	0	0	0	110.2
237	D	29.2	Very low	34.2	Very low	143 Å²	143	128.7 Å²	128.7	77%	0.765	75%	0.746	S	S	*	*			cis	-149.9	-174.1	12	-140.6	-37.7	0	0	0	114
238	S	30.8	Very low	34.3	Very low	89 Å²	89	131.7 Å²	131.7	62%	0.622	76%	0.76	S	S	*	*			trans	-34.8	161.9	168.4	-51.1	0	0	0	0	117.2
239	D	30.8	Very low	34.6	Very low	168 Å²	168	129.2 Å²	129.2	90%	0.898	77%	0.766	S	S	*	*				-160.5	171.1	70	-94.6	-35.2	0	0	0	115.6
240	D	32.8	Very low	34.8	Very low	163 Å²	163	125.6 Å²	125.6	87%	0.872	77%	0.768	S	S	*	*			trans	-101.9	179.4	-165.9	-122.8	-3.3	0	0	0	114.9
241	P	64.2	Low	35	Very low	101 Å²	101	126.8 Å²	126.8	66%	0.656	78%	0.778	S	S	*	*			trans	-92.5	-169	-165.8	40.3	-40.8	0	0	0	115
242	P	48.9	Very low	35.3	Very low	121 Å²	121	125.2 Å²	125.2	79%	0.786	78%	0.776	S	S	*	*				-157.8	-175.9	100.2	42.2	-23.5	0	0	0	117.9
243	A	34.6	Very low	35.6	Very low	80 Å²	80	123.6 Å²	123.6	66%	0.661	77%	0.772	S	S	*	*			trans	68.1	112.2	148.4	0	0	0	0	0	119.9
244	T	35.6	Very low	35.8	Very low	146 Å²	146	121.9 Å²	121.9	90%	0.896	77%	0.769	S	S	*	*				79.7	125.9	56.8	65.3	0	0	0	0	116.6
245	G	30	Very low	36.1	Very low	86 Å²	86	127 Å²	127	89%	0.887	78%	0.78	S	S	*	*			trans	179.4	139.5	169.1	0	0	0	0	0	113.6
246	G	29.1	Very low	36.2	Very low	76 Å²	76	124.4 Å²	124.4	78%	0.784	78%	0.779	S	S	*	*			trans	-121.5	-166.2	-167.6	0	0	0	0	0	117.1
247	P	66.7	Low	36.3	Very low	129 Å²	129	123.2 Å²	123.2	84%	0.838	78%	0.782	S	S	*	*			trans	-127.5	173.1	-152.7	43.7	-31.7	0	0	0	117.5
248	E	30.3	Very low	36.4	Very low	192 Å²	192	123.9 Å²	123.9	90%	0.897	78%	0.784	S	S	*	*			trans	-157.5	135.3	161.2	-103.5	168.8	-169.5	0	0	109.1
249	A	35.4	Very low	36.3	Very low	103 Å²	103	124.6 Å²	124.6	85%	0.851	79%	0.787	S	S	*	*				77	137.9	75.4	0	0	0	0	0	115.1
250	G	32.2	Very low	36.3	Very low	71 Å²	71	126.2 Å²	126.2	73%	0.732	78%	0.782	S	S	*	*			cis	178.3	-170.2	-4.7	0	0	0	0	0	112.8
251	I	31.8	Very low	36.2	Very low	180 Å²	180	127.7 Å²	127.7	92%	0.923	78%	0.781	S	S	*	*			trans	73.8	152.6	164.2	-74.5	170.4	0	0	0	119
252	S	33.1	Very low	34.5	Very low	88 Å²	88	132 Å²	132	62%	0.615	79%	0.79	S	S	*	*			cis	-173.3	147.3	-31.6	-167.9	0	0	0	0	116
253	T	34.2	Very low	34.6	Very low	112 Å²	112	131.3 Å²	131.3	69%	0.687	79%	0.785	S	S	*	*			trans	62.9	122.2	143.6	43.5	0	0	0	0	128.3
254	T	35.6	Very low	34.3	Very low	123 Å²	123	135.3 Å²	135.3	76%	0.755	79%	0.794	S	S	*	*			trans	73.4	158.6	135.5	62.5	0	0	0	0	121.9
255	K	32.2	Very low	34.2	Very low	195 Å²	195	134.4 Å²	134.4	85%	0.848	79%	0.788	S	S	*	*			cis	-150.6	-164.8	3.3	-133.9	166.3	-174.9	176.2	0	113.7
256	T	33.1	Very low	35.1	Very low	122 Å²	122	135.9 Å²	135.9	75%	0.748	78%	0.782	S	S	*	*			trans	-118.6	179.5	-158.1	56.8	0	0	0	0	117.8
257	S	31.8	Very low	36.4	Very low	100 Å²	100	137.2 Å²	137.2	70%	0.699	78%	0.777	S	S	*	*			trans	105.4	154.1	152.9	-56.1	0	0	0	0	118.1
258	I	32.3	Very low	34.7	Very low	157 Å²	157	138 Å²	138	81%	0.805	77%	0.773	S	S	*	*			cis	-164.4	169.3	-31.9	-107.5	158.3	0	0	0	109.5
259	C	28	Very low	34.7	Very low	103 Å²	103	136 Å²	136	70%	0.696	76%	0.764	S	S	*	*			trans	-67.5	164.3	-166.1	-43.5	0	0	0	0	119.8
260	Y	31	Very low	34.4	Very low	203 Å²	203	137.5 Å²	137.5	80%	0.796	76%	0.757	S	S	*	*				171.4	131.2	110.3	-106.4	-93.7	0	0	0	117.9
261	F	29.3	Very low	34.2	Very low	194 Å²	194	143.5 Å²	143.5	85%	0.851	76%	0.758	S	S	*	*			trans	61.9	175.4	144.4	-93.1	-116.2	0	0	0	126.8
262	K	30.4	Very low	34.2	Very low	192 Å²	192	141.5 Å²	141.5	84%	0.835	74%	0.744	S	S	*	*			trans	-123.1	-175.5	-160.2	-113.3	-179.1	-177.7	179.3	0	110.7
263	P	50.2	Low	34.1	Very low	106 Å²	106	143.9 Å²	143.9	69%	0.688	75%	0.745	S	S	*	*			cis	-133.6	-164	-21.8	40.4	-21.8	0	0	0	112.8
264	I	28.5	Very low	34	Very low	163 Å²	163	145.1 Å²	145.1	84%	0.836	74%	0.744	S	S	*	*			trans	175.8	156.4	141.6	-94.4	157.3	0	0	0	113.9
265	T	33.3	Very low	33.9	Very low	128 Å²	128	144.8 Å²	144.8	79%	0.785	74%	0.737	S	S	*	*			trans	-146.8	164	170.6	42.2	0	0	0	0	108.2
266	P	49.5	Very low	33.9	Very low	117 Å²	117	142.8 Å²	142.8	76%	0.76	73%	0.731	S	S	*	*			cis	-142.3	-133.8	34.2	42.1	-17.7	0	0	0	111.8
267	P	55.3	Low	33.9	Very low	104 Å²	104	141.3 Å²	141.3	68%	0.675	72%	0.722	S	S	*	*			cis	-132.2	174.2	-28.8	37.5	-18.3	0	0	0	117.2
268	L	31.3	Very low	33.9	Very low	145 Å²	145	143.9 Å²	143.9	76%	0.759	72%	0.722	S	S	*	*			trans	14.3	154.3	139.7	-49	-179.9	0	0	0	121.7
269	Q	31.3	Very low	33.9	Very low	149 Å²	149	143.1 Å²	143.1	70%	0.696	72%	0.716	S	S	*	*			cis	-171.7	178.2	6.5	-128	177.3	26.6	0	0	115.3
270	L	28.2	Very low	34.1	Very low	135 Å²	135	145.1 Å²	145.1	71%	0.707	71%	0.714	S	S	*	*			trans	82.2	117.8	141.6	-84.3	166.3	0	0	0	125.9
271	R	28.5	Very low	34	Very low	197 Å²	197	142.7 Å²	142.7	74%	0.743	71%	0.711	S	S	*	*				88.9	121.8	122.6	-140.6	-178	-174.1	159.5	1.5	124.7
272	H	31.2	Very low	33.9	Very low	139 Å²	139	140.9 Å²	140.9	64%	0.644	71%	0.705	S	S	*	*			trans	56.3	158.8	142.2	-69.9	3.6	0	0	0	121.2
273	E	30.5	Very low	33.7	Very low	137 Å²	137	137.9 Å²	137.9	64%	0.64	69%	0.693	S	S	*	*			cis	-158.8	154.5	-3.7	-121.1	173.9	120.5	0	0	115.4
274	Q	32.2	Very low	32.9	Very low	139 Å²	139	138.6 Å²	138.6	65%	0.65	70%	0.698	S	S	*	*			trans	41	130.4	142.1	-77.8	-172.3	61.6	0	0	126.6
275	N	33.3	Very low	32.7	Very low	115 Å²	115	138.5 Å²	138.5	62%	0.615	69%	0.694	S	S	*	*				70.9	168.2	128	-69.4	-17.2	0	0	0	122.1
276	Q	32.5	Very low	32.9	Very low	154 Å²	154	137.7 Å²	137.7	72%	0.72	69%	0.691	S	S	*	*			cis	-176.7	169.6	-24.9	-98.6	-172.5	46.6	0	0	108.9
277	V	32.9	Very low	31.7	Very low	91 Å²	91	137 Å²	137	55%	0.552	69%	0.689	S	S	*	*			cis	-163.4	137.5	-12.8	116.1	0	0	0	0	112.6
278	Q	31.6	Very low	30.2	Very low	154 Å²	154	137 Å²	137	72%	0.72	69%	0.691	S	S	*	*			trans	53.2	-168.3	150.3	-50.9	162.8	-3.9	0	0	119.3
279	Q	32.8	Very low	29.9	Very low	141 Å²	141	135.4 Å²	135.4	66%	0.659	69%	0.692	S	S	*	*			cis	-165.2	143	9.7	-144.7	178.9	65	0	0	115
280	Q	32.2	Very low	29.6	Very low	144 Å²	144	138 Å²	138	67%	0.673	70%	0.702	S	S	*	*			trans	50.8	161.5	138	-77.1	-178.9	-49.2	0	0	126.6
281	E	29.9	Very low	29.3	Very low	153 Å²	153	137.4 Å²	137.4	72%	0.715	71%	0.709	S	S	*	*			cis	-143.8	-118.6	-25.1	-156.6	160.8	-83.3	0	0	114.2
282	E	27	Very low	29.1	Very low	156 Å²	156	133 Å²	133	73%	0.729	71%	0.714	S	S	*	*			cis	-153.3	-125.5	7.5	-159.7	-134.7	69.2	0	0	114.8
283	Q	24.9	Very low	28.7	Very low	128 Å²	128	131.5 Å²	131.5	60%	0.598	72%	0.719	S	S	*	*			trans	-140.4	-179.5	-162.3	-89.1	-68.8	-61	0	0	113.8
284	P	34.6	Very low	28.4	Very low	121 Å²	121	132 Å²	132	79%	0.786	72%	0.721	S	S	*	*			cis	-148.5	-164.8	35.9	43.6	-18.6	0	0	0	120.7
285	Q	23.2	Very low	28	Very low	161 Å²	161	135.1 Å²	135.1	75%	0.752	73%	0.727	S	S	*	*			trans	-79.1	179.5	-167.5	-63.9	-76.3	-50.2	0	0	116.9
286	P	37.8	Very low	27.7	Very low	112 Å²	112	140.5 Å²	140.5	73%	0.727	74%	0.74	S	S	*	*			cis	-137.4	-142.8	13.7	42.5	-18.5	0	0	0	114.5
287	S	24.1	Very low	27.5	Very low	103 Å²	103	138.6 Å²	138.6	72%	0.72	74%	0.741	S	S	*	*			cis	-163.3	154.4	1.6	43.7	0	0	0	0	117
288	S	24.6	Very low	27	Very low	102 Å²	102	145.4 Å²	145.4	71%	0.713	76%	0.757	S	S	*	*			trans	44.8	109.1	145	67	0	0	0	0	128.4
289	S	25	Very low	26.8	Very low	112 Å²	112	144 Å²	144	78%	0.783	76%	0.761	S	S	*	*			trans	72	154	134.1	84.5	0	0	0	0	121.2
290	K	24.9	Very low	26.5	Very low	205 Å²	205	146.8 Å²	146.8	89%	0.891	77%	0.771	S	S	*	*			cis	-127	171.9	4.5	-74.1	-177.9	178.5	176.2	0	112
291	S	22.6	Very low	26.3	Very low	122 Å²	122	145.6 Å²	145.6	85%	0.853	78%	0.779	S	S	*	*			trans	-120.1	160.8	-171.6	53.5	0	0	0	0	115.3
292	A	23.2	Very low	26.1	Very low	103 Å²	103	143 Å²	143	85%	0.851	77%	0.773	S	S	*	*			trans	-142.7	157.3	165	0	0	0	0	0	110.3
293	S	22.5	Very low	26	Very low	109 Å²	109	142.6 Å²	142.6	76%	0.762	78%	0.775	S	S	*	*			trans	-88	151.1	-155.1	-63.2	0	0	0	0	118
294	H	25.4	Very low	26.1	Very low	147 Å²	147	142.7 Å²	142.7	68%	0.681	78%	0.778	S	S	*	*				99.7	129.3	128.8	-94.9	-22.9	0	0	0	123.4
295	R	23.9	Very low	25.6	Very low	204 Å²	204	141.2 Å²	141.2	77%	0.77	78%	0.776	S	S	*	*			trans	79.7	101.2	139.5	-65.7	168	-157.8	-173.7	7.6	120.2
296	Y	26.1	Very low	25.7	Very low	228 Å²	228	138.7 Å²	138.7	89%	0.894	78%	0.777	S	S	*	*			trans	-88.2	144.9	145	-76.8	-88.9	0	0	0	111
297	P	27.3	Very low	25.1	Very low	114 Å²	114	137.7 Å²	137.7	74%	0.74	78%	0.777	S	S	*	*				-126.8	124	118.6	34.1	-26.9	0	0	0	110.7
298	R	23.4	Very low	25.2	Very low	235 Å²	235	140.8 Å²	140.8	89%	0.887	78%	0.78	S	S	*	*				62.1	97.7	84.6	-71.8	-167.7	177.3	-154.6	-0.7	114.2
299	P	27.6	Very low	25.3	Very low	123 Å²	123	139.8 Å²	139.8	80%	0.799	77%	0.773	S	S	*	*			trans	-81.1	147.9	167.3	34.4	-33.7	0	0	0	111.4
300	K	27.2	Very low	25.3	Very low	200 Å²	200	140 Å²	140	87%	0.87	77%	0.765	S	S	*	*			trans	-157.9	116.8	156.8	-77.5	-149.1	175.1	-158.8	0	112.5
301	S	26.1	Very low	25.3	Very low	119 Å²	119	140 Å²	140	83%	0.832	77%	0.766	S	S	*	*			trans	-131.7	150	137	53.3	0	0	0	0	106.2
302	T	27.7	Very low	25.4	Very low	98 Å²	98	138 Å²	138	60%	0.601	76%	0.757	S	S	*	*			trans	-155.5	115.1	-175.1	-43.1	0	0	0	0	110.9	I304	T302-I304 HydrophobicContact CG2-CD1 4Å; T302-I304 HydrophobicContact CG2-CG1 3.62Å
303	I	24.4	Very low	25.6	Very low	148 Å²	148	137.3 Å²	137.3	76%	0.759	75%	0.751	S	S	*	*			trans	-73.9	127.4	162.1	-61.8	170.4	0	0	0	106.8
304	I	26.7	Very low	25.6	Very low	130 Å²	130	138 Å²	138	67%	0.667	76%	0.756	S	S	*	*			trans	-127.7	106.2	175.2	-61	-174.7	0	0	0	108.9	T302	T302-I304 HydrophobicContact CG2-CD1 4Å; T302-I304 HydrophobicContact CG2-CG1 3.62Å
305	A	24.1	Very low	25.6	Very low	90 Å²	90	140.6 Å²	140.6	74%	0.744	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-72.5	145.2	149.9	0	0	0	0	0	108.3	A307	A305-A307 PolarHBondContact O-N 3.47Å
306	S	24.8	Very low	25.7	Very low	109 Å²	109	139.8 Å²	139.8	76%	0.762	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-49.4	118.9	-169.4	-51.1	0	0	0	0	113.2
307	A	26.5	Very low	25.7	Very low	90 Å²	90	138 Å²	138	74%	0.744	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-80.8	132.1	176.9	0	0	0	0	0	110.9	A305	A305-A307 PolarHBondContact O-N 3.47Å
308	H	25.6	Very low	25.5	Very low	169 Å²	169	142.5 Å²	142.5	78%	0.782	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-63.2	136.5	173.2	-74	-100.3	0	0	0	111.5	N310	H308-N310 PolarHBondContact O-N 3.46Å; H308-N310 VanDerWaalsContact O-N 3.12Å
309	S	26.4	Very low	25.5	Very low	81 Å²	81	136.3 Å²	136.3	57%	0.566	77%	0.768	S	S	*	*			trans	-73.9	96.2	172.7	54	0	0	0	0	111.2
310	N	25	Very low	25.4	Very low	115 Å²	115	134.1 Å²	134.1	62%	0.615	77%	0.769	S	S	*	*			trans	-133.1	82.8	171.5	-100.5	-27.6	0	0	0	110.7	H308 T735	H308-N310 PolarHBondContact O-N 3.46Å; H308-N310 VanDerWaalsContact O-N 3.12Å; N310-T735 WeakPolarHBondContact OD1-CG2 3.35Å
311	F	24.9	Very low	25.2	Very low	206 Å²	206	128 Å²	128	90%	0.904	76%	0.762	S	S	*	*			trans	-159	91.6	154.9	-127.5	-76.6	0	0	0	111.2
312	A	25	Very low	25.3	Very low	80 Å²	80	130.1 Å²	130.1	66%	0.661	76%	0.763	S	S	*	*			trans	-79.6	143.7	156.1	0	0	0	0	0	108.4
313	A	26.5	Very low	25.2	Very low	88 Å²	88	136 Å²	136	73%	0.727	78%	0.776	S	S	*	*			trans	-85.5	127	-176.3	0	0	0	0	0	111.9
314	S	23.7	Very low	25.3	Very low	125 Å²	125	139.1 Å²	139.1	87%	0.874	78%	0.778	S	S	*	*			trans	-98.5	102.3	160.5	-66.3	0	0	0	0	109
315	F	25.7	Very low	25.2	Very low	201 Å²	201	140.9 Å²	140.9	88%	0.882	78%	0.783	S	S	*	*			trans	-116.5	94	171.3	-121.2	-71.7	0	0	0	108.3
316	E	24.2	Very low	25.3	Very low	187 Å²	187	142.2 Å²	142.2	87%	0.874	78%	0.783	S	S	*	*			trans	-73.6	143.2	163.1	-74	-162.2	117	0	0	109.8
317	K	26.3	Very low	25.3	Very low	191 Å²	191	144.3 Å²	144.3	83%	0.83	79%	0.785	S	S	*	*			trans	-82.8	152.3	170.6	-59	168.5	-178.2	170.5	0	108.3
318	F	23.9	Very low	25.3	Very low	207 Å²	207	143.1 Å²	143.1	91%	0.908	78%	0.782	S	S	*	*				-145.8	164.4	123	-116.5	-77.8	0	0	0	111.9
319	S	24.1	Very low	25.4	Very low	105 Å²	105	144.4 Å²	144.4	73%	0.734	79%	0.788	S	S	*	*			trans	-54.2	153.9	-162.5	-51.5	0	0	0	0	117.1
320	G	24.5	Very low	25.5	Very low	78 Å²	78	146.7 Å²	146.7	80%	0.804	80%	0.799	S	S	*	*			trans	-106.7	-178.2	160.3	0	0	0	0	0	112.8
321	G	24.2	Very low	25.8	Very low	71 Å²	71	148.6 Å²	148.6	73%	0.732	81%	0.809	S	S	*	*			trans	-107.9	125.1	162	0	0	0	0	0	109.7
322	L	26.3	Very low	26	Very low	164 Å²	164	146.7 Å²	146.7	86%	0.859	81%	0.806	S	S	*	*				64.7	103.4	82.5	-88.6	163.9	0	0	0	113.9
323	Y	26.7	Very low	26.1	Very low	220 Å²	220	150.9 Å²	150.9	86%	0.863	81%	0.812	S	S	*	*				-152.1	125.8	120.6	-122.3	-86	0	0	0	112.2
324	R	25.3	Very low	26.1	Very low	214 Å²	214	151.2 Å²	151.2	81%	0.808	81%	0.809	S	S	*	*			trans	52.5	124.6	157.4	-110.1	177.3	178.5	166.3	-1.9	123.5
325	Q	25.3	Very low	26.3	Very low	167 Å²	167	154.6 Å²	154.6	78%	0.78	81%	0.808	S	S	*	*			trans	-31.6	154.7	133.8	-64.2	157.9	-27	0	0	113.4
326	T	26.3	Very low	26.3	Very low	118 Å²	118	151.1 Å²	151.1	72%	0.724	80%	0.804	S	S	*	*				-149.4	158.4	51.8	48.6	0	0	0	0	115.6
327	N	25.8	Very low	26.4	Very low	153 Å²	153	147.2 Å²	147.2	82%	0.818	80%	0.797	S	S	*	*			trans	17.1	137.7	141.9	-43.7	1.3	0	0	0	118.8
328	G	26.3	Very low	26.5	Very low	65 Å²	65	142.2 Å²	142.2	67%	0.67	79%	0.786	S	S	*	*			cis	144.5	148.3	0.4	0	0	0	0	0	112
329	E	26.6	Very low	26.6	Very low	197 Å²	197	140.4 Å²	140.4	92%	0.921	79%	0.786	S	S	*	*			trans	65.3	155.4	176	-46	-174.1	127.1	0	0	113.9
330	T	28.7	Very low	26.9	Very low	129 Å²	129	139.5 Å²	139.5	79%	0.791	79%	0.785	S	S	*	*			cis	-136.3	169.1	16.1	48.2	0	0	0	0	113.2
331	N	31.4	Very low	27.1	Very low	155 Å²	155	146.8 Å²	146.8	83%	0.829	79%	0.788	S	S	*	*			trans	-70	157.7	156.2	-101.2	-45.9	0	0	0	110.9
332	I	29.7	Very low	27.3	Very low	165 Å²	165	154.1 Å²	154.1	85%	0.846	79%	0.794	S	S	*	*			trans	-167.8	154.5	136.9	-103.9	154.5	0	0	0	112
333	E	26.3	Very low	27.5	Very low	168 Å²	168	157.6 Å²	157.6	79%	0.785	80%	0.797	S	S	*	*			trans	-84.4	159.8	-165.9	-51.5	160.2	98.2	0	0	115.4
334	S	27.7	Very low	27.7	Very low	95 Å²	95	150.6 Å²	150.6	66%	0.664	79%	0.792	S	S	*	*			trans	68.4	134.6	145	79.7	0	0	0	0	117.9
335	K	26.7	Very low	28.3	Very low	196 Å²	196	148.1 Å²	148.1	85%	0.852	79%	0.793	S	S	*	*				-167.4	168.3	76.1	-109.3	156	-168.6	169	0	114.9
336	T	25.6	Very low	28.8	Very low	129 Å²	129	146.3 Å²	146.3	79%	0.791	79%	0.789	S	S	*	*			trans	-69	157.1	-178.3	49.7	0	0	0	0	116.4
337	S	26.3	Very low	29.5	Very low	104 Å²	104	145.4 Å²	145.4	73%	0.727	79%	0.787	S	S	*	*			trans	100.5	121.7	137.5	-144	0	0	0	0	120.1
338	S	29.5	Very low	30.6	Very low	87 Å²	87	144.7 Å²	144.7	61%	0.608	78%	0.782	S	S	*	*			trans	35.5	122	138.1	64.4	0	0	0	0	120.6
339	N	26.5	Very low	31.4	Very low	169 Å²	169	145.7 Å²	145.7	90%	0.904	78%	0.78	S	S	*	*				-167.6	175.8	102.1	-105.7	-55.9	0	0	0	113
340	A	28.7	Very low	32.3	Very low	86 Å²	86	141.5 Å²	141.5	71%	0.711	76%	0.762	S	S	*	*			trans	-114.4	168.7	-170.3	0	0	0	0	0	114.7
341	R	29.4	Very low	32.9	Very low	231 Å²	231	143.5 Å²	143.5	87%	0.872	76%	0.76	S	S	*	*			trans	94.9	144.6	161.2	-60.3	-179.4	158.2	-177.4	-6.3	119.2
342	R	27.7	Very low	33.7	Very low	224 Å²	224	139.6 Å²	139.6	85%	0.845	75%	0.749	S	S	*	*			trans	70.6	106.3	165.8	-48.4	-168.6	-151.6	-137.5	7	117.5
343	Y	31.5	Very low	34.2	Very low	238 Å²	238	136 Å²	136	93%	0.933	74%	0.739	S	S	*	*			trans	-104.8	134.1	132	-81.1	-82.8	0	0	0	108.4
344	G	30	Very low	35.2	Very low	73 Å²	73	133.5 Å²	133.5	75%	0.753	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-84.4	156.9	166.3	0	0	0	0	0	110.4
345	I	37.6	Very low	36	Very low	161 Å²	161	136.5 Å²	136.5	83%	0.826	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-92.3	118.4	173	-61.6	173.3	0	0	0	107.9	S347	I345-S347 PolarHBondContact O-N 3.05Å
346	D	36	Very low	36.5	Very low	130 Å²	130	136.1 Å²	136.1	70%	0.695	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-74.4	122.6	179.1	-111.3	-36	0	0	0	111.7	L348	D346-L348 PolarHBondContact O-N 2.86Å; D346-L348 VanDerWaalsContact O-N 3.14Å
347	S	41.6	Very low	37.1	Very low	98 Å²	98	138.3 Å²	138.3	69%	0.685	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	-3	-171.4	56.7	0	0	0	0	114.7	I345	I345-S347 PolarHBondContact O-N 3.05Å
348	L	49.1	Very low	37.7	Very low	138 Å²	138	139.4 Å²	139.4	72%	0.723	73%	0.728	S	S	*	*	H	α-helix	trans	-84.2	-24.3	-179.2	-75.1	162.8	0	0	0	114	D346	D346-L348 PolarHBondContact O-N 2.86Å; D346-L348 VanDerWaalsContact O-N 3.14Å
349	S	42.6	Very low	38.2	Very low	87 Å²	87	142.1 Å²	142.1	61%	0.608	74%	0.736	S	S	*	*	H	α-helix	trans	-70.3	-39.8	-178.3	-175.7	0	0	0	0	112.7	K351	S349-K351 VanDerWaalsContact C-N 3.34Å; S349-K351 PolarHBondContact O-N 3.25Å
350	I	46.2	Very low	38.6	Very low	108 Å²	108	142.2 Å²	142.2	55%	0.554	74%	0.736	S	S	*	*	H	α-helix	trans	-66.9	-34.6	-175.4	-63.6	172.9	0	0	0	111.8	A352 S353	I350-A352 PolarHBondContact O-N 3.42Å; I350-S353 PolarHBondContact O-N 2.66Å
351	K	41.9	Very low	39.2	Very low	171 Å²	171	143.7 Å²	143.7	74%	0.743	74%	0.74	S	S	*	*	H	α-helix	trans	-68.3	-35.4	-174.5	-131.1	176.4	-176.8	-177.6	0	112.9	S349 S353	S349-K351 VanDerWaalsContact C-N 3.34Å; S349-K351 PolarHBondContact O-N 3.25Å; K351-S353 VanDerWaalsContact C-N 3.27Å; K351-S353 PolarHBondContact O-N 3.03Å
352	A	47.3	Very low	39.4	Very low	74 Å²	74	135.7 Å²	135.7	61%	0.612	73%	0.73	S	S	*	*	H	α-helix	trans	-70.3	-18.8	178.6	0	0	0	0	0	114	I350	I350-A352 PolarHBondContact O-N 3.42Å
353	S	39.4	Very low	39.6	Very low	90 Å²	90	134.2 Å²	134.2	63%	0.629	73%	0.733	S	S	*	*	H	α-helix	trans	-85	-26.6	-176.7	-59.8	0	0	0	0	114.2	I350 K351	I350-S353 PolarHBondContact O-N 2.66Å; K351-S353 VanDerWaalsContact C-N 3.27Å; K351-S353 PolarHBondContact O-N 3.03Å
354	I	48.8	Very low	39.4	Very low	115 Å²	115	132 Å²	132	59%	0.59	73%	0.728	S	S	*	*	H	α-helix	trans	-81.4	-40.6	-176.8	-62.8	175.8	0	0	0	111.2	K356 F357	I354-K356 PolarHBondContact O-N 2.76Å; I354-K356 VanDerWaalsContact O-N 3.12Å; I354-F357 PolarHBondContact O-N 3.37Å; I354-F357 VanDerWaalsContact O-N 3.14Å
355	E	43	Very low	39.3	Very low	157 Å²	157	140.2 Å²	140.2	73%	0.734	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-18.1	-170.6	-156.5	162.7	-124.6	0	0	113.9
356	K	38.3	Very low	38.9	Very low	189 Å²	189	141.4 Å²	141.4	82%	0.822	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-8.9	178.6	-151.6	169.2	-172.5	173	0	114.3	I354	I354-K356 PolarHBondContact O-N 2.76Å; I354-K356 VanDerWaalsContact O-N 3.12Å
357	F	37.2	Very low	38.5	Very low	174 Å²	174	142.6 Å²	142.6	76%	0.763	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-32.8	-174.8	-161.3	-102.7	0	0	0	113.5	I354 N359	I354-F357 PolarHBondContact O-N 3.37Å; I354-F357 VanDerWaalsContact O-N 3.14Å; F357-N359 PolarHBondContact O-N 2.96Å
358	N	39.9	Very low	38.4	Very low	127 Å²	127	144 Å²	144	68%	0.679	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-77.9	-17.9	-174.5	-72.4	-12.1	0	0	0	114.8	L360	N358-L360 PolarHBondContact O-N 3.43Å
359	N	39.1	Very low	37.3	Very low	145 Å²	145	141 Å²	141	78%	0.775	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-89.7	17.6	-168.2	-96	-47.5	0	0	0	116.1	F357	F357-N359 PolarHBondContact O-N 2.96Å
360	L	34.9	Very low	36.8	Very low	171 Å²	171	143.1 Å²	143.1	90%	0.895	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-131.4	-0.9	173.6	-98.6	165.9	0	0	0	115	N358	N358-L360 PolarHBondContact O-N 3.43Å
361	S	40.9	Very low	35.8	Very low	116 Å²	116	141.4 Å²	141.4	81%	0.811	78%	0.778	S	S	*	*	S	Bend	trans	-105.5	67.5	176.4	179.1	0	0	0	0	111.4
362	G	35.5	Very low	35.2	Very low	64 Å²	64	139.5 Å²	139.5	66%	0.66	79%	0.786	S	S	*	*			trans	171.6	52.6	178.5	0	0	0	0	0	119.8
363	Q	30.4	Very low	34.2	Very low	193 Å²	193	139.5 Å²	139.5	90%	0.902	79%	0.794	S	S	*	*			trans	-166.5	110.8	149.4	-114.5	167.6	67.3	0	0	114.4
364	K	28.7	Very low	33.7	Very low	191 Å²	191	143.7 Å²	143.7	83%	0.83	81%	0.807	S	S	*	*				147.2	95	104.3	-165.7	166	-172.5	172.3	0	113.5
365	R	27.4	Very low	32.6	Very low	246 Å²	246	141.1 Å²	141.1	93%	0.928	81%	0.809	S	S	*	*			trans	-137	111	151.1	-106.9	-166.7	175.6	-152.1	0.3	108.5
366	Q	28.8	Very low	33.3	Very low	186 Å²	186	140.3 Å²	140.3	87%	0.869	82%	0.817	S	S	*	*			trans	-163.3	140.3	160.8	-111.9	174.6	13.8	0	0	108.4
367	N	27.6	Very low	32.9	Very low	154 Å²	154	134.7 Å²	134.7	82%	0.824	81%	0.813	S	S	*	*			trans	-97.2	158.2	166.7	-99.1	5.5	0	0	0	109.2
368	P	38.9	Very low	32.6	Very low	128 Å²	128	132.8 Å²	132.8	83%	0.831	82%	0.822	S	S	*	*			trans	-73.1	168.4	171.5	33.8	-36.3	0	0	0	111.7
369	G	26.7	Very low	32.1	Very low	76 Å²	76	130.8 Å²	130.8	78%	0.784	82%	0.823	S	S	*	*			trans	-150.1	178.8	176.2	0	0	0	0	0	113.4
370	S	32	Very low	31.6	Very low	131 Å²	131	130.4 Å²	130.4	92%	0.916	83%	0.826	S	S	*	*			trans	-166.9	164.2	174.6	50.1	0	0	0	0	108.2
371	G	25.8	Very low	31.4	Very low	72 Å²	72	127 Å²	127	74%	0.742	82%	0.823	S	S	*	*			cis	-151.7	-156.3	4.4	0	0	0	0	0	112.8
372	S	29	Very low	30.9	Very low	130 Å²	130	127.5 Å²	127.5	91%	0.909	83%	0.826	S	S	*	*			trans	-116.5	156	-151.9	-47.1	0	0	0	0	116.3
373	G	26.6	Very low	30.5	Very low	75 Å²	75	128.1 Å²	128.1	77%	0.773	83%	0.832	S	S	*	*				100.4	145.1	127	0	0	0	0	0	119.1
374	I	27.6	Very low	30.4	Very low	177 Å²	177	127.8 Å²	127.8	91%	0.908	84%	0.836	S	S	*	*			trans	-135.1	144.2	165	-67.4	179.9	0	0	0	108.1
375	G	25.2	Very low	30.4	Very low	61 Å²	61	122.5 Å²	122.5	63%	0.629	84%	0.835	S	S	*	*			trans	-122.7	163.1	169.2	0	0	0	0	0	112.1
376	P	57.9	Low	30.4	Very low	140 Å²	140	115 Å²	115	91%	0.909	83%	0.834	S	S	*	*			trans	-89.2	170.5	-166.2	36.4	-37.3	0	0	0	114.3
377	G	30.1	Very low	30.3	Very low	72 Å²	72	109.5 Å²	109.5	74%	0.742	83%	0.828	S	S	*	*			cis	157.9	-151.8	-1.7	0	0	0	0	0	112.6
378	S	31	Very low	30.4	Very low	134 Å²	134	113.4 Å²	113.4	94%	0.937	83%	0.831	S	S	*	*			trans	92.5	158.7	175.6	-152	0	0	0	0	118.4
379	A	30.2	Very low	29.9	Very low	85 Å²	85	113.5 Å²	113.5	70%	0.702	82%	0.824	S	S	*	*			trans	-100.3	-178.5	-163.4	0	0	0	0	0	112.5
380	T	28.3	Very low	30	Very low	136 Å²	136	114.2 Å²	114.2	83%	0.834	82%	0.817	S	S	*	*			cis	-154.5	-174.7	30.5	54.4	0	0	0	0	113.5
381	A	30.4	Very low	29.8	Very low	101 Å²	101	114.7 Å²	114.7	84%	0.835	81%	0.813	S	S	*	*			trans	87.8	165.5	158	0	0	0	0	0	119.4
382	S	29.6	Very low	29.9	Very low	126 Å²	126	115.3 Å²	115.3	88%	0.881	81%	0.812	S	S	*	*			trans	-134.5	149.1	-153.5	50.6	0	0	0	0	114.5
383	G	27.3	Very low	29.8	Very low	77 Å²	77	114.4 Å²	114.4	79%	0.794	81%	0.806	S	S	*	*			trans	-171.9	104.2	177.6	0	0	0	0	0	116.2
384	L	29.7	Very low	29.8	Very low	186 Å²	186	122.4 Å²	122.4	97%	0.974	81%	0.813	S	S	*	*			trans	-10.9	148	162.8	-60.1	163.4	0	0	0	121.4
385	G	27.3	Very low	29.9	Very low	79 Å²	79	118.4 Å²	118.4	81%	0.814	80%	0.8	S	S	*	*			trans	155.7	71.5	145.8	0	0	0	0	0	122.5
386	G	27.6	Very low	30.1	Very low	88 Å²	88	121.9 Å²	121.9	91%	0.907	80%	0.804	S	S	*	*			trans	59.7	159.5	152.6	0	0	0	0	0	121.6
387	G	28.2	Very low	28.8	Very low	71 Å²	71	123.9 Å²	123.9	73%	0.732	80%	0.801	S	S	*	*			cis	158.3	124	-18.1	0	0	0	0	0	115.9
388	R	29.2	Very low	28.7	Very low	237 Å²	237	123.8 Å²	123.8	89%	0.894	80%	0.8	S	S	*	*			trans	67.5	166.9	161.3	-61.7	-179.3	170	-137.7	-1.2	117.4
389	L	29.1	Very low	28.7	Very low	130 Å²	130	122.6 Å²	122.6	68%	0.681	79%	0.792	S	S	*	*			cis	-161.2	135.6	-32.6	-105.3	170.2	0	0	0	110.9
390	S	28.2	Very low	28.8	Very low	91 Å²	91	127.5 Å²	127.5	64%	0.636	80%	0.8	S	S	*	*			trans	31.5	149.2	138.6	72.5	0	0	0	0	126.3
391	V	26.7	Very low	28.9	Very low	140 Å²	140	126.1 Å²	126.1	85%	0.848	80%	0.802	S	S	*	*			trans	97.6	150.6	147.1	-177.5	0	0	0	0	120.1
392	A	27.9	Very low	28.7	Very low	86 Å²	86	125.1 Å²	125.1	71%	0.711	80%	0.802	S	S	*	*			trans	79.6	129.2	174.7	0	0	0	0	0	116.7
393	S	27.5	Very low	28.5	Very low	111 Å²	111	122.7 Å²	122.7	78%	0.776	80%	0.797	S	S	*	*			cis	101.5	125.3	12.1	-57.4	0	0	0	0	116.6
394	R	26.8	Very low	28.9	Very low	243 Å²	243	124.5 Å²	124.5	92%	0.917	80%	0.798	S	S	*	*			trans	67.6	158	165.5	-70	178	175.7	178.1	-2.4	115.5
395	S	29.9	Very low	29.1	Very low	93 Å²	93	121.4 Å²	121.4	65%	0.65	79%	0.791	S	S	*	*			cis	-172.1	157.4	-18.1	49.4	0	0	0	0	112.3
396	N	28.9	Very low	29.3	Very low	134 Å²	134	121.8 Å²	121.8	72%	0.717	78%	0.781	S	S	*	*			trans	60.9	134.7	143.4	-74.2	15.2	0	0	0	124.5
397	H	31.1	Very low	29.5	Very low	181 Å²	181	124.2 Å²	124.2	84%	0.838	77%	0.774	S	S	*	*			trans	71.6	155.5	143.5	-67.7	-51.9	0	0	0	122.3
398	G	28.2	Very low	29.6	Very low	70 Å²	70	126.9 Å²	126.9	72%	0.722	77%	0.771	S	S	*	*			trans	98.3	102.9	-174.7	0	0	0	0	0	111.7
399	S	31	Very low	29.7	Very low	109 Å²	109	122.5 Å²	122.5	76%	0.762	76%	0.76	S	S	*	*			cis	84.4	115.7	23.6	-50.8	0	0	0	0	115.8
400	Q	32.7	Very low	30	Very low	189 Å²	189	123 Å²	123	88%	0.883	76%	0.759	S	S	*	*			trans	67.7	122.6	169.7	-66.1	179.3	-7.8	0	0	115.3
401	A	29.6	Very low	30.1	Very low	106 Å²	106	127.6 Å²	127.6	88%	0.876	76%	0.763	S	S	*	*				62	135.3	89.2	0	0	0	0	0	113.3
402	G	26.8	Very low	30.4	Very low	81 Å²	81	130.9 Å²	130.9	84%	0.835	76%	0.761	S	S	*	*			cis	164.1	147.5	1.8	0	0	0	0	0	108.1
403	G	25.5	Very low	30.7	Very low	74 Å²	74	131.4 Å²	131.4	76%	0.763	76%	0.759	S	S	*	*			trans	-171.3	162.2	-172.7	0	0	0	0	0	114.2
404	S	34.9	Very low	31.1	Very low	116 Å²	116	130.4 Å²	130.4	81%	0.811	75%	0.753	S	S	*	*			trans	-148.3	175.3	-168.9	-59	0	0	0	0	112.8
405	S	34.1	Very low	31.2	Very low	121 Å²	121	125.1 Å²	125.1	85%	0.846	74%	0.743	S	S	*	*			trans	78.1	160.3	176	86.2	0	0	0	0	115.4
406	S	30.8	Very low	31.3	Very low	86 Å²	86	127.6 Å²	127.6	60%	0.601	75%	0.748	S	S	*	*			cis	-159.7	157	9.8	76.7	0	0	0	0	113.7
407	N	32.7	Very low	31.5	Very low	140 Å²	140	127.3 Å²	127.3	75%	0.749	75%	0.746	S	S	*	*			trans	61.4	164.9	140.5	-61.5	-20.2	0	0	0	119.7
408	L	30.5	Very low	31.5	Very low	127 Å²	127	124.4 Å²	124.4	67%	0.665	74%	0.737	S	S	*	*			cis	-161.3	173.6	-6.9	-142.4	43.6	0	0	0	113
409	Q	31.2	Very low	31.6	Very low	145 Å²	145	127.3 Å²	127.3	68%	0.678	74%	0.735	S	S	*	*			trans	60.2	143.3	166.6	-88.3	87.8	36.9	0	0	118.7
410	Q	35.7	Very low	31.4	Very low	141 Å²	141	132.8 Å²	132.8	66%	0.659	74%	0.739	S	S	*	*			cis	74.6	143.4	50	-64.1	-169.7	12.3	0	0	114.4
411	R	29.6	Very low	31.2	Very low	187 Å²	187	130.6 Å²	130.6	71%	0.706	74%	0.738	S	S	*	*			cis	-164.7	147.6	5.2	-129.9	-168	-90.5	-170.2	-7.8	111.6
412	Y	32.5	Very low	30.9	Very low	208 Å²	208	129.8 Å²	129.8	82%	0.816	73%	0.731	S	S	*	*			trans	53.3	161.2	159.7	-71.2	-71.5	0	0	0	118.9
413	S	34.2	Very low	30.8	Very low	97 Å²	97	131 Å²	131	68%	0.678	73%	0.733	S	S	*	*			cis	-156.6	-177.6	6.4	-129.8	0	0	0	0	109.6
414	S	36	Very low	30.7	Very low	91 Å²	91	130.2 Å²	130.2	64%	0.636	73%	0.725	S	S	*	*			cis	-132.1	-118.5	-3.8	7	0	0	0	0	111.4
415	D	29.8	Very low	30.1	Very low	132 Å²	132	136.1 Å²	136.1	71%	0.706	73%	0.732	S	S	*	*			cis	-156.4	157.5	0.2	-86.1	-76.1	0	0	0	111.6
416	L	31.9	Very low	29.6	Very low	144 Å²	144	134.9 Å²	134.9	75%	0.754	72%	0.723	S	S	*	*			trans	21.8	121.4	163.3	-61.8	172.2	0	0	0	120
417	D	32.3	Very low	29.3	Very low	129 Å²	129	136.1 Å²	136.1	69%	0.69	73%	0.732	S	S	*	*			cis	103.5	154.4	46.4	-93.7	44.8	0	0	0	111.8
418	N	31.1	Very low	29	Very low	120 Å²	120	134.5 Å²	134.5	64%	0.642	73%	0.731	S	S	*	*			cis	-177.5	161.2	-29	-107.1	-27.9	0	0	0	107.5
419	I	30.2	Very low	28.7	Very low	131 Å²	131	135.8 Å²	135.8	67%	0.672	74%	0.738	S	S	*	*			cis	-169	167.5	-14.1	-162	171.9	0	0	0	109.7
420	R	26.5	Very low	28.5	Very low	224 Å²	224	134.5 Å²	134.5	85%	0.845	74%	0.74	S	S	*	*			trans	73.5	165.7	165.5	-71.2	173.4	179.7	173.4	-0.4	119.3
421	V	30	Very low	28.1	Very low	142 Å²	142	139.1 Å²	139.1	86%	0.861	75%	0.751	S	S	*	*				-177.4	121.7	-55.6	139.6	0	0	0	0	110.1
422	A	23.5	Very low	27.8	Very low	90 Å²	90	134.3 Å²	134.3	74%	0.744	75%	0.752	S	S	*	*			trans	-170.6	154.4	165.4	0	0	0	0	0	107.1
423	A	24.3	Very low	27.9	Very low	105 Å²	105	128.3 Å²	128.3	87%	0.868	75%	0.745	S	S	*	*			cis	62.8	127.8	31	0	0	0	0	0	113.6
424	G	22.2	Very low	27.4	Very low	59 Å²	59	134.4 Å²	134.4	61%	0.608	76%	0.755	S	S	*	*			cis	179.4	-173.3	-3.8	0	0	0	0	0	108.8
425	Y	23.6	Very low	27.1	Very low	240 Å²	240	139.7 Å²	139.7	94%	0.941	76%	0.761	S	S	*	*			trans	66.4	165.2	179.4	-57.4	-89.5	0	0	0	117.2
426	S	23.3	Very low	26.9	Very low	95 Å²	95	140.3 Å²	140.3	66%	0.664	77%	0.77	S	S	*	*			cis	-175.3	142.9	-43.3	-174.1	0	0	0	0	109.3
427	S	24.8	Very low	26.6	Very low	112 Å²	112	139 Å²	139	78%	0.783	77%	0.768	S	S	*	*			trans	61.4	141.1	175.7	76.7	0	0	0	0	115.3
428	S	25.3	Very low	26.2	Very low	106 Å²	106	137.8 Å²	137.8	74%	0.741	78%	0.776	S	S	*	*			cis	-144.4	-172.1	3.1	-132.4	0	0	0	0	108.3
429	L	24.9	Very low	26	Very low	153 Å²	153	138.4 Å²	138.4	80%	0.801	78%	0.784	S	S	*	*			cis	-144.1	-177	26.7	-121.9	119.6	0	0	0	111.9
430	T	27.5	Very low	25.9	Very low	119 Å²	119	140.6 Å²	140.6	73%	0.73	79%	0.794	S	S	*	*			trans	-70.1	167.4	167.6	50.6	0	0	0	0	111.9
431	R	25.7	Very low	25.9	Very low	237 Å²	237	138 Å²	138	89%	0.894	80%	0.797	S	S	*	*			cis	-155.4	157.6	22.9	-158.9	166.2	-175.8	164.4	2.3	114.1
432	A	25.2	Very low	25.8	Very low	86 Å²	86	136 Å²	136	71%	0.711	79%	0.789	S	S	*	*			trans	-141.7	171.4	165.5	0	0	0	0	0	109.2
433	A	32.6	Very low	25.8	Very low	82 Å²	82	138.8 Å²	138.8	68%	0.678	80%	0.796	S	S	*	*			cis	-118.6	-115.8	-2.1	0	0	0	0	0	111.5
434	Y	25.4	Very low	25.8	Very low	225 Å²	225	138.1 Å²	138.1	88%	0.882	79%	0.785	S	S	*	*			cis	-132.7	142.9	8.5	-104	-82.1	0	0	0	113.3
435	R	29.7	Very low	26	Very low	202 Å²	202	141.8 Å²	141.8	76%	0.762	80%	0.796	S	S	*	*			trans	-91.2	169	159.1	-62.4	176.9	173.8	-179.4	-1.5	109
436	T	25.6	Very low	26.8	Very low	145 Å²	145	135.6 Å²	135.6	89%	0.89	79%	0.785	S	S	*	*				-139.7	140.5	124.8	5.4	0	0	0	0	111.3
437	T	25.8	Very low	26.9	Very low	116 Å²	116	138 Å²	138	71%	0.712	80%	0.796	S	S	*	*			trans	-145.4	129	171.2	47.8	0	0	0	0	106.6
438	A	24.1	Very low	27	Very low	104 Å²	104	137 Å²	137	86%	0.86	79%	0.794	S	S	*	*			trans	-137.4	149.1	175.1	0	0	0	0	0	109.6
439	T	26.6	Very low	27.2	Very low	134 Å²	134	138.9 Å²	138.9	82%	0.822	80%	0.801	S	S	*	*			trans	-137.1	128	-178	42.6	0	0	0	0	110.7
440	M	28.1	Very low	27.2	Very low	176 Å²	176	137.5 Å²	137.5	87%	0.867	80%	0.799	S	S	*	*			trans	52.4	115.8	155.3	-63.2	-65.5	-178.7	0	0	118.7
441	N	26	Very low	27.2	Very low	170 Å²	170	136.5 Å²	136.5	91%	0.909	80%	0.797	S	S	*	*				-155.2	164.1	112	-109.2	-16.5	0	0	0	111.8
442	S	27.8	Very low	27.3	Very low	100 Å²	100	134 Å²	134	70%	0.699	80%	0.795	S	S	*	*			trans	-116.2	140.8	-166.1	55.5	0	0	0	0	113.6
443	V	22.8	Very low	27.5	Very low	148 Å²	148	138.6 Å²	138.6	90%	0.897	81%	0.807	S	S	*	*			trans	-137.5	151.3	156.3	-179.5	0	0	0	0	108.2
444	S	25	Very low	27.2	Very low	92 Å²	92	138.3 Å²	138.3	64%	0.643	81%	0.812	S	S	*	*			trans	-125.1	157.5	-174.7	-55	0	0	0	0	111.6
445	T	27.1	Very low	27.3	Very low	135 Å²	135	131.1 Å²	131.1	83%	0.828	81%	0.806	S	S	*	*			trans	62	174	166	82.4	0	0	0	0	116.2
446	P	39.7	Very low	28.1	Very low	110 Å²	110	126.8 Å²	126.8	71%	0.714	80%	0.804	S	S	*	*			cis	-122.7	177.3	-19.5	40.3	-28	0	0	0	112.6
447	V	25.2	Very low	28.2	Very low	147 Å²	147	127.3 Å²	127.3	89%	0.891	80%	0.8	S	S	*	*				-146.5	137	129.4	176.2	0	0	0	0	107.7
448	A	26.3	Very low	28.4	Very low	90 Å²	90	127.6 Å²	127.6	74%	0.744	81%	0.806	S	S	*	*			trans	-129.6	172	169	0	0	0	0	0	109.9
449	V	29.6	Very low	28.6	Very low	145 Å²	145	125.9 Å²	125.9	88%	0.879	80%	0.799	S	S	*	*			trans	-86.4	127.7	-167.9	-176	0	0	0	0	113.3
450	T	25.8	Very low	28.7	Very low	125 Å²	125	127.8 Å²	127.8	77%	0.767	80%	0.804	S	S	*	*			trans	-165.5	153.3	159.2	38.9	0	0	0	0	108.1
451	S	28.2	Very low	28.7	Very low	97 Å²	97	122.8 Å²	122.8	68%	0.678	80%	0.798	S	S	*	*			cis	178.1	139.9	-29.5	47.7	0	0	0	0	107.2
452	E	26.6	Very low	28.8	Very low	184 Å²	184	118.4 Å²	118.4	86%	0.86	79%	0.793	S	S	*	*			trans	58.7	124.8	166.6	-55.4	-165.7	158.1	0	0	120.4
453	L	29	Very low	29	Very low	183 Å²	183	122.7 Å²	122.7	96%	0.958	80%	0.802	S	S	*	*				-177.6	130.5	112.3	-98.9	165.4	0	0	0	110.4
454	G	27.8	Very low	29.4	Very low	76 Å²	76	122.9 Å²	122.9	78%	0.784	80%	0.804	S	S	*	*			trans	131	95.8	169.6	0	0	0	0	0	116.2
455	G	26.2	Very low	29.7	Very low	74 Å²	74	122.8 Å²	122.8	76%	0.763	81%	0.808	S	S	*	*			trans	-79.9	-174.7	148	0	0	0	0	0	110.8
456	P	45.9	Very low	29.8	Very low	112 Å²	112	123.3 Å²	123.3	73%	0.727	81%	0.811	S	S	*	*			cis	-145	163	28.6	41.2	-22.2	0	0	0	118.5
457	I	27.9	Very low	29.4	Very low	156 Å²	156	122.1 Å²	122.1	80%	0.8	81%	0.811	S	S	*	*			trans	62.8	141	138.8	-64.7	165.2	0	0	0	121.1
458	S	30.4	Very low	29.7	Very low	121 Å²	121	124.1 Å²	124.1	85%	0.846	81%	0.813	S	S	*	*			trans	81.5	146.2	178.8	-32.5	0	0	0	0	114.9
459	G	28.7	Very low	29.8	Very low	68 Å²	68	123.1 Å²	123.1	70%	0.701	81%	0.812	S	S	*	*			cis	151.4	104.6	-1	0	0	0	0	0	108.3
460	D	29.3	Very low	30	Very low	174 Å²	174	124.4 Å²	124.4	93%	0.93	81%	0.808	S	S	*	*				82.2	146.5	98.2	-168.6	35.4	0	0	0	114.5
461	G	27.9	Very low	31.2	Very low	71 Å²	71	124 Å²	124	73%	0.732	81%	0.807	S	S	*	*			trans	74.6	164.2	-176.5	0	0	0	0	0	115.5
462	G	27.2	Very low	31.4	Very low	78 Å²	78	124.7 Å²	124.7	80%	0.804	81%	0.808	S	S	*	*			cis	169	143.4	-3	0	0	0	0	0	111.2
463	E	32.6	Very low	31.7	Very low	191 Å²	191	120.8 Å²	120.8	89%	0.893	80%	0.801	S	S	*	*			trans	-65.3	159.3	-173.7	-54.4	171.7	117.3	0	0	114.4
464	T	30	Very low	31.6	Very low	152 Å²	152	121.1 Å²	121.1	93%	0.933	79%	0.794	S	S	*	*			trans	-170.3	161.4	130	14	0	0	0	0	112.2
465	A	32.2	Very low	31.5	Very low	89 Å²	89	123.2 Å²	123.2	74%	0.736	79%	0.792	S	S	*	*			trans	-136.1	163.9	178	0	0	0	0	0	110.8
466	T	29.8	Very low	31.5	Very low	146 Å²	146	125.1 Å²	125.1	90%	0.896	79%	0.789	S	S	*	*			trans	166	157	141.6	-73.9	0	0	0	0	112
467	A	31.5	Very low	30.6	Very low	86 Å²	86	126.1 Å²	126.1	71%	0.711	79%	0.792	S	S	*	*			trans	-77.4	-166	-177.5	0	0	0	0	0	113.6
468	M	31.8	Very low	30.4	Very low	188 Å²	188	129.8 Å²	129.8	93%	0.926	80%	0.796	S	S	*	*			cis	-163.1	169.6	11.7	-147.5	-143.9	-60.9	0	0	111
469	G	27.2	Very low	30.2	Very low	70 Å²	70	127.6 Å²	127.6	72%	0.722	79%	0.793	S	S	*	*			trans	167.3	136.9	164.2	0	0	0	0	0	117
470	Q	33.9	Very low	30	Very low	171 Å²	171	128.8 Å²	128.8	80%	0.799	80%	0.796	S	S	*	*			trans	-118.8	-178.3	169.8	-63.1	-171.1	-21.8	0	0	110.8
471	P	51.4	Low	29.9	Very low	117 Å²	117	129 Å²	129	76%	0.76	79%	0.791	S	S	*	*				-148.8	147.1	88.3	35.9	-16.7	0	0	0	118.3
472	T	32.2	Very low	29.7	Very low	112 Å²	112	130.5 Å²	130.5	69%	0.687	79%	0.791	S	S	*	*			trans	10	156.3	138	62.2	0	0	0	0	121.8
473	S	32.6	Very low	29.6	Very low	101 Å²	101	133.1 Å²	133.1	71%	0.706	79%	0.786	S	S	*	*			cis	-176.2	163.2	-8	-87.6	0	0	0	0	108.3
474	K	27.7	Very low	29.3	Very low	190 Å²	190	134.4 Å²	134.4	83%	0.826	78%	0.783	S	S	*	*				174.6	142	87.3	-90.3	-175.1	178.3	178.2	0	114.2
475	V	26	Very low	29.5	Very low	120 Å²	120	135.4 Å²	135.4	73%	0.727	78%	0.777	S	S	*	*			trans	60	106.6	136.6	-176.7	0	0	0	0	120
476	T	25.4	Very low	29.9	Very low	115 Å²	115	137.1 Å²	137.1	71%	0.706	78%	0.781	S	S	*	*				68.4	125.3	89.6	-35.2	0	0	0	0	114.2
477	V	26.7	Very low	30.2	Very low	132 Å²	132	137.4 Å²	137.4	80%	0.8	78%	0.775	S	S	*	*				-151.9	153.5	55.3	170.4	0	0	0	0	109.3
478	R	23.9	Very low	30	Very low	233 Å²	233	142.1 Å²	142.1	88%	0.879	78%	0.782	S	S	*	*			cis	101.5	57	6.9	-155.3	-173.4	178.2	-105.7	2.9	119.6
479	G	25.3	Very low	29.7	Very low	76 Å²	76	138.4 Å²	138.4	78%	0.784	77%	0.774	S	S	*	*			trans	143.2	163.9	160.9	0	0	0	0	0	115.2
480	A	26.3	Very low	29.9	Very low	93 Å²	93	142.6 Å²	142.6	77%	0.769	78%	0.78	S	S	*	*			cis	-165.2	160.1	-17.5	0	0	0	0	0	112.2
481	H	25.8	Very low	29.7	Very low	177 Å²	177	139.9 Å²	139.9	82%	0.819	78%	0.78	S	S	*	*			trans	49.3	108.4	158.7	-75.2	-73.7	0	0	0	123.6
482	S	24.6	Very low	28.8	Very low	103 Å²	103	140.8 Å²	140.8	72%	0.72	78%	0.782	S	S	*	*				89.8	146.7	113.9	78.8	0	0	0	0	123.6
483	N	25	Very low	28.9	Very low	133 Å²	133	141.1 Å²	141.1	71%	0.711	78%	0.784	S	S	*	*			trans	109.8	140.8	130.2	-139.8	1	0	0	0	119.7
484	R	26	Very low	28.9	Very low	218 Å²	218	143.2 Å²	143.2	82%	0.823	79%	0.786	S	S	*	*			trans	48.3	128.1	156	-87.3	169.3	179.2	-159.3	-2.6	122.4
485	Q	35	Very low	29	Very low	174 Å²	174	140 Å²	140	81%	0.813	78%	0.783	S	S	*	*			trans	-71.2	156.1	139.4	-64.9	-148.8	-19.8	0	0	110.7
486	P	40.7	Very low	29.5	Very low	125 Å²	125	140.2 Å²	140.2	81%	0.812	78%	0.78	S	S	*	*				-142.7	-170.9	112.8	39.5	-25.6	0	0	0	114.6
487	I	35.7	Very low	29.9	Very low	151 Å²	151	143.5 Å²	143.5	77%	0.774	79%	0.785	S	S	*	*			trans	-107	146.2	-173.4	-60.9	155.8	0	0	0	110.3
488	E	26.5	Very low	30.4	Very low	186 Å²	186	141.5 Å²	141.5	87%	0.869	78%	0.782	S	S	*	*			trans	-179.5	163.7	152.5	-102.4	-176.9	169.9	0	0	109
489	C	26.9	Very low	30.7	Very low	110 Å²	110	135.1 Å²	135.1	74%	0.743	77%	0.773	S	S	*	*			cis	-161.4	-179.7	-43.4	-114.3	0	0	0	0	110.6
490	D	29.5	Very low	31.1	Very low	158 Å²	158	139.7 Å²	139.7	85%	0.845	77%	0.771	S	S	*	*			trans	-62.6	148.6	-159.3	-76.6	-72.2	0	0	0	120.6
491	S	31.4	Very low	31.3	Very low	114 Å²	114	141.1 Å²	141.1	80%	0.797	77%	0.766	S	S	*	*			trans	-166.5	146.1	140.4	49.3	0	0	0	0	111.2
492	V	31.9	Very low	31.7	Very low	135 Å²	135	136.3 Å²	136.3	82%	0.818	76%	0.757	S	S	*	*			cis	-161.4	159.7	-19.6	63.3	0	0	0	0	110.2
493	V	33.9	Very low	32.1	Very low	119 Å²	119	137.6 Å²	137.6	72%	0.721	76%	0.761	S	S	*	*			trans	-45.2	138	166.2	169.6	0	0	0	0	111
494	L	32.3	Very low	32.4	Very low	145 Å²	145	137.6 Å²	137.6	76%	0.759	77%	0.766	S	S	*	*				-107.2	-165.3	55.8	-79.4	97.9	0	0	0	114.1
495	T	30.7	Very low	32.7	Very low	123 Å²	123	131.7 Å²	131.7	76%	0.755	76%	0.763	S	S	*	*			cis	-150.4	-139.8	17.7	-34.9	0	0	0	0	113.6
496	N	36.1	Very low	32.4	Very low	125 Å²	125	128.2 Å²	128.2	67%	0.668	77%	0.765	S	S	*	*			trans	-143.4	149.5	-163.2	-77.4	-53.1	0	0	0	111.1
497	K	33.7	Very low	32.1	Very low	183 Å²	183	128.8 Å²	128.8	80%	0.796	77%	0.766	S	S	*	*			cis	-163.3	136.5	-3.6	-128.5	174.9	-175.3	-178.5	0	112.8
498	A	36.7	Very low	32.8	Very low	90 Å²	90	126.4 Å²	126.4	74%	0.744	76%	0.76	S	S	*	*			trans	56.8	156.9	143.8	0	0	0	0	0	120.4
499	S	30.6	Very low	33.1	Very low	99 Å²	99	123.6 Å²	123.6	69%	0.692	76%	0.756	S	S	*	*			cis	-153	146.5	17.6	-48.8	0	0	0	0	113.7
500	K	34.3	Very low	33.3	Very low	173 Å²	173	124.6 Å²	124.6	75%	0.752	76%	0.758	S	S	*	*			trans	57.5	146.8	133.2	-66.2	-175.3	151.8	-67.7	0	121
501	D	30.1	Very low	33.4	Very low	123 Å²	123	120.8 Å²	120.8	66%	0.658	75%	0.749	S	S	*	*			cis	-159.9	153.6	-2.9	-109.7	-19	0	0	0	112.7
502	A	33.3	Very low	33.3	Very low	76 Å²	76	121.7 Å²	121.7	63%	0.628	75%	0.75	S	S	*	*			trans	68.2	109.5	139	0	0	0	0	0	124.9
503	T	33.8	Very low	33.2	Very low	130 Å²	130	119.2 Å²	119.2	80%	0.798	74%	0.743	S	S	*	*				52.7	147.1	115.7	-0.6	0	0	0	0	120.7
504	T	32	Very low	32.9	Very low	133 Å²	133	119.8 Å²	119.8	82%	0.816	75%	0.747	S	S	*	*			cis	-153.3	164.1	24	-42.3	0	0	0	0	112.8
505	A	31.3	Very low	32.8	Very low	93 Å²	93	116.6 Å²	116.6	77%	0.769	74%	0.741	S	S	*	*			trans	-93.7	165.1	-178.3	0	0	0	0	0	114.9
506	A	29.7	Very low	32.7	Very low	102 Å²	102	115.9 Å²	115.9	84%	0.843	74%	0.737	S	S	*	*			trans	-171.2	116.2	136.9	0	0	0	0	0	113.6
507	T	33.1	Very low	32.5	Very low	137 Å²	137	118.6 Å²	118.6	84%	0.84	75%	0.746	S	S	*	*			trans	-87	-176.7	149.2	8.1	0	0	0	0	108.5
508	P	50.8	Low	32.8	Very low	100 Å²	100	116.1 Å²	116.1	65%	0.649	75%	0.746	S	S	*	*			cis	-150.6	-177	27.4	35.8	-10	0	0	0	118.8
509	T	32.8	Very low	33.1	Very low	128 Å²	128	118.2 Å²	118.2	79%	0.785	75%	0.752	S	S	*	*			trans	62.7	157.7	142	43.4	0	0	0	0	121.3
510	V	31.6	Very low	33.1	Very low	131 Å²	131	117.5 Å²	117.5	79%	0.794	75%	0.752	S	S	*	*			cis	-159.4	150.9	-23.3	100.8	0	0	0	0	106.4
511	A	30.7	Very low	32.8	Very low	77 Å²	77	115.8 Å²	115.8	64%	0.636	76%	0.756	S	S	*	*				179.3	141.9	90.3	0	0	0	0	0	113.6
512	T	29.7	Very low	32.9	Very low	134 Å²	134	115 Å²	115	82%	0.822	76%	0.76	S	S	*	*				27.1	143.5	128.4	-4.4	0	0	0	0	119.9
513	A	30.3	Very low	32.8	Very low	82 Å²	82	116.4 Å²	116.4	68%	0.678	77%	0.765	S	S	*	*			cis	-159.1	170.5	30	0	0	0	0	0	116.5
514	T	28.1	Very low	32.6	Very low	132 Å²	132	116.6 Å²	116.6	81%	0.81	77%	0.766	S	S	*	*			trans	-2.2	153.5	155.1	2.6	0	0	0	0	120.1
515	A	30	Very low	32.8	Very low	77 Å²	77	115.1 Å²	115.1	64%	0.636	76%	0.761	S	S	*	*			cis	-160.2	141.5	22.2	0	0	0	0	0	117.4
516	T	29	Very low	32.6	Very low	109 Å²	109	117.2 Å²	117.2	67%	0.669	77%	0.765	S	S	*	*				53.4	134.8	128.1	62.8	0	0	0	0	125.9
517	H	31.4	Very low	33	Very low	182 Å²	182	118.7 Å²	118.7	84%	0.843	76%	0.763	S	S	*	*			trans	76.2	115.9	145.6	-65.2	-52	0	0	0	122.3
518	T	38.7	Very low	32.7	Very low	131 Å²	131	118.3 Å²	118.3	80%	0.804	76%	0.761	S	S	*	*			trans	-86.3	162.6	151	48.3	0	0	0	0	110.9
519	P	43.5	Very low	31.7	Very low	134 Å²	134	120 Å²	120	87%	0.87	77%	0.769	S	S	*	*				-139.7	-166.1	103.6	39.1	-25.8	0	0	0	113.6
520	A	31.1	Very low	31.7	Very low	83 Å²	83	119.9 Å²	119.9	69%	0.686	77%	0.768	S	S	*	*			trans	-130.9	-161.9	-172.4	0	0	0	0	0	112.6
521	T	28.3	Very low	31.9	Very low	137 Å²	137	118.3 Å²	118.3	84%	0.84	77%	0.769	S	S	*	*			trans	80.8	150.9	174	76.4	0	0	0	0	115.7
522	S	30.8	Very low	31.8	Very low	106 Å²	106	119.7 Å²	119.7	74%	0.741	78%	0.78	S	S	*	*			cis	-168.2	-169.3	-10.5	45.4	0	0	0	0	111.8
523	S	31.5	Very low	32.1	Very low	106 Å²	106	117.8 Å²	117.8	74%	0.741	78%	0.778	S	S	*	*			trans	84.7	134.7	173.4	78.2	0	0	0	0	117.3
524	V	31	Very low	33.2	Very low	135 Å²	135	119 Å²	119	82%	0.818	78%	0.779	S	S	*	*			cis	80.2	127.6	4.8	-171.9	0	0	0	0	116
525	S	34.6	Very low	33.2	Very low	102 Å²	102	120.3 Å²	120.3	71%	0.713	78%	0.781	S	S	*	*			cis	-173.1	175.8	-15.1	-92.9	0	0	0	0	109.3
526	T	28.9	Very low	33.3	Very low	137 Å²	137	122.3 Å²	122.3	84%	0.84	79%	0.79	S	S	*	*			trans	148	161.3	150.8	-61.9	0	0	0	0	112
527	V	36.1	Very low	33.4	Very low	133 Å²	133	121.9 Å²	121.9	81%	0.806	80%	0.798	S	S	*	*			trans	-145.2	149.3	-167.6	174.5	0	0	0	0	113.4
528	T	28.3	Very low	33.4	Very low	129 Å²	129	117.6 Å²	117.6	79%	0.791	79%	0.788	S	S	*	*			trans	-153.8	152.4	177.8	45.2	0	0	0	0	110
529	V	30.1	Very low	32.8	Very low	135 Å²	135	118 Å²	118	82%	0.818	79%	0.786	S	S	*	*			cis	-159.4	-149.2	-12.5	64.6	0	0	0	0	108.1
530	T	32.3	Very low	32.2	Very low	126 Å²	126	115.8 Å²	115.8	77%	0.773	77%	0.773	S	S	*	*			trans	-139.1	156.4	-169.6	51.5	0	0	0	0	114.6
531	A	35.1	Very low	32	Very low	97 Å²	97	118 Å²	118	80%	0.802	78%	0.778	S	S	*	*				153.2	151.9	113.3	0	0	0	0	0	117.7
532	A	29.3	Very low	32.2	Very low	106 Å²	106	116.2 Å²	116.2	88%	0.876	77%	0.771	S	S	*	*			trans	81.8	158.6	147.5	0	0	0	0	0	123.8
533	A	35.1	Very low	32.3	Very low	94 Å²	94	122.5 Å²	122.5	78%	0.777	78%	0.778	S	S	*	*			trans	-143.6	-168.7	178.5	0	0	0	0	0	107.5
534	P	53.3	Low	32.5	Very low	109 Å²	109	121.6 Å²	121.6	71%	0.708	77%	0.772	S	S	*	*			cis	-138.3	-165.1	6.4	44.8	-25.1	0	0	0	115
535	N	28.2	Very low	32.4	Very low	159 Å²	159	123 Å²	123	85%	0.85	77%	0.774	S	S	*	*			trans	171.5	175.2	136	-89.5	-20	0	0	0	114.7
536	S	32.2	Very low	32.3	Very low	118 Å²	118	122.2 Å²	122.2	83%	0.825	77%	0.774	S	S	*	*			trans	-142.5	169.5	-164.5	-55.3	0	0	0	0	114.5
537	A	31.6	Very low	32.2	Very low	100 Å²	100	127.3 Å²	127.3	83%	0.826	78%	0.778	S	S	*	*			trans	69	159.7	166.5	0	0	0	0	0	117.8
538	S	31.8	Very low	32.1	Very low	93 Å²	93	126.1 Å²	126.1	65%	0.65	78%	0.775	S	S	*	*			cis	-163.4	177.8	-28.1	61.1	0	0	0	0	110.4
539	D	26.4	Very low	33.3	Very low	140 Å²	140	125.2 Å²	125.2	75%	0.749	77%	0.771	S	S	*	*			trans	66	174.2	156.8	-73.1	-72	0	0	0	120.9
540	S	31	Very low	33.3	Very low	87 Å²	87	126.4 Å²	126.4	61%	0.608	77%	0.771	S	S	*	*				-165.8	-172.3	-64.8	57.2	0	0	0	0	110.5
541	V	26.6	Very low	33.5	Very low	129 Å²	129	125.5 Å²	125.5	78%	0.782	77%	0.77	S	S	*	*			trans	74.6	158.3	170.1	-163.2	0	0	0	0	116.3
542	S	32.5	Very low	33.5	Very low	99 Å²	99	125.5 Å²	125.5	69%	0.692	76%	0.764	S	S	*	*				-172.2	173.8	-63.9	-87.4	0	0	0	0	110.7
543	R	32.4	Very low	33.7	Very low	238 Å²	238	125.6 Å²	125.6	90%	0.898	75%	0.754	S	S	*	*			trans	75.3	155.2	157.6	-71.1	-177.8	-170	-153	2.1	118.8
544	S	35.3	Very low	33.7	Very low	87 Å²	87	129 Å²	129	61%	0.608	76%	0.759	S	S	*	*			cis	-176.8	174.4	-25.9	53.4	0	0	0	0	111.8
545	L	29.4	Very low	32.8	Very low	165 Å²	165	128.1 Å²	128.1	86%	0.864	76%	0.761	S	S	*	*			trans	86.3	150.6	164.1	-52.7	171.2	0	0	0	117.8
546	A	32.6	Very low	32.9	Very low	85 Å²	85	131.2 Å²	131.2	70%	0.702	76%	0.76	S	S	*	*			cis	-172.1	164.1	-27.1	0	0	0	0	0	112.9
547	R	27.6	Very low	32.9	Very low	245 Å²	245	131 Å²	131	93%	0.925	76%	0.759	S	S	*	*			trans	95	144.2	145.7	-145.9	174.4	-171	-165.7	1.6	120.1
548	S	32.4	Very low	32.6	Very low	107 Å²	107	129.5 Å²	129.5	75%	0.748	75%	0.753	S	S	*	*			trans	-115.8	-156.2	-174.6	-33.3	0	0	0	0	109.9
549	P	54.5	Low	32.6	Very low	110 Å²	110	132.4 Å²	132.4	71%	0.714	77%	0.767	S	S	*	*			cis	-141.3	-175.3	-3.7	29.4	-3.7	0	0	0	116.5
550	I	30.7	Very low	32.6	Very low	160 Å²	160	129 Å²	129	82%	0.821	77%	0.765	S	S	*	*				160	147.8	124.6	-79.5	163.3	0	0	0	114.2
551	S	35.3	Very low	32.5	Very low	107 Å²	107	131.1 Å²	131.1	75%	0.748	78%	0.78	S	S	*	*			trans	-52.4	172	-178	-54.3	0	0	0	0	119.7
552	S	35.1	Very low	32.8	Very low	97 Å²	97	130.1 Å²	130.1	68%	0.678	78%	0.778	S	S	*	*			cis	-170.2	-155.1	-18.5	51.1	0	0	0	0	108.8
553	T	33.8	Very low	32.7	Very low	108 Å²	108	131 Å²	131	66%	0.663	79%	0.785	S	S	*	*			cis	-170.4	160	8.9	-9.6	0	0	0	0	111.2
554	L	35.3	Very low	32.7	Very low	166 Å²	166	126.4 Å²	126.4	87%	0.869	78%	0.783	S	S	*	*			trans	54.6	142.8	153.3	-68.4	151.5	0	0	0	120.4
555	A	34.4	Very low	32.3	Very low	91 Å²	91	127.4 Å²	127.4	75%	0.752	80%	0.797	S	S	*	*			cis	-169.3	-160.4	-12.6	0	0	0	0	0	107.6
556	R	30.9	Very low	32.4	Very low	224 Å²	224	131.1 Å²	131.1	85%	0.845	80%	0.799	S	S	*	*			cis	-167.9	138.4	-4.1	164.2	176.9	173.3	-171.3	-2.1	110.1
557	S	31.3	Very low	32.2	Very low	113 Å²	113	133.1 Å²	133.1	79%	0.79	81%	0.808	S	S	*	*			trans	51.7	146.2	157.9	-55.6	0	0	0	0	122.1
558	G	26.4	Very low	32.3	Very low	68 Å²	68	127.5 Å²	127.5	70%	0.701	80%	0.8	S	S	*	*			cis	169.9	151.6	-9.9	0	0	0	0	0	115.2
559	T	30.2	Very low	32	Very low	155 Å²	155	129.9 Å²	129.9	95%	0.951	80%	0.804	S	S	*	*			trans	37.3	139.3	152.5	56.1	0	0	0	0	122.9
560	G	26.8	Very low	31.1	Very low	68 Å²	68	130.1 Å²	130.1	70%	0.701	81%	0.805	S	S	*	*			cis	158	160.3	-4.7	0	0	0	0	0	113.9
561	S	30	Very low	31.6	Very low	132 Å²	132	128.1 Å²	128.1	92%	0.923	80%	0.803	S	S	*	*			trans	58.1	164.4	165.5	-63.2	0	0	0	0	120.6
562	S	31.4	Very low	31.3	Very low	107 Å²	107	131.8 Å²	131.8	75%	0.748	81%	0.81	S	S	*	*			cis	-179.3	145.6	-36.6	-178.3	0	0	0	0	109.8
563	S	31	Very low	31.2	Very low	118 Å²	118	133.6 Å²	133.6	83%	0.825	82%	0.818	S	S	*	*			trans	124	147	151.4	80.3	0	0	0	0	120.9
564	T	32	Very low	31.7	Very low	141 Å²	141	134.1 Å²	134.1	87%	0.865	82%	0.823	S	S	*	*			trans	-77.5	158.7	-162.4	49.1	0	0	0	0	120.1
565	A	28.1	Very low	31.3	Very low	108 Å²	108	133.1 Å²	133.1	89%	0.893	82%	0.824	S	S	*	*			trans	-162	168.9	143.8	0	0	0	0	0	114.1
566	R	30.4	Very low	31.1	Very low	244 Å²	244	133.4 Å²	133.4	92%	0.921	82%	0.82	S	S	*	*			trans	-123.2	157.1	-178.8	-72.6	175.8	166.5	-179.1	-3.6	113
567	S	28.4	Very low	31.1	Very low	126 Å²	126	127.6 Å²	127.6	88%	0.881	81%	0.814	S	S	*	*			trans	-166.4	175.2	145.6	37.6	0	0	0	0	112.5
568	V	29.6	Very low	31.1	Very low	127 Å²	127	133.6 Å²	133.6	77%	0.77	82%	0.819	S	S	*	*			trans	-148.9	162.6	-155.3	-160.9	0	0	0	0	113.9
569	L	26.3	Very low	31.1	Very low	158 Å²	158	140 Å²	140	83%	0.827	82%	0.824	S	S	*	*			trans	85.6	160.3	167.3	-54.7	176.7	0	0	0	116.9
570	P	36.8	Very low	31.2	Very low	114 Å²	114	144.4 Å²	144.4	74%	0.74	82%	0.823	S	S	*	*			cis	-125.5	178.3	-2.5	41.8	-27.3	0	0	0	115.1
571	P	40.3	Very low	31.3	Very low	119 Å²	119	147.6 Å²	147.6	77%	0.773	82%	0.824	S	S	*	*			trans	-97.3	161	174.7	37.5	-34.3	0	0	0	114.6
572	M	29	Very low	31.4	Very low	183 Å²	183	152.5 Å²	152.5	90%	0.901	82%	0.822	S	S	*	*			trans	-136.3	160.1	171.8	-67.9	-166.2	74.4	0	0	112.7
573	T	32.4	Very low	31.3	Very low	135 Å²	135	155 Å²	155	83%	0.828	83%	0.827	S	S	*	*			trans	-122	-177	-176.5	72.2	0	0	0	0	110.3
574	P	44.6	Very low	31.5	Very low	119 Å²	119	154.7 Å²	154.7	77%	0.773	83%	0.825	S	S	*	*				-113.4	160.3	-124	19.8	4	0	0	0	115.6
575	T	27.8	Very low	31.4	Very low	145 Å²	145	151.7 Å²	151.7	89%	0.89	82%	0.822	S	S	*	*			trans	-139.5	160.1	168.1	-58.5	0	0	0	0	110.1
576	S	29.4	Very low	31.7	Very low	97 Å²	97	153.4 Å²	153.4	68%	0.678	82%	0.822	S	S	*	*			trans	-78.8	165.1	-161	60.1	0	0	0	0	117.2
577	S	30.1	Very low	31.8	Very low	102 Å²	102	147 Å²	147	71%	0.713	81%	0.814	S	S	*	*			trans	57.8	108.7	147.7	59	0	0	0	0	118.9
578	R	31.3	Very low	32.1	Very low	240 Å²	240	152.6 Å²	152.6	91%	0.906	82%	0.816	S	S	*	*			trans	-132.7	137.1	136	-70	-163.2	178.5	-172.1	-0.3	111.1
579	Y	27.7	Very low	32.2	Very low	202 Å²	202	152.4 Å²	152.4	79%	0.792	82%	0.821	S	S	*	*			trans	-80	148.7	171.7	-167	-106.5	0	0	0	108.2	D581	Y579-D581 WeakPolarHBondContact CD1-OD2 3.42Å; Y579-D581 WeakPolarHBondContact CE1-OD1 3.45Å
580	W	32.3	Very low	32.6	Very low	248 Å²	248	150.2 Å²	150.2	94%	0.939	82%	0.819	S	S	*	*			trans	-104.3	82.9	176.8	-68	101.2	0	0	0	109.9
581	D	27.8	Very low	32.4	Very low	134 Å²	134	153.4 Å²	153.4	72%	0.717	83%	0.827	S	S	*	*			trans	-68.6	144.5	162.4	-79.1	-59.1	0	0	0	110.2	Y579	Y579-D581 WeakPolarHBondContact CD1-OD2 3.42Å; Y579-D581 WeakPolarHBondContact CE1-OD1 3.45Å
582	R	32.7	Very low	32	Very low	236 Å²	236	150.4 Å²	150.4	89%	0.891	82%	0.818	S	S	*	*			trans	-135.7	106.6	175.6	-178.6	176.9	177.1	173.3	-0.7	109.3
583	D	29	Very low	32.1	Very low	158 Å²	158	148.3 Å²	148.3	85%	0.845	82%	0.816	S	S	*	*			trans	-57.3	141	178.9	-77.2	-62.5	0	0	0	113.3
584	S	35.1	Very low	32.2	Very low	113 Å²	113	147.8 Å²	147.8	79%	0.79	82%	0.817	S	S	*	*			trans	-158	90.7	158.5	-74.9	0	0	0	0	107.6
585	G	29.7	Very low	31.8	Very low	77 Å²	77	147.8 Å²	147.8	79%	0.794	82%	0.82	S	S	*	*			trans	-78.8	150	-172.3	0	0	0	0	0	114
586	T	34.6	Very low	31.9	Very low	145 Å²	145	145.8 Å²	145.8	89%	0.89	82%	0.819	S	S	*	*			trans	-143.3	156.4	165.5	-31.4	0	0	0	0	110.6
587	S	33.4	Very low	32.1	Very low	109 Å²	109	149.1 Å²	149.1	76%	0.762	83%	0.828	S	S	*	*			trans	-69.8	126.2	-157.2	-61	0	0	0	0	117.3
588	R	33.8	Very low	32.1	Very low	243 Å²	243	152.2 Å²	152.2	92%	0.917	84%	0.837	S	S	*	*			trans	-23.1	129.1	142.7	46.5	177.8	168.6	-175.5	-5.3	116.5
589	S	32.2	Very low	32.1	Very low	124 Å²	124	146 Å²	146	87%	0.867	83%	0.83	S	S	*	*			trans	-154.5	139.5	150	58.8	0	0	0	0	109.6
590	S	34.5	Very low	32.3	Very low	112 Å²	112	141.8 Å²	141.8	78%	0.783	83%	0.83	S	S	*	*			trans	-127.3	130.2	-164.9	55.8	0	0	0	0	114.4
591	I	33.5	Very low	32.5	Very low	181 Å²	181	135 Å²	135	93%	0.928	82%	0.821	S	S	*	*			trans	-171.5	148.6	161.1	-92.7	140.5	0	0	0	105.4
592	G	30.6	Very low	32.9	Very low	56 Å²	56	136.8 Å²	136.8	58%	0.577	83%	0.829	S	S	*	*			cis	164	92	-6.8	0	0	0	0	0	112.6
593	T	32.3	Very low	33	Very low	138 Å²	138	135.6 Å²	135.6	85%	0.847	83%	0.83	S	S	*	*			trans	53.6	140.7	158.1	7.5	0	0	0	0	123
594	S	33	Very low	33.3	Very low	124 Å²	124	136.1 Å²	136.1	87%	0.867	83%	0.827	S	S	*	*			trans	88.3	163.5	144.3	81	0	0	0	0	119.7
595	S	36	Very low	33.2	Very low	119 Å²	119	138.8 Å²	138.8	83%	0.832	83%	0.833	S	S	*	*			trans	-133.4	141	-157.5	55	0	0	0	0	112.1
596	A	31.7	Very low	33.5	Very low	104 Å²	104	139.7 Å²	139.7	86%	0.86	83%	0.827	S	S	*	*			trans	-146.4	156.6	165	0	0	0	0	0	111.4
597	L	33	Very low	33.6	Very low	167 Å²	167	140.2 Å²	140.2	87%	0.874	82%	0.824	S	S	*	*			trans	-93.9	143.9	178.6	-64	154.9	0	0	0	110.2
598	N	28.9	Very low	34.2	Very low	167 Å²	167	142.5 Å²	142.5	89%	0.893	83%	0.828	S	S	*	*				-168.5	156.1	121.4	-116.3	-25.1	0	0	0	114.1
599	S	31.9	Very low	34.6	Very low	110 Å²	110	133.3 Å²	133.3	77%	0.769	81%	0.809	S	S	*	*			trans	-110	140.3	170.1	-61.7	0	0	0	0	110.1
600	S	33.4	Very low	35.1	Very low	112 Å²	112	138.7 Å²	138.7	78%	0.783	81%	0.812	S	S	*	*			trans	-173.5	148.7	146.4	32.8	0	0	0	0	114.5
601	S	34.4	Very low	35.6	Very low	107 Å²	107	142.6 Å²	142.6	75%	0.748	82%	0.815	S	S	*	*			trans	57.3	85.1	145.6	-57.4	0	0	0	0	120.6
602	L	37	Very low	36.3	Very low	170 Å²	170	140.6 Å²	140.6	89%	0.89	81%	0.811	S	S	*	*				29.6	117.4	116.4	-59.1	173.2	0	0	0	118.6
603	K	34.2	Very low	36.9	Very low	211 Å²	211	141.7 Å²	141.7	92%	0.917	82%	0.815	S	S	*	*			trans	-156.5	133	130.1	-113.2	164.7	-173	176.9	0	111.4
604	H	35.7	Very low	37.4	Very low	169 Å²	169	138.7 Å²	138.7	78%	0.782	80%	0.799	S	S	*	*			trans	-69.5	144	163.2	-98.4	-94.8	0	0	0	109.5
605	N	33.2	Very low	37.6	Very low	169 Å²	169	137 Å²	137	90%	0.904	79%	0.788	S	S	*	*				-149.8	144.5	126.7	-105.7	-10.8	0	0	0	108.8
606	S	36.6	Very low	37.7	Very low	97 Å²	97	135 Å²	135	68%	0.678	77%	0.774	S	S	*	*			trans	-95.5	142.3	-176.7	-51	0	0	0	0	110.6
607	D	36.8	Very low	38.3	Very low	155 Å²	155	139.3 Å²	139.3	83%	0.829	77%	0.768	S	S	*	*			trans	-144	89.3	163.6	-169.6	29.3	0	0	0	109.9	G609	D607-G609 VanDerWaalsContact C-N 3.32Å; D607-G609 PolarHBondContact O-N 3.27Å; D607-G609 VanDerWaalsContact O-N 3.09Å
608	D	44.6	Very low	38.9	Very low	158 Å²	158	135.3 Å²	135.3	85%	0.845	75%	0.747	S	S	*	*			trans	-81.8	75.1	178	-89.8	-64.2	0	0	0	110.3
609	G	43.6	Very low	39.8	Very low	50 Å²	50	135.6 Å²	135.6	52%	0.515	74%	0.743	S	S	.	*			trans	-100.6	-26	-168.1	0	0	0	0	0	118.2	D607	D607-G609 VanDerWaalsContact C-N 3.32Å; D607-G609 PolarHBondContact O-N 3.27Å; D607-G609 VanDerWaalsContact O-N 3.09Å
610	Y	43	Very low	41	Very low	237 Å²	237	137.2 Å²	137.2	93%	0.929	74%	0.737	S	S	*	*			trans	-144.8	84.7	-170	-97.8	-84.6	0	0	0	114.6
611	K	45.1	Very low	42.4	Very low	194 Å²	194	133 Å²	133	84%	0.843	71%	0.707	S	S	*	*			trans	-138.7	49.3	172	-89.4	-169.2	176.6	173.6	0	114.5
612	T	48.2	Very low	44.9	Very low	138 Å²	138	130.8 Å²	130.8	85%	0.847	69%	0.685	S	S	*	*	S	Bend	trans	-136.9	50.6	177.5	-31.2	0	0	0	0	113.2
613	A	43.5	Very low	47.2	Very low	80 Å²	80	122.7 Å²	122.7	66%	0.661	64%	0.643	S	S	*	*	S	Bend	trans	-145.2	-16	177.8	0	0	0	0	0	116.5
614	S	41.3	Very low	50.1	Low	74 Å²	74	114.4 Å²	114.4	52%	0.517	61%	0.608	S	S	.	*	S	Bend	trans	-85.2	-32.1	-176.6	62.5	0	0	0	0	114.4	S616 R617	S614-S616 PolarHBondContact O-N 2.88Å; S614-R617 WeakPolarHBondContact O-CB 3.18Å; S614-R617 PolarHBondContact O-N 2.98Å
615	S	37.1	Very low	53	Low	89 Å²	89	106.4 Å²	106.4	62%	0.622	57%	0.571	S	S	*	*	H	α-helix	trans	-61.1	-15.6	-170.2	52.2	0	0	0	0	115.4
616	S	38.5	Very low	56	Low	77 Å²	77	98.3 Å²	98.3	54%	0.538	53%	0.528	S	S	.	.	H	α-helix	trans	-87.4	0.6	172.7	68.6	0	0	0	0	114.4	S614 K620	S614-S616 PolarHBondContact O-N 2.88Å; S616-K620 WeakPolarHBondContact O-CE 3.15Å; S616-K620 PolarHBondContact O-NZ 2.79Å
617	R	45.3	Very low	59	Low	194 Å²	194	93.7 Å²	93.7	73%	0.732	50%	0.496	S	S	*	.	H	α-helix	trans	-105.7	-33.6	172.6	-67.6	-172.9	173.8	-167.1	-2.2	112.8	S614 E619 K620	S614-R617 WeakPolarHBondContact O-CB 3.18Å; S614-R617 PolarHBondContact O-N 2.98Å; R617-E619 PolarHBondContact O-N 3.5Å; R617-K620 WeakPolarHBondContact O-CB 3.47Å; R617-K620 PolarHBondContact O-N 3.16Å; R617-K620 VanDerWaalsContact O-N 3.09Å
618	D	44.3	Very low	61.9	Low	84 Å²	84	92.4 Å²	92.4	45%	0.449	48%	0.479	S	S	.	.	H	α-helix	trans	-68.7	-33.5	-167.5	-58.1	-39.6	0	0	0	113.6	K620 S621	D618-K620 PolarHBondContact O-N 2.84Å; D618-S621 PolarHBondContact O-OG 3.18Å
619	E	48.7	Very low	64.4	Low	172 Å²	172	87.3 Å²	87.3	80%	0.804	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-9.5	172.5	-72.8	-166	139.7	0	0	114.6	R617	R617-E619 PolarHBondContact O-N 3.5Å
620	K	55.8	Low	66.9	Low	145 Å²	145	86.2 Å²	86.2	63%	0.63	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	16.6	-174.7	-65.1	165.5	179	150.4	0	113.5	S616 R617 D618	S616-K620 WeakPolarHBondContact O-CE 3.15Å; S616-K620 PolarHBondContact O-NZ 2.79Å; R617-K620 WeakPolarHBondContact O-CB 3.47Å; R617-K620 PolarHBondContact O-N 3.16Å; R617-K620 VanDerWaalsContact O-N 3.09Å; D618-K620 PolarHBondContact O-N 2.84Å
621	S	64.4	Low	69.3	Low	23 Å²	23	76.5 Å²	76.5	16%	0.161	41%	0.406	C	S	.	.			trans	-120.2	-17.1	-171	68.1	0	0	0	0	116.5	D618	D618-S621 PolarHBondContact O-OG 3.18Å
622	E	85.8	Confident	71.7	Confident	60 Å²	60	70.4 Å²	70.4	28%	0.28	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	146.1	177	-63.3	-160.8	152.5	0	0	111.7	L624 R654 W681 A683 H914	E622-L624 PolarHBondContact O-N 2.86Å; E622-R654 IonicContact OE1-NH2 3.97Å; E622-R654 PolarHBondContact OE1-NH2 2.59Å; E622-R654 IonicContact OE2-CZ 3.78Å; E622-R654 IonicContact OE2-NH1 3.74Å; E622-R654 PolarHBondContact OE2-NH1 3.14Å; E622-R654 IonicContact OE2-NH2 2.75Å; E622-R654 PolarHBondContact OE2-NH2 2.88Å; E622-W681 HydrophobicContact CB-CE3 4.06Å; E622-A683 HydrophobicContact CG-CB 4.28Å; E622-H914 PolarHBondContact O-NE2 3.15Å; E622-H914 VanDerWaalsContact O-NE2 3.15Å
623	G	86.6	Confident	74.1	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.01	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	-17	176.5	0	0	0	0	0	115.2	C625 M680	G623-C625 PolarHBondContact O-N 3.33Å; G623-M680 WeakPolarHBondContact CA-O 3.25Å; G623-M680 PolarHBondContact N-O 3.18Å
624	L	94.3	Very high	76.7	Confident	37 Å²	37	60.2 Å²	60.2	19%	0.194	31%	0.312	C	S	.	.			trans	-81.1	52.7	173.1	-60.7	-178.6	0	0	0	111.6	E622 H921 F923 V928	E622-L624 PolarHBondContact O-N 2.86Å; L624-H921 HydrophobicContact CD2-CB 4.45Å; L624-F923 HydrophobicContact CD2-CZ 4.26Å; L624-V928 HydrophobicContact CD2-CG1 4.48Å
625	C	96.1	Very high	79.3	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.29	C	S	.	.			trans	-114.3	125.9	-174.3	-177.7	0	0	0	0	111.8	G623 Q641 M680 V685	G623-C625 PolarHBondContact O-N 3.33Å; C625-Q641 PolarHBondContact O-NE2 2.94Å; C625-M680 HydrophobicContact CB-CB 4.2Å; C625-M680 HydrophobicContact CB-CG 4.37Å; C625-V685 VanDerWaalsContact CB-O 3.26Å; C625-V685 WeakPolarHBondContact CB-O 3.15Å; C625-V685 PolarHBondContact SG-O 2.89Å; C625-V685 VanDerWaalsContact SG-O 3.39Å
626	G	97.6	Very high	82.3	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	162.1	174.9	0	0	0	0	0	113.8	H686 T687 V688 D925	G626-H686 PolarHBondContact N-O 2.83Å; G626-T687 CarbonylContact O-C 3.58Å; G626-T687 VanDerWaalsContact O-CA 3.31Å; G626-T687 WeakPolarHBondContact O-CA 3.35Å; G626-V688 PolarHBondContact O-N 2.83Å; G626-D925 CarbonylContact C-O 3.47Å; G626-D925 WeakPolarHBondContact CA-O 3.26Å
627	L	98.5	Very high	85.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	112.6	177.1	-68.3	175	0	0	0	111.1	N629 N637 I640 Q641 L676 M680 V688 P690 D925 N926	L627-N629 PolarHBondContact O-N 3.48Å; L627-N637 HydrophobicContact CB-CB 4.1Å; L627-N637 HydrophobicContact CD1-CB 4.32Å; L627-N637 PolarHBondContact O-ND2 3.38Å; L627-N637 VanDerWaalsContact O-ND2 3.15Å; L627-I640 HydrophobicContact CD1-CB 3.83Å; L627-I640 HydrophobicContact CD1-CD1 4.5Å; L627-I640 HydrophobicContact CD1-CG2 3.51Å; L627-Q641 HydrophobicContact CD1-CG 4.11Å; L627-L676 HydrophobicContact CD2-CD1 3.94Å; L627-L676 HydrophobicContact CD2-CD2 4.48Å; L627-M680 HydrophobicContact CD1-CE 4.13Å; L627-M680 HydrophobicContact CD1-SD 4.34Å; L627-M680 HydrophobicContact CD2-CE 4.25Å; L627-M680 HydrophobicContact CD2-CG 4.3Å; L627-M680 HydrophobicContact CD2-SD 3.85Å; L627-M680 HydrophobicContact CG-CE 4.18Å; L627-M680 HydrophobicContact CG-SD 4.38Å; L627-V688 WeakPolarHBondContact CA-O 3.17Å; L627-V688 HydrophobicContact CD2-CB 4.32Å; L627-P690 HydrophobicContact CB-CG 4.41Å; L627-P690 HydrophobicContact CD2-CB 4.43Å; L627-P690 HydrophobicContact CD2-CG 4.25Å; L627-D925 PolarHBondContact N-O 3.22Å; L627-D925 CarbonylContact O-C 2.92Å; L627-D925 WeakPolarHBondContact O-CA 3.44Å; L627-D925 WeakPolarHBondContact O-CB 3.43Å; L627-N926 PolarHBondContact O-N 2.83Å
628	R	98.2	Very high	87.7	Confident	127 Å²	127	40.6 Å²	40.6	48%	0.479	20%	0.202	S	C	.	.			trans	-58.6	127.9	179.7	-176.3	179.1	-64.2	-78.9	-0.4	111.4	I630 T687 V688 T689 N926	R628-I630 WeakPolarHBondContact O-CG1 3.39Å; R628-I630 PolarHBondContact O-N 3Å; R628-T687 HydrophobicContact CB-CG2 4.39Å; R628-V688 PolarHBondContact N-O 2.78Å; R628-T689 HydrophobicContact CB-CG2 4.14Å; R628-T689 WeakPolarHBondContact CB-OG1 3.33Å; R628-T689 HydrophobicContact CG-CG2 4.46Å; R628-N926 HydrophobicContact CB-CB 4.48Å
629	N	97.3	Very high	90.2	Very high	51 Å²	51	36.6 Å²	36.6	27%	0.273	18%	0.181	S	C	.	.			trans	-63.8	130.5	172.1	-160.6	-49.6	0	0	0	110.2	L627 G631 N632 T633 D925	L627-N629 PolarHBondContact O-N 3.48Å; N629-G631 PolarHBondContact OD1-N 3.16Å; N629-N632 PolarHBondContact OD1-N 3.36Å; N629-T633 PolarHBondContact OD1-N 2.88Å; N629-T633 VanDerWaalsContact OD1-N 3.07Å; N629-D925 HydrophobicContact CB-CB 4.14Å; N629-D925 WeakPolarHBondContact CB-OD2 3.4Å; N629-D925 PolarHBondContact ND2-OD2 3Å
630	I	95.3	Very high	92.6	Very high	27 Å²	27	28.4 Å²	28.4	14%	0.138	14%	0.143	C	C	.	.	S	Bend	trans	-111.6	37.2	-177.6	-33.9	-176.9	0	0	0	110.4	R628 T633 T689 P690 M691 Y707	R628-I630 WeakPolarHBondContact O-CG1 3.39Å; R628-I630 PolarHBondContact O-N 3Å; I630-T633 HydrophobicContact CB-CG2 3.96Å; I630-T633 PolarHBondContact N-OG1 2.99Å; I630-T689 HydrophobicContact CD1-CG2 3.87Å; I630-T689 HydrophobicContact CG1-CG2 4.18Å; I630-P690 HydrophobicContact CD1-CG 4.08Å; I630-M691 VanDerWaalsContact CD1-CA 3.47Å; I630-M691 HydrophobicContact CD1-CB 3.98Å; I630-M691 HydrophobicContact CD1-CE 4.3Å; I630-M691 HydrophobicContact CD1-SD 4.37Å; I630-M691 HydrophobicContact CG2-CE 4.02Å; I630-M691 HydrophobicContact CG2-SD 3.8Å; I630-Y707 WeakPolarHBondContact O-CD1 3.23Å; I630-Y707 VanDerWaalsContact O-CE1 3.31Å; I630-Y707 WeakPolarHBondContact O-CE1 3.45Å
631	G	93.6	Very high	94.7	Very high	33 Å²	33	21.6 Å²	21.6	34%	0.34	11%	0.113	S	C	.	.	S	Bend	trans	87.3	96.2	-175.3	0	0	0	0	0	111.7	N629 T633	N629-G631 PolarHBondContact OD1-N 3.16Å; G631-T633 PolarHBondContact O-N 2.78Å
632	N	96.3	Very high	96.3	Very high	66 Å²	66	20.5 Å²	20.5	35%	0.353	11%	0.105	S	C	.	.	S	Bend	trans	59	18.6	-179.6	-73.6	-47.3	0	0	0	115.6	N629 C634 F635 Y707 Q709	N629-N632 PolarHBondContact OD1-N 3.36Å; N632-C634 VanDerWaalsContact C-N 3.27Å; N632-C634 PolarHBondContact O-N 2.89Å; N632-F635 VanDerWaalsContact O-CD1 3.24Å; N632-F635 WeakPolarHBondContact O-CD1 3.48Å; N632-F635 VanDerWaalsContact O-CE1 3.26Å; N632-F635 WeakPolarHBondContact O-CE1 3.48Å; N632-Y707 WeakPolarHBondContact CB-O 3.28Å; N632-Y707 PolarHBondContact ND2-O 3.25Å; N632-Q709 HydrophobicContact CB-CG 3.65Å; N632-Q709 VanDerWaalsContact CG-CG 3.46Å; N632-Q709 VanDerWaalsContact OD1-CG 3.31Å; N632-Q709 WeakPolarHBondContact OD1-CG 3.4Å; N632-Q709 PolarHBondContact OD1-NE2 2.8Å
633	T	97.3	Very high	96.9	Very high	1 Å²	1	17.6 Å²	17.6	1%	0.006	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	14.2	-175.2	67.5	0	0	0	0	114.7	N629 I630 G631 F635 M636 N637 K694	N629-T633 PolarHBondContact OD1-N 2.88Å; N629-T633 VanDerWaalsContact OD1-N 3.07Å; I630-T633 HydrophobicContact CB-CG2 3.96Å; I630-T633 PolarHBondContact N-OG1 2.99Å; G631-T633 PolarHBondContact O-N 2.78Å; T633-F635 VanDerWaalsContact C-N 3.29Å; T633-F635 PolarHBondContact O-N 2.85Å; T633-M636 HydrophobicContact CG2-CE 4.49Å; T633-M636 WeakPolarHBondContact O-CB 3.11Å; T633-M636 PolarHBondContact O-N 2.87Å; T633-M636 VanDerWaalsContact O-N 3.15Å; T633-N637 PolarHBondContact O-N 2.82Å; T633-N637 PolarHBondContact OG1-ND2 3.11Å; T633-K694 HydrophobicContact CG2-CD 4.07Å
634	C	97.8	Very high	97.4	Very high	3 Å²	3	17.6 Å²	17.6	2%	0.02	9%	0.092	C	C	.	.	H	α-helix	trans	-63.8	-31.8	-176.1	52.4	0	0	0	0	113	N632 M636 N637 S638 H907	N632-C634 VanDerWaalsContact C-N 3.27Å; N632-C634 PolarHBondContact O-N 2.89Å; C634-M636 PolarHBondContact O-N 2.89Å; C634-N637 PolarHBondContact O-N 2.88Å; C634-S638 WeakPolarHBondContact O-CB 3.32Å; C634-S638 PolarHBondContact O-N 3.38Å; C634-H907 VanDerWaalsContact CB-CE1 3.42Å; C634-H907 WeakPolarHBondContact CB-CE1 3.31Å; C634-H907 WeakPolarHBondContact CB-ND1 3.38Å; C634-H907 PolarHBondContact SG-ND1 3.45Å
635	F	97.9	Very high	97.6	Very high	11 Å²	11	16.1 Å²	16.1	5%	0.048	8%	0.084	C	C	.	.	H	α-helix	trans	-56.3	-50.8	172	68.6	-86.5	0	0	0	110.8	N632 T633 S638 V639 Y704 Q710 A712 F715 Y908	N632-F635 VanDerWaalsContact O-CD1 3.24Å; N632-F635 WeakPolarHBondContact O-CD1 3.48Å; N632-F635 VanDerWaalsContact O-CE1 3.26Å; N632-F635 WeakPolarHBondContact O-CE1 3.48Å; T633-F635 VanDerWaalsContact C-N 3.29Å; T633-F635 PolarHBondContact O-N 2.85Å; F635-S638 PolarHBondContact O-N 3.1Å; F635-S638 PolarHBondContact O-OG 2.94Å; F635-V639 PolarHBondContact O-N 2.93Å; F635-Y704 HydrophobicContact CD2-CE1 4.5Å; F635-Y704 AromaticContact CE2-CD1 3.73Å; F635-Y704 HydrophobicContact CE2-CD1 3.73Å; F635-Y704 AromaticContact CE2-CE1 3.6Å; F635-Y704 HydrophobicContact CE2-CE1 3.6Å; F635-Y704 AromaticContact CZ-CD1 3.81Å; F635-Y704 HydrophobicContact CZ-CD1 3.81Å; F635-Y704 HydrophobicContact CZ-CE1 4.07Å; F635-Q710 HydrophobicContact CD1-CB 4.08Å; F635-Q710 HydrophobicContact CD2-CB 4.02Å; F635-Q710 HydrophobicContact CE1-CB 3.89Å; F635-Q710 HydrophobicContact CE1-CG 4.08Å; F635-Q710 HydrophobicContact CE2-CB 3.87Å; F635-Q710 HydrophobicContact CE2-CG 4.37Å; F635-Q710 HydrophobicContact CG-CB 4.16Å; F635-Q710 HydrophobicContact CZ-CB 3.81Å; F635-Q710 HydrophobicContact CZ-CG 3.92Å; F635-A712 HydrophobicContact CB-CB 4.2Å; F635-F715 HydrophobicContact CD2-CB 3.74Å; F635-F715 HydrophobicContact CD2-CD1 4.49Å; F635-F715 HydrophobicContact CD2-CD2 4.47Å; F635-F715 AromaticContact CD2-CG 3.97Å; F635-F715 HydrophobicContact CD2-CG 3.97Å; F635-F715 HydrophobicContact CE2-CB 3.92Å; F635-F715 AromaticContact CE2-CD2 3.96Å; F635-F715 HydrophobicContact CE2-CD2 3.96Å; F635-F715 AromaticContact CE2-CG 3.92Å; F635-F715 HydrophobicContact CE2-CG 3.92Å; F635-Y908 HydrophobicContact CB-CD2 3.66Å; F635-Y908 HydrophobicContact CB-CE2 3.71Å; F635-Y908 HydrophobicContact CB-CG 4.19Å
636	M	98.1	Very high	97.7	Very high	5 Å²	5	16.1 Å²	16.1	3%	0.025	8%	0.084	C	C	.	.	H	α-helix	trans	-62.2	-46.9	178	-179.4	-171.9	84.3	0	0	110.9	T633 C634 S638 V639 I640 P690 K694 F715	T633-M636 HydrophobicContact CG2-CE 4.49Å; T633-M636 WeakPolarHBondContact O-CB 3.11Å; T633-M636 PolarHBondContact O-N 2.87Å; T633-M636 VanDerWaalsContact O-N 3.15Å; C634-M636 PolarHBondContact O-N 2.89Å; M636-S638 PolarHBondContact O-N 2.81Å; M636-V639 PolarHBondContact O-N 3.49Å; M636-I640 HydrophobicContact CE-CD1 4.27Å; M636-I640 HydrophobicContact CG-CD1 3.7Å; M636-I640 HydrophobicContact CG-CG1 4.46Å; M636-I640 WeakPolarHBondContact O-CB 3.35Å; M636-I640 VanDerWaalsContact O-CG1 3.27Å; M636-I640 WeakPolarHBondContact O-CG1 3.44Å; M636-I640 PolarHBondContact O-N 3.04Å; M636-I640 HydrophobicContact SD-CD1 4.44Å; M636-P690 HydrophobicContact CE-CB 4.08Å; M636-P690 HydrophobicContact CE-CG 3.67Å; M636-K694 HydrophobicContact CE-CB 4.29Å; M636-K694 HydrophobicContact SD-CB 4.15Å; M636-K694 HydrophobicContact SD-CG 4.29Å; M636-F715 HydrophobicContact CB-CE1 4.26Å; M636-F715 HydrophobicContact CB-CE2 4.42Å; M636-F715 HydrophobicContact CB-CZ 4.25Å; M636-F715 HydrophobicContact CG-CE1 3.95Å; M636-F715 HydrophobicContact CG-CE2 3.89Å; M636-F715 HydrophobicContact CG-CZ 3.56Å
637	N	98.6	Very high	97.6	Very high	4 Å²	4	17.7 Å²	17.7	2%	0.021	9%	0.091	C	C	.	.	H	α-helix	trans	-60.2	-45.2	178.7	-68.4	-14.8	0	0	0	111.4	L627 T633 C634 V639 I640 Q641 D925	L627-N637 HydrophobicContact CB-CB 4.1Å; L627-N637 HydrophobicContact CD1-CB 4.32Å; L627-N637 PolarHBondContact O-ND2 3.38Å; L627-N637 VanDerWaalsContact O-ND2 3.15Å; T633-N637 PolarHBondContact O-N 2.82Å; T633-N637 PolarHBondContact OG1-ND2 3.11Å; C634-N637 PolarHBondContact O-N 2.88Å; N637-V639 VanDerWaalsContact C-N 3.34Å; N637-V639 PolarHBondContact O-N 3.41Å; N637-I640 PolarHBondContact O-N 2.89Å; N637-Q641 VanDerWaalsContact O-CG 3.25Å; N637-Q641 WeakPolarHBondContact O-CG 3.4Å; N637-Q641 PolarHBondContact O-N 2.77Å; N637-D925 PolarHBondContact ND2-OD1 3.02Å
638	S	98.6	Very high	97.4	Very high	2 Å²	2	20.7 Å²	20.7	1%	0.014	11%	0.105	C	C	.	.	H	α-helix	trans	-62.1	-40	179.3	78.3	0	0	0	0	112.6	C634 F635 M636 Q641 C642 S897 A910	C634-S638 WeakPolarHBondContact O-CB 3.32Å; C634-S638 PolarHBondContact O-N 3.38Å; F635-S638 PolarHBondContact O-N 3.1Å; F635-S638 PolarHBondContact O-OG 2.94Å; M636-S638 PolarHBondContact O-N 2.81Å; S638-Q641 PolarHBondContact O-N 3.08Å; S638-C642 PolarHBondContact O-N 3.36Å; S638-C642 VanDerWaalsContact O-N 3.09Å; S638-C642 PolarHBondContact O-SG 2.69Å; S638-S897 PolarHBondContact OG-OG 3.15Å; S638-A910 WeakPolarHBondContact O-CB 3.26Å
639	V	98.7	Very high	97.4	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-71.7	-41.8	178.9	169.2	0	0	0	0	111.6	F635 M636 N637 Q641 C642 L643 A712 F715 L716	F635-V639 PolarHBondContact O-N 2.93Å; M636-V639 PolarHBondContact O-N 3.49Å; N637-V639 VanDerWaalsContact C-N 3.34Å; N637-V639 PolarHBondContact O-N 3.41Å; V639-Q641 VanDerWaalsContact C-N 3.28Å; V639-Q641 PolarHBondContact O-N 3.41Å; V639-C642 PolarHBondContact O-N 2.7Å; V639-L643 HydrophobicContact CG1-CD1 3.92Å; V639-L643 HydrophobicContact CG1-CG 4.37Å; V639-L643 WeakPolarHBondContact O-CG 3.18Å; V639-L643 PolarHBondContact O-N 3.18Å; V639-A712 HydrophobicContact CG2-CB 3.97Å; V639-A712 WeakPolarHBondContact CG2-O 3.24Å; V639-F715 HydrophobicContact CB-CD1 3.73Å; V639-F715 HydrophobicContact CB-CE1 3.82Å; V639-F715 HydrophobicContact CG1-CD1 3.74Å; V639-F715 HydrophobicContact CG1-CE1 3.66Å; V639-F715 HydrophobicContact CG2-CD1 4.05Å; V639-L716 HydrophobicContact CG1-CB 3.96Å; V639-L716 HydrophobicContact CG1-CD1 3.71Å; V639-L716 HydrophobicContact CG1-CG 4.4Å; V639-L716 HydrophobicContact CG2-CB 4.3Å
640	I	98.6	Very high	97.4	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-59.1	-42.2	174	-69.5	167.3	0	0	0	110.2	L627 M636 N637 L643 S644 F673 L676 M680 L693	L627-I640 HydrophobicContact CD1-CB 3.83Å; L627-I640 HydrophobicContact CD1-CD1 4.5Å; L627-I640 HydrophobicContact CD1-CG2 3.51Å; M636-I640 HydrophobicContact CE-CD1 4.27Å; M636-I640 HydrophobicContact CG-CD1 3.7Å; M636-I640 HydrophobicContact CG-CG1 4.46Å; M636-I640 WeakPolarHBondContact O-CB 3.35Å; M636-I640 VanDerWaalsContact O-CG1 3.27Å; M636-I640 WeakPolarHBondContact O-CG1 3.44Å; M636-I640 PolarHBondContact O-N 3.04Å; M636-I640 HydrophobicContact SD-CD1 4.44Å; N637-I640 PolarHBondContact O-N 2.89Å; I640-L643 PolarHBondContact O-N 3.01Å; I640-S644 WeakPolarHBondContact O-CB 3.43Å; I640-S644 PolarHBondContact O-N 2.79Å; I640-F673 HydrophobicContact CG2-CE2 4.24Å; I640-L676 HydrophobicContact CD1-CD2 4.15Å; I640-L676 HydrophobicContact CG2-CD2 3.93Å; I640-M680 HydrophobicContact CG2-CE 4.49Å; I640-M680 HydrophobicContact CG2-SD 4.11Å; I640-L693 HydrophobicContact CD1-CD2 3.77Å; I640-L693 HydrophobicContact CG1-CD2 4.42Å
641	Q	98.5	Very high	97.4	Very high	2 Å²	2	18.1 Å²	18.1	1%	0.009	9%	0.091	C	C	.	.	H	α-helix	trans	-64.6	-41.1	177.9	-68.6	-70.1	13.2	0	0	112.8	C625 L627 N637 S638 V639 S644 H645 A910 F923	C625-Q641 PolarHBondContact O-NE2 2.94Å; L627-Q641 HydrophobicContact CD1-CG 4.11Å; N637-Q641 VanDerWaalsContact O-CG 3.25Å; N637-Q641 WeakPolarHBondContact O-CG 3.4Å; N637-Q641 PolarHBondContact O-N 2.77Å; S638-Q641 PolarHBondContact O-N 3.08Å; V639-Q641 VanDerWaalsContact C-N 3.28Å; V639-Q641 PolarHBondContact O-N 3.41Å; Q641-S644 WeakPolarHBondContact O-CB 3.34Å; Q641-S644 PolarHBondContact O-N 3.43Å; Q641-H645 PolarHBondContact O-N 3.01Å; Q641-H645 PolarHBondContact O-ND1 2.97Å; Q641-A910 HydrophobicContact CB-CB 3.67Å; Q641-F923 HydrophobicContact CB-CB 4.22Å; Q641-F923 HydrophobicContact CB-CG 4.37Å; Q641-F923 VanDerWaalsContact CD-CD1 3.41Å; Q641-F923 HydrophobicContact CG-CB 3.69Å; Q641-F923 HydrophobicContact CG-CD1 4.24Å; Q641-F923 HydrophobicContact CG-CG 4.04Å; Q641-F923 VanDerWaalsContact NE2-CD1 3.32Å
642	C	98.6	Very high	97.5	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.5	-47.5	174.8	-63.1	0	0	0	0	111.5	S638 V639 S644 H645 T646 A895 F946	S638-C642 PolarHBondContact O-N 3.36Å; S638-C642 VanDerWaalsContact O-N 3.09Å; S638-C642 PolarHBondContact O-SG 2.69Å; V639-C642 PolarHBondContact O-N 2.7Å; C642-S644 VanDerWaalsContact C-N 3.34Å; C642-S644 PolarHBondContact O-N 2.73Å; C642-H645 PolarHBondContact O-N 2.58Å; C642-H645 VanDerWaalsContact O-N 3.16Å; C642-T646 PolarHBondContact O-N 3.22Å; C642-A895 HydrophobicContact CB-CB 3.89Å; C642-F946 HydrophobicContact CB-CD1 4.29Å; C642-F946 HydrophobicContact CB-CD2 3.77Å; C642-F946 HydrophobicContact CB-CE1 4.04Å; C642-F946 HydrophobicContact CB-CE2 3.48Å; C642-F946 VanDerWaalsContact CB-CE2 3.48Å; C642-F946 HydrophobicContact CB-CG 4.18Å; C642-F946 HydrophobicContact CB-CZ 3.63Å
643	L	98.5	Very high	97.5	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-68.5	-31.2	178.6	-67.4	175.7	0	0	0	113.1	V639 I640 H645 T646 L649 F673 L716 F719 L720 F767 F946	V639-L643 HydrophobicContact CG1-CD1 3.92Å; V639-L643 HydrophobicContact CG1-CG 4.37Å; V639-L643 WeakPolarHBondContact O-CG 3.18Å; V639-L643 PolarHBondContact O-N 3.18Å; I640-L643 PolarHBondContact O-N 3.01Å; L643-H645 PolarHBondContact O-N 3.44Å; L643-T646 VanDerWaalsContact O-CB 3.29Å; L643-T646 WeakPolarHBondContact O-CB 3.28Å; L643-T646 PolarHBondContact O-N 3.28Å; L643-T646 VanDerWaalsContact O-N 3.08Å; L643-T646 PolarHBondContact O-OG1 2.75Å; L643-L649 HydrophobicContact CB-CD2 4.25Å; L643-L649 HydrophobicContact CD2-CD2 4.27Å; L643-F673 HydrophobicContact CB-CZ 4.15Å; L643-L716 HydrophobicContact CD1-CD1 3.99Å; L643-L716 HydrophobicContact CD2-CD1 4.13Å; L643-L716 HydrophobicContact CG-CD1 4.28Å; L643-F719 HydrophobicContact CD1-CD1 3.64Å; L643-F719 HydrophobicContact CD1-CE1 3.93Å; L643-L720 HydrophobicContact CD1-CD2 4.38Å; L643-L720 HydrophobicContact CD2-CD2 4.13Å; L643-F767 HydrophobicContact CD2-CE1 4.26Å; L643-F767 HydrophobicContact CD2-CE2 4.49Å; L643-F767 HydrophobicContact CD2-CZ 3.72Å; L643-F946 HydrophobicContact CD2-CE1 4.3Å
644	S	97.9	Very high	97.3	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.007	9%	0.087	C	C	.	.	H	α-helix	trans	-63	-26.9	172.6	-176.3	0	0	0	0	112.2	I640 Q641 C642 T650 I677 W681	I640-S644 WeakPolarHBondContact O-CB 3.43Å; I640-S644 PolarHBondContact O-N 2.79Å; Q641-S644 WeakPolarHBondContact O-CB 3.34Å; Q641-S644 PolarHBondContact O-N 3.43Å; C642-S644 VanDerWaalsContact C-N 3.34Å; C642-S644 PolarHBondContact O-N 2.73Å; S644-T650 VanDerWaalsContact C-OG1 3.31Å; S644-T650 PolarHBondContact O-OG1 2.99Å; S644-I677 WeakPolarHBondContact OG-CD1 3.34Å; S644-W681 WeakPolarHBondContact O-CZ2 3.34Å; S644-W681 PolarHBondContact O-NE1 3Å; S644-W681 PolarHBondContact OG-NE1 2.89Å
645	H	97.5	Very high	97	Very high	5 Å²	5	24.3 Å²	24.3	2%	0.023	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-4.8	174	-71	78.4	0	0	0	113.7	Q641 C642 L643 Q647 Y894 C912 F923	Q641-H645 PolarHBondContact O-N 3.01Å; Q641-H645 PolarHBondContact O-ND1 2.97Å; C642-H645 PolarHBondContact O-N 2.58Å; C642-H645 VanDerWaalsContact O-N 3.16Å; L643-H645 PolarHBondContact O-N 3.44Å; H645-Q647 PolarHBondContact O-N 2.76Å; H645-Y894 HydrophobicContact CB-CD2 4.14Å; H645-Y894 HydrophobicContact CB-CE2 4.34Å; H645-C912 HydrophobicContact CB-CB 4.1Å; H645-C912 VanDerWaalsContact CG-CB 3.47Å; H645-C912 WeakPolarHBondContact ND1-CB 3.49Å; H645-F923 AromaticContact CE1-CE2 3.75Å; H645-F923 AromaticContact CE1-CZ 3.47Å; H645-F923 VanDerWaalsContact CE1-CZ 3.47Å; H645-F923 WeakPolarHBondContact CE1-CZ 3.4Å; H645-F923 AromaticContact NE2-CZ 3.82Å
646	T	98	Very high	96.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.119	C	C	.	.			trans	-69.1	96.5	169.2	-52.1	0	0	0	0	109	C642 L643 E648 L649 T650 L766 F767 Y847 Y894	C642-T646 PolarHBondContact O-N 3.22Å; L643-T646 VanDerWaalsContact O-CB 3.29Å; L643-T646 WeakPolarHBondContact O-CB 3.28Å; L643-T646 PolarHBondContact O-N 3.28Å; L643-T646 VanDerWaalsContact O-N 3.08Å; L643-T646 PolarHBondContact O-OG1 2.75Å; T646-E648 VanDerWaalsContact C-N 3.33Å; T646-E648 PolarHBondContact O-N 2.8Å; T646-E648 VanDerWaalsContact O-N 3.13Å; T646-L649 HydrophobicContact CG2-CB 3.9Å; T646-L649 PolarHBondContact O-N 3.5Å; T646-L649 VanDerWaalsContact O-N 3.13Å; T646-T650 PolarHBondContact O-N 2.85Å; T646-L766 HydrophobicContact CG2-CD1 4.42Å; T646-F767 HydrophobicContact CG2-CE1 4.44Å; T646-F767 HydrophobicContact CG2-CZ 3.8Å; T646-Y847 HydrophobicContact CG2-CD1 3.94Å; T646-Y847 HydrophobicContact CG2-CD2 3.72Å; T646-Y847 HydrophobicContact CG2-CE1 3.81Å; T646-Y847 HydrophobicContact CG2-CE2 3.59Å; T646-Y847 HydrophobicContact CG2-CG 3.88Å; T646-Y894 PolarHBondContact OG1-OH 3.07Å
647	Q	94.9	Very high	95.5	Very high	34 Å²	34	32.6 Å²	32.6	16%	0.159	15%	0.151	C	C	.	.	H	α-helix	trans	-54.1	-43.6	-161.9	-50.9	-172.2	40.3	0	0	114.2	H645 R651 Y847 P915 E948	H645-Q647 PolarHBondContact O-N 2.76Å; Q647-R651 WeakPolarHBondContact O-CB 3.36Å; Q647-R651 VanDerWaalsContact O-CG 3.23Å; Q647-R651 WeakPolarHBondContact O-CG 3.23Å; Q647-R651 PolarHBondContact O-N 2.74Å; Q647-Y847 PolarHBondContact N-OH 2.85Å; Q647-P915 HydrophobicContact CG-CB 4.36Å; Q647-E948 PolarHBondContact NE2-OE1 3Å; Q647-E948 PolarHBondContact NE2-OE2 3.16Å
648	E	96.3	Very high	93.9	Very high	63 Å²	63	33.8 Å²	33.8	29%	0.294	16%	0.164	S	C	.	.	H	α-helix	trans	-76.9	-33.3	-176.7	-66.7	-174.7	175	0	0	113.6	T646 F652 L766 K846 Y847	T646-E648 VanDerWaalsContact C-N 3.33Å; T646-E648 PolarHBondContact O-N 2.8Å; T646-E648 VanDerWaalsContact O-N 3.13Å; E648-F652 PolarHBondContact O-N 3.49Å; E648-F652 VanDerWaalsContact O-N 3.07Å; E648-L766 HydrophobicContact CB-CD1 4.28Å; E648-L766 HydrophobicContact CB-CD2 4.13Å; E648-K846 WeakPolarHBondContact OE1-CE 3.43Å; E648-K846 IonicContact OE1-NZ 2.65Å; E648-K846 PolarHBondContact OE1-NZ 3.46Å; E648-K846 WeakPolarHBondContact OE2-CE 3.32Å; E648-K846 IonicContact OE2-NZ 3.14Å; E648-K846 PolarHBondContact OE2-NZ 2.96Å; E648-Y847 HydrophobicContact CB-CE2 4.34Å; E648-Y847 PolarHBondContact N-OH 3.34Å
649	L	97.1	Very high	92.2	Very high	1 Å²	1	37 Å²	37	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-62.8	-46.1	170.8	-178.9	61	0	0	0	110.1	L643 T646 F652 L653 F673 L766 F767	L643-L649 HydrophobicContact CB-CD2 4.25Å; L643-L649 HydrophobicContact CD2-CD2 4.27Å; T646-L649 HydrophobicContact CG2-CB 3.9Å; T646-L649 PolarHBondContact O-N 3.5Å; T646-L649 VanDerWaalsContact O-N 3.13Å; L649-F652 PolarHBondContact O-N 3.02Å; L649-L653 HydrophobicContact CD1-CD1 3.91Å; L649-L653 HydrophobicContact CD1-CG 4.29Å; L649-L653 HydrophobicContact CG-CD1 3.81Å; L649-L653 WeakPolarHBondContact O-CB 3.42Å; L649-L653 VanDerWaalsContact O-CG 3.25Å; L649-L653 WeakPolarHBondContact O-CG 3.43Å; L649-L653 PolarHBondContact O-N 3.03Å; L649-F673 HydrophobicContact CD2-CE1 4.3Å; L649-L766 HydrophobicContact CB-CD1 3.87Å; L649-F767 HydrophobicContact CD2-CE2 4.29Å; L649-F767 HydrophobicContact CD2-CZ 4.44Å
650	T	96.3	Very high	90.1	Very high	9 Å²	9	49.1 Å²	49.1	6%	0.055	23%	0.232	C	C	.	.	H	α-helix	trans	-67	-39.7	178.3	-71.8	0	0	0	0	112.9	S644 T646 F652 L653 R654 I677 W681	S644-T650 VanDerWaalsContact C-OG1 3.31Å; S644-T650 PolarHBondContact O-OG1 2.99Å; T646-T650 PolarHBondContact O-N 2.85Å; T650-F652 PolarHBondContact O-N 3.14Å; T650-L653 PolarHBondContact O-N 2.86Å; T650-R654 HydrophobicContact CG2-CG 4.37Å; T650-R654 WeakPolarHBondContact O-CB 3.45Å; T650-R654 WeakPolarHBondContact O-CG 3.48Å; T650-R654 PolarHBondContact O-N 3.46Å; T650-I677 HydrophobicContact CG2-CG2 3.96Å; T650-W681 HydrophobicContact CG2-CD2 4.13Å; T650-W681 HydrophobicContact CG2-CG 4.17Å; T650-W681 HydrophobicContact CG2-CZ2 4.4Å
651	R	95.6	Very high	88.2	Confident	141 Å²	141	52.6 Å²	52.6	53%	0.532	26%	0.257	S	S	.	.	H	α-helix	trans	-57.2	-48.2	172.1	-76.7	168.2	-172.3	124.5	10.8	111.4	Q647 S655	Q647-R651 WeakPolarHBondContact O-CB 3.36Å; Q647-R651 VanDerWaalsContact O-CG 3.23Å; Q647-R651 WeakPolarHBondContact O-CG 3.23Å; Q647-R651 PolarHBondContact O-N 2.74Å; R651-S655 PolarHBondContact O-N 2.61Å
652	F	96.1	Very high	86.8	Confident	61 Å²	61	55.8 Å²	55.8	27%	0.268	27%	0.273	S	S	.	.	H	α-helix	trans	-59.9	-51.1	175.7	172.1	-99.6	0	0	0	111.3	E648 L649 T650 R654 S655 H656 L727 L762	E648-F652 PolarHBondContact O-N 3.49Å; E648-F652 VanDerWaalsContact O-N 3.07Å; L649-F652 PolarHBondContact O-N 3.02Å; T650-F652 PolarHBondContact O-N 3.14Å; F652-R654 PolarHBondContact O-N 3.02Å; F652-S655 CarbonylContact O-C 3.2Å; F652-S655 PolarHBondContact O-N 2.96Å; F652-S655 PolarHBondContact O-OG 2.94Å; F652-H656 HydrophobicContact CE1-CB 4.32Å; F652-H656 AromaticContact CE1-ND1 3.95Å; F652-H656 AromaticContact CZ-ND1 3.55Å; F652-H656 WeakPolarHBondContact O-CB 3.25Å; F652-H656 PolarHBondContact O-N 2.72Å; F652-L727 HydrophobicContact CE1-CD1 3.87Å; F652-L727 HydrophobicContact CE1-CD2 3.87Å; F652-L727 HydrophobicContact CZ-CD1 4.34Å; F652-L727 HydrophobicContact CZ-CD2 3.66Å; F652-L762 HydrophobicContact CB-CD2 3.51Å; F652-L762 HydrophobicContact CD1-CD2 3.64Å; F652-L762 HydrophobicContact CD2-CD2 3.89Å; F652-L762 HydrophobicContact CE1-CD2 4.32Å; F652-L762 HydrophobicContact CG-CD2 3.39Å
653	L	95.6	Very high	85.8	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66.4	-33.6	-176.1	-69.3	171.6	0	0	0	113.7	L649 T650 S655 H656 L670 F673 A674 I677 Q678	L649-L653 HydrophobicContact CD1-CD1 3.91Å; L649-L653 HydrophobicContact CD1-CG 4.29Å; L649-L653 HydrophobicContact CG-CD1 3.81Å; L649-L653 WeakPolarHBondContact O-CB 3.42Å; L649-L653 VanDerWaalsContact O-CG 3.25Å; L649-L653 WeakPolarHBondContact O-CG 3.43Å; L649-L653 PolarHBondContact O-N 3.03Å; T650-L653 PolarHBondContact O-N 2.86Å; L653-S655 PolarHBondContact O-N 2.92Å; L653-H656 PolarHBondContact O-N 3.41Å; L653-H656 VanDerWaalsContact O-N 3.14Å; L653-L670 HydrophobicContact CD2-CD1 3.87Å; L653-F673 HydrophobicContact CD1-CD1 3.54Å; L653-F673 HydrophobicContact CD1-CE1 3.27Å; L653-F673 HydrophobicContact CD1-CG 4.4Å; L653-F673 HydrophobicContact CD1-CZ 3.92Å; L653-F673 HydrophobicContact CD2-CD1 4.41Å; L653-A674 HydrophobicContact CB-CB 4.49Å; L653-A674 HydrophobicContact CD2-CB 3.82Å; L653-I677 HydrophobicContact CB-CB 4.16Å; L653-I677 HydrophobicContact CB-CG1 4.45Å; L653-I677 HydrophobicContact CB-CG2 3.9Å; L653-I677 HydrophobicContact CD1-CG1 3.96Å; L653-Q678 PolarHBondContact O-NE2 2.92Å
654	R	94	Very high	85.4	Confident	94 Å²	94	62.9 Å²	62.9	36%	0.355	32%	0.32	S	S	.	.	H	α-helix	trans	-61.7	-31.3	171.2	-74.9	-176.3	82.6	171.4	5.4	112.3	E622 T650 F652 I677 W681	E622-R654 IonicContact OE1-NH2 3.97Å; E622-R654 PolarHBondContact OE1-NH2 2.59Å; E622-R654 IonicContact OE2-CZ 3.78Å; E622-R654 IonicContact OE2-NH1 3.74Å; E622-R654 PolarHBondContact OE2-NH1 3.14Å; E622-R654 IonicContact OE2-NH2 2.75Å; E622-R654 PolarHBondContact OE2-NH2 2.88Å; T650-R654 HydrophobicContact CG2-CG 4.37Å; T650-R654 WeakPolarHBondContact O-CB 3.45Å; T650-R654 WeakPolarHBondContact O-CG 3.48Å; T650-R654 PolarHBondContact O-N 3.46Å; F652-R654 PolarHBondContact O-N 3.02Å; R654-I677 HydrophobicContact CG-CG2 4.16Å; R654-W681 HydrophobicContact CG-CB 4.31Å; R654-W681 VanDerWaalsContact CZ-O 3.31Å; R654-W681 PolarHBondContact NH2-O 3.3Å
655	S	92	Very high	85.2	Confident	78 Å²	78	67.8 Å²	67.8	55%	0.545	34%	0.341	S	S	.	.	H	α-helix	trans	-88	-10.8	174.5	73.1	0	0	0	0	114.7	R651 F652 L653 H657	R651-S655 PolarHBondContact O-N 2.61Å; F652-S655 CarbonylContact O-C 3.2Å; F652-S655 PolarHBondContact O-N 2.96Å; F652-S655 PolarHBondContact O-OG 2.94Å; L653-S655 PolarHBondContact O-N 2.92Å; S655-H657 PolarHBondContact O-N 2.85Å
656	H	87.8	Confident	85.1	Confident	40 Å²	40	68.8 Å²	68.8	19%	0.185	35%	0.347	C	S	.	.			trans	-89.2	88.6	-172.1	-168.8	86.4	0	0	0	111.7	F652 L653 G658 A674 Q678	F652-H656 HydrophobicContact CE1-CB 4.32Å; F652-H656 AromaticContact CE1-ND1 3.95Å; F652-H656 AromaticContact CZ-ND1 3.55Å; F652-H656 WeakPolarHBondContact O-CB 3.25Å; F652-H656 PolarHBondContact O-N 2.72Å; L653-H656 PolarHBondContact O-N 3.41Å; L653-H656 VanDerWaalsContact O-N 3.14Å; H656-G658 PolarHBondContact O-N 2.74Å; H656-A674 HydrophobicContact CB-CB 4.24Å; H656-A674 WeakPolarHBondContact O-CB 3.39Å; H656-Q678 PolarHBondContact O-NE2 2.76Å
657	H	77	Confident	84.9	Confident	150 Å²	150	71.1 Å²	71.1	69%	0.694	36%	0.358	S	S	*	.			trans	-79.3	13.5	178.2	-56.6	-56.3	0	0	0	114.8	S655	S655-H657 PolarHBondContact O-N 2.85Å
658	G	65.1	Low	84.9	Confident	28 Å²	28	72.7 Å²	72.7	29%	0.289	37%	0.365	S	S	.	.			trans	77.3	152.9	177.4	0	0	0	0	0	114.9	H656	H656-G658 PolarHBondContact O-N 2.74Å
659	S	62.4	Low	84.9	Confident	71 Å²	71	69.7 Å²	69.7	50%	0.497	35%	0.351	S	S	.	.			trans	-80.5	137.8	163	-178.9	0	0	0	0	109.8	S661	S659-S661 PolarHBondContact O-N 2.87Å; S659-S661 PolarHBondContact OG-N 2.93Å
660	R	54.7	Low	84.9	Confident	254 Å²	254	69.8 Å²	69.8	96%	0.958	35%	0.352	S	S	*	.	S	Bend	trans	-62.3	-10.3	174.4	-72.8	-178.3	173.2	166	-1.5	113.8
661	S	58.1	Low	84.8	Confident	73 Å²	73	71.9 Å²	71.9	51%	0.51	36%	0.361	S	S	.	.			trans	-104.9	88.9	174.1	-168.8	0	0	0	0	110.6	S659 S663	S659-S661 PolarHBondContact O-N 2.87Å; S659-S661 PolarHBondContact OG-N 2.93Å; S661-S663 PolarHBondContact O-N 2.64Å
662	L	69.1	Low	84.8	Confident	69 Å²	69	66.7 Å²	66.7	36%	0.361	34%	0.343	S	S	.	.			trans	-78.2	54.5	175	-65.3	90.1	0	0	0	111.1	T664 Q668 H671	L662-T664 PolarHBondContact O-N 2.68Å; L662-Q668 HydrophobicContact CB-CG 3.9Å; L662-Q668 HydrophobicContact CD2-CG 4.06Å; L662-Q668 PolarHBondContact O-NE2 2.75Å; L662-H671 HydrophobicContact CD2-CB 3.98Å
663	S	76.8	Confident	84.9	Confident	90 Å²	90	63.8 Å²	63.8	63%	0.629	33%	0.33	S	S	*	.			trans	-71.6	-21.7	-165.6	60.1	0	0	0	0	115.2	S661	S661-S663 PolarHBondContact O-N 2.64Å
664	T	91.5	Very high	85	Confident	59 Å²	59	63.8 Å²	63.8	36%	0.362	33%	0.33	S	S	.	.	S	Bend	trans	-125.3	160.2	177.3	81.1	0	0	0	0	111.3	L662 D666 Q667 Q668	L662-T664 PolarHBondContact O-N 2.68Å; T664-D666 PolarHBondContact O-N 3.05Å; T664-D666 PolarHBondContact OG1-N 2.7Å; T664-Q667 PolarHBondContact O-N 3.44Å; T664-Q667 WeakPolarHBondContact OG1-CG 3.41Å; T664-Q667 PolarHBondContact OG1-N 3.5Å; T664-Q667 VanDerWaalsContact OG1-N 3.14Å; T664-Q668 WeakPolarHBondContact O-CG 3.12Å; T664-Q668 PolarHBondContact O-N 2.91Å; T664-Q668 VanDerWaalsContact O-N 3.15Å
665	K	94.2	Very high	85.1	Confident	103 Å²	103	62.8 Å²	62.8	45%	0.448	33%	0.328	S	S	.	.	H	α-helix	trans	-62	-32.9	174.5	-63.8	-179	177.6	179.2	0	112	Q668 I669 T699 K700	K665-Q668 WeakPolarHBondContact O-CB 3.45Å; K665-Q668 PolarHBondContact O-N 3.49Å; K665-I669 VanDerWaalsContact O-CG1 3.31Å; K665-I669 WeakPolarHBondContact O-CG1 3.32Å; K665-I669 PolarHBondContact O-N 3.21Å; K665-T699 WeakPolarHBondContact CE-O 3.32Å; K665-T699 PolarHBondContact NZ-O 2.95Å; K665-K700 HydrophobicContact CB-CB 4.23Å; K665-K700 HydrophobicContact CD-CB 4.11Å
666	D	95.1	Very high	85.3	Confident	26 Å²	26	59.4 Å²	59.4	14%	0.139	30%	0.304	C	S	.	.	H	α-helix	trans	-67.1	-42.7	176.9	-60.9	-72.3	0	0	0	111.5	T664 Q668 I669 L670 K700 S722 A726	T664-D666 PolarHBondContact O-N 3.05Å; T664-D666 PolarHBondContact OG1-N 2.7Å; D666-Q668 PolarHBondContact O-N 3.01Å; D666-I669 PolarHBondContact O-N 2.86Å; D666-L670 WeakPolarHBondContact O-CB 3.37Å; D666-L670 PolarHBondContact O-N 3.35Å; D666-K700 WeakPolarHBondContact OD1-CD 3.49Å; D666-K700 WeakPolarHBondContact OD1-CE 3.49Å; D666-K700 IonicContact OD1-NZ 2.72Å; D666-K700 PolarHBondContact OD1-NZ 3.44Å; D666-K700 IonicContact OD2-NZ 2.91Å; D666-S722 VanDerWaalsContact OD1-CA 3.31Å; D666-S722 WeakPolarHBondContact OD1-CA 3.12Å; D666-S722 WeakPolarHBondContact OD1-CB 3.42Å; D666-A726 HydrophobicContact CB-CB 4.04Å; D666-A726 WeakPolarHBondContact O-CB 3.19Å
667	Q	93.6	Very high	85.8	Confident	49 Å²	49	57.5 Å²	57.5	23%	0.229	30%	0.295	C	S	.	.	H	α-helix	trans	-60.3	-34.8	170.9	-64.6	-61.5	-18.8	0	0	112.1	T664 H671 A726	T664-Q667 PolarHBondContact O-N 3.44Å; T664-Q667 WeakPolarHBondContact OG1-CG 3.41Å; T664-Q667 PolarHBondContact OG1-N 3.5Å; T664-Q667 VanDerWaalsContact OG1-N 3.14Å; Q667-H671 VanDerWaalsContact O-CB 3.26Å; Q667-H671 WeakPolarHBondContact O-CB 3.22Å; Q667-H671 PolarHBondContact O-N 3.17Å; Q667-A726 PolarHBondContact NE2-O 3Å
668	Q	94.3	Very high	86.7	Confident	68 Å²	68	52.8 Å²	52.8	32%	0.318	27%	0.273	S	S	.	.	H	α-helix	trans	-70.9	-38.9	176.7	-66.2	164.2	15.6	0	0	112.1	L662 T664 K665 D666 H671 E672	L662-Q668 HydrophobicContact CB-CG 3.9Å; L662-Q668 HydrophobicContact CD2-CG 4.06Å; L662-Q668 PolarHBondContact O-NE2 2.75Å; T664-Q668 WeakPolarHBondContact O-CG 3.12Å; T664-Q668 PolarHBondContact O-N 2.91Å; T664-Q668 VanDerWaalsContact O-N 3.15Å; K665-Q668 WeakPolarHBondContact O-CB 3.45Å; K665-Q668 PolarHBondContact O-N 3.49Å; D666-Q668 PolarHBondContact O-N 3.01Å; Q668-H671 PolarHBondContact O-N 2.9Å; Q668-E672 PolarHBondContact O-N 3.14Å; Q668-E672 VanDerWaalsContact O-N 3.08Å
669	I	96.5	Very high	88.1	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.9	-45.1	173.6	-67.8	161	0	0	0	110.4	K665 D666 F673 L693 A696 F697 K700 F719 L723	K665-I669 VanDerWaalsContact O-CG1 3.31Å; K665-I669 WeakPolarHBondContact O-CG1 3.32Å; K665-I669 PolarHBondContact O-N 3.21Å; D666-I669 PolarHBondContact O-N 2.86Å; I669-F673 VanDerWaalsContact O-CB 3.29Å; I669-F673 WeakPolarHBondContact O-CB 3.35Å; I669-F673 PolarHBondContact O-N 3.08Å; I669-L693 HydrophobicContact CG2-CD1 4.32Å; I669-L693 WeakPolarHBondContact O-CD1 3.34Å; I669-A696 HydrophobicContact CG1-CB 4.22Å; I669-F697 HydrophobicContact CD1-CD2 4.05Å; I669-F697 HydrophobicContact CG1-CB 4.45Å; I669-F697 HydrophobicContact CG1-CD2 4.44Å; I669-F697 HydrophobicContact CG2-CD2 4.29Å; I669-K700 HydrophobicContact CD1-CB 4.08Å; I669-K700 HydrophobicContact CD1-CD 4.16Å; I669-F719 HydrophobicContact CG2-CD2 4.28Å; I669-F719 HydrophobicContact CG2-CE2 3.88Å; I669-L723 HydrophobicContact CG2-CD2 4.44Å
670	L	96.4	Very high	89.7	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-60.6	-44.1	174.7	176.6	67.2	0	0	0	111.9	L653 D666 F673 A674 L723 A726 L727	L653-L670 HydrophobicContact CD2-CD1 3.87Å; D666-L670 WeakPolarHBondContact O-CB 3.37Å; D666-L670 PolarHBondContact O-N 3.35Å; L670-F673 PolarHBondContact O-N 3.02Å; L670-A674 WeakPolarHBondContact O-CB 3.23Å; L670-A674 PolarHBondContact O-N 3.1Å; L670-L723 HydrophobicContact CB-CD2 4.31Å; L670-L723 HydrophobicContact CD1-CD2 3.96Å; L670-A726 HydrophobicContact CB-CB 3.72Å; L670-A726 HydrophobicContact CD2-CB 3.72Å; L670-A726 HydrophobicContact CG-CB 4.29Å; L670-L727 HydrophobicContact CD1-CD1 4.19Å; L670-L727 HydrophobicContact CD1-CD2 4.37Å; L670-L727 HydrophobicContact CD1-CG 4.26Å; L670-L727 HydrophobicContact CD2-CD2 3.58Å; L670-L727 HydrophobicContact CD2-CG 3.94Å
671	H	95.1	Very high	91.6	Very high	54 Å²	54	40.2 Å²	40.2	25%	0.25	21%	0.21	C	C	.	.	H	α-helix	trans	-61.3	-53.6	179.6	178.5	-94.7	0	0	0	112.4	L662 Q667 Q668 F673 A674 K675	L662-H671 HydrophobicContact CD2-CB 3.98Å; Q667-H671 VanDerWaalsContact O-CB 3.26Å; Q667-H671 WeakPolarHBondContact O-CB 3.22Å; Q667-H671 PolarHBondContact O-N 3.17Å; Q668-H671 PolarHBondContact O-N 2.9Å; H671-F673 VanDerWaalsContact C-N 3.25Å; H671-F673 PolarHBondContact O-N 3.22Å; H671-A674 PolarHBondContact O-N 2.76Å; H671-K675 WeakPolarHBondContact O-CB 3.28Å; H671-K675 PolarHBondContact O-N 3.26Å
672	E	96.5	Very high	93.2	Very high	31 Å²	31	40 Å²	40	15%	0.145	21%	0.206	C	C	.	.	H	α-helix	trans	-68.4	-25.2	179.2	-63.3	-49.7	125.6	0	0	112.4	Q668 K675 L676 E692 L693 A696	Q668-E672 PolarHBondContact O-N 3.14Å; Q668-E672 VanDerWaalsContact O-N 3.08Å; E672-K675 IonicContact OE2-NZ 3.17Å; E672-K675 PolarHBondContact OE2-NZ 3.1Å; E672-L676 WeakPolarHBondContact O-CB 3.36Å; E672-L676 PolarHBondContact O-N 3.5Å; E672-E692 HydrophobicContact CG-CB 4.01Å; E672-E692 VanDerWaalsContact OE2-CB 3.28Å; E672-E692 WeakPolarHBondContact OE2-CB 3.49Å; E672-L693 HydrophobicContact CB-CB 4.23Å; E672-L693 HydrophobicContact CB-CD1 4.13Å; E672-A696 HydrophobicContact CG-CB 4.35Å
673	F	97.6	Very high	94.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-73.9	-43.5	172.1	-175.4	-136.2	0	0	0	112.3	I640 L643 L649 L653 I669 L670 H671 K675 L676 I677 L693 F719 L723	I640-F673 HydrophobicContact CG2-CE2 4.24Å; L643-F673 HydrophobicContact CB-CZ 4.15Å; L649-F673 HydrophobicContact CD2-CE1 4.3Å; L653-F673 HydrophobicContact CD1-CD1 3.54Å; L653-F673 HydrophobicContact CD1-CE1 3.27Å; L653-F673 HydrophobicContact CD1-CG 4.4Å; L653-F673 HydrophobicContact CD1-CZ 3.92Å; L653-F673 HydrophobicContact CD2-CD1 4.41Å; I669-F673 VanDerWaalsContact O-CB 3.29Å; I669-F673 WeakPolarHBondContact O-CB 3.35Å; I669-F673 PolarHBondContact O-N 3.08Å; L670-F673 PolarHBondContact O-N 3.02Å; H671-F673 VanDerWaalsContact C-N 3.25Å; H671-F673 PolarHBondContact O-N 3.22Å; F673-K675 VanDerWaalsContact C-N 3.33Å; F673-K675 PolarHBondContact O-N 3.4Å; F673-L676 PolarHBondContact O-N 2.75Å; F673-I677 HydrophobicContact CD2-CG1 4Å; F673-I677 HydrophobicContact CE2-CD1 3.77Å; F673-I677 HydrophobicContact CE2-CG1 3.65Å; F673-I677 HydrophobicContact CZ-CD1 4.11Å; F673-I677 HydrophobicContact CZ-CG1 3.97Å; F673-I677 WeakPolarHBondContact O-CG1 3.32Å; F673-I677 PolarHBondContact O-N 3.08Å; F673-L693 HydrophobicContact CB-CD1 3.98Å; F673-L693 HydrophobicContact CB-CD2 4.23Å; F673-L693 HydrophobicContact CD2-CD2 3.94Å; F673-L693 HydrophobicContact CG-CD2 4.49Å; F673-F719 HydrophobicContact CB-CZ 4.03Å; F673-F719 AromaticContact CD1-CE1 3.89Å; F673-F719 HydrophobicContact CD1-CE1 3.89Å; F673-F719 AromaticContact CD1-CZ 3.89Å; F673-F719 HydrophobicContact CD1-CZ 3.89Å; F673-F719 HydrophobicContact CD2-CE1 4.1Å; F673-F719 AromaticContact CD2-CZ 3.74Å; F673-F719 HydrophobicContact CD2-CZ 3.74Å; F673-F719 AromaticContact CE1-CE1 3.81Å; F673-F719 HydrophobicContact CE1-CE1 3.81Å; F673-F719 HydrophobicContact CE1-CZ 4.25Å; F673-F719 HydrophobicContact CE2-CE1 4.04Å; F673-F719 HydrophobicContact CE2-CZ 4.14Å; F673-F719 HydrophobicContact CG-CE1 4.04Å; F673-F719 AromaticContact CG-CZ 3.61Å; F673-F719 HydrophobicContact CG-CZ 3.61Å; F673-F719 AromaticContact CZ-CE1 3.9Å; F673-F719 HydrophobicContact CZ-CE1 3.9Å; F673-F719 HydrophobicContact CZ-CZ 4.38Å; F673-L723 HydrophobicContact CB-CD2 4.36Å; F673-L723 HydrophobicContact CD1-CD1 3.65Å; F673-L723 HydrophobicContact CD1-CD2 3.68Å; F673-L723 HydrophobicContact CD1-CG 4.31Å; F673-L723 HydrophobicContact CE1-CD1 3.57Å; F673-L723 HydrophobicContact CE1-CD2 4.46Å; F673-L723 HydrophobicContact CG-CD2 4.43Å
674	A	97.1	Very high	94.5	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.008	20%	0.202	C	C	.	.	H	α-helix	trans	-59.9	-44.7	175.5	0	0	0	0	0	111.4	L653 H656 L670 H671 I677 Q678	L653-A674 HydrophobicContact CB-CB 4.49Å; L653-A674 HydrophobicContact CD2-CB 3.82Å; H656-A674 HydrophobicContact CB-CB 4.24Å; H656-A674 WeakPolarHBondContact O-CB 3.39Å; L670-A674 WeakPolarHBondContact O-CB 3.23Å; L670-A674 PolarHBondContact O-N 3.1Å; H671-A674 PolarHBondContact O-N 2.76Å; A674-I677 PolarHBondContact O-N 3.47Å; A674-Q678 VanDerWaalsContact O-CG 3.26Å; A674-Q678 WeakPolarHBondContact O-CG 3.39Å; A674-Q678 PolarHBondContact O-N 2.99Å; A674-Q678 PolarHBondContact O-NE2 2.98Å
675	K	96.1	Very high	94.5	Very high	73 Å²	73	38.8 Å²	38.8	32%	0.317	20%	0.197	S	C	.	.	H	α-helix	trans	-61.5	-46.2	173	176.3	-179.2	148	-149.6	0	112.4	H671 E672 F673 I677 Q678 E679	H671-K675 WeakPolarHBondContact O-CB 3.28Å; H671-K675 PolarHBondContact O-N 3.26Å; E672-K675 IonicContact OE2-NZ 3.17Å; E672-K675 PolarHBondContact OE2-NZ 3.1Å; F673-K675 VanDerWaalsContact C-N 3.33Å; F673-K675 PolarHBondContact O-N 3.4Å; K675-I677 VanDerWaalsContact C-N 3.31Å; K675-I677 PolarHBondContact O-N 2.85Å; K675-Q678 WeakPolarHBondContact O-CB 3.47Å; K675-Q678 PolarHBondContact O-N 3.18Å; K675-Q678 VanDerWaalsContact O-N 3.14Å; K675-E679 WeakPolarHBondContact CE-OE1 3.19Å; K675-E679 WeakPolarHBondContact CG-OE1 3.19Å; K675-E679 WeakPolarHBondContact O-CG 3.45Å; K675-E679 PolarHBondContact O-N 2.72Å
676	L	97.1	Very high	94.4	Very high	7 Å²	7	39.6 Å²	39.6	4%	0.037	20%	0.202	C	C	.	.	H	α-helix	trans	-59.3	-42.1	176.2	178.6	61.1	0	0	0	111.9	L627 I640 E672 F673 E679 M680 V688 P690 L693	L627-L676 HydrophobicContact CD2-CD1 3.94Å; L627-L676 HydrophobicContact CD2-CD2 4.48Å; I640-L676 HydrophobicContact CD1-CD2 4.15Å; I640-L676 HydrophobicContact CG2-CD2 3.93Å; E672-L676 WeakPolarHBondContact O-CB 3.36Å; E672-L676 PolarHBondContact O-N 3.5Å; F673-L676 PolarHBondContact O-N 2.75Å; L676-E679 PolarHBondContact O-N 2.74Å; L676-M680 HydrophobicContact CD1-CG 4.14Å; L676-M680 HydrophobicContact CD1-SD 4.12Å; L676-M680 HydrophobicContact CD2-SD 4.44Å; L676-M680 HydrophobicContact CG-CG 4.37Å; L676-M680 HydrophobicContact CG-SD 3.86Å; L676-M680 WeakPolarHBondContact O-CB 3.39Å; L676-M680 VanDerWaalsContact O-CG 3.23Å; L676-M680 WeakPolarHBondContact O-CG 3.47Å; L676-M680 PolarHBondContact O-N 2.87Å; L676-V688 HydrophobicContact CD1-CB 4.08Å; L676-V688 HydrophobicContact CD1-CG1 3.41Å; L676-V688 VanDerWaalsContact CD1-CG1 3.41Å; L676-P690 HydrophobicContact CD1-CB 4.33Å; L676-P690 HydrophobicContact CD2-CB 3.8Å; L676-L693 HydrophobicContact CD2-CB 4.48Å; L676-L693 HydrophobicContact CD2-CD2 3.52Å
677	I	97.2	Very high	94.5	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.6	-39.1	175.1	-69.6	-61.7	0	0	0	111.4	S644 T650 L653 R654 F673 A674 K675 M680 W681	S644-I677 WeakPolarHBondContact OG-CD1 3.34Å; T650-I677 HydrophobicContact CG2-CG2 3.96Å; L653-I677 HydrophobicContact CB-CB 4.16Å; L653-I677 HydrophobicContact CB-CG1 4.45Å; L653-I677 HydrophobicContact CB-CG2 3.9Å; L653-I677 HydrophobicContact CD1-CG1 3.96Å; R654-I677 HydrophobicContact CG-CG2 4.16Å; F673-I677 HydrophobicContact CD2-CG1 4Å; F673-I677 HydrophobicContact CE2-CD1 3.77Å; F673-I677 HydrophobicContact CE2-CG1 3.65Å; F673-I677 HydrophobicContact CZ-CD1 4.11Å; F673-I677 HydrophobicContact CZ-CG1 3.97Å; F673-I677 WeakPolarHBondContact O-CG1 3.32Å; F673-I677 PolarHBondContact O-N 3.08Å; A674-I677 PolarHBondContact O-N 3.47Å; K675-I677 VanDerWaalsContact C-N 3.31Å; K675-I677 PolarHBondContact O-N 2.85Å; I677-M680 HydrophobicContact CD1-SD 4.42Å; I677-M680 PolarHBondContact O-N 3.23Å; I677-W681 WeakPolarHBondContact O-CB 3.32Å; I677-W681 VanDerWaalsContact O-CD1 3.28Å; I677-W681 PolarHBondContact O-N 3.31Å
678	Q	95.6	Very high	94.6	Very high	50 Å²	50	39.2 Å²	39.2	23%	0.234	20%	0.204	C	C	.	.	H	α-helix	trans	-62.2	-43	173.6	-71.3	159.7	34.3	0	0	111.4	L653 H656 A674 K675 W681 T682	L653-Q678 PolarHBondContact O-NE2 2.92Å; H656-Q678 PolarHBondContact O-NE2 2.76Å; A674-Q678 VanDerWaalsContact O-CG 3.26Å; A674-Q678 WeakPolarHBondContact O-CG 3.39Å; A674-Q678 PolarHBondContact O-N 2.99Å; A674-Q678 PolarHBondContact O-NE2 2.98Å; K675-Q678 WeakPolarHBondContact O-CB 3.47Å; K675-Q678 PolarHBondContact O-N 3.18Å; K675-Q678 VanDerWaalsContact O-N 3.14Å; Q678-W681 CarbonylContact O-C 3.52Å; Q678-T682 PolarHBondContact O-N 2.83Å; Q678-T682 PolarHBondContact O-OG1 2.85Å
679	E	95.1	Very high	94.8	Very high	75 Å²	75	39.1 Å²	39.1	35%	0.35	21%	0.208	S	C	.	.	H	α-helix	trans	-66.6	-43.2	175.7	-69.2	174.6	-158	0	0	112.5	K675 L676 W681 T682 V685 V688	K675-E679 WeakPolarHBondContact CE-OE1 3.19Å; K675-E679 WeakPolarHBondContact CG-OE1 3.19Å; K675-E679 WeakPolarHBondContact O-CG 3.45Å; K675-E679 PolarHBondContact O-N 2.72Å; L676-E679 PolarHBondContact O-N 2.74Å; E679-W681 VanDerWaalsContact C-N 3.34Å; E679-W681 PolarHBondContact O-N 3.29Å; E679-T682 PolarHBondContact O-N 2.89Å; E679-V685 WeakPolarHBondContact O-CB 3.29Å; E679-V685 WeakPolarHBondContact O-CG1 3.41Å; E679-V688 HydrophobicContact CB-CG1 4.49Å; E679-V688 HydrophobicContact CB-CG2 3.91Å; E679-V688 WeakPolarHBondContact OE2-CG1 3.37Å
680	M	95.4	Very high	94.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-67.5	-30.3	177.8	-71.8	173.9	74.4	0	0	113.6	G623 C625 L627 I640 L676 I677 V688	G623-M680 WeakPolarHBondContact CA-O 3.25Å; G623-M680 PolarHBondContact N-O 3.18Å; C625-M680 HydrophobicContact CB-CB 4.2Å; C625-M680 HydrophobicContact CB-CG 4.37Å; L627-M680 HydrophobicContact CD1-CE 4.13Å; L627-M680 HydrophobicContact CD1-SD 4.34Å; L627-M680 HydrophobicContact CD2-CE 4.25Å; L627-M680 HydrophobicContact CD2-CG 4.3Å; L627-M680 HydrophobicContact CD2-SD 3.85Å; L627-M680 HydrophobicContact CG-CE 4.18Å; L627-M680 HydrophobicContact CG-SD 4.38Å; I640-M680 HydrophobicContact CG2-CE 4.49Å; I640-M680 HydrophobicContact CG2-SD 4.11Å; L676-M680 HydrophobicContact CD1-CG 4.14Å; L676-M680 HydrophobicContact CD1-SD 4.12Å; L676-M680 HydrophobicContact CD2-SD 4.44Å; L676-M680 HydrophobicContact CG-CG 4.37Å; L676-M680 HydrophobicContact CG-SD 3.86Å; L676-M680 WeakPolarHBondContact O-CB 3.39Å; L676-M680 VanDerWaalsContact O-CG 3.23Å; L676-M680 WeakPolarHBondContact O-CG 3.47Å; L676-M680 PolarHBondContact O-N 2.87Å; I677-M680 HydrophobicContact CD1-SD 4.42Å; I677-M680 PolarHBondContact O-N 3.23Å; M680-V688 HydrophobicContact CG-CG2 4.49Å
681	W	94.6	Very high	94.8	Very high	14 Å²	14	42.5 Å²	42.5	5%	0.053	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	36.4	176.3	-65.9	84.8	0	0	0	111.9	E622 S644 T650 R654 I677 Q678 E679 P915	E622-W681 HydrophobicContact CB-CE3 4.06Å; S644-W681 WeakPolarHBondContact O-CZ2 3.34Å; S644-W681 PolarHBondContact O-NE1 3Å; S644-W681 PolarHBondContact OG-NE1 2.89Å; T650-W681 HydrophobicContact CG2-CD2 4.13Å; T650-W681 HydrophobicContact CG2-CG 4.17Å; T650-W681 HydrophobicContact CG2-CZ2 4.4Å; R654-W681 HydrophobicContact CG-CB 4.31Å; R654-W681 VanDerWaalsContact CZ-O 3.31Å; R654-W681 PolarHBondContact NH2-O 3.3Å; I677-W681 WeakPolarHBondContact O-CB 3.32Å; I677-W681 VanDerWaalsContact O-CD1 3.28Å; I677-W681 PolarHBondContact O-N 3.31Å; Q678-W681 CarbonylContact O-C 3.52Å; E679-W681 VanDerWaalsContact C-N 3.34Å; E679-W681 PolarHBondContact O-N 3.29Å; W681-P915 HydrophobicContact CH2-CG 3.71Å; W681-P915 HydrophobicContact CZ3-CG 4.15Å
682	T	92.2	Very high	94.9	Very high	70 Å²	70	43.1 Å²	43.1	43%	0.429	23%	0.228	S	C	.	.	S	Bend	trans	-106	132.9	165.5	-68.2	0	0	0	0	109.2	Q678 E679 V685	Q678-T682 PolarHBondContact O-N 2.83Å; Q678-T682 PolarHBondContact O-OG1 2.85Å; E679-T682 PolarHBondContact O-N 2.89Å; T682-V685 HydrophobicContact CG2-CG2 3.87Å; T682-V685 WeakPolarHBondContact O-CB 3.45Å; T682-V685 PolarHBondContact O-N 2.88Å
683	A	87.8	Confident	94.9	Very high	39 Å²	39	41.9 Å²	41.9	32%	0.322	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	143	178.5	0	0	0	0	0	112.4	E622 V685	E622-A683 HydrophobicContact CG-CB 4.28Å; A683-V685 PolarHBondContact O-N 2.76Å
684	N	86	Confident	94.9	Very high	111 Å²	111	42.4 Å²	42.4	59%	0.594	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.6	9.2	-176.4	-45.5	-75.9	0	0	0	116.3
685	V	91.2	Very high	94.8	Very high	41 Å²	41	49.9 Å²	49.9	25%	0.248	25%	0.253	C	S	.	.			trans	-93.4	102.8	172.8	-174.7	0	0	0	0	110.2	C625 E679 T682 A683 V688	C625-V685 VanDerWaalsContact CB-O 3.26Å; C625-V685 WeakPolarHBondContact CB-O 3.15Å; C625-V685 PolarHBondContact SG-O 2.89Å; C625-V685 VanDerWaalsContact SG-O 3.39Å; E679-V685 WeakPolarHBondContact O-CB 3.29Å; E679-V685 WeakPolarHBondContact O-CG1 3.41Å; T682-V685 HydrophobicContact CG2-CG2 3.87Å; T682-V685 WeakPolarHBondContact O-CB 3.45Å; T682-V685 PolarHBondContact O-N 2.88Å; A683-V685 PolarHBondContact O-N 2.76Å; V685-V688 HydrophobicContact CG1-CG2 3.64Å
686	H	92.2	Very high	94.9	Very high	120 Å²	120	46.8 Å²	46.8	56%	0.556	24%	0.241	S	C	*	.			trans	-93.7	-15.6	-177	-57.2	-54.1	0	0	0	114.7	G626	G626-H686 PolarHBondContact N-O 2.83Å
687	T	96.2	Very high	94.8	Very high	57 Å²	57	46.7 Å²	46.7	35%	0.35	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	130	176.3	-65.8	0	0	0	0	111.2	G626 R628 N926	G626-T687 CarbonylContact O-C 3.58Å; G626-T687 VanDerWaalsContact O-CA 3.31Å; G626-T687 WeakPolarHBondContact O-CA 3.35Å; R628-T687 HydrophobicContact CB-CG2 4.39Å; T687-N926 HydrophobicContact CG2-CB 3.66Å; T687-N926 PolarHBondContact OG1-O 2.81Å
688	V	97.1	Very high	94.8	Very high	10 Å²	10	47.6 Å²	47.6	6%	0.061	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	158.3	168.8	179.5	0	0	0	0	109.8	G626 L627 R628 L676 E679 M680 V685	G626-V688 PolarHBondContact O-N 2.83Å; L627-V688 WeakPolarHBondContact CA-O 3.17Å; L627-V688 HydrophobicContact CD2-CB 4.32Å; R628-V688 PolarHBondContact N-O 2.78Å; L676-V688 HydrophobicContact CD1-CB 4.08Å; L676-V688 HydrophobicContact CD1-CG1 3.41Å; L676-V688 VanDerWaalsContact CD1-CG1 3.41Å; E679-V688 HydrophobicContact CB-CG1 4.49Å; E679-V688 HydrophobicContact CB-CG2 3.91Å; E679-V688 WeakPolarHBondContact OE2-CG1 3.37Å; M680-V688 HydrophobicContact CG-CG2 4.49Å; V685-V688 HydrophobicContact CG1-CG2 3.64Å
689	T	97.6	Very high	94.7	Very high	67 Å²	67	48 Å²	48	41%	0.411	25%	0.252	S	S	.	.			trans	-113.1	107.7	173.2	-55.8	0	0	0	0	109	R628 I630 M691	R628-T689 HydrophobicContact CB-CG2 4.14Å; R628-T689 WeakPolarHBondContact CB-OG1 3.33Å; R628-T689 HydrophobicContact CG-CG2 4.46Å; I630-T689 HydrophobicContact CD1-CG2 3.87Å; I630-T689 HydrophobicContact CG1-CG2 4.18Å; T689-M691 HydrophobicContact CG2-CB 4.32Å; T689-M691 PolarHBondContact O-N 2.91Å
690	P	97	Very high	94.7	Very high	4 Å²	4	47 Å²	47	3%	0.026	25%	0.247	C	C	.	.			trans	-76	41.3	-172.2	31.9	-36.8	0	0	0	113.9	L627 I630 M636 L676 L693 K694	L627-P690 HydrophobicContact CB-CG 4.41Å; L627-P690 HydrophobicContact CD2-CB 4.43Å; L627-P690 HydrophobicContact CD2-CG 4.25Å; I630-P690 HydrophobicContact CD1-CG 4.08Å; M636-P690 HydrophobicContact CE-CB 4.08Å; M636-P690 HydrophobicContact CE-CG 3.67Å; L676-P690 HydrophobicContact CD1-CB 4.33Å; L676-P690 HydrophobicContact CD2-CB 3.8Å; P690-L693 PolarHBondContact O-N 3.38Å; P690-K694 PolarHBondContact O-N 2.58Å
691	M	96.4	Very high	94.7	Very high	69 Å²	69	48 Å²	48	34%	0.34	25%	0.251	S	S	.	.	H	α-helix	trans	-65.1	-44.8	-173.3	-177.9	75.4	-83.9	0	0	112	I630 T689 K694 R695	I630-M691 VanDerWaalsContact CD1-CA 3.47Å; I630-M691 HydrophobicContact CD1-CB 3.98Å; I630-M691 HydrophobicContact CD1-CE 4.3Å; I630-M691 HydrophobicContact CD1-SD 4.37Å; I630-M691 HydrophobicContact CG2-CE 4.02Å; I630-M691 HydrophobicContact CG2-SD 3.8Å; T689-M691 HydrophobicContact CG2-CB 4.32Å; T689-M691 PolarHBondContact O-N 2.91Å; M691-K694 HydrophobicContact CE-CB 4.16Å; M691-K694 HydrophobicContact CE-CD 4Å; M691-K694 PolarHBondContact O-N 3.5Å; M691-R695 VanDerWaalsContact O-CB 3.3Å; M691-R695 WeakPolarHBondContact O-CB 3.27Å; M691-R695 PolarHBondContact O-N 2.94Å
692	E	96.5	Very high	94.6	Very high	67 Å²	67	57.1 Å²	57.1	31%	0.313	29%	0.286	S	S	.	.	H	α-helix	trans	-67.8	-37.8	-179.9	-65.8	-56.2	151.3	0	0	112.1	E672 R695 A696	E672-E692 HydrophobicContact CG-CB 4.01Å; E672-E692 VanDerWaalsContact OE2-CB 3.28Å; E672-E692 WeakPolarHBondContact OE2-CB 3.49Å; E692-R695 WeakPolarHBondContact O-CB 3.46Å; E692-R695 PolarHBondContact O-N 3.4Å; E692-R695 IonicContact OE1-NE 3.78Å; E692-R695 IonicContact OE1-NH2 3.66Å; E692-R695 IonicContact OE2-CZ 2.66Å; E692-R695 IonicContact OE2-NE 3.11Å; E692-R695 PolarHBondContact OE2-NE 3.13Å; E692-R695 IonicContact OE2-NH2 2.87Å; E692-R695 PolarHBondContact OE2-NH2 2.84Å; E692-A696 WeakPolarHBondContact O-CB 3.36Å; E692-A696 PolarHBondContact O-N 3.48Å
693	L	97.3	Very high	94.6	Very high	4 Å²	4	57.4 Å²	57.4	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-65.9	-44.9	173.7	-174.5	57.9	0	0	0	112	I640 I669 E672 F673 L676 P690 R695 A696 F697 F719	I640-L693 HydrophobicContact CD1-CD2 3.77Å; I640-L693 HydrophobicContact CG1-CD2 4.42Å; I669-L693 HydrophobicContact CG2-CD1 4.32Å; I669-L693 WeakPolarHBondContact O-CD1 3.34Å; E672-L693 HydrophobicContact CB-CB 4.23Å; E672-L693 HydrophobicContact CB-CD1 4.13Å; F673-L693 HydrophobicContact CB-CD1 3.98Å; F673-L693 HydrophobicContact CB-CD2 4.23Å; F673-L693 HydrophobicContact CD2-CD2 3.94Å; F673-L693 HydrophobicContact CG-CD2 4.49Å; L676-L693 HydrophobicContact CD2-CB 4.48Å; L676-L693 HydrophobicContact CD2-CD2 3.52Å; P690-L693 PolarHBondContact O-N 3.38Å; L693-R695 VanDerWaalsContact C-N 3.29Å; L693-R695 PolarHBondContact O-N 3.48Å; L693-A696 PolarHBondContact O-N 3.02Å; L693-F697 VanDerWaalsContact O-CB 3.27Å; L693-F697 WeakPolarHBondContact O-CB 3.48Å; L693-F697 PolarHBondContact O-N 3.15Å; L693-F719 HydrophobicContact CD1-CE2 4Å; L693-F719 HydrophobicContact CD1-CZ 4.32Å; L693-F719 HydrophobicContact CD2-CE2 4.22Å; L693-F719 HydrophobicContact CD2-CZ 4.04Å; L693-F719 HydrophobicContact CG-CE2 4.35Å
694	K	96.9	Very high	94.8	Very high	12 Å²	12	56 Å²	56	5%	0.052	27%	0.27	C	S	.	.	H	α-helix	trans	-57	-45.9	172.1	-168.9	-164.7	-167.3	-68.5	0	110.2	T633 M636 P690 M691 F697 S698 Y704 S705 D706	T633-K694 HydrophobicContact CG2-CD 4.07Å; M636-K694 HydrophobicContact CE-CB 4.29Å; M636-K694 HydrophobicContact SD-CB 4.15Å; M636-K694 HydrophobicContact SD-CG 4.29Å; P690-K694 PolarHBondContact O-N 2.58Å; M691-K694 HydrophobicContact CE-CB 4.16Å; M691-K694 HydrophobicContact CE-CD 4Å; M691-K694 PolarHBondContact O-N 3.5Å; K694-F697 PolarHBondContact O-N 2.86Å; K694-S698 VanDerWaalsContact O-CB 3.27Å; K694-S698 WeakPolarHBondContact O-CB 3.41Å; K694-S698 PolarHBondContact O-N 3.19Å; K694-S698 PolarHBondContact O-OG 2.85Å; K694-Y704 PolarHBondContact NZ-O 2.96Å; K694-S705 PolarHBondContact NZ-O 3.16Å; K694-S705 VanDerWaalsContact NZ-O 3.1Å; K694-D706 PolarHBondContact NZ-O 2.84Å
695	R	96.4	Very high	95.1	Very high	157 Å²	157	53.2 Å²	53.2	59%	0.592	26%	0.259	S	S	*	.	H	α-helix	trans	-60.1	-51.8	-179.1	-172.5	169	74.8	124.6	-2.9	111.2	M691 E692 L693 S698 T699	M691-R695 VanDerWaalsContact O-CB 3.3Å; M691-R695 WeakPolarHBondContact O-CB 3.27Å; M691-R695 PolarHBondContact O-N 2.94Å; E692-R695 WeakPolarHBondContact O-CB 3.46Å; E692-R695 PolarHBondContact O-N 3.4Å; E692-R695 IonicContact OE1-NE 3.78Å; E692-R695 IonicContact OE1-NH2 3.66Å; E692-R695 IonicContact OE2-CZ 2.66Å; E692-R695 IonicContact OE2-NE 3.11Å; E692-R695 PolarHBondContact OE2-NE 3.13Å; E692-R695 IonicContact OE2-NH2 2.87Å; E692-R695 PolarHBondContact OE2-NH2 2.84Å; L693-R695 VanDerWaalsContact C-N 3.29Å; L693-R695 PolarHBondContact O-N 3.48Å; R695-S698 PolarHBondContact O-N 3.15Å; R695-T699 WeakPolarHBondContact O-CG2 3.3Å; R695-T699 PolarHBondContact O-N 3.17Å
696	A	96.3	Very high	95.1	Very high	9 Å²	9	55.5 Å²	55.5	7%	0.074	27%	0.27	C	S	.	.	H	α-helix	trans	-58	-50.6	177.2	0	0	0	0	0	111.8	I669 E672 E692 L693 S698 T699	I669-A696 HydrophobicContact CG1-CB 4.22Å; E672-A696 HydrophobicContact CG-CB 4.35Å; E692-A696 WeakPolarHBondContact O-CB 3.36Å; E692-A696 PolarHBondContact O-N 3.48Å; L693-A696 PolarHBondContact O-N 3.02Å; A696-S698 PolarHBondContact O-N 2.62Å; A696-T699 WeakPolarHBondContact O-CB 3.34Å; A696-T699 PolarHBondContact O-N 3.38Å; A696-T699 PolarHBondContact O-OG1 3.46Å
697	F	96.7	Very high	95.1	Very high	4 Å²	4	56.4 Å²	56.4	2%	0.018	27%	0.269	C	S	.	.	H	α-helix	trans	-60.6	-44.3	-179.6	-169.9	-104.3	0	0	0	112.5	I669 L693 K694 T699 K700 H701 Y704 F715 F718 F719	I669-F697 HydrophobicContact CD1-CD2 4.05Å; I669-F697 HydrophobicContact CG1-CB 4.45Å; I669-F697 HydrophobicContact CG1-CD2 4.44Å; I669-F697 HydrophobicContact CG2-CD2 4.29Å; L693-F697 VanDerWaalsContact O-CB 3.27Å; L693-F697 WeakPolarHBondContact O-CB 3.48Å; L693-F697 PolarHBondContact O-N 3.15Å; K694-F697 PolarHBondContact O-N 2.86Å; F697-T699 PolarHBondContact O-N 3.29Å; F697-K700 PolarHBondContact O-N 2.87Å; F697-K700 VanDerWaalsContact O-N 3.1Å; F697-H701 HydrophobicContact CD1-CB 4.46Å; F697-H701 AromaticContact CD2-CD2 3.7Å; F697-H701 HydrophobicContact CE1-CB 4.11Å; F697-H701 AromaticContact CE1-CD2 3.97Å; F697-H701 AromaticContact CE2-CD2 3.26Å; F697-H701 WeakPolarHBondContact CE2-CD2 3.4Å; F697-H701 AromaticContact CE2-NE2 3.74Å; F697-H701 HydrophobicContact CZ-CB 4.32Å; F697-H701 AromaticContact CZ-CD2 3.43Å; F697-H701 VanDerWaalsContact CZ-CD2 3.43Å; F697-H701 WeakPolarHBondContact CZ-CD2 3.26Å; F697-H701 PolarHBondContact O-N 3.47Å; F697-Y704 HydrophobicContact CD1-CD2 4.16Å; F697-Y704 HydrophobicContact CD1-CG 4.03Å; F697-Y704 HydrophobicContact CE1-CD1 4.1Å; F697-Y704 AromaticContact CE1-CD2 3.46Å; F697-Y704 HydrophobicContact CE1-CD2 3.46Å; F697-Y704 VanDerWaalsContact CE1-CD2 3.46Å; F697-Y704 HydrophobicContact CE1-CE1 4.4Å; F697-Y704 AromaticContact CE1-CE2 3.82Å; F697-Y704 HydrophobicContact CE1-CE2 3.82Å; F697-Y704 AromaticContact CE1-CG 3.62Å; F697-Y704 HydrophobicContact CE1-CG 3.62Å; F697-Y704 HydrophobicContact CZ-CD2 4.35Å; F697-Y704 HydrophobicContact CZ-CE2 4.35Å; F697-F715 HydrophobicContact CD1-CD2 4.27Å; F697-F715 AromaticContact CD1-CE2 3.84Å; F697-F715 HydrophobicContact CD1-CE2 3.84Å; F697-F715 HydrophobicContact CD2-CE2 4.43Å; F697-F715 AromaticContact CE1-CD2 3.5Å; F697-F715 HydrophobicContact CE1-CD2 3.5Å; F697-F715 AromaticContact CE1-CE2 3.45Å; F697-F715 HydrophobicContact CE1-CE2 3.45Å; F697-F715 VanDerWaalsContact CE1-CE2 3.45Å; F697-F715 HydrophobicContact CE2-CE2 4.11Å; F697-F715 HydrophobicContact CG-CE2 4.3Å; F697-F715 AromaticContact CZ-CD2 3.69Å; F697-F715 HydrophobicContact CZ-CD2 3.69Å; F697-F715 AromaticContact CZ-CE2 3.59Å; F697-F715 HydrophobicContact CZ-CE2 3.59Å; F697-F718 HydrophobicContact CE2-CB 4.41Å; F697-F718 HydrophobicContact CZ-CB 3.84Å; F697-F719 AromaticContact CD2-CD2 3.83Å; F697-F719 HydrophobicContact CD2-CD2 3.83Å; F697-F719 HydrophobicContact CD2-CE2 4.43Å; F697-F719 HydrophobicContact CE2-CB 4.17Å; F697-F719 AromaticContact CE2-CD2 3.77Å; F697-F719 HydrophobicContact CE2-CD2 3.77Å; F697-F719 HydrophobicContact CE2-CG 4.49Å
698	S	95.5	Very high	95	Very high	19 Å²	19	58.1 Å²	58.1	13%	0.133	28%	0.277	C	S	.	.	H	α-helix	trans	-59	-26.1	175.4	-58.1	0	0	0	0	113.3	K694 R695 A696 K700 Y704	K694-S698 VanDerWaalsContact O-CB 3.27Å; K694-S698 WeakPolarHBondContact O-CB 3.41Å; K694-S698 PolarHBondContact O-N 3.19Å; K694-S698 PolarHBondContact O-OG 2.85Å; R695-S698 PolarHBondContact O-N 3.15Å; A696-S698 PolarHBondContact O-N 2.62Å; S698-K700 VanDerWaalsContact C-N 3.35Å; S698-Y704 PolarHBondContact OG-O 2.99Å
699	T	94.5	Very high	94.9	Very high	58 Å²	58	60.9 Å²	60.9	36%	0.356	29%	0.289	S	S	.	.	H	α-helix	trans	-69.9	-30.8	177.4	77.6	0	0	0	0	112.9	K665 R695 A696 F697	K665-T699 WeakPolarHBondContact CE-O 3.32Å; K665-T699 PolarHBondContact NZ-O 2.95Å; R695-T699 WeakPolarHBondContact O-CG2 3.3Å; R695-T699 PolarHBondContact O-N 3.17Å; A696-T699 WeakPolarHBondContact O-CB 3.34Å; A696-T699 PolarHBondContact O-N 3.38Å; A696-T699 PolarHBondContact O-OG1 3.46Å; F697-T699 PolarHBondContact O-N 3.29Å
700	K	94.9	Very high	94.8	Very high	54 Å²	54	59.9 Å²	59.9	24%	0.235	28%	0.279	C	S	.	.	H	α-helix	trans	-86.2	-56.3	173.8	-177.2	177.6	168.7	-167.6	0	109.4	K665 D666 I669 F697 S698 R702 D721 S722	K665-K700 HydrophobicContact CB-CB 4.23Å; K665-K700 HydrophobicContact CD-CB 4.11Å; D666-K700 WeakPolarHBondContact OD1-CD 3.49Å; D666-K700 WeakPolarHBondContact OD1-CE 3.49Å; D666-K700 IonicContact OD1-NZ 2.72Å; D666-K700 PolarHBondContact OD1-NZ 3.44Å; D666-K700 IonicContact OD2-NZ 2.91Å; I669-K700 HydrophobicContact CD1-CB 4.08Å; I669-K700 HydrophobicContact CD1-CD 4.16Å; F697-K700 PolarHBondContact O-N 2.87Å; F697-K700 VanDerWaalsContact O-N 3.1Å; S698-K700 VanDerWaalsContact C-N 3.35Å; K700-R702 PolarHBondContact O-N 3.11Å; K700-D721 IonicContact NZ-OD2 2.76Å; K700-D721 PolarHBondContact NZ-OD2 2.83Å; K700-S722 PolarHBondContact NZ-OG 2.95Å
701	H	94.9	Very high	94.7	Very high	21 Å²	21	61.3 Å²	61.3	10%	0.097	29%	0.287	C	S	.	.			trans	-101.8	85.9	-169.6	-56.8	-70.4	0	0	0	111.2	F697 M703 Y704 F718 S722	F697-H701 HydrophobicContact CD1-CB 4.46Å; F697-H701 AromaticContact CD2-CD2 3.7Å; F697-H701 HydrophobicContact CE1-CB 4.11Å; F697-H701 AromaticContact CE1-CD2 3.97Å; F697-H701 AromaticContact CE2-CD2 3.26Å; F697-H701 WeakPolarHBondContact CE2-CD2 3.4Å; F697-H701 AromaticContact CE2-NE2 3.74Å; F697-H701 HydrophobicContact CZ-CB 4.32Å; F697-H701 AromaticContact CZ-CD2 3.43Å; F697-H701 VanDerWaalsContact CZ-CD2 3.43Å; F697-H701 WeakPolarHBondContact CZ-CD2 3.26Å; F697-H701 PolarHBondContact O-N 3.47Å; H701-M703 PolarHBondContact O-N 2.83Å; H701-Y704 HydrophobicContact CB-CD2 3.64Å; H701-Y704 HydrophobicContact CB-CE2 4.16Å; H701-Y704 PolarHBondContact O-N 3.32Å; H701-F718 AromaticContact CE1-CD1 3.58Å; H701-F718 AromaticContact CE1-CG 3.96Å; H701-F718 AromaticContact ND1-CD1 3.78Å; H701-F718 PolarHBondContact NE2-O 2.93Å; H701-S722 PolarHBondContact NE2-OG 3.15Å
702	R	92.3	Very high	94.7	Very high	207 Å²	207	58 Å²	58	78%	0.781	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-57.5	-24.6	-170.7	-72.7	-173.5	62	-171.2	-4.3	115.7	K700 Y704 S705	K700-R702 PolarHBondContact O-N 3.11Å; R702-Y704 PolarHBondContact O-N 3.36Å; R702-S705 PolarHBondContact O-N 3.5Å; R702-S705 PolarHBondContact O-OG 3.24Å
703	M	92.1	Very high	94.8	Very high	75 Å²	75	56 Å²	56	37%	0.369	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-65	-17.4	175.8	65.4	-159.3	-77.2	0	0	113.6	H701 Q710 E714 F718	H701-M703 PolarHBondContact O-N 2.83Å; M703-Q710 PolarHBondContact O-NE2 3.15Å; M703-E714 VanDerWaalsContact CE-CD 3.47Å; M703-E714 WeakPolarHBondContact CE-OE1 3.44Å; M703-E714 WeakPolarHBondContact CE-OE2 3.18Å; M703-F718 HydrophobicContact SD-CE2 4.05Å
704	Y	93.5	Very high	94.7	Very high	9 Å²	9	59.1 Å²	59.1	4%	0.035	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-97.8	5.3	177.9	-59.1	-87.7	0	0	0	113.6	F635 K694 F697 S698 H701 R702 D706 Q710 F715 F718	F635-Y704 HydrophobicContact CD2-CE1 4.5Å; F635-Y704 AromaticContact CE2-CD1 3.73Å; F635-Y704 HydrophobicContact CE2-CD1 3.73Å; F635-Y704 AromaticContact CE2-CE1 3.6Å; F635-Y704 HydrophobicContact CE2-CE1 3.6Å; F635-Y704 AromaticContact CZ-CD1 3.81Å; F635-Y704 HydrophobicContact CZ-CD1 3.81Å; F635-Y704 HydrophobicContact CZ-CE1 4.07Å; K694-Y704 PolarHBondContact NZ-O 2.96Å; F697-Y704 HydrophobicContact CD1-CD2 4.16Å; F697-Y704 HydrophobicContact CD1-CG 4.03Å; F697-Y704 HydrophobicContact CE1-CD1 4.1Å; F697-Y704 AromaticContact CE1-CD2 3.46Å; F697-Y704 HydrophobicContact CE1-CD2 3.46Å; F697-Y704 VanDerWaalsContact CE1-CD2 3.46Å; F697-Y704 HydrophobicContact CE1-CE1 4.4Å; F697-Y704 AromaticContact CE1-CE2 3.82Å; F697-Y704 HydrophobicContact CE1-CE2 3.82Å; F697-Y704 AromaticContact CE1-CG 3.62Å; F697-Y704 HydrophobicContact CE1-CG 3.62Å; F697-Y704 HydrophobicContact CZ-CD2 4.35Å; F697-Y704 HydrophobicContact CZ-CE2 4.35Å; S698-Y704 PolarHBondContact OG-O 2.99Å; H701-Y704 HydrophobicContact CB-CD2 3.64Å; H701-Y704 HydrophobicContact CB-CE2 4.16Å; H701-Y704 PolarHBondContact O-N 3.32Å; R702-Y704 PolarHBondContact O-N 3.36Å; Y704-D706 VanDerWaalsContact C-N 3.25Å; Y704-D706 PolarHBondContact O-N 3.3Å; Y704-Q710 HydrophobicContact CD1-CB 4.38Å; Y704-Q710 HydrophobicContact CD1-CG 3.91Å; Y704-Q710 HydrophobicContact CE1-CB 3.82Å; Y704-Q710 HydrophobicContact CE1-CG 3.78Å; Y704-F715 HydrophobicContact CD1-CD2 4.37Å; Y704-F715 HydrophobicContact CE1-CB 4.05Å; Y704-F715 HydrophobicContact CE1-CD2 4.03Å; Y704-F715 WeakPolarHBondContact OH-CA 3.4Å; Y704-F715 PolarHBondContact OH-N 3.47Å; Y704-F718 HydrophobicContact CE2-CD2 4.07Å
705	S	91.4	Very high	94.8	Very high	54 Å²	54	58.7 Å²	58.7	38%	0.378	27%	0.274	S	S	.	.	S	Bend	trans	-61	-39.1	173.8	53.8	0	0	0	0	112.1	K694 R702	K694-S705 PolarHBondContact NZ-O 3.16Å; K694-S705 VanDerWaalsContact NZ-O 3.1Å; R702-S705 PolarHBondContact O-N 3.5Å; R702-S705 PolarHBondContact O-OG 3.24Å
706	D	91.6	Very high	94.9	Very high	88 Å²	88	51.3 Å²	51.3	47%	0.471	25%	0.246	S	C	.	.	S	Bend	trans	-83	-173.6	-167.7	-58	0.4	0	0	0	111.5	K694 Y704	K694-D706 PolarHBondContact NZ-O 2.84Å; Y704-D706 VanDerWaalsContact C-N 3.25Å; Y704-D706 PolarHBondContact O-N 3.3Å
707	Y	93.3	Very high	94.9	Very high	139 Å²	139	56 Å²	56	55%	0.545	26%	0.262	S	S	.	.	S	Bend	trans	-113.2	32.6	-179.7	-55.6	-75.8	0	0	0	111.5	I630 N632	I630-Y707 WeakPolarHBondContact O-CD1 3.23Å; I630-Y707 VanDerWaalsContact O-CE1 3.31Å; I630-Y707 WeakPolarHBondContact O-CE1 3.45Å; N632-Y707 WeakPolarHBondContact CB-O 3.28Å; N632-Y707 PolarHBondContact ND2-O 3.25Å
708	N	93.9	Very high	95	Very high	94 Å²	94	59.1 Å²	59.1	50%	0.503	28%	0.276	S	S	.	.			trans	-84.5	154.4	174.4	-61.9	-34.9	0	0	0	109.9
709	Q	93.7	Very high	95.1	Very high	68 Å²	68	58.2 Å²	58.2	32%	0.318	27%	0.269	S	S	.	.			trans	-70.6	148.2	167.1	-63.3	-171.2	-4.2	0	0	109.8	N632 G906	N632-Q709 HydrophobicContact CB-CG 3.65Å; N632-Q709 VanDerWaalsContact CG-CG 3.46Å; N632-Q709 VanDerWaalsContact OD1-CG 3.31Å; N632-Q709 WeakPolarHBondContact OD1-CG 3.4Å; N632-Q709 PolarHBondContact OD1-NE2 2.8Å; Q709-G906 PolarHBondContact NE2-O 3.4Å; Q709-G906 PolarHBondContact OE1-O 2.92Å
710	Q	94.9	Very high	95.3	Very high	45 Å²	45	55.7 Å²	55.7	21%	0.21	25%	0.254	C	S	.	.			trans	-138.2	168.3	-178.4	-60.1	-67	8.3	0	0	110	F635 M703 Y704	F635-Q710 HydrophobicContact CD1-CB 4.08Å; F635-Q710 HydrophobicContact CD2-CB 4.02Å; F635-Q710 HydrophobicContact CE1-CB 3.89Å; F635-Q710 HydrophobicContact CE1-CG 4.08Å; F635-Q710 HydrophobicContact CE2-CB 3.87Å; F635-Q710 HydrophobicContact CE2-CG 4.37Å; F635-Q710 HydrophobicContact CG-CB 4.16Å; F635-Q710 HydrophobicContact CZ-CB 3.81Å; F635-Q710 HydrophobicContact CZ-CG 3.92Å; M703-Q710 PolarHBondContact O-NE2 3.15Å; Y704-Q710 HydrophobicContact CD1-CB 4.38Å; Y704-Q710 HydrophobicContact CD1-CG 3.91Å; Y704-Q710 HydrophobicContact CE1-CB 3.82Å; Y704-Q710 HydrophobicContact CE1-CG 3.78Å
711	D	95.1	Very high	95.4	Very high	35 Å²	35	56.2 Å²	56.2	19%	0.187	26%	0.259	C	S	.	.			trans	-77.4	135.5	175.5	-169.1	-81.1	0	0	0	111.9	Q713 E714 F715 F855 Y943	D711-Q713 WeakPolarHBondContact OD1-CA 3.35Å; D711-Q713 WeakPolarHBondContact OD1-CB 3.29Å; D711-Q713 PolarHBondContact OD1-N 2.91Å; D711-E714 HydrophobicContact CB-CB 3.95Å; D711-E714 PolarHBondContact OD1-N 2.69Å; D711-E714 VanDerWaalsContact OD1-N 3.08Å; D711-F715 WeakPolarHBondContact O-CB 3.46Å; D711-F715 PolarHBondContact O-N 2.92Å; D711-F715 VanDerWaalsContact O-N 3.07Å; D711-F855 WeakPolarHBondContact OD2-CD2 3.19Å; D711-F855 WeakPolarHBondContact OD2-CE2 3.26Å; D711-Y943 PolarHBondContact OD1-OH 2.96Å; D711-Y943 PolarHBondContact OD2-OH 3.25Å; D711-Y943 VanDerWaalsContact OD2-OH 3.06Å
712	A	97.4	Very high	95.5	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-72.7	-31.8	-179.4	0	0	0	0	0	113.4	F635 V639 L716 Y908 Y943 I944	F635-A712 HydrophobicContact CB-CB 4.2Å; V639-A712 HydrophobicContact CG2-CB 3.97Å; V639-A712 WeakPolarHBondContact CG2-O 3.24Å; A712-L716 VanDerWaalsContact O-CB 3.27Å; A712-L716 WeakPolarHBondContact O-CB 3.18Å; A712-L716 PolarHBondContact O-N 3.22Å; A712-Y908 HydrophobicContact CB-CD1 3.83Å; A712-Y908 HydrophobicContact CB-CE1 3.38Å; A712-Y908 PolarHBondContact N-OH 3.43Å; A712-Y943 HydrophobicContact CB-CE1 4.39Å; A712-I944 HydrophobicContact CB-CD1 4.04Å
713	Q	97.4	Very high	95.7	Very high	25 Å²	25	45.4 Å²	45.4	12%	0.117	22%	0.218	C	C	.	.	H	α-helix	trans	-77	-37	177.8	-173.3	-97.4	16.6	0	0	111	D711 L716 R717 D792 S794 H851 Y943 I944	D711-Q713 WeakPolarHBondContact OD1-CA 3.35Å; D711-Q713 WeakPolarHBondContact OD1-CB 3.29Å; D711-Q713 PolarHBondContact OD1-N 2.91Å; Q713-L716 PolarHBondContact O-N 2.97Å; Q713-R717 VanDerWaalsContact NE2-CD 3.29Å; Q713-R717 WeakPolarHBondContact O-CG 3.31Å; Q713-R717 PolarHBondContact O-N 2.75Å; Q713-D792 PolarHBondContact NE2-OD2 3.19Å; Q713-S794 PolarHBondContact NE2-OG 3.05Å; Q713-H851 HydrophobicContact CG-CB 3.9Å; Q713-H851 PolarHBondContact NE2-ND1 3.4Å; Q713-Y943 HydrophobicContact CB-CE1 4.37Å; Q713-I944 HydrophobicContact CB-CD1 3.88Å; Q713-I944 HydrophobicContact CB-CG1 4.46Å
714	E	96.8	Very high	95.9	Very high	69 Å²	69	42.4 Å²	42.4	32%	0.322	20%	0.203	S	C	.	.	H	α-helix	trans	-62	-46.4	171.3	-171.4	178.7	-146.1	0	0	111	M703 D711 R717 F718	M703-E714 VanDerWaalsContact CE-CD 3.47Å; M703-E714 WeakPolarHBondContact CE-OE1 3.44Å; M703-E714 WeakPolarHBondContact CE-OE2 3.18Å; D711-E714 HydrophobicContact CB-CB 3.95Å; D711-E714 PolarHBondContact OD1-N 2.69Å; D711-E714 VanDerWaalsContact OD1-N 3.08Å; E714-R717 PolarHBondContact O-N 2.81Å; E714-F718 HydrophobicContact CG-CD2 3.78Å; E714-F718 HydrophobicContact CG-CE2 3.54Å; E714-F718 WeakPolarHBondContact O-CD2 3.41Å; E714-F718 PolarHBondContact O-N 2.83Å; E714-F718 VanDerWaalsContact O-N 3.09Å
715	F	98.1	Very high	96	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.009	22%	0.219	C	C	.	.	H	α-helix	trans	-58.6	-49.1	174	171.6	-100.9	0	0	0	111.7	F635 M636 V639 F697 Y704 D711 R717 F718 F719	F635-F715 HydrophobicContact CD2-CB 3.74Å; F635-F715 HydrophobicContact CD2-CD1 4.49Å; F635-F715 HydrophobicContact CD2-CD2 4.47Å; F635-F715 AromaticContact CD2-CG 3.97Å; F635-F715 HydrophobicContact CD2-CG 3.97Å; F635-F715 HydrophobicContact CE2-CB 3.92Å; F635-F715 AromaticContact CE2-CD2 3.96Å; F635-F715 HydrophobicContact CE2-CD2 3.96Å; F635-F715 AromaticContact CE2-CG 3.92Å; F635-F715 HydrophobicContact CE2-CG 3.92Å; M636-F715 HydrophobicContact CB-CE1 4.26Å; M636-F715 HydrophobicContact CB-CE2 4.42Å; M636-F715 HydrophobicContact CB-CZ 4.25Å; M636-F715 HydrophobicContact CG-CE1 3.95Å; M636-F715 HydrophobicContact CG-CE2 3.89Å; M636-F715 HydrophobicContact CG-CZ 3.56Å; V639-F715 HydrophobicContact CB-CD1 3.73Å; V639-F715 HydrophobicContact CB-CE1 3.82Å; V639-F715 HydrophobicContact CG1-CD1 3.74Å; V639-F715 HydrophobicContact CG1-CE1 3.66Å; V639-F715 HydrophobicContact CG2-CD1 4.05Å; F697-F715 HydrophobicContact CD1-CD2 4.27Å; F697-F715 AromaticContact CD1-CE2 3.84Å; F697-F715 HydrophobicContact CD1-CE2 3.84Å; F697-F715 HydrophobicContact CD2-CE2 4.43Å; F697-F715 AromaticContact CE1-CD2 3.5Å; F697-F715 HydrophobicContact CE1-CD2 3.5Å; F697-F715 AromaticContact CE1-CE2 3.45Å; F697-F715 HydrophobicContact CE1-CE2 3.45Å; F697-F715 VanDerWaalsContact CE1-CE2 3.45Å; F697-F715 HydrophobicContact CE2-CE2 4.11Å; F697-F715 HydrophobicContact CG-CE2 4.3Å; F697-F715 AromaticContact CZ-CD2 3.69Å; F697-F715 HydrophobicContact CZ-CD2 3.69Å; F697-F715 AromaticContact CZ-CE2 3.59Å; F697-F715 HydrophobicContact CZ-CE2 3.59Å; Y704-F715 HydrophobicContact CD1-CD2 4.37Å; Y704-F715 HydrophobicContact CE1-CB 4.05Å; Y704-F715 HydrophobicContact CE1-CD2 4.03Å; Y704-F715 WeakPolarHBondContact OH-CA 3.4Å; Y704-F715 PolarHBondContact OH-N 3.47Å; D711-F715 WeakPolarHBondContact O-CB 3.46Å; D711-F715 PolarHBondContact O-N 2.92Å; D711-F715 VanDerWaalsContact O-N 3.07Å; F715-R717 VanDerWaalsContact C-N 3.3Å; F715-R717 PolarHBondContact O-N 2.84Å; F715-F718 PolarHBondContact O-N 3.13Å; F715-F719 HydrophobicContact CE1-CB 4.21Å; F715-F719 HydrophobicContact CE1-CD2 4.47Å; F715-F719 HydrophobicContact CE1-CG 4.22Å; F715-F719 HydrophobicContact CE2-CB 4.32Å; F715-F719 HydrophobicContact CE2-CD2 4.07Å; F715-F719 HydrophobicContact CE2-CG 4.43Å; F715-F719 HydrophobicContact CZ-CB 3.99Å; F715-F719 AromaticContact CZ-CD2 3.62Å; F715-F719 HydrophobicContact CZ-CD2 3.62Å; F715-F719 HydrophobicContact CZ-CE2 4.21Å; F715-F719 AromaticContact CZ-CG 3.8Å; F715-F719 HydrophobicContact CZ-CG 3.8Å; F715-F719 WeakPolarHBondContact O-CB 3.19Å; F715-F719 PolarHBondContact O-N 2.99Å
716	L	98.5	Very high	96.2	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.016	20%	0.204	C	C	.	.	H	α-helix	trans	-53.8	-45.6	178.2	173.2	63.9	0	0	0	111.7	V639 L643 A712 Q713 F719 L720 V849 I944 F946	V639-L716 HydrophobicContact CG1-CB 3.96Å; V639-L716 HydrophobicContact CG1-CD1 3.71Å; V639-L716 HydrophobicContact CG1-CG 4.4Å; V639-L716 HydrophobicContact CG2-CB 4.3Å; L643-L716 HydrophobicContact CD1-CD1 3.99Å; L643-L716 HydrophobicContact CD2-CD1 4.13Å; L643-L716 HydrophobicContact CG-CD1 4.28Å; A712-L716 VanDerWaalsContact O-CB 3.27Å; A712-L716 WeakPolarHBondContact O-CB 3.18Å; A712-L716 PolarHBondContact O-N 3.22Å; Q713-L716 PolarHBondContact O-N 2.97Å; L716-F719 PolarHBondContact O-N 2.82Å; L716-L720 HydrophobicContact CD1-CD1 3.78Å; L716-L720 HydrophobicContact CD1-CG 3.89Å; L716-L720 HydrophobicContact CG-CD1 4.12Å; L716-L720 HydrophobicContact CG-CG 4.49Å; L716-L720 WeakPolarHBondContact O-CB 3.37Å; L716-L720 WeakPolarHBondContact O-CG 3.37Å; L716-L720 PolarHBondContact O-N 3.01Å; L716-V849 HydrophobicContact CD2-CG1 3.86Å; L716-I944 HydrophobicContact CD2-CD1 4.39Å; L716-I944 HydrophobicContact CD2-CG2 4.36Å; L716-F946 HydrophobicContact CD1-CE1 4.32Å; L716-F946 HydrophobicContact CD1-CZ 4.38Å; L716-F946 HydrophobicContact CD2-CE1 4.14Å; L716-F946 HydrophobicContact CD2-CZ 3.86Å
717	R	97.3	Very high	96.3	Very high	108 Å²	108	39.8 Å²	39.8	41%	0.408	19%	0.19	S	C	.	.	H	α-helix	trans	-65.9	-47.2	-179.8	-73.4	176.6	59.3	84.6	5.9	112.3	Q713 E714 F715 F719 D721 D792	Q713-R717 VanDerWaalsContact NE2-CD 3.29Å; Q713-R717 WeakPolarHBondContact O-CG 3.31Å; Q713-R717 PolarHBondContact O-N 2.75Å; E714-R717 PolarHBondContact O-N 2.81Å; F715-R717 VanDerWaalsContact C-N 3.3Å; F715-R717 PolarHBondContact O-N 2.84Å; R717-F719 VanDerWaalsContact C-N 3.26Å; R717-F719 PolarHBondContact O-N 2.85Å; R717-D721 WeakPolarHBondContact O-CB 2.95Å; R717-D721 PolarHBondContact O-N 2.72Å; R717-D792 WeakPolarHBondContact CD-OD1 3.47Å; R717-D792 IonicContact CZ-OD1 2.72Å; R717-D792 IonicContact NH1-OD1 2.65Å; R717-D792 PolarHBondContact NH1-OD1 3.39Å
718	F	98.1	Very high	96.3	Very high	69 Å²	69	34.9 Å²	34.9	30%	0.303	17%	0.173	S	C	.	.	H	α-helix	trans	-66.5	-28	175.6	-75.3	-55.9	0	0	0	113.1	F697 H701 M703 Y704 E714 F715 S722	F697-F718 HydrophobicContact CE2-CB 4.41Å; F697-F718 HydrophobicContact CZ-CB 3.84Å; H701-F718 AromaticContact CE1-CD1 3.58Å; H701-F718 AromaticContact CE1-CG 3.96Å; H701-F718 AromaticContact ND1-CD1 3.78Å; H701-F718 PolarHBondContact NE2-O 2.93Å; M703-F718 HydrophobicContact SD-CE2 4.05Å; Y704-F718 HydrophobicContact CE2-CD2 4.07Å; E714-F718 HydrophobicContact CG-CD2 3.78Å; E714-F718 HydrophobicContact CG-CE2 3.54Å; E714-F718 WeakPolarHBondContact O-CD2 3.41Å; E714-F718 PolarHBondContact O-N 2.83Å; E714-F718 VanDerWaalsContact O-N 3.09Å; F715-F718 PolarHBondContact O-N 3.13Å; F718-S722 WeakPolarHBondContact O-CB 3.39Å; F718-S722 PolarHBondContact O-N 2.88Å; F718-S722 PolarHBondContact O-OG 3.32Å
719	F	98.3	Very high	96.3	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-73.2	-50.9	176	-163.3	-111.2	0	0	0	111.5	L643 I669 F673 L693 F697 F715 L716 R717 D721 S722 L723	L643-F719 HydrophobicContact CD1-CD1 3.64Å; L643-F719 HydrophobicContact CD1-CE1 3.93Å; I669-F719 HydrophobicContact CG2-CD2 4.28Å; I669-F719 HydrophobicContact CG2-CE2 3.88Å; F673-F719 HydrophobicContact CB-CZ 4.03Å; F673-F719 AromaticContact CD1-CE1 3.89Å; F673-F719 HydrophobicContact CD1-CE1 3.89Å; F673-F719 AromaticContact CD1-CZ 3.89Å; F673-F719 HydrophobicContact CD1-CZ 3.89Å; F673-F719 HydrophobicContact CD2-CE1 4.1Å; F673-F719 AromaticContact CD2-CZ 3.74Å; F673-F719 HydrophobicContact CD2-CZ 3.74Å; F673-F719 AromaticContact CE1-CE1 3.81Å; F673-F719 HydrophobicContact CE1-CE1 3.81Å; F673-F719 HydrophobicContact CE1-CZ 4.25Å; F673-F719 HydrophobicContact CE2-CE1 4.04Å; F673-F719 HydrophobicContact CE2-CZ 4.14Å; F673-F719 HydrophobicContact CG-CE1 4.04Å; F673-F719 AromaticContact CG-CZ 3.61Å; F673-F719 HydrophobicContact CG-CZ 3.61Å; F673-F719 AromaticContact CZ-CE1 3.9Å; F673-F719 HydrophobicContact CZ-CE1 3.9Å; F673-F719 HydrophobicContact CZ-CZ 4.38Å; L693-F719 HydrophobicContact CD1-CE2 4Å; L693-F719 HydrophobicContact CD1-CZ 4.32Å; L693-F719 HydrophobicContact CD2-CE2 4.22Å; L693-F719 HydrophobicContact CD2-CZ 4.04Å; L693-F719 HydrophobicContact CG-CE2 4.35Å; F697-F719 AromaticContact CD2-CD2 3.83Å; F697-F719 HydrophobicContact CD2-CD2 3.83Å; F697-F719 HydrophobicContact CD2-CE2 4.43Å; F697-F719 HydrophobicContact CE2-CB 4.17Å; F697-F719 AromaticContact CE2-CD2 3.77Å; F697-F719 HydrophobicContact CE2-CD2 3.77Å; F697-F719 HydrophobicContact CE2-CG 4.49Å; F715-F719 HydrophobicContact CE1-CB 4.21Å; F715-F719 HydrophobicContact CE1-CD2 4.47Å; F715-F719 HydrophobicContact CE1-CG 4.22Å; F715-F719 HydrophobicContact CE2-CB 4.32Å; F715-F719 HydrophobicContact CE2-CD2 4.07Å; F715-F719 HydrophobicContact CE2-CG 4.43Å; F715-F719 HydrophobicContact CZ-CB 3.99Å; F715-F719 AromaticContact CZ-CD2 3.62Å; F715-F719 HydrophobicContact CZ-CD2 3.62Å; F715-F719 HydrophobicContact CZ-CE2 4.21Å; F715-F719 AromaticContact CZ-CG 3.8Å; F715-F719 HydrophobicContact CZ-CG 3.8Å; F715-F719 WeakPolarHBondContact O-CB 3.19Å; F715-F719 PolarHBondContact O-N 2.99Å; L716-F719 PolarHBondContact O-N 2.82Å; R717-F719 VanDerWaalsContact C-N 3.26Å; R717-F719 PolarHBondContact O-N 2.85Å; F719-D721 VanDerWaalsContact C-N 3.35Å; F719-D721 PolarHBondContact O-N 3.4Å; F719-S722 PolarHBondContact O-N 2.75Å; F719-L723 HydrophobicContact CD1-CD1 3.94Å; F719-L723 HydrophobicContact CD1-CG 4.43Å; F719-L723 HydrophobicContact CE1-CD1 3.72Å; F719-L723 HydrophobicContact CE1-CG 4.31Å; F719-L723 HydrophobicContact CZ-CD1 4.41Å; F719-L723 WeakPolarHBondContact O-CG 3.45Å; F719-L723 PolarHBondContact O-N 2.88Å
720	L	98.1	Very high	96.1	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.021	17%	0.173	C	C	.	.	H	α-helix	trans	-60.4	-40.5	175.1	-68.7	179.3	0	0	0	112.1	L643 L716 S722 L723 H724 V763 F767 W791	L643-L720 HydrophobicContact CD1-CD2 4.38Å; L643-L720 HydrophobicContact CD2-CD2 4.13Å; L716-L720 HydrophobicContact CD1-CD1 3.78Å; L716-L720 HydrophobicContact CD1-CG 3.89Å; L716-L720 HydrophobicContact CG-CD1 4.12Å; L716-L720 HydrophobicContact CG-CG 4.49Å; L716-L720 WeakPolarHBondContact O-CB 3.37Å; L716-L720 WeakPolarHBondContact O-CG 3.37Å; L716-L720 PolarHBondContact O-N 3.01Å; L720-S722 VanDerWaalsContact C-N 3.26Å; L720-S722 PolarHBondContact O-N 2.81Å; L720-L723 PolarHBondContact O-N 2.84Å; L720-H724 WeakPolarHBondContact O-CB 3.26Å; L720-H724 PolarHBondContact O-N 3.44Å; L720-V763 HydrophobicContact CB-CG1 4.34Å; L720-V763 HydrophobicContact CD2-CG1 3.78Å; L720-F767 HydrophobicContact CD1-CG 4.42Å; L720-F767 HydrophobicContact CD2-CD2 4.12Å; L720-F767 HydrophobicContact CD2-CE2 3.97Å; L720-F767 HydrophobicContact CD2-CZ 4.42Å; L720-W791 HydrophobicContact CB-CE3 3.96Å; L720-W791 HydrophobicContact CB-CZ3 4.03Å; L720-W791 HydrophobicContact CD1-CE3 4.33Å
721	D	96.9	Very high	95.5	Very high	65 Å²	65	34.3 Å²	34.3	35%	0.348	19%	0.188	S	C	.	.	H	α-helix	trans	-55.6	-39.2	171	166.2	81.3	0	0	0	112.8	K700 R717 F719 S725	K700-D721 IonicContact NZ-OD2 2.76Å; K700-D721 PolarHBondContact NZ-OD2 2.83Å; R717-D721 WeakPolarHBondContact O-CB 2.95Å; R717-D721 PolarHBondContact O-N 2.72Å; F719-D721 VanDerWaalsContact C-N 3.35Å; F719-D721 PolarHBondContact O-N 3.4Å; D721-S725 VanDerWaalsContact O-CB 3.23Å; D721-S725 WeakPolarHBondContact O-CB 3.45Å; D721-S725 PolarHBondContact O-N 3.48Å; D721-S725 PolarHBondContact O-OG 3.38Å
722	S	96.9	Very high	94.8	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-77.6	-40.6	-177.3	-52	0	0	0	0	111.7	D666 K700 H701 F718 F719 L720 H724 S725 A726	D666-S722 VanDerWaalsContact OD1-CA 3.31Å; D666-S722 WeakPolarHBondContact OD1-CA 3.12Å; D666-S722 WeakPolarHBondContact OD1-CB 3.42Å; K700-S722 PolarHBondContact NZ-OG 2.95Å; H701-S722 PolarHBondContact NE2-OG 3.15Å; F718-S722 WeakPolarHBondContact O-CB 3.39Å; F718-S722 PolarHBondContact O-N 2.88Å; F718-S722 PolarHBondContact O-OG 3.32Å; F719-S722 PolarHBondContact O-N 2.75Å; L720-S722 VanDerWaalsContact C-N 3.26Å; L720-S722 PolarHBondContact O-N 2.81Å; S722-H724 VanDerWaalsContact C-N 3.31Å; S722-S725 PolarHBondContact O-N 2.78Å; S722-A726 WeakPolarHBondContact O-CB 3.19Å; S722-A726 PolarHBondContact O-N 3.07Å
723	L	97	Very high	93.3	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-63.8	-39.5	171.6	-61.9	-179.3	0	0	0	111.4	I669 L670 F673 F719 L720 A726 L727 V763	I669-L723 HydrophobicContact CG2-CD2 4.44Å; L670-L723 HydrophobicContact CB-CD2 4.31Å; L670-L723 HydrophobicContact CD1-CD2 3.96Å; F673-L723 HydrophobicContact CB-CD2 4.36Å; F673-L723 HydrophobicContact CD1-CD1 3.65Å; F673-L723 HydrophobicContact CD1-CD2 3.68Å; F673-L723 HydrophobicContact CD1-CG 4.31Å; F673-L723 HydrophobicContact CE1-CD1 3.57Å; F673-L723 HydrophobicContact CE1-CD2 4.46Å; F673-L723 HydrophobicContact CG-CD2 4.43Å; F719-L723 HydrophobicContact CD1-CD1 3.94Å; F719-L723 HydrophobicContact CD1-CG 4.43Å; F719-L723 HydrophobicContact CE1-CD1 3.72Å; F719-L723 HydrophobicContact CE1-CG 4.31Å; F719-L723 HydrophobicContact CZ-CD1 4.41Å; F719-L723 WeakPolarHBondContact O-CG 3.45Å; F719-L723 PolarHBondContact O-N 2.88Å; L720-L723 PolarHBondContact O-N 2.84Å; L723-A726 PolarHBondContact O-N 3.08Å; L723-L727 WeakPolarHBondContact O-CB 3.2Å; L723-L727 WeakPolarHBondContact O-CG 3.46Å; L723-L727 PolarHBondContact O-N 2.98Å; L723-V763 HydrophobicContact CB-CG2 3.97Å
724	H	96.6	Very high	92.2	Very high	12 Å²	12	47.6 Å²	47.6	6%	0.056	26%	0.264	C	S	.	.	H	α-helix	trans	-61.8	-52	173.7	173.3	46.5	0	0	0	111.5	L720 S722 A726 L727 N728 E759 S761 V763 W791	L720-H724 WeakPolarHBondContact O-CB 3.26Å; L720-H724 PolarHBondContact O-N 3.44Å; S722-H724 VanDerWaalsContact C-N 3.31Å; H724-A726 PolarHBondContact O-N 2.72Å; H724-L727 CarbonylContact O-C 3.44Å; H724-L727 PolarHBondContact O-N 3.13Å; H724-N728 VanDerWaalsContact O-CB 3.32Å; H724-N728 WeakPolarHBondContact O-CB 3.4Å; H724-N728 PolarHBondContact O-N 2.91Å; H724-E759 IonicContact CE1-OE2 2.68Å; H724-E759 IonicContact NE2-OE2 2.64Å; H724-E759 PolarHBondContact NE2-OE2 3.35Å; H724-E759 VanDerWaalsContact NE2-OE2 3.17Å; H724-S761 PolarHBondContact ND1-OG 3.16Å; H724-V763 HydrophobicContact CB-CB 4.23Å; H724-V763 HydrophobicContact CB-CG2 4.35Å; H724-W791 HydrophobicContact CB-CH2 3.62Å; H724-W791 HydrophobicContact CB-CZ3 4.12Å; H724-W791 AromaticContact CD2-CH2 3.56Å; H724-W791 AromaticContact CD2-CZ2 3.77Å; H724-W791 AromaticContact CG-CH2 3.46Å; H724-W791 VanDerWaalsContact CG-CH2 3.46Å; H724-W791 AromaticContact ND1-CH2 3.98Å
725	S	95.3	Very high	91.3	Very high	54 Å²	54	48.6 Å²	48.6	38%	0.378	28%	0.275	S	S	.	.	H	α-helix	trans	-59.9	-27.7	178	-66.8	0	0	0	0	113.2	D721 S722	D721-S725 VanDerWaalsContact O-CB 3.23Å; D721-S725 WeakPolarHBondContact O-CB 3.45Å; D721-S725 PolarHBondContact O-N 3.48Å; D721-S725 PolarHBondContact O-OG 3.38Å; S722-S725 PolarHBondContact O-N 2.78Å
726	A	94.4	Very high	90.6	Very high	8 Å²	8	51.6 Å²	51.6	7%	0.066	29%	0.291	C	S	.	.	H	α-helix	trans	-78.7	-32.1	173.4	0	0	0	0	0	113.4	D666 Q667 L670 S722 L723 H724	D666-A726 HydrophobicContact CB-CB 4.04Å; D666-A726 WeakPolarHBondContact O-CB 3.19Å; Q667-A726 PolarHBondContact NE2-O 3Å; L670-A726 HydrophobicContact CB-CB 3.72Å; L670-A726 HydrophobicContact CD2-CB 3.72Å; L670-A726 HydrophobicContact CG-CB 4.29Å; S722-A726 WeakPolarHBondContact O-CB 3.19Å; S722-A726 PolarHBondContact O-N 3.07Å; L723-A726 PolarHBondContact O-N 3.08Å; H724-A726 PolarHBondContact O-N 2.72Å
727	L	94.2	Very high	90	Very high	34 Å²	34	58.7 Å²	58.7	18%	0.178	33%	0.329	C	S	.	.	H	α-helix	trans	-100.9	-2.7	-176.1	-66	174.6	0	0	0	113.8	F652 L670 L723 H724 S729 S761 L762 V763	F652-L727 HydrophobicContact CE1-CD1 3.87Å; F652-L727 HydrophobicContact CE1-CD2 3.87Å; F652-L727 HydrophobicContact CZ-CD1 4.34Å; F652-L727 HydrophobicContact CZ-CD2 3.66Å; L670-L727 HydrophobicContact CD1-CD1 4.19Å; L670-L727 HydrophobicContact CD1-CD2 4.37Å; L670-L727 HydrophobicContact CD1-CG 4.26Å; L670-L727 HydrophobicContact CD2-CD2 3.58Å; L670-L727 HydrophobicContact CD2-CG 3.94Å; L723-L727 WeakPolarHBondContact O-CB 3.2Å; L723-L727 WeakPolarHBondContact O-CG 3.46Å; L723-L727 PolarHBondContact O-N 2.98Å; H724-L727 CarbonylContact O-C 3.44Å; H724-L727 PolarHBondContact O-N 3.13Å; L727-S729 PolarHBondContact O-N 2.92Å; L727-S761 VanDerWaalsContact C-CB 3.43Å; L727-S761 VanDerWaalsContact O-CB 3.25Å; L727-S761 WeakPolarHBondContact O-CB 3.35Å; L727-L762 HydrophobicContact CD1-CB 4.46Å; L727-V763 HydrophobicContact CD1-CG2 4Å
728	N	94.4	Very high	89.4	Confident	35 Å²	35	55.9 Å²	55.9	19%	0.187	32%	0.321	C	S	.	.			trans	-74.9	120.1	-178.2	-173.1	11.4	0	0	0	111.8	H724 G730 H758 E759 N760	H724-N728 VanDerWaalsContact O-CB 3.32Å; H724-N728 WeakPolarHBondContact O-CB 3.4Å; H724-N728 PolarHBondContact O-N 2.91Å; N728-G730 WeakPolarHBondContact OD1-CA 3.16Å; N728-G730 PolarHBondContact OD1-N 3.07Å; N728-H758 PolarHBondContact ND2-O 3.45Å; N728-H758 PolarHBondContact OD1-O 3.48Å; N728-E759 PolarHBondContact ND2-OE2 3.35Å; N728-N760 WeakPolarHBondContact CA-O 3.12Å; N728-N760 PolarHBondContact OD1-N 3.15Å; N728-N760 PolarHBondContact OD1-O 3.09Å
729	S	92.8	Very high	88.8	Confident	89 Å²	89	56.6 Å²	56.6	62%	0.622	33%	0.329	S	S	*	.			trans	-108.5	5.9	176.5	59.8	0	0	0	0	113.5	L727 N760	L727-S729 PolarHBondContact O-N 2.92Å; S729-N760 PolarHBondContact N-O 3.27Å; S729-N760 PolarHBondContact OG-ND2 3.32Å; S729-N760 PolarHBondContact OG-O 3.4Å; S729-N760 VanDerWaalsContact OG-O 3.05Å
730	G	88.8	Confident	88.1	Confident	18 Å²	18	63 Å²	63	19%	0.186	36%	0.363	C	S	.	.			trans	-69.7	156.3	-175.5	0	0	0	0	0	114.4	N728 R757	N728-G730 WeakPolarHBondContact OD1-CA 3.16Å; N728-G730 PolarHBondContact OD1-N 3.07Å; G730-R757 CarbonylContact C-O 3.55Å; G730-R757 WeakPolarHBondContact CA-O 3.47Å
731	V	83.4	Confident	87.6	Confident	89 Å²	89	69.7 Å²	69.7	54%	0.539	40%	0.399	S	S	.	.			trans	-79.5	140.9	179.5	-176.5	0	0	0	0	109.2	R757 H758	V731-R757 PolarHBondContact N-O 2.96Å; V731-H758 WeakPolarHBondContact O-CA 3.43Å; V731-H758 PolarHBondContact O-CD2 3.42Å; V731-H758 PolarHBondContact O-NE2 2.97Å
732	K	80.9	Confident	87.4	Confident	174 Å²	174	69.5 Å²	69.5	76%	0.757	40%	0.397	S	S	*	.			trans	-115.4	118.1	176.9	-61.2	-173.8	-179.5	-172.3	0	110.2
733	G	64.4	Low	87.2	Confident	67 Å²	67	73.3 Å²	73.3	69%	0.691	42%	0.424	S	S	*	.			trans	155.4	-12	166.1	0	0	0	0	0	117.8
734	E	74.4	Confident	87	Confident	98 Å²	98	75.8 Å²	75.8	46%	0.458	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-90.6	125.8	-177.2	-58.1	-177.7	144.3	0	0	111	W754 R757 H758	E734-W754 PolarHBondContact O-NE1 3.06Å; E734-R757 IonicContact OE2-CZ 2.7Å; E734-R757 IonicContact OE2-NH1 2.73Å; E734-R757 PolarHBondContact OE2-NH1 2.87Å; E734-H758 PolarHBondContact N-NE2 3.41Å
735	T	78.9	Confident	86.8	Confident	89 Å²	89	78.8 Å²	78.8	55%	0.546	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-82.5	126.9	170.1	51.4	0	0	0	0	109.8	N310 N737	N310-T735 WeakPolarHBondContact OD1-CG2 3.35Å; T735-N737 PolarHBondContact O-N 2.9Å
736	L	83.6	Confident	86.7	Confident	65 Å²	65	80 Å²	80	34%	0.34	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-77	117	177.5	-175.1	59.8	0	0	0	110.4	I738 T751 W754	L736-I738 HydrophobicContact CD1-CG1 4.14Å; L736-I738 HydrophobicContact CD2-CD1 3.72Å; L736-I738 HydrophobicContact CD2-CG1 3.91Å; L736-I738 HydrophobicContact CG-CD1 4.1Å; L736-I738 HydrophobicContact CG-CG1 3.7Å; L736-T751 HydrophobicContact CD2-CG2 4.38Å; L736-W754 HydrophobicContact CB-CD2 3.88Å; L736-W754 HydrophobicContact CB-CG 3.82Å; L736-W754 HydrophobicContact CD1-CB 3.92Å; L736-W754 HydrophobicContact CD1-CG 4.03Å; L736-W754 HydrophobicContact CD2-CB 3.89Å; L736-W754 HydrophobicContact CD2-CD2 4.15Å; L736-W754 HydrophobicContact CD2-CE3 4.31Å; L736-W754 HydrophobicContact CD2-CG 3.96Å; L736-W754 HydrophobicContact CG-CB 4.33Å; L736-W754 HydrophobicContact CG-CG 4.15Å
737	N	84.4	Confident	86.7	Confident	153 Å²	153	80.6 Å²	80.6	82%	0.818	45%	0.453	S	S	*	.			trans	-111	122	168.5	-167.6	1.9	0	0	0	108.6	T735	T735-N737 PolarHBondContact O-N 2.9Å
738	I	86.3	Confident	86.8	Confident	48 Å²	48	79 Å²	79	25%	0.246	45%	0.445	C	S	.	.			trans	-116.6	126.3	-177.7	-45.2	-179.7	0	0	0	107.8	L736 D740 L742 K747 L750 T751	L736-I738 HydrophobicContact CD1-CG1 4.14Å; L736-I738 HydrophobicContact CD2-CD1 3.72Å; L736-I738 HydrophobicContact CD2-CG1 3.91Å; L736-I738 HydrophobicContact CG-CD1 4.1Å; L736-I738 HydrophobicContact CG-CG1 3.7Å; I738-D740 PolarHBondContact O-N 3.42Å; I738-L742 HydrophobicContact CG2-CD1 4Å; I738-K747 HydrophobicContact CG2-CB 4.26Å; I738-K747 HydrophobicContact CG2-CD 4.44Å; I738-K747 HydrophobicContact CG2-CG 3.82Å; I738-L750 HydrophobicContact CG2-CD1 4.41Å; I738-T751 WeakPolarHBondContact CD1-OG1 3.02Å
739	D	85.3	Confident	86.8	Confident	85 Å²	85	79.7 Å²	79.7	46%	0.455	45%	0.449	S	S	.	.			trans	-64.6	126.7	172.9	174.3	18	0	0	0	110.3	N741 L742 K747	D739-N741 PolarHBondContact O-N 3.34Å; D739-N741 PolarHBondContact OD1-N 2.85Å; D739-N741 PolarHBondContact OD1-ND2 3.43Å; D739-L742 HydrophobicContact CB-CD1 4.16Å; D739-L742 HydrophobicContact CB-CG 4.04Å; D739-L742 WeakPolarHBondContact O-CB 3.23Å; D739-L742 WeakPolarHBondContact O-CG 3.28Å; D739-L742 PolarHBondContact O-N 3.04Å; D739-K747 WeakPolarHBondContact O-CE 3.26Å
740	D	83.6	Confident	87	Confident	135 Å²	135	77.8 Å²	77.8	72%	0.722	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-15.8	-176.7	-120.2	-21.4	0	0	0	113	I738 L742 K747	I738-D740 PolarHBondContact O-N 3.42Å; D740-L742 VanDerWaalsContact C-N 3.32Å; D740-K747 WeakPolarHBondContact O-CE 3.32Å; D740-K747 PolarHBondContact O-NZ 2.9Å; D740-K747 IonicContact OD1-NZ 2.72Å; D740-K747 PolarHBondContact OD1-NZ 2.8Å
741	N	88.1	Confident	87.2	Confident	144 Å²	144	78 Å²	78	77%	0.77	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-8.4	176	-57.4	-78.3	0	0	0	113.7	D739	D739-N741 PolarHBondContact O-N 3.34Å; D739-N741 PolarHBondContact OD1-N 2.85Å; D739-N741 PolarHBondContact OD1-ND2 3.43Å
742	L	91.3	Very high	87.8	Confident	60 Å²	60	75.7 Å²	75.7	31%	0.314	41%	0.41	S	S	.	.	S	Bend	trans	-70.1	151.7	177.2	-65.4	174.3	0	0	0	112.2	I738 D739 D740 K747 L750	I738-L742 HydrophobicContact CG2-CD1 4Å; D739-L742 HydrophobicContact CB-CD1 4.16Å; D739-L742 HydrophobicContact CB-CG 4.04Å; D739-L742 WeakPolarHBondContact O-CB 3.23Å; D739-L742 WeakPolarHBondContact O-CG 3.28Å; D739-L742 PolarHBondContact O-N 3.04Å; D740-L742 VanDerWaalsContact C-N 3.32Å; L742-K747 HydrophobicContact CB-CG 3.88Å; L742-K747 VanDerWaalsContact O-CE 3.23Å; L742-K747 WeakPolarHBondContact O-CE 3.24Å; L742-L750 HydrophobicContact CD1-CD1 3.58Å
743	S	93	Very high	88.4	Confident	80 Å²	80	71.3 Å²	71.3	56%	0.559	39%	0.393	S	S	*	.			trans	-65.9	148	173.5	65.7	0	0	0	0	111.6	N745 K746 K747	S743-N745 PolarHBondContact O-N 3.1Å; S743-N745 VanDerWaalsContact O-N 3.13Å; S743-K746 PolarHBondContact O-N 2.89Å; S743-K747 PolarHBondContact O-N 3.17Å
744	D	92.4	Very high	89.8	Confident	55 Å²	55	70.3 Å²	70.3	29%	0.294	37%	0.368	S	S	.	.	H	α-helix	trans	-46.5	-45.3	178.5	-80.7	-0.1	0	0	0	112.9	K747 A748 K772 F787	D744-K747 PolarHBondContact O-N 2.79Å; D744-A748 WeakPolarHBondContact O-CB 3.35Å; D744-A748 PolarHBondContact O-N 3.16Å; D744-K772 WeakPolarHBondContact OD2-CE 3.27Å; D744-K772 IonicContact OD2-NZ 3.77Å; D744-K772 PolarHBondContact OD2-NZ 3.4Å; D744-F787 HydrophobicContact CB-CZ 4.08Å; D744-F787 VanDerWaalsContact O-CE2 3.29Å; D744-F787 WeakPolarHBondContact O-CE2 3.47Å; D744-F787 WeakPolarHBondContact O-CZ 3.29Å
745	N	92.8	Very high	90.8	Very high	74 Å²	74	66.7 Å²	66.7	40%	0.396	35%	0.35	S	S	.	.	H	α-helix	trans	-65.1	-41.1	178.7	-75.5	-18.2	0	0	0	112.2	S743 A748 D749 Q842	S743-N745 PolarHBondContact O-N 3.1Å; S743-N745 VanDerWaalsContact O-N 3.13Å; N745-A748 WeakPolarHBondContact O-CB 3.39Å; N745-A748 PolarHBondContact O-N 3.47Å; N745-D749 PolarHBondContact O-N 3.05Å; N745-Q842 PolarHBondContact OD1-NE2 2.84Å
746	K	94.1	Very high	91.4	Very high	79 Å²	79	64.3 Å²	64.3	34%	0.343	34%	0.336	S	S	.	.	H	α-helix	trans	-73.7	-29.6	177	-169.2	51.8	-176.6	163.8	0	112.6	S743 D749 L750 E753	S743-K746 PolarHBondContact O-N 2.89Å; K746-D749 HydrophobicContact CD-CB 4.15Å; K746-L750 HydrophobicContact CD-CG 4.22Å; K746-L750 HydrophobicContact CG-CD1 4.23Å; K746-L750 HydrophobicContact CG-CG 4.4Å; K746-L750 WeakPolarHBondContact O-CB 3.4Å; K746-L750 VanDerWaalsContact O-CG 3.28Å; K746-L750 WeakPolarHBondContact O-CG 3.33Å; K746-L750 PolarHBondContact O-N 3.46Å; K746-E753 IonicContact NZ-OE1 3.54Å; K746-E753 PolarHBondContact NZ-OE1 3.35Å
747	K	94.6	Very high	91.8	Very high	22 Å²	22	66.4 Å²	66.4	10%	0.096	34%	0.339	C	S	.	.	H	α-helix	trans	-61.1	-47.5	167.4	-66.2	-170.2	177.6	173.2	0	110.8	I738 D739 D740 L742 S743 D744 D749 L750 T751 F787	I738-K747 HydrophobicContact CG2-CB 4.26Å; I738-K747 HydrophobicContact CG2-CD 4.44Å; I738-K747 HydrophobicContact CG2-CG 3.82Å; D739-K747 WeakPolarHBondContact O-CE 3.26Å; D740-K747 WeakPolarHBondContact O-CE 3.32Å; D740-K747 PolarHBondContact O-NZ 2.9Å; D740-K747 IonicContact OD1-NZ 2.72Å; D740-K747 PolarHBondContact OD1-NZ 2.8Å; L742-K747 HydrophobicContact CB-CG 3.88Å; L742-K747 VanDerWaalsContact O-CE 3.23Å; L742-K747 WeakPolarHBondContact O-CE 3.24Å; S743-K747 PolarHBondContact O-N 3.17Å; D744-K747 PolarHBondContact O-N 2.79Å; K747-D749 VanDerWaalsContact C-N 3.35Å; K747-D749 PolarHBondContact O-N 3.12Å; K747-L750 PolarHBondContact O-N 2.9Å; K747-T751 PolarHBondContact O-N 3.41Å; K747-T751 PolarHBondContact O-OG1 2.83Å; K747-T751 VanDerWaalsContact O-OG1 3.05Å; K747-F787 HydrophobicContact CB-CD2 4.11Å; K747-F787 HydrophobicContact CB-CE2 3.77Å
748	A	95.3	Very high	92.2	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-57.3	-46	176.8	0	0	0	0	0	112.8	D744 N745 T751 W752 Q770 F787 Q842	D744-A748 WeakPolarHBondContact O-CB 3.35Å; D744-A748 PolarHBondContact O-N 3.16Å; N745-A748 WeakPolarHBondContact O-CB 3.39Å; N745-A748 PolarHBondContact O-N 3.47Å; A748-T751 PolarHBondContact O-N 3.31Å; A748-W752 WeakPolarHBondContact O-CB 3.23Å; A748-W752 PolarHBondContact O-N 2.73Å; A748-Q770 PolarHBondContact O-NE2 2.93Å; A748-F787 HydrophobicContact CB-CD1 3.57Å; A748-F787 HydrophobicContact CB-CD2 4.19Å; A748-F787 HydrophobicContact CB-CE1 3.52Å; A748-F787 HydrophobicContact CB-CE2 4.15Å; A748-F787 HydrophobicContact CB-CG 3.9Å; A748-F787 HydrophobicContact CB-CZ 3.83Å; A748-Q842 HydrophobicContact CB-CG 3.71Å
749	D	95.5	Very high	92.5	Very high	50 Å²	50	60.2 Å²	60.2	27%	0.267	30%	0.304	S	S	.	.	H	α-helix	trans	-64.4	-48.1	179.9	-66.1	-19.6	0	0	0	111.3	N745 K746 K747 T751 W752 E753 R843	N745-D749 PolarHBondContact O-N 3.05Å; K746-D749 HydrophobicContact CD-CB 4.15Å; K747-D749 VanDerWaalsContact C-N 3.35Å; K747-D749 PolarHBondContact O-N 3.12Å; D749-T751 VanDerWaalsContact C-N 3.35Å; D749-T751 PolarHBondContact O-N 2.92Å; D749-W752 CarbonylContact O-C 3.53Å; D749-W752 PolarHBondContact O-N 2.85Å; D749-W752 VanDerWaalsContact O-N 3.08Å; D749-E753 WeakPolarHBondContact O-CB 3.44Å; D749-E753 VanDerWaalsContact O-CG 3.23Å; D749-E753 WeakPolarHBondContact O-CG 3.43Å; D749-E753 PolarHBondContact O-N 2.87Å; D749-R843 IonicContact OD1-CZ 2.84Å; D749-R843 IonicContact OD1-NH2 2.73Å; D749-R843 PolarHBondContact OD1-NH2 2.9Å
750	L	95.1	Very high	93	Very high	48 Å²	48	59.2 Å²	59.2	25%	0.251	30%	0.299	S	S	.	.	H	α-helix	trans	-61.8	-40.7	177.9	-70.7	170.7	0	0	0	112.4	I738 L742 K746 K747 W752 W754	I738-L750 HydrophobicContact CG2-CD1 4.41Å; L742-L750 HydrophobicContact CD1-CD1 3.58Å; K746-L750 HydrophobicContact CD-CG 4.22Å; K746-L750 HydrophobicContact CG-CD1 4.23Å; K746-L750 HydrophobicContact CG-CG 4.4Å; K746-L750 WeakPolarHBondContact O-CB 3.4Å; K746-L750 VanDerWaalsContact O-CG 3.28Å; K746-L750 WeakPolarHBondContact O-CG 3.33Å; K746-L750 PolarHBondContact O-N 3.46Å; K747-L750 PolarHBondContact O-N 2.9Å; L750-W752 VanDerWaalsContact C-N 3.33Å; L750-W752 PolarHBondContact O-N 2.68Å; L750-W754 WeakPolarHBondContact O-CB 3.41Å; L750-W754 PolarHBondContact O-N 2.77Å
751	T	94.8	Very high	93.6	Very high	22 Å²	22	53 Å²	53	14%	0.135	27%	0.266	C	S	.	.	H	α-helix	trans	-62.8	-40	172.7	-56.1	0	0	0	0	111.8	L736 I738 K747 A748 D749 Y755 F787	L736-T751 HydrophobicContact CD2-CG2 4.38Å; I738-T751 WeakPolarHBondContact CD1-OG1 3.02Å; K747-T751 PolarHBondContact O-N 3.41Å; K747-T751 PolarHBondContact O-OG1 2.83Å; K747-T751 VanDerWaalsContact O-OG1 3.05Å; A748-T751 PolarHBondContact O-N 3.31Å; D749-T751 VanDerWaalsContact C-N 3.35Å; D749-T751 PolarHBondContact O-N 2.92Å; T751-Y755 WeakPolarHBondContact O-CB 3.14Å; T751-Y755 PolarHBondContact O-N 3.02Å; T751-F787 HydrophobicContact CG2-CB 4.3Å; T751-F787 WeakPolarHBondContact CG2-O 3.49Å
752	W	95.7	Very high	94	Very high	41 Å²	41	48.5 Å²	48.5	16%	0.155	24%	0.242	C	C	.	.	H	α-helix	trans	-71.8	-41	179.2	-169.5	-101	0	0	0	112.8	A748 D749 L750 Y755 T756 V768 Q770 R843	A748-W752 WeakPolarHBondContact O-CB 3.23Å; A748-W752 PolarHBondContact O-N 2.73Å; D749-W752 CarbonylContact O-C 3.53Å; D749-W752 PolarHBondContact O-N 2.85Å; D749-W752 VanDerWaalsContact O-N 3.08Å; L750-W752 VanDerWaalsContact C-N 3.33Å; L750-W752 PolarHBondContact O-N 2.68Å; W752-Y755 HydrophobicContact CE3-CD1 4.34Å; W752-Y755 HydrophobicContact CZ3-CD1 4.17Å; W752-Y755 HydrophobicContact CZ3-CE1 4.48Å; W752-Y755 PolarHBondContact O-N 3.11Å; W752-T756 PolarHBondContact NE1-OG1 2.83Å; W752-T756 VanDerWaalsContact O-CB 3.24Å; W752-T756 WeakPolarHBondContact O-CB 3.33Å; W752-T756 PolarHBondContact O-N 3.12Å; W752-T756 PolarHBondContact O-OG1 3.06Å; W752-V768 HydrophobicContact CH2-CG1 4.09Å; W752-V768 HydrophobicContact CZ3-CG1 4.24Å; W752-Q770 HydrophobicContact CE3-CB 3.88Å; W752-Q770 HydrophobicContact CE3-CG 4.2Å; W752-Q770 HydrophobicContact CZ3-CB 3.92Å; W752-R843 VanDerWaalsContact CD2-CD 3.45Å
753	E	94	Very high	94.3	Very high	83 Å²	83	45.6 Å²	45.6	39%	0.388	23%	0.227	S	C	.	.	H	α-helix	trans	-59.2	-46.5	173.8	-72.7	167.4	-138	0	0	110.9	K746 D749 R757	K746-E753 IonicContact NZ-OE1 3.54Å; K746-E753 PolarHBondContact NZ-OE1 3.35Å; D749-E753 WeakPolarHBondContact O-CB 3.44Å; D749-E753 VanDerWaalsContact O-CG 3.23Å; D749-E753 WeakPolarHBondContact O-CG 3.43Å; D749-E753 PolarHBondContact O-N 2.87Å; E753-R757 PolarHBondContact O-N 2.85Å
754	W	93.6	Very high	94.4	Very high	45 Å²	45	43.1 Å²	43.1	17%	0.17	21%	0.205	C	C	.	.	H	α-helix	trans	-65.8	-47.3	176.3	175.9	89.1	0	0	0	112.1	E734 L736 L750 T756 R757 H758	E734-W754 PolarHBondContact O-NE1 3.06Å; L736-W754 HydrophobicContact CB-CD2 3.88Å; L736-W754 HydrophobicContact CB-CG 3.82Å; L736-W754 HydrophobicContact CD1-CB 3.92Å; L736-W754 HydrophobicContact CD1-CG 4.03Å; L736-W754 HydrophobicContact CD2-CB 3.89Å; L736-W754 HydrophobicContact CD2-CD2 4.15Å; L736-W754 HydrophobicContact CD2-CE3 4.31Å; L736-W754 HydrophobicContact CD2-CG 3.96Å; L736-W754 HydrophobicContact CG-CB 4.33Å; L736-W754 HydrophobicContact CG-CG 4.15Å; L750-W754 WeakPolarHBondContact O-CB 3.41Å; L750-W754 PolarHBondContact O-N 2.77Å; W754-T756 PolarHBondContact O-N 2.82Å; W754-R757 WeakPolarHBondContact O-CB 3.49Å; W754-R757 PolarHBondContact O-N 3.08Å; W754-R757 VanDerWaalsContact O-N 3.15Å; W754-H758 AromaticContact CD1-CE1 3.49Å; W754-H758 VanDerWaalsContact CD1-CE1 3.49Å; W754-H758 AromaticContact CD1-ND1 3.74Å; W754-H758 AromaticContact CD2-ND1 3.89Å; W754-H758 AromaticContact CE2-CE1 3.61Å; W754-H758 AromaticContact CE2-ND1 3.58Å; W754-H758 AromaticContact CG-ND1 3.97Å; W754-H758 AromaticContact NE1-CE1 3.11Å; W754-H758 PolarHBondContact NE1-CE1 3.27Å; W754-H758 AromaticContact NE1-ND1 3.51Å; W754-H758 AromaticContact NE1-NE2 3.71Å; W754-H758 PolarHBondContact O-N 2.85Å; W754-H758 PolarHBondContact O-ND1 2.97Å
755	Y	94.2	Very high	94.6	Very high	22 Å²	22	44.2 Å²	44.2	9%	0.086	21%	0.211	C	C	.	.	H	α-helix	trans	-61.1	-44.5	179.4	178.2	-104.1	0	0	0	111.4	T751 W752 R757 H758 E759 R764 V768 P789	T751-Y755 WeakPolarHBondContact O-CB 3.14Å; T751-Y755 PolarHBondContact O-N 3.02Å; W752-Y755 HydrophobicContact CE3-CD1 4.34Å; W752-Y755 HydrophobicContact CZ3-CD1 4.17Å; W752-Y755 HydrophobicContact CZ3-CE1 4.48Å; W752-Y755 PolarHBondContact O-N 3.11Å; Y755-R757 PolarHBondContact O-N 3.28Å; Y755-H758 PolarHBondContact O-N 3.4Å; Y755-H758 VanDerWaalsContact O-N 3.15Å; Y755-E759 HydrophobicContact CD2-CB 4.34Å; Y755-E759 HydrophobicContact CD2-CG 3.98Å; Y755-E759 HydrophobicContact CE1-CB 4.38Å; Y755-E759 HydrophobicContact CE2-CB 3.83Å; Y755-E759 HydrophobicContact CE2-CG 3.51Å; Y755-E759 PolarHBondContact O-N 3.09Å; Y755-R764 HydrophobicContact CE1-CG 3.79Å; Y755-V768 HydrophobicContact CE1-CG1 3.77Å; Y755-P789 HydrophobicContact CD1-CB 4.3Å; Y755-P789 HydrophobicContact CD2-CB 4.36Å; Y755-P789 HydrophobicContact CD2-CG 4.02Å; Y755-P789 HydrophobicContact CE1-CB 3.95Å; Y755-P789 HydrophobicContact CE2-CB 4.01Å; Y755-P789 HydrophobicContact CE2-CG 3.77Å
756	T	92.9	Very high	94.9	Very high	39 Å²	39	40.9 Å²	40.9	24%	0.239	19%	0.193	C	C	.	.	H	α-helix	trans	-63.1	-29.7	177.6	-55.7	0	0	0	0	112.3	W752 W754 N760	W752-T756 PolarHBondContact NE1-OG1 2.83Å; W752-T756 VanDerWaalsContact O-CB 3.24Å; W752-T756 WeakPolarHBondContact O-CB 3.33Å; W752-T756 PolarHBondContact O-N 3.12Å; W752-T756 PolarHBondContact O-OG1 3.06Å; W754-T756 PolarHBondContact O-N 2.82Å; T756-N760 WeakPolarHBondContact O-CB 3.35Å
757	R	91.4	Very high	95.1	Very high	110 Å²	110	37.1 Å²	37.1	42%	0.415	18%	0.177	S	C	.	.	H	α-helix	trans	-73.9	-31.9	175.4	-168.9	-176.4	-53.9	135.3	13.3	113.4	G730 V731 E734 E753 W754 Y755	G730-R757 CarbonylContact C-O 3.55Å; G730-R757 WeakPolarHBondContact CA-O 3.47Å; V731-R757 PolarHBondContact N-O 2.96Å; E734-R757 IonicContact OE2-CZ 2.7Å; E734-R757 IonicContact OE2-NH1 2.73Å; E734-R757 PolarHBondContact OE2-NH1 2.87Å; E753-R757 PolarHBondContact O-N 2.85Å; W754-R757 WeakPolarHBondContact O-CB 3.49Å; W754-R757 PolarHBondContact O-N 3.08Å; W754-R757 VanDerWaalsContact O-N 3.15Å; Y755-R757 PolarHBondContact O-N 3.28Å
758	H	91.5	Very high	95.3	Very high	10 Å²	10	36.4 Å²	36.4	5%	0.046	17%	0.174	C	C	.	.	H	α-helix	trans	-91.7	-35.8	-176.4	-71.5	73.6	0	0	0	112.8	N728 V731 E734 W754 Y755	N728-H758 PolarHBondContact ND2-O 3.45Å; N728-H758 PolarHBondContact OD1-O 3.48Å; V731-H758 WeakPolarHBondContact O-CA 3.43Å; V731-H758 PolarHBondContact O-CD2 3.42Å; V731-H758 PolarHBondContact O-NE2 2.97Å; E734-H758 PolarHBondContact N-NE2 3.41Å; W754-H758 AromaticContact CD1-CE1 3.49Å; W754-H758 VanDerWaalsContact CD1-CE1 3.49Å; W754-H758 AromaticContact CD1-ND1 3.74Å; W754-H758 AromaticContact CD2-ND1 3.89Å; W754-H758 AromaticContact CE2-CE1 3.61Å; W754-H758 AromaticContact CE2-ND1 3.58Å; W754-H758 AromaticContact CG-ND1 3.97Å; W754-H758 AromaticContact NE1-CE1 3.11Å; W754-H758 PolarHBondContact NE1-CE1 3.27Å; W754-H758 AromaticContact NE1-ND1 3.51Å; W754-H758 AromaticContact NE1-NE2 3.71Å; W754-H758 PolarHBondContact O-N 2.85Å; W754-H758 PolarHBondContact O-ND1 2.97Å; Y755-H758 PolarHBondContact O-N 3.4Å; Y755-H758 VanDerWaalsContact O-N 3.15Å
759	E	94.1	Very high	95.3	Very high	60 Å²	60	36.4 Å²	36.4	28%	0.28	17%	0.174	S	C	.	.	S	Bend	trans	-116.4	54.2	-174.3	-55.7	-52.5	167.9	0	0	111.7	H724 N728 Y755 S761 R764	H724-E759 IonicContact CE1-OE2 2.68Å; H724-E759 IonicContact NE2-OE2 2.64Å; H724-E759 PolarHBondContact NE2-OE2 3.35Å; H724-E759 VanDerWaalsContact NE2-OE2 3.17Å; N728-E759 PolarHBondContact ND2-OE2 3.35Å; Y755-E759 HydrophobicContact CD2-CB 4.34Å; Y755-E759 HydrophobicContact CD2-CG 3.98Å; Y755-E759 HydrophobicContact CE1-CB 4.38Å; Y755-E759 HydrophobicContact CE2-CB 3.83Å; Y755-E759 HydrophobicContact CE2-CG 3.51Å; Y755-E759 PolarHBondContact O-N 3.09Å; E759-S761 PolarHBondContact O-N 3.44Å; E759-R764 WeakPolarHBondContact O-CB 3.49Å; E759-R764 VanDerWaalsContact O-CD 3.23Å; E759-R764 WeakPolarHBondContact O-CD 3.29Å; E759-R764 VanDerWaalsContact O-CG 3.26Å; E759-R764 WeakPolarHBondContact O-CG 3.38Å
760	N	94.6	Very high	95.4	Very high	64 Å²	64	34.1 Å²	34.1	34%	0.342	16%	0.162	S	C	.	.			trans	-88.1	96.4	-174.2	-171.1	37.3	0	0	0	113.3	N728 S729 T756	N728-N760 WeakPolarHBondContact CA-O 3.12Å; N728-N760 PolarHBondContact OD1-N 3.15Å; N728-N760 PolarHBondContact OD1-O 3.09Å; S729-N760 PolarHBondContact N-O 3.27Å; S729-N760 PolarHBondContact OG-ND2 3.32Å; S729-N760 PolarHBondContact OG-O 3.4Å; S729-N760 VanDerWaalsContact OG-O 3.05Å; T756-N760 WeakPolarHBondContact O-CB 3.35Å
761	S	96.4	Very high	95.5	Very high	6 Å²	6	32.7 Å²	32.7	4%	0.042	15%	0.154	C	C	.	.	S	Bend	trans	-153.8	156.8	177.4	75	0	0	0	0	112.1	H724 L727 E759 V763 R764 D765	H724-S761 PolarHBondContact ND1-OG 3.16Å; L727-S761 VanDerWaalsContact C-CB 3.43Å; L727-S761 VanDerWaalsContact O-CB 3.25Å; L727-S761 WeakPolarHBondContact O-CB 3.35Å; E759-S761 PolarHBondContact O-N 3.44Å; S761-V763 PolarHBondContact O-N 3.21Å; S761-V763 PolarHBondContact OG-N 2.92Å; S761-R764 WeakPolarHBondContact O-CA 3.35Å; S761-R764 VanDerWaalsContact O-CB 3.24Å; S761-R764 WeakPolarHBondContact O-CB 3.26Å; S761-R764 PolarHBondContact O-N 3.08Å; S761-R764 PolarHBondContact OG-N 2.99Å; S761-D765 PolarHBondContact O-N 2.74Å; S761-D765 VanDerWaalsContact O-N 3.17Å
762	L	96.3	Very high	95.6	Very high	48 Å²	48	33.3 Å²	33.3	25%	0.251	16%	0.155	S	C	.	.	H	α-helix	trans	-49.9	-35.8	173.8	179.5	63.6	0	0	0	113.6	F652 L727 R764 D765 L766	F652-L762 HydrophobicContact CB-CD2 3.51Å; F652-L762 HydrophobicContact CD1-CD2 3.64Å; F652-L762 HydrophobicContact CD2-CD2 3.89Å; F652-L762 HydrophobicContact CE1-CD2 4.32Å; F652-L762 HydrophobicContact CG-CD2 3.39Å; L727-L762 HydrophobicContact CD1-CB 4.46Å; L762-R764 VanDerWaalsContact C-N 3.25Å; L762-R764 PolarHBondContact O-N 3.37Å; L762-D765 WeakPolarHBondContact O-CB 3.36Å; L762-D765 PolarHBondContact O-N 2.95Å; L762-D765 VanDerWaalsContact O-N 3.16Å; L762-L766 HydrophobicContact CD1-CD1 4.23Å; L762-L766 HydrophobicContact CD1-CD2 4.21Å; L762-L766 HydrophobicContact CD1-CG 3.96Å; L762-L766 HydrophobicContact CG-CD1 4.19Å; L762-L766 HydrophobicContact CG-CG 4.22Å; L762-L766 WeakPolarHBondContact O-CG 3.46Å; L762-L766 PolarHBondContact O-N 3.07Å
763	V	97.3	Very high	95.7	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.2	-30.9	179.8	-155.5	0	0	0	0	111.6	L720 L723 H724 L727 S761 F767 W791	L720-V763 HydrophobicContact CB-CG1 4.34Å; L720-V763 HydrophobicContact CD2-CG1 3.78Å; L723-V763 HydrophobicContact CB-CG2 3.97Å; H724-V763 HydrophobicContact CB-CB 4.23Å; H724-V763 HydrophobicContact CB-CG2 4.35Å; L727-V763 HydrophobicContact CD1-CG2 4Å; S761-V763 PolarHBondContact O-N 3.21Å; S761-V763 PolarHBondContact OG-N 2.92Å; V763-F767 HydrophobicContact CG1-CD2 3.76Å; V763-F767 HydrophobicContact CG1-CE2 4.28Å; V763-F767 PolarHBondContact O-N 2.86Å; V763-W791 HydrophobicContact CB-CZ3 4.22Å; V763-W791 HydrophobicContact CG1-CH2 4.46Å; V763-W791 HydrophobicContact CG1-CZ3 3.69Å
764	R	96.5	Very high	95.7	Very high	27 Å²	27	29.4 Å²	29.4	10%	0.102	14%	0.142	C	C	.	.	H	α-helix	trans	-72.1	-39	172	-170.5	-118.7	76.6	-120.4	1.6	111.7	Y755 E759 S761 L762 L766 V768	Y755-R764 HydrophobicContact CE1-CG 3.79Å; E759-R764 WeakPolarHBondContact O-CB 3.49Å; E759-R764 VanDerWaalsContact O-CD 3.23Å; E759-R764 WeakPolarHBondContact O-CD 3.29Å; E759-R764 VanDerWaalsContact O-CG 3.26Å; E759-R764 WeakPolarHBondContact O-CG 3.38Å; S761-R764 WeakPolarHBondContact O-CA 3.35Å; S761-R764 VanDerWaalsContact O-CB 3.24Å; S761-R764 WeakPolarHBondContact O-CB 3.26Å; S761-R764 PolarHBondContact O-N 3.08Å; S761-R764 PolarHBondContact OG-N 2.99Å; L762-R764 VanDerWaalsContact C-N 3.25Å; L762-R764 PolarHBondContact O-N 3.37Å; R764-L766 VanDerWaalsContact C-N 3.31Å; R764-L766 PolarHBondContact O-N 3.26Å; R764-V768 HydrophobicContact CB-CG2 4.41Å; R764-V768 HydrophobicContact CG-CB 4.19Å; R764-V768 HydrophobicContact CG-CG2 4.23Å; R764-V768 PolarHBondContact O-N 3.39Å
765	D	96.9	Very high	95.9	Very high	79 Å²	79	29.3 Å²	29.3	42%	0.422	15%	0.145	S	C	.	.	H	α-helix	trans	-63.4	-34.9	173.8	-67.6	82.7	0	0	0	113	S761 L762	S761-D765 PolarHBondContact O-N 2.74Å; S761-D765 VanDerWaalsContact O-N 3.17Å; L762-D765 WeakPolarHBondContact O-CB 3.36Å; L762-D765 PolarHBondContact O-N 2.95Å; L762-D765 VanDerWaalsContact O-N 3.16Å
766	L	98.1	Very high	96	Very high	3 Å²	3	33 Å²	33	2%	0.016	16%	0.161	C	C	.	.	H	α-helix	trans	-85.9	-53	-176.9	-66.7	-166.4	0	0	0	113.5	T646 E648 L649 L762 R764 K846 Y847	T646-L766 HydrophobicContact CG2-CD1 4.42Å; E648-L766 HydrophobicContact CB-CD1 4.28Å; E648-L766 HydrophobicContact CB-CD2 4.13Å; L649-L766 HydrophobicContact CB-CD1 3.87Å; L762-L766 HydrophobicContact CD1-CD1 4.23Å; L762-L766 HydrophobicContact CD1-CD2 4.21Å; L762-L766 HydrophobicContact CD1-CG 3.96Å; L762-L766 HydrophobicContact CG-CD1 4.19Å; L762-L766 HydrophobicContact CG-CG 4.22Å; L762-L766 WeakPolarHBondContact O-CG 3.46Å; L762-L766 PolarHBondContact O-N 3.07Å; R764-L766 VanDerWaalsContact C-N 3.31Å; R764-L766 PolarHBondContact O-N 3.26Å; L766-K846 HydrophobicContact CD2-CD 4.29Å; L766-K846 PolarHBondContact O-N 3.29Å; L766-K846 VanDerWaalsContact O-N 3.14Å; L766-Y847 HydrophobicContact CB-CD2 3.94Å; L766-Y847 HydrophobicContact CD1-CD2 4.32Å; L766-Y847 HydrophobicContact CD1-CE2 4.19Å; L766-Y847 HydrophobicContact CD2-CD2 4.01Å; L766-Y847 HydrophobicContact CD2-CE2 3.85Å; L766-Y847 HydrophobicContact CG-CD2 4.28Å; L766-Y847 HydrophobicContact CG-CE2 4.39Å; L766-Y847 PolarHBondContact O-N 3.45Å
767	F	98.3	Very high	96.3	Very high	1 Å²	1	31.3 Å²	31.3	0%	0.004	15%	0.15	C	C	.	.	H	α-helix	trans	-106.9	-13.4	-163.4	-64.8	-80.2	0	0	0	115.5	L643 T646 L649 L720 V763 P845 V849	L643-F767 HydrophobicContact CD2-CE1 4.26Å; L643-F767 HydrophobicContact CD2-CE2 4.49Å; L643-F767 HydrophobicContact CD2-CZ 3.72Å; T646-F767 HydrophobicContact CG2-CE1 4.44Å; T646-F767 HydrophobicContact CG2-CZ 3.8Å; L649-F767 HydrophobicContact CD2-CE2 4.29Å; L649-F767 HydrophobicContact CD2-CZ 4.44Å; L720-F767 HydrophobicContact CD1-CG 4.42Å; L720-F767 HydrophobicContact CD2-CD2 4.12Å; L720-F767 HydrophobicContact CD2-CE2 3.97Å; L720-F767 HydrophobicContact CD2-CZ 4.42Å; V763-F767 HydrophobicContact CG1-CD2 3.76Å; V763-F767 HydrophobicContact CG1-CE2 4.28Å; V763-F767 PolarHBondContact O-N 2.86Å; F767-P845 WeakPolarHBondContact O-CB 3.43Å; F767-V849 HydrophobicContact CD1-CG2 3.97Å; F767-V849 HydrophobicContact CE1-CG2 4.22Å
768	V	98.1	Very high	96.6	Very high	6 Å²	6	29.5 Å²	29.5	4%	0.036	15%	0.152	C	C	.	.			trans	-95.3	124.5	-169.8	-175.9	0	0	0	0	112.6	W752 Y755 R764 P789 F790 W791	W752-V768 HydrophobicContact CH2-CG1 4.09Å; W752-V768 HydrophobicContact CZ3-CG1 4.24Å; Y755-V768 HydrophobicContact CE1-CG1 3.77Å; R764-V768 HydrophobicContact CB-CG2 4.41Å; R764-V768 HydrophobicContact CG-CB 4.19Å; R764-V768 HydrophobicContact CG-CG2 4.23Å; R764-V768 PolarHBondContact O-N 3.39Å; V768-P789 HydrophobicContact CG1-CB 3.95Å; V768-F790 CarbonylContact C-O 3.56Å; V768-F790 VanDerWaalsContact CA-O 3.28Å; V768-F790 WeakPolarHBondContact CA-O 3.23Å; V768-W791 HydrophobicContact CG2-CD2 3.62Å; V768-W791 HydrophobicContact CG2-CE3 4.05Å; V768-W791 HydrophobicContact CG2-CG 4.05Å; V768-W791 HydrophobicContact CG2-CH2 3.99Å; V768-W791 HydrophobicContact CG2-CZ2 3.6Å; V768-W791 HydrophobicContact CG2-CZ3 4.23Å
769	G	97.1	Very high	96.8	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	-174.3	167.1	0	0	0	0	0	112.2	P789 F790 R843	G769-P789 WeakPolarHBondContact O-CA 3.48Å; G769-F790 VanDerWaalsContact C-CE1 3.41Å; G769-F790 VanDerWaalsContact CA-CE1 3.5Å; G769-F790 PolarHBondContact N-O 2.65Å; G769-F790 PolarHBondContact O-N 2.79Å; G769-R843 CarbonylContact C-O 3.54Å; G769-R843 VanDerWaalsContact CA-O 3.26Å; G769-R843 WeakPolarHBondContact CA-O 3.23Å
770	Q	97.6	Very high	96.9	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.009	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	124.2	176.9	-166.4	-179.7	41.7	0	0	110	A748 W752 F787 F790 Q842 R843	A748-Q770 PolarHBondContact O-NE2 2.93Å; W752-Q770 HydrophobicContact CE3-CB 3.88Å; W752-Q770 HydrophobicContact CE3-CG 4.2Å; W752-Q770 HydrophobicContact CZ3-CB 3.92Å; Q770-F787 HydrophobicContact CG-CB 4.28Å; Q770-F790 VanDerWaalsContact N-CE1 3.32Å; Q770-Q842 HydrophobicContact CB-CB 4.33Å; Q770-Q842 HydrophobicContact CG-CB 4.34Å; Q770-Q842 PolarHBondContact O-N 3.27Å; Q770-R843 HydrophobicContact CB-CB 3.72Å; Q770-R843 HydrophobicContact CB-CG 3.96Å; Q770-R843 PolarHBondContact N-O 3.37Å; Q770-R843 PolarHBondContact O-N 2.71Å
771	L	97.3	Very high	97	Very high	18 Å²	18	32 Å²	32	9%	0.094	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	148.1	167.9	-72.3	170.3	0	0	0	109.9	F787 D788 F790 L793 F812 F839 I841	L771-F787 CarbonylContact O-C 3.59Å; L771-F787 VanDerWaalsContact O-CA 3.28Å; L771-F787 WeakPolarHBondContact O-CA 3.48Å; L771-D788 PolarHBondContact N-O 3.42Å; L771-D788 PolarHBondContact O-N 3.03Å; L771-F790 HydrophobicContact CB-CD1 4.49Å; L771-F790 HydrophobicContact CD1-CB 4.24Å; L771-F790 HydrophobicContact CD1-CD1 4.38Å; L771-F790 HydrophobicContact CD1-CG 4.48Å; L771-F790 HydrophobicContact CD2-CD1 4.29Å; L771-F790 HydrophobicContact CD2-CE1 4.34Å; L771-F790 HydrophobicContact CG-CB 4.39Å; L771-F790 HydrophobicContact CG-CD1 3.65Å; L771-F790 HydrophobicContact CG-CE1 4.16Å; L771-F790 HydrophobicContact CG-CG 4.21Å; L771-L793 HydrophobicContact CD2-CD2 4.3Å; L771-F812 HydrophobicContact CD1-CZ 4.08Å; L771-F812 HydrophobicContact CD2-CE1 3.99Å; L771-F812 HydrophobicContact CD2-CZ 4.23Å; L771-F839 HydrophobicContact CD1-CD1 4.33Å; L771-I841 HydrophobicContact CD2-CG1 3.95Å
772	K	96.4	Very high	96.9	Very high	36 Å²	36	32.8 Å²	32.8	16%	0.157	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	109.8	161.5	177.1	-178.3	-177	178.3	0	107.8	D744 V785 F787 F839 T840 Q842	D744-K772 WeakPolarHBondContact OD2-CE 3.27Å; D744-K772 IonicContact OD2-NZ 3.77Å; D744-K772 PolarHBondContact OD2-NZ 3.4Å; K772-V785 HydrophobicContact CD-CG1 4.29Å; K772-V785 HydrophobicContact CG-CG1 3.72Å; K772-F787 HydrophobicContact CB-CD1 4Å; K772-F787 HydrophobicContact CB-CE1 3.64Å; K772-F787 HydrophobicContact CD-CE1 3.92Å; K772-F787 HydrophobicContact CD-CZ 4.2Å; K772-F787 HydrophobicContact CG-CD1 4.25Å; K772-F787 HydrophobicContact CG-CE1 3.54Å; K772-F787 HydrophobicContact CG-CZ 4.01Å; K772-F839 WeakPolarHBondContact O-CA 3.39Å; K772-T840 PolarHBondContact N-O 3.39Å; K772-T840 PolarHBondContact O-N 3.35Å; K772-Q842 HydrophobicContact CB-CB 4.29Å
773	S	96.3	Very high	96.9	Very high	12 Å²	12	33.8 Å²	33.8	8%	0.084	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	120.3	176.1	163	0	0	0	0	108.7	V785 T786 D788	S773-V785 CarbonylContact O-C 3.55Å; S773-V785 WeakPolarHBondContact O-CA 3.47Å; S773-T786 VanDerWaalsContact CB-OG1 3.3Å; S773-T786 WeakPolarHBondContact CB-OG1 3.4Å; S773-T786 PolarHBondContact N-O 2.95Å; S773-T786 PolarHBondContact O-N 2.96Å; S773-T786 PolarHBondContact OG-OG1 3.3Å; S773-D788 WeakPolarHBondContact CB-OD2 3.28Å
774	T	95.8	Very high	96.7	Very high	30 Å²	30	36.2 Å²	36.2	18%	0.184	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	125.1	-179.2	-56.2	0	0	0	0	109.2	T783 V785 K837 S838	T774-T783 HydrophobicContact CG2-CG2 3.55Å; T774-V785 HydrophobicContact CG2-CG2 4.31Å; T774-K837 CarbonylContact O-C 3.48Å; T774-K837 VanDerWaalsContact O-CA 3.25Å; T774-K837 WeakPolarHBondContact O-CA 3.48Å; T774-S838 PolarHBondContact N-O 3.09Å; T774-S838 PolarHBondContact O-N 3.29Å
775	L	96.8	Very high	96.6	Very high	43 Å²	43	36.4 Å²	36.4	23%	0.225	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	122.1	178.4	-179.5	72.7	0	0	0	109.9	T783 S784 L818 P824 C835 T836 K837	L775-T783 CarbonylContact O-C 3.55Å; L775-T783 WeakPolarHBondContact O-CA 3.49Å; L775-S784 PolarHBondContact N-O 3.09Å; L775-S784 PolarHBondContact O-N 3.32Å; L775-S784 PolarHBondContact O-OG 3.34Å; L775-L818 HydrophobicContact CD1-CD1 3.88Å; L775-P824 HydrophobicContact CD1-CG 4.19Å; L775-P824 HydrophobicContact CD2-CG 4.18Å; L775-C835 HydrophobicContact CD1-CB 3.71Å; L775-C835 HydrophobicContact CG-CB 4.36Å; L775-T836 CarbonylContact C-O 3.55Å; L775-T836 WeakPolarHBondContact CA-O 3.48Å; L775-K837 HydrophobicContact CD1-CB 3.96Å; L775-K837 HydrophobicContact CD1-CD 4.43Å
776	K	97.4	Very high	96.5	Very high	100 Å²	100	35.9 Å²	35.9	44%	0.435	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	120.5	-173.4	176.7	179.4	177	-173.2	0	111.5	T778 N782 T783 C835 T836	K776-T778 PolarHBondContact O-N 3.33Å; K776-N782 WeakPolarHBondContact CA-O 3.35Å; K776-T783 HydrophobicContact CB-CG2 4.43Å; K776-C835 CarbonylContact O-C 3.53Å; K776-C835 WeakPolarHBondContact O-CA 3.14Å; K776-C835 WeakPolarHBondContact O-CB 3.41Å; K776-T836 PolarHBondContact N-O 3.15Å; K776-T836 PolarHBondContact O-N 2.93Å
777	C	97.8	Very high	96.4	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.014	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	123.4	176.1	178.2	0	0	0	0	111.3	T779 G781 N782 C826	C777-T779 PolarHBondContact O-N 2.88Å; C777-G781 VanDerWaalsContact O-CA 3.31Å; C777-G781 WeakPolarHBondContact O-CA 3.39Å; C777-G781 PolarHBondContact O-N 2.98Å; C777-N782 HydrophobicContact CB-CB 4.37Å; C777-N782 PolarHBondContact N-O 2.82Å; C777-C826 HydrophobicContact CB-CB 4.25Å; C777-C826 VanDerWaalsContact SG-SG 3.64Å
778	T	97.1	Very high	96.2	Very high	73 Å²	73	39.1 Å²	39.1	45%	0.448	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-12	-178.3	72.9	0	0	0	0	113.2	K776 K834 T836	K776-T778 PolarHBondContact O-N 3.33Å; T778-K834 HydrophobicContact CG2-CG 4.18Å; T778-K834 PolarHBondContact N-O 3.39Å; T778-K834 PolarHBondContact OG1-O 2.79Å; T778-T836 HydrophobicContact CG2-CG2 3.91Å
779	T	96.8	Very high	96.2	Very high	83 Å²	83	41.5 Å²	41.5	51%	0.509	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-32.9	-179.4	-51	0	0	0	0	113.6	C777 R833	C777-T779 PolarHBondContact O-N 2.88Å; T779-R833 WeakPolarHBondContact OG1-CD 3.33Å
780	C	96.8	Very high	96.2	Very high	57 Å²	57	42.1 Å²	42.1	39%	0.385	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.4	7.5	-176.1	70.2	0	0	0	0	114.3	N782 C826 C829	C780-N782 PolarHBondContact O-N 2.73Å; C780-N782 VanDerWaalsContact SG-CB 3.59Å; C780-C826 VanDerWaalsContact SG-SG 3.61Å; C780-C829 PolarHBondContact SG-SG 2.84Å
781	G	95.8	Very high	96.1	Very high	46 Å²	46	44.1 Å²	44.1	47%	0.474	26%	0.261	S	S	.	.			trans	67.7	-3.4	-179.2	0	0	0	0	0	115.3	C777 T783	C777-G781 VanDerWaalsContact O-CA 3.31Å; C777-G781 WeakPolarHBondContact O-CA 3.39Å; C777-G781 PolarHBondContact O-N 2.98Å; G781-T783 PolarHBondContact O-N 3.41Å; G781-T783 VanDerWaalsContact O-N 3.07Å; G781-T783 PolarHBondContact O-OG1 3.34Å
782	N	95.1	Very high	96.2	Very high	22 Å²	22	43.9 Å²	43.9	12%	0.118	26%	0.26	C	S	.	.			trans	-60.1	117.5	-176	-173.3	81.4	0	0	0	111.1	K776 C777 C780 K828	K776-N782 WeakPolarHBondContact CA-O 3.35Å; C777-N782 HydrophobicContact CB-CB 4.37Å; C777-N782 PolarHBondContact N-O 2.82Å; C780-N782 PolarHBondContact O-N 2.73Å; C780-N782 VanDerWaalsContact SG-CB 3.59Å; N782-K828 HydrophobicContact CB-CB 4.28Å; N782-K828 HydrophobicContact CB-CD 4.06Å; N782-K828 HydrophobicContact CB-CG 4.24Å; N782-K828 WeakPolarHBondContact OD1-CD 3.38Å; N782-K828 WeakPolarHBondContact OD1-CE 3.4Å; N782-K828 WeakPolarHBondContact OD1-CG 3.49Å; N782-K828 PolarHBondContact OD1-NZ 3.36Å
783	T	94.6	Very high	96.2	Very high	70 Å²	70	42.2 Å²	42.2	43%	0.429	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	135.3	176	-54.2	0	0	0	0	109.1	T774 L775 K776 G781	T774-T783 HydrophobicContact CG2-CG2 3.55Å; L775-T783 CarbonylContact O-C 3.55Å; L775-T783 WeakPolarHBondContact O-CA 3.49Å; K776-T783 HydrophobicContact CB-CG2 4.43Å; G781-T783 PolarHBondContact O-N 3.41Å; G781-T783 VanDerWaalsContact O-N 3.07Å; G781-T783 PolarHBondContact O-OG1 3.34Å
784	S	93	Very high	96.3	Very high	51 Å²	51	42.8 Å²	42.8	36%	0.357	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	138.8	174	50.5	0	0	0	0	109	L775	L775-S784 PolarHBondContact N-O 3.09Å; L775-S784 PolarHBondContact O-N 3.32Å; L775-S784 PolarHBondContact O-OG 3.34Å
785	V	94.5	Very high	96.3	Very high	31 Å²	31	41.4 Å²	41.4	19%	0.188	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	130	-175.2	178.6	0	0	0	0	109.5	K772 S773 T774 F787	K772-V785 HydrophobicContact CD-CG1 4.29Å; K772-V785 HydrophobicContact CG-CG1 3.72Å; S773-V785 CarbonylContact O-C 3.55Å; S773-V785 WeakPolarHBondContact O-CA 3.47Å; T774-V785 HydrophobicContact CG2-CG2 4.31Å; V785-F787 HydrophobicContact CG1-CD2 4.28Å; V785-F787 HydrophobicContact CG1-CE1 4.22Å; V785-F787 HydrophobicContact CG1-CE2 3.54Å; V785-F787 HydrophobicContact CG1-CZ 3.5Å
786	T	94.7	Very high	96.3	Very high	68 Å²	68	41.3 Å²	41.3	42%	0.417	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	154.8	170.4	60.7	0	0	0	0	110.7	S773 D788	S773-T786 VanDerWaalsContact CB-OG1 3.3Å; S773-T786 WeakPolarHBondContact CB-OG1 3.4Å; S773-T786 PolarHBondContact N-O 2.95Å; S773-T786 PolarHBondContact O-N 2.96Å; S773-T786 PolarHBondContact OG-OG1 3.3Å; T786-D788 WeakPolarHBondContact CB-OD2 3.47Å; T786-D788 PolarHBondContact OG1-OD2 2.97Å
787	F	96.7	Very high	96.1	Very high	13 Å²	13	37.6 Å²	37.6	6%	0.057	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	102	-177.6	-69.5	-77.1	0	0	0	110.1	D744 K747 A748 T751 Q770 L771 K772 V785 Q842	D744-F787 HydrophobicContact CB-CZ 4.08Å; D744-F787 VanDerWaalsContact O-CE2 3.29Å; D744-F787 WeakPolarHBondContact O-CE2 3.47Å; D744-F787 WeakPolarHBondContact O-CZ 3.29Å; K747-F787 HydrophobicContact CB-CD2 4.11Å; K747-F787 HydrophobicContact CB-CE2 3.77Å; A748-F787 HydrophobicContact CB-CD1 3.57Å; A748-F787 HydrophobicContact CB-CD2 4.19Å; A748-F787 HydrophobicContact CB-CE1 3.52Å; A748-F787 HydrophobicContact CB-CE2 4.15Å; A748-F787 HydrophobicContact CB-CG 3.9Å; A748-F787 HydrophobicContact CB-CZ 3.83Å; T751-F787 HydrophobicContact CG2-CB 4.3Å; T751-F787 WeakPolarHBondContact CG2-O 3.49Å; Q770-F787 HydrophobicContact CG-CB 4.28Å; L771-F787 CarbonylContact O-C 3.59Å; L771-F787 VanDerWaalsContact O-CA 3.28Å; L771-F787 WeakPolarHBondContact O-CA 3.48Å; K772-F787 HydrophobicContact CB-CD1 4Å; K772-F787 HydrophobicContact CB-CE1 3.64Å; K772-F787 HydrophobicContact CD-CE1 3.92Å; K772-F787 HydrophobicContact CD-CZ 4.2Å; K772-F787 HydrophobicContact CG-CD1 4.25Å; K772-F787 HydrophobicContact CG-CE1 3.54Å; K772-F787 HydrophobicContact CG-CZ 4.01Å; V785-F787 HydrophobicContact CG1-CD2 4.28Å; V785-F787 HydrophobicContact CG1-CE1 4.22Å; V785-F787 HydrophobicContact CG1-CE2 3.54Å; V785-F787 HydrophobicContact CG1-CZ 3.5Å; F787-Q842 HydrophobicContact CD1-CB 4.32Å; F787-Q842 HydrophobicContact CD1-CG 4.09Å; F787-Q842 HydrophobicContact CE1-CB 4.42Å; F787-Q842 HydrophobicContact CE1-CG 3.99Å
788	D	95.1	Very high	95.9	Very high	59 Å²	59	38.8 Å²	38.8	32%	0.316	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	124.2	-160.1	-57.9	-61	0	0	0	110.2	L771 S773 T786	L771-D788 PolarHBondContact N-O 3.42Å; L771-D788 PolarHBondContact O-N 3.03Å; S773-D788 WeakPolarHBondContact CB-OD2 3.28Å; T786-D788 WeakPolarHBondContact CB-OD2 3.47Å; T786-D788 PolarHBondContact OG1-OD2 2.97Å
789	P	96.8	Very high	95.5	Very high	55 Å²	55	40.8 Å²	40.8	36%	0.357	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	136.4	180	28.7	-33.6	0	0	0	111.2	Y755 V768 G769	Y755-P789 HydrophobicContact CD1-CB 4.3Å; Y755-P789 HydrophobicContact CD2-CB 4.36Å; Y755-P789 HydrophobicContact CD2-CG 4.02Å; Y755-P789 HydrophobicContact CE1-CB 3.95Å; Y755-P789 HydrophobicContact CE2-CB 4.01Å; Y755-P789 HydrophobicContact CE2-CG 3.77Å; V768-P789 HydrophobicContact CG1-CB 3.95Å; G769-P789 WeakPolarHBondContact O-CA 3.48Å
790	F	97.2	Very high	95.2	Very high	13 Å²	13	39.9 Å²	39.9	6%	0.057	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	146.1	-179.6	76.2	-89	0	0	0	112.3	V768 G769 Q770 L771 L793 I841 P845 L848	V768-F790 CarbonylContact C-O 3.56Å; V768-F790 VanDerWaalsContact CA-O 3.28Å; V768-F790 WeakPolarHBondContact CA-O 3.23Å; G769-F790 VanDerWaalsContact C-CE1 3.41Å; G769-F790 VanDerWaalsContact CA-CE1 3.5Å; G769-F790 PolarHBondContact N-O 2.65Å; G769-F790 PolarHBondContact O-N 2.79Å; Q770-F790 VanDerWaalsContact N-CE1 3.32Å; L771-F790 HydrophobicContact CB-CD1 4.49Å; L771-F790 HydrophobicContact CD1-CB 4.24Å; L771-F790 HydrophobicContact CD1-CD1 4.38Å; L771-F790 HydrophobicContact CD1-CG 4.48Å; L771-F790 HydrophobicContact CD2-CD1 4.29Å; L771-F790 HydrophobicContact CD2-CE1 4.34Å; L771-F790 HydrophobicContact CG-CB 4.39Å; L771-F790 HydrophobicContact CG-CD1 3.65Å; L771-F790 HydrophobicContact CG-CE1 4.16Å; L771-F790 HydrophobicContact CG-CG 4.21Å; F790-L793 HydrophobicContact CD2-CD2 3.51Å; F790-L793 HydrophobicContact CD2-CG 3.98Å; F790-L793 HydrophobicContact CE2-CD1 4.27Å; F790-L793 HydrophobicContact CE2-CD2 3.52Å; F790-L793 HydrophobicContact CE2-CG 3.67Å; F790-L793 HydrophobicContact CG-CD2 4.06Å; F790-L793 HydrophobicContact CZ-CD2 4.05Å; F790-L793 HydrophobicContact CZ-CG 4.39Å; F790-I841 HydrophobicContact CE1-CG2 4.14Å; F790-I841 HydrophobicContact CZ-CG2 4.24Å; F790-P845 HydrophobicContact CE2-CG 4.27Å; F790-P845 HydrophobicContact CZ-CG 4.38Å; F790-L848 HydrophobicContact CE2-CD1 4.04Å
791	W	96.9	Very high	95	Very high	45 Å²	45	41.8 Å²	41.8	17%	0.17	27%	0.27	C	S	.	.	S	Bend	trans	-110.7	-25.4	-177.7	-64.9	63.1	0	0	0	112	L720 H724 V763 V768	L720-W791 HydrophobicContact CB-CE3 3.96Å; L720-W791 HydrophobicContact CB-CZ3 4.03Å; L720-W791 HydrophobicContact CD1-CE3 4.33Å; H724-W791 HydrophobicContact CB-CH2 3.62Å; H724-W791 HydrophobicContact CB-CZ3 4.12Å; H724-W791 AromaticContact CD2-CH2 3.56Å; H724-W791 AromaticContact CD2-CZ2 3.77Å; H724-W791 AromaticContact CG-CH2 3.46Å; H724-W791 VanDerWaalsContact CG-CH2 3.46Å; H724-W791 AromaticContact ND1-CH2 3.98Å; V763-W791 HydrophobicContact CB-CZ3 4.22Å; V763-W791 HydrophobicContact CG1-CH2 4.46Å; V763-W791 HydrophobicContact CG1-CZ3 3.69Å; V768-W791 HydrophobicContact CG2-CD2 3.62Å; V768-W791 HydrophobicContact CG2-CE3 4.05Å; V768-W791 HydrophobicContact CG2-CG 4.05Å; V768-W791 HydrophobicContact CG2-CH2 3.99Å; V768-W791 HydrophobicContact CG2-CZ2 3.6Å; V768-W791 HydrophobicContact CG2-CZ3 4.23Å
792	D	97.9	Very high	95	Very high	13 Å²	13	45.5 Å²	45.5	7%	0.07	27%	0.27	C	S	.	.			trans	-148	149.2	175.8	71.5	-78	0	0	0	109.4	Q713 R717 S794 V849	Q713-D792 PolarHBondContact NE2-OD2 3.19Å; R717-D792 WeakPolarHBondContact CD-OD1 3.47Å; R717-D792 IonicContact CZ-OD1 2.72Å; R717-D792 IonicContact NH1-OD1 2.65Å; R717-D792 PolarHBondContact NH1-OD1 3.39Å; D792-S794 PolarHBondContact OD2-OG 3.36Å; D792-V849 CarbonylContact C-O 3.56Å; D792-V849 WeakPolarHBondContact CA-O 3.49Å; D792-V849 HydrophobicContact CB-CB 4.03Å; D792-V849 HydrophobicContact CB-CG1 3.96Å
793	L	97.9	Very high	95.1	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	99.9	169.8	-65.3	-175.9	0	0	0	109.5	L771 F790 V795 L809 F812 I841 L848 V849 I850 H851 M878	L771-L793 HydrophobicContact CD2-CD2 4.3Å; F790-L793 HydrophobicContact CD2-CD2 3.51Å; F790-L793 HydrophobicContact CD2-CG 3.98Å; F790-L793 HydrophobicContact CE2-CD1 4.27Å; F790-L793 HydrophobicContact CE2-CD2 3.52Å; F790-L793 HydrophobicContact CE2-CG 3.67Å; F790-L793 HydrophobicContact CG-CD2 4.06Å; F790-L793 HydrophobicContact CZ-CD2 4.05Å; F790-L793 HydrophobicContact CZ-CG 4.39Å; L793-V795 HydrophobicContact CB-CG1 4.29Å; L793-V795 PolarHBondContact O-N 2.87Å; L793-L809 HydrophobicContact CD1-CD2 4.43Å; L793-F812 HydrophobicContact CD2-CE1 4.02Å; L793-F812 HydrophobicContact CD2-CZ 3.91Å; L793-I841 HydrophobicContact CD1-CD1 3.9Å; L793-L848 HydrophobicContact CD1-CD1 3.92Å; L793-L848 HydrophobicContact CG-CD1 4.08Å; L793-V849 PolarHBondContact N-O 2.89Å; L793-I850 WeakPolarHBondContact O-CA 3.49Å; L793-H851 PolarHBondContact O-N 3.14Å; L793-M878 HydrophobicContact CD1-CE 4.33Å
794	S	97.4	Very high	95.1	Very high	24 Å²	24	47.9 Å²	47.9	17%	0.168	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	88.2	174.3	-71.6	0	0	0	0	110.8	Q713 D792 H851 K853	Q713-S794 PolarHBondContact NE2-OG 3.05Å; D792-S794 PolarHBondContact OD2-OG 3.36Å; S794-H851 CarbonylContact C-O 3.58Å; S794-H851 WeakPolarHBondContact CA-O 3.44Å; S794-H851 WeakPolarHBondContact CB-ND1 3.47Å; S794-H851 PolarHBondContact OG-ND1 3.24Å; S794-K853 WeakPolarHBondContact O-CD 3.13Å; S794-K853 WeakPolarHBondContact O-CE 3.41Å; S794-K853 PolarHBondContact O-NZ 2.65Å
795	V	96.8	Very high	95.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	142.7	-172.4	-60.7	0	0	0	0	113.2	L793 C808 L809 F812 I850 H851 L852 K853	L793-V795 HydrophobicContact CB-CG1 4.29Å; L793-V795 PolarHBondContact O-N 2.87Å; V795-C808 HydrophobicContact CB-CB 4.24Å; V795-C808 HydrophobicContact CG2-CB 3.87Å; V795-L809 HydrophobicContact CG1-CD2 3.96Å; V795-F812 HydrophobicContact CB-CB 4.47Å; V795-F812 HydrophobicContact CG1-CB 4.07Å; V795-F812 HydrophobicContact CG1-CD2 4.35Å; V795-F812 HydrophobicContact CG1-CG 4.21Å; V795-I850 HydrophobicContact CG1-CG2 4.05Å; V795-I850 HydrophobicContact CG2-CG2 3.77Å; V795-H851 PolarHBondContact N-O 2.91Å; V795-L852 HydrophobicContact CG2-CD2 3.71Å; V795-K853 VanDerWaalsContact O-CB 3.26Å; V795-K853 WeakPolarHBondContact O-CB 3.28Å; V795-K853 WeakPolarHBondContact O-CG 3.25Å; V795-K853 PolarHBondContact O-N 3.42Å
796	P	95.3	Very high	95.4	Very high	41 Å²	41	46.8 Å²	46.8	27%	0.266	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-73.9	155.9	171.9	34.3	-35.3	0	0	0	111.2	C808 L811	P796-C808 WeakPolarHBondContact O-CB 3.45Å; P796-L811 HydrophobicContact CG-CB 3.78Å
797	L	94.2	Very high	95.5	Very high	22 Å²	22	45.1 Å²	45.1	12%	0.115	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-103.3	141.5	173.9	-70.3	74.4	0	0	0	110.4	L852 K853 R854 L863 N865 V867	L797-L852 HydrophobicContact CD1-CB 4.1Å; L797-K853 HydrophobicContact CD1-CB 4.43Å; L797-R854 HydrophobicContact CD2-CG 4.14Å; L797-L863 HydrophobicContact CB-CD1 4.13Å; L797-L863 HydrophobicContact CD2-CB 4.36Å; L797-L863 HydrophobicContact CD2-CD1 4.48Å; L797-N865 HydrophobicContact CD2-CB 4.3Å; L797-V867 HydrophobicContact CD2-CG2 3.99Å; L797-V867 HydrophobicContact CG-CG2 4.41Å
798	P	92.8	Very high	95.5	Very high	27 Å²	27	44.5 Å²	44.5	18%	0.175	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-67.9	159.8	169.9	29.7	-34.8	0	0	0	111.5	S800 C803 L811 N865	P798-S800 PolarHBondContact O-N 3.32Å; P798-C803 HydrophobicContact CG-CB 3.42Å; P798-C803 VanDerWaalsContact CG-CB 3.42Å; P798-C803 WeakPolarHBondContact CG-SG 3.18Å; P798-L811 HydrophobicContact CB-CD1 3.79Å; P798-L811 HydrophobicContact CG-CD1 4.44Å; P798-N865 PolarHBondContact O-ND2 2.84Å
799	S	88.5	Confident	95.6	Very high	115 Å²	115	41.8 Å²	41.8	80%	0.804	24%	0.238	S	C	*	.	S	Bend	trans	-67.6	-12.2	178.3	-58.7	0	0	0	0	114.7
800	S	91.6	Very high	95.5	Very high	64 Å²	64	42.9 Å²	42.9	45%	0.448	24%	0.241	S	C	.	.	S	Bend	trans	-67.4	134.9	177.9	-176.4	0	0	0	0	111.5	P798 R802 N865	P798-S800 PolarHBondContact O-N 3.32Å; S800-R802 WeakPolarHBondContact CB-O 3.4Å; S800-R802 PolarHBondContact O-N 3.03Å; S800-R802 VanDerWaalsContact O-N 3.17Å; S800-R802 PolarHBondContact OG-O 2.72Å; S800-N865 PolarHBondContact O-ND2 2.85Å
801	S	92.3	Very high	95.5	Very high	97 Å²	97	44.9 Å²	44.9	68%	0.678	25%	0.252	S	S	*	.	S	Bend	trans	-61.9	-22	179.1	55.2	0	0	0	0	113.8	N865 I866	S801-N865 CarbonylContact O-C 3.57Å; S801-N865 VanDerWaalsContact O-CA 3.29Å; S801-N865 WeakPolarHBondContact O-CA 3.42Å; S801-I866 PolarHBondContact O-N 3.14Å
802	R	95.9	Very high	95.4	Very high	124 Å²	124	44 Å²	44	47%	0.468	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	136.1	169.5	-170.2	168.4	-176.5	119	1.2	109.8	S800 I866 E868	S800-R802 WeakPolarHBondContact CB-O 3.4Å; S800-R802 PolarHBondContact O-N 3.03Å; S800-R802 VanDerWaalsContact O-N 3.17Å; S800-R802 PolarHBondContact OG-O 2.72Å; R802-I866 VanDerWaalsContact CA-O 3.32Å; R802-I866 WeakPolarHBondContact CA-O 3.25Å; R802-I866 HydrophobicContact CG-CB 4.14Å; R802-I866 HydrophobicContact CG-CG2 4.36Å; R802-E868 HydrophobicContact CG-CG 4.37Å; R802-E868 IonicContact CZ-OE1 3.81Å; R802-E868 IonicContact NE-OE1 2.72Å; R802-E868 PolarHBondContact NE-OE1 3.04Å; R802-E868 IonicContact NH2-OE1 2.65Å; R802-E868 PolarHBondContact NH2-OE1 3.39Å
803	C	96.1	Very high	95.3	Very high	15 Å²	15	45.5 Å²	45.5	10%	0.101	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	167.8	179.5	63.2	0	0	0	0	110.5	P798 I866 V867 E868	P798-C803 HydrophobicContact CG-CB 3.42Å; P798-C803 VanDerWaalsContact CG-CB 3.42Å; P798-C803 WeakPolarHBondContact CG-SG 3.18Å; C803-I866 PolarHBondContact N-O 2.81Å; C803-V867 CarbonylContact O-C 3.55Å; C803-V867 WeakPolarHBondContact O-CA 3.46Å; C803-E868 PolarHBondContact O-N 3.01Å
804	K	96.3	Very high	95.2	Very high	127 Å²	127	52.1 Å²	52.1	55%	0.552	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	160.1	169.8	-54.1	-169.2	170.8	-169.7	0	112.1	E806 A807 E868	K804-E806 VanDerWaalsContact C-N 3.31Å; K804-E806 WeakPolarHBondContact CB-OE2 3.4Å; K804-A807 WeakPolarHBondContact O-CB 3.44Å; K804-A807 PolarHBondContact O-N 3.23Å; K804-E868 CarbonylContact C-O 3.59Å; K804-E868 WeakPolarHBondContact CA-O 3.42Å; K804-E868 HydrophobicContact CG-CB 4.41Å
805	L	96.9	Very high	95.1	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.8	-36.9	177	-179.6	61.3	0	0	0	111.9	A807 C808 L809 I850 L852 V867 E868 F869 L876 L945 Y947	L805-A807 VanDerWaalsContact C-N 3.27Å; L805-A807 PolarHBondContact O-N 3.26Å; L805-C808 WeakPolarHBondContact O-CA 3.26Å; L805-C808 VanDerWaalsContact O-CB 3.32Å; L805-C808 WeakPolarHBondContact O-CB 3.34Å; L805-C808 PolarHBondContact O-N 3.49Å; L805-L809 HydrophobicContact CG-CD1 4.24Å; L805-L809 PolarHBondContact O-N 3.08Å; L805-I850 HydrophobicContact CD1-CG2 4.23Å; L805-I850 HydrophobicContact CD2-CD1 4.16Å; L805-L852 HydrophobicContact CD1-CD2 4.07Å; L805-V867 HydrophobicContact CB-CG1 4.13Å; L805-V867 HydrophobicContact CD1-CG1 4.28Å; L805-E868 WeakPolarHBondContact CB-O 3.32Å; L805-E868 PolarHBondContact N-O 3.34Å; L805-F869 HydrophobicContact CB-CB 4.01Å; L805-F869 HydrophobicContact CD2-CB 3.82Å; L805-L876 HydrophobicContact CD2-CD1 4.16Å; L805-L876 HydrophobicContact CD2-CD2 3.83Å; L805-L945 HydrophobicContact CD1-CD1 4.08Å; L805-L945 HydrophobicContact CD2-CD1 3.89Å; L805-Y947 HydrophobicContact CD2-CE2 4.12Å; L805-Y947 WeakPolarHBondContact CD2-OH 3.46Å
806	E	95.9	Very high	95.1	Very high	59 Å²	59	58.8 Å²	58.8	28%	0.276	31%	0.31	S	S	.	.	H	α-helix	trans	-55.7	-43.3	173.7	-61.8	79.7	-177.2	0	0	110.2	K804 C808 L809 D810 Y881	K804-E806 VanDerWaalsContact C-N 3.31Å; K804-E806 WeakPolarHBondContact CB-OE2 3.4Å; E806-C808 PolarHBondContact O-N 3.32Å; E806-L809 CarbonylContact O-C 3.53Å; E806-L809 WeakPolarHBondContact O-CA 3.45Å; E806-L809 WeakPolarHBondContact O-CB 3.46Å; E806-L809 PolarHBondContact O-N 2.84Å; E806-D810 WeakPolarHBondContact O-CB 3.16Å; E806-D810 PolarHBondContact O-N 3.43Å; E806-Y881 PolarHBondContact O-OH 2.98Å
807	A	96.4	Very high	95.1	Very high	34 Å²	34	60.7 Å²	60.7	28%	0.281	32%	0.321	S	S	.	.	H	α-helix	trans	-65.6	-24.2	176.5	0	0	0	0	0	113.8	K804 L805 L811	K804-A807 WeakPolarHBondContact O-CB 3.44Å; K804-A807 PolarHBondContact O-N 3.23Å; L805-A807 VanDerWaalsContact C-N 3.27Å; L805-A807 PolarHBondContact O-N 3.26Å; A807-L811 VanDerWaalsContact O-CG 3.29Å; A807-L811 WeakPolarHBondContact O-CG 3.19Å; A807-L811 PolarHBondContact O-N 2.88Å
808	C	97.1	Very high	95.2	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-78.1	-34.7	171.7	-58.7	0	0	0	0	111.7	V795 P796 L805 E806 F812	V795-C808 HydrophobicContact CB-CB 4.24Å; V795-C808 HydrophobicContact CG2-CB 3.87Å; P796-C808 WeakPolarHBondContact O-CB 3.45Å; L805-C808 WeakPolarHBondContact O-CA 3.26Å; L805-C808 VanDerWaalsContact O-CB 3.32Å; L805-C808 WeakPolarHBondContact O-CB 3.34Å; L805-C808 PolarHBondContact O-N 3.49Å; E806-C808 PolarHBondContact O-N 3.32Å; C808-F812 PolarHBondContact O-N 2.99Å; C808-F812 VanDerWaalsContact O-N 3.16Å
809	L	96.9	Very high	95.3	Very high	2 Å²	2	62.8 Å²	62.8	1%	0.01	33%	0.331	C	S	.	.	H	α-helix	trans	-71.6	-41.7	174.6	-69.4	164.1	0	0	0	111.5	L793 V795 L805 E806 L811 F812 I813 L876 M878 Y881	L793-L809 HydrophobicContact CD1-CD2 4.43Å; V795-L809 HydrophobicContact CG1-CD2 3.96Å; L805-L809 HydrophobicContact CG-CD1 4.24Å; L805-L809 PolarHBondContact O-N 3.08Å; E806-L809 CarbonylContact O-C 3.53Å; E806-L809 WeakPolarHBondContact O-CA 3.45Å; E806-L809 WeakPolarHBondContact O-CB 3.46Å; E806-L809 PolarHBondContact O-N 2.84Å; L809-L811 VanDerWaalsContact C-N 3.32Å; L809-L811 PolarHBondContact O-N 2.79Å; L809-F812 WeakPolarHBondContact O-CA 3.31Å; L809-F812 WeakPolarHBondContact O-CB 3.38Å; L809-F812 PolarHBondContact O-N 3.16Å; L809-I813 PolarHBondContact O-N 2.76Å; L809-L876 HydrophobicContact CD1-CD1 4.31Å; L809-M878 HydrophobicContact CD1-CE 4.39Å; L809-M878 HydrophobicContact CD1-SD 3.68Å; L809-M878 HydrophobicContact CD2-CE 4.11Å; L809-M878 HydrophobicContact CD2-SD 4.4Å; L809-Y881 HydrophobicContact CB-CD1 4.15Å; L809-Y881 HydrophobicContact CB-CD2 4.4Å; L809-Y881 HydrophobicContact CB-CE1 3.63Å; L809-Y881 HydrophobicContact CB-CE2 3.9Å; L809-Y881 HydrophobicContact CD1-CD2 4.33Å; L809-Y881 HydrophobicContact CD1-CE2 3.86Å; L809-Y881 HydrophobicContact CG-CE2 4.48Å
810	D	95.9	Very high	95.6	Very high	77 Å²	77	59.5 Å²	59.5	41%	0.412	32%	0.315	S	S	.	.	H	α-helix	trans	-55.4	-48.5	171.3	-62.8	-16.7	0	0	0	110.1	E806 F812 I813 R814 Y881	E806-D810 WeakPolarHBondContact O-CB 3.16Å; E806-D810 PolarHBondContact O-N 3.43Å; D810-F812 PolarHBondContact O-N 2.97Å; D810-I813 PolarHBondContact O-N 3.2Å; D810-R814 WeakPolarHBondContact O-CB 3.44Å; D810-R814 PolarHBondContact O-N 3.22Å; D810-Y881 VanDerWaalsContact OD1-CE1 3.23Å; D810-Y881 WeakPolarHBondContact OD1-CE1 3.5Å; D810-Y881 PolarHBondContact OD1-OH 3.36Å
811	L	95.8	Very high	95.7	Very high	55 Å²	55	61.5 Å²	61.5	29%	0.288	32%	0.321	S	S	.	.	H	α-helix	trans	-66.2	-19	175.7	-75.7	178.3	0	0	0	114.3	P796 P798 A807 L809	P796-L811 HydrophobicContact CG-CB 3.78Å; P798-L811 HydrophobicContact CB-CD1 3.79Å; P798-L811 HydrophobicContact CG-CD1 4.44Å; A807-L811 VanDerWaalsContact O-CG 3.29Å; A807-L811 WeakPolarHBondContact O-CG 3.19Å; A807-L811 PolarHBondContact O-N 2.88Å; L809-L811 VanDerWaalsContact C-N 3.32Å; L809-L811 PolarHBondContact O-N 2.79Å
812	F	96.1	Very high	95.8	Very high	28 Å²	28	62.3 Å²	62.3	12%	0.123	31%	0.314	C	S	.	.	H	α-helix	trans	-83.9	-39.1	175.2	175.4	-93.9	0	0	0	112.5	L771 L793 V795 C808 L809 D810 F839	L771-F812 HydrophobicContact CD1-CZ 4.08Å; L771-F812 HydrophobicContact CD2-CE1 3.99Å; L771-F812 HydrophobicContact CD2-CZ 4.23Å; L793-F812 HydrophobicContact CD2-CE1 4.02Å; L793-F812 HydrophobicContact CD2-CZ 3.91Å; V795-F812 HydrophobicContact CB-CB 4.47Å; V795-F812 HydrophobicContact CG1-CB 4.07Å; V795-F812 HydrophobicContact CG1-CD2 4.35Å; V795-F812 HydrophobicContact CG1-CG 4.21Å; C808-F812 PolarHBondContact O-N 2.99Å; C808-F812 VanDerWaalsContact O-N 3.16Å; L809-F812 WeakPolarHBondContact O-CA 3.31Å; L809-F812 WeakPolarHBondContact O-CB 3.38Å; L809-F812 PolarHBondContact O-N 3.16Å; D810-F812 PolarHBondContact O-N 2.97Å; F812-F839 HydrophobicContact CE1-CB 4.2Å
813	I	95.3	Very high	95.8	Very high	44 Å²	44	58.5 Å²	58.5	23%	0.226	30%	0.302	C	S	.	.	H	α-helix	trans	-82.9	-27.6	177	62	149.4	0	0	0	113.6	L809 D810 E815 F839 Y881	L809-I813 PolarHBondContact O-N 2.76Å; D810-I813 PolarHBondContact O-N 3.2Å; I813-E815 PolarHBondContact O-N 2.82Å; I813-F839 WeakPolarHBondContact CA-O 3.42Å; I813-F839 VanDerWaalsContact CB-O 3.23Å; I813-F839 WeakPolarHBondContact CB-O 3.45Å; I813-F839 WeakPolarHBondContact CG2-O 3.47Å; I813-Y881 HydrophobicContact CD1-CD1 3.69Å; I813-Y881 HydrophobicContact CD1-CE1 4.05Å; I813-Y881 HydrophobicContact CG1-CD1 3.88Å; I813-Y881 HydrophobicContact CG1-CE1 4.16Å; I813-Y881 HydrophobicContact CG2-CD1 3.89Å
814	R	95.4	Very high	95.8	Very high	140 Å²	140	58 Å²	58	53%	0.528	30%	0.299	S	S	.	.	S	Bend	trans	-54.5	137.4	-176.8	180	-170.6	62.3	67.2	11.1	111.2	D810 E816	D810-R814 WeakPolarHBondContact O-CB 3.44Å; D810-R814 PolarHBondContact O-N 3.22Å; R814-E816 PolarHBondContact O-N 3.46Å; R814-E816 VanDerWaalsContact O-N 3.16Å
815	E	96	Very high	95.9	Very high	92 Å²	92	52.9 Å²	52.9	43%	0.43	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-55	118	176.2	-168.6	174.4	72.9	0	0	112.1	I813 T836 K837	I813-E815 PolarHBondContact O-N 2.82Å; E815-T836 VanDerWaalsContact CD-OG1 3.25Å; E815-T836 VanDerWaalsContact CG-CB 3.5Å; E815-T836 HydrophobicContact CG-CG2 4.18Å; E815-T836 WeakPolarHBondContact OE2-CB 3.41Å; E815-T836 PolarHBondContact OE2-OG1 3.21Å; E815-K837 CarbonylContact C-O 3.53Å; E815-K837 WeakPolarHBondContact CA-O 3.49Å
816	E	95.4	Very high	95.8	Very high	71 Å²	71	53.1 Å²	53.1	33%	0.332	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	151.3	170.8	73	-175.5	167.1	0	0	110.6	R814 L818 T836 K837	R814-E816 PolarHBondContact O-N 3.46Å; R814-E816 VanDerWaalsContact O-N 3.16Å; E816-L818 HydrophobicContact CG-CD2 4.24Å; E816-T836 CarbonylContact O-C 3.6Å; E816-T836 VanDerWaalsContact O-CA 3.32Å; E816-T836 WeakPolarHBondContact O-CA 3.27Å; E816-K837 HydrophobicContact CG-CB 3.89Å; E816-K837 HydrophobicContact CG-CG 4.37Å; E816-K837 PolarHBondContact N-O 3.17Å; E816-K837 PolarHBondContact O-N 2.83Å; E816-K837 IonicContact OE1-NZ 2.78Å; E816-K837 PolarHBondContact OE1-NZ 3.07Å
817	V	96.6	Very high	95.7	Very high	81 Å²	81	51.8 Å²	51.8	49%	0.491	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	112	-175.7	-175.2	0	0	0	0	108.6	D819 K834 T836	V817-D819 HydrophobicContact CG1-CB 4.17Å; V817-D819 PolarHBondContact O-N 3.41Å; V817-K834 HydrophobicContact CG1-CD 4.45Å; V817-K834 HydrophobicContact CG1-CG 4.29Å; V817-T836 HydrophobicContact CG2-CG2 4.38Å
818	L	96.4	Very high	95.6	Very high	26 Å²	26	57.4 Å²	57.4	14%	0.136	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	103.3	177.2	-53.7	-177.6	0	0	0	108.5	L775 E816 E822 P824 K834 C835 K837	L775-L818 HydrophobicContact CD1-CD1 3.88Å; E816-L818 HydrophobicContact CG-CD2 4.24Å; L818-E822 HydrophobicContact CB-CB 4.31Å; L818-E822 HydrophobicContact CD2-CB 4.17Å; L818-P824 HydrophobicContact CD1-CG 4.22Å; L818-K834 WeakPolarHBondContact O-CA 3.39Å; L818-C835 PolarHBondContact N-O 3.33Å; L818-C835 PolarHBondContact O-N 2.87Å; L818-K837 HydrophobicContact CD1-CB 4.12Å; L818-K837 HydrophobicContact CD1-CD 4.24Å; L818-K837 HydrophobicContact CG-CB 4.35Å
819	D	95.3	Very high	95.6	Very high	67 Å²	67	59.3 Å²	59.3	36%	0.358	31%	0.309	S	S	.	.			trans	-146.5	161.1	-168.4	-165.3	13.7	0	0	0	111	V817 D821 E822 M823 K834	V817-D819 HydrophobicContact CG1-CB 4.17Å; V817-D819 PolarHBondContact O-N 3.41Å; D819-D821 CarbonylContact O-C 3.52Å; D819-D821 WeakPolarHBondContact O-CA 3.36Å; D819-E822 PolarHBondContact O-N 3.34Å; D819-M823 WeakPolarHBondContact OD1-CE 3.38Å; D819-K834 HydrophobicContact CB-CD 4.17Å; D819-K834 HydrophobicContact CB-CG 4.03Å; D819-K834 WeakPolarHBondContact OD2-CD 3.38Å; D819-K834 WeakPolarHBondContact OD2-CE 3.49Å; D819-K834 IonicContact OD2-NZ 2.66Å; D819-K834 PolarHBondContact OD2-NZ 3.37Å
820	G	94.5	Very high	95.6	Very high	47 Å²	47	66.1 Å²	66.1	49%	0.485	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	-119.4	-180	0	0	0	0	0	114.1
821	D	93.8	Very high	95.6	Very high	106 Å²	106	65.4 Å²	65.4	57%	0.567	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn		70.2	-152.6	57.2	-25.5	42.6	0	0	0	108.3	L66 D819 M823 R832	L66-D821 HydrophobicContact CD1-CB 4.16Å; L66-D821 VanDerWaalsContact CD1-CG 3.47Å; L66-D821 WeakPolarHBondContact CD1-O 3.49Å; L66-D821 HydrophobicContact CD2-CB 3.66Å; L66-D821 WeakPolarHBondContact CD2-O 3.12Å; L66-D821 HydrophobicContact CG-CB 4.32Å; D819-D821 CarbonylContact O-C 3.52Å; D819-D821 WeakPolarHBondContact O-CA 3.36Å; D821-M823 PolarHBondContact O-N 2.88Å; D821-R832 PolarHBondContact O-NH2 2.84Å
822	E	94.4	Very high	95.7	Very high	114 Å²	114	66 Å²	66	53%	0.533	34%	0.336	S	S	.	.	S	Bend	trans	-58	8.5	-171.6	-68.5	-60.7	113.9	0	0	119	L818 D819 P824	L818-E822 HydrophobicContact CB-CB 4.31Å; L818-E822 HydrophobicContact CD2-CB 4.17Å; D819-E822 PolarHBondContact O-N 3.34Å; E822-P824 WeakPolarHBondContact O-CD 3.4Å
823	M	96.2	Very high	95.8	Very high	43 Å²	43	69 Å²	69	21%	0.212	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-49.2	117.8	-179.9	-69.1	-166.9	-168.3	0	0	114	D819 D821 R832 R833 K834	D819-M823 WeakPolarHBondContact OD1-CE 3.38Å; D821-M823 PolarHBondContact O-N 2.88Å; M823-R832 HydrophobicContact CB-CB 4.29Å; M823-R832 VanDerWaalsContact O-CZ 3.24Å; M823-R832 PolarHBondContact O-NE 2.8Å; M823-R832 PolarHBondContact O-NH2 2.92Å; M823-R833 WeakPolarHBondContact CB-O 3.1Å; M823-R833 VanDerWaalsContact SD-C 3.59Å; M823-K834 HydrophobicContact CE-CB 4.4Å
824	P	96.1	Very high	95.9	Very high	6 Å²	6	70.6 Å²	70.6	4%	0.039	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-77.6	163.7	169.9	32.8	-34.7	0	0	0	111.6	L775 L818 E822 R832 R833 C835	L775-P824 HydrophobicContact CD1-CG 4.19Å; L775-P824 HydrophobicContact CD2-CG 4.18Å; L818-P824 HydrophobicContact CD1-CG 4.22Å; E822-P824 WeakPolarHBondContact O-CD 3.4Å; P824-R832 WeakPolarHBondContact O-CA 3.46Å; P824-R833 PolarHBondContact O-N 2.79Å; P824-C835 HydrophobicContact CG-CB 3.84Å
825	T	96.8	Very high	96	Very high	18 Å²	18	64 Å²	64	11%	0.11	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-80.9	119.5	173	-61.8	0	0	0	0	110.2	S68 A827	S68-T825 PolarHBondContact O-N 3.35Å; T825-A827 PolarHBondContact O-N 2.96Å
826	C	96.6	Very high	96.1	Very high	6 Å²	6	60.4 Å²	60.4	4%	0.041	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-77	125.5	-175.5	170	0	0	0	0	111.7	C777 C780 K828 C829 K830 T831 R833	C777-C826 HydrophobicContact CB-CB 4.25Å; C777-C826 VanDerWaalsContact SG-SG 3.64Å; C780-C826 VanDerWaalsContact SG-SG 3.61Å; C826-K828 VanDerWaalsContact C-N 3.27Å; C826-K828 PolarHBondContact O-N 2.87Å; C826-K828 VanDerWaalsContact O-N 3.1Å; C826-C829 HydrophobicContact CB-CB 4.02Å; C826-C829 PolarHBondContact O-N 3.48Å; C826-C829 VanDerWaalsContact O-N 3.11Å; C826-K830 PolarHBondContact O-N 3.32Å; C826-T831 PolarHBondContact N-O 2.81Å; C826-R833 HydrophobicContact CB-CB 4.15Å; C826-R833 HydrophobicContact CB-CG 3.98Å
827	A	92.8	Very high	96.2	Very high	30 Å²	30	59.2 Å²	59.2	25%	0.248	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-38.9	-179.9	0	0	0	0	0	115.1	Y70 T825 K830	Y70-A827 HydrophobicContact CD2-CB 4.4Å; Y70-A827 HydrophobicContact CE2-CB 3.6Å; T825-A827 PolarHBondContact O-N 2.96Å; A827-K830 WeakPolarHBondContact O-CD 3.37Å; A827-K830 WeakPolarHBondContact O-CE 3.46Å; A827-K830 PolarHBondContact O-NZ 2.9Å
828	K	95.2	Very high	96.1	Very high	152 Å²	152	56.8 Å²	56.8	66%	0.661	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-39.8	175.4	-75.3	-169.9	179	131.2	0	114.6	N782 C826 K830	N782-K828 HydrophobicContact CB-CB 4.28Å; N782-K828 HydrophobicContact CB-CD 4.06Å; N782-K828 HydrophobicContact CB-CG 4.24Å; N782-K828 WeakPolarHBondContact OD1-CD 3.38Å; N782-K828 WeakPolarHBondContact OD1-CE 3.4Å; N782-K828 WeakPolarHBondContact OD1-CG 3.49Å; N782-K828 PolarHBondContact OD1-NZ 3.36Å; C826-K828 VanDerWaalsContact C-N 3.27Å; C826-K828 PolarHBondContact O-N 2.87Å; C826-K828 VanDerWaalsContact O-N 3.1Å; K828-K830 VanDerWaalsContact C-N 3.34Å
829	C	95.8	Very high	96.1	Very high	40 Å²	40	57.6 Å²	57.6	27%	0.27	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-13.6	-179.8	-60.8	0	0	0	0	114.6	C780 C826 T831 R833	C780-C829 PolarHBondContact SG-SG 2.84Å; C826-C829 HydrophobicContact CB-CB 4.02Å; C826-C829 PolarHBondContact O-N 3.48Å; C826-C829 VanDerWaalsContact O-N 3.11Å; C829-T831 HydrophobicContact CB-CG2 4.13Å; C829-T831 PolarHBondContact O-N 3.41Å; C829-R833 HydrophobicContact CB-CG 4.06Å
830	K	97	Very high	96.1	Very high	145 Å²	145	56.4 Å²	56.4	63%	0.63	29%	0.29	S	S	*	.	S	Bend	trans	53	22.3	-175.2	-53.1	-57.2	-174.4	-166.7	0	114.8	C826 A827 K828	C826-K830 PolarHBondContact O-N 3.32Å; A827-K830 WeakPolarHBondContact O-CD 3.37Å; A827-K830 WeakPolarHBondContact O-CE 3.46Å; A827-K830 PolarHBondContact O-NZ 2.9Å; K828-K830 VanDerWaalsContact C-N 3.34Å
831	T	97.3	Very high	96.2	Very high	63 Å²	63	54.2 Å²	54.2	39%	0.387	27%	0.267	S	S	.	.	S	Bend	trans	-146.9	165.2	178.4	-168.8	0	0	0	0	110.5	C826 C829 R833	C826-T831 PolarHBondContact N-O 2.81Å; C829-T831 HydrophobicContact CB-CG2 4.13Å; C829-T831 PolarHBondContact O-N 3.41Å; T831-R833 HydrophobicContact CG2-CG 4.47Å; T831-R833 PolarHBondContact O-N 3.46Å
832	R	97.6	Very high	96.3	Very high	67 Å²	67	50 Å²	50	25%	0.253	24%	0.244	S	C	.	.	B	Isolated β-bridge	trans	-61.9	132.3	177	-61.8	-168.4	73	-159.3	2.4	110.3	V67 D821 M823 P824	V67-R832 HydrophobicContact CG1-CG 4.38Å; D821-R832 PolarHBondContact O-NH2 2.84Å; M823-R832 HydrophobicContact CB-CB 4.29Å; M823-R832 VanDerWaalsContact O-CZ 3.24Å; M823-R832 PolarHBondContact O-NE 2.8Å; M823-R832 PolarHBondContact O-NH2 2.92Å; P824-R832 WeakPolarHBondContact O-CA 3.46Å
833	R	97.4	Very high	96.4	Very high	92 Å²	92	48.6 Å²	48.6	35%	0.347	23%	0.234	S	C	.	.			trans	-139.2	152.3	178	-66.6	-61	-175.3	-161.9	0.6	110.3	T779 M823 P824 C826 C829 T831 C835	T779-R833 WeakPolarHBondContact OG1-CD 3.33Å; M823-R833 WeakPolarHBondContact CB-O 3.1Å; M823-R833 VanDerWaalsContact SD-C 3.59Å; P824-R833 PolarHBondContact O-N 2.79Å; C826-R833 HydrophobicContact CB-CB 4.15Å; C826-R833 HydrophobicContact CB-CG 3.98Å; C829-R833 HydrophobicContact CB-CG 4.06Å; T831-R833 HydrophobicContact CG2-CG 4.47Å; T831-R833 PolarHBondContact O-N 3.46Å; R833-C835 PolarHBondContact O-N 2.94Å
834	K	97.8	Very high	96.4	Very high	76 Å²	76	48.2 Å²	48.2	33%	0.33	23%	0.231	S	C	.	.			trans	-58.9	127.9	162.3	-176.4	171.4	-173.1	154.7	0	108.6	T778 V817 L818 D819 M823	T778-K834 HydrophobicContact CG2-CG 4.18Å; T778-K834 PolarHBondContact N-O 3.39Å; T778-K834 PolarHBondContact OG1-O 2.79Å; V817-K834 HydrophobicContact CG1-CD 4.45Å; V817-K834 HydrophobicContact CG1-CG 4.29Å; L818-K834 WeakPolarHBondContact O-CA 3.39Å; D819-K834 HydrophobicContact CB-CD 4.17Å; D819-K834 HydrophobicContact CB-CG 4.03Å; D819-K834 WeakPolarHBondContact OD2-CD 3.38Å; D819-K834 WeakPolarHBondContact OD2-CE 3.49Å; D819-K834 IonicContact OD2-NZ 2.66Å; D819-K834 PolarHBondContact OD2-NZ 3.37Å; M823-K834 HydrophobicContact CE-CB 4.4Å
835	C	97.7	Very high	96.4	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.014	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	152.6	178.3	-70.4	0	0	0	0	109.5	L775 K776 L818 P824 R833	L775-C835 HydrophobicContact CD1-CB 3.71Å; L775-C835 HydrophobicContact CG-CB 4.36Å; K776-C835 CarbonylContact O-C 3.53Å; K776-C835 WeakPolarHBondContact O-CA 3.14Å; K776-C835 WeakPolarHBondContact O-CB 3.41Å; L818-C835 PolarHBondContact N-O 3.33Å; L818-C835 PolarHBondContact O-N 2.87Å; P824-C835 HydrophobicContact CG-CB 3.84Å; R833-C835 PolarHBondContact O-N 2.94Å
836	T	97.6	Very high	96.4	Very high	16 Å²	16	51.3 Å²	51.3	10%	0.098	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	146.5	163.1	66.5	0	0	0	0	109.9	L775 K776 T778 E815 E816 V817	L775-T836 CarbonylContact C-O 3.55Å; L775-T836 WeakPolarHBondContact CA-O 3.48Å; K776-T836 PolarHBondContact N-O 3.15Å; K776-T836 PolarHBondContact O-N 2.93Å; T778-T836 HydrophobicContact CG2-CG2 3.91Å; E815-T836 VanDerWaalsContact CD-OG1 3.25Å; E815-T836 VanDerWaalsContact CG-CB 3.5Å; E815-T836 HydrophobicContact CG-CG2 4.18Å; E815-T836 WeakPolarHBondContact OE2-CB 3.41Å; E815-T836 PolarHBondContact OE2-OG1 3.21Å; E816-T836 CarbonylContact O-C 3.6Å; E816-T836 VanDerWaalsContact O-CA 3.32Å; E816-T836 WeakPolarHBondContact O-CA 3.27Å; V817-T836 HydrophobicContact CG2-CG2 4.38Å
837	K	96.6	Very high	96.5	Very high	46 Å²	46	51 Å²	51	20%	0.2	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	138	179.5	173.3	160.8	157.8	-86.2	0	110	T774 L775 E815 E816 L818 F839	T774-K837 CarbonylContact O-C 3.48Å; T774-K837 VanDerWaalsContact O-CA 3.25Å; T774-K837 WeakPolarHBondContact O-CA 3.48Å; L775-K837 HydrophobicContact CD1-CB 3.96Å; L775-K837 HydrophobicContact CD1-CD 4.43Å; E815-K837 CarbonylContact C-O 3.53Å; E815-K837 WeakPolarHBondContact CA-O 3.49Å; E816-K837 HydrophobicContact CG-CB 3.89Å; E816-K837 HydrophobicContact CG-CG 4.37Å; E816-K837 PolarHBondContact N-O 3.17Å; E816-K837 PolarHBondContact O-N 2.83Å; E816-K837 IonicContact OE1-NZ 2.78Å; E816-K837 PolarHBondContact OE1-NZ 3.07Å; L818-K837 HydrophobicContact CD1-CB 4.12Å; L818-K837 HydrophobicContact CD1-CD 4.24Å; L818-K837 HydrophobicContact CG-CB 4.35Å; K837-F839 VanDerWaalsContact CE-CZ 3.47Å; K837-F839 VanDerWaalsContact NZ-CZ 3.29Å
838	S	96.1	Very high	96.8	Very high	31 Å²	31	49.7 Å²	49.7	22%	0.217	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	157.8	178	58.2	0	0	0	0	111.5	T774	T774-S838 PolarHBondContact N-O 3.09Å; T774-S838 PolarHBondContact O-N 3.29Å
839	F	95.9	Very high	96.9	Very high	42 Å²	42	42.5 Å²	42.5	18%	0.184	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	142.8	178.4	-67.4	-72.3	0	0	0	110.5	L771 K772 F812 I813 K837	L771-F839 HydrophobicContact CD1-CD1 4.33Å; K772-F839 WeakPolarHBondContact O-CA 3.39Å; F812-F839 HydrophobicContact CE1-CB 4.2Å; I813-F839 WeakPolarHBondContact CA-O 3.42Å; I813-F839 VanDerWaalsContact CB-O 3.23Å; I813-F839 WeakPolarHBondContact CB-O 3.45Å; I813-F839 WeakPolarHBondContact CG2-O 3.47Å; K837-F839 VanDerWaalsContact CE-CZ 3.47Å; K837-F839 VanDerWaalsContact NZ-CZ 3.29Å
840	T	95.5	Very high	97.1	Very high	42 Å²	42	40.6 Å²	40.6	26%	0.258	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	157.2	164.5	45.4	0	0	0	0	108.8	K772	K772-T840 PolarHBondContact N-O 3.39Å; K772-T840 PolarHBondContact O-N 3.35Å
841	I	96	Very high	97.1	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.01	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	111.8	-179.6	-59.8	167.4	0	0	0	108.8	L771 F790 L793 R843 F844 M878 Y881 G882 A883	L771-I841 HydrophobicContact CD2-CG1 3.95Å; F790-I841 HydrophobicContact CE1-CG2 4.14Å; F790-I841 HydrophobicContact CZ-CG2 4.24Å; L793-I841 HydrophobicContact CD1-CD1 3.9Å; I841-R843 WeakPolarHBondContact CG2-O 3.35Å; I841-F844 HydrophobicContact CB-CD1 4.39Å; I841-F844 HydrophobicContact CB-CE1 3.81Å; I841-F844 HydrophobicContact CB-CE2 4.38Å; I841-F844 HydrophobicContact CB-CZ 3.81Å; I841-F844 HydrophobicContact CD1-CD1 4.26Å; I841-F844 HydrophobicContact CD1-CE1 3.54Å; I841-F844 HydrophobicContact CD1-CZ 4.21Å; I841-F844 HydrophobicContact CG1-CE1 4.27Å; I841-F844 HydrophobicContact CG2-CD1 3.59Å; I841-F844 HydrophobicContact CG2-CD2 4.1Å; I841-F844 HydrophobicContact CG2-CE1 3.52Å; I841-F844 HydrophobicContact CG2-CE2 4.06Å; I841-F844 HydrophobicContact CG2-CG 3.88Å; I841-F844 HydrophobicContact CG2-CZ 3.77Å; I841-M878 HydrophobicContact CD1-CE 3.6Å; I841-Y881 PolarHBondContact N-O 3.41Å; I841-G882 CarbonylContact O-C 3.6Å; I841-G882 VanDerWaalsContact O-CA 3.31Å; I841-G882 WeakPolarHBondContact O-CA 3.36Å; I841-A883 PolarHBondContact O-N 2.88Å
842	Q	95.9	Very high	97.2	Very high	18 Å²	18	31.5 Å²	31.5	8%	0.084	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-37.8	178.6	-171.7	70.2	25.3	0	0	111.3	N745 A748 Q770 K772 F787 A883	N745-Q842 PolarHBondContact OD1-NE2 2.84Å; A748-Q842 HydrophobicContact CB-CG 3.71Å; Q770-Q842 HydrophobicContact CB-CB 4.33Å; Q770-Q842 HydrophobicContact CG-CB 4.34Å; Q770-Q842 PolarHBondContact O-N 3.27Å; K772-Q842 HydrophobicContact CB-CB 4.29Å; F787-Q842 HydrophobicContact CD1-CB 4.32Å; F787-Q842 HydrophobicContact CD1-CG 4.09Å; F787-Q842 HydrophobicContact CE1-CB 4.42Å; F787-Q842 HydrophobicContact CE1-CG 3.99Å; Q842-A883 VanDerWaalsContact OE1-CB 3.25Å
843	R	95.6	Very high	97.1	Very high	84 Å²	84	32.8 Å²	32.8	32%	0.317	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	130.6	177.7	-59.3	177.2	172.5	-92.2	-6	110.3	D749 W752 G769 Q770 I841	D749-R843 IonicContact OD1-CZ 2.84Å; D749-R843 IonicContact OD1-NH2 2.73Å; D749-R843 PolarHBondContact OD1-NH2 2.9Å; W752-R843 VanDerWaalsContact CD2-CD 3.45Å; G769-R843 CarbonylContact C-O 3.54Å; G769-R843 VanDerWaalsContact CA-O 3.26Å; G769-R843 WeakPolarHBondContact CA-O 3.23Å; Q770-R843 HydrophobicContact CB-CB 3.72Å; Q770-R843 HydrophobicContact CB-CG 3.96Å; Q770-R843 PolarHBondContact N-O 3.37Å; Q770-R843 PolarHBondContact O-N 2.71Å; I841-R843 WeakPolarHBondContact CG2-O 3.35Å
844	F	96.6	Very high	96.9	Very high	34 Å²	34	28.4 Å²	28.4	15%	0.149	13%	0.132	C	C	.	.			trans	-91.7	136.3	179.9	-71.5	-81.1	0	0	0	111.4	I841 M878 V889 Y891	I841-F844 HydrophobicContact CB-CD1 4.39Å; I841-F844 HydrophobicContact CB-CE1 3.81Å; I841-F844 HydrophobicContact CB-CE2 4.38Å; I841-F844 HydrophobicContact CB-CZ 3.81Å; I841-F844 HydrophobicContact CD1-CD1 4.26Å; I841-F844 HydrophobicContact CD1-CE1 3.54Å; I841-F844 HydrophobicContact CD1-CZ 4.21Å; I841-F844 HydrophobicContact CG1-CE1 4.27Å; I841-F844 HydrophobicContact CG2-CD1 3.59Å; I841-F844 HydrophobicContact CG2-CD2 4.1Å; I841-F844 HydrophobicContact CG2-CE1 3.52Å; I841-F844 HydrophobicContact CG2-CE2 4.06Å; I841-F844 HydrophobicContact CG2-CG 3.88Å; I841-F844 HydrophobicContact CG2-CZ 3.77Å; F844-M878 HydrophobicContact CD1-CB 4.28Å; F844-M878 HydrophobicContact CE1-CB 3.69Å; F844-M878 HydrophobicContact CE1-CE 4.09Å; F844-M878 HydrophobicContact CZ-CB 4.27Å; F844-M878 VanDerWaalsContact CZ-O 3.28Å; F844-M878 WeakPolarHBondContact CZ-O 3.25Å; F844-V889 HydrophobicContact CB-CG1 4.13Å; F844-V889 HydrophobicContact CD1-CG1 3.97Å; F844-V889 HydrophobicContact CD2-CB 4.37Å; F844-V889 HydrophobicContact CD2-CG1 4Å; F844-V889 HydrophobicContact CD2-CG2 3.84Å; F844-V889 HydrophobicContact CE1-CG1 4.39Å; F844-V889 HydrophobicContact CE2-CB 4.43Å; F844-V889 HydrophobicContact CE2-CG1 4.39Å; F844-V889 HydrophobicContact CE2-CG2 4.01Å; F844-V889 HydrophobicContact CG-CG1 3.77Å; F844-V889 HydrophobicContact CG-CG2 4.43Å; F844-Y891 HydrophobicContact CD1-CE2 4.34Å
845	P	97.2	Very high	96.3	Very high	5 Å²	5	27.3 Å²	27.3	3%	0.032	13%	0.127	C	C	.	.			trans	-71.8	169.7	174.8	32.8	-36.7	0	0	0	111.5	F767 F790 L848 Y891	F767-P845 WeakPolarHBondContact O-CB 3.43Å; F790-P845 HydrophobicContact CE2-CG 4.27Å; F790-P845 HydrophobicContact CZ-CG 4.38Å; P845-L848 HydrophobicContact CG-CB 4.09Å; P845-L848 HydrophobicContact CG-CD1 3.91Å; P845-Y891 PolarHBondContact O-OH 2.75Å
846	K	97.3	Very high	95.1	Very high	84 Å²	84	29.8 Å²	29.8	37%	0.365	14%	0.144	S	C	.	.	S	Bend	trans	-78.3	-41.2	173.2	-172.1	170.2	-176.1	177.3	0	112.1	E648 L766 R949	E648-K846 WeakPolarHBondContact OE1-CE 3.43Å; E648-K846 IonicContact OE1-NZ 2.65Å; E648-K846 PolarHBondContact OE1-NZ 3.46Å; E648-K846 WeakPolarHBondContact OE2-CE 3.32Å; E648-K846 IonicContact OE2-NZ 3.14Å; E648-K846 PolarHBondContact OE2-NZ 2.96Å; L766-K846 HydrophobicContact CD2-CD 4.29Å; L766-K846 PolarHBondContact O-N 3.29Å; L766-K846 VanDerWaalsContact O-N 3.14Å; K846-R949 VanDerWaalsContact O-CB 3.27Å; K846-R949 WeakPolarHBondContact O-CB 3.36Å; K846-R949 PolarHBondContact O-N 3.35Å
847	Y	98.3	Very high	93.3	Very high	1 Å²	1	37.9 Å²	37.9	0%	0.004	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	115.9	169.9	-68.6	-79.5	0	0	0	109	T646 Q647 E648 L766 Y894 Y947 E948	T646-Y847 HydrophobicContact CG2-CD1 3.94Å; T646-Y847 HydrophobicContact CG2-CD2 3.72Å; T646-Y847 HydrophobicContact CG2-CE1 3.81Å; T646-Y847 HydrophobicContact CG2-CE2 3.59Å; T646-Y847 HydrophobicContact CG2-CG 3.88Å; Q647-Y847 PolarHBondContact N-OH 2.85Å; E648-Y847 HydrophobicContact CB-CE2 4.34Å; E648-Y847 PolarHBondContact N-OH 3.34Å; L766-Y847 HydrophobicContact CB-CD2 3.94Å; L766-Y847 HydrophobicContact CD1-CD2 4.32Å; L766-Y847 HydrophobicContact CD1-CE2 4.19Å; L766-Y847 HydrophobicContact CD2-CD2 4.01Å; L766-Y847 HydrophobicContact CD2-CE2 3.85Å; L766-Y847 HydrophobicContact CG-CD2 4.28Å; L766-Y847 HydrophobicContact CG-CE2 4.39Å; L766-Y847 PolarHBondContact O-N 3.45Å; Y847-Y894 HydrophobicContact CD1-CD1 4.49Å; Y847-Y894 AromaticContact CD1-CE1 3.6Å; Y847-Y894 HydrophobicContact CD1-CE1 3.6Å; Y847-Y894 AromaticContact CD1-CZ 3.86Å; Y847-Y894 HydrophobicContact CE1-CE1 4.05Å; Y847-Y947 CarbonylContact C-O 3.44Å; Y847-Y947 VanDerWaalsContact CA-O 3.23Å; Y847-Y947 WeakPolarHBondContact CA-O 3.27Å; Y847-E948 HydrophobicContact CD1-CB 3.9Å; Y847-E948 HydrophobicContact CD1-CG 4.09Å; Y847-E948 HydrophobicContact CE1-CB 3.67Å; Y847-E948 HydrophobicContact CE1-CG 3.47Å; Y847-E948 VanDerWaalsContact CE1-CG 3.47Å; Y847-E948 WeakPolarHBondContact CE1-OE1 3.48Å; Y847-E948 PolarHBondContact OH-OE1 3.46Å
848	L	98.2	Very high	91.7	Very high	1 Å²	1	41 Å²	41	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	118.5	-179.2	177	62.1	0	0	0	109.8	F790 L793 P845 I850 M878 Y891 Y947	F790-L848 HydrophobicContact CE2-CD1 4.04Å; L793-L848 HydrophobicContact CD1-CD1 3.92Å; L793-L848 HydrophobicContact CG-CD1 4.08Å; P845-L848 HydrophobicContact CG-CB 4.09Å; P845-L848 HydrophobicContact CG-CD1 3.91Å; L848-I850 HydrophobicContact CD1-CG1 4.49Å; L848-I850 HydrophobicContact CD2-CD1 4.08Å; L848-I850 HydrophobicContact CD2-CG1 4.26Å; L848-I850 HydrophobicContact CG-CD1 4.34Å; L848-I850 HydrophobicContact CG-CG1 3.99Å; L848-M878 HydrophobicContact CD2-CE 3.96Å; L848-M878 HydrophobicContact CD2-CG 3.97Å; L848-M878 HydrophobicContact CD2-SD 4.05Å; L848-Y891 HydrophobicContact CB-CD1 3.99Å; L848-Y891 HydrophobicContact CB-CE1 3.48Å; L848-Y891 VanDerWaalsContact CB-CE1 3.48Å; L848-Y891 HydrophobicContact CB-CE2 4.39Å; L848-Y891 HydrophobicContact CD2-CD2 4.18Å; L848-Y891 HydrophobicContact CD2-CE1 4.41Å; L848-Y891 HydrophobicContact CD2-CE2 3.86Å; L848-Y947 PolarHBondContact N-O 3.31Å; L848-Y947 WeakPolarHBondContact O-CB 3.22Å; L848-Y947 PolarHBondContact O-N 3.4Å
849	V	98.6	Very high	90	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	126.6	172.2	-177.6	0	0	0	0	108.8	L716 F767 D792 L793 I944 L945 F946	L716-V849 HydrophobicContact CD2-CG1 3.86Å; F767-V849 HydrophobicContact CD1-CG2 3.97Å; F767-V849 HydrophobicContact CE1-CG2 4.22Å; D792-V849 CarbonylContact C-O 3.56Å; D792-V849 WeakPolarHBondContact CA-O 3.49Å; D792-V849 HydrophobicContact CB-CB 4.03Å; D792-V849 HydrophobicContact CB-CG1 3.96Å; L793-V849 PolarHBondContact N-O 2.89Å; V849-I944 HydrophobicContact CG1-CG2 3.51Å; V849-L945 WeakPolarHBondContact CA-O 3.38Å; V849-F946 HydrophobicContact CG1-CE1 4.38Å; V849-F946 HydrophobicContact CG2-CD1 3.84Å; V849-F946 HydrophobicContact CG2-CE1 3.95Å
850	I	98.6	Very high	88.8	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	118.2	175.1	-52.7	177.3	0	0	0	109.1	L793 V795 L805 L848 L876 I944 L945 Y947	L793-I850 WeakPolarHBondContact O-CA 3.49Å; V795-I850 HydrophobicContact CG1-CG2 4.05Å; V795-I850 HydrophobicContact CG2-CG2 3.77Å; L805-I850 HydrophobicContact CD1-CG2 4.23Å; L805-I850 HydrophobicContact CD2-CD1 4.16Å; L848-I850 HydrophobicContact CD1-CG1 4.49Å; L848-I850 HydrophobicContact CD2-CD1 4.08Å; L848-I850 HydrophobicContact CD2-CG1 4.26Å; L848-I850 HydrophobicContact CG-CD1 4.34Å; L848-I850 HydrophobicContact CG-CG1 3.99Å; I850-L876 HydrophobicContact CD1-CD2 3.88Å; I850-I944 WeakPolarHBondContact O-CA 3.3Å; I850-L945 HydrophobicContact CB-CB 4.42Å; I850-L945 PolarHBondContact N-O 3.14Å; I850-L945 PolarHBondContact O-N 3.46Å; I850-Y947 HydrophobicContact CD1-CD2 4.13Å; I850-Y947 HydrophobicContact CD1-CE2 3.99Å; I850-Y947 HydrophobicContact CG1-CD2 4.49Å
851	H	98.4	Very high	88	Confident	17 Å²	17	57 Å²	57	8%	0.079	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	122.9	174.9	156.7	-139.8	0	0	0	109.6	Q713 L793 S794 V795 K853 Y943	Q713-H851 HydrophobicContact CG-CB 3.9Å; Q713-H851 PolarHBondContact NE2-ND1 3.4Å; L793-H851 PolarHBondContact O-N 3.14Å; S794-H851 CarbonylContact C-O 3.58Å; S794-H851 WeakPolarHBondContact CA-O 3.44Å; S794-H851 WeakPolarHBondContact CB-ND1 3.47Å; S794-H851 PolarHBondContact OG-ND1 3.24Å; V795-H851 PolarHBondContact N-O 2.91Å; H851-K853 PolarHBondContact O-N 2.89Å; H851-Y943 AromaticContact CD2-CE2 3.35Å; H851-Y943 WeakPolarHBondContact CD2-CE2 3.06Å; H851-Y943 AromaticContact CD2-CZ 3.52Å; H851-Y943 PolarHBondContact CD2-OH 3.36Å; H851-Y943 AromaticContact NE2-CE2 3.28Å; H851-Y943 VanDerWaalsContact NE2-CE2 3.28Å; H851-Y943 WeakPolarHBondContact NE2-CE2 3.25Å; H851-Y943 AromaticContact NE2-CZ 3.4Å; H851-Y943 PolarHBondContact NE2-OH 3.45Å
852	L	97.7	Very high	87.7	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	110.2	174.7	-61.6	175.7	0	0	0	108.8	V795 L797 L805 R854 V867 A942 Y943	V795-L852 HydrophobicContact CG2-CD2 3.71Å; L797-L852 HydrophobicContact CD1-CB 4.1Å; L805-L852 HydrophobicContact CD1-CD2 4.07Å; L852-R854 HydrophobicContact CB-CG 4.33Å; L852-R854 PolarHBondContact O-N 2.93Å; L852-V867 HydrophobicContact CD1-CB 4.05Å; L852-V867 HydrophobicContact CD1-CG1 4.37Å; L852-V867 HydrophobicContact CD1-CG2 3.96Å; L852-V867 HydrophobicContact CD2-CG1 4.25Å; L852-V867 HydrophobicContact CD2-CG2 4.3Å; L852-A942 WeakPolarHBondContact CD1-O 3.44Å; L852-Y943 PolarHBondContact N-O 2.74Å; L852-Y943 WeakPolarHBondContact O-CD2 3.27Å; L852-Y943 VanDerWaalsContact O-CE2 3.27Å; L852-Y943 WeakPolarHBondContact O-CE2 3.49Å
853	K	95.3	Very high	87.4	Confident	93 Å²	93	59 Å²	59	40%	0.404	28%	0.275	S	S	.	.			trans	-65.1	69.4	-179.2	-74.3	171.3	158.7	147.6	0	113.3	S794 V795 L797 H851 F855	S794-K853 WeakPolarHBondContact O-CD 3.13Å; S794-K853 WeakPolarHBondContact O-CE 3.41Å; S794-K853 PolarHBondContact O-NZ 2.65Å; V795-K853 VanDerWaalsContact O-CB 3.26Å; V795-K853 WeakPolarHBondContact O-CB 3.28Å; V795-K853 WeakPolarHBondContact O-CG 3.25Å; V795-K853 PolarHBondContact O-N 3.42Å; L797-K853 HydrophobicContact CD1-CB 4.43Å; H851-K853 PolarHBondContact O-N 2.89Å; K853-F855 VanDerWaalsContact C-N 3.34Å
854	R	93.9	Very high	87.3	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.289	C	S	.	.			trans	-79.8	-15.2	-179.2	-67.8	-174.3	-179.4	-76.1	1.4	113.8	L797 L852 K862 L863 N865 S940 A942 Y943	L797-R854 HydrophobicContact CD2-CG 4.14Å; L852-R854 HydrophobicContact CB-CG 4.33Å; L852-R854 PolarHBondContact O-N 2.93Å; R854-K862 HydrophobicContact CB-CG 4.08Å; R854-K862 CarbonylContact O-C 3.55Å; R854-K862 WeakPolarHBondContact O-CA 3.49Å; R854-L863 HydrophobicContact CB-CB 4.34Å; R854-L863 WeakPolarHBondContact CD-O 3.22Å; R854-L863 HydrophobicContact CG-CB 4.49Å; R854-L863 WeakPolarHBondContact CG-O 3.41Å; R854-L863 PolarHBondContact NH1-O 3Å; R854-L863 PolarHBondContact O-N 3.35Å; R854-N865 PolarHBondContact NH1-O 2.98Å; R854-N865 PolarHBondContact NH2-O 3.3Å; R854-N865 VanDerWaalsContact NH2-O 3.1Å; R854-S940 VanDerWaalsContact CZ-O 3.3Å; R854-S940 PolarHBondContact NH2-O 3.44Å; R854-A942 VanDerWaalsContact CZ-O 3.28Å; R854-A942 PolarHBondContact NE-O 3.07Å; R854-A942 PolarHBondContact NH2-O 3.29Å; R854-Y943 HydrophobicContact CB-CD2 4.3Å; R854-Y943 HydrophobicContact CB-CE2 4.46Å; R854-Y943 HydrophobicContact CG-CD2 4.32Å
855	F	85.8	Confident	87.1	Confident	54 Å²	54	58.6 Å²	58.6	24%	0.237	29%	0.287	C	S	.	.			trans	-106.9	145.7	175.3	-51.2	-57.8	0	0	0	109.8	D711 K853 K862 H899 T903 Y943	D711-F855 WeakPolarHBondContact OD2-CD2 3.19Å; D711-F855 WeakPolarHBondContact OD2-CE2 3.26Å; K853-F855 VanDerWaalsContact C-N 3.34Å; F855-K862 HydrophobicContact CD1-CB 4.22Å; F855-K862 HydrophobicContact CD1-CG 4.1Å; F855-K862 HydrophobicContact CE1-CB 4.17Å; F855-K862 HydrophobicContact CE1-CD 4.01Å; F855-K862 HydrophobicContact CE1-CG 3.88Å; F855-H899 AromaticContact CE1-CE1 3.97Å; F855-H899 AromaticContact CE1-ND1 3.92Å; F855-H899 AromaticContact CZ-CE1 3.56Å; F855-H899 AromaticContact CZ-ND1 3.34Å; F855-H899 VanDerWaalsContact CZ-ND1 3.34Å; F855-H899 WeakPolarHBondContact CZ-ND1 3.37Å; F855-T903 HydrophobicContact CD1-CG2 3.66Å; F855-T903 HydrophobicContact CE1-CG2 4.24Å; F855-Y943 HydrophobicContact CD2-CE2 4.03Å; F855-Y943 AromaticContact CD2-CZ 3.96Å; F855-Y943 HydrophobicContact CE2-CE1 4.2Å; F855-Y943 AromaticContact CE2-CE2 3.93Å; F855-Y943 HydrophobicContact CE2-CE2 3.93Å; F855-Y943 AromaticContact CE2-CZ 3.71Å
856	S	72.5	Confident	87.1	Confident	54 Å²	54	60.7 Å²	60.7	38%	0.378	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-150.7	134.4	174.1	178.8	0	0	0	0	109.1	T858 R859	S856-T858 PolarHBondContact O-N 2.93Å; S856-T858 VanDerWaalsContact O-N 3.12Å; S856-T858 PolarHBondContact OG-N 3.38Å; S856-T858 PolarHBondContact OG-OG1 3.25Å; S856-R859 CarbonylContact O-C 3.47Å; S856-R859 PolarHBondContact O-N 2.95Å
857	E	60	Low	87.1	Confident	186 Å²	186	56.7 Å²	56.7	87%	0.869	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-28.7	177	-60.5	176.1	-172.4	0	0	112.5	R859	E857-R859 VanDerWaalsContact C-N 3.3Å; E857-R859 PolarHBondContact O-N 3.36Å
858	T	61.5	Low	87	Confident	112 Å²	112	59.6 Å²	59.6	69%	0.687	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-14.5	176.5	67.3	0	0	0	0	114.1	S856	S856-T858 PolarHBondContact O-N 2.93Å; S856-T858 VanDerWaalsContact O-N 3.12Å; S856-T858 PolarHBondContact OG-N 3.38Å; S856-T858 PolarHBondContact OG-OG1 3.25Å
859	R	62.3	Low	86.9	Confident	128 Å²	128	60 Å²	60	48%	0.483	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	-124	112.9	-174.9	-62.8	-170.2	-175.6	-164.5	2.6	110.9	S856 E857 S861	S856-R859 CarbonylContact O-C 3.47Å; S856-R859 PolarHBondContact O-N 2.95Å; E857-R859 VanDerWaalsContact C-N 3.3Å; E857-R859 PolarHBondContact O-N 3.36Å; R859-S861 PolarHBondContact O-N 3.23Å
860	W	68.9	Low	86.6	Confident	248 Å²	248	60.6 Å²	60.6	94%	0.939	30%	0.3	S	S	*	.	S	Bend	trans	-61.4	3.2	172.6	-50.6	84	0	0	0	114.5	T903	W860-T903 PolarHBondContact O-OG1 3.43Å
861	S	79.4	Confident	86	Confident	74 Å²	74	62.2 Å²	62.2	52%	0.517	31%	0.31	S	S	.	.	S	Bend	trans	-139.1	145.8	-176.4	56.5	0	0	0	0	112	R859	R859-S861 PolarHBondContact O-N 3.23Å
862	K	89.6	Confident	85.1	Confident	34 Å²	34	63.5 Å²	63.5	15%	0.148	32%	0.321	C	S	.	.			trans	-74.7	139.4	176.5	178	-170.5	174.1	-177.8	0	111	R854 F855 S864 H899 G901 T903	R854-K862 HydrophobicContact CB-CG 4.08Å; R854-K862 CarbonylContact O-C 3.55Å; R854-K862 WeakPolarHBondContact O-CA 3.49Å; F855-K862 HydrophobicContact CD1-CB 4.22Å; F855-K862 HydrophobicContact CD1-CG 4.1Å; F855-K862 HydrophobicContact CE1-CB 4.17Å; F855-K862 HydrophobicContact CE1-CD 4.01Å; F855-K862 HydrophobicContact CE1-CG 3.88Å; K862-S864 PolarHBondContact O-N 3.4Å; K862-H899 PolarHBondContact NZ-ND1 3Å; K862-H899 VanDerWaalsContact NZ-ND1 3.11Å; K862-H899 PolarHBondContact NZ-O 2.95Å; K862-G901 WeakPolarHBondContact CD-O 3.23Å; K862-G901 PolarHBondContact NZ-O 2.99Å; K862-T903 HydrophobicContact CB-CG2 4.48Å
863	L	90.6	Very high	83.8	Confident	29 Å²	29	71.2 Å²	71.2	15%	0.152	36%	0.362	C	S	.	.			trans	-71.7	112.7	171.3	-53.9	-175.3	0	0	0	110.4	L797 R854	L797-L863 HydrophobicContact CB-CD1 4.13Å; L797-L863 HydrophobicContact CD2-CB 4.36Å; L797-L863 HydrophobicContact CD2-CD1 4.48Å; R854-L863 HydrophobicContact CB-CB 4.34Å; R854-L863 WeakPolarHBondContact CD-O 3.22Å; R854-L863 HydrophobicContact CG-CB 4.49Å; R854-L863 WeakPolarHBondContact CG-O 3.41Å; R854-L863 PolarHBondContact NH1-O 3Å; R854-L863 PolarHBondContact O-N 3.35Å
864	S	91.8	Very high	83.3	Confident	88 Å²	88	70.3 Å²	70.3	62%	0.615	37%	0.367	S	S	*	.			trans	-93.8	11.8	-180	54	0	0	0	0	113.9	K862 S940	K862-S864 PolarHBondContact O-N 3.4Å; S864-S940 WeakPolarHBondContact O-CB 3.31Å
865	N	93.9	Very high	83.2	Confident	20 Å²	20	74 Å²	74	11%	0.107	38%	0.384	C	S	.	.			trans	-58.7	135.9	-177.7	-48.2	48.3	0	0	0	110.8	L797 P798 S800 S801 R854 V867	L797-N865 HydrophobicContact CD2-CB 4.3Å; P798-N865 PolarHBondContact O-ND2 2.84Å; S800-N865 PolarHBondContact O-ND2 2.85Å; S801-N865 CarbonylContact O-C 3.57Å; S801-N865 VanDerWaalsContact O-CA 3.29Å; S801-N865 WeakPolarHBondContact O-CA 3.42Å; R854-N865 PolarHBondContact NH1-O 2.98Å; R854-N865 PolarHBondContact NH2-O 3.3Å; R854-N865 VanDerWaalsContact NH2-O 3.1Å; N865-V867 PolarHBondContact O-N 3.37Å
866	I	96.4	Very high	83.6	Confident	49 Å²	49	71.4 Å²	71.4	25%	0.251	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	119.3	175.5	-60.3	172.7	0	0	0	107.9	S801 R802 C803 V938	S801-I866 PolarHBondContact O-N 3.14Å; R802-I866 VanDerWaalsContact CA-O 3.32Å; R802-I866 WeakPolarHBondContact CA-O 3.25Å; R802-I866 HydrophobicContact CG-CB 4.14Å; R802-I866 HydrophobicContact CG-CG2 4.36Å; C803-I866 PolarHBondContact N-O 2.81Å; I866-V938 HydrophobicContact CG2-CG1 4.02Å
867	V	97.1	Very high	84.6	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	112.5	172.5	-176.8	0	0	0	0	107	L797 C803 L805 L852 N865 F869	L797-V867 HydrophobicContact CD2-CG2 3.99Å; L797-V867 HydrophobicContact CG-CG2 4.41Å; C803-V867 CarbonylContact O-C 3.55Å; C803-V867 WeakPolarHBondContact O-CA 3.46Å; L805-V867 HydrophobicContact CB-CG1 4.13Å; L805-V867 HydrophobicContact CD1-CG1 4.28Å; L852-V867 HydrophobicContact CD1-CB 4.05Å; L852-V867 HydrophobicContact CD1-CG1 4.37Å; L852-V867 HydrophobicContact CD1-CG2 3.96Å; L852-V867 HydrophobicContact CD2-CG1 4.25Å; L852-V867 HydrophobicContact CD2-CG2 4.3Å; N865-V867 PolarHBondContact O-N 3.37Å; V867-F869 WeakPolarHBondContact O-CD1 3.43Å; V867-F869 WeakPolarHBondContact O-CE1 3.37Å
868	E	96	Very high	86.2	Confident	62 Å²	62	63.7 Å²	63.7	29%	0.29	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	132.9	168.9	-57.5	-177.2	146.5	0	0	108.9	R802 C803 K804 L805 V938	R802-E868 HydrophobicContact CG-CG 4.37Å; R802-E868 IonicContact CZ-OE1 3.81Å; R802-E868 IonicContact NE-OE1 2.72Å; R802-E868 PolarHBondContact NE-OE1 3.04Å; R802-E868 IonicContact NH2-OE1 2.65Å; R802-E868 PolarHBondContact NH2-OE1 3.39Å; C803-E868 PolarHBondContact O-N 3.01Å; K804-E868 CarbonylContact C-O 3.59Å; K804-E868 WeakPolarHBondContact CA-O 3.42Å; K804-E868 HydrophobicContact CG-CB 4.41Å; L805-E868 WeakPolarHBondContact CB-O 3.32Å; L805-E868 PolarHBondContact N-O 3.34Å; E868-V938 HydrophobicContact CG-CG1 4.42Å
869	F	95.9	Very high	87.6	Confident	11 Å²	11	58.7 Å²	58.7	5%	0.048	30%	0.304	C	S	.	.			trans	-138.1	154.4	177.5	44.6	-100.6	0	0	0	109.8	L805 V867 T871 L893 I896 L937 V938 A942 L945	L805-F869 HydrophobicContact CB-CB 4.01Å; L805-F869 HydrophobicContact CD2-CB 3.82Å; V867-F869 WeakPolarHBondContact O-CD1 3.43Å; V867-F869 WeakPolarHBondContact O-CE1 3.37Å; F869-T871 HydrophobicContact CD2-CG2 3.92Å; F869-T871 HydrophobicContact CE2-CG2 3.91Å; F869-T871 PolarHBondContact O-N 3.45Å; F869-L893 HydrophobicContact CD2-CD2 3.71Å; F869-L893 HydrophobicContact CE2-CD2 3.55Å; F869-I896 HydrophobicContact CE2-CD1 3.91Å; F869-I896 HydrophobicContact CZ-CD1 3.86Å; F869-L937 HydrophobicContact CE2-CB 4.39Å; F869-V938 HydrophobicContact CD2-CG2 4.2Å; F869-V938 HydrophobicContact CE1-CG2 4.42Å; F869-V938 HydrophobicContact CE2-CG2 3.92Å; F869-V938 HydrophobicContact CZ-CB 4.49Å; F869-V938 HydrophobicContact CZ-CG2 4.05Å; F869-A942 HydrophobicContact CE1-CB 3.8Å; F869-A942 HydrophobicContact CZ-CB 4.21Å; F869-L945 HydrophobicContact CB-CD1 4.17Å; F869-L945 HydrophobicContact CD1-CD1 3.86Å; F869-L945 HydrophobicContact CD1-CD2 4.03Å; F869-L945 HydrophobicContact CE1-CD1 4.45Å; F869-L945 HydrophobicContact CE1-CD2 3.81Å; F869-L945 HydrophobicContact CE2-CD2 4.33Å; F869-L945 HydrophobicContact CG-CD1 4.02Å; F869-L945 HydrophobicContact CG-CD2 4.39Å; F869-L945 HydrophobicContact CZ-CD2 3.96Å
870	P	92.9	Very high	89	Confident	14 Å²	14	56.8 Å²	56.8	9%	0.091	31%	0.31	C	S	.	.			trans	-56.8	135.1	177.3	-27.2	36.8	0	0	0	112.3	S874 L876	P870-S874 WeakPolarHBondContact CB-O 3.49Å; P870-L876 HydrophobicContact CB-CB 4.48Å; P870-L876 HydrophobicContact CG-CB 4.04Å; P870-L876 HydrophobicContact CG-CD1 4.11Å
871	T	86.6	Confident	90.2	Very high	34 Å²	34	45.5 Å²	45.5	21%	0.209	27%	0.268	C	S	.	.			trans	-136.9	173.7	179.4	53.3	0	0	0	0	109.5	F869 D873 S874 L893 L937 V938	F869-T871 HydrophobicContact CD2-CG2 3.92Å; F869-T871 HydrophobicContact CE2-CG2 3.91Å; F869-T871 PolarHBondContact O-N 3.45Å; T871-D873 PolarHBondContact O-N 2.9Å; T871-S874 VanDerWaalsContact O-CB 3.25Å; T871-S874 WeakPolarHBondContact O-CB 3.29Å; T871-S874 PolarHBondContact O-N 2.9Å; T871-L893 HydrophobicContact CG2-CD2 4.44Å; T871-L937 HydrophobicContact CG2-CB 4.24Å; T871-L937 HydrophobicContact CG2-CD1 3.94Å; T871-V938 HydrophobicContact CG2-CG2 4.11Å
872	S	77.9	Confident	90.8	Very high	44 Å²	44	42.6 Å²	42.6	31%	0.308	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	-133.2	-178.4	-53.2	0	0	0	0	111.6	S874 E934	S872-S874 VanDerWaalsContact C-N 3.28Å; S872-E934 WeakPolarHBondContact CA-OE2 3.27Å; S872-E934 WeakPolarHBondContact CB-OE2 3.42Å; S872-E934 PolarHBondContact OG-OE2 3.22Å
873	D	71.7	Confident	90.7	Very high	161 Å²	161	42.6 Å²	42.6	86%	0.861	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	4.8	175.7	-50.2	-52.6	0	0	0	112.4	T871 E875	T871-D873 PolarHBondContact O-N 2.9Å; D873-E875 PolarHBondContact O-N 3.03Å
874	S	84.2	Confident	90.2	Very high	74 Å²	74	45 Å²	45	52%	0.517	27%	0.269	S	S	.	.			trans	-81.5	114.3	172.3	-169.2	0	0	0	0	109.7	P870 T871 S872	P870-S874 WeakPolarHBondContact CB-O 3.49Å; T871-S874 VanDerWaalsContact O-CB 3.25Å; T871-S874 WeakPolarHBondContact O-CB 3.29Å; T871-S874 PolarHBondContact O-N 2.9Å; S872-S874 VanDerWaalsContact C-N 3.28Å
875	E	91.1	Very high	88.7	Confident	78 Å²	78	46.3 Å²	46.3	36%	0.364	28%	0.278	S	S	.	.			trans	-84.4	150.9	177.8	-59.5	174.5	124	0	0	111.8	D873 N877 H890 Y891 T950	D873-E875 PolarHBondContact O-N 3.03Å; E875-N877 PolarHBondContact O-N 3.23Å; E875-H890 HydrophobicContact CB-CB 4.12Å; E875-H890 IonicContact OE2-CE1 3.62Å; E875-H890 IonicContact OE2-CG 3.22Å; E875-H890 IonicContact OE2-ND1 2.98Å; E875-H890 PolarHBondContact OE2-ND1 2.72Å; E875-Y891 CarbonylContact C-O 3.51Å; E875-Y891 WeakPolarHBondContact CA-O 3.26Å; E875-T950 WeakPolarHBondContact OE1-CB 3.31Å; E875-T950 WeakPolarHBondContact OE1-CG2 3.43Å; E875-T950 PolarHBondContact OE1-OG1 3.33Å
876	L	94.1	Very high	87.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	32%	0.315	C	S	.	.			trans	-82.4	104.9	167.2	177.3	65.8	0	0	0	109.2	L805 L809 I850 P870 M878 Y891 Y947	L805-L876 HydrophobicContact CD2-CD1 4.16Å; L805-L876 HydrophobicContact CD2-CD2 3.83Å; L809-L876 HydrophobicContact CD1-CD1 4.31Å; I850-L876 HydrophobicContact CD1-CD2 3.88Å; P870-L876 HydrophobicContact CB-CB 4.48Å; P870-L876 HydrophobicContact CG-CB 4.04Å; P870-L876 HydrophobicContact CG-CD1 4.11Å; L876-M878 HydrophobicContact CD1-SD 4.49Å; L876-M878 HydrophobicContact CD2-CG 4.19Å; L876-M878 HydrophobicContact CD2-SD 3.81Å; L876-M878 HydrophobicContact CG-CG 4.07Å; L876-M878 HydrophobicContact CG-SD 3.97Å; L876-M878 PolarHBondContact O-N 2.97Å; L876-Y891 PolarHBondContact N-O 2.65Å; L876-Y891 PolarHBondContact O-N 2.79Å; L876-Y947 HydrophobicContact CB-CD1 4.27Å; L876-Y947 HydrophobicContact CB-CE1 3.77Å; L876-Y947 HydrophobicContact CD2-CD1 4.35Å; L876-Y947 HydrophobicContact CD2-CD2 4.29Å; L876-Y947 HydrophobicContact CD2-CE1 3.96Å; L876-Y947 HydrophobicContact CD2-CE2 3.89Å
877	N	93.6	Very high	85.7	Confident	78 Å²	78	52.4 Å²	52.4	42%	0.417	31%	0.314	S	S	.	.			trans	-73.1	114.3	171	-177.1	-11.1	0	0	0	109.5	E875 G879	E875-N877 PolarHBondContact O-N 3.23Å; N877-G879 PolarHBondContact OD1-N 3.17Å
878	M	94.4	Very high	85.1	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	35%	0.347	C	S	.	.			trans	-101.2	-4.2	178.5	-73.7	-64.7	-59.4	0	0	113.4	L793 L809 I841 F844 L848 L876 S880 Y881 V889 Y891	L793-M878 HydrophobicContact CD1-CE 4.33Å; L809-M878 HydrophobicContact CD1-CE 4.39Å; L809-M878 HydrophobicContact CD1-SD 3.68Å; L809-M878 HydrophobicContact CD2-CE 4.11Å; L809-M878 HydrophobicContact CD2-SD 4.4Å; I841-M878 HydrophobicContact CD1-CE 3.6Å; F844-M878 HydrophobicContact CD1-CB 4.28Å; F844-M878 HydrophobicContact CE1-CB 3.69Å; F844-M878 HydrophobicContact CE1-CE 4.09Å; F844-M878 HydrophobicContact CZ-CB 4.27Å; F844-M878 VanDerWaalsContact CZ-O 3.28Å; F844-M878 WeakPolarHBondContact CZ-O 3.25Å; L848-M878 HydrophobicContact CD2-CE 3.96Å; L848-M878 HydrophobicContact CD2-CG 3.97Å; L848-M878 HydrophobicContact CD2-SD 4.05Å; L876-M878 HydrophobicContact CD1-SD 4.49Å; L876-M878 HydrophobicContact CD2-CG 4.19Å; L876-M878 HydrophobicContact CD2-SD 3.81Å; L876-M878 HydrophobicContact CG-CG 4.07Å; L876-M878 HydrophobicContact CG-SD 3.97Å; L876-M878 PolarHBondContact O-N 2.97Å; M878-S880 VanDerWaalsContact C-N 3.29Å; M878-S880 PolarHBondContact O-N 3.27Å; M878-Y881 HydrophobicContact CE-CD2 4.01Å; M878-Y881 HydrophobicContact CE-CG 4.42Å; M878-Y881 PolarHBondContact O-N 3.14Å; M878-Y881 HydrophobicContact SD-CD2 4.04Å; M878-V889 HydrophobicContact CB-CG1 4.16Å; M878-V889 PolarHBondContact N-O 3.19Å; M878-Y891 HydrophobicContact CB-CD2 3.96Å; M878-Y891 HydrophobicContact CB-CE2 3.9Å; M878-Y891 HydrophobicContact CG-CD2 3.45Å; M878-Y891 VanDerWaalsContact CG-CD2 3.45Å; M878-Y891 HydrophobicContact CG-CE2 3.65Å
879	G	91.8	Very high	85	Confident	7 Å²	7	55.9 Å²	55.9	7%	0.072	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-61.7	-32	-171.5	0	0	0	0	0	114.5	N877 Y881 G882 S887	N877-G879 PolarHBondContact OD1-N 3.17Å; G879-Y881 PolarHBondContact O-N 3.41Å; G879-G882 PolarHBondContact O-N 3.26Å; G879-G882 VanDerWaalsContact O-N 3.14Å; G879-S887 VanDerWaalsContact CA-O 3.26Å; G879-S887 WeakPolarHBondContact CA-O 3.26Å
880	S	91.4	Very high	84.9	Confident	87 Å²	87	57.5 Å²	57.5	61%	0.608	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-65.2	-23	175	49.4	0	0	0	0	114.1	M878	M878-S880 VanDerWaalsContact C-N 3.29Å; M878-S880 PolarHBondContact O-N 3.27Å
881	Y	93.6	Very high	85.1	Confident	11 Å²	11	56.8 Å²	56.8	4%	0.043	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-90.9	-3.1	176.9	-55	-71.1	0	0	0	112.5	E806 L809 D810 I813 I841 M878 G879	E806-Y881 PolarHBondContact O-OH 2.98Å; L809-Y881 HydrophobicContact CB-CD1 4.15Å; L809-Y881 HydrophobicContact CB-CD2 4.4Å; L809-Y881 HydrophobicContact CB-CE1 3.63Å; L809-Y881 HydrophobicContact CB-CE2 3.9Å; L809-Y881 HydrophobicContact CD1-CD2 4.33Å; L809-Y881 HydrophobicContact CD1-CE2 3.86Å; L809-Y881 HydrophobicContact CG-CE2 4.48Å; D810-Y881 VanDerWaalsContact OD1-CE1 3.23Å; D810-Y881 WeakPolarHBondContact OD1-CE1 3.5Å; D810-Y881 PolarHBondContact OD1-OH 3.36Å; I813-Y881 HydrophobicContact CD1-CD1 3.69Å; I813-Y881 HydrophobicContact CD1-CE1 4.05Å; I813-Y881 HydrophobicContact CG1-CD1 3.88Å; I813-Y881 HydrophobicContact CG1-CE1 4.16Å; I813-Y881 HydrophobicContact CG2-CD1 3.89Å; I841-Y881 PolarHBondContact N-O 3.41Å; M878-Y881 HydrophobicContact CE-CD2 4.01Å; M878-Y881 HydrophobicContact CE-CG 4.42Å; M878-Y881 PolarHBondContact O-N 3.14Å; M878-Y881 HydrophobicContact SD-CD2 4.04Å; G879-Y881 PolarHBondContact O-N 3.41Å
882	G	92.2	Very high	85.5	Confident	13 Å²	13	56.7 Å²	56.7	13%	0.134	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-76.9	145.5	178.4	0	0	0	0	0	112.9	I841 G879 N884	I841-G882 CarbonylContact O-C 3.6Å; I841-G882 VanDerWaalsContact O-CA 3.31Å; I841-G882 WeakPolarHBondContact O-CA 3.36Å; G879-G882 PolarHBondContact O-N 3.26Å; G879-G882 VanDerWaalsContact O-N 3.14Å; G882-N884 PolarHBondContact O-N 3.2Å
883	A	86.9	Confident	86.4	Confident	34 Å²	34	54.9 Å²	54.9	28%	0.281	33%	0.325	S	S	.	.	S	Bend	trans	-68.5	-10	173	0	0	0	0	0	113.6	I841 Q842	I841-A883 PolarHBondContact O-N 2.88Å; Q842-A883 VanDerWaalsContact OE1-CB 3.25Å
884	N	79.8	Confident	87.6	Confident	79 Å²	79	47.9 Å²	47.9	42%	0.422	29%	0.287	S	S	.	.	S	Bend	trans	-123.3	113.3	177.8	-64.3	-64.5	0	0	0	109.8	G882 N886 S887	G882-N884 PolarHBondContact O-N 3.2Å; N884-N886 PolarHBondContact O-N 3.35Å; N884-S887 PolarHBondContact O-N 3.43Å; N884-S887 PolarHBondContact O-OG 2.99Å
885	S	60.1	Low	88.3	Confident	117 Å²	117	44.3 Å²	44.3	82%	0.818	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-13.9	-168	-40.4	0	0	0	0	116.3
886	N	60.5	Low	88.6	Confident	163 Å²	163	40.6 Å²	40.6	87%	0.872	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.6	18.8	-174.4	-62.4	2.4	0	0	0	112.7	N884 N888	N884-N886 PolarHBondContact O-N 3.35Å; N886-N888 PolarHBondContact O-N 2.98Å
887	S	67.6	Low	88.8	Confident	34 Å²	34	40.6 Å²	40.6	24%	0.238	25%	0.245	C	C	.	.			trans	-88	102	-173.6	74	0	0	0	0	112.3	G879 N884 V889	G879-S887 VanDerWaalsContact CA-O 3.26Å; G879-S887 WeakPolarHBondContact CA-O 3.26Å; N884-S887 PolarHBondContact O-N 3.43Å; N884-S887 PolarHBondContact O-OG 2.99Å; S887-V889 PolarHBondContact O-N 3.17Å
888	N	84.6	Confident	89.1	Confident	130 Å²	130	37.4 Å²	37.4	70%	0.695	23%	0.227	S	C	*	.			trans	-71.6	93.4	167.6	-168.3	49	0	0	0	108.9	N886	N886-N888 PolarHBondContact O-N 2.98Å
889	V	93.1	Very high	89.2	Confident	4 Å²	4	37.6 Å²	37.6	2%	0.024	23%	0.228	C	C	.	.			trans	-129.1	98.9	-174.3	-176.4	0	0	0	0	108.9	F844 M878 S887 Y891	F844-V889 HydrophobicContact CB-CG1 4.13Å; F844-V889 HydrophobicContact CD1-CG1 3.97Å; F844-V889 HydrophobicContact CD2-CB 4.37Å; F844-V889 HydrophobicContact CD2-CG1 4Å; F844-V889 HydrophobicContact CD2-CG2 3.84Å; F844-V889 HydrophobicContact CE1-CG1 4.39Å; F844-V889 HydrophobicContact CE2-CB 4.43Å; F844-V889 HydrophobicContact CE2-CG1 4.39Å; F844-V889 HydrophobicContact CE2-CG2 4.01Å; F844-V889 HydrophobicContact CG-CG1 3.77Å; F844-V889 HydrophobicContact CG-CG2 4.43Å; M878-V889 HydrophobicContact CB-CG1 4.16Å; M878-V889 PolarHBondContact N-O 3.19Å; S887-V889 PolarHBondContact O-N 3.17Å; V889-Y891 HydrophobicContact CG1-CD2 4.18Å; V889-Y891 HydrophobicContact CG1-CE2 3.55Å
890	H	94.5	Very high	89.4	Confident	45 Å²	45	40.7 Å²	40.7	21%	0.208	24%	0.242	C	C	.	.			trans	-112.7	156.4	-178	-79	-138.4	0	0	0	110.4	E875 T950	E875-H890 HydrophobicContact CB-CB 4.12Å; E875-H890 IonicContact OE2-CE1 3.62Å; E875-H890 IonicContact OE2-CG 3.22Å; E875-H890 IonicContact OE2-ND1 2.98Å; E875-H890 PolarHBondContact OE2-ND1 2.72Å; H890-T950 VanDerWaalsContact C-OG1 3.3Å; H890-T950 WeakPolarHBondContact CB-OG1 3.47Å; H890-T950 PolarHBondContact O-N 3.46Å; H890-T950 VanDerWaalsContact O-N 3.16Å; H890-T950 PolarHBondContact O-OG1 3.14Å
891	Y	96.4	Very high	89.3	Confident	0 Å²	0	39 Å²	39	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	131.4	-172	-81.2	-79.6	0	0	0	111.1	F844 P845 L848 E875 L876 M878 V889 E948 R949	F844-Y891 HydrophobicContact CD1-CE2 4.34Å; P845-Y891 PolarHBondContact O-OH 2.75Å; L848-Y891 HydrophobicContact CB-CD1 3.99Å; L848-Y891 HydrophobicContact CB-CE1 3.48Å; L848-Y891 VanDerWaalsContact CB-CE1 3.48Å; L848-Y891 HydrophobicContact CB-CE2 4.39Å; L848-Y891 HydrophobicContact CD2-CD2 4.18Å; L848-Y891 HydrophobicContact CD2-CE1 4.41Å; L848-Y891 HydrophobicContact CD2-CE2 3.86Å; E875-Y891 CarbonylContact C-O 3.51Å; E875-Y891 WeakPolarHBondContact CA-O 3.26Å; L876-Y891 PolarHBondContact N-O 2.65Å; L876-Y891 PolarHBondContact O-N 2.79Å; M878-Y891 HydrophobicContact CB-CD2 3.96Å; M878-Y891 HydrophobicContact CB-CE2 3.9Å; M878-Y891 HydrophobicContact CG-CD2 3.45Å; M878-Y891 VanDerWaalsContact CG-CD2 3.45Å; M878-Y891 HydrophobicContact CG-CE2 3.65Å; V889-Y891 HydrophobicContact CG1-CD2 4.18Å; V889-Y891 HydrophobicContact CG1-CE2 3.55Å; Y891-E948 WeakPolarHBondContact CA-O 3.43Å; Y891-R949 HydrophobicContact CD1-CB 3.93Å; Y891-R949 HydrophobicContact CE1-CB 3.63Å; Y891-R949 HydrophobicContact CE1-CG 4.35Å
892	S	95.6	Very high	89.1	Confident	31 Å²	31	41 Å²	41	22%	0.217	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	136	172.2	-167.7	0	0	0	0	110.8	Y947 E948	S892-Y947 CarbonylContact O-C 3.48Å; S892-Y947 WeakPolarHBondContact O-CA 3.42Å; S892-E948 PolarHBondContact N-O 2.75Å; S892-E948 PolarHBondContact O-N 3.25Å
893	L	97.4	Very high	88.6	Confident	7 Å²	7	43.5 Å²	43.5	4%	0.037	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	128.4	177.1	-171.7	76.7	0	0	0	109.9	F869 T871 I896 W920 L945 Y947	F869-L893 HydrophobicContact CD2-CD2 3.71Å; F869-L893 HydrophobicContact CE2-CD2 3.55Å; T871-L893 HydrophobicContact CG2-CD2 4.44Å; L893-I896 HydrophobicContact CD1-CG1 4.48Å; L893-I896 HydrophobicContact CD2-CD1 3.89Å; L893-I896 HydrophobicContact CD2-CG1 3.95Å; L893-I896 HydrophobicContact CG-CG1 4.45Å; L893-W920 HydrophobicContact CD2-CH2 4Å; L893-W920 HydrophobicContact CD2-CZ2 4.4Å; L893-W920 HydrophobicContact CG-CH2 3.97Å; L893-W920 WeakPolarHBondContact O-CZ2 3.49Å; L893-L945 HydrophobicContact CD1-CB 3.98Å; L893-L945 HydrophobicContact CD1-CD2 4.35Å; L893-Y947 HydrophobicContact CB-CD1 4.02Å; L893-Y947 HydrophobicContact CB-CE1 3.67Å; L893-Y947 HydrophobicContact CD1-CD1 4.16Å; L893-Y947 HydrophobicContact CD1-CD2 3.98Å; L893-Y947 HydrophobicContact CD1-CE1 3.81Å; L893-Y947 HydrophobicContact CD1-CE2 3.61Å; L893-Y947 HydrophobicContact CD1-CG 4.24Å; L893-Y947 HydrophobicContact CG-CE1 4.33Å
894	Y	97.1	Very high	88.3	Confident	13 Å²	13	46.7 Å²	46.7	5%	0.051	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	-21.1	178.7	76.7	-85.8	0	0	0	114.6	H645 T646 Y847 C912 K913 F946 Y947 E948	H645-Y894 HydrophobicContact CB-CD2 4.14Å; H645-Y894 HydrophobicContact CB-CE2 4.34Å; T646-Y894 PolarHBondContact OG1-OH 3.07Å; Y847-Y894 HydrophobicContact CD1-CD1 4.49Å; Y847-Y894 AromaticContact CD1-CE1 3.6Å; Y847-Y894 HydrophobicContact CD1-CE1 3.6Å; Y847-Y894 AromaticContact CD1-CZ 3.86Å; Y847-Y894 HydrophobicContact CE1-CE1 4.05Å; Y894-C912 WeakPolarHBondContact O-CA 3.48Å; Y894-K913 PolarHBondContact O-N 3.4Å; Y894-F946 HydrophobicContact CD1-CB 4.31Å; Y894-F946 WeakPolarHBondContact CD1-O 3.42Å; Y894-F946 HydrophobicContact CE1-CB 3.7Å; Y894-F946 HydrophobicContact CE2-CB 4.24Å; Y894-F946 PolarHBondContact N-O 3.19Å; Y894-Y947 VanDerWaalsContact CE1-C 3.49Å; Y894-E948 HydrophobicContact CD1-CB 3.78Å; Y894-E948 HydrophobicContact CE1-CB 4.2Å
895	A	98.1	Very high	88.5	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	155.3	172.6	0	0	0	0	0	113.6	C642 L911 C912 F946	C642-A895 HydrophobicContact CB-CB 3.89Å; A895-L911 CarbonylContact C-O 3.52Å; A895-L911 VanDerWaalsContact CA-O 3.26Å; A895-L911 WeakPolarHBondContact CA-O 3.42Å; A895-C912 HydrophobicContact CB-CB 4.32Å; A895-F946 HydrophobicContact CB-CB 3.99Å; A895-F946 HydrophobicContact CB-CD2 4.29Å; A895-F946 HydrophobicContact CB-CG 4.33Å; A895-F946 PolarHBondContact N-O 2.91Å; A895-F946 WeakPolarHBondContact O-CB 3.28Å; A895-F946 PolarHBondContact O-N 3.12Å
896	I	98.5	Very high	90	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	125.8	178.9	-54.5	167.7	0	0	0	108	F869 L893 N898 A910 L911 W920 L937 A942 I944 L945	F869-I896 HydrophobicContact CE2-CD1 3.91Å; F869-I896 HydrophobicContact CZ-CD1 3.86Å; L893-I896 HydrophobicContact CD1-CG1 4.48Å; L893-I896 HydrophobicContact CD2-CD1 3.89Å; L893-I896 HydrophobicContact CD2-CG1 3.95Å; L893-I896 HydrophobicContact CG-CG1 4.45Å; I896-N898 WeakPolarHBondContact CG2-OD1 3.42Å; I896-A910 CarbonylContact O-C 3.54Å; I896-A910 VanDerWaalsContact O-CA 3.29Å; I896-A910 WeakPolarHBondContact O-CA 3.31Å; I896-L911 HydrophobicContact CB-CB 4.27Å; I896-L911 HydrophobicContact CD1-CB 4.46Å; I896-L911 HydrophobicContact CD1-CD1 4.37Å; I896-L911 PolarHBondContact N-O 3.33Å; I896-L911 PolarHBondContact O-N 2.91Å; I896-W920 HydrophobicContact CD1-CZ3 4.49Å; I896-W920 HydrophobicContact CG1-CZ3 4.47Å; I896-L937 HydrophobicContact CD1-CB 3.9Å; I896-L937 HydrophobicContact CD1-CD2 4.11Å; I896-L937 HydrophobicContact CD1-CG 4.48Å; I896-A942 HydrophobicContact CG2-CB 4.01Å; I896-I944 CarbonylContact C-O 3.54Å; I896-I944 WeakPolarHBondContact CA-O 3.35Å; I896-L945 HydrophobicContact CG1-CD2 4.09Å; I896-L945 HydrophobicContact CG2-CD2 4.08Å
897	S	98.6	Very high	91.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	116.5	159.2	-179.1	0	0	0	0	108.6	S638 Y943 I944	S638-S897 PolarHBondContact OG-OG 3.15Å; S897-Y943 WeakPolarHBondContact O-CB 3.33Å; S897-Y943 PolarHBondContact O-N 3.37Å; S897-I944 PolarHBondContact N-O 3.3Å; S897-I944 PolarHBondContact O-N 3.34Å; S897-I944 VanDerWaalsContact O-N 3.13Å
898	N	98.2	Very high	93.3	Very high	10 Å²	10	33.2 Å²	33.2	5%	0.053	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	135.8	173.7	-82.9	-23.8	0	0	0	109.4	I896 Y908 V909 L911 S941 A942	I896-N898 WeakPolarHBondContact CG2-OD1 3.42Å; N898-Y908 VanDerWaalsContact O-CA 3.26Å; N898-Y908 WeakPolarHBondContact O-CA 3.48Å; N898-V909 HydrophobicContact CB-CG2 3.71Å; N898-V909 PolarHBondContact N-O 3.08Å; N898-V909 PolarHBondContact O-N 3.5Å; N898-L911 WeakPolarHBondContact ND2-CD1 3.38Å; N898-L911 WeakPolarHBondContact ND2-CG 3.31Å; N898-S941 WeakPolarHBondContact CA-O 3.22Å; N898-A942 WeakPolarHBondContact OD1-CA 3.35Å; N898-A942 PolarHBondContact OD1-N 2.95Å; N898-A942 VanDerWaalsContact OD1-N 3.15Å
899	H	97.5	Very high	93.9	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.019	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	130.1	168.4	179.2	-137.5	0	0	0	110.6	F855 K862 S902 H907 Y908 S941 Y943	F855-H899 AromaticContact CE1-CE1 3.97Å; F855-H899 AromaticContact CE1-ND1 3.92Å; F855-H899 AromaticContact CZ-CE1 3.56Å; F855-H899 AromaticContact CZ-ND1 3.34Å; F855-H899 VanDerWaalsContact CZ-ND1 3.34Å; F855-H899 WeakPolarHBondContact CZ-ND1 3.37Å; K862-H899 PolarHBondContact NZ-ND1 3Å; K862-H899 VanDerWaalsContact NZ-ND1 3.11Å; K862-H899 PolarHBondContact NZ-O 2.95Å; H899-S902 PolarHBondContact CE1-O 2.95Å; H899-H907 PolarHBondContact CD2-O 3.17Å; H899-Y908 HydrophobicContact CB-CD1 3.77Å; H899-Y908 HydrophobicContact CB-CE1 3.56Å; H899-Y908 AromaticContact CD2-CD2 3.9Å; H899-Y908 AromaticContact CD2-CE1 3.92Å; H899-Y908 AromaticContact CD2-CE2 3.7Å; H899-Y908 AromaticContact CD2-CZ 3.72Å; H899-Y908 AromaticContact CG-CE1 3.78Å; H899-Y908 AromaticContact CG-CZ 3.86Å; H899-S941 PolarHBondContact N-O 2.74Å; H899-S941 WeakPolarHBondContact O-CA 3.14Å; H899-S941 WeakPolarHBondContact O-CB 3.5Å; H899-Y943 HydrophobicContact CB-CD1 4.49Å; H899-Y943 HydrophobicContact CB-CG 4.4Å
900	M	95	Very high	94.2	Very high	73 Å²	73	26.9 Å²	26.9	36%	0.36	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	135.2	175.3	-65.3	169.6	-75.1	0	0	109.5	G906 H907 V909	M900-G906 CarbonylContact O-C 3.58Å; M900-G906 WeakPolarHBondContact O-CA 3.39Å; M900-H907 PolarHBondContact N-O 3.45Å; M900-H907 PolarHBondContact O-N 3.1Å; M900-V909 HydrophobicContact CE-CB 4.45Å; M900-V909 HydrophobicContact CE-CG1 3.66Å; M900-V909 HydrophobicContact CE-CG2 3.95Å
901	G	91.1	Very high	94.4	Very high	52 Å²	52	25 Å²	25	54%	0.536	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	108.9	-155.2	-175.9	0	0	0	0	0	114.2	K862	K862-G901 WeakPolarHBondContact CD-O 3.23Å; K862-G901 PolarHBondContact NZ-O 2.99Å
902	S	88.2	Confident	94.4	Very high	53 Å²	53	25 Å²	25	37%	0.371	18%	0.175	S	C	.	.			trans	-110.3	-179.7	-162.3	76.7	0	0	0	0	113.9	H899 A904 G905	H899-S902 PolarHBondContact CE1-O 2.95Å; S902-A904 VanDerWaalsContact C-N 3.34Å; S902-A904 PolarHBondContact OG-N 3.39Å; S902-G905 WeakPolarHBondContact CA-O 3.12Å; S902-G905 PolarHBondContact N-O 3.06Å; S902-G905 PolarHBondContact OG-N 2.94Å; S902-G905 PolarHBondContact OG-O 3.46Å
903	T	83	Confident	94.4	Very high	65 Å²	65	25 Å²	25	40%	0.399	17%	0.171	S	C	.	.	S	Bend	trans	-66.6	-30.7	168.4	36.3	0	0	0	0	113.5	F855 W860 K862	F855-T903 HydrophobicContact CD1-CG2 3.66Å; F855-T903 HydrophobicContact CE1-CG2 4.24Å; W860-T903 PolarHBondContact O-OG1 3.43Å; K862-T903 HydrophobicContact CB-CG2 4.48Å
904	A	80.1	Confident	94.3	Very high	101 Å²	101	25 Å²	25	84%	0.835	17%	0.171	S	C	*	.	S	Bend	trans	-88.2	-6.3	-179.1	0	0	0	0	0	113.5	S902	S902-A904 VanDerWaalsContact C-N 3.34Å; S902-A904 PolarHBondContact OG-N 3.39Å
905	G	83.5	Confident	94	Very high	25 Å²	25	26 Å²	26	26%	0.258	18%	0.179	S	C	.	.			trans	155	157.3	178.8	0	0	0	0	0	113.4	S902	S902-G905 WeakPolarHBondContact CA-O 3.12Å; S902-G905 PolarHBondContact N-O 3.06Å; S902-G905 PolarHBondContact OG-N 2.94Å; S902-G905 PolarHBondContact OG-O 3.46Å
906	G	92.3	Very high	93.6	Very high	21 Å²	21	31.9 Å²	31.9	22%	0.216	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.7	-149.7	-173.4	0	0	0	0	0	112.3	Q709 M900	Q709-G906 PolarHBondContact NE2-O 3.4Å; Q709-G906 PolarHBondContact OE1-O 2.92Å; M900-G906 CarbonylContact O-C 3.58Å; M900-G906 WeakPolarHBondContact O-CA 3.39Å
907	H	97.4	Very high	93.2	Very high	53 Å²	53	34.5 Å²	34.5	25%	0.245	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	145.2	177.5	-174.9	48.2	0	0	0	110.8	C634 H899 M900 N924 D925	C634-H907 VanDerWaalsContact CB-CE1 3.42Å; C634-H907 WeakPolarHBondContact CB-CE1 3.31Å; C634-H907 WeakPolarHBondContact CB-ND1 3.38Å; C634-H907 PolarHBondContact SG-ND1 3.45Å; H899-H907 PolarHBondContact CD2-O 3.17Å; M900-H907 PolarHBondContact N-O 3.45Å; M900-H907 PolarHBondContact O-N 3.1Å; H907-N924 PolarHBondContact NE2-OD1 3.28Å; H907-D925 IonicContact CE1-OD2 3.75Å; H907-D925 PolarHBondContact CE1-OD2 3.14Å
908	Y	98.4	Very high	92.9	Very high	10 Å²	10	41.8 Å²	41.8	4%	0.039	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	140.5	-179.7	-70.5	-95.8	0	0	0	111.4	F635 A712 N898 H899 Y943	F635-Y908 HydrophobicContact CB-CD2 3.66Å; F635-Y908 HydrophobicContact CB-CE2 3.71Å; F635-Y908 HydrophobicContact CB-CG 4.19Å; A712-Y908 HydrophobicContact CB-CD1 3.83Å; A712-Y908 HydrophobicContact CB-CE1 3.38Å; A712-Y908 PolarHBondContact N-OH 3.43Å; N898-Y908 VanDerWaalsContact O-CA 3.26Å; N898-Y908 WeakPolarHBondContact O-CA 3.48Å; H899-Y908 HydrophobicContact CB-CD1 3.77Å; H899-Y908 HydrophobicContact CB-CE1 3.56Å; H899-Y908 AromaticContact CD2-CD2 3.9Å; H899-Y908 AromaticContact CD2-CE1 3.92Å; H899-Y908 AromaticContact CD2-CE2 3.7Å; H899-Y908 AromaticContact CD2-CZ 3.72Å; H899-Y908 AromaticContact CG-CE1 3.78Å; H899-Y908 AromaticContact CG-CZ 3.86Å; Y908-Y943 AromaticContact CE1-CD1 3.92Å; Y908-Y943 HydrophobicContact CE1-CD1 3.92Å; Y908-Y943 HydrophobicContact CE1-CE1 4.3Å
909	V	98.4	Very high	92.7	Very high	2 Å²	2	47 Å²	47	1%	0.012	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	153.6	171.8	-55.7	0	0	0	0	109.1	N898 M900 E922 N924	N898-V909 HydrophobicContact CB-CG2 3.71Å; N898-V909 PolarHBondContact N-O 3.08Å; N898-V909 PolarHBondContact O-N 3.5Å; M900-V909 HydrophobicContact CE-CB 4.45Å; M900-V909 HydrophobicContact CE-CG1 3.66Å; M900-V909 HydrophobicContact CE-CG2 3.95Å; V909-E922 HydrophobicContact CB-CG 4.11Å; V909-E922 HydrophobicContact CG2-CG 4.18Å; V909-N924 HydrophobicContact CG1-CB 3.88Å; V909-N924 VanDerWaalsContact CG1-CG 3.41Å
910	A	98.7	Very high	92.6	Very high	0 Å²	0	47 Å²	47	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	137.3	173.4	0	0	0	0	0	110.9	S638 Q641 I896 E922 F923	S638-A910 WeakPolarHBondContact O-CB 3.26Å; Q641-A910 HydrophobicContact CB-CB 3.67Å; I896-A910 CarbonylContact O-C 3.54Å; I896-A910 VanDerWaalsContact O-CA 3.29Å; I896-A910 WeakPolarHBondContact O-CA 3.31Å; A910-E922 CarbonylContact O-C 3.38Å; A910-E922 WeakPolarHBondContact O-CA 3.27Å; A910-F923 HydrophobicContact CB-CB 4.42Å; A910-F923 PolarHBondContact N-O 2.78Å; A910-F923 VanDerWaalsContact N-O 3.08Å; A910-F923 PolarHBondContact O-N 2.9Å
911	L	98.3	Very high	92.7	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.026	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	123.4	164.4	-49.2	-174.4	0	0	0	107.2	A895 I896 N898 W920 H921 E922 L932 L937	A895-L911 CarbonylContact C-O 3.52Å; A895-L911 VanDerWaalsContact CA-O 3.26Å; A895-L911 WeakPolarHBondContact CA-O 3.42Å; I896-L911 HydrophobicContact CB-CB 4.27Å; I896-L911 HydrophobicContact CD1-CB 4.46Å; I896-L911 HydrophobicContact CD1-CD1 4.37Å; I896-L911 PolarHBondContact N-O 3.33Å; I896-L911 PolarHBondContact O-N 2.91Å; N898-L911 WeakPolarHBondContact ND2-CD1 3.38Å; N898-L911 WeakPolarHBondContact ND2-CG 3.31Å; L911-W920 HydrophobicContact CB-CE3 4.25Å; L911-W920 HydrophobicContact CB-CZ3 4.49Å; L911-H921 WeakPolarHBondContact CA-O 3.24Å; L911-E922 HydrophobicContact CD2-CB 3.53Å; L911-E922 HydrophobicContact CD2-CG 3.78Å; L911-L932 HydrophobicContact CD2-CD1 4Å; L911-L937 HydrophobicContact CB-CD2 4.19Å; L911-L937 HydrophobicContact CD1-CD2 3.81Å
912	C	97.7	Very high	93	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	140.4	-179	-53.4	0	0	0	0	112.1	H645 Y894 A895 W920 H921 F923	H645-C912 HydrophobicContact CB-CB 4.1Å; H645-C912 VanDerWaalsContact CG-CB 3.47Å; H645-C912 WeakPolarHBondContact ND1-CB 3.49Å; Y894-C912 WeakPolarHBondContact O-CA 3.48Å; A895-C912 HydrophobicContact CB-CB 4.32Å; C912-W920 WeakPolarHBondContact O-CA 3.2Å; C912-H921 PolarHBondContact N-O 2.99Å; C912-H921 PolarHBondContact O-N 3.37Å; C912-F923 HydrophobicContact CB-CD2 4.3Å; C912-F923 HydrophobicContact CB-CE2 3.87Å
913	K	95.6	Very high	93.5	Very high	31 Å²	31	42 Å²	42	14%	0.135	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	108.8	174.5	-157.4	168	-170.1	157	0	108.2	Y894 R918 K919 W920 E934	Y894-K913 PolarHBondContact O-N 3.4Å; K913-R918 WeakPolarHBondContact CE-O 3.45Å; K913-R918 WeakPolarHBondContact CG-O 3.06Å; K913-K919 WeakPolarHBondContact CA-O 3.48Å; K913-W920 HydrophobicContact CB-CD2 3.82Å; K913-W920 HydrophobicContact CB-CE3 4.09Å; K913-W920 HydrophobicContact CB-CG 4.43Å; K913-W920 HydrophobicContact CB-CH2 4.04Å; K913-W920 HydrophobicContact CB-CZ2 3.8Å; K913-W920 HydrophobicContact CB-CZ3 4.19Å; K913-W920 HydrophobicContact CD-CZ2 3.78Å; K913-W920 HydrophobicContact CG-CD2 4.17Å; K913-W920 HydrophobicContact CG-CG 4.38Å; K913-W920 HydrophobicContact CG-CZ2 4.17Å; K913-E934 IonicContact NZ-OE1 3.46Å; K913-E934 PolarHBondContact NZ-OE1 2.8Å
914	H	94.4	Very high	94.2	Very high	7 Å²	7	41.1 Å²	41.1	3%	0.032	23%	0.231	C	C	.	.			trans	-66	129.2	-177.4	174.6	-82.4	0	0	0	110.5	E622 V916 S917 R918 K919	E622-H914 PolarHBondContact O-NE2 3.15Å; E622-H914 VanDerWaalsContact O-NE2 3.15Å; H914-V916 PolarHBondContact O-N 3.05Å; H914-S917 PolarHBondContact ND1-N 3.09Å; H914-S917 PolarHBondContact ND1-OG 3.24Å; H914-R918 WeakPolarHBondContact O-CA 3.34Å; H914-R918 PolarHBondContact O-N 3.03Å; H914-K919 PolarHBondContact N-O 3.36Å
915	P	91	Very high	95.1	Very high	33 Å²	33	37.2 Å²	37.2	21%	0.214	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-35.1	-161.6	23.3	-34.2	0	0	0	114.7	Q647 W681 R918	Q647-P915 HydrophobicContact CG-CB 4.36Å; W681-P915 HydrophobicContact CH2-CG 3.71Å; W681-P915 HydrophobicContact CZ3-CG 4.15Å; P915-R918 WeakPolarHBondContact O-CD 3.48Å; P915-R918 PolarHBondContact O-NE 2.92Å; P915-R918 VanDerWaalsContact O-NE 3.14Å
916	V	90	Very high	95.7	Very high	125 Å²	125	39 Å²	39	76%	0.758	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-58.6	-179	-172.1	0	0	0	0	111.1	H914 R918	H914-V916 PolarHBondContact O-N 3.05Å; V916-R918 PolarHBondContact O-N 3.08Å
917	S	90.7	Very high	95.9	Very high	54 Å²	54	43.2 Å²	43.2	38%	0.378	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-17	-179.1	68.3	0	0	0	0	115	H914 K919	H914-S917 PolarHBondContact ND1-N 3.09Å; H914-S917 PolarHBondContact ND1-OG 3.24Å; S917-K919 PolarHBondContact O-N 3.22Å; S917-K919 VanDerWaalsContact O-N 3.08Å; S917-K919 PolarHBondContact OG-N 3.15Å
918	R	91.3	Very high	95.9	Very high	153 Å²	153	42.6 Å²	42.6	58%	0.577	22%	0.216	S	C	*	.			trans	56.5	13.3	-174	-60	-62.5	-173.8	129.9	6.1	115.6	K913 H914 P915 V916	K913-R918 WeakPolarHBondContact CE-O 3.45Å; K913-R918 WeakPolarHBondContact CG-O 3.06Å; H914-R918 WeakPolarHBondContact O-CA 3.34Å; H914-R918 PolarHBondContact O-N 3.03Å; P915-R918 WeakPolarHBondContact O-CD 3.48Å; P915-R918 PolarHBondContact O-NE 2.92Å; P915-R918 VanDerWaalsContact O-NE 3.14Å; V916-R918 PolarHBondContact O-N 3.08Å
919	K	93.6	Very high	95.7	Very high	120 Å²	120	43.8 Å²	43.8	52%	0.522	23%	0.226	S	C	.	.			trans	-88.2	151.6	176.8	-59.6	-168.3	-178.2	-172.2	0	111.6	K913 H914 S917 A931	K913-K919 WeakPolarHBondContact CA-O 3.48Å; H914-K919 PolarHBondContact N-O 3.36Å; S917-K919 PolarHBondContact O-N 3.22Å; S917-K919 VanDerWaalsContact O-N 3.08Å; S917-K919 PolarHBondContact OG-N 3.15Å; K919-A931 HydrophobicContact CB-CB 3.98Å; K919-A931 HydrophobicContact CD-CB 3.57Å; K919-A931 HydrophobicContact CG-CB 4.34Å
920	W	96.3	Very high	95.4	Very high	3 Å²	3	50.7 Å²	50.7	1%	0.011	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	143.1	174.7	-70.7	87.6	0	0	0	111.7	L893 I896 L911 C912 K913 A931 L932 E934 L937	L893-W920 HydrophobicContact CD2-CH2 4Å; L893-W920 HydrophobicContact CD2-CZ2 4.4Å; L893-W920 HydrophobicContact CG-CH2 3.97Å; L893-W920 WeakPolarHBondContact O-CZ2 3.49Å; I896-W920 HydrophobicContact CD1-CZ3 4.49Å; I896-W920 HydrophobicContact CG1-CZ3 4.47Å; L911-W920 HydrophobicContact CB-CE3 4.25Å; L911-W920 HydrophobicContact CB-CZ3 4.49Å; C912-W920 WeakPolarHBondContact O-CA 3.2Å; K913-W920 HydrophobicContact CB-CD2 3.82Å; K913-W920 HydrophobicContact CB-CE3 4.09Å; K913-W920 HydrophobicContact CB-CG 4.43Å; K913-W920 HydrophobicContact CB-CH2 4.04Å; K913-W920 HydrophobicContact CB-CZ2 3.8Å; K913-W920 HydrophobicContact CB-CZ3 4.19Å; K913-W920 HydrophobicContact CD-CZ2 3.78Å; K913-W920 HydrophobicContact CG-CD2 4.17Å; K913-W920 HydrophobicContact CG-CG 4.38Å; K913-W920 HydrophobicContact CG-CZ2 4.17Å; W920-A931 CarbonylContact O-C 3.53Å; W920-A931 WeakPolarHBondContact O-CA 3.46Å; W920-L932 HydrophobicContact CB-CB 4.23Å; W920-L932 PolarHBondContact O-N 2.98Å; W920-E934 VanDerWaalsContact CD1-CG 3.46Å; W920-E934 PolarHBondContact NE1-OE1 3.21Å; W920-L937 HydrophobicContact CB-CD2 4.31Å; W920-L937 HydrophobicContact CD2-CD1 3.86Å; W920-L937 HydrophobicContact CD2-CD2 3.6Å; W920-L937 HydrophobicContact CD2-CG 4.37Å; W920-L937 VanDerWaalsContact CE2-CD1 3.49Å; W920-L937 HydrophobicContact CE3-CD1 4.38Å; W920-L937 HydrophobicContact CE3-CD2 3.57Å; W920-L937 HydrophobicContact CG-CD1 4.25Å; W920-L937 HydrophobicContact CG-CD2 3.95Å; W920-L937 HydrophobicContact CH2-CD1 4.31Å; W920-L937 HydrophobicContact CZ2-CD1 3.74Å; W920-L937 HydrophobicContact CZ3-CD2 4.09Å
921	H	97.1	Very high	95.1	Very high	16 Å²	16	53 Å²	53	7%	0.074	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	141.8	175.2	-66	-96.9	0	0	0	109.9	L624 L911 C912 F923 V928 S929	L624-H921 HydrophobicContact CD2-CB 4.45Å; L911-H921 WeakPolarHBondContact CA-O 3.24Å; C912-H921 PolarHBondContact N-O 2.99Å; C912-H921 PolarHBondContact O-N 3.37Å; H921-F923 HydrophobicContact CB-CD2 4.46Å; H921-F923 HydrophobicContact CB-CE2 3.78Å; H921-F923 HydrophobicContact CB-CZ 4.17Å; H921-F923 WeakPolarHBondContact O-CD2 3.46Å; H921-V928 HydrophobicContact CB-CG1 4.14Å; H921-S929 PolarHBondContact ND1-O 2.97Å
922	E	98.1	Very high	94.8	Very high	55 Å²	55	55.1 Å²	55.1	26%	0.257	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	131.7	165.8	178.4	173.5	116.3	0	0	109.6	V909 A910 L911 N924 V928 S929 L932	V909-E922 HydrophobicContact CB-CG 4.11Å; V909-E922 HydrophobicContact CG2-CG 4.18Å; A910-E922 CarbonylContact O-C 3.38Å; A910-E922 WeakPolarHBondContact O-CA 3.27Å; L911-E922 HydrophobicContact CD2-CB 3.53Å; L911-E922 HydrophobicContact CD2-CG 3.78Å; E922-N924 HydrophobicContact CG-CB 4.13Å; E922-N924 WeakPolarHBondContact OE1-CB 3.31Å; E922-N924 PolarHBondContact OE1-ND2 3.03Å; E922-V928 CarbonylContact O-C 3.47Å; E922-V928 VanDerWaalsContact O-CA 3.31Å; E922-V928 WeakPolarHBondContact O-CA 3.46Å; E922-S929 PolarHBondContact N-OG 2.66Å; E922-S929 PolarHBondContact O-N 3.39Å; E922-L932 HydrophobicContact CB-CD1 3.93Å
923	F	98.4	Very high	94.4	Very high	4 Å²	4	57.9 Å²	57.9	2%	0.018	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	100.9	171.5	-60.9	-100.6	0	0	0	107.8	L624 Q641 H645 A910 C912 H921 V928	L624-F923 HydrophobicContact CD2-CZ 4.26Å; Q641-F923 HydrophobicContact CB-CB 4.22Å; Q641-F923 HydrophobicContact CB-CG 4.37Å; Q641-F923 VanDerWaalsContact CD-CD1 3.41Å; Q641-F923 HydrophobicContact CG-CB 3.69Å; Q641-F923 HydrophobicContact CG-CD1 4.24Å; Q641-F923 HydrophobicContact CG-CG 4.04Å; Q641-F923 VanDerWaalsContact NE2-CD1 3.32Å; H645-F923 AromaticContact CE1-CE2 3.75Å; H645-F923 AromaticContact CE1-CZ 3.47Å; H645-F923 VanDerWaalsContact CE1-CZ 3.47Å; H645-F923 WeakPolarHBondContact CE1-CZ 3.4Å; H645-F923 AromaticContact NE2-CZ 3.82Å; A910-F923 HydrophobicContact CB-CB 4.42Å; A910-F923 PolarHBondContact N-O 2.78Å; A910-F923 VanDerWaalsContact N-O 3.08Å; A910-F923 PolarHBondContact O-N 2.9Å; C912-F923 HydrophobicContact CB-CD2 4.3Å; C912-F923 HydrophobicContact CB-CE2 3.87Å; H921-F923 HydrophobicContact CB-CD2 4.46Å; H921-F923 HydrophobicContact CB-CE2 3.78Å; H921-F923 HydrophobicContact CB-CZ 4.17Å; H921-F923 WeakPolarHBondContact O-CD2 3.46Å; F923-V928 HydrophobicContact CD1-CB 4.41Å; F923-V928 HydrophobicContact CD1-CG1 3.97Å; F923-V928 HydrophobicContact CD1-CG2 3.66Å; F923-V928 HydrophobicContact CE1-CG1 3.75Å; F923-V928 HydrophobicContact CE1-CG2 3.91Å; F923-V928 HydrophobicContact CZ-CG1 4.09Å
924	N	98.1	Very high	94.1	Very high	46 Å²	46	58.5 Å²	58.5	25%	0.246	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	83.4	-175.1	-165.5	-23.7	0	0	0	108.5	H907 V909 E922 N926 I927	H907-N924 PolarHBondContact NE2-OD1 3.28Å; V909-N924 HydrophobicContact CG1-CB 3.88Å; V909-N924 VanDerWaalsContact CG1-CG 3.41Å; E922-N924 HydrophobicContact CG-CB 4.13Å; E922-N924 WeakPolarHBondContact OE1-CB 3.31Å; E922-N924 PolarHBondContact OE1-ND2 3.03Å; N924-N926 PolarHBondContact O-N 3.47Å; N924-N926 VanDerWaalsContact O-N 3.17Å; N924-I927 PolarHBondContact N-O 3.45Å; N924-I927 PolarHBondContact O-N 3.42Å
925	D	98.1	Very high	93.8	Very high	18 Å²	18	64.9 Å²	64.9	10%	0.096	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	-117.2	-164.6	-67.7	-43.1	0	0	0	111.7	G626 L627 N629 N637 H907 I927	G626-D925 CarbonylContact C-O 3.47Å; G626-D925 WeakPolarHBondContact CA-O 3.26Å; L627-D925 PolarHBondContact N-O 3.22Å; L627-D925 CarbonylContact O-C 2.92Å; L627-D925 WeakPolarHBondContact O-CA 3.44Å; L627-D925 WeakPolarHBondContact O-CB 3.43Å; N629-D925 HydrophobicContact CB-CB 4.14Å; N629-D925 WeakPolarHBondContact CB-OD2 3.4Å; N629-D925 PolarHBondContact ND2-OD2 3Å; N637-D925 PolarHBondContact ND2-OD1 3.02Å; H907-D925 IonicContact CE1-OD2 3.75Å; H907-D925 PolarHBondContact CE1-OD2 3.14Å; D925-I927 PolarHBondContact O-N 2.78Å
926	N	96.9	Very high	93.7	Very high	64 Å²	64	69.4 Å²	69.4	34%	0.342	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	9.1	-179.1	65.3	-103.5	0	0	0	114.6	L627 R628 T687 N924	L627-N926 PolarHBondContact O-N 2.83Å; R628-N926 HydrophobicContact CB-CB 4.48Å; T687-N926 HydrophobicContact CG2-CB 3.66Å; T687-N926 PolarHBondContact OG1-O 2.81Å; N924-N926 PolarHBondContact O-N 3.47Å; N924-N926 VanDerWaalsContact O-N 3.17Å
927	I	96.6	Very high	93.9	Very high	109 Å²	109	63.5 Å²	63.5	56%	0.559	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.6	126.3	178.1	-56.2	178.7	0	0	0	107.6	N924 D925	N924-I927 PolarHBondContact N-O 3.45Å; N924-I927 PolarHBondContact O-N 3.42Å; D925-I927 PolarHBondContact O-N 2.78Å
928	V	97.1	Very high	94.1	Very high	40 Å²	40	62.8 Å²	62.8	24%	0.242	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	130.4	170.1	-171.8	0	0	0	0	107.4	L624 H921 E922 F923	L624-V928 HydrophobicContact CD2-CG1 4.48Å; H921-V928 HydrophobicContact CB-CG1 4.14Å; E922-V928 CarbonylContact O-C 3.47Å; E922-V928 VanDerWaalsContact O-CA 3.31Å; E922-V928 WeakPolarHBondContact O-CA 3.46Å; F923-V928 HydrophobicContact CD1-CB 4.41Å; F923-V928 HydrophobicContact CD1-CG1 3.97Å; F923-V928 HydrophobicContact CD1-CG2 3.66Å; F923-V928 HydrophobicContact CE1-CG1 3.75Å; F923-V928 HydrophobicContact CE1-CG2 3.91Å; F923-V928 HydrophobicContact CZ-CG1 4.09Å
929	S	94.3	Very high	94.3	Very high	34 Å²	34	56.8 Å²	56.8	24%	0.238	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-75.8	160.2	179.1	77.5	0	0	0	0	112.1	H921 E922	H921-S929 PolarHBondContact ND1-O 2.97Å; E922-S929 PolarHBondContact N-OG 2.66Å; E922-S929 PolarHBondContact O-N 3.39Å
930	D	91.7	Very high	94.3	Very high	147 Å²	147	53.4 Å²	53.4	79%	0.786	30%	0.298	S	S	*	.	S	Bend	trans	-57.1	166.6	155	-79.6	-55.6	0	0	0	111.6	L932	D930-L932 PolarHBondContact O-N 3.1Å
931	A	91.5	Very high	94.3	Very high	48 Å²	48	54.4 Å²	54.4	40%	0.397	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-60.1	122.2	-176.2	0	0	0	0	0	112.9	K919 W920	K919-A931 HydrophobicContact CB-CB 3.98Å; K919-A931 HydrophobicContact CD-CB 3.57Å; K919-A931 HydrophobicContact CG-CB 4.34Å; W920-A931 CarbonylContact O-C 3.53Å; W920-A931 WeakPolarHBondContact O-CA 3.46Å
932	L	91.9	Very high	94.4	Very high	50 Å²	50	53.7 Å²	53.7	26%	0.262	30%	0.302	S	S	.	.	B	Isolated β-bridge	trans	-84.7	149.7	-179.3	-60.7	177.6	0	0	0	112.4	L911 W920 E922 D930	L911-L932 HydrophobicContact CD2-CD1 4Å; W920-L932 HydrophobicContact CB-CB 4.23Å; W920-L932 PolarHBondContact O-N 2.98Å; E922-L932 HydrophobicContact CB-CD1 3.93Å; D930-L932 PolarHBondContact O-N 3.1Å
933	S	90.9	Very high	94.4	Very high	58 Å²	58	51.2 Å²	51.2	41%	0.406	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-74.2	140.3	165.5	-178	0	0	0	0	110.4	N935 H936	S933-N935 PolarHBondContact O-N 2.91Å; S933-N935 VanDerWaalsContact O-N 3.14Å; S933-H936 PolarHBondContact O-N 2.76Å
934	E	88.9	Confident	94.4	Very high	44 Å²	44	51 Å²	51	21%	0.206	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-62.6	-21.5	178.6	-65	-172.4	125.9	0	0	112.7	S872 K913 W920 H936 L937	S872-E934 WeakPolarHBondContact CA-OE2 3.27Å; S872-E934 WeakPolarHBondContact CB-OE2 3.42Å; S872-E934 PolarHBondContact OG-OE2 3.22Å; K913-E934 IonicContact NZ-OE1 3.46Å; K913-E934 PolarHBondContact NZ-OE1 2.8Å; W920-E934 VanDerWaalsContact CD1-CG 3.46Å; W920-E934 PolarHBondContact NE1-OE1 3.21Å; E934-H936 PolarHBondContact O-N 2.66Å; E934-H936 VanDerWaalsContact O-N 3.08Å; E934-L937 HydrophobicContact CB-CD1 3.89Å; E934-L937 HydrophobicContact CG-CD1 4Å; E934-L937 WeakPolarHBondContact O-CB 3.48Å; E934-L937 VanDerWaalsContact O-CG 3.31Å; E934-L937 WeakPolarHBondContact O-CG 3.32Å; E934-L937 PolarHBondContact O-N 2.84Å; E934-L937 VanDerWaalsContact O-N 3.1Å
935	N	87.4	Confident	94.4	Very high	141 Å²	141	48.8 Å²	48.8	75%	0.754	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-57.1	-20.4	170.9	-67	-15.7	0	0	0	114.1	S933	S933-N935 PolarHBondContact O-N 2.91Å; S933-N935 VanDerWaalsContact O-N 3.14Å
936	H	89.4	Confident	94.4	Very high	129 Å²	129	48 Å²	48	60%	0.597	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-95.7	-3	-179.3	-61.8	173.2	0	0	0	113.7	S933 E934	S933-H936 PolarHBondContact O-N 2.76Å; E934-H936 PolarHBondContact O-N 2.66Å; E934-H936 VanDerWaalsContact O-N 3.08Å
937	L	93.9	Very high	94.5	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-44	-178.5	-59.6	173.9	0	0	0	112.1	F869 T871 I896 L911 W920 E934 S939	F869-L937 HydrophobicContact CE2-CB 4.39Å; T871-L937 HydrophobicContact CG2-CB 4.24Å; T871-L937 HydrophobicContact CG2-CD1 3.94Å; I896-L937 HydrophobicContact CD1-CB 3.9Å; I896-L937 HydrophobicContact CD1-CD2 4.11Å; I896-L937 HydrophobicContact CD1-CG 4.48Å; L911-L937 HydrophobicContact CB-CD2 4.19Å; L911-L937 HydrophobicContact CD1-CD2 3.81Å; W920-L937 HydrophobicContact CB-CD2 4.31Å; W920-L937 HydrophobicContact CD2-CD1 3.86Å; W920-L937 HydrophobicContact CD2-CD2 3.6Å; W920-L937 HydrophobicContact CD2-CG 4.37Å; W920-L937 VanDerWaalsContact CE2-CD1 3.49Å; W920-L937 HydrophobicContact CE3-CD1 4.38Å; W920-L937 HydrophobicContact CE3-CD2 3.57Å; W920-L937 HydrophobicContact CG-CD1 4.25Å; W920-L937 HydrophobicContact CG-CD2 3.95Å; W920-L937 HydrophobicContact CH2-CD1 4.31Å; W920-L937 HydrophobicContact CZ2-CD1 3.74Å; W920-L937 HydrophobicContact CZ3-CD2 4.09Å; E934-L937 HydrophobicContact CB-CD1 3.89Å; E934-L937 HydrophobicContact CG-CD1 4Å; E934-L937 WeakPolarHBondContact O-CB 3.48Å; E934-L937 VanDerWaalsContact O-CG 3.31Å; E934-L937 WeakPolarHBondContact O-CG 3.32Å; E934-L937 PolarHBondContact O-N 2.84Å; E934-L937 VanDerWaalsContact O-N 3.1Å; L937-S939 PolarHBondContact O-N 3.29Å
938	V	95.3	Very high	94.5	Very high	40 Å²	40	41.4 Å²	41.4	24%	0.242	24%	0.238	C	C	.	.			trans	-75.5	107.6	-176.9	177.1	0	0	0	0	110	I866 E868 F869 T871	I866-V938 HydrophobicContact CG2-CG1 4.02Å; E868-V938 HydrophobicContact CG-CG1 4.42Å; F869-V938 HydrophobicContact CD2-CG2 4.2Å; F869-V938 HydrophobicContact CE1-CG2 4.42Å; F869-V938 HydrophobicContact CE2-CG2 3.92Å; F869-V938 HydrophobicContact CZ-CB 4.49Å; F869-V938 HydrophobicContact CZ-CG2 4.05Å; T871-V938 HydrophobicContact CG2-CG2 4.11Å
939	S	94.5	Very high	94.3	Very high	26 Å²	26	44.7 Å²	44.7	18%	0.182	25%	0.246	C	C	.	.			trans	-143.1	165.1	-177.3	72	0	0	0	0	112.7	L937 S941 A942	L937-S939 PolarHBondContact O-N 3.29Å; S939-S941 PolarHBondContact O-N 2.9Å; S939-S941 PolarHBondContact OG-N 2.88Å; S939-A942 PolarHBondContact OG-N 3.44Å
940	S	94.8	Very high	94.1	Very high	49 Å²	49	48.4 Å²	48.4	34%	0.343	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-12.4	167.5	47.8	0	0	0	0	113.5	R854 S864	R854-S940 VanDerWaalsContact CZ-O 3.3Å; R854-S940 PolarHBondContact NH2-O 3.44Å; S864-S940 WeakPolarHBondContact O-CB 3.31Å
941	S	96.4	Very high	94.2	Very high	25 Å²	25	43.5 Å²	43.5	18%	0.175	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-27.3	178.5	-58	0	0	0	0	113.1	N898 H899 S939 Y943	N898-S941 WeakPolarHBondContact CA-O 3.22Å; H899-S941 PolarHBondContact N-O 2.74Å; H899-S941 WeakPolarHBondContact O-CA 3.14Å; H899-S941 WeakPolarHBondContact O-CB 3.5Å; S939-S941 PolarHBondContact O-N 2.9Å; S939-S941 PolarHBondContact OG-N 2.88Å; S941-Y943 PolarHBondContact O-N 2.87Å
942	A	97.6	Very high	94.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	122.5	-177.8	0	0	0	0	0	111.2	L852 R854 F869 I896 N898 S939 L945	L852-A942 WeakPolarHBondContact CD1-O 3.44Å; R854-A942 VanDerWaalsContact CZ-O 3.28Å; R854-A942 PolarHBondContact NE-O 3.07Å; R854-A942 PolarHBondContact NH2-O 3.29Å; F869-A942 HydrophobicContact CE1-CB 3.8Å; F869-A942 HydrophobicContact CZ-CB 4.21Å; I896-A942 HydrophobicContact CG2-CB 4.01Å; N898-A942 WeakPolarHBondContact OD1-CA 3.35Å; N898-A942 PolarHBondContact OD1-N 2.95Å; N898-A942 VanDerWaalsContact OD1-N 3.15Å; S939-A942 PolarHBondContact OG-N 3.44Å; A942-L945 HydrophobicContact CB-CD2 4.37Å
943	Y	98.1	Very high	94.5	Very high	3 Å²	3	42.9 Å²	42.9	1%	0.012	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	-44	-169.5	178.4	-124.6	0	0	0	112.9	D711 A712 Q713 H851 L852 R854 F855 S897 H899 Y908 S941	D711-Y943 PolarHBondContact OD1-OH 2.96Å; D711-Y943 PolarHBondContact OD2-OH 3.25Å; D711-Y943 VanDerWaalsContact OD2-OH 3.06Å; A712-Y943 HydrophobicContact CB-CE1 4.39Å; Q713-Y943 HydrophobicContact CB-CE1 4.37Å; H851-Y943 AromaticContact CD2-CE2 3.35Å; H851-Y943 WeakPolarHBondContact CD2-CE2 3.06Å; H851-Y943 AromaticContact CD2-CZ 3.52Å; H851-Y943 PolarHBondContact CD2-OH 3.36Å; H851-Y943 AromaticContact NE2-CE2 3.28Å; H851-Y943 VanDerWaalsContact NE2-CE2 3.28Å; H851-Y943 WeakPolarHBondContact NE2-CE2 3.25Å; H851-Y943 AromaticContact NE2-CZ 3.4Å; H851-Y943 PolarHBondContact NE2-OH 3.45Å; L852-Y943 PolarHBondContact N-O 2.74Å; L852-Y943 WeakPolarHBondContact O-CD2 3.27Å; L852-Y943 VanDerWaalsContact O-CE2 3.27Å; L852-Y943 WeakPolarHBondContact O-CE2 3.49Å; R854-Y943 HydrophobicContact CB-CD2 4.3Å; R854-Y943 HydrophobicContact CB-CE2 4.46Å; R854-Y943 HydrophobicContact CG-CD2 4.32Å; F855-Y943 HydrophobicContact CD2-CE2 4.03Å; F855-Y943 AromaticContact CD2-CZ 3.96Å; F855-Y943 HydrophobicContact CE2-CE1 4.2Å; F855-Y943 AromaticContact CE2-CE2 3.93Å; F855-Y943 HydrophobicContact CE2-CE2 3.93Å; F855-Y943 AromaticContact CE2-CZ 3.71Å; S897-Y943 WeakPolarHBondContact O-CB 3.33Å; S897-Y943 PolarHBondContact O-N 3.37Å; H899-Y943 HydrophobicContact CB-CD1 4.49Å; H899-Y943 HydrophobicContact CB-CG 4.4Å; Y908-Y943 AromaticContact CE1-CD1 3.92Å; Y908-Y943 HydrophobicContact CE1-CD1 3.92Å; Y908-Y943 HydrophobicContact CE1-CE1 4.3Å; S941-Y943 PolarHBondContact O-N 2.87Å
944	I	98.6	Very high	94.7	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	127.8	171.5	-44.7	174.7	0	0	0	108.3	A712 Q713 L716 V849 I850 I896 S897 F946	A712-I944 HydrophobicContact CB-CD1 4.04Å; Q713-I944 HydrophobicContact CB-CD1 3.88Å; Q713-I944 HydrophobicContact CB-CG1 4.46Å; L716-I944 HydrophobicContact CD2-CD1 4.39Å; L716-I944 HydrophobicContact CD2-CG2 4.36Å; V849-I944 HydrophobicContact CG1-CG2 3.51Å; I850-I944 WeakPolarHBondContact O-CA 3.3Å; I896-I944 CarbonylContact C-O 3.54Å; I896-I944 WeakPolarHBondContact CA-O 3.35Å; S897-I944 PolarHBondContact N-O 3.3Å; S897-I944 PolarHBondContact O-N 3.34Å; S897-I944 VanDerWaalsContact O-N 3.13Å; I944-F946 HydrophobicContact CB-CE2 4Å; I944-F946 HydrophobicContact CG2-CD2 4.18Å; I944-F946 HydrophobicContact CG2-CE2 3.6Å; I944-F946 HydrophobicContact CG2-CZ 3.97Å
945	L	98.6	Very high	95	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	134.5	176.4	-54.7	176.5	0	0	0	109.3	L805 V849 I850 F869 L893 I896 A942 Y947	L805-L945 HydrophobicContact CD1-CD1 4.08Å; L805-L945 HydrophobicContact CD2-CD1 3.89Å; V849-L945 WeakPolarHBondContact CA-O 3.38Å; I850-L945 HydrophobicContact CB-CB 4.42Å; I850-L945 PolarHBondContact N-O 3.14Å; I850-L945 PolarHBondContact O-N 3.46Å; F869-L945 HydrophobicContact CB-CD1 4.17Å; F869-L945 HydrophobicContact CD1-CD1 3.86Å; F869-L945 HydrophobicContact CD1-CD2 4.03Å; F869-L945 HydrophobicContact CE1-CD1 4.45Å; F869-L945 HydrophobicContact CE1-CD2 3.81Å; F869-L945 HydrophobicContact CE2-CD2 4.33Å; F869-L945 HydrophobicContact CG-CD1 4.02Å; F869-L945 HydrophobicContact CG-CD2 4.39Å; F869-L945 HydrophobicContact CZ-CD2 3.96Å; L893-L945 HydrophobicContact CD1-CB 3.98Å; L893-L945 HydrophobicContact CD1-CD2 4.35Å; I896-L945 HydrophobicContact CG1-CD2 4.09Å; I896-L945 HydrophobicContact CG2-CD2 4.08Å; A942-L945 HydrophobicContact CB-CD2 4.37Å; L945-Y947 HydrophobicContact CB-CD2 4.22Å; L945-Y947 HydrophobicContact CB-CE2 3.73Å; L945-Y947 HydrophobicContact CD1-CE2 4.15Å
946	F	98.6	Very high	95.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	119.1	178.5	-65.7	-104.8	0	0	0	109.8	C642 L643 L716 V849 Y894 A895 I944	C642-F946 HydrophobicContact CB-CD1 4.29Å; C642-F946 HydrophobicContact CB-CD2 3.77Å; C642-F946 HydrophobicContact CB-CE1 4.04Å; C642-F946 HydrophobicContact CB-CE2 3.48Å; C642-F946 VanDerWaalsContact CB-CE2 3.48Å; C642-F946 HydrophobicContact CB-CG 4.18Å; C642-F946 HydrophobicContact CB-CZ 3.63Å; L643-F946 HydrophobicContact CD2-CE1 4.3Å; L716-F946 HydrophobicContact CD1-CE1 4.32Å; L716-F946 HydrophobicContact CD1-CZ 4.38Å; L716-F946 HydrophobicContact CD2-CE1 4.14Å; L716-F946 HydrophobicContact CD2-CZ 3.86Å; V849-F946 HydrophobicContact CG1-CE1 4.38Å; V849-F946 HydrophobicContact CG2-CD1 3.84Å; V849-F946 HydrophobicContact CG2-CE1 3.95Å; Y894-F946 HydrophobicContact CD1-CB 4.31Å; Y894-F946 WeakPolarHBondContact CD1-O 3.42Å; Y894-F946 HydrophobicContact CE1-CB 3.7Å; Y894-F946 HydrophobicContact CE2-CB 4.24Å; Y894-F946 PolarHBondContact N-O 3.19Å; A895-F946 HydrophobicContact CB-CB 3.99Å; A895-F946 HydrophobicContact CB-CD2 4.29Å; A895-F946 HydrophobicContact CB-CG 4.33Å; A895-F946 PolarHBondContact N-O 2.91Å; A895-F946 WeakPolarHBondContact O-CB 3.28Å; A895-F946 PolarHBondContact O-N 3.12Å; I944-F946 HydrophobicContact CB-CE2 4Å; I944-F946 HydrophobicContact CG2-CD2 4.18Å; I944-F946 HydrophobicContact CG2-CE2 3.6Å; I944-F946 HydrophobicContact CG2-CZ 3.97Å
947	Y	97.9	Very high	96	Very high	1 Å²	1	28.6 Å²	28.6	0%	0.004	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	142.5	-178	-75.6	-87.8	0	0	0	111.7	L805 Y847 L848 I850 L876 S892 L893 Y894 L945	L805-Y947 HydrophobicContact CD2-CE2 4.12Å; L805-Y947 WeakPolarHBondContact CD2-OH 3.46Å; Y847-Y947 CarbonylContact C-O 3.44Å; Y847-Y947 VanDerWaalsContact CA-O 3.23Å; Y847-Y947 WeakPolarHBondContact CA-O 3.27Å; L848-Y947 PolarHBondContact N-O 3.31Å; L848-Y947 WeakPolarHBondContact O-CB 3.22Å; L848-Y947 PolarHBondContact O-N 3.4Å; I850-Y947 HydrophobicContact CD1-CD2 4.13Å; I850-Y947 HydrophobicContact CD1-CE2 3.99Å; I850-Y947 HydrophobicContact CG1-CD2 4.49Å; L876-Y947 HydrophobicContact CB-CD1 4.27Å; L876-Y947 HydrophobicContact CB-CE1 3.77Å; L876-Y947 HydrophobicContact CD2-CD1 4.35Å; L876-Y947 HydrophobicContact CD2-CD2 4.29Å; L876-Y947 HydrophobicContact CD2-CE1 3.96Å; L876-Y947 HydrophobicContact CD2-CE2 3.89Å; S892-Y947 CarbonylContact O-C 3.48Å; S892-Y947 WeakPolarHBondContact O-CA 3.42Å; L893-Y947 HydrophobicContact CB-CD1 4.02Å; L893-Y947 HydrophobicContact CB-CE1 3.67Å; L893-Y947 HydrophobicContact CD1-CD1 4.16Å; L893-Y947 HydrophobicContact CD1-CD2 3.98Å; L893-Y947 HydrophobicContact CD1-CE1 3.81Å; L893-Y947 HydrophobicContact CD1-CE2 3.61Å; L893-Y947 HydrophobicContact CD1-CG 4.24Å; L893-Y947 HydrophobicContact CG-CE1 4.33Å; Y894-Y947 VanDerWaalsContact CE1-C 3.49Å; L945-Y947 HydrophobicContact CB-CD2 4.22Å; L945-Y947 HydrophobicContact CB-CE2 3.73Å; L945-Y947 HydrophobicContact CD1-CE2 4.15Å
948	E	96.4	Very high	96.1	Very high	35 Å²	35	30.8 Å²	30.8	16%	0.164	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	128.5	173	-179	164.1	-126.1	0	0	107.8	Q647 Y847 Y891 S892 Y894	Q647-E948 PolarHBondContact NE2-OE1 3Å; Q647-E948 PolarHBondContact NE2-OE2 3.16Å; Y847-E948 HydrophobicContact CD1-CB 3.9Å; Y847-E948 HydrophobicContact CD1-CG 4.09Å; Y847-E948 HydrophobicContact CE1-CB 3.67Å; Y847-E948 HydrophobicContact CE1-CG 3.47Å; Y847-E948 VanDerWaalsContact CE1-CG 3.47Å; Y847-E948 WeakPolarHBondContact CE1-OE1 3.48Å; Y847-E948 PolarHBondContact OH-OE1 3.46Å; Y891-E948 WeakPolarHBondContact CA-O 3.43Å; S892-E948 PolarHBondContact N-O 2.75Å; S892-E948 PolarHBondContact O-N 3.25Å; Y894-E948 HydrophobicContact CD1-CB 3.78Å; Y894-E948 HydrophobicContact CE1-CB 4.2Å
949	R	94.6	Very high	96.2	Very high	108 Å²	108	30 Å²	30	41%	0.408	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	134.2	179.1	-177.9	174.9	175.2	172.6	2.5	110.5	K846 Y891	K846-R949 VanDerWaalsContact O-CB 3.27Å; K846-R949 WeakPolarHBondContact O-CB 3.36Å; K846-R949 PolarHBondContact O-N 3.35Å; Y891-R949 HydrophobicContact CD1-CB 3.93Å; Y891-R949 HydrophobicContact CE1-CB 3.63Å; Y891-R949 HydrophobicContact CE1-CG 4.35Å
950	T	88.4	Confident	96.3	Very high	113 Å²	113	30.4 Å²	30.4	69%	0.693	16%	0.163	S	C	*	.			trans	-94.7	0	174.4	46.5	0	0	0	0	113	E875 H890	E875-T950 WeakPolarHBondContact OE1-CB 3.31Å; E875-T950 WeakPolarHBondContact OE1-CG2 3.43Å; E875-T950 PolarHBondContact OE1-OG1 3.33Å; H890-T950 VanDerWaalsContact C-OG1 3.3Å; H890-T950 WeakPolarHBondContact CB-OG1 3.47Å; H890-T950 PolarHBondContact O-N 3.46Å; H890-T950 VanDerWaalsContact O-N 3.16Å; H890-T950 PolarHBondContact O-OG1 3.14Å

Retrieved 950 of 950 residues in 206 ms (Link to these results)

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