A0A087XFA4_POEFO Loading...

AF4/FMR2 family, member 2

AlphaFold DB , UniProt , Accession A0A087XFA4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 875 aa.

						>A0A087XFA4_POEFO|A0A087XFA4
SGASGSSSESESSSESDTDESESSSSDSDYNQASRTNTPEPEPPSTNKWQLDSWLNKVQAQTKPLVPTQQEHHGAGSISQDPQTFSPRNEAPERNASRPLSKVSVEFSPGREKAKAKLGQKAAGEGQRSKMRLSPGLLSGQEVPAPRRNTTGKKQPRRAERSSSVEENQNQAWSRTNQHSPAAREKDLLPPPPLEHQNPPRPRGKPLSGKTAPRKEPRSATSLDKDKRKHRGPSTKITPKSREFIETDSSSSSSECQSDGEEATKIPSMPAPSISAQMLATVHSNGNLLSIGNISASFGNSVPDPGGQGKDAEPASPPSNVGHDVALSPLRDYHEVQSLWVKIDLSFLSRVPEQTAGERARLAGRTERLENGGKHRRQAAANMVAPTEKHTSKSKRKHKLDHGESPVKCNKKLRLDKDCLLLPPCISPIHNHKSSSAEENEEKTINHAKKQTRRRDDKLLPPLLSPLSDEPPRKRACDGGPSLTEEAGAVGMLPCSASSAAAAASSHRHRRGEGKATAHARNGGVSVLLEPSIICFPGQGTERRLVRSTYLLLLVLRKNKEKTINHANNIQNDSYDMDSHCDKPGGDGYHANGHSDSEVWSEAMMGQSEPRRPRLSFTDTVHTAEYYMQEAKRLKHKADALTDKFGKAVNYADGALSFIECGNAMERDPLEAKSPYTMYSETVELIRYAMRLKNFTSHSATVLEKRLAVLCNRCLSLLYLRMFHLKKDHAVKYSRSLMEYFKVIQNSAKSSHQAPSPWRSNGKVNGTPSPLSLSPSPASSGGAPAAATGGGGTSGSSGSVAIPQRIHHMAASHVNITNNILRSYEQWETADRLAADSRDFFQDLDSALSQQSSMVELVRYIRQGLHWLRSEAQLL
					

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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	S	40.4	Very low	37.4	Very low	175 Å²	175	117.9 Å²	117.9	100%	1.224	81%	0.808	S	S	*	*				0	122.6	0	-38.7	0	0	0	0	107.2
2	G	38.3	Very low	36.8	Very low	76 Å²	76	118.6 Å²	118.6	78%	0.784	81%	0.814	S	S	*	*			cis	86.5	131.4	18.4	0	0	0	0	0	110.7
3	A	37.2	Very low	37.1	Very low	93 Å²	93	118.2 Å²	118.2	77%	0.769	81%	0.812	S	S	*	*			cis	-161.8	175.4	-2.8	0	0	0	0	0	111.1
4	S	37	Very low	36.9	Very low	128 Å²	128	118.4 Å²	118.4	90%	0.895	82%	0.815	S	S	*	*			trans	68.4	154.2	171.1	-49.8	0	0	0	0	116.2
5	G	36.4	Very low	37.2	Very low	69 Å²	69	122.8 Å²	122.8	71%	0.711	82%	0.818	S	S	*	*			cis	124.9	146.2	4.5	0	0	0	0	0	110.9
6	S	39.4	Very low	36.9	Very low	115 Å²	115	122.6 Å²	122.6	80%	0.804	82%	0.819	S	S	*	*			cis	-166.2	-171.2	-3.7	-74.7	0	0	0	0	109.4
7	S	38.7	Very low	37.4	Very low	111 Å²	111	123.9 Å²	123.9	78%	0.776	82%	0.817	S	S	*	*			trans	76.3	150.9	158.6	-69.4	0	0	0	0	119.1
8	S	37.3	Very low	37.7	Very low	83 Å²	83	124 Å²	124	58%	0.58	81%	0.814	S	S	*	*			cis	-163.4	133.2	-14	-89.8	0	0	0	0	106.8
9	E	35.1	Very low	37.7	Very low	169 Å²	169	125.4 Å²	125.4	79%	0.79	81%	0.814	S	S	*	*				90.2	144.3	69.2	-70.2	163.4	145.9	0	0	115.4
10	S	33.9	Very low	37.9	Very low	110 Å²	110	127.4 Å²	127.4	77%	0.769	81%	0.811	S	S	*	*			trans	101.9	108.5	154.3	-55.8	0	0	0	0	121.7
11	E	38.3	Very low	37.7	Very low	168 Å²	168	125.8 Å²	125.8	79%	0.785	80%	0.804	S	S	*	*			trans	-55.1	165.5	157.6	43.8	-99.6	56.9	0	0	117.9
12	S	29.7	Very low	37.4	Very low	126 Å²	126	125 Å²	125	88%	0.881	78%	0.781	S	S	*	*			trans	-165	155.1	138.9	-81.5	0	0	0	0	112.6
13	S	41.3	Very low	37	Very low	113 Å²	113	125.5 Å²	125.5	79%	0.79	77%	0.773	S	S	*	*			trans	-132.6	162.3	-179.2	-50.1	0	0	0	0	110.7
14	S	33.4	Very low	36.8	Very low	122 Å²	122	126.6 Å²	126.6	85%	0.853	78%	0.775	S	S	*	*			trans	174.3	165.1	141.2	-79.6	0	0	0	0	113.5
15	E	41.5	Very low	36.5	Very low	184 Å²	184	125 Å²	125	86%	0.86	76%	0.764	S	S	*	*			trans	-120.2	168.2	-173.3	-60.8	156.1	114.1	0	0	111.6
16	S	32.2	Very low	36.2	Very low	120 Å²	120	125.7 Å²	125.7	84%	0.839	76%	0.758	S	S	*	*			trans	-170.8	162.2	164.1	-76.8	0	0	0	0	112.6
17	D	46.1	Very low	35.8	Very low	144 Å²	144	127 Å²	127	77%	0.77	76%	0.755	S	S	*	*			trans	-128.2	178.6	-154.2	-54.9	-91.8	0	0	0	117.4
18	T	42	Very low	35.6	Very low	126 Å²	126	126.8 Å²	126.8	77%	0.773	75%	0.754	S	S	*	*			trans	69.2	155.9	152.8	37.3	0	0	0	0	120.2
19	D	38.6	Very low	35.5	Very low	151 Å²	151	129.7 Å²	129.7	81%	0.807	76%	0.763	S	S	*	*			cis	-150.7	176.1	4.5	-136.6	-32	0	0	0	113.9
20	E	40.3	Very low	35.3	Very low	164 Å²	164	132.5 Å²	132.5	77%	0.766	77%	0.768	S	S	*	*			trans	-76.3	173.5	-176.4	-83.7	-82.9	141.5	0	0	116.5
21	S	34.4	Very low	35.2	Very low	95 Å²	95	133.7 Å²	133.7	66%	0.664	77%	0.766	S	S	*	*			cis	-139.1	-119.6	7.8	-155.7	0	0	0	0	114.1
22	E	34	Very low	34.8	Very low	157 Å²	157	134.9 Å²	134.9	73%	0.734	77%	0.771	S	S	*	*			cis	-159	-153	8.6	-140.2	-65.4	103.2	0	0	111.5
23	S	30	Very low	34.7	Very low	87 Å²	87	132.5 Å²	132.5	61%	0.608	76%	0.76	S	S	*	*			trans	-119.3	137.4	-149.1	-66.3	0	0	0	0	121
24	S	33.8	Very low	34.1	Very low	117 Å²	117	132.7 Å²	132.7	82%	0.818	76%	0.761	S	S	*	*				75.3	133.4	128.5	-158.1	0	0	0	0	125.8
25	S	29.2	Very low	34	Very low	95 Å²	95	139 Å²	139	66%	0.664	77%	0.766	S	S	*	*				116.5	137	126.7	-152.3	0	0	0	0	122.5
26	S	30.1	Very low	33.4	Very low	83 Å²	83	136.6 Å²	136.6	58%	0.58	76%	0.764	S	S	*	*			trans	104.2	142.4	136.1	-151.6	0	0	0	0	122.6	Q308	S26-Q308 PolarHBondContact O-NE2 2.85Å
27	D	32.7	Very low	33.4	Very low	141 Å²	141	138.5 Å²	138.5	75%	0.754	77%	0.765	S	S	*	*			trans	-55.6	155.2	176.3	-87.3	-80.9	0	0	0	117.5
28	S	34	Very low	32.6	Very low	107 Å²	107	138 Å²	138	75%	0.748	77%	0.767	S	S	*	*				-179.1	137.1	113	36.3	0	0	0	0	115.2
29	D	35.6	Very low	32.3	Very low	144 Å²	144	137.6 Å²	137.6	77%	0.77	77%	0.767	S	S	*	*			trans	-64.4	148.1	156.9	-85.1	-66.8	0	0	0	111.4
30	Y	29.5	Very low	31.9	Very low	228 Å²	228	138.8 Å²	138.8	89%	0.894	77%	0.768	S	S	*	*			trans	-154.7	144	134.4	-116.4	-75.3	0	0	0	113.5
31	N	32.2	Very low	31.8	Very low	136 Å²	136	136.5 Å²	136.5	73%	0.727	77%	0.767	S	S	*	*			trans	-76.5	155.2	-174.2	-66.9	-96.9	0	0	0	113.7
32	Q	29.8	Very low	31.7	Very low	192 Å²	192	140.8 Å²	140.8	90%	0.897	78%	0.777	S	S	*	*				-156.1	126.3	117.2	-152.9	134.9	68.4	0	0	116.3
33	A	27.4	Very low	31.8	Very low	77 Å²	77	138.8 Å²	138.8	64%	0.636	78%	0.777	S	S	*	*			trans	58.1	93.2	144.3	0	0	0	0	0	122.6
34	S	28.4	Very low	32	Very low	117 Å²	117	140.4 Å²	140.4	82%	0.818	79%	0.785	S	S	*	*				56.3	111.3	111.2	-53	0	0	0	0	121.8
35	R	32.7	Very low	32.3	Very low	253 Å²	253	138.6 Å²	138.6	96%	0.955	77%	0.773	S	S	*	*			trans	-149.5	162.4	131	-108.3	157.2	-163.5	-105.3	-0.8	111.1
36	T	29.2	Very low	32.6	Very low	135 Å²	135	138.7 Å²	138.7	83%	0.828	77%	0.77	S	S	*	*			trans	-94.6	153	-152.6	46.6	0	0	0	0	115.9
37	N	30.7	Very low	33.3	Very low	159 Å²	159	139.1 Å²	139.1	85%	0.85	77%	0.766	S	S	*	*			trans	-63.4	134.8	177.5	-71	-58.3	0	0	0	114.4
38	T	29.3	Very low	33.6	Very low	134 Å²	134	138.5 Å²	138.5	82%	0.822	76%	0.756	S	S	*	*			trans	-147.6	111.5	144.3	-50.8	0	0	0	0	108.9
39	P	35.6	Very low	34	Very low	117 Å²	117	141 Å²	141	76%	0.76	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-82.1	123.8	171.5	30.9	-31	0	0	0	111.1
40	E	31	Very low	34.7	Very low	177 Å²	177	139.2 Å²	139.2	83%	0.827	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-73.3	140.8	172.8	-169.6	177.1	125	0	0	110.7	E42	E40-E42 PolarHBondContact O-N 3.15Å
41	P	37.9	Very low	35.7	Very low	116 Å²	116	132.7 Å²	132.7	75%	0.753	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-73.9	116.5	179.3	28.6	-33.9	0	0	0	111.9
42	E	32.6	Very low	36.3	Very low	185 Å²	185	128.8 Å²	128.8	86%	0.864	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-55.1	139.6	173.9	-89.8	-163.6	117	0	0	112.4	E40	E40-E42 PolarHBondContact O-N 3.15Å
43	P	35.8	Very low	36.9	Very low	114 Å²	114	122.8 Å²	122.8	74%	0.74	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-68	135.7	177.2	27.9	-34.1	0	0	0	111.3	S45	P43-S45 PolarHBondContact O-N 3.2Å
44	P	34.6	Very low	37.8	Very low	121 Å²	121	122.6 Å²	122.6	79%	0.786	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-66.2	128	-174	25.9	-34.5	0	0	0	112	T46	P44-T46 PolarHBondContact O-N 2.72Å
45	S	40.9	Very low	38.9	Very low	80 Å²	80	118.6 Å²	118.6	56%	0.559	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-56.4	134.4	-176.5	75.6	0	0	0	0	113	P43 N47 K48	P43-S45 PolarHBondContact O-N 3.2Å; S45-N47 PolarHBondContact O-N 2.66Å; S45-K48 PolarHBondContact O-N 2.83Å
46	T	35.3	Very low	39.7	Very low	97 Å²	97	111.2 Å²	111.2	60%	0.595	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-3.5	-175	35.2	0	0	0	0	115.2	P44 W49	P44-T46 PolarHBondContact O-N 2.72Å; T46-W49 PolarHBondContact O-NE1 2.9Å
47	N	44.5	Very low	40.4	Very low	92 Å²	92	112.1 Å²	112.1	49%	0.492	60%	0.599	S	S	.	*	H	α-helix	trans	-81.5	-20.2	177.3	-71.8	-43.1	0	0	0	114.3	S45	S45-N47 PolarHBondContact O-N 2.66Å
48	K	39.4	Very low	40.9	Very low	127 Å²	127	105.9 Å²	105.9	55%	0.552	57%	0.566	S	S	*	*	H	α-helix	trans	-66.5	-51.7	179.8	-72.6	-160.4	92.7	-72.7	0	112	S45 Q50 L51 D52	S45-K48 PolarHBondContact O-N 2.83Å; K48-Q50 VanDerWaalsContact C-N 3.27Å; K48-Q50 PolarHBondContact O-N 2.72Å; K48-L51 PolarHBondContact O-N 3.4Å; K48-D52 IonicContact NZ-OD2 3.9Å; K48-D52 PolarHBondContact NZ-OD2 3.22Å; K48-D52 VanDerWaalsContact O-CB 3.3Å; K48-D52 WeakPolarHBondContact O-CB 3.22Å; K48-D52 VanDerWaalsContact O-CG 3.27Å; K48-D52 PolarHBondContact O-N 3.28Å
49	W	40.9	Very low	41.5	Very low	160 Å²	160	105.9 Å²	105.9	61%	0.606	56%	0.557	S	S	*	*	H	α-helix	trans	-64.5	-28.1	-171.2	69.2	-97.3	0	0	0	113.6	T46 S53	T46-W49 PolarHBondContact O-NE1 2.9Å; W49-S53 WeakPolarHBondContact O-CA 3.45Å; W49-S53 WeakPolarHBondContact O-CB 3.42Å; W49-S53 PolarHBondContact O-N 2.92Å
50	Q	50.1	Low	41.6	Very low	106 Å²	106	103.5 Å²	103.5	50%	0.495	55%	0.547	S	S	.	.	H	α-helix	trans	-71.9	-49.4	179.3	-62	-169.3	-85.1	0	0	112.1	K48 S53 W54	K48-Q50 VanDerWaalsContact C-N 3.27Å; K48-Q50 PolarHBondContact O-N 2.72Å; Q50-S53 PolarHBondContact O-N 3.4Å; Q50-W54 PolarHBondContact O-N 3.07Å; Q50-W54 VanDerWaalsContact O-N 3.13Å
51	L	51	Low	41.8	Very low	91 Å²	91	103 Å²	103	48%	0.476	55%	0.545	S	S	.	.	H	α-helix	trans	-68	-43.5	177.4	-73.1	166.6	0	0	0	111.6	K48 S53 W54 L55	K48-L51 PolarHBondContact O-N 3.4Å; L51-S53 VanDerWaalsContact C-N 3.33Å; L51-S53 PolarHBondContact O-N 3.43Å; L51-W54 PolarHBondContact O-N 3.39Å; L51-L55 VanDerWaalsContact O-CG 3.32Å; L51-L55 WeakPolarHBondContact O-CG 3.5Å; L51-L55 PolarHBondContact O-N 2.84Å
52	D	45.5	Very low	41.9	Very low	55 Å²	55	101.8 Å²	101.8	29%	0.294	54%	0.535	S	S	.	.	H	α-helix	trans	-67.5	-34.1	178.4	-65	-29.2	0	0	0	110.8	K48 N56	K48-D52 IonicContact NZ-OD2 3.9Å; K48-D52 PolarHBondContact NZ-OD2 3.22Å; K48-D52 VanDerWaalsContact O-CB 3.3Å; K48-D52 WeakPolarHBondContact O-CB 3.22Å; K48-D52 VanDerWaalsContact O-CG 3.27Å; K48-D52 PolarHBondContact O-N 3.28Å; D52-N56 VanDerWaalsContact O-CB 3.31Å; D52-N56 WeakPolarHBondContact O-CB 3.39Å; D52-N56 PolarHBondContact O-N 2.79Å; D52-N56 PolarHBondContact O-ND2 3.24Å
53	S	41.4	Very low	41.7	Very low	65 Å²	65	101.6 Å²	101.6	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-64.7	-45.2	173.5	178.6	0	0	0	0	112.3	W49 Q50 L51 K57	W49-S53 WeakPolarHBondContact O-CA 3.45Å; W49-S53 WeakPolarHBondContact O-CB 3.42Å; W49-S53 PolarHBondContact O-N 2.92Å; Q50-S53 PolarHBondContact O-N 3.4Å; L51-S53 VanDerWaalsContact C-N 3.33Å; L51-S53 PolarHBondContact O-N 3.43Å; S53-K57 WeakPolarHBondContact O-CB 3.31Å; S53-K57 PolarHBondContact O-N 3.43Å
54	W	46.4	Very low	41.3	Very low	73 Å²	73	101.7 Å²	101.7	28%	0.277	53%	0.532	S	S	.	.	H	α-helix	trans	-63.4	-45.4	176.5	-174.5	81.9	0	0	0	112	Q50 L51 K57 V58 M628	Q50-W54 PolarHBondContact O-N 3.07Å; Q50-W54 VanDerWaalsContact O-N 3.13Å; L51-W54 PolarHBondContact O-N 3.39Å; W54-K57 PolarHBondContact O-N 3.25Å; W54-V58 HydrophobicContact CD2-CG2 4.41Å; W54-V58 WeakPolarHBondContact O-CG2 3.44Å; W54-V58 PolarHBondContact O-N 3.26Å; W54-M628 HydrophobicContact CH2-CE 3.8Å; W54-M628 HydrophobicContact CH2-CG 4.13Å; W54-M628 HydrophobicContact CH2-SD 3.61Å; W54-M628 HydrophobicContact CZ2-CE 3.82Å; W54-M628 HydrophobicContact CZ2-SD 4.05Å
55	L	52.6	Low	40.9	Very low	33 Å²	33	103.7 Å²	103.7	17%	0.173	54%	0.536	C	S	.	.	H	α-helix	trans	-61.3	-49.1	178.2	-70.6	170.9	0	0	0	112	L51 K57 V58 Q59 K632	L51-L55 VanDerWaalsContact O-CG 3.32Å; L51-L55 WeakPolarHBondContact O-CG 3.5Å; L51-L55 PolarHBondContact O-N 2.84Å; L55-K57 PolarHBondContact O-N 3.31Å; L55-V58 PolarHBondContact O-N 2.76Å; L55-Q59 PolarHBondContact O-N 3.46Å; L55-K632 HydrophobicContact CD2-CD 4.3Å; L55-K632 HydrophobicContact CD2-CG 4.34Å
56	N	48.3	Very low	40.1	Very low	98 Å²	98	105.5 Å²	105.5	52%	0.524	54%	0.543	S	S	.	.	H	α-helix	trans	-65.1	-38.4	177.6	-78	-69.4	0	0	0	112.4	D52 V58 Q59 A60	D52-N56 VanDerWaalsContact O-CB 3.31Å; D52-N56 WeakPolarHBondContact O-CB 3.39Å; D52-N56 PolarHBondContact O-N 2.79Å; D52-N56 PolarHBondContact O-ND2 3.24Å; N56-V58 VanDerWaalsContact C-N 3.32Å; N56-V58 PolarHBondContact O-N 3.42Å; N56-Q59 PolarHBondContact O-N 3.33Å; N56-A60 WeakPolarHBondContact O-CB 3.34Å; N56-A60 PolarHBondContact O-N 2.85Å
57	K	44.1	Very low	39.7	Very low	155 Å²	155	106.2 Å²	106.2	67%	0.674	55%	0.55	S	S	*	.	H	α-helix	trans	-71.1	-26.9	-179.7	-165.3	167.8	-175.6	175.8	0	112.8	S53 W54 L55 Q61	S53-K57 WeakPolarHBondContact O-CB 3.31Å; S53-K57 PolarHBondContact O-N 3.43Å; W54-K57 PolarHBondContact O-N 3.25Å; L55-K57 PolarHBondContact O-N 3.31Å; K57-Q61 WeakPolarHBondContact O-CG 3.27Å
58	V	41.5	Very low	38.8	Very low	28 Å²	28	108.5 Å²	108.5	17%	0.17	57%	0.567	C	S	.	*	H	α-helix	trans	-75.5	-39.5	168.4	173.6	0	0	0	0	111.4	W54 L55 N56 A60 Q61 T62	W54-V58 HydrophobicContact CD2-CG2 4.41Å; W54-V58 WeakPolarHBondContact O-CG2 3.44Å; W54-V58 PolarHBondContact O-N 3.26Å; L55-V58 PolarHBondContact O-N 2.76Å; N56-V58 VanDerWaalsContact C-N 3.32Å; N56-V58 PolarHBondContact O-N 3.42Å; V58-A60 PolarHBondContact O-N 2.97Å; V58-Q61 PolarHBondContact O-N 3.3Å; V58-T62 PolarHBondContact O-OG1 2.72Å
59	Q	42	Very low	38.4	Very low	133 Å²	133	111.3 Å²	111.3	62%	0.621	58%	0.582	S	S	*	*	H	α-helix	trans	-64.1	-36.6	173.7	-99.8	178.7	-44.2	0	0	113.3	L55 N56 Q61 T62	L55-Q59 PolarHBondContact O-N 3.46Å; N56-Q59 PolarHBondContact O-N 3.33Å; Q59-Q61 PolarHBondContact O-N 2.95Å; Q59-T62 WeakPolarHBondContact CA-OG1 3.3Å; Q59-T62 PolarHBondContact O-N 3.11Å; Q59-T62 VanDerWaalsContact O-N 3.07Å; Q59-T62 PolarHBondContact O-OG1 3.39Å
60	A	38.8	Very low	37.6	Very low	68 Å²	68	111.4 Å²	111.4	56%	0.562	59%	0.589	S	S	*	*	H	α-helix	trans	-62.1	-26.5	176.8	0	0	0	0	0	113.3	N56 V58	N56-A60 WeakPolarHBondContact O-CB 3.34Å; N56-A60 PolarHBondContact O-N 2.85Å; V58-A60 PolarHBondContact O-N 2.97Å
61	Q	35	Very low	36.3	Very low	165 Å²	165	113 Å²	113	77%	0.771	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	0.8	177.4	-65.5	-68.3	-29.3	0	0	113.4	K57 V58 Q59	K57-Q61 WeakPolarHBondContact O-CG 3.27Å; V58-Q61 PolarHBondContact O-N 3.3Å; Q59-Q61 PolarHBondContact O-N 2.95Å
62	T	38.3	Very low	35.2	Very low	91 Å²	91	115 Å²	115	56%	0.558	60%	0.603	S	S	*	*			trans	-125.4	39.6	-174.5	39.4	0	0	0	0	113.3	V58 Q59	V58-T62 PolarHBondContact O-OG1 2.72Å; Q59-T62 WeakPolarHBondContact CA-OG1 3.3Å; Q59-T62 PolarHBondContact O-N 3.11Å; Q59-T62 VanDerWaalsContact O-N 3.07Å; Q59-T62 PolarHBondContact O-OG1 3.39Å
63	K	28.7	Very low	34.3	Very low	181 Å²	181	120.8 Å²	120.8	79%	0.787	63%	0.628	S	S	*	*			trans	-79.9	124.4	162.1	-76.4	-173.5	175.3	-178.9	0	110.2	L65	K63-L65 PolarHBondContact O-N 2.67Å
64	P	28.1	Very low	33.5	Very low	116 Å²	116	121.4 Å²	121.4	75%	0.753	65%	0.645	S	S	*	*			trans	-63.8	130.7	173	-21	33.2	0	0	0	111.3	V66	P64-V66 PolarHBondContact O-N 3.35Å
65	L	25.4	Very low	32.5	Very low	164 Å²	164	123.3 Å²	123.3	86%	0.859	68%	0.676	S	S	*	*			trans	-78	112.8	168.5	-171.3	71.4	0	0	0	108.3	K63 P67	K63-L65 PolarHBondContact O-N 2.67Å; L65-P67 WeakPolarHBondContact O-CD 3.42Å
66	V	24.8	Very low	31.2	Very low	117 Å²	117	124.9 Å²	124.9	71%	0.709	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-94.3	116.7	175.3	177.3	0	0	0	0	108.8	P64	P64-V66 PolarHBondContact O-N 3.35Å
67	P	27.9	Very low	30.2	Very low	113 Å²	113	125.9 Å²	125.9	73%	0.734	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-75.6	122.7	168.9	-12.5	29.7	0	0	0	109.9	L65	L65-P67 WeakPolarHBondContact O-CD 3.42Å
68	T	25	Very low	29.4	Very low	140 Å²	140	125.3 Å²	125.3	86%	0.859	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-65.8	135.2	169.5	-50.9	0	0	0	0	109.9
69	Q	30.2	Very low	28.6	Very low	186 Å²	186	128.2 Å²	128.2	87%	0.869	74%	0.74	S	S	*	*			trans	-107.3	134.8	174.4	-169.5	-174.6	47.1	0	0	110.2
70	Q	24.3	Very low	27.8	Very low	161 Å²	161	130.5 Å²	130.5	75%	0.752	75%	0.75	S	S	*	*			trans	-148.1	118.9	159.1	-168.5	165.7	4.1	0	0	110.9
71	E	23.6	Very low	27	Very low	139 Å²	139	133.6 Å²	133.6	65%	0.65	76%	0.757	S	S	*	*			trans	44.8	139.8	151	-58.1	174.7	104.6	0	0	119.8
72	H	26.8	Very low	27.1	Very low	134 Å²	134	131.1 Å²	131.1	62%	0.62	76%	0.755	S	S	*	*				-166.6	147.8	55.1	-127.8	-77.9	0	0	0	113.7
73	H	26.9	Very low	26.5	Very low	176 Å²	176	134.4 Å²	134.4	82%	0.815	76%	0.764	S	S	*	*			trans	65.4	146.3	169.6	-44.2	-71.7	0	0	0	118.2
74	G	24.5	Very low	26.2	Very low	78 Å²	78	130.8 Å²	130.8	80%	0.804	76%	0.758	S	S	*	*			cis	-171.7	165.5	-4.6	0	0	0	0	0	112.8
75	A	26.4	Very low	25.9	Very low	114 Å²	114	134.7 Å²	134.7	94%	0.942	76%	0.763	S	S	*	*			trans	-94.1	174.9	-179.4	0	0	0	0	0	112.8
76	G	25.4	Very low	26	Very low	66 Å²	66	131.9 Å²	131.9	68%	0.68	76%	0.757	S	S	*	*			cis	-163.1	179.1	7.5	0	0	0	0	0	111.7
77	S	25.7	Very low	26.5	Very low	118 Å²	118	132 Å²	132	83%	0.825	76%	0.761	S	S	*	*				62	143.3	93.9	-106.9	0	0	0	0	116.1
78	I	28	Very low	26.2	Very low	144 Å²	144	136.3 Å²	136.3	74%	0.738	76%	0.762	S	S	*	*			cis	-168.7	166.5	8.7	-154.6	170.3	0	0	0	112.7
79	S	24.9	Very low	26.2	Very low	89 Å²	89	134.7 Å²	134.7	62%	0.622	75%	0.748	S	S	*	*			trans	69.8	164	153.1	-69.2	0	0	0	0	120.8
80	Q	25.5	Very low	25.9	Very low	181 Å²	181	133.8 Å²	133.8	85%	0.846	74%	0.744	S	S	*	*			cis	-149.9	167.9	5.1	-138.6	158.5	23.2	0	0	116.4
81	D	21.2	Very low	26	Very low	133 Å²	133	130.2 Å²	130.2	71%	0.711	74%	0.742	S	S	*	*			trans	-36.3	166.8	162	-126.6	-50.2	0	0	0	117.4	Q83	D81-Q83 PolarHBondContact OD1-N 3.07Å
82	P	37.7	Very low	26.7	Very low	112 Å²	112	129.1 Å²	129.1	73%	0.727	75%	0.747	S	S	*	*				-149.7	133.7	75.1	37.2	-16.3	0	0	0	119.6
83	Q	24.9	Very low	26.7	Very low	160 Å²	160	129.8 Å²	129.8	75%	0.748	75%	0.75	S	S	*	*			trans	70	120.5	133.8	-67.9	-163.5	23	0	0	119.8	D81	D81-Q83 PolarHBondContact OD1-N 3.07Å
84	T	22.9	Very low	26.8	Very low	106 Å²	106	131 Å²	131	65%	0.65	75%	0.748	S	S	*	*				87.3	118.5	80	-57.3	0	0	0	0	114
85	F	22.2	Very low	26.8	Very low	197 Å²	197	134.6 Å²	134.6	86%	0.864	75%	0.749	S	S	*	*			trans	174	144.8	130.8	-102.5	-72.9	0	0	0	112.1
86	S	26.3	Very low	27	Very low	105 Å²	105	134 Å²	134	73%	0.734	74%	0.743	S	S	*	*			trans	-119	150.6	154.3	-76	0	0	0	0	105.6
87	P	35.8	Very low	27.1	Very low	120 Å²	120	136 Å²	136	78%	0.779	75%	0.747	S	S	*	*				-159.4	-168.8	56.8	39.4	-15.2	0	0	0	117.7
88	R	22.1	Very low	27.4	Very low	204 Å²	204	140.1 Å²	140.1	77%	0.77	75%	0.745	S	S	*	*			trans	91.6	111.6	134	-158.5	172.7	-174	-112.3	-7.5	121.9
89	N	24.7	Very low	28.5	Very low	106 Å²	106	138.9 Å²	138.9	57%	0.567	75%	0.746	S	S	*	*			trans	72.3	140.4	139.4	-67.2	24.3	0	0	0	124.8
90	E	24.3	Very low	28.6	Very low	167 Å²	167	140.6 Å²	140.6	78%	0.78	75%	0.747	S	S	*	*			trans	74.8	126.8	138.2	-76.3	155.2	-129.7	0	0	122.3
91	A	26.7	Very low	28.8	Very low	86 Å²	86	136.8 Å²	136.8	71%	0.711	74%	0.741	S	S	*	*			trans	-97.3	166.9	151.6	0	0	0	0	0	108.6
92	P	38.9	Very low	29.2	Very low	115 Å²	115	139.9 Å²	139.9	75%	0.747	75%	0.748	S	S	*	*				-155.9	153.6	91.9	37.7	-18.1	0	0	0	119.1
93	E	26.2	Very low	29	Very low	148 Å²	148	140.3 Å²	140.3	69%	0.692	75%	0.748	S	S	*	*			trans	64.6	159.7	138	-72.1	-163.1	151.7	0	0	125.6
94	R	29.3	Very low	29.3	Very low	202 Å²	202	137.1 Å²	137.1	76%	0.762	74%	0.744	S	S	*	*			trans	93.6	132.3	153.9	-50.6	-155.8	-179	162.8	6.3	116.9
95	N	23.7	Very low	29.7	Very low	154 Å²	154	137.9 Å²	137.9	82%	0.824	75%	0.748	S	S	*	*			cis	-144.2	174.9	3.3	-106.5	-12.9	0	0	0	112
96	A	30.6	Very low	29.9	Very low	100 Å²	100	134.5 Å²	134.5	83%	0.826	73%	0.734	S	S	*	*			trans	-146	151.7	-169.3	0	0	0	0	0	116.3
97	S	26.9	Very low	29.7	Very low	110 Å²	110	138.8 Å²	138.8	77%	0.769	74%	0.74	S	S	*	*			trans	-173.1	122.5	150.8	52.3	0	0	0	0	108.9
98	R	33.8	Very low	29.4	Very low	204 Å²	204	137 Å²	137	77%	0.77	73%	0.73	S	S	*	*				55.2	145.2	82.6	-83.4	-170.9	73.6	-137.2	1.7	114.1	L100	R98-L100 PolarHBondContact NE-O 3.45Å; R98-L100 VanDerWaalsContact NE-O 3.15Å; R98-L100 PolarHBondContact NH2-O 3.5Å
99	P	50.8	Low	30.6	Very low	117 Å²	117	133.7 Å²	133.7	76%	0.76	74%	0.735	S	S	*	*			cis	-79.6	179.7	21.4	35.4	-40.5	0	0	0	115.1
100	L	26.4	Very low	30.6	Very low	125 Å²	125	132 Å²	132	65%	0.654	74%	0.743	S	S	*	*			cis	-122.4	-91.7	7.4	-177.2	55.3	0	0	0	113.7	R98	R98-L100 PolarHBondContact NE-O 3.45Å; R98-L100 VanDerWaalsContact NE-O 3.15Å; R98-L100 PolarHBondContact NH2-O 3.5Å
101	S	29.1	Very low	30.8	Very low	101 Å²	101	135.3 Å²	135.3	71%	0.706	75%	0.748	S	S	*	*			cis	-153.3	163.1	2.1	-63.2	0	0	0	0	113.2
102	K	30.8	Very low	31	Very low	199 Å²	199	137.9 Å²	137.9	87%	0.865	75%	0.746	S	S	*	*			trans	-153.3	166.8	173.9	-78.9	-165.8	177	-174.3	0	107.5
103	V	32.3	Very low	30.6	Very low	120 Å²	120	140.9 Å²	140.9	73%	0.727	75%	0.747	S	S	*	*			cis	-150.8	161.4	-0.5	100.4	0	0	0	0	106.1
104	S	31.8	Very low	30.6	Very low	94 Å²	94	138.9 Å²	138.9	66%	0.657	76%	0.756	S	S	*	*			cis	-141.2	163.7	6.8	-122.5	0	0	0	0	108.5
105	V	31	Very low	30.7	Very low	121 Å²	121	139.3 Å²	139.3	73%	0.733	76%	0.763	S	S	*	*			cis	74.5	93.8	12.7	-167.9	0	0	0	0	115.2
106	E	25.6	Very low	30.8	Very low	126 Å²	126	137 Å²	137	59%	0.589	77%	0.765	S	S	*	*			cis	-148.4	-146	-10.5	-146.6	-162.3	109.5	0	0	109.7	S108	E106-S108 VanDerWaalsContact OE1-CB 3.22Å; E106-S108 WeakPolarHBondContact OE1-CB 3.49Å; E106-S108 PolarHBondContact OE1-N 2.92Å; E106-S108 PolarHBondContact OE1-OG 2.89Å
107	F	23.9	Very low	30.7	Very low	196 Å²	196	141.9 Å²	141.9	86%	0.86	77%	0.768	S	S	*	*			cis	-141.9	152.4	24.4	-97.6	-76	0	0	0	113.7
108	S	28.7	Very low	30.7	Very low	81 Å²	81	145.3 Å²	145.3	57%	0.566	78%	0.777	S	S	*	*			trans	-127.8	169.4	-172.6	-35.3	0	0	0	0	113	E106	E106-S108 VanDerWaalsContact OE1-CB 3.22Å; E106-S108 WeakPolarHBondContact OE1-CB 3.49Å; E106-S108 PolarHBondContact OE1-N 2.92Å; E106-S108 PolarHBondContact OE1-OG 2.89Å
109	P	46.7	Very low	30.4	Very low	135 Å²	135	138.5 Å²	138.5	88%	0.877	77%	0.77	S	S	*	*				-133.6	-166.4	95.4	42.5	-32.1	0	0	0	111.9
110	G	24.5	Very low	29.3	Very low	70 Å²	70	141.9 Å²	141.9	72%	0.722	78%	0.776	S	S	*	*			cis	-174.3	-147.4	11.4	0	0	0	0	0	114.4
111	R	29.9	Very low	29.2	Very low	238 Å²	238	144.7 Å²	144.7	90%	0.898	78%	0.782	S	S	*	*			trans	-150.3	176.5	-177.3	-73.6	-172.7	173.9	177.6	-0.3	109.7
112	E	29.3	Very low	29.1	Very low	140 Å²	140	144.4 Å²	144.4	65%	0.654	79%	0.786	S	S	*	*			cis	-152.3	-155	13.9	-146.1	-170.9	119.7	0	0	114
113	K	30.4	Very low	29	Very low	177 Å²	177	140 Å²	140	77%	0.77	79%	0.787	S	S	*	*			trans	-78.2	162.2	-171.7	-49.1	151.3	-169.6	131.2	0	114.3
114	A	27.2	Very low	28.7	Very low	107 Å²	107	137.4 Å²	137.4	88%	0.884	79%	0.785	S	S	*	*				-167.7	165.7	127.2	0	0	0	0	0	112.5
115	K	30.4	Very low	28.6	Very low	210 Å²	210	142.9 Å²	142.9	91%	0.913	80%	0.799	S	S	*	*			trans	-143.2	121.9	171.3	-174.7	177.2	-175.1	174.8	0	109.5
116	A	26.2	Very low	28.6	Very low	105 Å²	105	140.3 Å²	140.3	87%	0.868	80%	0.797	S	S	*	*			trans	-129.9	156.4	-179.7	0	0	0	0	0	111.4
117	K	29.9	Very low	28.9	Very low	203 Å²	203	143 Å²	143	88%	0.883	81%	0.81	S	S	*	*			trans	-157.7	90.5	-168.6	-173.8	-165.8	177.6	-171.2	0	113.9
118	L	25.6	Very low	29.1	Very low	183 Å²	183	144.1 Å²	144.1	96%	0.958	81%	0.809	S	S	*	*			trans	-171.4	144.8	161.4	-134	67.1	0	0	0	108.5
119	G	27.2	Very low	29.3	Very low	60 Å²	60	145.1 Å²	145.1	62%	0.619	82%	0.816	S	S	*	*			cis	169.6	158.8	-12.2	0	0	0	0	0	112.8
120	Q	29.2	Very low	28.6	Very low	189 Å²	189	146.2 Å²	146.2	88%	0.883	81%	0.807	S	S	*	*			trans	69.6	150.9	175.5	-40.6	-170.4	28.5	0	0	115.6
121	K	24.1	Very low	28.9	Very low	184 Å²	184	150.1 Å²	150.1	80%	0.8	81%	0.808	S	S	*	*			cis	-149.6	122.4	0	-160.1	167.6	177.8	179.6	0	107.5
122	A	26.7	Very low	28.8	Very low	95 Å²	95	148.9 Å²	148.9	79%	0.785	80%	0.803	S	S	*	*				44.1	138.8	97.1	0	0	0	0	0	115.6
123	A	28.4	Very low	28.8	Very low	106 Å²	106	148.8 Å²	148.8	88%	0.876	81%	0.807	S	S	*	*			cis	-153.4	-176.5	13.2	0	0	0	0	0	110.5
124	G	27.1	Very low	28.7	Very low	66 Å²	66	145.4 Å²	145.4	68%	0.68	81%	0.805	S	S	*	*			cis	167.8	-178.9	-1.5	0	0	0	0	0	113.6
125	E	29	Very low	29.9	Very low	208 Å²	208	146.6 Å²	146.6	97%	0.972	80%	0.804	S	S	*	*			trans	63.1	151.4	162.9	-54.5	-158.7	102	0	0	120.2
126	G	31.3	Very low	29.7	Very low	67 Å²	67	139.7 Å²	139.7	69%	0.691	79%	0.793	S	S	*	*			cis	172.1	175.3	-9.3	0	0	0	0	0	115.6
127	Q	32.2	Very low	29.9	Very low	184 Å²	184	142.5 Å²	142.5	86%	0.86	79%	0.792	S	S	*	*			trans	81.2	143.1	166.8	-70.6	-161.9	-146.6	0	0	121.1
128	R	28	Very low	29.8	Very low	219 Å²	219	139.8 Å²	139.8	83%	0.826	79%	0.786	S	S	*	*			cis	-163.1	152.6	-20.5	-161.5	164.4	-176.6	-119.3	14.6	113.4
129	S	31.3	Very low	29.9	Very low	102 Å²	102	135.4 Å²	135.4	71%	0.713	77%	0.771	S	S	*	*			trans	-52.6	172.8	172.5	-144.4	0	0	0	0	115.7
130	K	33.8	Very low	29.8	Very low	157 Å²	157	135.5 Å²	135.5	68%	0.683	77%	0.772	S	S	*	*				176.2	152.5	55.9	-146.8	173.7	167.5	-174.5	0	115.3
131	M	30.7	Very low	29.7	Very low	153 Å²	153	134.3 Å²	134.3	75%	0.754	77%	0.766	S	S	*	*			trans	57.3	162.8	146.4	76.5	-153.3	164.5	0	0	121.8
132	R	27.3	Very low	29.7	Very low	211 Å²	211	132.2 Å²	132.2	80%	0.796	76%	0.76	S	S	*	*			cis	-164.9	149.4	2.4	-144.2	-168.3	168.5	-164.9	-4.2	113.9
133	L	29.7	Very low	29.7	Very low	139 Å²	139	133.4 Å²	133.4	73%	0.728	76%	0.757	S	S	*	*			trans	64.6	159.3	148.3	-83.4	175.9	0	0	0	125.5
134	S	27	Very low	30.3	Very low	106 Å²	106	133.6 Å²	133.6	74%	0.741	75%	0.749	S	S	*	*			trans	-124.8	-155.7	174.6	-41.6	0	0	0	0	108.9
135	P	53.4	Low	30.4	Very low	132 Å²	132	134.8 Å²	134.8	86%	0.857	75%	0.753	S	S	*	*			cis	-136.5	-165.9	-14.2	43.4	-25.1	0	0	0	114.4
136	G	26.6	Very low	31.1	Very low	65 Å²	65	129.8 Å²	129.8	67%	0.67	74%	0.738	S	S	*	*			trans	162.2	99.1	150.7	0	0	0	0	0	120.8
137	L	29.1	Very low	31	Very low	164 Å²	164	136.8 Å²	136.8	86%	0.859	74%	0.744	S	S	*	*			trans	65.1	171	152	-52	-176.8	0	0	0	117.2
138	L	28.8	Very low	30.9	Very low	145 Å²	145	137.6 Å²	137.6	76%	0.759	74%	0.739	S	S	*	*			cis	-159.3	176	-29.7	-102.2	169.9	0	0	0	106.5
139	S	26.3	Very low	30.9	Very low	92 Å²	92	132 Å²	132	64%	0.643	73%	0.726	S	S	*	*			cis	-125.5	-128.8	4.1	-154.4	0	0	0	0	111
140	G	26.4	Very low	31.1	Very low	62 Å²	62	132.4 Å²	132.4	64%	0.639	72%	0.724	S	S	*	*			cis	86.3	149.8	4.5	0	0	0	0	0	114.9
141	Q	25.4	Very low	31.1	Very low	163 Å²	163	131.7 Å²	131.7	76%	0.762	73%	0.733	S	S	*	*			cis	-164.2	163.9	-3.2	-85.3	168.8	-94.9	0	0	106.2
142	E	24	Very low	30.9	Very low	141 Å²	141	128.2 Å²	128.2	66%	0.659	74%	0.736	S	S	*	*			cis	-160.1	171.8	-15.5	-98.8	-177	-93.5	0	0	106.6
143	V	27	Very low	31.5	Very low	119 Å²	119	127.6 Å²	127.6	72%	0.721	74%	0.739	S	S	*	*			cis	73.4	139.6	40.6	156.8	0	0	0	0	112.9
144	P	41.4	Very low	31.7	Very low	111 Å²	111	130.6 Å²	130.6	72%	0.721	75%	0.746	S	S	*	*			cis	-133.5	143.4	21.7	38.6	-19.5	0	0	0	120.5
145	A	28.8	Very low	32.1	Very low	91 Å²	91	133.7 Å²	133.7	75%	0.752	75%	0.749	S	S	*	*				73.4	169.5	127.1	0	0	0	0	0	122.3
146	P	45.2	Very low	31.7	Very low	103 Å²	103	133.2 Å²	133.2	67%	0.669	75%	0.746	S	S	*	*			cis	-145.1	-167.3	-48.6	41.8	-24.8	0	0	0	116.2
147	R	27.6	Very low	31.9	Very low	213 Å²	213	140.8 Å²	140.8	80%	0.804	75%	0.754	S	S	*	*			trans	80.4	155.9	153.2	-75.6	172.1	-172.7	-144.1	1.3	119.1
148	R	30.3	Very low	32	Very low	201 Å²	201	142.2 Å²	142.2	76%	0.758	75%	0.748	S	S	*	*			cis	-162.7	172.5	-22.4	-128.3	173.8	105.3	158.3	4.5	112.2
149	N	27.9	Very low	31.9	Very low	103 Å²	103	139.7 Å²	139.7	55%	0.551	75%	0.748	S	S	*	*			trans	-40.9	143.4	-177.7	66.8	-72	0	0	0	125.9
150	T	35.2	Very low	32	Very low	109 Å²	109	140.3 Å²	140.3	67%	0.669	74%	0.741	S	S	*	*				61.5	122.9	129	63.2	0	0	0	0	127.1
151	T	33.9	Very low	32.4	Very low	142 Å²	142	146.3 Å²	146.3	87%	0.871	74%	0.744	S	S	*	*			trans	75.2	121.9	131.4	57.1	0	0	0	0	126.9
152	G	27.4	Very low	32.7	Very low	80 Å²	80	142.9 Å²	142.9	83%	0.825	74%	0.738	S	S	*	*			trans	99	160.2	140.4	0	0	0	0	0	120
153	K	40.2	Very low	32.8	Very low	199 Å²	199	141 Å²	141	87%	0.865	74%	0.741	S	S	*	*			cis	-171.8	144.2	-23.3	-149.2	177.8	-174.7	170.4	0	112.7
154	K	33.1	Very low	32.9	Very low	202 Å²	202	140.4 Å²	140.4	88%	0.878	74%	0.742	S	S	*	*			trans	85.6	161.1	163.6	-67	-165.9	173.6	-175.2	0	122.2
155	Q	36.6	Very low	32.5	Very low	170 Å²	170	141.3 Å²	141.3	79%	0.794	75%	0.745	S	S	*	*			trans	-105.9	175.5	-170	-58	-179.2	-36.1	0	0	114.8
156	P	44.8	Very low	32.7	Very low	123 Å²	123	145.4 Å²	145.4	80%	0.799	75%	0.749	S	S	*	*				-126.2	150.5	91.5	5.6	16.8	0	0	0	114
157	R	31	Very low	32.1	Very low	224 Å²	224	148.1 Å²	148.1	85%	0.845	75%	0.753	S	S	*	*				59.2	142.2	83	-78.1	-166.5	176.4	-134.2	-2.3	116
158	R	30.2	Very low	32.2	Very low	193 Å²	193	142.6 Å²	142.6	73%	0.728	74%	0.739	S	S	*	*			cis	-88.2	-114.5	30.5	-158.6	175.9	176.1	157.9	-2.6	117.1	E160	R158-E160 IonicContact CZ-OE1 3.15Å; R158-E160 IonicContact NE-OE1 2.72Å; R158-E160 PolarHBondContact NE-OE1 3.5Å; R158-E160 IonicContact NH2-OE1 2.88Å; R158-E160 PolarHBondContact NH2-OE1 3.18Å; R158-E160 IonicContact NH2-OE2 2.85Å
159	A	27.1	Very low	32.1	Very low	92 Å²	92	140.8 Å²	140.8	76%	0.76	74%	0.739	S	S	*	*			cis	-143.3	174.2	3.3	0	0	0	0	0	111.2
160	E	28.9	Very low	32.1	Very low	106 Å²	106	141.9 Å²	141.9	50%	0.495	75%	0.745	S	S	.	*			trans	-155.7	158.7	-162.6	-79	175	-119.7	0	0	110	R158	R158-E160 IonicContact CZ-OE1 3.15Å; R158-E160 IonicContact NE-OE1 2.72Å; R158-E160 PolarHBondContact NE-OE1 3.5Å; R158-E160 IonicContact NH2-OE1 2.88Å; R158-E160 PolarHBondContact NH2-OE1 3.18Å; R158-E160 IonicContact NH2-OE2 2.85Å
161	R	34	Very low	31.8	Very low	187 Å²	187	145 Å²	145	71%	0.706	75%	0.752	S	S	*	*			cis	-169.6	171.8	-4.6	-123.4	-173	-57.2	98.9	4.7	111.7
162	S	32.9	Very low	31.5	Very low	91 Å²	91	142.9 Å²	142.9	64%	0.636	75%	0.749	S	S	*	*			trans	69.6	140.5	147.8	-68.5	0	0	0	0	120
163	S	26.1	Very low	31.3	Very low	101 Å²	101	150.1 Å²	150.1	71%	0.706	75%	0.751	S	S	*	*			cis	176.9	158.8	-11.6	42.2	0	0	0	0	109.1
164	S	27.5	Very low	30.8	Very low	107 Å²	107	145.5 Å²	145.5	75%	0.748	74%	0.744	S	S	*	*			cis	-176.7	172.5	-17.1	-82.8	0	0	0	0	108.7
165	V	33	Very low	30.4	Very low	130 Å²	130	147.3 Å²	147.3	79%	0.788	75%	0.745	S	S	*	*			trans	79.1	139.9	161.4	112.4	0	0	0	0	116.6
166	E	32.7	Very low	29.8	Very low	178 Å²	178	144.7 Å²	144.7	83%	0.832	74%	0.741	S	S	*	*			cis	-129.5	-163.7	5.5	-159.4	137.5	-110.4	0	0	112.6
167	E	33.8	Very low	28.8	Very low	159 Å²	159	144.9 Å²	144.9	74%	0.743	74%	0.736	S	S	*	*			trans	-154.3	175.7	-158.3	-159.6	-178.4	73	0	0	113.5
168	N	28.7	Very low	28.6	Very low	97 Å²	97	141.2 Å²	141.2	52%	0.519	73%	0.728	S	S	.	*			trans	92.1	148	153.9	-75.3	-59.9	0	0	0	121.5
169	Q	29.2	Very low	28.5	Very low	163 Å²	163	140.6 Å²	140.6	76%	0.762	73%	0.733	S	S	*	*			cis	-143.2	155.9	5.9	-147.9	139.3	69.5	0	0	116.6
170	N	27.7	Very low	28.4	Very low	126 Å²	126	141 Å²	141	67%	0.674	73%	0.73	S	S	*	*			trans	-40.4	151.5	175.7	-61.3	-24.7	0	0	0	117.5
171	Q	29.2	Very low	29.4	Very low	176 Å²	176	141.6 Å²	141.6	82%	0.822	74%	0.744	S	S	*	*			cis	68.7	122.4	49.9	-64.3	-168.8	24.5	0	0	116.9
172	A	26.4	Very low	29.1	Very low	96 Å²	96	137.3 Å²	137.3	79%	0.793	75%	0.748	S	S	*	*				174.5	116	128.5	0	0	0	0	0	117
173	W	24.6	Very low	28.9	Very low	232 Å²	232	137.2 Å²	137.2	88%	0.879	75%	0.752	S	S	*	*			trans	34.6	112.3	132.9	-70.7	64	0	0	0	124.8
174	S	30.4	Very low	29	Very low	103 Å²	103	142.8 Å²	142.8	72%	0.72	76%	0.758	S	S	*	*				71	121.8	117.2	-58	0	0	0	0	125.7
175	R	24.2	Very low	29	Very low	239 Å²	239	144 Å²	144	90%	0.902	75%	0.752	S	S	*	*			trans	94.8	130.9	135.7	-114.9	-172	-164.6	-141	5.2	122.7
176	T	23.6	Very low	28.9	Very low	115 Å²	115	144.2 Å²	144.2	71%	0.706	74%	0.742	S	S	*	*			trans	101.7	122	136.8	-55.9	0	0	0	0	122.2
177	N	24.1	Very low	28.5	Very low	128 Å²	128	140.9 Å²	140.9	68%	0.684	73%	0.73	S	S	*	*			trans	76.4	128.3	151.8	-120.9	22.6	0	0	0	126.1
178	Q	26.8	Very low	28.4	Very low	146 Å²	146	139.8 Å²	139.8	68%	0.682	73%	0.729	S	S	*	*			trans	-6.4	127.5	148.3	-57.2	169.2	86.4	0	0	120.7
179	H	27.1	Very low	28.5	Very low	180 Å²	180	142.4 Å²	142.4	83%	0.833	74%	0.742	S	S	*	*				178.9	158.4	106.4	-114.2	-94.1	0	0	0	114.2
180	S	26.1	Very low	29.5	Very low	100 Å²	100	139.8 Å²	139.8	70%	0.699	74%	0.739	S	S	*	*			trans	-107.8	178.8	163.7	-48.4	0	0	0	0	109.2
181	P	49.1	Very low	30.6	Very low	120 Å²	120	139.4 Å²	139.4	78%	0.779	74%	0.744	S	S	*	*			cis	-150	-170.3	11.5	44.9	-23.8	0	0	0	118.6
182	A	28.5	Very low	31.8	Very low	97 Å²	97	136 Å²	136	80%	0.802	74%	0.737	S	S	*	*			trans	83.2	170.3	139.3	0	0	0	0	0	123.1
183	A	27.6	Very low	32.5	Very low	88 Å²	88	137.3 Å²	137.3	73%	0.727	74%	0.737	S	S	*	*			trans	82.8	117.6	-178.2	0	0	0	0	0	116.1
184	R	28	Very low	33	Very low	219 Å²	219	133.6 Å²	133.6	83%	0.826	73%	0.733	S	S	*	*				79.7	143.1	60.8	-66.5	-88.1	-173.1	-154.5	-2.3	111.1
185	E	29	Very low	32.8	Very low	132 Å²	132	135.9 Å²	135.9	62%	0.617	73%	0.733	S	S	*	*			cis	-163.2	172.9	-4.5	-82.9	-103.8	133.3	0	0	106.6
186	K	29.8	Very low	33.3	Very low	135 Å²	135	131.7 Å²	131.7	59%	0.587	72%	0.723	S	S	*	*			cis	178	159.7	-26.3	-176.1	-166.9	157.5	-120.5	0	106.7
187	D	25.6	Very low	33.5	Very low	108 Å²	108	133.7 Å²	133.7	58%	0.578	73%	0.725	S	S	*	*			trans	65	163.2	168.2	-55.7	-39.5	0	0	0	118.8
188	L	30.4	Very low	33.5	Very low	135 Å²	135	134.2 Å²	134.2	71%	0.707	73%	0.727	S	S	*	*			cis	-163.7	126	-38.4	-99.3	172.1	0	0	0	111
189	L	31.6	Very low	35	Very low	152 Å²	152	132.3 Å²	132.3	80%	0.796	73%	0.728	S	S	*	*			trans	66.6	-168.9	149.6	-58.8	174.7	0	0	0	119.6
190	P	49.3	Very low	35.9	Very low	108 Å²	108	130.1 Å²	130.1	70%	0.701	73%	0.729	S	S	*	*				-136.4	-154.1	-80.4	45.5	-29	0	0	0	114.5
191	P	50.9	Low	36.3	Very low	119 Å²	119	136.6 Å²	136.6	77%	0.773	74%	0.738	S	S	*	*			cis	-120	-113.8	-45	23.5	2.1	0	0	0	116.3
192	P	54.2	Low	36	Very low	105 Å²	105	137 Å²	137	68%	0.682	74%	0.741	S	S	*	*				-122.9	178.8	-124.5	44.7	-26.1	0	0	0	116.2
193	P	42.5	Very low	36.2	Very low	123 Å²	123	144.3 Å²	144.3	80%	0.799	75%	0.748	S	S	*	*				-152.3	-147.8	84	37.5	-13.9	0	0	0	114.2
194	L	34	Very low	36.2	Very low	153 Å²	153	143.5 Å²	143.5	80%	0.801	75%	0.748	S	S	*	*				-155.1	165.7	-96.2	-106.7	167.7	0	0	0	112.1
195	E	27	Very low	36.2	Very low	152 Å²	152	142.9 Å²	142.9	71%	0.71	75%	0.752	S	S	*	*			trans	77.8	109.2	152.5	-59	-103.1	95.9	0	0	125.3
196	H	33.4	Very low	37.1	Very low	151 Å²	151	141.7 Å²	141.7	70%	0.699	76%	0.755	S	S	*	*				58.9	125.6	120.8	-69.4	122.1	0	0	0	129.8
197	Q	27.6	Very low	37.2	Very low	157 Å²	157	143 Å²	143	73%	0.734	77%	0.768	S	S	*	*				85.9	114.4	127.9	-75.3	-157.3	82.8	0	0	128.4
198	N	24.4	Very low	37.4	Very low	138 Å²	138	143.4 Å²	143.4	74%	0.738	78%	0.779	S	S	*	*				79.4	164.2	126.9	-81.6	-39.1	0	0	0	125.4
199	P	59.8	Low	37.2	Very low	107 Å²	107	140.3 Å²	140.3	70%	0.695	78%	0.78	S	S	*	*			trans	-125.8	-174.3	-150.3	47	-36.1	0	0	0	117.9
200	P	45.9	Very low	37.3	Very low	133 Å²	133	142.7 Å²	142.7	86%	0.864	78%	0.784	S	S	*	*				-152	-166.9	129	39.1	-20.1	0	0	0	118.5
201	R	34.3	Very low	36.4	Very low	236 Å²	236	144.9 Å²	144.9	89%	0.891	80%	0.796	S	S	*	*			trans	-118.8	161.3	-176.3	-120.4	-174.9	-171.7	-164.1	4.4	111.5
202	P	42.7	Very low	35.4	Very low	128 Å²	128	143.6 Å²	143.6	83%	0.831	80%	0.795	S	S	*	*				-159.1	-142.5	82.8	41.1	-17.6	0	0	0	114.6
203	R	31.1	Very low	34.9	Very low	251 Å²	251	144.8 Å²	144.8	95%	0.947	80%	0.803	S	S	*	*				-164.6	140.3	-84.8	176.2	-171.4	179.9	-176	0.5	109.5
204	G	28.3	Very low	34.2	Very low	72 Å²	72	149.6 Å²	149.6	74%	0.742	81%	0.805	S	S	*	*			trans	174.2	154.8	170.7	0	0	0	0	0	118
205	K	28.3	Very low	33.9	Very low	206 Å²	206	151.6 Å²	151.6	90%	0.896	81%	0.807	S	S	*	*			trans	-178.1	-177.3	176.2	-86.6	-123	176.8	-173.3	0	109.5
206	P	48.2	Very low	34.1	Very low	107 Å²	107	151.2 Å²	151.2	70%	0.695	81%	0.805	S	S	*	*			cis	-143.9	-140.7	15.4	38.6	-11.3	0	0	0	116.1
207	L	31.3	Very low	34.3	Very low	161 Å²	161	150.1 Å²	150.1	84%	0.843	81%	0.812	S	S	*	*			trans	83.1	155.3	167.1	-59.7	164.3	0	0	0	119.7
208	S	29.9	Very low	34.5	Very low	117 Å²	117	153 Å²	153	82%	0.818	82%	0.816	S	S	*	*			cis	-173	154.7	-29.1	-170.6	0	0	0	0	112.6
209	G	27.1	Very low	34.5	Very low	70 Å²	70	152.4 Å²	152.4	72%	0.722	82%	0.822	S	S	*	*			trans	175.7	158.9	173.4	0	0	0	0	0	116.9
210	K	34	Very low	32.9	Very low	203 Å²	203	151.5 Å²	151.5	88%	0.883	82%	0.823	S	S	*	*			trans	-155.7	155.7	-175.1	-62.2	179	179.8	176.3	0	114.5
211	T	29.8	Very low	31.9	Very low	154 Å²	154	151.8 Å²	151.8	95%	0.945	82%	0.823	S	S	*	*				174.9	172.7	126.2	33.1	0	0	0	0	114
212	A	29.5	Very low	31.4	Very low	92 Å²	92	145.6 Å²	145.6	76%	0.76	82%	0.816	S	S	*	*			trans	-152.6	171.4	-177.5	0	0	0	0	0	112.5
213	P	44.4	Very low	30.7	Very low	130 Å²	130	147.1 Å²	147.1	84%	0.844	82%	0.816	S	S	*	*				-158.4	125.1	122.9	36	-14.7	0	0	0	120.8
214	R	28	Very low	30.6	Very low	224 Å²	224	141.7 Å²	141.7	85%	0.845	81%	0.806	S	S	*	*				30.4	127.2	127.5	-166.6	-166	-177.1	178.8	3.4	124.6
215	K	27.3	Very low	30.6	Very low	195 Å²	195	147.9 Å²	147.9	85%	0.848	81%	0.813	S	S	*	*				-178.5	171.6	117.1	-100.7	-174.1	180	-177.8	0	116.3
216	E	30.5	Very low	30.7	Very low	144 Å²	144	144.5 Å²	144.5	67%	0.673	80%	0.804	S	S	*	*			trans	-110.5	174.5	-166	-109	-179.8	142.8	0	0	112.9	R218	E216-R218 IonicContact OE1-CZ 3.95Å; E216-R218 IonicContact OE1-NE 3.58Å; E216-R218 IonicContact OE1-NH2 3.23Å; E216-R218 PolarHBondContact OE1-NH2 2.89Å
217	P	38.1	Very low	29.8	Very low	128 Å²	128	149.2 Å²	149.2	83%	0.831	81%	0.814	S	S	*	*				-150.3	-153.6	52.1	42.9	-18.7	0	0	0	118.1
218	R	30.7	Very low	29.8	Very low	218 Å²	218	150.8 Å²	150.8	82%	0.823	81%	0.808	S	S	*	*			trans	-128.2	165.7	-160.7	-50.4	176.6	-170.3	172.2	1.5	116.6	E216	E216-R218 IonicContact OE1-CZ 3.95Å; E216-R218 IonicContact OE1-NE 3.58Å; E216-R218 IonicContact OE1-NH2 3.23Å; E216-R218 PolarHBondContact OE1-NH2 2.89Å
219	S	24.6	Very low	29.8	Very low	125 Å²	125	152.4 Å²	152.4	87%	0.874	80%	0.801	S	S	*	*			trans	-152.2	172.4	171.2	61.4	0	0	0	0	113.4
220	A	26.1	Very low	30	Very low	87 Å²	87	156.8 Å²	156.8	72%	0.719	80%	0.802	S	S	*	*			trans	-164.7	174.2	-175	0	0	0	0	0	117.8
221	T	25.8	Very low	29.8	Very low	140 Å²	140	158.7 Å²	158.7	86%	0.859	80%	0.804	S	S	*	*			trans	69.2	133.7	157	47.6	0	0	0	0	123.9
222	S	24.5	Very low	29.8	Very low	106 Å²	106	154.4 Å²	154.4	74%	0.741	79%	0.79	S	S	*	*				143.3	119.4	122.2	-171.2	0	0	0	0	120.2
223	L	27.2	Very low	30.3	Very low	159 Å²	159	156.1 Å²	156.1	83%	0.832	79%	0.793	S	S	*	*			trans	52.9	107.8	140.4	-66.2	168	0	0	0	127.2
224	D	28.5	Very low	29.4	Very low	137 Å²	137	155 Å²	155	73%	0.733	79%	0.789	S	S	*	*				27.4	132	113.9	-153.4	-90.1	0	0	0	124.9
225	K	28.1	Very low	29.5	Very low	203 Å²	203	151.1 Å²	151.1	88%	0.883	79%	0.79	S	S	*	*				-179.9	153.2	124.6	-99.1	159.4	-171.9	162.6	0	118.3
226	D	31.6	Very low	29.5	Very low	134 Å²	134	151 Å²	151	72%	0.717	79%	0.79	S	S	*	*			trans	-116.7	155.7	-178.2	168.6	27.1	0	0	0	112.9	R228	D226-R228 PolarHBondContact OD1-N 3.11Å
227	K	29.4	Very low	29.6	Very low	206 Å²	206	151.7 Å²	151.7	90%	0.896	80%	0.796	S	S	*	*			trans	-169.2	68.3	160.9	-110.6	162.4	-172.6	-178.6	0	119.1
228	R	31.5	Very low	29.5	Very low	194 Å²	194	151.6 Å²	151.6	73%	0.732	79%	0.794	S	S	*	*				17.1	124.3	128.8	-155.6	-163.3	179.6	178.5	3.5	121.8	D226	D226-R228 PolarHBondContact OD1-N 3.11Å
229	K	30.2	Very low	29.6	Very low	151 Å²	151	146.9 Å²	146.9	66%	0.657	79%	0.791	S	S	*	*				148.6	117.1	121.7	-81.9	-166.5	172.2	-177.1	0	120.1
230	H	30.3	Very low	29.8	Very low	163 Å²	163	150.2 Å²	150.2	76%	0.755	79%	0.79	S	S	*	*			trans	56.1	163.7	144	-52.4	-60.4	0	0	0	121
231	R	30.5	Very low	30.2	Very low	243 Å²	243	150.9 Å²	150.9	92%	0.917	79%	0.79	S	S	*	*			cis	-154.2	154	17.2	-154.3	176.9	-166.9	168.1	0.8	111
232	G	29.7	Very low	30.4	Very low	64 Å²	64	153.2 Å²	153.2	66%	0.66	78%	0.783	S	S	*	*			trans	-89.2	-167.6	171.6	0	0	0	0	0	113.9
233	P	38.8	Very low	30.8	Very low	127 Å²	127	154.2 Å²	154.2	83%	0.825	78%	0.775	S	S	*	*			cis	-149.1	163.6	36.3	43	-23	0	0	0	120.5
234	S	25.6	Very low	30.9	Very low	108 Å²	108	154 Å²	154	76%	0.755	77%	0.768	S	S	*	*			trans	18.3	135.6	141.3	-168.6	0	0	0	0	123.6
235	T	30	Very low	31.1	Very low	142 Å²	142	153.9 Å²	153.9	87%	0.871	77%	0.766	S	S	*	*				-159.7	177.7	125.8	2.3	0	0	0	0	114.2
236	K	28.8	Very low	31.1	Very low	191 Å²	191	151.6 Å²	151.6	83%	0.83	76%	0.758	S	S	*	*			trans	-83.2	-172.5	-174.3	-61.2	173.7	-177.3	174.6	0	111.4
237	I	32.3	Very low	31.2	Very low	159 Å²	159	150.7 Å²	150.7	82%	0.815	76%	0.758	S	S	*	*			cis	-155.2	162.2	24.2	-41.1	158.1	0	0	0	111.2
238	T	36.1	Very low	31.1	Very low	126 Å²	126	147.3 Å²	147.3	77%	0.773	75%	0.75	S	S	*	*			trans	-68.4	156	172.1	-22.9	0	0	0	0	115.4
239	P	33	Very low	31.1	Very low	119 Å²	119	142.7 Å²	142.7	77%	0.773	75%	0.747	S	S	*	*			trans	-109.2	159.1	151.2	36.7	-29.7	0	0	0	113.4
240	K	27.8	Very low	31.1	Very low	196 Å²	196	140.7 Å²	140.7	85%	0.852	75%	0.752	S	S	*	*			trans	-116.1	160.8	174	-96.8	-176.2	175.5	-179.4	0	110.7
241	S	33.6	Very low	30.9	Very low	101 Å²	101	138.8 Å²	138.8	71%	0.706	76%	0.757	S	S	*	*			trans	-10.8	147.4	154.8	57	0	0	0	0	116.8
242	R	32	Very low	30.8	Very low	189 Å²	189	133 Å²	133	71%	0.713	75%	0.754	S	S	*	*				-178.4	136.5	68.6	-178.3	167.6	-169.8	-172.4	-5.3	113.8
243	E	31.7	Very low	30.9	Very low	126 Å²	126	135.1 Å²	135.1	59%	0.589	76%	0.759	S	S	*	*			trans	37.8	167.2	150.7	-60.1	142.7	-133.4	0	0	120.1
244	F	29.3	Very low	30.4	Very low	156 Å²	156	134.6 Å²	134.6	68%	0.684	76%	0.758	S	S	*	*			cis	-167.9	154	30.3	-139.6	-65.8	0	0	0	111.5
245	I	33	Very low	30.6	Very low	133 Å²	133	138.2 Å²	138.2	68%	0.682	76%	0.763	S	S	*	*			trans	59.1	158.3	165.4	36.9	-177.1	0	0	0	118.8
246	E	27.5	Very low	30.6	Very low	155 Å²	155	137.8 Å²	137.8	72%	0.724	77%	0.765	S	S	*	*			cis	-149.6	154.1	13	-134	163.9	-126	0	0	113.9
247	T	34.2	Very low	30.5	Very low	115 Å²	115	138 Å²	138	71%	0.706	77%	0.768	S	S	*	*			trans	61.8	142	151.7	-34.3	0	0	0	0	124.8
248	D	28	Very low	30.5	Very low	136 Å²	136	135.3 Å²	135.3	73%	0.727	76%	0.764	S	S	*	*			trans	74	108	154.2	-96.7	-46.6	0	0	0	125.6
249	S	30.7	Very low	30.2	Very low	96 Å²	96	137 Å²	137	67%	0.671	77%	0.768	S	S	*	*				39.9	131.1	123.4	-51.9	0	0	0	0	124.7
250	S	30.3	Very low	30.1	Very low	110 Å²	110	134.2 Å²	134.2	77%	0.769	76%	0.761	S	S	*	*			trans	85.5	103.3	144.1	-59.8	0	0	0	0	121.2
251	S	27	Very low	30.2	Very low	122 Å²	122	133.9 Å²	133.9	85%	0.853	76%	0.762	S	S	*	*				33.4	114.4	126.6	-55.3	0	0	0	0	121
252	S	27.6	Very low	30.1	Very low	122 Å²	122	137.2 Å²	137.2	85%	0.853	77%	0.767	S	S	*	*				-172.9	-178.2	101.4	-154.7	0	0	0	0	112.8
253	S	31.1	Very low	30	Very low	109 Å²	109	132.1 Å²	132.1	76%	0.762	77%	0.765	S	S	*	*			trans	-82.7	146.2	-177.1	54	0	0	0	0	115.3
254	S	28.8	Very low	30	Very low	116 Å²	116	132.7 Å²	132.7	81%	0.811	78%	0.778	S	S	*	*			trans	-159	156	137.4	-160.3	0	0	0	0	111.8
255	E	30.3	Very low	30	Very low	183 Å²	183	134.6 Å²	134.6	86%	0.855	79%	0.785	S	S	*	*			trans	-104.8	141.2	159.8	-61.7	-171.8	113.5	0	0	108.3
256	C	29.5	Very low	29.8	Very low	134 Å²	134	135.6 Å²	135.6	91%	0.905	79%	0.791	S	S	*	*			trans	-170.2	-177.2	162	-105.4	0	0	0	0	112.7
257	Q	27.3	Very low	30.3	Very low	195 Å²	195	133.7 Å²	133.7	91%	0.911	79%	0.792	S	S	*	*			trans	-107.7	-157	-161.3	-60.5	179.1	-7.9	0	0	114.4
258	S	32.7	Very low	29.8	Very low	102 Å²	102	133 Å²	133	71%	0.713	79%	0.792	S	S	*	*			trans	-96.7	171.5	-151.3	-44.9	0	0	0	0	118.4
259	D	29.6	Very low	29.7	Very low	162 Å²	162	134.5 Å²	134.5	87%	0.866	80%	0.796	S	S	*	*			trans	83.1	144	146.3	-66.4	-52.2	0	0	0	122.4
260	G	30.5	Very low	29.8	Very low	61 Å²	61	135.5 Å²	135.5	63%	0.629	80%	0.8	S	S	*	*			trans	84.9	157.7	166.2	0	0	0	0	0	118.5
261	E	30.2	Very low	29.6	Very low	188 Å²	188	134.3 Å²	134.3	88%	0.879	80%	0.798	S	S	*	*			cis	-164.4	171.4	-49.2	50.5	-163.5	98.3	0	0	112.2
262	E	31.8	Very low	29.9	Very low	172 Å²	172	134 Å²	134	80%	0.804	79%	0.793	S	S	*	*			trans	53.7	96.6	161.3	-157.1	163.7	149.6	0	0	124.8
263	A	29.9	Very low	29.7	Very low	82 Å²	82	133.4 Å²	133.4	68%	0.678	79%	0.789	S	S	*	*				56.7	171	121.4	0	0	0	0	0	126.3
264	T	30.7	Very low	29.6	Very low	138 Å²	138	135.7 Å²	135.7	85%	0.847	79%	0.79	S	S	*	*			trans	79.3	140.7	172.4	74	0	0	0	0	117.6
265	K	28.4	Very low	29.5	Very low	195 Å²	195	135.2 Å²	135.2	85%	0.848	79%	0.787	S	S	*	*			cis	-160.6	142	-14	179	175.2	179.8	-178.7	0	112.1
266	I	29.6	Very low	29.4	Very low	155 Å²	155	130.6 Å²	130.6	80%	0.795	78%	0.78	S	S	*	*			trans	-49.8	165.8	169.3	32.7	169	0	0	0	115.8
267	P	37.9	Very low	29.3	Very low	114 Å²	114	132.3 Å²	132.3	74%	0.74	78%	0.775	S	S	*	*			cis	-150.1	179.2	26.8	45	-24.9	0	0	0	120.9
268	S	25	Very low	29.3	Very low	102 Å²	102	130.1 Å²	130.1	71%	0.713	77%	0.767	S	S	*	*			trans	81	105	139.4	-166.3	0	0	0	0	124.5
269	M	25.1	Very low	28.9	Very low	167 Å²	167	132.4 Å²	132.4	82%	0.823	77%	0.77	S	S	*	*				34.9	155.5	108.1	-54.5	-70	-83.9	0	0	121.7
270	P	32.3	Very low	28.7	Very low	116 Å²	116	128.8 Å²	128.8	75%	0.753	76%	0.763	S	S	*	*			cis	-133.1	-173.8	6.2	41.5	-23.6	0	0	0	116.2
271	A	26.3	Very low	28.5	Very low	86 Å²	86	132.2 Å²	132.2	71%	0.711	77%	0.771	S	S	*	*			trans	-103.5	169.5	173.3	0	0	0	0	0	113.5
272	P	33	Very low	28.5	Very low	115 Å²	115	129 Å²	129	75%	0.747	76%	0.764	S	S	*	*				-127.2	152.6	107.6	4.4	18.1	0	0	0	112.5
273	S	24.6	Very low	28.1	Very low	110 Å²	110	129.7 Å²	129.7	77%	0.769	77%	0.767	S	S	*	*				56.4	138.3	77	-51.8	0	0	0	0	113.4
274	I	28.7	Very low	27.9	Very low	156 Å²	156	130.4 Å²	130.4	80%	0.8	77%	0.767	S	S	*	*			cis	-157.5	153.5	49.7	-66.4	158.4	0	0	0	112
275	S	26.3	Very low	27.7	Very low	107 Å²	107	130.7 Å²	130.7	75%	0.748	76%	0.764	S	S	*	*			trans	37.9	113.5	156.9	-59.7	0	0	0	0	125.4
276	A	27.5	Very low	27.5	Very low	86 Å²	86	124.9 Å²	124.9	71%	0.711	76%	0.759	S	S	*	*				67.2	131.6	106.2	0	0	0	0	0	125.1
277	Q	27	Very low	27.5	Very low	169 Å²	169	124.3 Å²	124.3	79%	0.79	76%	0.758	S	S	*	*			trans	91	124.3	132.3	-88.3	-179.1	25.2	0	0	123.1
278	M	27.3	Very low	27	Very low	149 Å²	149	126.8 Å²	126.8	73%	0.734	76%	0.764	S	S	*	*			trans	65.2	147.2	152.7	-54.1	-44.4	-172.9	0	0	119.1
279	L	26	Very low	27.3	Very low	150 Å²	150	129.9 Å²	129.9	79%	0.785	77%	0.771	S	S	*	*			cis	-161.7	166.3	-29.7	-124.8	175.7	0	0	0	108.8
280	A	25	Very low	27.3	Very low	86 Å²	86	127.5 Å²	127.5	71%	0.711	77%	0.771	S	S	*	*			trans	62.2	113.1	164	0	0	0	0	0	119.4
281	T	26.3	Very low	27.1	Very low	133 Å²	133	129.7 Å²	129.7	82%	0.816	78%	0.775	S	S	*	*			trans	-151.8	126.8	147.4	-75.4	0	0	0	0	110.1
282	V	29.2	Very low	27.1	Very low	120 Å²	120	128.8 Å²	128.8	73%	0.727	77%	0.774	S	S	*	*			trans	14.8	118.3	157.8	-174.1	0	0	0	0	118.6
283	H	23.5	Very low	26.8	Very low	188 Å²	188	130.7 Å²	130.7	87%	0.87	78%	0.778	S	S	*	*			trans	-80.4	148	156.2	-73.8	177.9	0	0	0	111.3
284	S	26	Very low	27.1	Very low	96 Å²	96	133.8 Å²	133.8	67%	0.671	78%	0.784	S	S	*	*			trans	-145.9	111	165.2	-80.2	0	0	0	0	112.7
285	N	26.3	Very low	26.9	Very low	145 Å²	145	132.5 Å²	132.5	78%	0.775	79%	0.789	S	S	*	*			trans	52.7	100.5	140.2	-56.7	-15.6	0	0	0	119.6
286	G	25.2	Very low	26.9	Very low	73 Å²	73	132 Å²	132	75%	0.753	79%	0.791	S	S	*	*			trans	-126.8	63.4	154.8	0	0	0	0	0	110.6	L288	G286-L288 PolarHBondContact O-N 2.88Å
287	N	29.1	Very low	26.8	Very low	143 Å²	143	133.5 Å²	133.5	77%	0.765	80%	0.796	S	S	*	*			trans	-70	128.4	-174	-93	0.2	0	0	0	112.6
288	L	28.4	Very low	26.9	Very low	165 Å²	165	133.1 Å²	133.1	86%	0.864	79%	0.792	S	S	*	*			trans	-74.3	132.9	165.4	-64.3	92.4	0	0	0	109.4	G286	G286-L288 PolarHBondContact O-N 2.88Å
289	L	29.9	Very low	26.9	Very low	167 Å²	167	129.6 Å²	129.6	87%	0.874	79%	0.794	S	S	*	*			trans	-93.2	113.6	169.4	-68.7	179.2	0	0	0	110.3
290	S	25.6	Very low	27.1	Very low	117 Å²	117	129.7 Å²	129.7	82%	0.818	80%	0.795	S	S	*	*			trans	-69.8	139.3	175.5	-64.2	0	0	0	0	111.7	G292	S290-G292 PolarHBondContact O-N 3.41Å
291	I	27.4	Very low	27.2	Very low	162 Å²	162	131.3 Å²	131.3	83%	0.831	80%	0.801	S	S	*	*			trans	-80.3	113.4	168.5	-61.9	174.5	0	0	0	108
292	G	26.6	Very low	27.4	Very low	67 Å²	67	131.1 Å²	131.1	69%	0.691	80%	0.8	S	S	*	*			trans	-79.1	127.8	173.5	0	0	0	0	0	111.7	S290	S290-G292 PolarHBondContact O-N 3.41Å
293	N	27	Very low	27.7	Very low	156 Å²	156	131.5 Å²	131.5	83%	0.834	81%	0.805	S	S	*	*			trans	-80.6	135.6	165.6	-74.4	2.5	0	0	0	109.3
294	I	31.1	Very low	27.9	Very low	175 Å²	175	129.6 Å²	129.6	90%	0.897	80%	0.801	S	S	*	*			trans	-119.6	126.9	160.1	47.5	173	0	0	0	109.2
295	S	23.6	Very low	28.4	Very low	129 Å²	129	130.4 Å²	130.4	90%	0.902	80%	0.804	S	S	*	*			trans	-123.8	115.3	173.3	177.2	0	0	0	0	106.8
296	A	26.5	Very low	28.5	Very low	95 Å²	95	127.2 Å²	127.2	79%	0.785	81%	0.805	S	S	*	*			trans	-124.1	134.1	178.2	0	0	0	0	0	109.2
297	S	26.9	Very low	28.7	Very low	118 Å²	118	126.6 Å²	126.6	83%	0.825	80%	0.799	S	S	*	*			trans	-99.9	163.4	171.3	-165.8	0	0	0	0	110.1
298	F	27.5	Very low	28.7	Very low	162 Å²	162	127.2 Å²	127.2	71%	0.711	80%	0.797	S	S	*	*			trans	-84.8	151.9	-173.8	-68	-99.5	0	0	0	113.1	H698	F298-H698 AromaticContact CE1-CE1 3.78Å; F298-H698 AromaticContact CE1-NE2 3.47Å; F298-H698 WeakPolarHBondContact CE1-NE2 3.07Å; F298-H698 AromaticContact CZ-NE2 3.85Å
299	G	27.7	Very low	28.8	Very low	75 Å²	75	122.7 Å²	122.7	77%	0.773	79%	0.79	S	S	*	*			trans	-162.6	139.5	167.8	0	0	0	0	0	108.8
300	N	29.6	Very low	28.9	Very low	151 Å²	151	123.8 Å²	123.8	81%	0.807	79%	0.788	S	S	*	*			trans	-110.4	163.7	-169.5	-88	16.1	0	0	0	113.4
301	S	28.9	Very low	29.1	Very low	120 Å²	120	125.5 Å²	125.5	84%	0.839	79%	0.788	S	S	*	*			trans	85.5	146.5	156.4	-56.5	0	0	0	0	118.7
302	V	30.3	Very low	29.2	Very low	129 Å²	129	122.8 Å²	122.8	78%	0.782	79%	0.79	S	S	*	*			trans	-145.7	137.6	-176.3	169.1	0	0	0	0	106.1
303	P	34.9	Very low	29.4	Very low	129 Å²	129	127.4 Å²	127.4	84%	0.838	79%	0.793	S	S	*	*				-121.9	164.9	112.7	-5.6	26.3	0	0	0	115.3
304	D	26.8	Very low	30	Very low	147 Å²	147	125.3 Å²	125.3	79%	0.786	79%	0.788	S	S	*	*			trans	-70.3	175.3	171.6	-134.6	30.6	0	0	0	112.1
305	P	36.9	Very low	29.8	Very low	114 Å²	114	120.2 Å²	120.2	74%	0.74	77%	0.773	S	S	*	*			cis	-134.6	-177.5	10.5	40.4	-20.5	0	0	0	116.9
306	G	28.8	Very low	30.3	Very low	77 Å²	77	119.2 Å²	119.2	79%	0.794	77%	0.766	S	S	*	*			trans	-92.9	-171.3	174.6	0	0	0	0	0	114.8
307	G	29.6	Very low	31.2	Very low	60 Å²	60	120.5 Å²	120.5	62%	0.619	77%	0.766	S	S	*	*			cis	172.3	177.1	-0.4	0	0	0	0	0	112.9
308	Q	29.4	Very low	32.2	Very low	156 Å²	156	120.4 Å²	120.4	73%	0.729	76%	0.762	S	S	*	*			trans	67.7	152.6	-173.5	-54	-168.7	93	0	0	115.7	S26	S26-Q308 PolarHBondContact O-NE2 2.85Å
309	G	29.8	Very low	32.4	Very low	70 Å²	70	118.5 Å²	118.5	72%	0.722	77%	0.769	S	S	*	*			cis	176.7	144.8	-11.8	0	0	0	0	0	115.4
310	K	32.3	Very low	32.4	Very low	191 Å²	191	121.8 Å²	121.8	83%	0.83	77%	0.769	S	S	*	*			trans	56.4	117.4	156.7	-63.9	-176.5	-178.9	170.1	0	123
311	D	29.5	Very low	32.6	Very low	152 Å²	152	120.7 Å²	120.7	81%	0.813	77%	0.767	S	S	*	*				53.1	110.2	121.9	-45.7	-37.4	0	0	0	122.5
312	A	28.9	Very low	32.7	Very low	105 Å²	105	118.2 Å²	118.2	87%	0.868	76%	0.761	S	S	*	*			trans	-159.1	111.1	143.2	0	0	0	0	0	113.2
313	E	31.5	Very low	33	Very low	164 Å²	164	120.6 Å²	120.6	77%	0.766	76%	0.764	S	S	*	*			trans	-82.2	163.2	149.2	-124.1	-123.2	119.5	0	0	107.5	A315	E313-A315 PolarHBondContact OE1-N 3.39Å
314	P	40	Very low	32.8	Very low	112 Å²	112	121.8 Å²	121.8	73%	0.727	76%	0.763	S	S	*	*			cis	-152.9	173.2	47.7	43.2	-21.9	0	0	0	120.8
315	A	26.5	Very low	33.1	Very low	69 Å²	69	120.5 Å²	120.5	57%	0.57	76%	0.76	S	S	*	*			trans	88.1	104.2	140.9	0	0	0	0	0	120.8	E313	E313-A315 PolarHBondContact OE1-N 3.39Å
316	S	33.7	Very low	32.7	Very low	108 Å²	108	119.2 Å²	119.2	76%	0.755	76%	0.759	S	S	*	*				32.4	144.7	106.5	-57.7	0	0	0	0	119.8
317	P	45.6	Very low	33	Very low	122 Å²	122	123.7 Å²	123.7	79%	0.792	76%	0.764	S	S	*	*				-150.2	-146.8	59.9	39.1	-13.3	0	0	0	114.9
318	P	47.7	Very low	33.1	Very low	115 Å²	115	126.7 Å²	126.7	75%	0.747	78%	0.776	S	S	*	*				-133.7	167.8	-93.6	42.6	-26	0	0	0	116.4
319	S	32.8	Very low	33.4	Very low	122 Å²	122	125.1 Å²	125.1	85%	0.853	78%	0.779	S	S	*	*			trans	178.4	170.6	142.2	40.4	0	0	0	0	112.6
320	N	27.6	Very low	33.7	Very low	145 Å²	145	129.9 Å²	129.9	78%	0.775	79%	0.787	S	S	*	*				-166.6	136.3	-73.6	-177.8	32	0	0	0	109.5
321	V	32.6	Very low	33.8	Very low	127 Å²	127	130.9 Å²	130.9	77%	0.77	79%	0.785	S	S	*	*			trans	62.2	133.1	171.3	167	0	0	0	0	118
322	G	30.9	Very low	33.8	Very low	69 Å²	69	129.5 Å²	129.5	71%	0.711	78%	0.778	S	S	*	*			trans	176.2	21.7	177.1	0	0	0	0	0	122.4
323	H	37.1	Very low	33.8	Very low	179 Å²	179	135.9 Å²	135.9	83%	0.829	78%	0.781	S	S	*	*			trans	58.6	85.2	165.8	-63.1	-75.9	0	0	0	121.4
324	D	30.9	Very low	34	Very low	154 Å²	154	135.4 Å²	135.4	82%	0.824	78%	0.779	S	S	*	*				56.4	152	112.3	-128.1	-23.6	0	0	0	125.7
325	V	33.5	Very low	33.8	Very low	119 Å²	119	138 Å²	138	72%	0.721	78%	0.781	S	S	*	*			trans	64.4	83.7	161.9	-164.8	0	0	0	0	121.3
326	A	28.8	Very low	34.5	Very low	88 Å²	88	140.8 Å²	140.8	73%	0.727	79%	0.791	S	S	*	*				69.5	148.5	115.2	0	0	0	0	0	125.2
327	L	34.4	Very low	34.8	Very low	170 Å²	170	143.1 Å²	143.1	89%	0.89	79%	0.79	S	S	*	*			trans	66.3	89.5	161.9	-59.8	179.7	0	0	0	119.3
328	S	31.3	Very low	34.6	Very low	124 Å²	124	141.5 Å²	141.5	87%	0.867	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-76.3	134.6	159.8	-55.5	0	0	0	0	112
329	P	35.2	Very low	34.6	Very low	122 Å²	122	143.5 Å²	143.5	79%	0.792	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-80.7	165.7	-178	-13.9	30.3	0	0	0	115
330	L	37.4	Very low	35.2	Very low	171 Å²	171	149.2 Å²	149.2	90%	0.895	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-58.5	139.6	160.3	-88.7	69	0	0	0	110.7
331	R	34.6	Very low	36.5	Very low	211 Å²	211	148.1 Å²	148.1	80%	0.796	79%	0.786	S	S	*	*			trans	-138.8	119.2	155.4	-86.5	-165.2	167.5	-101	10.2	112.1
332	D	29.1	Very low	36.9	Very low	123 Å²	123	150.1 Å²	150.1	66%	0.658	79%	0.785	S	S	*	*				46.3	91.5	125.1	-41.2	-33.3	0	0	0	117.4	H334	D332-H334 PolarHBondContact O-N 3.05Å
333	Y	28.5	Very low	38.4	Very low	240 Å²	240	153.4 Å²	153.4	94%	0.941	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-67.8	116.8	158.2	-105.9	-96.9	0	0	0	109.6
334	H	35.4	Very low	39.2	Very low	154 Å²	154	148.4 Å²	148.4	71%	0.713	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-64	137.1	178.8	-165.8	-71.5	0	0	0	111.3	D332 V336	D332-H334 PolarHBondContact O-N 3.05Å; H334-V336 PolarHBondContact O-N 3.23Å
335	E	35.9	Very low	40.3	Very low	165 Å²	165	147.6 Å²	147.6	77%	0.771	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-61.4	127.6	179.1	-171.1	172.7	-146.5	0	0	110.9	Q337	E335-Q337 PolarHBondContact O-N 3.49Å
336	V	40.8	Very low	41.3	Very low	128 Å²	128	145.4 Å²	145.4	78%	0.776	75%	0.749	S	S	*	*			trans	-80.4	90.1	-177.3	-175.1	0	0	0	0	109.5	H334 S338	H334-V336 PolarHBondContact O-N 3.23Å; V336-S338 PolarHBondContact O-N 3.01Å; V336-S338 PolarHBondContact O-OG 3.46Å
337	Q	39.9	Very low	42	Very low	157 Å²	157	149.5 Å²	149.5	73%	0.734	75%	0.75	S	S	*	*			trans	-56.9	107.8	175.1	-69.1	-170.8	1.8	0	0	110.6	E335 L339	E335-Q337 PolarHBondContact O-N 3.49Å; Q337-L339 PolarHBondContact O-N 3.39Å
338	S	41.8	Very low	42.7	Very low	88 Å²	88	148 Å²	148	62%	0.615	74%	0.743	S	S	*	*			trans	-77.9	91.8	-178.9	-65.3	0	0	0	0	110.4	V336 W340	V336-S338 PolarHBondContact O-N 3.01Å; V336-S338 PolarHBondContact O-OG 3.46Å; S338-W340 PolarHBondContact O-N 3.03Å; S338-W340 PolarHBondContact O-NE1 3.4Å
339	L	47.7	Very low	43.4	Very low	157 Å²	157	146.9 Å²	146.9	82%	0.822	74%	0.735	S	S	*	*			trans	-67.2	112.2	174.6	-86.8	162.4	0	0	0	111.3	Q337 V341	Q337-L339 PolarHBondContact O-N 3.39Å; L339-V341 PolarHBondContact O-N 2.96Å
340	W	45.8	Very low	43.7	Very low	242 Å²	242	152.1 Å²	152.1	92%	0.917	74%	0.739	S	S	*	*			trans	-84.8	90.5	178.4	-65	88.5	0	0	0	111.2	S338 K342	S338-W340 PolarHBondContact O-N 3.03Å; S338-W340 PolarHBondContact O-NE1 3.4Å; W340-K342 PolarHBondContact O-N 3.41Å
341	V	54	Low	43.6	Very low	122 Å²	122	150.2 Å²	150.2	74%	0.739	73%	0.734	S	S	*	*			trans	-74	117	175.9	-176.9	0	0	0	0	110.6	L339 I343	L339-V341 PolarHBondContact O-N 2.96Å; V341-I343 HydrophobicContact CG1-CG1 4.3Å; V341-I343 PolarHBondContact O-N 2.94Å
342	K	42.5	Very low	43.6	Very low	170 Å²	170	145.6 Å²	145.6	74%	0.739	73%	0.731	S	S	*	*			trans	-86	99.3	171.4	-173.6	-164	-179.6	-130.7	0	109.8	W340 D344	W340-K342 PolarHBondContact O-N 3.41Å; K342-D344 IonicContact NZ-OD2 3.41Å; K342-D344 PolarHBondContact NZ-OD2 2.91Å
343	I	61.7	Low	43.7	Very low	137 Å²	137	149.1 Å²	149.1	70%	0.703	74%	0.744	S	S	*	*			trans	-76.8	121.7	169.8	-56.4	175.9	0	0	0	108.3	V341	V341-I343 HydrophobicContact CG1-CG1 4.3Å; V341-I343 PolarHBondContact O-N 2.94Å
344	D	53.8	Low	43.9	Very low	74 Å²	74	146.5 Å²	146.5	40%	0.396	74%	0.74	S	S	.	*			trans	-87.6	130.2	174.6	-127.2	-55.6	0	0	0	110.7	K342 S346 F347	K342-D344 IonicContact NZ-OD2 3.41Å; K342-D344 PolarHBondContact NZ-OD2 2.91Å; D344-S346 PolarHBondContact O-N 3.34Å; D344-F347 HydrophobicContact CB-CD2 4.21Å; D344-F347 HydrophobicContact CB-CE2 4.18Å; D344-F347 WeakPolarHBondContact O-CD2 3.43Å; D344-F347 PolarHBondContact O-N 2.96Å
345	L	53.6	Low	43.6	Very low	137 Å²	137	146.1 Å²	146.1	72%	0.717	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-73.3	-12	-168.7	-78.5	137.2	0	0	0	113.4	F347 L348	L345-F347 PolarHBondContact O-N 3.5Å; L345-L348 HydrophobicContact CD2-CD1 4.26Å; L345-L348 PolarHBondContact O-N 3.05Å
346	S	55.2	Low	43.2	Very low	73 Å²	73	143.5 Å²	143.5	51%	0.51	76%	0.755	S	S	.	*	G	3₁₀ helix	trans	-62.4	-23.3	174.1	50	0	0	0	0	113.9	D344 L348 S349	D344-S346 PolarHBondContact O-N 3.34Å; S346-L348 VanDerWaalsContact C-N 3.26Å; S346-L348 PolarHBondContact O-N 3.38Å; S346-S349 PolarHBondContact O-OG 2.79Å
347	F	44.5	Very low	42.7	Very low	174 Å²	174	140.7 Å²	140.7	76%	0.763	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-77.2	-8.7	177.6	-65.6	-72.7	0	0	0	113.9	D344 L345	D344-F347 HydrophobicContact CB-CD2 4.21Å; D344-F347 HydrophobicContact CB-CE2 4.18Å; D344-F347 WeakPolarHBondContact O-CD2 3.43Å; D344-F347 PolarHBondContact O-N 2.96Å; L345-F347 PolarHBondContact O-N 3.5Å
348	L	47.6	Very low	42.1	Very low	139 Å²	139	141.9 Å²	141.9	73%	0.728	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-94.2	-0.7	178.5	-69.2	170.2	0	0	0	114	L345 S346	L345-L348 HydrophobicContact CD2-CD1 4.26Å; L345-L348 PolarHBondContact O-N 3.05Å; S346-L348 VanDerWaalsContact C-N 3.26Å; S346-L348 PolarHBondContact O-N 3.38Å
349	S	45.5	Very low	41.3	Very low	101 Å²	101	148.8 Å²	148.8	71%	0.706	77%	0.771	S	S	*	*			trans	-105.5	30.7	-174.2	71.3	0	0	0	0	114.6	S346	S346-S349 PolarHBondContact O-OG 2.79Å
350	R	42.3	Very low	40.4	Very low	231 Å²	231	146.1 Å²	146.1	87%	0.872	77%	0.771	S	S	*	*			trans	-126	91.5	175.2	-173.7	169.2	-74.8	-172.9	-3.8	110.9
351	V	34.8	Very low	39.7	Very low	131 Å²	131	146 Å²	146	79%	0.794	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-74.8	137.8	170.7	-179.9	0	0	0	0	109.1	E353	V351-E353 PolarHBondContact O-N 3.38Å
352	P	35.3	Very low	38.4	Very low	115 Å²	115	148.6 Å²	148.6	75%	0.747	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-68	121.7	170	-18.8	32.6	0	0	0	111.2
353	E	30.5	Very low	37.7	Very low	197 Å²	197	145.2 Å²	145.2	92%	0.921	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-80.2	124.7	174.8	-169.3	176	163.3	0	0	109.5	V351	V351-E353 PolarHBondContact O-N 3.38Å
354	Q	34.1	Very low	36	Very low	185 Å²	185	141.9 Å²	141.9	86%	0.864	78%	0.783	S	S	*	*			trans	-106.1	142.1	174.6	-77.1	-164.6	-5.4	0	0	111.6
355	T	27.6	Very low	34.9	Very low	146 Å²	146	148.5 Å²	148.5	90%	0.896	80%	0.803	S	S	*	*			trans	-79	126.8	-167.1	51.2	0	0	0	0	113.3
356	A	28.8	Very low	33.8	Very low	109 Å²	109	146.8 Å²	146.8	90%	0.901	80%	0.798	S	S	*	*			trans	-104.5	123.7	160.3	0	0	0	0	0	109.4
357	G	28.8	Very low	32.5	Very low	70 Å²	70	148.3 Å²	148.3	72%	0.722	80%	0.797	S	S	*	*			trans	-122.7	137.9	-172.5	0	0	0	0	0	114.1
358	E	27.6	Very low	31.8	Very low	182 Å²	182	149.1 Å²	149.1	85%	0.85	80%	0.795	S	S	*	*			trans	73.8	143	163	-68.8	-139.6	94.1	0	0	121.9
359	R	25.6	Very low	30.9	Very low	232 Å²	232	149.4 Å²	149.4	88%	0.875	80%	0.796	S	S	*	*			trans	68.2	132.5	170.5	-66.3	178.5	177.2	-177.4	-2.5	117.3
360	A	28.4	Very low	30	Very low	101 Å²	101	151.6 Å²	151.6	84%	0.835	80%	0.795	S	S	*	*			cis	-132.3	158.3	3.3	0	0	0	0	0	113
361	R	31	Very low	29.4	Very low	239 Å²	239	147.1 Å²	147.1	90%	0.902	79%	0.788	S	S	*	*			trans	-102.5	156.4	176.5	-67.4	175.9	173.1	161.4	-2.7	111
362	L	28.1	Very low	29.1	Very low	177 Å²	177	144.8 Å²	144.8	93%	0.927	79%	0.791	S	S	*	*			trans	153.3	140.5	148.1	-84.6	161.5	0	0	0	107
363	A	26	Very low	28.7	Very low	99 Å²	99	142.7 Å²	142.7	82%	0.818	79%	0.791	S	S	*	*			cis	-163	161.1	-20.5	0	0	0	0	0	106.9
364	G	27.6	Very low	28.7	Very low	68 Å²	68	142.2 Å²	142.2	70%	0.701	79%	0.785	S	S	*	*			cis	157.2	157.9	-7.2	0	0	0	0	0	111.9
365	R	30.6	Very low	28.7	Very low	213 Å²	213	141.4 Å²	141.4	80%	0.804	78%	0.781	S	S	*	*			trans	72.9	154	167.6	-128.5	176.4	165.2	175	-5.2	114.7	E367	R365-E367 IonicContact CZ-OE1 3.07Å; R365-E367 IonicContact NE-OE1 3.42Å; R365-E367 PolarHBondContact NE-OE1 2.88Å; R365-E367 VanDerWaalsContact NE-OE1 3.07Å; R365-E367 IonicContact NH2-OE1 2.76Å; R365-E367 PolarHBondContact NH2-OE1 3.5Å
366	T	28.7	Very low	28.8	Very low	100 Å²	100	144.3 Å²	144.3	61%	0.613	78%	0.776	S	S	*	*			cis	-153.3	118.8	25.6	-53	0	0	0	0	116
367	E	28.4	Very low	29.1	Very low	105 Å²	105	148.2 Å²	148.2	49%	0.491	77%	0.767	S	S	.	*			trans	51.9	168.2	141.3	-55	169.8	-144.4	0	0	119.6	R365	R365-E367 IonicContact CZ-OE1 3.07Å; R365-E367 IonicContact NE-OE1 3.42Å; R365-E367 PolarHBondContact NE-OE1 2.88Å; R365-E367 VanDerWaalsContact NE-OE1 3.07Å; R365-E367 IonicContact NH2-OE1 2.76Å; R365-E367 PolarHBondContact NH2-OE1 3.5Å
368	R	30	Very low	29.5	Very low	192 Å²	192	151.5 Å²	151.5	73%	0.725	76%	0.764	S	S	*	*			cis	-154.5	168.7	14.3	-150.7	165.9	-85.6	168.1	-5.4	107.8
369	L	29	Very low	29.7	Very low	145 Å²	145	147.4 Å²	147.4	76%	0.759	76%	0.761	S	S	*	*			cis	-124.5	-109.7	9.5	-163.6	7.7	0	0	0	111
370	E	26.5	Very low	29.9	Very low	147 Å²	147	141.1 Å²	141.1	69%	0.687	76%	0.759	S	S	*	*			cis	-145.5	-148.8	-6.4	-140.8	-77.1	125.9	0	0	109.6
371	N	28.9	Very low	29.9	Very low	136 Å²	136	141.1 Å²	141.1	73%	0.727	76%	0.759	S	S	*	*			trans	-110.6	151.2	-156.1	-91.9	-53.7	0	0	0	117.7
372	G	28.5	Very low	29.9	Very low	82 Å²	82	136 Å²	136	85%	0.845	75%	0.749	S	S	*	*			trans	87.5	136.9	146.7	0	0	0	0	0	118.1
373	G	28.6	Very low	29.9	Very low	72 Å²	72	135.1 Å²	135.1	74%	0.742	74%	0.743	S	S	*	*			cis	169	124	-11.7	0	0	0	0	0	115.7
374	K	30.1	Very low	30.2	Very low	186 Å²	186	137 Å²	137	81%	0.809	74%	0.743	S	S	*	*			trans	67.4	109.8	150.4	-67.6	180	-179.1	174.7	0	121.6
375	H	33.9	Very low	30.3	Very low	168 Å²	168	137.8 Å²	137.8	78%	0.778	74%	0.743	S	S	*	*			trans	75.6	166	141	-48.4	-42	0	0	0	117.4
376	R	30	Very low	30.9	Very low	208 Å²	208	132.9 Å²	132.9	79%	0.785	74%	0.739	S	S	*	*			cis	-158.1	120.6	17	-158.6	175.3	-168.2	-137.4	5.1	115.3
377	R	35.5	Very low	31	Very low	191 Å²	191	134.6 Å²	134.6	72%	0.721	75%	0.749	S	S	*	*			trans	59	163.7	141.1	-68.7	-174.9	165.6	-137.4	8.7	120.1
378	Q	36.3	Very low	31.1	Very low	138 Å²	138	135.4 Å²	135.4	65%	0.645	75%	0.753	S	S	*	*			cis	-169.2	161	-25.1	-110.1	171.7	-26.1	0	0	110.6
379	A	31.1	Very low	31	Very low	96 Å²	96	134.2 Å²	134.2	79%	0.793	75%	0.754	S	S	*	*			trans	38.7	154.3	137.4	0	0	0	0	0	122.2
380	A	29.7	Very low	31.1	Very low	101 Å²	101	134.2 Å²	134.2	84%	0.835	75%	0.749	S	S	*	*			cis	-123	-130.1	14	0	0	0	0	0	112.8
381	A	29.9	Very low	31	Very low	100 Å²	100	132.8 Å²	132.8	83%	0.826	75%	0.751	S	S	*	*			cis	-117.4	-155.2	10.9	0	0	0	0	0	113.2
382	N	30.2	Very low	30.9	Very low	132 Å²	132	131 Å²	131	71%	0.706	75%	0.749	S	S	*	*			trans	-159.2	139.1	-166.5	-157.1	27.4	0	0	0	113.5
383	M	29.1	Very low	31	Very low	159 Å²	159	136.8 Å²	136.8	78%	0.783	75%	0.751	S	S	*	*			trans	61.1	159.6	168.6	-45.3	-52.9	-177.9	0	0	117.1
384	V	31.7	Very low	30.9	Very low	137 Å²	137	138.8 Å²	138.8	83%	0.83	75%	0.754	S	S	*	*			cis	-137.7	152.4	17.3	167.4	0	0	0	0	110.5
385	A	30.1	Very low	30.9	Very low	85 Å²	85	137.8 Å²	137.8	70%	0.702	75%	0.749	S	S	*	*			trans	-110.4	164.8	166	0	0	0	0	0	110.6
386	P	43.7	Very low	30.7	Very low	111 Å²	111	140.1 Å²	140.1	72%	0.721	75%	0.751	S	S	*	*				-151.5	150.9	98.9	39.4	-22.8	0	0	0	117.6
387	T	30.7	Very low	30.8	Very low	135 Å²	135	137.9 Å²	137.9	83%	0.828	75%	0.747	S	S	*	*			trans	53.9	127.9	144	56.4	0	0	0	0	120.6
388	E	30.1	Very low	30.6	Very low	123 Å²	123	136.3 Å²	136.3	58%	0.575	75%	0.748	S	S	*	*			cis	-138.9	-110.7	12.1	-164.4	-154	110.6	0	0	111.3	H390	E388-H390 IonicContact OE1-CD2 3.51Å; E388-H390 PolarHBondContact OE1-CD2 2.77Å; E388-H390 IonicContact OE1-CG 3.75Å; E388-H390 PolarHBondContact OE1-N 2.95Å
389	K	27.9	Very low	30.4	Very low	167 Å²	167	137.5 Å²	137.5	73%	0.726	75%	0.751	S	S	*	*			cis	-139	134.1	-7.4	-165.1	99	-159.9	81.9	0	112.2
390	H	29.9	Very low	30.4	Very low	145 Å²	145	139.3 Å²	139.3	67%	0.671	75%	0.747	S	S	*	*			trans	-85.4	167	171.6	-69.3	-92.8	0	0	0	112.2	E388	E388-H390 IonicContact OE1-CD2 3.51Å; E388-H390 PolarHBondContact OE1-CD2 2.77Å; E388-H390 IonicContact OE1-CG 3.75Å; E388-H390 PolarHBondContact OE1-N 2.95Å
391	T	25.2	Very low	30.2	Very low	116 Å²	116	140.8 Å²	140.8	71%	0.712	74%	0.74	S	S	*	*			cis	-163.2	148.1	20.9	-9.5	0	0	0	0	113.8
392	S	27.9	Very low	30.1	Very low	100 Å²	100	144.7 Å²	144.7	70%	0.699	74%	0.741	S	S	*	*			trans	41.4	124.8	130.1	-60	0	0	0	0	125.7
393	K	30	Very low	30	Very low	202 Å²	202	141.8 Å²	141.8	88%	0.878	74%	0.743	S	S	*	*				36.5	152.8	117.5	-66.5	-178.2	176.8	177.1	0	122.6
394	S	27.1	Very low	29.9	Very low	115 Å²	115	143.3 Å²	143.3	80%	0.804	75%	0.748	S	S	*	*			trans	92.4	156.9	158.5	-136.6	0	0	0	0	114.3
395	K	28.4	Very low	29.9	Very low	164 Å²	164	141.6 Å²	141.6	71%	0.713	74%	0.742	S	S	*	*			cis	-165.9	122.9	25.8	-168.2	170.8	-176.2	176.2	0	115.5
396	R	31.2	Very low	30.8	Very low	217 Å²	217	142.6 Å²	142.6	82%	0.819	74%	0.741	S	S	*	*			trans	62.7	170.5	157.1	-67.7	-179.8	162.7	169.1	-4.5	116
397	K	30.8	Very low	30.1	Very low	161 Å²	161	142.8 Å²	142.8	70%	0.7	74%	0.74	S	S	*	*			cis	-157.9	146.7	4.7	-148	-177.4	177.8	-170	0	110.9
398	H	32	Very low	30	Very low	159 Å²	159	145.6 Å²	145.6	74%	0.736	74%	0.741	S	S	*	*			trans	62	157.5	152.3	-102.6	-149	0	0	0	118
399	K	31.6	Very low	29.7	Very low	162 Å²	162	144.6 Å²	144.6	70%	0.704	75%	0.746	S	S	*	*			cis	-157.4	170	-16.3	-153.3	-159.3	175.9	-157.3	0	108.2
400	L	30.8	Very low	29.8	Very low	135 Å²	135	143.3 Å²	143.3	71%	0.707	75%	0.747	S	S	*	*			trans	-61.6	165.4	155.8	-51.9	93.4	0	0	0	110.3
401	D	26.5	Very low	30.1	Very low	131 Å²	131	146.7 Å²	146.7	70%	0.701	76%	0.76	S	S	*	*			cis	-165.8	-170.3	41.7	-145.6	-81.2	0	0	0	113.7
402	H	28	Very low	30.5	Very low	182 Å²	182	150.2 Å²	150.2	84%	0.843	77%	0.766	S	S	*	*			trans	-50.7	158.8	174.2	-97.7	-94.7	0	0	0	115.4
403	G	27.9	Very low	30.7	Very low	72 Å²	72	152.6 Å²	152.6	74%	0.742	77%	0.769	S	S	*	*			trans	-172.9	141.8	161	0	0	0	0	0	112.1
404	E	26.2	Very low	30.5	Very low	191 Å²	191	153.5 Å²	153.5	89%	0.893	77%	0.767	S	S	*	*			trans	-101.1	-173	-175.7	-62.7	-164.7	115.2	0	0	114.1
405	S	32.5	Very low	30.6	Very low	101 Å²	101	155.5 Å²	155.5	71%	0.706	77%	0.768	S	S	*	*			trans	-54.7	-170.1	170.7	73.4	0	0	0	0	114.9
406	P	47.9	Very low	30.5	Very low	106 Å²	106	153.9 Å²	153.9	69%	0.688	77%	0.767	S	S	*	*			cis	-148.8	-163.1	13.6	26.8	2.8	0	0	0	117.9
407	V	29.9	Very low	30.6	Very low	115 Å²	115	151 Å²	151	70%	0.697	76%	0.761	S	S	*	*			trans	105.5	113.1	146.3	-170	0	0	0	0	120.5
408	K	28.3	Very low	30.6	Very low	194 Å²	194	149.8 Å²	149.8	84%	0.843	76%	0.762	S	S	*	*			trans	25.6	153.2	132.2	-47	175.4	-179	169.2	0	120
409	C	24.5	Very low	30.3	Very low	101 Å²	101	147.7 Å²	147.7	68%	0.682	76%	0.764	S	S	*	*			cis	-169.5	157	41.3	67.4	0	0	0	0	119
410	N	29.5	Very low	30.3	Very low	141 Å²	141	148 Å²	148	75%	0.754	77%	0.773	S	S	*	*			trans	58.5	119.9	138.2	-64.1	-21.6	0	0	0	124
411	K	35.6	Very low	30.4	Very low	215 Å²	215	148.9 Å²	148.9	94%	0.935	78%	0.777	S	S	*	*				-153.8	165.7	109.7	-111.7	169.3	-176.9	174.4	0	111.6
412	K	33.9	Very low	30.5	Very low	191 Å²	191	150.1 Å²	150.1	83%	0.83	78%	0.783	S	S	*	*			trans	-131.9	147.3	-168.7	-74.7	179.7	173.7	176.7	0	113
413	L	31.6	Very low	31.9	Very low	149 Å²	149	146.5 Å²	146.5	78%	0.78	78%	0.775	S	S	*	*				-174.4	131.3	125.7	-114.4	79.1	0	0	0	107
414	R	26.2	Very low	32.7	Very low	222 Å²	222	149.2 Å²	149.2	84%	0.838	78%	0.78	S	S	*	*				48.4	116.8	88.9	-68.9	-175.9	164.9	136.9	-5.3	113.6
415	L	30.1	Very low	33	Very low	156 Å²	156	145.6 Å²	145.6	82%	0.817	77%	0.774	S	S	*	*			cis	69.8	131.7	23.2	-65.6	80.1	0	0	0	114.5
416	D	26.6	Very low	32.8	Very low	130 Å²	130	148.7 Å²	148.7	70%	0.695	78%	0.781	S	S	*	*			cis	-162.7	171.2	-3.8	-177.4	-148.6	0	0	0	111.5
417	K	33.1	Very low	32	Very low	157 Å²	157	148.8 Å²	148.8	68%	0.683	79%	0.785	S	S	*	*			trans	87.7	145.8	151.7	-131.6	83.1	179.6	-179.6	0	123.5
418	D	30.4	Very low	32.7	Very low	136 Å²	136	148.5 Å²	148.5	73%	0.727	79%	0.785	S	S	*	*			trans	82.6	134.7	148.1	-67.1	-33.9	0	0	0	125.4
419	C	26.2	Very low	32.7	Very low	115 Å²	115	146.4 Å²	146.4	78%	0.777	78%	0.782	S	S	*	*			trans	65.3	156	158.3	-62.9	0	0	0	0	119
420	L	30.8	Very low	33	Very low	169 Å²	169	149.4 Å²	149.4	89%	0.885	79%	0.785	S	S	*	*			cis	-143.7	-163	32.5	-78.1	165.2	0	0	0	114.3
421	L	32	Very low	32.8	Very low	152 Å²	152	148.7 Å²	148.7	80%	0.796	78%	0.781	S	S	*	*			trans	-122.3	135.8	-163.2	-63.8	160.8	0	0	0	116.4
422	L	30.1	Very low	32.6	Very low	157 Å²	157	145.8 Å²	145.8	82%	0.822	77%	0.771	S	S	*	*			trans	53.8	-174.9	144.1	-63.9	166.4	0	0	0	119.6
423	P	56.5	Low	32.4	Very low	106 Å²	106	142.8 Å²	142.8	69%	0.688	76%	0.758	S	S	*	*				-120.4	-172.1	-94.1	40.9	-22.4	0	0	0	113.3
424	P	45.6	Very low	32.2	Very low	129 Å²	129	141 Å²	141	84%	0.838	76%	0.758	S	S	*	*				-155	-165.4	91.1	41.4	-20	0	0	0	116.4
425	C	30.9	Very low	32.2	Very low	115 Å²	115	134.5 Å²	134.5	78%	0.777	75%	0.746	S	S	*	*			trans	-105.7	-175.3	-158.4	-43.7	0	0	0	0	116.3
426	I	28.5	Very low	32.2	Very low	167 Å²	167	132.7 Å²	132.7	86%	0.856	75%	0.746	S	S	*	*			trans	124.6	139	149.5	-64.7	158.9	0	0	0	116.3
427	S	31.1	Very low	32.3	Very low	108 Å²	108	130.5 Å²	130.5	76%	0.755	75%	0.747	S	S	*	*			trans	-118.6	165.2	174.1	-43.2	0	0	0	0	110.9
428	P	45.8	Very low	32.1	Very low	109 Å²	109	131.1 Å²	131.1	71%	0.708	75%	0.752	S	S	*	*				-155.4	-172.8	124.9	35	-14.3	0	0	0	116.9
429	I	27.5	Very low	32	Very low	150 Å²	150	133.1 Å²	133.1	77%	0.769	76%	0.757	S	S	*	*			trans	100.3	108.9	163.6	-57.1	160	0	0	0	113.2
430	H	30.2	Very low	32	Very low	163 Å²	163	133.4 Å²	133.4	76%	0.755	75%	0.751	S	S	*	*			cis	70.3	136.6	40.8	-68.8	109.2	0	0	0	114.5
431	N	27.1	Very low	32	Very low	127 Å²	127	132.2 Å²	132.2	68%	0.679	74%	0.741	S	S	*	*			cis	-158.2	-168	3.7	-137.5	-22.4	0	0	0	107
432	H	31.3	Very low	32	Very low	154 Å²	154	131.1 Å²	131.1	71%	0.713	73%	0.731	S	S	*	*			cis	-166.8	-174.9	0.2	-143.6	39.2	0	0	0	106.2
433	K	28.9	Very low	32	Very low	128 Å²	128	130.8 Å²	130.8	56%	0.557	72%	0.723	S	S	*	*				-164.6	116.1	-65.8	167.6	-99.6	117	-122.5	0	110.8	S435	K433-S435 PolarHBondContact NZ-OG 2.54Å
434	S	27.6	Very low	30.7	Very low	111 Å²	111	131.5 Å²	131.5	78%	0.776	73%	0.726	S	S	*	*			trans	-153.9	129	162.7	45.5	0	0	0	0	110.1
435	S	26.5	Very low	30	Very low	86 Å²	86	133 Å²	133	60%	0.601	73%	0.726	S	S	*	*			cis	73.6	130.6	33.3	79.9	0	0	0	0	114.8	K433	K433-S435 PolarHBondContact NZ-OG 2.54Å
436	S	28.6	Very low	29.8	Very low	117 Å²	117	134.4 Å²	134.4	82%	0.818	73%	0.725	S	S	*	*			cis	-144.3	-157.6	-5.6	41.9	0	0	0	0	107.8
437	A	28.6	Very low	29.9	Very low	85 Å²	85	135 Å²	135	70%	0.702	72%	0.724	S	S	*	*			cis	-165.4	-171.8	8.9	0	0	0	0	0	106.2
438	E	29.7	Very low	29.8	Very low	170 Å²	170	133.8 Å²	133.8	79%	0.794	72%	0.72	S	S	*	*			cis	-173.2	-179.7	-31	-105.5	-63.1	160.6	0	0	106.9
439	E	28.1	Very low	29	Very low	177 Å²	177	138.2 Å²	138.2	83%	0.827	73%	0.728	S	S	*	*			trans	73.9	138.3	173.2	-68.6	-170.6	176.8	0	0	118.6
440	N	27.2	Very low	29.1	Very low	121 Å²	121	139.3 Å²	139.3	65%	0.647	73%	0.728	S	S	*	*			cis	-161.3	157.5	-20.7	-158.3	19.3	0	0	0	113.5
441	E	30.8	Very low	29	Very low	144 Å²	144	139.1 Å²	139.1	67%	0.673	73%	0.727	S	S	*	*			trans	32.7	155.4	146.1	-84.5	-177.8	129.5	0	0	125.1
442	E	31	Very low	29.1	Very low	129 Å²	129	136.9 Å²	136.9	60%	0.603	72%	0.718	S	S	*	*			cis	-164.2	171.5	-13.9	-142.5	-162.6	174.8	0	0	114.3
443	K	30.4	Very low	29.1	Very low	150 Å²	150	140.1 Å²	140.1	65%	0.652	72%	0.724	S	S	*	*			trans	53.1	110	148.4	-87.8	-175.9	-171.7	84.4	0	124.7
444	T	29.4	Very low	29.2	Very low	121 Å²	121	143 Å²	143	74%	0.742	73%	0.731	S	S	*	*				55.8	133.7	110.2	-40	0	0	0	0	123.5
445	I	30.7	Very low	29.3	Very low	162 Å²	162	146.8 Å²	146.8	83%	0.831	73%	0.729	S	S	*	*				163.9	156.1	126.1	-83.9	173.1	0	0	0	112.5
446	N	27.7	Very low	29.3	Very low	143 Å²	143	147.5 Å²	147.5	77%	0.765	73%	0.726	S	S	*	*			trans	-94.9	153	-170.7	-69	-64.2	0	0	0	116.5
447	H	29.7	Very low	29.2	Very low	180 Å²	180	147.8 Å²	147.8	83%	0.833	72%	0.718	S	S	*	*			trans	44.5	113.9	144.2	-87.7	-86.6	0	0	0	123.3
448	A	28.9	Very low	29.3	Very low	82 Å²	82	151.4 Å²	151.4	68%	0.678	72%	0.718	S	S	*	*				89.1	153.6	118.9	0	0	0	0	0	123.3
449	K	29.6	Very low	29.4	Very low	202 Å²	202	151.2 Å²	151.2	88%	0.878	72%	0.721	S	S	*	*			trans	83	154.2	169.4	-61.2	172.8	-177.8	167	0	117.9
450	K	29.5	Very low	29.5	Very low	174 Å²	174	150.5 Å²	150.5	76%	0.757	72%	0.722	S	S	*	*			cis	-177.6	126.4	-29.1	-179.8	178.3	-178.9	-176.8	0	112.6	T452	K450-T452 HydrophobicContact CD-CG2 4.32Å; K450-T452 HydrophobicContact CG-CG2 3.74Å
451	Q	28.6	Very low	30.9	Very low	159 Å²	159	150.3 Å²	150.3	74%	0.743	73%	0.728	S	S	*	*			trans	-166.6	152.2	145.8	-95	-159	109	0	0	107.2
452	T	28.4	Very low	31.1	Very low	79 Å²	79	149.1 Å²	149.1	49%	0.485	73%	0.732	S	S	.	*			cis	66	86.6	-15	176.1	0	0	0	0	121.7	K450	K450-T452 HydrophobicContact CD-CG2 4.32Å; K450-T452 HydrophobicContact CG-CG2 3.74Å
453	R	31.6	Very low	31.3	Very low	222 Å²	222	150.6 Å²	150.6	84%	0.838	74%	0.744	S	S	*	*				-109.7	140.3	116.8	-62.7	-169.7	176.3	-151.4	-0.7	107.1
454	R	29.8	Very low	31.1	Very low	188 Å²	188	151.6 Å²	151.6	71%	0.709	76%	0.755	S	S	*	*			cis	72.5	132	35.2	-59.4	-77.1	-179.6	170.7	1.3	111.3
455	R	30.6	Very low	31.2	Very low	192 Å²	192	150.7 Å²	150.7	73%	0.725	75%	0.754	S	S	*	*			cis	-160	159.3	17.8	-133.9	-168.8	157.8	132.4	-1.3	112.5
456	D	26.4	Very low	31.7	Very low	101 Å²	101	148 Å²	148	54%	0.54	75%	0.747	S	S	.	*			trans	26.9	154.9	135	-54.3	-0.7	0	0	0	120.4
457	D	26.3	Very low	31.6	Very low	122 Å²	122	148.5 Å²	148.5	65%	0.652	75%	0.749	S	S	*	*			cis	-157	-178.9	24.2	-137.5	-18.2	0	0	0	116.9
458	K	31.9	Very low	31.4	Very low	161 Å²	161	144.5 Å²	144.5	70%	0.7	74%	0.741	S	S	*	*			trans	-70.8	163.3	-168.5	-16.7	95.2	-174.5	-35	0	117.4
459	L	31	Very low	31.2	Very low	166 Å²	166	148.3 Å²	148.3	87%	0.869	75%	0.75	S	S	*	*				179.2	179.1	111.2	-90.7	174.9	0	0	0	113.3
460	L	30.6	Very low	31.2	Very low	162 Å²	162	145 Å²	145	85%	0.848	74%	0.738	S	S	*	*			trans	-104.5	-159.4	-169.6	-58.4	170.9	0	0	0	113.7
461	P	55.8	Low	32.5	Very low	117 Å²	117	139.9 Å²	139.9	76%	0.76	72%	0.722	S	S	*	*				-99.8	-172	-123.6	40.1	-21.7	0	0	0	113.8
462	P	36.1	Very low	33.2	Very low	119 Å²	119	138.1 Å²	138.1	77%	0.773	72%	0.724	S	S	*	*				-148.1	173.5	95.5	41.8	-26.9	0	0	0	115.8
463	L	34.5	Very low	33.4	Very low	161 Å²	161	142.7 Å²	142.7	84%	0.843	73%	0.733	S	S	*	*			trans	-71.9	154.1	155.2	-64.2	164.3	0	0	0	109.7
464	L	25.6	Very low	33.2	Very low	170 Å²	170	140.2 Å²	140.2	89%	0.89	73%	0.728	S	S	*	*			trans	171.4	124.6	140.3	-93.9	163.3	0	0	0	111.8
465	S	32	Very low	33.1	Very low	103 Å²	103	142.3 Å²	142.3	72%	0.72	74%	0.736	S	S	*	*			trans	-85.6	168.3	137.7	-48.7	0	0	0	0	107.1
466	P	41.3	Very low	32.9	Very low	105 Å²	105	137.3 Å²	137.3	68%	0.682	74%	0.736	S	S	*	*			cis	-151	-157	30.4	36.2	-9.6	0	0	0	115.1
467	L	25.8	Very low	33	Very low	154 Å²	154	137.9 Å²	137.9	81%	0.806	75%	0.746	S	S	*	*			trans	72.3	146.8	157.4	-66.2	165.4	0	0	0	117.9
468	S	25.6	Very low	32.9	Very low	95 Å²	95	139.8 Å²	139.8	66%	0.664	76%	0.757	S	S	*	*			cis	-169.9	155.4	-23.4	-152.5	0	0	0	0	110.8
469	D	25.3	Very low	32.6	Very low	163 Å²	163	135.8 Å²	135.8	87%	0.872	76%	0.761	S	S	*	*			trans	-154.4	140.4	134	-162.1	17.1	0	0	0	110.8
470	E	29.7	Very low	32.5	Very low	132 Å²	132	131.5 Å²	131.5	62%	0.617	76%	0.757	S	S	*	*			trans	-168.5	172.1	176.3	80.2	142.6	-127.5	0	0	110.4	R473	E470-R473 IonicContact OE1-CZ 3.5Å; E470-R473 IonicContact OE1-NH2 2.72Å; E470-R473 PolarHBondContact OE1-NH2 2.8Å
471	P	55.5	Low	33.2	Very low	66 Å²	66	129.3 Å²	129.3	43%	0.429	75%	0.752	S	S	.	*			cis	-128.4	-158.3	-19.2	42.5	-24.9	0	0	0	110.4	R473	P471-R473 HydrophobicContact CB-CG 4.09Å; P471-R473 HydrophobicContact CG-CG 3.83Å
472	P	43.5	Very low	31.6	Very low	122 Å²	122	128.6 Å²	128.6	79%	0.792	75%	0.75	S	S	*	*				-125.7	142.5	64.8	6.9	18.2	0	0	0	113.2
473	R	31.9	Very low	31.1	Very low	175 Å²	175	129.8 Å²	129.8	66%	0.66	75%	0.749	S	S	*	*				61.4	134.9	64.5	-61.2	-171.4	-146	-137.4	5.7	112.9	E470 P471	E470-R473 IonicContact OE1-CZ 3.5Å; E470-R473 IonicContact OE1-NH2 2.72Å; E470-R473 PolarHBondContact OE1-NH2 2.8Å; P471-R473 HydrophobicContact CB-CG 4.09Å; P471-R473 HydrophobicContact CG-CG 3.83Å
474	K	28.6	Very low	30.7	Very low	171 Å²	171	127.7 Å²	127.7	74%	0.743	74%	0.743	S	S	*	*			cis	-169.2	159.2	13.7	-133.6	175.9	-179.4	-177.3	0	113.4
475	R	28.1	Very low	30.9	Very low	232 Å²	232	127.6 Å²	127.6	88%	0.875	74%	0.738	S	S	*	*			trans	79.4	160.7	164.5	-61	-179.8	-71.4	-176	-2.8	118.4
476	A	25.8	Very low	30.6	Very low	87 Å²	87	131 Å²	131	72%	0.719	74%	0.742	S	S	*	*				159.1	137.5	-57.9	0	0	0	0	0	113.1
477	C	27.2	Very low	30	Very low	112 Å²	112	129.9 Å²	129.9	76%	0.757	74%	0.742	S	S	*	*			trans	65.1	131.3	152.2	-66.7	0	0	0	0	122.9
478	D	26.2	Very low	30.1	Very low	163 Å²	163	126.1 Å²	126.1	87%	0.872	74%	0.741	S	S	*	*			trans	52.1	140	139.2	-65.4	-77.5	0	0	0	123.6
479	G	25.5	Very low	30.2	Very low	77 Å²	77	126.1 Å²	126.1	79%	0.794	75%	0.747	S	S	*	*			trans	139.3	115.6	158.6	0	0	0	0	0	116.5
480	G	27.1	Very low	30.3	Very low	75 Å²	75	125.2 Å²	125.2	77%	0.773	75%	0.747	S	S	*	*			trans	-108	-167.7	141	0	0	0	0	0	108.9
481	P	45.1	Very low	30.2	Very low	117 Å²	117	122.4 Å²	122.4	76%	0.76	75%	0.753	S	S	*	*			cis	-130.9	-152.1	1.7	42	-23.9	0	0	0	111.7
482	S	23.7	Very low	29	Very low	101 Å²	101	127.4 Å²	127.4	71%	0.706	77%	0.773	S	S	*	*			trans	64.2	158	162.2	35.3	0	0	0	0	117.6
483	L	24.7	Very low	28.5	Very low	144 Å²	144	129.1 Å²	129.1	75%	0.754	77%	0.774	S	S	*	*			cis	161.8	146.6	-23.9	-103	167.1	0	0	0	104.6
484	T	27.5	Very low	28.8	Very low	117 Å²	117	126.8 Å²	126.8	72%	0.718	78%	0.782	S	S	*	*			trans	63.9	150.5	155.6	50	0	0	0	0	118.6
485	E	28.9	Very low	28.5	Very low	169 Å²	169	124.1 Å²	124.1	79%	0.79	78%	0.784	S	S	*	*			cis	-153.5	-161.1	-1.4	-134.2	173	140.6	0	0	113.6
486	E	25.5	Very low	28.5	Very low	173 Å²	173	118.8 Å²	118.8	81%	0.808	78%	0.782	S	S	*	*			trans	79.1	133.9	174.5	-62.4	-69.8	102.9	0	0	118.1
487	A	28.3	Very low	28.4	Very low	82 Å²	82	118.8 Å²	118.8	68%	0.678	78%	0.782	S	S	*	*			cis	-165.7	154	-23.3	0	0	0	0	0	110.8
488	G	27.5	Very low	28.4	Very low	75 Å²	75	118.7 Å²	118.7	77%	0.773	78%	0.782	S	S	*	*			trans	82.4	110.7	167.1	0	0	0	0	0	115.9
489	A	29.1	Very low	28.5	Very low	96 Å²	96	116.1 Å²	116.1	79%	0.793	78%	0.777	S	S	*	*				79.6	127.9	63.2	0	0	0	0	0	114
490	V	27.6	Very low	28.6	Very low	144 Å²	144	117.1 Å²	117.1	87%	0.873	78%	0.778	S	S	*	*			cis	-160.1	146.7	-4.2	-101.7	0	0	0	0	111.5
491	G	27.4	Very low	28.7	Very low	72 Å²	72	118.4 Å²	118.4	74%	0.742	78%	0.781	S	S	*	*			trans	81.2	153.4	151.2	0	0	0	0	0	118.4
492	M	30.5	Very low	27.9	Very low	172 Å²	172	117.5 Å²	117.5	85%	0.847	78%	0.783	S	S	*	*			cis	-147.4	148.4	-3.3	-79.3	-114.8	69.1	0	0	111.3
493	L	31.7	Very low	28.1	Very low	157 Å²	157	117.2 Å²	117.2	82%	0.822	79%	0.787	S	S	*	*			trans	-121.5	150.9	154.4	-70.3	173.6	0	0	0	106.5
494	P	38.2	Very low	28.3	Very low	126 Å²	126	114.6 Å²	114.6	82%	0.818	79%	0.786	S	S	*	*				-151.6	-178.8	85.7	39.8	-20.2	0	0	0	116.4
495	C	23.3	Very low	28.3	Very low	116 Å²	116	114.4 Å²	114.4	78%	0.784	79%	0.79	S	S	*	*			trans	-69	162.8	179.8	-42.5	0	0	0	0	114.5
496	S	26.9	Very low	28.5	Very low	120 Å²	120	110.9 Å²	110.9	84%	0.839	78%	0.784	S	S	*	*				174.1	145.4	111.6	-78.5	0	0	0	0	117.1
497	A	25.4	Very low	28.5	Very low	86 Å²	86	109.3 Å²	109.3	71%	0.711	78%	0.776	S	S	*	*			trans	54.1	107.9	139.1	0	0	0	0	0	123.8
498	S	26.1	Very low	29.1	Very low	111 Å²	111	114.1 Å²	114.1	78%	0.776	78%	0.777	S	S	*	*				75.2	133	112.6	-54.5	0	0	0	0	124.7
499	S	27.8	Very low	29.4	Very low	109 Å²	109	118 Å²	118	76%	0.762	77%	0.774	S	S	*	*			trans	75.4	92.5	137.5	53.5	0	0	0	0	123.5
500	A	27.6	Very low	29.5	Very low	98 Å²	98	124.1 Å²	124.1	81%	0.81	78%	0.777	S	S	*	*				77.4	157	105.1	0	0	0	0	0	123.6
501	A	29.1	Very low	29.6	Very low	102 Å²	102	127.1 Å²	127.1	84%	0.843	77%	0.773	S	S	*	*			trans	70.3	146.8	167.9	0	0	0	0	0	117.2
502	A	28.3	Very low	29.8	Very low	97 Å²	97	126.6 Å²	126.6	80%	0.802	77%	0.767	S	S	*	*			cis	-161.4	-168.9	-18.5	0	0	0	0	0	106.6
503	A	28.8	Very low	29.8	Very low	95 Å²	95	127.2 Å²	127.2	79%	0.785	77%	0.768	S	S	*	*			cis	-150.8	-143.4	8.7	0	0	0	0	0	107.6
504	A	28.6	Very low	29.8	Very low	89 Å²	89	123.1 Å²	123.1	74%	0.736	76%	0.764	S	S	*	*			cis	-164.2	164.9	0	0	0	0	0	0	111.9
505	S	28.5	Very low	29.6	Very low	114 Å²	114	127.5 Å²	127.5	80%	0.797	77%	0.77	S	S	*	*			trans	68.7	132.8	155.1	-112.5	0	0	0	0	119.2
506	S	32.8	Very low	29.9	Very low	94 Å²	94	125.7 Å²	125.7	66%	0.657	76%	0.763	S	S	*	*			cis	-162.8	171.9	5.2	-123.5	0	0	0	0	110.5
507	H	26.1	Very low	29.9	Very low	140 Å²	140	126.4 Å²	126.4	65%	0.648	76%	0.763	S	S	*	*			cis	-140.5	-63.9	8.1	-161.3	53.7	0	0	0	114.3
508	R	40.1	Very low	30	Very low	183 Å²	183	126 Å²	126	69%	0.691	76%	0.76	S	S	*	*			trans	-154.4	-178.9	-174	-51	-178.4	-143.7	169.5	10.3	108.3
509	H	32.5	Very low	29.9	Very low	156 Å²	156	129.8 Å²	129.8	72%	0.722	77%	0.765	S	S	*	*			cis	-146.5	-154.4	8.8	-133.5	-34.1	0	0	0	108.6
510	R	32.1	Very low	29.9	Very low	226 Å²	226	129.4 Å²	129.4	85%	0.853	77%	0.768	S	S	*	*			cis	-123.5	-110.4	11.6	-167.7	-167.3	-175	-148.7	4.8	110.9
511	R	30.7	Very low	30	Very low	207 Å²	207	136.9 Å²	136.9	78%	0.781	78%	0.775	S	S	*	*			trans	-175.2	139.8	-176.3	177	-171.5	-75.1	-98.5	8.2	106.2
512	G	31.1	Very low	29.8	Very low	61 Å²	61	139.8 Å²	139.8	63%	0.629	78%	0.776	S	S	*	*			cis	171.5	171	-8.2	0	0	0	0	0	112.3
513	E	29.5	Very low	29.8	Very low	185 Å²	185	138.7 Å²	138.7	86%	0.864	78%	0.775	S	S	*	*			trans	65.9	134.8	157.6	-56.3	176.5	118.2	0	0	118.6
514	G	31.5	Very low	29.7	Very low	71 Å²	71	137.2 Å²	137.2	73%	0.732	77%	0.769	S	S	*	*			cis	-179.9	175	-6.9	0	0	0	0	0	114.3
515	K	34.6	Very low	29.5	Very low	217 Å²	217	139.2 Å²	139.2	94%	0.943	77%	0.772	S	S	*	*			trans	32	141.2	150	-80	179.8	178.6	178.8	0	121.4
516	A	29.6	Very low	29.3	Very low	78 Å²	78	138.9 Å²	138.9	65%	0.645	77%	0.769	S	S	*	*			cis	-164.7	173.7	5	0	0	0	0	0	114.4
517	T	26.8	Very low	29.2	Very low	136 Å²	136	137.9 Å²	137.9	83%	0.834	76%	0.759	S	S	*	*			trans	16.7	148.1	145.7	55.1	0	0	0	0	122.7
518	A	28	Very low	29.1	Very low	78 Å²	78	137.7 Å²	137.7	65%	0.645	76%	0.762	S	S	*	*			cis	-174.1	173.6	-11.7	0	0	0	0	0	112.2
519	H	24.5	Very low	28.6	Very low	190 Å²	190	133.8 Å²	133.8	88%	0.88	75%	0.754	S	S	*	*			trans	59.6	101.4	159.1	-66.8	-70.9	0	0	0	121.8
520	A	26.7	Very low	28.1	Very low	100 Å²	100	133 Å²	133	83%	0.826	75%	0.751	S	S	*	*				-157.3	128.5	120.4	0	0	0	0	0	109.7
521	R	30.3	Very low	28.1	Very low	255 Å²	255	125.2 Å²	125.2	96%	0.962	73%	0.73	S	S	*	*			trans	-101.2	102	174.9	-79.4	174.8	71.1	-176.1	2.6	109.5
522	N	25.4	Very low	27.9	Very low	163 Å²	163	120.3 Å²	120.3	87%	0.872	73%	0.727	S	S	*	*			trans	-119.1	130.7	164.4	-133.7	-13.8	0	0	0	109.5	G524	N522-G524 PolarHBondContact O-N 3.21Å
523	G	28.6	Very low	27.9	Very low	75 Å²	75	124.7 Å²	124.7	77%	0.773	73%	0.734	S	S	*	*			trans	-77.3	39.2	-160	0	0	0	0	0	116.6	V525	G523-V525 PolarHBondContact O-N 3.31Å
524	G	24.8	Very low	28	Very low	63 Å²	63	119.3 Å²	119.3	65%	0.649	71%	0.711	S	S	*	*			trans	-69.4	99	179.4	0	0	0	0	0	112.2	N522 S526	N522-G524 PolarHBondContact O-N 3.21Å; G524-S526 VanDerWaalsContact C-N 3.27Å; G524-S526 PolarHBondContact O-N 3.09Å
525	V	25	Very low	27.8	Very low	132 Å²	132	121 Å²	121	80%	0.8	71%	0.711	S	S	*	*			trans	-67.2	86.1	175.5	-175.7	0	0	0	0	110	G523 V527	G523-V525 PolarHBondContact O-N 3.31Å; V525-V527 HydrophobicContact CG1-CG2 4.09Å; V525-V527 PolarHBondContact O-N 2.78Å
526	S	24.8	Very low	27.8	Very low	107 Å²	107	113.9 Å²	113.9	75%	0.748	68%	0.68	S	S	*	*			trans	-71.4	91.6	174.8	-69.3	0	0	0	0	109.1	G524 L528	G524-S526 VanDerWaalsContact C-N 3.27Å; G524-S526 PolarHBondContact O-N 3.09Å; S526-L528 PolarHBondContact O-N 2.98Å
527	V	29.9	Very low	28	Very low	73 Å²	73	116.6 Å²	116.6	44%	0.442	69%	0.691	S	S	.	*			trans	-70.1	79.4	173.4	-176.3	0	0	0	0	108.7	V525 L529	V525-V527 HydrophobicContact CG1-CG2 4.09Å; V525-V527 PolarHBondContact O-N 2.78Å; V527-L529 VanDerWaalsContact C-N 3.28Å; V527-L529 HydrophobicContact CG1-CD1 4.29Å; V527-L529 HydrophobicContact CG1-CG 4.11Å; V527-L529 PolarHBondContact O-N 3.5Å
528	L	25.5	Very low	28.4	Very low	136 Å²	136	110.9 Å²	110.9	71%	0.712	66%	0.659	S	S	*	*			trans	-78.2	79.8	-179.5	-152.9	172.3	0	0	0	108.7	S526 E530	S526-L528 PolarHBondContact O-N 2.98Å; L528-E530 VanDerWaalsContact C-N 3.29Å; L528-E530 HydrophobicContact CD2-CB 4.38Å; L528-E530 HydrophobicContact CD2-CG 3.83Å; L528-E530 PolarHBondContact O-N 2.71Å
529	L	28.6	Very low	29.2	Very low	100 Å²	100	115.3 Å²	115.3	52%	0.524	67%	0.666	S	S	.	*			trans	-72.4	85.9	170	-79.6	165.2	0	0	0	109.2	V527 P531	V527-L529 VanDerWaalsContact C-N 3.28Å; V527-L529 HydrophobicContact CG1-CD1 4.29Å; V527-L529 HydrophobicContact CG1-CG 4.11Å; V527-L529 PolarHBondContact O-N 3.5Å; L529-P531 WeakPolarHBondContact O-CD 3.24Å
530	E	22.5	Very low	29.9	Very low	139 Å²	139	108.3 Å²	108.3	65%	0.65	65%	0.646	S	S	*	*			trans	-60.8	117.7	169.5	-108.1	-52.6	115.5	0	0	110	L528 S532	L528-E530 VanDerWaalsContact C-N 3.29Å; L528-E530 HydrophobicContact CD2-CB 4.38Å; L528-E530 HydrophobicContact CD2-CG 3.83Å; L528-E530 PolarHBondContact O-N 2.71Å; E530-S532 PolarHBondContact O-N 2.72Å
531	P	32.3	Very low	30.6	Very low	64 Å²	64	108.8 Å²	108.8	42%	0.416	64%	0.639	S	S	.	*			trans	-83.1	85.2	-173.8	33.6	-34	0	0	0	110.7	L529 I533	L529-P531 WeakPolarHBondContact O-CD 3.24Å; P531-I533 PolarHBondContact O-N 2.79Å
532	S	25.8	Very low	31	Very low	103 Å²	103	99.2 Å²	99.2	72%	0.72	61%	0.605	S	S	*	*			trans	-56.6	108.8	165.3	-69.7	0	0	0	0	109.9	E530 I534	E530-S532 PolarHBondContact O-N 2.72Å; S532-I534 PolarHBondContact O-N 3.4Å; S532-I534 VanDerWaalsContact O-N 3.14Å
533	I	31.2	Very low	31.9	Very low	153 Å²	153	97.3 Å²	97.3	79%	0.785	59%	0.585	S	S	*	*			trans	-71	110.2	-176.6	-59.1	178.5	0	0	0	109.1	P531	P531-I533 PolarHBondContact O-N 2.79Å
534	I	31.5	Very low	32.5	Very low	72 Å²	72	102.7 Å²	102.7	37%	0.369	58%	0.582	S	S	.	*			trans	-114.1	109.5	174.2	-60	178.3	0	0	0	108.5	S532 F536	S532-I534 PolarHBondContact O-N 3.4Å; S532-I534 VanDerWaalsContact O-N 3.14Å; I534-F536 HydrophobicContact CB-CE2 4.07Å; I534-F536 HydrophobicContact CG2-CD2 3.85Å; I534-F536 HydrophobicContact CG2-CE2 3.45Å; I534-F536 VanDerWaalsContact CG2-CE2 3.45Å; I534-F536 HydrophobicContact CG2-CZ 4.21Å; I534-F536 WeakPolarHBondContact O-CD2 3.47Å
535	C	27.4	Very low	33.5	Very low	108 Å²	108	102.8 Å²	102.8	73%	0.73	57%	0.568	S	S	*	*			trans	-73.6	135.7	168.5	-72.2	0	0	0	0	110.6	Q745	C535-Q745 PolarHBondContact O-NE2 3.48Å
536	F	35	Very low	34.6	Very low	66 Å²	66	99.7 Å²	99.7	29%	0.289	55%	0.549	S	S	.	.			trans	-115.7	119.5	175.8	-80.1	-108.6	0	0	0	110.2	I534 G538 F741 Q745	I534-F536 HydrophobicContact CB-CE2 4.07Å; I534-F536 HydrophobicContact CG2-CD2 3.85Å; I534-F536 HydrophobicContact CG2-CE2 3.45Å; I534-F536 VanDerWaalsContact CG2-CE2 3.45Å; I534-F536 HydrophobicContact CG2-CZ 4.21Å; I534-F536 WeakPolarHBondContact O-CD2 3.47Å; F536-G538 PolarHBondContact O-N 2.67Å; F536-F741 HydrophobicContact CE1-CB 4.38Å; F536-F741 HydrophobicContact CZ-CB 4.18Å; F536-Q745 HydrophobicContact CD1-CG 4.19Å; F536-Q745 VanDerWaalsContact CD2-NE2 3.28Å; F536-Q745 HydrophobicContact CE1-CG 3.6Å; F536-Q745 VanDerWaalsContact CE2-NE2 3.34Å; F536-Q745 HydrophobicContact CZ-CG 3.86Å; F536-Q745 VanDerWaalsContact CZ-NE2 3.31Å
537	P	33.8	Very low	35.6	Very low	135 Å²	135	102.9 Å²	102.9	88%	0.877	54%	0.544	S	S	*	.			trans	-83.3	84.8	166.9	33.2	-30.8	0	0	0	109.9
538	G	35.5	Very low	36.3	Very low	16 Å²	16	101.4 Å²	101.4	17%	0.165	54%	0.537	C	S	.	.			trans	-141.4	154.7	178.2	0	0	0	0	0	112	F536 R543	F536-G538 PolarHBondContact O-N 2.67Å; G538-R543 WeakPolarHBondContact O-CD 3.36Å; G538-R543 VanDerWaalsContact O-CG 3.31Å; G538-R543 WeakPolarHBondContact O-CG 3.36Å; G538-R543 PolarHBondContact O-NE 3.38Å; G538-R543 PolarHBondContact O-NH1 3.44Å
539	Q	44.3	Very low	37.4	Very low	171 Å²	171	96.6 Å²	96.6	80%	0.799	51%	0.514	S	S	*	.			trans	-93.7	166.4	-176.2	-66.8	-154.2	26.2	0	0	113.7	T541	Q539-T541 PolarHBondContact O-N 3.23Å
540	G	39.2	Very low	38.4	Very low	44 Å²	44	98.1 Å²	98.1	45%	0.454	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	-91.5	160.5	0	0	0	0	0	117.8
541	T	40.4	Very low	40	Very low	110 Å²	110	96.5 Å²	96.5	68%	0.675	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-45.7	-160	48.7	0	0	0	0	113.4	Q539 R543 R544 L545	Q539-T541 PolarHBondContact O-N 3.23Å; T541-R543 VanDerWaalsContact C-N 3.3Å; T541-R543 PolarHBondContact O-N 3.05Å; T541-R544 WeakPolarHBondContact O-CA 3.46Å; T541-R544 VanDerWaalsContact O-CB 3.31Å; T541-R544 WeakPolarHBondContact O-CB 3.49Å; T541-R544 PolarHBondContact O-N 2.84Å; T541-L545 PolarHBondContact O-N 3.43Å
542	E	40.6	Very low	41.2	Very low	53 Å²	53	93.9 Å²	93.9	25%	0.248	49%	0.491	C	S	.	.	H	α-helix	trans	-59.8	-42.3	176.4	-68.5	-165.2	141.3	0	0	111	R544 L545 V546	E542-R544 PolarHBondContact O-N 3Å; E542-L545 PolarHBondContact O-N 3.38Å; E542-V546 WeakPolarHBondContact O-CB 3.3Å; E542-V546 WeakPolarHBondContact O-CG2 3.48Å; E542-V546 PolarHBondContact O-N 2.85Å
543	R	43	Very low	42.5	Very low	124 Å²	124	93.5 Å²	93.5	47%	0.468	48%	0.48	S	S	.	.	H	α-helix	trans	-61.3	-26.2	173	-71	-163.9	-63.8	-146.8	-0.8	113	G538 T541 R547	G538-R543 WeakPolarHBondContact O-CD 3.36Å; G538-R543 VanDerWaalsContact O-CG 3.31Å; G538-R543 WeakPolarHBondContact O-CG 3.36Å; G538-R543 PolarHBondContact O-NE 3.38Å; G538-R543 PolarHBondContact O-NH1 3.44Å; T541-R543 VanDerWaalsContact C-N 3.3Å; T541-R543 PolarHBondContact O-N 3.05Å; R543-R547 WeakPolarHBondContact O-CB 3.45Å; R543-R547 WeakPolarHBondContact O-CD 3.32Å; R543-R547 WeakPolarHBondContact O-CG 3.31Å; R543-R547 PolarHBondContact O-N 2.79Å
544	R	42	Very low	43.6	Very low	188 Å²	188	89.5 Å²	89.5	71%	0.709	46%	0.46	S	S	*	.	H	α-helix	trans	-79	-40.8	176.5	-152.4	-179.4	-60.8	-161.2	1.7	111.2	T541 E542 S548	T541-R544 WeakPolarHBondContact O-CA 3.46Å; T541-R544 VanDerWaalsContact O-CB 3.31Å; T541-R544 WeakPolarHBondContact O-CB 3.49Å; T541-R544 PolarHBondContact O-N 2.84Å; E542-R544 PolarHBondContact O-N 3Å; R544-S548 WeakPolarHBondContact O-CB 3.46Å; R544-S548 PolarHBondContact O-N 3.15Å
545	L	45.8	Very low	44.6	Very low	65 Å²	65	88.6 Å²	88.6	34%	0.34	46%	0.458	S	S	.	.	H	α-helix	trans	-67	-49.9	174.6	-179.4	59.8	0	0	0	111.8	T541 E542 S548 T549 V814	T541-L545 PolarHBondContact O-N 3.43Å; E542-L545 PolarHBondContact O-N 3.38Å; L545-S548 WeakPolarHBondContact O-CB 3.39Å; L545-S548 PolarHBondContact O-N 2.84Å; L545-S548 VanDerWaalsContact O-N 3.15Å; L545-T549 PolarHBondContact O-N 3.37Å; L545-T549 PolarHBondContact O-OG1 3.12Å; L545-V814 HydrophobicContact CD1-CG2 3.32Å
546	V	46.8	Very low	45.6	Very low	66 Å²	66	86.5 Å²	86.5	40%	0.4	44%	0.439	S	S	.	.	H	α-helix	trans	-65.8	-41.3	178.4	176.3	0	0	0	0	111	E542 T549 Y550	E542-V546 WeakPolarHBondContact O-CB 3.3Å; E542-V546 WeakPolarHBondContact O-CG2 3.48Å; E542-V546 PolarHBondContact O-N 2.85Å; V546-T549 WeakPolarHBondContact CA-OG1 3.3Å; V546-T549 PolarHBondContact O-N 2.88Å; V546-T549 PolarHBondContact O-OG1 3.34Å; V546-Y550 WeakPolarHBondContact O-CB 3.41Å; V546-Y550 PolarHBondContact O-N 3Å
547	R	47.7	Very low	46.2	Very low	175 Å²	175	90.8 Å²	90.8	66%	0.66	45%	0.453	S	S	*	.	H	α-helix	trans	-64.3	-37.5	170.4	-78	175.3	164.5	173.8	-6.4	112.2	R543 Y550 L551	R543-R547 WeakPolarHBondContact O-CB 3.45Å; R543-R547 WeakPolarHBondContact O-CD 3.32Å; R543-R547 WeakPolarHBondContact O-CG 3.31Å; R543-R547 PolarHBondContact O-N 2.79Å; R547-Y550 PolarHBondContact O-N 3.47Å; R547-L551 WeakPolarHBondContact O-CB 3.13Å; R547-L551 WeakPolarHBondContact O-CD1 3.32Å; R547-L551 WeakPolarHBondContact O-CG 3.31Å; R547-L551 PolarHBondContact O-N 3.48Å
548	S	44.4	Very low	46.7	Very low	42 Å²	42	91.2 Å²	91.2	29%	0.294	44%	0.441	S	S	.	.	H	α-helix	trans	-63	-47.2	176	176.8	0	0	0	0	111.3	R544 L545 Y550 L551 L552	R544-S548 WeakPolarHBondContact O-CB 3.46Å; R544-S548 PolarHBondContact O-N 3.15Å; L545-S548 WeakPolarHBondContact O-CB 3.39Å; L545-S548 PolarHBondContact O-N 2.84Å; L545-S548 VanDerWaalsContact O-N 3.15Å; S548-Y550 PolarHBondContact O-N 3.39Å; S548-L551 PolarHBondContact O-N 2.7Å; S548-L552 VanDerWaalsContact O-CB 3.26Å; S548-L552 WeakPolarHBondContact O-CB 3.27Å; S548-L552 PolarHBondContact O-N 3.03Å
549	T	47.4	Very low	47.4	Very low	35 Å²	35	91.6 Å²	91.6	22%	0.215	44%	0.44	C	S	.	.	H	α-helix	trans	-67.3	-34.6	175.3	49.1	0	0	0	0	113.1	L545 V546 L553	L545-T549 PolarHBondContact O-N 3.37Å; L545-T549 PolarHBondContact O-OG1 3.12Å; V546-T549 WeakPolarHBondContact CA-OG1 3.3Å; V546-T549 PolarHBondContact O-N 2.88Å; V546-T549 PolarHBondContact O-OG1 3.34Å; T549-L553 WeakPolarHBondContact O-CB 3.37Å; T549-L553 VanDerWaalsContact O-CG 3.27Å; T549-L553 WeakPolarHBondContact O-CG 3.5Å; T549-L553 PolarHBondContact O-N 3.28Å
550	Y	49.1	Very low	47.4	Very low	132 Å²	132	90.3 Å²	90.3	52%	0.518	43%	0.431	S	S	.	.	H	α-helix	trans	-73.9	-39	177.2	-176.4	-107.9	0	0	0	112.2	V546 R547 S548 L553 L554	V546-Y550 WeakPolarHBondContact O-CB 3.41Å; V546-Y550 PolarHBondContact O-N 3Å; R547-Y550 PolarHBondContact O-N 3.47Å; S548-Y550 PolarHBondContact O-N 3.39Å; Y550-L553 PolarHBondContact O-N 3.32Å; Y550-L554 HydrophobicContact CD1-CD1 3.81Å; Y550-L554 HydrophobicContact CD1-CG 4.39Å; Y550-L554 HydrophobicContact CE1-CD1 3.4Å; Y550-L554 VanDerWaalsContact CE1-CD1 3.4Å; Y550-L554 HydrophobicContact CE1-CG 4.1Å; Y550-L554 WeakPolarHBondContact O-CB 3.34Å; Y550-L554 WeakPolarHBondContact O-CG 3.2Å; Y550-L554 PolarHBondContact O-N 3.45Å
551	L	57.3	Low	47.4	Very low	104 Å²	104	93.4 Å²	93.4	55%	0.545	43%	0.434	S	S	.	.	H	α-helix	trans	-64.8	-43.1	170.9	-76.2	165.7	0	0	0	110.5	R547 S548 L553 L554 V555	R547-L551 WeakPolarHBondContact O-CB 3.13Å; R547-L551 WeakPolarHBondContact O-CD1 3.32Å; R547-L551 WeakPolarHBondContact O-CG 3.31Å; R547-L551 PolarHBondContact O-N 3.48Å; S548-L551 PolarHBondContact O-N 2.7Å; L551-L553 VanDerWaalsContact C-N 3.35Å; L551-L553 PolarHBondContact O-N 3.07Å; L551-L554 CarbonylContact O-C 3.59Å; L551-L554 PolarHBondContact O-N 2.88Å; L551-V555 WeakPolarHBondContact O-CB 3.36Å; L551-V555 VanDerWaalsContact O-CG2 3.25Å; L551-V555 WeakPolarHBondContact O-CG2 3.37Å; L551-V555 PolarHBondContact O-N 3.35Å
552	L	56.2	Low	47.4	Very low	10 Å²	10	95 Å²	95	5%	0.052	43%	0.431	C	S	.	.	H	α-helix	trans	-60.9	-42.8	173	174.9	60.8	0	0	0	111.6	S548 V555 L556 T817 I820 L821	S548-L552 VanDerWaalsContact O-CB 3.26Å; S548-L552 WeakPolarHBondContact O-CB 3.27Å; S548-L552 PolarHBondContact O-N 3.03Å; L552-V555 PolarHBondContact O-N 3.03Å; L552-L556 HydrophobicContact CD1-CD1 4Å; L552-L556 HydrophobicContact CD1-CG 4.12Å; L552-L556 HydrophobicContact CG-CD1 4.01Å; L552-L556 VanDerWaalsContact O-CB 3.29Å; L552-L556 WeakPolarHBondContact O-CB 3.49Å; L552-L556 VanDerWaalsContact O-CG 3.24Å; L552-L556 WeakPolarHBondContact O-CG 3.24Å; L552-L556 PolarHBondContact O-N 3.14Å; L552-T817 HydrophobicContact CD2-CG2 4.16Å; L552-I820 HydrophobicContact CD1-CB 3.99Å; L552-I820 HydrophobicContact CD1-CD1 4.3Å; L552-I820 HydrophobicContact CD1-CG2 3.84Å; L552-I820 HydrophobicContact CD2-CD1 4.48Å; L552-L821 HydrophobicContact CB-CD2 4.44Å; L552-L821 HydrophobicContact CD1-CD2 3.77Å; L552-L821 HydrophobicContact CD1-CG 4.15Å
553	L	54.3	Low	47.3	Very low	95 Å²	95	96.6 Å²	96.6	50%	0.497	45%	0.445	S	S	.	.	H	α-helix	trans	-65.8	-36.8	174.6	-77.3	165.9	0	0	0	112.4	T549 Y550 L551 R557	T549-L553 WeakPolarHBondContact O-CB 3.37Å; T549-L553 VanDerWaalsContact O-CG 3.27Å; T549-L553 WeakPolarHBondContact O-CG 3.5Å; T549-L553 PolarHBondContact O-N 3.28Å; Y550-L553 PolarHBondContact O-N 3.32Å; L551-L553 VanDerWaalsContact C-N 3.35Å; L551-L553 PolarHBondContact O-N 3.07Å; L553-R557 VanDerWaalsContact O-CB 3.23Å; L553-R557 WeakPolarHBondContact O-CB 3.47Å; L553-R557 PolarHBondContact O-N 3.29Å
554	L	53.8	Low	47.2	Very low	68 Å²	68	94.3 Å²	94.3	36%	0.356	44%	0.442	S	S	.	.	H	α-helix	trans	-70.6	-37.7	174	-78.8	176.5	0	0	0	112.7	Y550 L551 R557 K558	Y550-L554 HydrophobicContact CD1-CD1 3.81Å; Y550-L554 HydrophobicContact CD1-CG 4.39Å; Y550-L554 HydrophobicContact CE1-CD1 3.4Å; Y550-L554 VanDerWaalsContact CE1-CD1 3.4Å; Y550-L554 HydrophobicContact CE1-CG 4.1Å; Y550-L554 WeakPolarHBondContact O-CB 3.34Å; Y550-L554 WeakPolarHBondContact O-CG 3.2Å; Y550-L554 PolarHBondContact O-N 3.45Å; L551-L554 CarbonylContact O-C 3.59Å; L551-L554 PolarHBondContact O-N 2.88Å; L554-R557 PolarHBondContact O-N 3.18Å; L554-K558 WeakPolarHBondContact O-CB 3.37Å; L554-K558 PolarHBondContact O-N 3.46Å
555	V	52.3	Low	46.8	Very low	53 Å²	53	90 Å²	90	32%	0.321	43%	0.432	S	S	.	.	H	α-helix	trans	-66.3	-45.6	173.4	166.9	0	0	0	0	109.5	L551 L552 R557 K558 N559	L551-V555 WeakPolarHBondContact O-CB 3.36Å; L551-V555 VanDerWaalsContact O-CG2 3.25Å; L551-V555 WeakPolarHBondContact O-CG2 3.37Å; L551-V555 PolarHBondContact O-N 3.35Å; L552-V555 PolarHBondContact O-N 3.03Å; V555-R557 VanDerWaalsContact C-N 3.3Å; V555-R557 PolarHBondContact O-N 3.15Å; V555-K558 PolarHBondContact O-N 3.44Å; V555-N559 WeakPolarHBondContact CG1-ND2 3.47Å; V555-N559 WeakPolarHBondContact O-CB 3.46Å; V555-N559 PolarHBondContact O-N 3.39Å
556	L	49.3	Very low	46.2	Very low	64 Å²	64	92.7 Å²	92.7	34%	0.335	44%	0.443	S	S	.	.	H	α-helix	trans	-62	-35.6	172.4	-74.6	168.7	0	0	0	112.3	L552 K560 I820	L552-L556 HydrophobicContact CD1-CD1 4Å; L552-L556 HydrophobicContact CD1-CG 4.12Å; L552-L556 HydrophobicContact CG-CD1 4.01Å; L552-L556 VanDerWaalsContact O-CB 3.29Å; L552-L556 WeakPolarHBondContact O-CB 3.49Å; L552-L556 VanDerWaalsContact O-CG 3.24Å; L552-L556 WeakPolarHBondContact O-CG 3.24Å; L552-L556 PolarHBondContact O-N 3.14Å; L556-K560 VanDerWaalsContact O-CB 3.22Å; L556-K560 WeakPolarHBondContact O-CB 3.24Å; L556-K560 PolarHBondContact O-N 2.9Å; L556-I820 HydrophobicContact CD1-CD1 4.2Å; L556-I820 HydrophobicContact CD2-CG2 4.08Å
557	R	47.7	Very low	45.6	Very low	157 Å²	157	91.7 Å²	91.7	59%	0.592	44%	0.442	S	S	*	.	H	α-helix	trans	-69.5	-53	176.1	-165.4	175.8	-163.2	135.4	3.5	111.4	L553 L554 V555 N559 K560 E561	L553-R557 VanDerWaalsContact O-CB 3.23Å; L553-R557 WeakPolarHBondContact O-CB 3.47Å; L553-R557 PolarHBondContact O-N 3.29Å; L554-R557 PolarHBondContact O-N 3.18Å; V555-R557 VanDerWaalsContact C-N 3.3Å; V555-R557 PolarHBondContact O-N 3.15Å; R557-N559 VanDerWaalsContact C-N 3.3Å; R557-N559 PolarHBondContact O-N 3Å; R557-K560 PolarHBondContact O-N 3.38Å; R557-E561 WeakPolarHBondContact O-CB 3.2Å; R557-E561 PolarHBondContact O-N 2.98Å
558	K	44.5	Very low	45	Very low	143 Å²	143	87.4 Å²	87.4	62%	0.622	43%	0.432	S	S	*	.	H	α-helix	trans	-64.1	-31.8	176	-87.6	-155.8	169.5	-167.6	0	112.9	L554 V555 K562	L554-K558 WeakPolarHBondContact O-CB 3.37Å; L554-K558 PolarHBondContact O-N 3.46Å; V555-K558 PolarHBondContact O-N 3.44Å; K558-K562 WeakPolarHBondContact O-CB 3.05Å; K558-K562 VanDerWaalsContact O-CG 3.31Å; K558-K562 WeakPolarHBondContact O-CG 3.32Å; K558-K562 PolarHBondContact O-N 3.18Å
559	N	48.6	Very low	44.5	Very low	25 Å²	25	89.6 Å²	89.6	13%	0.134	44%	0.44	C	S	.	.	H	α-helix	trans	-78.1	-37.9	176.3	-68.7	-8.4	0	0	0	111.1	V555 R557 E561 K562 T563 Y824	V555-N559 WeakPolarHBondContact CG1-ND2 3.47Å; V555-N559 WeakPolarHBondContact O-CB 3.46Å; V555-N559 PolarHBondContact O-N 3.39Å; R557-N559 VanDerWaalsContact C-N 3.3Å; R557-N559 PolarHBondContact O-N 3Å; N559-E561 VanDerWaalsContact C-N 3.26Å; N559-E561 PolarHBondContact O-N 3.24Å; N559-K562 PolarHBondContact O-N 2.82Å; N559-T563 WeakPolarHBondContact O-CB 3.36Å; N559-T563 PolarHBondContact O-N 3.47Å; N559-T563 PolarHBondContact O-OG1 2.99Å; N559-Y824 HydrophobicContact CB-CE1 4.34Å; N559-Y824 WeakPolarHBondContact ND2-CD1 3.48Å; N559-Y824 WeakPolarHBondContact ND2-CE1 3.28Å; N559-Y824 VanDerWaalsContact ND2-CZ 3.27Å
560	K	44.7	Very low	44.2	Very low	144 Å²	144	92.6 Å²	92.6	63%	0.626	45%	0.454	S	S	*	.	H	α-helix	trans	-57.5	-42.5	167.1	-179.9	178.1	177	-177.4	0	111.2	L556 R557 T563 I564	L556-K560 VanDerWaalsContact O-CB 3.22Å; L556-K560 WeakPolarHBondContact O-CB 3.24Å; L556-K560 PolarHBondContact O-N 2.9Å; R557-K560 PolarHBondContact O-N 3.38Å; K560-T563 PolarHBondContact O-N 3.28Å; K560-I564 HydrophobicContact CD-CD1 4.42Å; K560-I564 HydrophobicContact CG-CD1 3.85Å; K560-I564 HydrophobicContact CG-CG1 4.49Å; K560-I564 WeakPolarHBondContact O-CB 3.4Å; K560-I564 VanDerWaalsContact O-CG1 3.27Å; K560-I564 WeakPolarHBondContact O-CG1 3.5Å; K560-I564 PolarHBondContact O-N 3.05Å
561	E	39.9	Very low	43.6	Very low	108 Å²	108	92 Å²	92	51%	0.505	46%	0.456	S	S	.	.	H	α-helix	trans	-66.5	-44.3	177.6	-166.6	162.5	-138.2	0	0	111.8	R557 N559 I564 N565	R557-E561 WeakPolarHBondContact O-CB 3.2Å; R557-E561 PolarHBondContact O-N 2.98Å; N559-E561 VanDerWaalsContact C-N 3.26Å; N559-E561 PolarHBondContact O-N 3.24Å; E561-I564 PolarHBondContact O-N 2.75Å; E561-N565 VanDerWaalsContact O-CB 3.28Å; E561-N565 WeakPolarHBondContact O-CB 3.34Å; E561-N565 PolarHBondContact O-N 3.26Å; E561-N565 PolarHBondContact O-ND2 3.35Å; E561-N565 PolarHBondContact O-OD1 2.98Å
562	K	40.2	Very low	42.5	Very low	143 Å²	143	91 Å²	91	62%	0.622	45%	0.451	S	S	*	.	H	α-helix	trans	-59.7	-43.9	170	-78.6	178.1	173.5	-172.9	0	112.7	K558 N559 N565 H566	K558-K562 WeakPolarHBondContact O-CB 3.05Å; K558-K562 VanDerWaalsContact O-CG 3.31Å; K558-K562 WeakPolarHBondContact O-CG 3.32Å; K558-K562 PolarHBondContact O-N 3.18Å; N559-K562 PolarHBondContact O-N 2.82Å; K562-N565 PolarHBondContact O-N 3.36Å; K562-H566 VanDerWaalsContact O-CB 3.23Å; K562-H566 WeakPolarHBondContact O-CB 3Å; K562-H566 PolarHBondContact O-N 2.97Å
563	T	37.9	Very low	41.4	Very low	87 Å²	87	96.4 Å²	96.4	53%	0.534	48%	0.48	S	S	.	.	H	α-helix	trans	-67.4	-40.6	179.6	-59	0	0	0	0	111.4	N559 K560 H566 A567	N559-T563 WeakPolarHBondContact O-CB 3.36Å; N559-T563 PolarHBondContact O-N 3.47Å; N559-T563 PolarHBondContact O-OG1 2.99Å; K560-T563 PolarHBondContact O-N 3.28Å; T563-H566 PolarHBondContact O-N 3.43Å; T563-A567 VanDerWaalsContact O-CB 3.27Å; T563-A567 WeakPolarHBondContact O-CB 3.36Å; T563-A567 PolarHBondContact O-N 3.47Å
564	I	41.6	Very low	40.3	Very low	77 Å²	77	96.4 Å²	96.4	40%	0.395	49%	0.488	S	S	.	.	H	α-helix	trans	-64.5	-44.9	172.8	-72.2	169.6	0	0	0	110.4	K560 E561 H566 A567 N568	K560-I564 HydrophobicContact CD-CD1 4.42Å; K560-I564 HydrophobicContact CG-CD1 3.85Å; K560-I564 HydrophobicContact CG-CG1 4.49Å; K560-I564 WeakPolarHBondContact O-CB 3.4Å; K560-I564 VanDerWaalsContact O-CG1 3.27Å; K560-I564 WeakPolarHBondContact O-CG1 3.5Å; K560-I564 PolarHBondContact O-N 3.05Å; E561-I564 PolarHBondContact O-N 2.75Å; I564-H566 VanDerWaalsContact C-N 3.35Å; I564-H566 PolarHBondContact O-N 2.76Å; I564-A567 PolarHBondContact O-N 3.49Å; I564-N568 VanDerWaalsContact O-CB 3.29Å; I564-N568 WeakPolarHBondContact O-CB 2.93Å; I564-N568 PolarHBondContact O-N 3.4Å; I564-N568 PolarHBondContact O-ND2 3.31Å; I564-N568 PolarHBondContact O-OD1 3.48Å
565	N	32.5	Very low	39.3	Very low	97 Å²	97	100 Å²	100	52%	0.519	50%	0.498	S	S	.	.	H	α-helix	trans	-67.4	-35	179.4	-67.1	-7.4	0	0	0	112.1	E561 K562 N569	E561-N565 VanDerWaalsContact O-CB 3.28Å; E561-N565 WeakPolarHBondContact O-CB 3.34Å; E561-N565 PolarHBondContact O-N 3.26Å; E561-N565 PolarHBondContact O-ND2 3.35Å; E561-N565 PolarHBondContact O-OD1 2.98Å; K562-N565 PolarHBondContact O-N 3.36Å; N565-N569 VanDerWaalsContact O-CB 3.29Å; N565-N569 WeakPolarHBondContact O-CB 3.49Å; N565-N569 PolarHBondContact O-N 2.97Å
566	H	33.2	Very low	38.4	Very low	121 Å²	121	104.3 Å²	104.3	56%	0.56	52%	0.519	S	S	*	.	H	α-helix	trans	-71.6	-40.5	175.3	-171.5	49.4	0	0	0	111.9	K562 T563 I564 N569 I570	K562-H566 VanDerWaalsContact O-CB 3.23Å; K562-H566 WeakPolarHBondContact O-CB 3Å; K562-H566 PolarHBondContact O-N 2.97Å; T563-H566 PolarHBondContact O-N 3.43Å; I564-H566 VanDerWaalsContact C-N 3.35Å; I564-H566 PolarHBondContact O-N 2.76Å; H566-N569 PolarHBondContact O-N 3.46Å; H566-I570 WeakPolarHBondContact O-CG1 3.42Å; H566-I570 PolarHBondContact O-N 3.37Å
567	A	34.4	Very low	37.7	Very low	46 Å²	46	109.7 Å²	109.7	38%	0.38	55%	0.545	S	S	.	.	H	α-helix	trans	-63.2	-45.4	172.4	0	0	0	0	0	111.6	T563 I564 N569 I570 Q571	T563-A567 VanDerWaalsContact O-CB 3.27Å; T563-A567 WeakPolarHBondContact O-CB 3.36Å; T563-A567 PolarHBondContact O-N 3.47Å; I564-A567 PolarHBondContact O-N 3.49Å; A567-N569 VanDerWaalsContact C-N 3.28Å; A567-N569 PolarHBondContact O-N 2.94Å; A567-I570 PolarHBondContact O-N 2.86Å; A567-Q571 WeakPolarHBondContact O-CB 3.45Å; A567-Q571 PolarHBondContact O-N 3.08Å
568	N	36.6	Very low	36.8	Very low	84 Å²	84	110 Å²	110	45%	0.449	56%	0.558	S	S	.	*	H	α-helix	trans	-63.4	-32.8	174.8	-68.6	-7.6	0	0	0	112	I564 N572	I564-N568 VanDerWaalsContact O-CB 3.29Å; I564-N568 WeakPolarHBondContact O-CB 2.93Å; I564-N568 PolarHBondContact O-N 3.4Å; I564-N568 PolarHBondContact O-ND2 3.31Å; I564-N568 PolarHBondContact O-OD1 3.48Å; N568-N572 VanDerWaalsContact O-CB 3.3Å; N568-N572 WeakPolarHBondContact O-CB 3.32Å; N568-N572 PolarHBondContact O-N 3.38Å; N568-N572 PolarHBondContact O-OD1 3.03Å
569	N	34	Very low	36.1	Very low	88 Å²	88	108.2 Å²	108.2	47%	0.471	56%	0.564	S	S	.	*	H	α-helix	trans	-72.6	-48.2	176.8	-157.2	49.6	0	0	0	111.7	N565 H566 A567 Q571 N572 D573	N565-N569 VanDerWaalsContact O-CB 3.29Å; N565-N569 WeakPolarHBondContact O-CB 3.49Å; N565-N569 PolarHBondContact O-N 2.97Å; H566-N569 PolarHBondContact O-N 3.46Å; A567-N569 VanDerWaalsContact C-N 3.28Å; A567-N569 PolarHBondContact O-N 2.94Å; N569-Q571 PolarHBondContact O-N 3.32Å; N569-N572 WeakPolarHBondContact O-CA 3.42Å; N569-N572 WeakPolarHBondContact O-CB 3.35Å; N569-N572 PolarHBondContact O-N 3.13Å; N569-D573 PolarHBondContact O-N 3.48Å
570	I	39.4	Very low	35.3	Very low	99 Å²	99	114.7 Å²	114.7	51%	0.508	59%	0.593	S	S	.	*	H	α-helix	trans	-58.5	-36.5	173.8	-71.6	169.8	0	0	0	111.2	H566 A567	H566-I570 WeakPolarHBondContact O-CG1 3.42Å; H566-I570 PolarHBondContact O-N 3.37Å; A567-I570 PolarHBondContact O-N 2.86Å
571	Q	37.1	Very low	34.4	Very low	119 Å²	119	114 Å²	114	56%	0.556	60%	0.604	S	S	*	*	H	α-helix	trans	-72.3	-37.9	176.2	-166.9	143.6	-9	0	0	111.2	A567 N569 S574 Y575	A567-Q571 WeakPolarHBondContact O-CB 3.45Å; A567-Q571 PolarHBondContact O-N 3.08Å; N569-Q571 PolarHBondContact O-N 3.32Å; Q571-S574 WeakPolarHBondContact O-CB 3.49Å; Q571-S574 PolarHBondContact O-N 3.47Å; Q571-S574 VanDerWaalsContact O-N 3.15Å; Q571-Y575 HydrophobicContact CB-CE1 4.46Å; Q571-Y575 HydrophobicContact CG-CE1 3.55Å; Q571-Y575 VanDerWaalsContact O-CD1 3.31Å; Q571-Y575 WeakPolarHBondContact O-CD1 3.35Å; Q571-Y575 WeakPolarHBondContact O-CE1 3.41Å
572	N	33.5	Very low	34	Very low	82 Å²	82	114.9 Å²	114.9	44%	0.439	61%	0.613	S	S	.	*	H	α-helix	trans	-64	-42.4	173.6	-75.7	-2.8	0	0	0	113.9	N568 N569 S574 Y575	N568-N572 VanDerWaalsContact O-CB 3.3Å; N568-N572 WeakPolarHBondContact O-CB 3.32Å; N568-N572 PolarHBondContact O-N 3.38Å; N568-N572 PolarHBondContact O-OD1 3.03Å; N569-N572 WeakPolarHBondContact O-CA 3.42Å; N569-N572 WeakPolarHBondContact O-CB 3.35Å; N569-N572 PolarHBondContact O-N 3.13Å; N572-S574 PolarHBondContact O-N 3.05Å; N572-Y575 VanDerWaalsContact CA-CE2 3.46Å; N572-Y575 HydrophobicContact CB-CE2 4.25Å; N572-Y575 PolarHBondContact O-N 2.95Å; N572-Y575 WeakPolarHBondContact OD1-CE2 3.34Å; N572-Y575 PolarHBondContact OD1-OH 2.74Å
573	D	33.7	Very low	33.8	Very low	125 Å²	125	117.7 Å²	117.7	67%	0.668	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-7.7	175	-67.2	-32.1	0	0	0	112.6	N569	N569-D573 PolarHBondContact O-N 3.48Å
574	S	31	Very low	33.7	Very low	95 Å²	95	119.8 Å²	119.8	66%	0.664	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	2.4	-174.1	-170.8	0	0	0	0	115.4	Q571 N572	Q571-S574 WeakPolarHBondContact O-CB 3.49Å; Q571-S574 PolarHBondContact O-N 3.47Å; Q571-S574 VanDerWaalsContact O-N 3.15Å; N572-S574 PolarHBondContact O-N 3.05Å
575	Y	33.6	Very low	33	Very low	144 Å²	144	120.1 Å²	120.1	57%	0.565	66%	0.662	S	S	*	*	S	Bend	trans	-122.3	3.8	175.7	18.9	-105.6	0	0	0	117.3	Q571 N572	Q571-Y575 HydrophobicContact CB-CE1 4.46Å; Q571-Y575 HydrophobicContact CG-CE1 3.55Å; Q571-Y575 VanDerWaalsContact O-CD1 3.31Å; Q571-Y575 WeakPolarHBondContact O-CD1 3.35Å; Q571-Y575 WeakPolarHBondContact O-CE1 3.41Å; N572-Y575 VanDerWaalsContact CA-CE2 3.46Å; N572-Y575 HydrophobicContact CB-CE2 4.25Å; N572-Y575 PolarHBondContact O-N 2.95Å; N572-Y575 WeakPolarHBondContact OD1-CE2 3.34Å; N572-Y575 PolarHBondContact OD1-OH 2.74Å
576	D	32.5	Very low	32.9	Very low	142 Å²	142	118.8 Å²	118.8	76%	0.759	67%	0.671	S	S	*	*	S	Bend	trans	-93.8	14.8	178.4	-118.4	-61	0	0	0	114.4
577	M	35.5	Very low	32.7	Very low	178 Å²	178	120.7 Å²	120.7	88%	0.877	69%	0.686	S	S	*	*	S	Bend	trans	-138.3	47	-174.6	-77.5	-68.4	147.1	0	0	114.6
578	D	28.7	Very low	32.5	Very low	164 Å²	164	121.1 Å²	121.1	88%	0.877	70%	0.695	S	S	*	*			trans	-154.9	81	158.3	-145.1	-20.1	0	0	0	114.1
579	S	30.4	Very low	32.3	Very low	104 Å²	104	126.8 Å²	126.8	73%	0.727	71%	0.711	S	S	*	*			trans	-165.9	81.8	163.1	179.1	0	0	0	0	113.1
580	H	30.8	Very low	32.2	Very low	161 Å²	161	131.5 Å²	131.5	75%	0.745	73%	0.73	S	S	*	*			trans	177.7	112.5	132.7	-103.2	-77.6	0	0	0	109.8	D582	H580-D582 IonicContact CE1-OD2 3.37Å; H580-D582 IonicContact ND1-OD2 2.77Å; H580-D582 PolarHBondContact ND1-OD2 3.32Å
581	C	27.1	Very low	31.7	Very low	129 Å²	129	131.1 Å²	131.1	87%	0.872	74%	0.742	S	S	*	*			trans	-134.1	79.7	168.2	-170.1	0	0	0	0	109.1
582	D	30	Very low	31.3	Very low	127 Å²	127	133.7 Å²	133.7	68%	0.679	76%	0.759	S	S	*	*			trans	-73.9	131.8	172.9	-77.7	-80	0	0	0	110.7	H580 P584	H580-D582 IonicContact CE1-OD2 3.37Å; H580-D582 IonicContact ND1-OD2 2.77Å; H580-D582 PolarHBondContact ND1-OD2 3.32Å; D582-P584 WeakPolarHBondContact O-CD 3.4Å
583	K	37.4	Very low	31.1	Very low	203 Å²	203	133.4 Å²	133.4	88%	0.883	78%	0.776	S	S	*	*			trans	-79.7	139.5	172.9	-69.3	178.4	178.6	175.6	0	110.5
584	P	34.7	Very low	31.1	Very low	130 Å²	130	135.4 Å²	135.4	84%	0.844	78%	0.781	S	S	*	*			trans	-124.1	153.8	139.6	36.2	-28.5	0	0	0	112	D582	D582-P584 WeakPolarHBondContact O-CD 3.4Å
585	G	26.7	Very low	31.2	Very low	84 Å²	84	136.6 Å²	136.6	87%	0.866	79%	0.789	S	S	*	*			trans	-177.1	111.4	172	0	0	0	0	0	111.3
586	G	30.2	Very low	31.1	Very low	69 Å²	69	136.5 Å²	136.5	71%	0.711	80%	0.799	S	S	*	*			trans	156.8	128.1	179.8	0	0	0	0	0	111.2
587	D	28.7	Very low	31	Very low	161 Å²	161	135 Å²	135	86%	0.861	80%	0.8	S	S	*	*			trans	59.5	144	171.3	-48.3	-27	0	0	0	117.7
588	G	31.4	Very low	30.9	Very low	55 Å²	55	135 Å²	135	57%	0.567	80%	0.797	S	S	*	*			cis	174.9	175.3	-6.4	0	0	0	0	0	112.1
589	Y	32.3	Very low	31	Very low	204 Å²	204	133.3 Å²	133.3	80%	0.8	79%	0.793	S	S	*	*			trans	77	120	163.7	-40.9	-71.8	0	0	0	120.6
590	H	31.6	Very low	31.1	Very low	186 Å²	186	138.8 Å²	138.8	86%	0.861	80%	0.798	S	S	*	*			trans	9.7	140.8	147.6	-49.7	-88.7	0	0	0	120
591	A	28	Very low	31	Very low	92 Å²	92	136.5 Å²	136.5	76%	0.76	80%	0.8	S	S	*	*			cis	-177.9	148.8	46.1	0	0	0	0	0	113.9
592	N	29.4	Very low	30.9	Very low	172 Å²	172	140 Å²	140	92%	0.92	80%	0.803	S	S	*	*			trans	37.3	123.5	138.9	-157.1	35.5	0	0	0	122
593	G	29.3	Very low	31.2	Very low	77 Å²	77	138 Å²	138	79%	0.794	80%	0.804	S	S	*	*			trans	173.9	90	166.9	0	0	0	0	0	115.2
594	H	34	Very low	30.7	Very low	166 Å²	166	137.3 Å²	137.3	77%	0.769	81%	0.806	S	S	*	*			trans	-91.7	130.1	172.7	-148.9	-67.9	0	0	0	109.8	D596	H594-D596 IonicContact CE1-OD2 3.93Å; H594-D596 IonicContact ND1-OD2 3.9Å
595	S	33	Very low	30.8	Very low	120 Å²	120	139 Å²	139	84%	0.839	81%	0.805	S	S	*	*			trans	-170.8	119.8	160.4	-79.9	0	0	0	0	111.7
596	D	30.7	Very low	31	Very low	143 Å²	143	138.5 Å²	138.5	77%	0.765	80%	0.8	S	S	*	*			trans	-79.3	145.3	170	-52.9	-87.8	0	0	0	111.5	H594	H594-D596 IonicContact CE1-OD2 3.93Å; H594-D596 IonicContact ND1-OD2 3.9Å
597	S	30.7	Very low	31	Very low	111 Å²	111	144 Å²	144	78%	0.776	81%	0.807	S	S	*	*			trans	-157.2	96.5	164.9	-168.3	0	0	0	0	110.8	V599	S597-V599 PolarHBondContact O-N 3.13Å
598	E	34.1	Very low	31.1	Very low	176 Å²	176	142 Å²	142	82%	0.822	81%	0.805	S	S	*	*			trans	-74.6	114.8	170.3	-67.2	-170.3	140.7	0	0	110.1
599	V	30.8	Very low	31.1	Very low	129 Å²	129	147.8 Å²	147.8	78%	0.782	82%	0.818	S	S	*	*			trans	-131.3	124.3	158.8	-178.7	0	0	0	0	107.7	S597	S597-V599 PolarHBondContact O-N 3.13Å
600	W	33.2	Very low	31.9	Very low	220 Å²	220	142.4 Å²	142.4	83%	0.833	81%	0.808	S	S	*	*			trans	-77.6	131.4	-172.5	-71.6	61.5	0	0	0	111.9
601	S	28.6	Very low	33.2	Very low	113 Å²	113	144.6 Å²	144.6	79%	0.79	81%	0.809	S	S	*	*				176	158.3	115.4	-78.6	0	0	0	0	114.5
602	E	24.7	Very low	35.3	Very low	201 Å²	201	142.8 Å²	142.8	94%	0.939	78%	0.782	S	S	*	*			trans	76.1	128.8	156.4	-152.1	138.4	-139.5	0	0	118.5
603	A	35	Very low	37.5	Very low	85 Å²	85	138.8 Å²	138.8	70%	0.702	77%	0.766	S	S	*	*			trans	-106.6	116	-168	0	0	0	0	0	112.3	M605	A603-M605 VanDerWaalsContact C-N 3.27Å; A603-M605 PolarHBondContact O-N 3.43Å
604	M	28.6	Very low	39.9	Very low	189 Å²	189	142.6 Å²	142.6	93%	0.931	76%	0.756	S	S	*	*			trans	-84.2	63.2	175.7	-159.9	65.7	170.7	0	0	112.1	G606	M604-G606 VanDerWaalsContact C-N 3.3Å; M604-G606 PolarHBondContact O-N 2.9Å
605	M	36.3	Very low	42.2	Very low	167 Å²	167	137.5 Å²	137.5	82%	0.823	73%	0.734	S	S	*	*			trans	-71.1	82.1	174	-85.8	-70.2	-74	0	0	111.1	A603 Q607	A603-M605 VanDerWaalsContact C-N 3.27Å; A603-M605 PolarHBondContact O-N 3.43Å; M605-Q607 PolarHBondContact O-N 2.95Å
606	G	31.2	Very low	44.3	Very low	73 Å²	73	137.6 Å²	137.6	75%	0.753	74%	0.735	S	S	*	*			trans	-88.2	23.4	-173.4	0	0	0	0	0	116.7	M604	M604-G606 VanDerWaalsContact C-N 3.3Å; M604-G606 PolarHBondContact O-N 2.9Å
607	Q	28.6	Very low	46.7	Very low	183 Å²	183	134 Å²	134	86%	0.855	71%	0.713	S	S	*	*			trans	-108.1	115.7	171	-69	-152.1	-1.5	0	0	110.3	M605 E609	M605-Q607 PolarHBondContact O-N 2.95Å; Q607-E609 PolarHBondContact O-N 3.4Å; Q607-E609 VanDerWaalsContact O-N 3.13Å
608	S	31.4	Very low	48.8	Very low	119 Å²	119	133.7 Å²	133.7	83%	0.832	71%	0.706	S	S	*	*			trans	-76.3	100.2	-177.5	55.3	0	0	0	0	111.1
609	E	32.5	Very low	50.8	Low	177 Å²	177	131.4 Å²	131.4	83%	0.827	70%	0.699	S	S	*	*			trans	-52.2	139.6	164.3	-167.9	174.5	-150.2	0	0	110.6	Q607 R611	Q607-E609 PolarHBondContact O-N 3.4Å; Q607-E609 VanDerWaalsContact O-N 3.13Å; E609-R611 PolarHBondContact O-N 3.4Å
610	P	47.4	Very low	53	Low	92 Å²	92	128.9 Å²	128.9	60%	0.597	68%	0.684	S	S	*	*			trans	-64.2	110.5	-177	24.5	-34.3	0	0	0	111.5	R612	P610-R612 PolarHBondContact O-N 3.21Å
611	R	59.9	Low	55.4	Low	232 Å²	232	123 Å²	123	88%	0.875	67%	0.672	S	S	*	*	S	Bend	trans	-49.2	-17.5	-172.9	-104	-178.5	177.1	157.2	0	117.6	E609	E609-R611 PolarHBondContact O-N 3.4Å
612	R	71.6	Confident	58.3	Low	54 Å²	54	120.7 Å²	120.7	20%	0.204	65%	0.649	C	S	.	*	S	Bend	trans	-140.8	145.5	170.8	-61.9	-167.2	-168.8	86.9	18.1	110.4	P610 R614 D843 W867 E871	P610-R612 PolarHBondContact O-N 3.21Å; R612-R614 PolarHBondContact O-N 3.13Å; R612-D843 IonicContact CZ-OD2 2.63Å; R612-D843 IonicContact NH1-OD2 2.8Å; R612-D843 PolarHBondContact NH1-OD2 2.7Å; R612-D843 IonicContact NH2-OD2 3.22Å; R612-D843 PolarHBondContact NH2-OD2 3.14Å; R612-W867 HydrophobicContact CB-CD2 4.12Å; R612-W867 HydrophobicContact CB-CG 4.41Å; R612-W867 HydrophobicContact CB-CZ2 3.77Å; R612-W867 VanDerWaalsContact CD-CD2 3.42Å; R612-W867 HydrophobicContact CG-CD2 4.42Å; R612-E871 IonicContact NE-OE1 3.38Å
613	P	75.3	Confident	61.5	Low	88 Å²	88	115.8 Å²	115.8	57%	0.571	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-56.2	129.9	176.9	-26.1	34.8	0	0	0	113	Q863 W867	P613-Q863 PolarHBondContact O-NE2 2.89Å; P613-Q863 VanDerWaalsContact O-NE2 3.15Å; P613-W867 PolarHBondContact O-NE1 3.02Å
614	R	81	Confident	64.3	Low	157 Å²	157	112.4 Å²	112.4	59%	0.592	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-95.7	138.5	173.6	-69.5	-172.5	174.9	-124.6	-8.3	110.7	R612 D843 Q863	R612-R614 PolarHBondContact O-N 3.13Å; R614-D843 PolarHBondContact NH2-O 3.03Å; R614-Q863 VanDerWaalsContact CA-OE1 3.28Å
615	L	81.7	Confident	67.5	Low	58 Å²	58	107.4 Å²	107.4	30%	0.304	58%	0.579	S	S	.	*	P	Polyproline II helix	trans	-72.7	131.4	175	-68.4	177.4	0	0	0	110.1	F617 R862 H866	L615-F617 HydrophobicContact CB-CD2 4.36Å; L615-F617 HydrophobicContact CB-CE1 4.42Å; L615-F617 HydrophobicContact CB-CE2 3.81Å; L615-F617 HydrophobicContact CB-CZ 3.84Å; L615-F617 HydrophobicContact CD1-CE1 4.17Å; L615-F617 HydrophobicContact CD1-CE2 4.5Å; L615-F617 HydrophobicContact CD1-CZ 3.74Å; L615-F617 HydrophobicContact CG-CZ 4.45Å; L615-F617 PolarHBondContact O-N 3.25Å; L615-R862 HydrophobicContact CD1-CB 4.12Å; L615-H866 HydrophobicContact CD1-CB 3.94Å; L615-H866 HydrophobicContact CD2-CB 4.12Å; L615-H866 HydrophobicContact CG-CB 4.11Å
616	S	77	Confident	70.3	Confident	122 Å²	122	104.5 Å²	104.5	85%	0.853	56%	0.56	S	S	*	*			trans	-76.6	113.9	162.3	43.6	0	0	0	0	109.4
617	F	81.3	Confident	73.3	Confident	69 Å²	69	102.2 Å²	102.2	30%	0.303	53%	0.529	S	S	.	.			trans	-93.6	125.8	171.6	-64.6	-79.5	0	0	0	109.5	L615 R859 R862	L615-F617 HydrophobicContact CB-CD2 4.36Å; L615-F617 HydrophobicContact CB-CE1 4.42Å; L615-F617 HydrophobicContact CB-CE2 3.81Å; L615-F617 HydrophobicContact CB-CZ 3.84Å; L615-F617 HydrophobicContact CD1-CE1 4.17Å; L615-F617 HydrophobicContact CD1-CE2 4.5Å; L615-F617 HydrophobicContact CD1-CZ 3.74Å; L615-F617 HydrophobicContact CG-CZ 4.45Å; L615-F617 PolarHBondContact O-N 3.25Å; F617-R859 HydrophobicContact CB-CG 4.5Å; F617-R859 HydrophobicContact CD1-CG 3.91Å; F617-R859 HydrophobicContact CD2-CB 4.25Å; F617-R859 HydrophobicContact CD2-CG 3.99Å; F617-R859 HydrophobicContact CE1-CB 4.3Å; F617-R859 HydrophobicContact CE1-CG 4.07Å; F617-R859 HydrophobicContact CE2-CB 3.94Å; F617-R859 HydrophobicContact CE2-CG 4.15Å; F617-R859 HydrophobicContact CG-CG 3.86Å; F617-R859 HydrophobicContact CZ-CB 3.97Å; F617-R859 HydrophobicContact CZ-CG 4.19Å; F617-R859 VanDerWaalsContact CZ-O 3.27Å; F617-R859 WeakPolarHBondContact CZ-O 3.18Å; F617-R862 HydrophobicContact CE1-CB 3.99Å; F617-R862 HydrophobicContact CZ-CB 4.1Å
618	T	74.4	Confident	76.5	Confident	104 Å²	104	93.6 Å²	93.6	64%	0.638	49%	0.489	S	S	*	.			trans	-81.2	132.5	170.5	51.7	0	0	0	0	109.9	T620	T618-T620 WeakPolarHBondContact CB-OG1 3.42Å; T618-T620 PolarHBondContact O-N 3.41Å; T618-T620 PolarHBondContact OG1-OG1 3.49Å
619	D	76.1	Confident	79.7	Confident	127 Å²	127	94.8 Å²	94.8	68%	0.679	48%	0.481	S	S	*	.			trans	-73.6	15	175.2	-69.8	-53.3	0	0	0	113.6	V621 R859	D619-V621 PolarHBondContact O-N 3.01Å; D619-R859 IonicContact OD1-CZ 3.54Å; D619-R859 IonicContact OD1-NH1 2.69Å; D619-R859 PolarHBondContact OD1-NH1 2.99Å; D619-R859 IonicContact OD1-NH2 2.63Å; D619-R859 PolarHBondContact OD1-NH2 3Å
620	T	77.8	Confident	82.7	Confident	76 Å²	76	88.6 Å²	88.6	47%	0.466	45%	0.452	S	S	.	.			trans	-64.3	99.3	172.1	47.8	0	0	0	0	110.8	T618 H622	T618-T620 WeakPolarHBondContact CB-OG1 3.42Å; T618-T620 PolarHBondContact O-N 3.41Å; T618-T620 PolarHBondContact OG1-OG1 3.49Å; T620-H622 PolarHBondContact O-CE1 2.95Å; T620-H622 PolarHBondContact O-N 3.34Å; T620-H622 PolarHBondContact O-ND1 3.45Å; T620-H622 PolarHBondContact OG1-CE1 3.34Å
621	V	82.6	Confident	85.1	Confident	96 Å²	96	84.2 Å²	84.2	58%	0.582	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-74	120	172.3	-176.2	0	0	0	0	109.2	D619	D619-V621 PolarHBondContact O-N 3.01Å
622	H	90.2	Very high	86.9	Confident	66 Å²	66	75.1 Å²	75.1	31%	0.306	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-96.8	169.7	177.3	-61.6	64.1	0	0	0	111.6	T620 Y626 Y627	T620-H622 PolarHBondContact O-CE1 2.95Å; T620-H622 PolarHBondContact O-N 3.34Å; T620-H622 PolarHBondContact O-ND1 3.45Å; T620-H622 PolarHBondContact OG1-CE1 3.34Å; H622-Y626 HydrophobicContact CB-CD1 3.4Å; H622-Y626 HydrophobicContact CB-CE1 4Å; H622-Y626 HydrophobicContact CB-CG 3.95Å; H622-Y626 AromaticContact CD2-CD1 3.42Å; H622-Y626 VanDerWaalsContact CD2-CD1 3.42Å; H622-Y626 WeakPolarHBondContact CD2-CD1 3.37Å; H622-Y626 AromaticContact CD2-CD2 3.97Å; H622-Y626 AromaticContact CD2-CE1 3.3Å; H622-Y626 WeakPolarHBondContact CD2-CE1 3.47Å; H622-Y626 AromaticContact CD2-CE2 3.87Å; H622-Y626 AromaticContact CD2-CG 3.76Å; H622-Y626 AromaticContact CD2-CZ 3.53Å; H622-Y626 AromaticContact CG-CD1 3.57Å; H622-Y626 AromaticContact CG-CE1 3.65Å; H622-Y626 AromaticContact NE2-CE1 3.83Å; H622-Y626 AromaticContact NE2-CZ 3.8Å; H622-Y627 HydrophobicContact CB-CD2 4.22Å; H622-Y627 HydrophobicContact CB-CE1 4.28Å; H622-Y627 HydrophobicContact CB-CE2 3.66Å; H622-Y627 PolarHBondContact N-OH 3.39Å; H622-Y627 WeakPolarHBondContact O-CE2 3.36Å
623	T	92.7	Very high	88.1	Confident	97 Å²	97	78.7 Å²	78.7	60%	0.595	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-75.8	158.2	175.8	61.8	0	0	0	0	111.9	E625 Y626 Y627	T623-E625 VanDerWaalsContact C-N 3.26Å; T623-E625 PolarHBondContact O-N 2.83Å; T623-Y626 PolarHBondContact O-N 2.96Å; T623-Y627 VanDerWaalsContact O-CD2 3.27Å; T623-Y627 WeakPolarHBondContact O-CD2 3.47Å; T623-Y627 PolarHBondContact O-N 3.29Å
624	A	93.8	Very high	89.2	Confident	15 Å²	15	74.9 Å²	74.9	12%	0.124	38%	0.379	C	S	.	.	H	α-helix	trans	-56.8	-39.4	175.6	0	0	0	0	0	112.4	Y626 Y627 M628 C661 A664 M665	A624-Y626 VanDerWaalsContact C-N 3.35Å; A624-Y626 PolarHBondContact O-N 3.38Å; A624-Y627 PolarHBondContact O-N 2.97Å; A624-M628 WeakPolarHBondContact O-CB 3.36Å; A624-M628 PolarHBondContact O-N 3.37Å; A624-C661 PolarHBondContact O-SG 3.08Å; A624-A664 HydrophobicContact CB-CB 3.99Å; A624-M665 HydrophobicContact CB-CG 3.72Å
625	E	93.9	Very high	89.9	Confident	83 Å²	83	69.3 Å²	69.3	39%	0.388	36%	0.359	S	S	.	.	H	α-helix	trans	-67.2	-34.1	-178.1	-148.4	65	-140.7	0	0	112.4	T623 M628 Q629 K673	T623-E625 VanDerWaalsContact C-N 3.26Å; T623-E625 PolarHBondContact O-N 2.83Å; E625-M628 PolarHBondContact O-N 2.9Å; E625-Q629 WeakPolarHBondContact O-CB 3.42Å; E625-Q629 PolarHBondContact O-N 3.36Å; E625-K673 IonicContact OE1-NZ 3.19Å; E625-K673 IonicContact OE2-NZ 2.7Å; E625-K673 PolarHBondContact OE2-NZ 3.36Å
626	Y	95.4	Very high	90.7	Very high	107 Å²	107	71.5 Å²	71.5	42%	0.42	37%	0.367	S	S	.	.	H	α-helix	trans	-61.9	-52.6	171	170.6	-91.7	0	0	0	111.4	H622 T623 A624 M628 Q629 E630	H622-Y626 HydrophobicContact CB-CD1 3.4Å; H622-Y626 HydrophobicContact CB-CE1 4Å; H622-Y626 HydrophobicContact CB-CG 3.95Å; H622-Y626 AromaticContact CD2-CD1 3.42Å; H622-Y626 VanDerWaalsContact CD2-CD1 3.42Å; H622-Y626 WeakPolarHBondContact CD2-CD1 3.37Å; H622-Y626 AromaticContact CD2-CD2 3.97Å; H622-Y626 AromaticContact CD2-CE1 3.3Å; H622-Y626 WeakPolarHBondContact CD2-CE1 3.47Å; H622-Y626 AromaticContact CD2-CE2 3.87Å; H622-Y626 AromaticContact CD2-CG 3.76Å; H622-Y626 AromaticContact CD2-CZ 3.53Å; H622-Y626 AromaticContact CG-CD1 3.57Å; H622-Y626 AromaticContact CG-CE1 3.65Å; H622-Y626 AromaticContact NE2-CE1 3.83Å; H622-Y626 AromaticContact NE2-CZ 3.8Å; T623-Y626 PolarHBondContact O-N 2.96Å; A624-Y626 VanDerWaalsContact C-N 3.35Å; A624-Y626 PolarHBondContact O-N 3.38Å; Y626-M628 VanDerWaalsContact C-N 3.26Å; Y626-M628 PolarHBondContact O-N 3.42Å; Y626-Q629 PolarHBondContact O-N 2.92Å; Y626-Q629 VanDerWaalsContact O-N 3.11Å; Y626-E630 PolarHBondContact O-N 3.02Å
627	Y	95.6	Very high	91.6	Very high	25 Å²	25	70.6 Å²	70.6	10%	0.098	35%	0.348	C	S	.	.	H	α-helix	trans	-62.6	-34.8	179.3	-70.1	-60.8	0	0	0	111.9	H622 T623 A624 E630 A631 E660 A664	H622-Y627 HydrophobicContact CB-CD2 4.22Å; H622-Y627 HydrophobicContact CB-CE1 4.28Å; H622-Y627 HydrophobicContact CB-CE2 3.66Å; H622-Y627 PolarHBondContact N-OH 3.39Å; H622-Y627 WeakPolarHBondContact O-CE2 3.36Å; T623-Y627 VanDerWaalsContact O-CD2 3.27Å; T623-Y627 WeakPolarHBondContact O-CD2 3.47Å; T623-Y627 PolarHBondContact O-N 3.29Å; A624-Y627 PolarHBondContact O-N 2.97Å; Y627-E630 PolarHBondContact O-N 2.99Å; Y627-A631 WeakPolarHBondContact O-CB 3.36Å; Y627-A631 PolarHBondContact O-N 2.86Å; Y627-E660 HydrophobicContact CD1-CB 3.47Å; Y627-E660 VanDerWaalsContact CD1-CB 3.47Å; Y627-E660 HydrophobicContact CD1-CG 4.29Å; Y627-E660 WeakPolarHBondContact CD1-OE2 3.38Å; Y627-E660 HydrophobicContact CD2-CB 4Å; Y627-E660 HydrophobicContact CE1-CB 3.62Å; Y627-E660 HydrophobicContact CE1-CG 4.06Å; Y627-E660 WeakPolarHBondContact CE1-OE2 3.31Å; Y627-E660 HydrophobicContact CE2-CB 4.11Å; Y627-E660 HydrophobicContact CG-CB 3.69Å; Y627-A664 HydrophobicContact CD2-CB 4.24Å; Y627-A664 HydrophobicContact CE2-CB 4.49Å
628	M	95.8	Very high	92.4	Very high	1 Å²	1	67.3 Å²	67.3	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-65.3	-40.2	173.4	-170.5	-179.8	-64.4	0	0	112.6	W54 A624 E625 Y626 K632 M678	W54-M628 HydrophobicContact CH2-CE 3.8Å; W54-M628 HydrophobicContact CH2-CG 4.13Å; W54-M628 HydrophobicContact CH2-SD 3.61Å; W54-M628 HydrophobicContact CZ2-CE 3.82Å; W54-M628 HydrophobicContact CZ2-SD 4.05Å; A624-M628 WeakPolarHBondContact O-CB 3.36Å; A624-M628 PolarHBondContact O-N 3.37Å; E625-M628 PolarHBondContact O-N 2.9Å; Y626-M628 VanDerWaalsContact C-N 3.26Å; Y626-M628 PolarHBondContact O-N 3.42Å; M628-K632 HydrophobicContact CG-CD 4.24Å; M628-K632 WeakPolarHBondContact O-CB 3.39Å; M628-K632 WeakPolarHBondContact O-CD 3.39Å; M628-K632 VanDerWaalsContact O-CG 3.24Å; M628-K632 WeakPolarHBondContact O-CG 3.4Å; M628-K632 PolarHBondContact O-N 3.13Å; M628-K632 VanDerWaalsContact O-N 3.07Å; M628-K632 PolarHBondContact SD-NZ 3.46Å; M628-M678 HydrophobicContact CE-CE 3.57Å
629	Q	97	Very high	93.4	Very high	145 Å²	145	65.4 Å²	65.4	68%	0.678	32%	0.32	S	S	*	.	H	α-helix	trans	-66.8	-43.9	176.6	-172	174.5	10.1	0	0	111.2	E625 Y626 K632 R633	E625-Q629 WeakPolarHBondContact O-CB 3.42Å; E625-Q629 PolarHBondContact O-N 3.36Å; Y626-Q629 PolarHBondContact O-N 2.92Å; Y626-Q629 VanDerWaalsContact O-N 3.11Å; Q629-K632 PolarHBondContact O-N 3.23Å; Q629-R633 WeakPolarHBondContact O-CB 3.37Å; Q629-R633 PolarHBondContact O-N 2.91Å
630	E	96.5	Very high	94.5	Very high	46 Å²	46	63.4 Å²	63.4	22%	0.215	32%	0.321	C	S	.	.	H	α-helix	trans	-65.1	-42.1	177.4	178.4	57.3	-169.2	0	0	112.1	Y626 Y627 K632 R633 L634	Y626-E630 PolarHBondContact O-N 3.02Å; Y627-E630 PolarHBondContact O-N 2.99Å; E630-K632 PolarHBondContact O-N 2.93Å; E630-R633 WeakPolarHBondContact O-CB 3.4Å; E630-R633 PolarHBondContact O-N 3.32Å; E630-R633 IonicContact OE1-CZ 2.76Å; E630-R633 IonicContact OE1-NE 2.75Å; E630-R633 IonicContact OE1-NH2 3.57Å; E630-R633 PolarHBondContact OE1-NH2 3.18Å; E630-R633 IonicContact OE2-CZ 3.29Å; E630-R633 IonicContact OE2-NE 3.24Å; E630-R633 PolarHBondContact OE2-NE 3.03Å; E630-R633 IonicContact OE2-NH2 3.22Å; E630-R633 PolarHBondContact OE2-NH2 3.33Å; E630-L634 HydrophobicContact CG-CD1 4.12Å; E630-L634 WeakPolarHBondContact O-CG 3.37Å; E630-L634 PolarHBondContact O-N 3.09Å
631	A	97.4	Very high	95.3	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-61.1	-42.3	174.5	0	0	0	0	0	112.6	Y627 L634 K635 G654 F658	Y627-A631 WeakPolarHBondContact O-CB 3.36Å; Y627-A631 PolarHBondContact O-N 2.86Å; A631-L634 PolarHBondContact O-N 2.81Å; A631-K635 WeakPolarHBondContact O-CB 3.49Å; A631-K635 PolarHBondContact O-N 3.21Å; A631-G654 WeakPolarHBondContact CB-O 3.34Å; A631-F658 HydrophobicContact CB-CB 4.41Å; A631-F658 HydrophobicContact CB-CD1 3.53Å; A631-F658 HydrophobicContact CB-CD2 3.65Å; A631-F658 HydrophobicContact CB-CE1 3.55Å; A631-F658 HydrophobicContact CB-CE2 3.67Å; A631-F658 HydrophobicContact CB-CG 3.57Å; A631-F658 HydrophobicContact CB-CZ 3.62Å
632	K	97.3	Very high	95.8	Very high	41 Å²	41	65 Å²	65	18%	0.178	33%	0.328	C	S	.	.	H	α-helix	trans	-63.4	-41.3	173	-72.9	165.7	-177.4	169.5	0	111.6	L55 M628 Q629 E630 K635 H636	L55-K632 HydrophobicContact CD2-CD 4.3Å; L55-K632 HydrophobicContact CD2-CG 4.34Å; M628-K632 HydrophobicContact CG-CD 4.24Å; M628-K632 WeakPolarHBondContact O-CB 3.39Å; M628-K632 WeakPolarHBondContact O-CD 3.39Å; M628-K632 VanDerWaalsContact O-CG 3.24Å; M628-K632 WeakPolarHBondContact O-CG 3.4Å; M628-K632 PolarHBondContact O-N 3.13Å; M628-K632 VanDerWaalsContact O-N 3.07Å; M628-K632 PolarHBondContact SD-NZ 3.46Å; Q629-K632 PolarHBondContact O-N 3.23Å; E630-K632 PolarHBondContact O-N 2.93Å; K632-K635 PolarHBondContact O-N 3.03Å; K632-H636 VanDerWaalsContact O-CG 3.31Å; K632-H636 PolarHBondContact O-N 2.95Å; K632-H636 PolarHBondContact O-ND1 2.93Å
633	R	97.9	Very high	96	Very high	130 Å²	130	65.7 Å²	65.7	49%	0.491	33%	0.334	S	S	.	.	H	α-helix	trans	-61.7	-47.1	176.7	-169.5	-167.1	69.6	83.3	0.6	111.8	Q629 E630 H636 K637	Q629-R633 WeakPolarHBondContact O-CB 3.37Å; Q629-R633 PolarHBondContact O-N 2.91Å; E630-R633 WeakPolarHBondContact O-CB 3.4Å; E630-R633 PolarHBondContact O-N 3.32Å; E630-R633 IonicContact OE1-CZ 2.76Å; E630-R633 IonicContact OE1-NE 2.75Å; E630-R633 IonicContact OE1-NH2 3.57Å; E630-R633 PolarHBondContact OE1-NH2 3.18Å; E630-R633 IonicContact OE2-CZ 3.29Å; E630-R633 IonicContact OE2-NE 3.24Å; E630-R633 PolarHBondContact OE2-NE 3.03Å; E630-R633 IonicContact OE2-NH2 3.22Å; E630-R633 PolarHBondContact OE2-NH2 3.33Å; R633-H636 PolarHBondContact O-N 3.19Å; R633-K637 PolarHBondContact O-N 2.93Å
634	L	97.4	Very high	96.2	Very high	8 Å²	8	66.5 Å²	66.5	4%	0.042	33%	0.329	C	S	.	.	H	α-helix	trans	-66.7	-38.8	177.4	-72.3	168.2	0	0	0	112.2	E630 A631 K637 A638 D653 S657	E630-L634 HydrophobicContact CG-CD1 4.12Å; E630-L634 WeakPolarHBondContact O-CG 3.37Å; E630-L634 PolarHBondContact O-N 3.09Å; A631-L634 PolarHBondContact O-N 2.81Å; L634-K637 PolarHBondContact O-N 3.33Å; L634-A638 PolarHBondContact O-N 3.44Å; L634-D653 HydrophobicContact CD1-CB 4.38Å; L634-S657 WeakPolarHBondContact CD1-OG 3.44Å
635	K	96.6	Very high	96.3	Very high	39 Å²	39	66.7 Å²	66.7	17%	0.17	33%	0.327	C	S	.	.	H	α-helix	trans	-58.7	-51.1	171.6	-171.6	-147.9	166.4	-160	0	111.1	A631 K632 K637 A638 D639 Y651	A631-K635 WeakPolarHBondContact O-CB 3.49Å; A631-K635 PolarHBondContact O-N 3.21Å; K632-K635 PolarHBondContact O-N 3.03Å; K635-K637 VanDerWaalsContact C-N 3.31Å; K635-K637 PolarHBondContact O-N 3.27Å; K635-A638 CarbonylContact O-C 3.55Å; K635-A638 WeakPolarHBondContact O-CA 3.19Å; K635-A638 WeakPolarHBondContact O-CB 3.44Å; K635-A638 PolarHBondContact O-N 2.69Å; K635-D639 VanDerWaalsContact CE-OD2 3.31Å; K635-D639 WeakPolarHBondContact CE-OD2 3.32Å; K635-D639 IonicContact NZ-OD2 3.71Å; K635-D639 VanDerWaalsContact O-CG 3.26Å; K635-D639 PolarHBondContact O-N 2.92Å; K635-Y651 HydrophobicContact CG-CD1 4.19Å; K635-Y651 HydrophobicContact CG-CE1 3.93Å
636	H	97.4	Very high	96.3	Very high	105 Å²	105	62.9 Å²	62.9	49%	0.486	31%	0.31	S	S	.	.	H	α-helix	trans	-64.9	-33.6	178.9	-63	155.4	0	0	0	112.8	K632 R633 A638 D639 A640	K632-H636 VanDerWaalsContact O-CG 3.31Å; K632-H636 PolarHBondContact O-N 2.95Å; K632-H636 PolarHBondContact O-ND1 2.93Å; R633-H636 PolarHBondContact O-N 3.19Å; H636-A638 VanDerWaalsContact C-N 3.33Å; H636-A638 PolarHBondContact O-N 3.43Å; H636-D639 IonicContact CD2-OD2 2.67Å; H636-D639 PolarHBondContact O-N 2.86Å; H636-A640 PolarHBondContact O-N 2.67Å; H636-A640 VanDerWaalsContact O-N 3.09Å
637	K	96.8	Very high	96.4	Very high	103 Å²	103	59.2 Å²	59.2	45%	0.448	30%	0.297	S	S	.	.	H	α-helix	trans	-60.6	-42.3	170.2	-173.8	-176	173.9	-155.9	0	111.3	R633 L634 K635 L641 N650	R633-K637 PolarHBondContact O-N 2.93Å; L634-K637 PolarHBondContact O-N 3.33Å; K635-K637 VanDerWaalsContact C-N 3.31Å; K635-K637 PolarHBondContact O-N 3.27Å; K637-L641 WeakPolarHBondContact O-CG 3.48Å; K637-N650 VanDerWaalsContact CD-OD1 3.3Å; K637-N650 WeakPolarHBondContact CD-OD1 3.41Å; K637-N650 VanDerWaalsContact CE-OD1 3.31Å; K637-N650 WeakPolarHBondContact CE-OD1 3.41Å; K637-N650 PolarHBondContact NZ-OD1 3.46Å; K637-N650 VanDerWaalsContact NZ-OD1 3.11Å
638	A	97.3	Very high	96.5	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-67.2	-43.3	173.7	0	0	0	0	0	112.2	L634 K635 H636 A640 L641 K647 N650 Y651	L634-A638 PolarHBondContact O-N 3.44Å; K635-A638 CarbonylContact O-C 3.55Å; K635-A638 WeakPolarHBondContact O-CA 3.19Å; K635-A638 WeakPolarHBondContact O-CB 3.44Å; K635-A638 PolarHBondContact O-N 2.69Å; H636-A638 VanDerWaalsContact C-N 3.33Å; H636-A638 PolarHBondContact O-N 3.43Å; A638-A640 PolarHBondContact O-N 3.14Å; A638-L641 PolarHBondContact O-N 3.48Å; A638-K647 HydrophobicContact CB-CG 4.45Å; A638-K647 WeakPolarHBondContact O-CG 3.47Å; A638-K647 PolarHBondContact O-NZ 2.94Å; A638-N650 HydrophobicContact CB-CB 3.65Å; A638-Y651 HydrophobicContact CB-CD1 3.37Å; A638-Y651 HydrophobicContact CB-CD2 4.11Å; A638-Y651 HydrophobicContact CB-CE1 3.48Å; A638-Y651 VanDerWaalsContact CB-CE1 3.48Å; A638-Y651 HydrophobicContact CB-CE2 4.22Å; A638-Y651 HydrophobicContact CB-CG 3.69Å
639	D	97.1	Very high	96.5	Very high	64 Å²	64	58.1 Å²	58.1	34%	0.342	29%	0.293	S	S	.	.	H	α-helix	trans	-55	-38	178.2	-67.3	-35.8	0	0	0	111.4	K635 H636 L641 K647 Y651	K635-D639 VanDerWaalsContact CE-OD2 3.31Å; K635-D639 WeakPolarHBondContact CE-OD2 3.32Å; K635-D639 IonicContact NZ-OD2 3.71Å; K635-D639 VanDerWaalsContact O-CG 3.26Å; K635-D639 PolarHBondContact O-N 2.92Å; H636-D639 IonicContact CD2-OD2 2.67Å; H636-D639 PolarHBondContact O-N 2.86Å; D639-L641 PolarHBondContact O-N 3.44Å; D639-K647 VanDerWaalsContact C-NZ 3.34Å; D639-K647 PolarHBondContact O-NZ 3.35Å; D639-Y651 WeakPolarHBondContact OD1-CE1 3.32Å; D639-Y651 PolarHBondContact OD1-OH 2.95Å
640	A	97.2	Very high	96.5	Very high	85 Å²	85	51.7 Å²	51.7	70%	0.702	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-13.9	176.5	0	0	0	0	0	116	H636 A638	H636-A640 PolarHBondContact O-N 2.67Å; H636-A640 VanDerWaalsContact O-N 3.09Å; A638-A640 PolarHBondContact O-N 3.14Å
641	L	95.2	Very high	96.6	Very high	62 Å²	62	49.7 Å²	49.7	33%	0.325	25%	0.254	S	S	.	.			trans	-82.8	136.8	179	-70.3	172.9	0	0	0	112.4	K637 A638 D639 K647 N650	K637-L641 WeakPolarHBondContact O-CG 3.48Å; A638-L641 PolarHBondContact O-N 3.48Å; D639-L641 PolarHBondContact O-N 3.44Å; L641-K647 HydrophobicContact CB-CB 4.12Å; L641-K647 PolarHBondContact O-NZ 3.45Å; L641-N650 HydrophobicContact CD1-CB 4.31Å; L641-N650 WeakPolarHBondContact CD1-ND2 3.34Å
642	T	94.1	Very high	96.7	Very high	143 Å²	143	50 Å²	50	88%	0.877	26%	0.256	S	S	*	.			trans	-87.9	-38.5	175.2	49.1	0	0	0	0	112.7	K644	T642-K644 PolarHBondContact O-N 2.96Å
643	D	94.4	Very high	96.7	Very high	81 Å²	81	48.9 Å²	48.9	43%	0.433	25%	0.252	S	S	.	.	S	Bend	trans	-64.7	130.3	173.7	169.5	42	0	0	0	111.3	F645 G646 K647	D643-F645 PolarHBondContact OD1-N 2.95Å; D643-F645 VanDerWaalsContact OD1-N 3.13Å; D643-F645 PolarHBondContact OD2-N 3.48Å; D643-G646 PolarHBondContact OD2-N 3.48Å; D643-K647 WeakPolarHBondContact O-CB 3.48Å; D643-K647 PolarHBondContact O-N 3.2Å
644	K	95.5	Very high	96.7	Very high	113 Å²	113	42.7 Å²	42.7	49%	0.491	23%	0.229	S	C	.	.	H	α-helix	trans	-68.1	-34.2	-178.4	-66.7	178.3	165.1	-149.5	0	112.9	T642 A648 L692 K693	T642-K644 PolarHBondContact O-N 2.96Å; K644-A648 WeakPolarHBondContact O-CB 3.13Å; K644-A648 PolarHBondContact O-N 3.31Å; K644-L692 WeakPolarHBondContact CD-O 3.47Å; K644-L692 WeakPolarHBondContact CE-O 3.44Å; K644-L692 PolarHBondContact NZ-O 2.55Å; K644-K693 HydrophobicContact CB-CB 4.42Å; K644-K693 HydrophobicContact CD-CB 4.38Å
645	F	95.6	Very high	96.7	Very high	20 Å²	20	42.3 Å²	42.3	9%	0.088	23%	0.227	C	C	.	.	H	α-helix	trans	-74.7	-53.6	-179.5	177	-103.8	0	0	0	110.9	D643 K647 A648 V649 F695 L703 E704 L707 A872 L874	D643-F645 PolarHBondContact OD1-N 2.95Å; D643-F645 VanDerWaalsContact OD1-N 3.13Å; D643-F645 PolarHBondContact OD2-N 3.48Å; F645-K647 VanDerWaalsContact C-N 3.29Å; F645-K647 PolarHBondContact O-N 2.88Å; F645-A648 WeakPolarHBondContact O-CB 3.2Å; F645-A648 PolarHBondContact O-N 2.74Å; F645-A648 VanDerWaalsContact O-N 3.08Å; F645-V649 HydrophobicContact CD1-CG2 4.33Å; F645-V649 HydrophobicContact CE1-CG2 3.94Å; F645-V649 HydrophobicContact CE2-CG2 4.17Å; F645-V649 HydrophobicContact CZ-CG2 3.86Å; F645-V649 WeakPolarHBondContact O-CG2 3.47Å; F645-V649 PolarHBondContact O-N 3.24Å; F645-F695 HydrophobicContact CD2-CE1 4.1Å; F645-L703 HydrophobicContact CE2-CB 4.28Å; F645-L703 HydrophobicContact CZ-CB 3.96Å; F645-E704 HydrophobicContact CD2-CG 3.68Å; F645-E704 HydrophobicContact CE2-CG 4.07Å; F645-L707 HydrophobicContact CD2-CD2 3.87Å; F645-L707 HydrophobicContact CE2-CB 4.03Å; F645-L707 HydrophobicContact CE2-CD2 3.71Å; F645-L707 HydrophobicContact CE2-CG 4.5Å; F645-A872 HydrophobicContact CD1-CB 4.46Å; F645-A872 HydrophobicContact CE1-CB 3.68Å; F645-L874 HydrophobicContact CD1-CD1 3.81Å; F645-L874 HydrophobicContact CE1-CD1 3.79Å
646	G	95.3	Very high	96.8	Very high	3 Å²	3	40.5 Å²	40.5	3%	0.031	22%	0.219	C	C	.	.	H	α-helix	trans	-56.7	-39.6	173.5	0	0	0	0	0	112.8	D643 V649 N650	D643-G646 PolarHBondContact OD2-N 3.48Å; G646-V649 PolarHBondContact O-N 2.63Å; G646-N650 PolarHBondContact O-N 2.9Å; G646-N650 PolarHBondContact O-ND2 3.4Å
647	K	96.9	Very high	96.7	Very high	30 Å²	30	35.5 Å²	35.5	13%	0.13	20%	0.196	C	C	.	.	H	α-helix	trans	-60.6	-48	172.3	-175.9	175.4	-147	83.6	0	111.9	A638 D639 L641 D643 F645 V649 N650 Y651 L692	A638-K647 HydrophobicContact CB-CG 4.45Å; A638-K647 WeakPolarHBondContact O-CG 3.47Å; A638-K647 PolarHBondContact O-NZ 2.94Å; D639-K647 VanDerWaalsContact C-NZ 3.34Å; D639-K647 PolarHBondContact O-NZ 3.35Å; L641-K647 HydrophobicContact CB-CB 4.12Å; L641-K647 PolarHBondContact O-NZ 3.45Å; D643-K647 WeakPolarHBondContact O-CB 3.48Å; D643-K647 PolarHBondContact O-N 3.2Å; F645-K647 VanDerWaalsContact C-N 3.29Å; F645-K647 PolarHBondContact O-N 2.88Å; K647-V649 PolarHBondContact O-N 2.89Å; K647-N650 PolarHBondContact O-N 2.91Å; K647-Y651 HydrophobicContact CD-CE2 3.95Å; K647-Y651 WeakPolarHBondContact CE-OH 3.17Å; K647-Y651 HydrophobicContact CG-CD2 3.89Å; K647-Y651 HydrophobicContact CG-CE2 3.4Å; K647-Y651 VanDerWaalsContact O-CD2 3.32Å; K647-Y651 WeakPolarHBondContact O-CD2 3.45Å; K647-Y651 PolarHBondContact O-N 2.99Å; K647-L692 HydrophobicContact CB-CD1 4.22Å; K647-L692 HydrophobicContact CD-CD1 4Å; K647-L692 HydrophobicContact CD-CD2 4.29Å; K647-L692 HydrophobicContact CG-CD1 3.79Å
648	A	97.4	Very high	96.8	Very high	3 Å²	3	31.7 Å²	31.7	3%	0.025	18%	0.18	C	C	.	.	H	α-helix	trans	-61.9	-41.2	175.3	0	0	0	0	0	112.7	K644 F645 N650 Y651 A652 L692 F695 L707	K644-A648 WeakPolarHBondContact O-CB 3.13Å; K644-A648 PolarHBondContact O-N 3.31Å; F645-A648 WeakPolarHBondContact O-CB 3.2Å; F645-A648 PolarHBondContact O-N 2.74Å; F645-A648 VanDerWaalsContact O-N 3.08Å; A648-N650 PolarHBondContact O-N 3.33Å; A648-Y651 PolarHBondContact O-N 2.96Å; A648-A652 WeakPolarHBondContact O-CB 3.49Å; A648-A652 PolarHBondContact O-N 2.95Å; A648-L692 HydrophobicContact CB-CD1 4.12Å; A648-F695 HydrophobicContact CB-CE1 4.25Å; A648-F695 HydrophobicContact CB-CE2 4Å; A648-F695 HydrophobicContact CB-CZ 3.52Å; A648-L707 HydrophobicContact CB-CD2 3.79Å
649	V	97.1	Very high	96.8	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.7	-36.7	175.9	166.7	0	0	0	0	112.6	F645 G646 K647 D653 L707 R869	F645-V649 HydrophobicContact CD1-CG2 4.33Å; F645-V649 HydrophobicContact CE1-CG2 3.94Å; F645-V649 HydrophobicContact CE2-CG2 4.17Å; F645-V649 HydrophobicContact CZ-CG2 3.86Å; F645-V649 WeakPolarHBondContact O-CG2 3.47Å; F645-V649 PolarHBondContact O-N 3.24Å; G646-V649 PolarHBondContact O-N 2.63Å; K647-V649 PolarHBondContact O-N 2.89Å; V649-D653 PolarHBondContact O-N 3.4Å; V649-L707 HydrophobicContact CG2-CD1 4.08Å; V649-L707 HydrophobicContact CG2-CD2 3.81Å; V649-R869 HydrophobicContact CG1-CG 3.91Å; V649-R869 VanDerWaalsContact CG1-NE 3.33Å; V649-R869 PolarHBondContact O-NH2 3.26Å
650	N	96.9	Very high	96.7	Very high	9 Å²	9	30.4 Å²	30.4	5%	0.048	17%	0.171	C	C	.	.	H	α-helix	trans	-81	-33.4	178.1	-74.1	-99.4	0	0	0	111.7	K637 A638 L641 G646 K647 A648 G654	K637-N650 VanDerWaalsContact CD-OD1 3.3Å; K637-N650 WeakPolarHBondContact CD-OD1 3.41Å; K637-N650 VanDerWaalsContact CE-OD1 3.31Å; K637-N650 WeakPolarHBondContact CE-OD1 3.41Å; K637-N650 PolarHBondContact NZ-OD1 3.46Å; K637-N650 VanDerWaalsContact NZ-OD1 3.11Å; A638-N650 HydrophobicContact CB-CB 3.65Å; L641-N650 HydrophobicContact CD1-CB 4.31Å; L641-N650 WeakPolarHBondContact CD1-ND2 3.34Å; G646-N650 PolarHBondContact O-N 2.9Å; G646-N650 PolarHBondContact O-ND2 3.4Å; K647-N650 PolarHBondContact O-N 2.91Å; A648-N650 PolarHBondContact O-N 3.33Å; N650-G654 PolarHBondContact O-N 2.74Å
651	Y	98.4	Very high	96.7	Very high	5 Å²	5	26.3 Å²	26.3	2%	0.02	14%	0.138	C	C	.	.	H	α-helix	trans	-65.5	-36.6	168.9	-73.6	-47	0	0	0	112.6	K635 A638 D639 K647 A648 G654 A655 L685 Y688 A689 L692	K635-Y651 HydrophobicContact CG-CD1 4.19Å; K635-Y651 HydrophobicContact CG-CE1 3.93Å; A638-Y651 HydrophobicContact CB-CD1 3.37Å; A638-Y651 HydrophobicContact CB-CD2 4.11Å; A638-Y651 HydrophobicContact CB-CE1 3.48Å; A638-Y651 VanDerWaalsContact CB-CE1 3.48Å; A638-Y651 HydrophobicContact CB-CE2 4.22Å; A638-Y651 HydrophobicContact CB-CG 3.69Å; D639-Y651 WeakPolarHBondContact OD1-CE1 3.32Å; D639-Y651 PolarHBondContact OD1-OH 2.95Å; K647-Y651 HydrophobicContact CD-CE2 3.95Å; K647-Y651 WeakPolarHBondContact CE-OH 3.17Å; K647-Y651 HydrophobicContact CG-CD2 3.89Å; K647-Y651 HydrophobicContact CG-CE2 3.4Å; K647-Y651 VanDerWaalsContact O-CD2 3.32Å; K647-Y651 WeakPolarHBondContact O-CD2 3.45Å; K647-Y651 PolarHBondContact O-N 2.99Å; A648-Y651 PolarHBondContact O-N 2.96Å; Y651-G654 PolarHBondContact O-N 3.18Å; Y651-A655 WeakPolarHBondContact O-CB 3.45Å; Y651-A655 PolarHBondContact O-N 3.46Å; Y651-L685 HydrophobicContact CD1-CD1 3.97Å; Y651-L685 HydrophobicContact CG-CD1 4.35Å; Y651-Y688 HydrophobicContact CD2-CD1 4.43Å; Y651-Y688 HydrophobicContact CD2-CE1 4.3Å; Y651-Y688 HydrophobicContact CE2-CD1 4.11Å; Y651-Y688 AromaticContact CE2-CE1 3.55Å; Y651-Y688 HydrophobicContact CE2-CE1 3.55Å; Y651-Y688 AromaticContact CZ-CE1 3.78Å; Y651-A689 HydrophobicContact CD2-CB 4.23Å; Y651-A689 HydrophobicContact CG-CB 4.44Å; Y651-L692 HydrophobicContact CD2-CD1 3.86Å; Y651-L692 HydrophobicContact CE2-CD1 3.89Å
652	A	97.9	Very high	96.7	Very high	7 Å²	7	23.4 Å²	23.4	6%	0.058	12%	0.122	C	C	.	.	H	α-helix	trans	-61.3	-46.4	176.4	0	0	0	0	0	111.4	A648 A655 L656 L707 L865	A648-A652 WeakPolarHBondContact O-CB 3.49Å; A648-A652 PolarHBondContact O-N 2.95Å; A652-A655 WeakPolarHBondContact O-CB 3.46Å; A652-A655 PolarHBondContact O-N 3.21Å; A652-L656 WeakPolarHBondContact O-CG 3.25Å; A652-L656 PolarHBondContact O-N 3.32Å; A652-L707 HydrophobicContact CB-CD1 4.45Å; A652-L865 HydrophobicContact CB-CD1 3.99Å; A652-L865 HydrophobicContact CB-CD2 4.23Å
653	D	97.4	Very high	96.7	Very high	16 Å²	16	18.1 Å²	18.1	9%	0.086	9%	0.089	C	C	.	.	H	α-helix	trans	-69.3	-36.3	177.8	-155.2	2.5	0	0	0	112.7	L634 V649 A655 L656 S657 R862 L865 R869	L634-D653 HydrophobicContact CD1-CB 4.38Å; V649-D653 PolarHBondContact O-N 3.4Å; D653-A655 VanDerWaalsContact C-N 3.3Å; D653-A655 PolarHBondContact O-N 2.69Å; D653-L656 PolarHBondContact O-N 3.34Å; D653-S657 PolarHBondContact O-N 3.32Å; D653-S657 PolarHBondContact O-OG 2.97Å; D653-R862 IonicContact OD1-NE 2.76Å; D653-R862 PolarHBondContact OD1-NE 3.4Å; D653-L865 HydrophobicContact CB-CD1 4.03Å; D653-R869 VanDerWaalsContact CB-NH2 3.28Å; D653-R869 IonicContact OD2-CZ 3.06Å; D653-R869 VanDerWaalsContact OD2-CZ 3.22Å; D653-R869 IonicContact OD2-NH1 3.43Å; D653-R869 PolarHBondContact OD2-NH1 3.33Å; D653-R869 IonicContact OD2-NH2 2.67Å; D653-R869 PolarHBondContact OD2-NH2 2.6Å
654	G	98	Very high	96.7	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-60.9	-39.4	168.9	0	0	0	0	0	112.2	A631 N650 Y651 S657 F658	A631-G654 WeakPolarHBondContact CB-O 3.34Å; N650-G654 PolarHBondContact O-N 2.74Å; Y651-G654 PolarHBondContact O-N 3.18Å; G654-S657 PolarHBondContact O-N 3.25Å; G654-F658 VanDerWaalsContact O-CD2 3.24Å; G654-F658 WeakPolarHBondContact O-CD2 3.47Å; G654-F658 PolarHBondContact O-N 2.67Å
655	A	98.4	Very high	96.6	Very high	1 Å²	1	9.5 Å²	9.5	1%	0.008	5%	0.049	C	C	.	.	H	α-helix	trans	-63.7	-44.2	172.8	0	0	0	0	0	111.8	Y651 A652 D653 S657 F658 I659 T682 L685 I686	Y651-A655 WeakPolarHBondContact O-CB 3.45Å; Y651-A655 PolarHBondContact O-N 3.46Å; A652-A655 WeakPolarHBondContact O-CB 3.46Å; A652-A655 PolarHBondContact O-N 3.21Å; D653-A655 VanDerWaalsContact C-N 3.3Å; D653-A655 PolarHBondContact O-N 2.69Å; A655-S657 PolarHBondContact O-N 2.97Å; A655-F658 CarbonylContact O-C 3.5Å; A655-F658 WeakPolarHBondContact O-CA 3.26Å; A655-F658 WeakPolarHBondContact O-CB 3.14Å; A655-F658 PolarHBondContact O-N 3.43Å; A655-I659 WeakPolarHBondContact O-CG1 3.2Å; A655-I659 PolarHBondContact O-N 3.19Å; A655-T682 HydrophobicContact CB-CG2 3.87Å; A655-L685 HydrophobicContact CB-CD2 4.09Å; A655-L685 HydrophobicContact CB-CG 4.49Å; A655-I686 HydrophobicContact CB-CD1 4.07Å; A655-I686 HydrophobicContact CB-CG1 3.55Å
656	L	97.6	Very high	96.5	Very high	1 Å²	1	10.8 Å²	10.8	1%	0.005	6%	0.056	C	C	.	.	H	α-helix	trans	-57.1	-38.5	174.7	-62.5	178.7	0	0	0	112.4	A652 D653 F658 I659 E660 V858 I861 R862 L865	A652-L656 WeakPolarHBondContact O-CG 3.25Å; A652-L656 PolarHBondContact O-N 3.32Å; D653-L656 PolarHBondContact O-N 3.34Å; L656-F658 VanDerWaalsContact C-N 3.35Å; L656-I659 HydrophobicContact CD2-CD1 4.08Å; L656-I659 WeakPolarHBondContact O-CA 3.45Å; L656-I659 WeakPolarHBondContact O-CB 3.28Å; L656-I659 PolarHBondContact O-N 3.06Å; L656-I659 VanDerWaalsContact O-N 3.09Å; L656-E660 PolarHBondContact O-N 3.43Å; L656-V858 HydrophobicContact CB-CG1 4.33Å; L656-V858 HydrophobicContact CB-CG2 4.34Å; L656-V858 HydrophobicContact CD2-CG2 4.24Å; L656-I861 HydrophobicContact CD1-CB 3.85Å; L656-I861 HydrophobicContact CD1-CG2 3.71Å; L656-I861 HydrophobicContact CD2-CB 3.83Å; L656-I861 HydrophobicContact CD2-CG1 4.24Å; L656-I861 HydrophobicContact CD2-CG2 3.92Å; L656-I861 HydrophobicContact CG-CB 4.46Å; L656-I861 HydrophobicContact CG-CG2 4.27Å; L656-R862 HydrophobicContact CD1-CB 4.43Å; L656-R862 HydrophobicContact CD1-CG 3.49Å; L656-R862 VanDerWaalsContact CD1-CG 3.49Å; L656-L865 HydrophobicContact CD1-CD1 3.93Å
657	S	97.3	Very high	96.2	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-69.2	-32	175.8	-51.4	0	0	0	0	111.9	L634 D653 G654 A655 E660 C661 R862	L634-S657 WeakPolarHBondContact CD1-OG 3.44Å; D653-S657 PolarHBondContact O-N 3.32Å; D653-S657 PolarHBondContact O-OG 2.97Å; G654-S657 PolarHBondContact O-N 3.25Å; A655-S657 PolarHBondContact O-N 2.97Å; S657-E660 PolarHBondContact O-N 3.29Å; S657-C661 WeakPolarHBondContact O-CB 3.31Å; S657-C661 PolarHBondContact O-N 3.45Å; S657-R862 PolarHBondContact OG-NH2 3.32Å
658	F	97.8	Very high	95.8	Very high	23 Å²	23	22.9 Å²	22.9	10%	0.101	11%	0.108	C	C	.	.	H	α-helix	trans	-68.8	-32.4	166.2	-72	-62.7	0	0	0	113	A631 G654 A655 L656 C661 G662 T682 L685	A631-F658 HydrophobicContact CB-CB 4.41Å; A631-F658 HydrophobicContact CB-CD1 3.53Å; A631-F658 HydrophobicContact CB-CD2 3.65Å; A631-F658 HydrophobicContact CB-CE1 3.55Å; A631-F658 HydrophobicContact CB-CE2 3.67Å; A631-F658 HydrophobicContact CB-CG 3.57Å; A631-F658 HydrophobicContact CB-CZ 3.62Å; G654-F658 VanDerWaalsContact O-CD2 3.24Å; G654-F658 WeakPolarHBondContact O-CD2 3.47Å; G654-F658 PolarHBondContact O-N 2.67Å; A655-F658 CarbonylContact O-C 3.5Å; A655-F658 WeakPolarHBondContact O-CA 3.26Å; A655-F658 WeakPolarHBondContact O-CB 3.14Å; A655-F658 PolarHBondContact O-N 3.43Å; L656-F658 VanDerWaalsContact C-N 3.35Å; F658-C661 WeakPolarHBondContact O-CB 3.21Å; F658-C661 PolarHBondContact O-N 3.49Å; F658-G662 PolarHBondContact O-N 3.3Å; F658-T682 HydrophobicContact CB-CG2 4.1Å; F658-T682 VanDerWaalsContact CB-OG1 3.31Å; F658-T682 WeakPolarHBondContact CB-OG1 3.42Å; F658-L685 HydrophobicContact CD2-CD2 3.77Å; F658-L685 HydrophobicContact CE2-CD2 3.8Å
659	I	97.2	Very high	95.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.6	-45.3	171.8	-54.2	-174	0	0	0	110.1	A655 L656 C661 G662 N663 Y679 T682 L718 M854 L857 V858	A655-I659 WeakPolarHBondContact O-CG1 3.2Å; A655-I659 PolarHBondContact O-N 3.19Å; L656-I659 HydrophobicContact CD2-CD1 4.08Å; L656-I659 WeakPolarHBondContact O-CA 3.45Å; L656-I659 WeakPolarHBondContact O-CB 3.28Å; L656-I659 PolarHBondContact O-N 3.06Å; L656-I659 VanDerWaalsContact O-N 3.09Å; I659-C661 VanDerWaalsContact C-N 3.33Å; I659-C661 PolarHBondContact O-N 2.58Å; I659-G662 PolarHBondContact O-N 3.11Å; I659-N663 WeakPolarHBondContact O-CB 3.44Å; I659-N663 PolarHBondContact O-N 3.04Å; I659-Y679 HydrophobicContact CG2-CE1 4.1Å; I659-T682 HydrophobicContact CG1-CG2 4.01Å; I659-L718 HydrophobicContact CD1-CD1 3.79Å; I659-L718 HydrophobicContact CD1-CD2 4.06Å; I659-L718 HydrophobicContact CD1-CG 3.98Å; I659-L718 HydrophobicContact CG1-CD1 4.16Å; I659-L718 HydrophobicContact CG1-CD2 4.01Å; I659-L718 HydrophobicContact CG1-CG 4.42Å; I659-L718 HydrophobicContact CG2-CD2 4.36Å; I659-M854 HydrophobicContact CG2-CB 4Å; I659-M854 HydrophobicContact CG2-CG 4.35Å; I659-M854 HydrophobicContact CG2-SD 4.03Å; I659-L857 HydrophobicContact CD1-CD2 3.9Å; I659-V858 HydrophobicContact CB-CG2 4.03Å; I659-V858 HydrophobicContact CG2-CG2 4.02Å
660	E	95.8	Very high	94.2	Very high	36 Å²	36	30.8 Å²	30.8	17%	0.168	15%	0.154	C	C	.	.	H	α-helix	trans	-62.6	-39.7	175.8	-70.7	179.7	134.2	0	0	112.3	Y627 L656 S657 N663 A664 V858 R862	Y627-E660 HydrophobicContact CD1-CB 3.47Å; Y627-E660 VanDerWaalsContact CD1-CB 3.47Å; Y627-E660 HydrophobicContact CD1-CG 4.29Å; Y627-E660 WeakPolarHBondContact CD1-OE2 3.38Å; Y627-E660 HydrophobicContact CD2-CB 4Å; Y627-E660 HydrophobicContact CE1-CB 3.62Å; Y627-E660 HydrophobicContact CE1-CG 4.06Å; Y627-E660 WeakPolarHBondContact CE1-OE2 3.31Å; Y627-E660 HydrophobicContact CE2-CB 4.11Å; Y627-E660 HydrophobicContact CG-CB 3.69Å; L656-E660 PolarHBondContact O-N 3.43Å; S657-E660 PolarHBondContact O-N 3.29Å; E660-N663 PolarHBondContact O-N 3.43Å; E660-A664 WeakPolarHBondContact O-CB 3.3Å; E660-A664 PolarHBondContact O-N 3.39Å; E660-V858 HydrophobicContact CG-CB 4.41Å; E660-V858 HydrophobicContact CG-CG1 3.92Å; E660-V858 HydrophobicContact CG-CG2 4.06Å; E660-R862 IonicContact OE1-CZ 3.32Å; E660-R862 IonicContact OE1-NH1 3.4Å; E660-R862 PolarHBondContact OE1-NH1 2.93Å; E660-R862 IonicContact OE2-CZ 3.26Å; E660-R862 VanDerWaalsContact OE2-CZ 3.24Å; E660-R862 IonicContact OE2-NH1 3.97Å; E660-R862 PolarHBondContact OE2-NH1 3.46Å; E660-R862 IonicContact OE2-NH2 3.96Å; E660-R862 PolarHBondContact OE2-NH2 3.47Å
661	C	95.6	Very high	92.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.8	-45.6	172.8	-173	0	0	0	0	111.9	A624 S657 F658 I659 A664 M665 M678	A624-C661 PolarHBondContact O-SG 3.08Å; S657-C661 WeakPolarHBondContact O-CB 3.31Å; S657-C661 PolarHBondContact O-N 3.45Å; F658-C661 WeakPolarHBondContact O-CB 3.21Å; F658-C661 PolarHBondContact O-N 3.49Å; I659-C661 VanDerWaalsContact C-N 3.33Å; I659-C661 PolarHBondContact O-N 2.58Å; C661-A664 PolarHBondContact O-N 3.03Å; C661-M665 WeakPolarHBondContact O-CG 3.33Å; C661-M665 PolarHBondContact O-N 3.48Å; C661-M678 HydrophobicContact CB-CE 4.48Å; C661-M678 HydrophobicContact CB-SD 3.58Å; C661-M678 VanDerWaalsContact CB-SD 3.58Å; C661-M678 VanDerWaalsContact SG-CE 3.54Å; C661-M678 PolarHBondContact SG-SD 3.32Å
662	G	95.4	Very high	91.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.6	-41.8	176.2	0	0	0	0	0	112.2	F658 I659 A664 M665 E666 M678	F658-G662 PolarHBondContact O-N 3.3Å; I659-G662 PolarHBondContact O-N 3.11Å; G662-A664 VanDerWaalsContact C-N 3.34Å; G662-A664 PolarHBondContact O-N 2.91Å; G662-M665 CarbonylContact O-C 3.5Å; G662-M665 PolarHBondContact O-N 3.29Å; G662-E666 PolarHBondContact O-N 3.22Å; G662-M678 PolarHBondContact N-SD 3.35Å
663	N	94.7	Very high	90.9	Very high	32 Å²	32	47.7 Å²	47.7	17%	0.171	25%	0.249	C	C	.	.	H	α-helix	trans	-68.8	-30.8	177.8	179.4	80.5	0	0	0	112.4	I659 E660 E666 R667 Y679 M854	I659-N663 WeakPolarHBondContact O-CB 3.44Å; I659-N663 PolarHBondContact O-N 3.04Å; E660-N663 PolarHBondContact O-N 3.43Å; N663-E666 PolarHBondContact O-N 3.36Å; N663-R667 WeakPolarHBondContact O-CG 3.25Å; N663-R667 PolarHBondContact O-N 3.27Å; N663-Y679 WeakPolarHBondContact CA-OH 3.48Å; N663-Y679 PolarHBondContact N-OH 3.5Å; N663-Y679 VanDerWaalsContact N-OH 3.13Å; N663-M854 HydrophobicContact CB-CB 4.16Å
664	A	94.3	Very high	90.6	Very high	10 Å²	10	49.7 Å²	49.7	8%	0.083	26%	0.264	C	S	.	.	H	α-helix	trans	-67.1	-42.9	168.9	0	0	0	0	0	111.2	A624 Y627 E660 C661 G662 E666 R667 D668	A624-A664 HydrophobicContact CB-CB 3.99Å; Y627-A664 HydrophobicContact CD2-CB 4.24Å; Y627-A664 HydrophobicContact CE2-CB 4.49Å; E660-A664 WeakPolarHBondContact O-CB 3.3Å; E660-A664 PolarHBondContact O-N 3.39Å; C661-A664 PolarHBondContact O-N 3.03Å; G662-A664 VanDerWaalsContact C-N 3.34Å; G662-A664 PolarHBondContact O-N 2.91Å; A664-E666 VanDerWaalsContact C-N 3.25Å; A664-E666 PolarHBondContact O-N 3Å; A664-R667 WeakPolarHBondContact O-CB 3.44Å; A664-R667 PolarHBondContact O-N 3.44Å; A664-D668 PolarHBondContact O-N 3.41Å
665	M	94.3	Very high	90.4	Very high	3 Å²	3	50.6 Å²	50.6	2%	0.015	27%	0.27	C	S	.	.	H	α-helix	trans	-68.1	-18.8	174.7	-66.3	168	46.1	0	0	113.9	A624 C661 G662 D668 P669 K673 S674 P675 M678	A624-M665 HydrophobicContact CB-CG 3.72Å; C661-M665 WeakPolarHBondContact O-CG 3.33Å; C661-M665 PolarHBondContact O-N 3.48Å; G662-M665 CarbonylContact O-C 3.5Å; G662-M665 PolarHBondContact O-N 3.29Å; M665-D668 CarbonylContact O-C 3.6Å; M665-P669 WeakPolarHBondContact O-CA 3.43Å; M665-K673 HydrophobicContact CE-CB 3.56Å; M665-K673 WeakPolarHBondContact CE-O 3.3Å; M665-K673 HydrophobicContact SD-CB 4.49Å; M665-S674 VanDerWaalsContact CE-C 3.5Å; M665-P675 HydrophobicContact CB-CB 4.49Å; M665-P675 HydrophobicContact CB-CG 3.9Å; M665-P675 HydrophobicContact CE-CG 4.49Å; M665-M678 HydrophobicContact CE-CE 4.27Å; M665-M678 HydrophobicContact SD-CE 3.42Å; M665-M678 WeakPolarHBondContact SD-CE 3.42Å; M665-M678 HydrophobicContact SD-SD 3.66Å; M665-M678 VanDerWaalsContact SD-SD 3.66Å
666	E	92.6	Very high	90.3	Very high	48 Å²	48	51.8 Å²	51.8	22%	0.224	27%	0.274	C	S	.	.	H	α-helix	trans	-78.3	-20	168.2	-72.2	-166.9	-98.4	0	0	113.2	G662 N663 A664 P675 Y679 R721 L725	G662-E666 PolarHBondContact O-N 3.22Å; N663-E666 PolarHBondContact O-N 3.36Å; A664-E666 VanDerWaalsContact C-N 3.25Å; A664-E666 PolarHBondContact O-N 3Å; E666-P675 HydrophobicContact CG-CB 3.67Å; E666-P675 HydrophobicContact CG-CG 3.9Å; E666-Y679 HydrophobicContact CG-CE2 4.42Å; E666-Y679 WeakPolarHBondContact OE1-CE2 3.44Å; E666-Y679 VanDerWaalsContact OE1-CZ 3.31Å; E666-Y679 PolarHBondContact OE1-OH 3.49Å; E666-R721 VanDerWaalsContact CD-NE 3.35Å; E666-R721 VanDerWaalsContact CD-NH2 3.27Å; E666-R721 IonicContact OE1-CZ 3.39Å; E666-R721 IonicContact OE1-NE 3.56Å; E666-R721 PolarHBondContact OE1-NE 3.21Å; E666-R721 IonicContact OE1-NH2 3.47Å; E666-R721 PolarHBondContact OE1-NH2 3.27Å; E666-R721 IonicContact OE2-CZ 2.77Å; E666-R721 VanDerWaalsContact OE2-CZ 3.26Å; E666-R721 IonicContact OE2-NE 3.47Å; E666-R721 PolarHBondContact OE2-NE 2.96Å; E666-R721 IonicContact OE2-NH2 2.72Å; E666-R721 PolarHBondContact OE2-NH2 3.13Å; E666-L725 HydrophobicContact CG-CD2 4.22Å; E666-L725 WeakPolarHBondContact OE2-CD2 3.49Å
667	R	89.9	Confident	90.2	Very high	176 Å²	176	54.9 Å²	54.9	66%	0.664	29%	0.293	S	S	*	.	H	α-helix	trans	-89.8	-33.7	176	-65.5	170.8	66.8	97.6	1.6	112.1	N663 A664	N663-R667 WeakPolarHBondContact O-CG 3.25Å; N663-R667 PolarHBondContact O-N 3.27Å; A664-R667 WeakPolarHBondContact O-CB 3.44Å; A664-R667 PolarHBondContact O-N 3.44Å
668	D	87.4	Confident	90.1	Very high	111 Å²	111	55.2 Å²	55.2	59%	0.594	30%	0.295	S	S	*	.	S	Bend	trans	-128.8	87.6	177.4	-173	17.1	0	0	0	109.8	A664 M665 L670	A664-D668 PolarHBondContact O-N 3.41Å; M665-D668 CarbonylContact O-C 3.6Å; D668-L670 PolarHBondContact O-N 3.41Å
669	P	82.5	Confident	90.1	Very high	94 Å²	94	54.1 Å²	54.1	61%	0.61	29%	0.29	S	S	*	.			trans	-74	93	-172.1	-20	35.2	0	0	0	113.4	M665 E671	M665-P669 WeakPolarHBondContact O-CA 3.43Å; P669-E671 PolarHBondContact O-N 2.99Å
670	L	78.7	Confident	90.1	Very high	74 Å²	74	56 Å²	56	39%	0.387	30%	0.303	S	S	.	.			trans	-67.5	112.7	170.8	-57.9	177.2	0	0	0	110.5	D668 A672 K673	D668-L670 PolarHBondContact O-N 3.41Å; L670-A672 PolarHBondContact O-N 3.39Å; L670-K673 HydrophobicContact CB-CB 4.44Å; L670-K673 HydrophobicContact CD1-CD 4.21Å; L670-K673 CarbonylContact O-C 3.54Å; L670-K673 PolarHBondContact O-N 3.08Å; L670-K673 VanDerWaalsContact O-O 3.04Å
671	E	70.5	Confident	90.1	Very high	207 Å²	207	57.8 Å²	57.8	97%	0.967	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-33.3	-175.2	-63.2	-171.5	132.1	0	0	114	P669	P669-E671 PolarHBondContact O-N 2.99Å
672	A	71.6	Confident	90.2	Very high	102 Å²	102	57.9 Å²	57.9	84%	0.843	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-7.6	-179.7	0	0	0	0	0	115.6	L670	L670-A672 PolarHBondContact O-N 3.39Å
673	K	81.4	Confident	90.4	Very high	68 Å²	68	58 Å²	58	30%	0.296	31%	0.313	S	S	.	.	S	Bend	trans	-133.8	113.6	-177.9	-62.8	-178.4	-177.5	175.6	0	110.3	E625 M665 L670	E625-K673 IonicContact OE1-NZ 3.19Å; E625-K673 IonicContact OE2-NZ 2.7Å; E625-K673 PolarHBondContact OE2-NZ 3.36Å; M665-K673 HydrophobicContact CE-CB 3.56Å; M665-K673 WeakPolarHBondContact CE-O 3.3Å; M665-K673 HydrophobicContact SD-CB 4.49Å; L670-K673 HydrophobicContact CB-CB 4.44Å; L670-K673 HydrophobicContact CD1-CD 4.21Å; L670-K673 CarbonylContact O-C 3.54Å; L670-K673 PolarHBondContact O-N 3.08Å; L670-K673 VanDerWaalsContact O-O 3.04Å
674	S	91.7	Very high	90.5	Very high	57 Å²	57	60.4 Å²	60.4	40%	0.399	32%	0.323	S	S	.	.			trans	-84.9	132.8	-179.7	-170.4	0	0	0	0	113	M665 Y676 T677 M678	M665-S674 VanDerWaalsContact CE-C 3.5Å; S674-Y676 PolarHBondContact O-N 3.47Å; S674-Y676 PolarHBondContact OG-N 3.45Å; S674-T677 PolarHBondContact O-N 3.3Å; S674-T677 PolarHBondContact O-OG1 2.97Å; S674-M678 PolarHBondContact O-N 3.26Å
675	P	94.5	Very high	90.7	Very high	20 Å²	20	61.2 Å²	61.2	13%	0.13	33%	0.325	C	S	.	.	H	α-helix	trans	-59.3	-31.2	169.4	-23.4	32.8	0	0	0	112.9	M665 E666 T677 M678 Y679 L725	M665-P675 HydrophobicContact CB-CB 4.49Å; M665-P675 HydrophobicContact CB-CG 3.9Å; M665-P675 HydrophobicContact CE-CG 4.49Å; E666-P675 HydrophobicContact CG-CB 3.67Å; E666-P675 HydrophobicContact CG-CG 3.9Å; P675-T677 PolarHBondContact O-N 2.9Å; P675-M678 PolarHBondContact O-N 3.49Å; P675-Y679 HydrophobicContact CB-CE2 4.4Å; P675-Y679 VanDerWaalsContact O-CD2 3.28Å; P675-Y679 WeakPolarHBondContact O-CD2 3.41Å; P675-Y679 PolarHBondContact O-N 3.22Å; P675-L725 HydrophobicContact CB-CD1 4.11Å
676	Y	95.3	Very high	90.8	Very high	26 Å²	26	61.2 Å²	61.2	10%	0.102	33%	0.326	C	S	.	.	H	α-helix	trans	-64.5	-41.5	-179.9	-176.5	-80.1	0	0	0	112.3	S674 S680 M722 L725 K726	S674-Y676 PolarHBondContact O-N 3.47Å; S674-Y676 PolarHBondContact OG-N 3.45Å; Y676-S680 WeakPolarHBondContact O-CB 3.37Å; Y676-S680 PolarHBondContact O-N 2.96Å; Y676-S680 PolarHBondContact O-OG 2.72Å; Y676-M722 HydrophobicContact CD2-CB 4.26Å; Y676-M722 HydrophobicContact CD2-CG 4.43Å; Y676-M722 HydrophobicContact CE1-CE 3.96Å; Y676-M722 HydrophobicContact CE2-CB 3.88Å; Y676-M722 HydrophobicContact CE2-CE 3.98Å; Y676-M722 HydrophobicContact CE2-CG 4.33Å; Y676-M722 WeakPolarHBondContact CE2-O 3.21Å; Y676-L725 HydrophobicContact CD2-CB 4.24Å; Y676-L725 HydrophobicContact CD2-CD1 4.49Å; Y676-K726 HydrophobicContact CD2-CD 3.7Å; Y676-K726 VanDerWaalsContact CD2-CE 3.44Å; Y676-K726 HydrophobicContact CD2-CG 3.9Å; Y676-K726 HydrophobicContact CE2-CD 3.48Å; Y676-K726 VanDerWaalsContact CE2-CD 3.48Å; Y676-K726 HydrophobicContact CE2-CG 3.98Å; Y676-K726 HydrophobicContact CG-CD 4.3Å
677	T	94.9	Very high	91	Very high	65 Å²	65	62.1 Å²	62.1	40%	0.399	33%	0.327	S	S	.	.	H	α-helix	trans	-67.2	-44.2	179.8	50.7	0	0	0	0	110.1	S674 P675 Y679 S680 E681	S674-T677 PolarHBondContact O-N 3.3Å; S674-T677 PolarHBondContact O-OG1 2.97Å; P675-T677 PolarHBondContact O-N 2.9Å; T677-Y679 PolarHBondContact O-N 2.96Å; T677-S680 WeakPolarHBondContact CA-OG 3.41Å; T677-S680 PolarHBondContact O-N 3.06Å; T677-S680 PolarHBondContact O-OG 3.12Å; T677-E681 WeakPolarHBondContact O-CG 3.38Å; T677-E681 PolarHBondContact O-N 3.23Å
678	M	96.1	Very high	91.4	Very high	8 Å²	8	58.9 Å²	58.9	4%	0.039	32%	0.315	C	S	.	.	H	α-helix	trans	-58.4	-46.5	177.2	-173.2	163.3	-71.8	0	0	113	M628 C661 G662 M665 S674 P675 S680 E681 T682	M628-M678 HydrophobicContact CE-CE 3.57Å; C661-M678 HydrophobicContact CB-CE 4.48Å; C661-M678 HydrophobicContact CB-SD 3.58Å; C661-M678 VanDerWaalsContact CB-SD 3.58Å; C661-M678 VanDerWaalsContact SG-CE 3.54Å; C661-M678 PolarHBondContact SG-SD 3.32Å; G662-M678 PolarHBondContact N-SD 3.35Å; M665-M678 HydrophobicContact CE-CE 4.27Å; M665-M678 HydrophobicContact SD-CE 3.42Å; M665-M678 WeakPolarHBondContact SD-CE 3.42Å; M665-M678 HydrophobicContact SD-SD 3.66Å; M665-M678 VanDerWaalsContact SD-SD 3.66Å; S674-M678 PolarHBondContact O-N 3.26Å; P675-M678 PolarHBondContact O-N 3.49Å; M678-S680 VanDerWaalsContact C-N 3.34Å; M678-S680 PolarHBondContact O-N 3.45Å; M678-E681 PolarHBondContact O-N 3.36Å; M678-T682 WeakPolarHBondContact O-CB 3.49Å; M678-T682 PolarHBondContact O-N 3.16Å; M678-T682 PolarHBondContact O-OG1 3.05Å
679	Y	97.4	Very high	91.9	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64	-38.7	174.1	-66.3	-40	0	0	0	112.1	I659 N663 E666 P675 T677 E681 T682 V683 L718 R721 L725	I659-Y679 HydrophobicContact CG2-CE1 4.1Å; N663-Y679 WeakPolarHBondContact CA-OH 3.48Å; N663-Y679 PolarHBondContact N-OH 3.5Å; N663-Y679 VanDerWaalsContact N-OH 3.13Å; E666-Y679 HydrophobicContact CG-CE2 4.42Å; E666-Y679 WeakPolarHBondContact OE1-CE2 3.44Å; E666-Y679 VanDerWaalsContact OE1-CZ 3.31Å; E666-Y679 PolarHBondContact OE1-OH 3.49Å; P675-Y679 HydrophobicContact CB-CE2 4.4Å; P675-Y679 VanDerWaalsContact O-CD2 3.28Å; P675-Y679 WeakPolarHBondContact O-CD2 3.41Å; P675-Y679 PolarHBondContact O-N 3.22Å; T677-Y679 PolarHBondContact O-N 2.96Å; Y679-E681 PolarHBondContact O-N 3.27Å; Y679-T682 PolarHBondContact O-N 3.34Å; Y679-V683 VanDerWaalsContact O-CG2 3.3Å; Y679-V683 WeakPolarHBondContact O-CG2 3.4Å; Y679-V683 PolarHBondContact O-N 3.4Å; Y679-L718 HydrophobicContact CD1-CD2 3.41Å; Y679-L718 VanDerWaalsContact CD1-CD2 3.41Å; Y679-L718 HydrophobicContact CE1-CD2 4.03Å; Y679-L718 HydrophobicContact CG-CD2 3.88Å; Y679-R721 HydrophobicContact CD2-CG 4.2Å; Y679-R721 HydrophobicContact CE2-CB 4.49Å; Y679-R721 HydrophobicContact CE2-CG 3.63Å; Y679-L725 HydrophobicContact CD2-CD1 3.7Å; Y679-L725 HydrophobicContact CE2-CD1 3.88Å
680	S	96.6	Very high	92.5	Very high	38 Å²	38	51.1 Å²	51.1	27%	0.266	27%	0.268	S	S	.	.	H	α-helix	trans	-65.6	-37.2	178.1	72.3	0	0	0	0	113.6	Y676 T677 M678 V683 E684	Y676-S680 WeakPolarHBondContact O-CB 3.37Å; Y676-S680 PolarHBondContact O-N 2.96Å; Y676-S680 PolarHBondContact O-OG 2.72Å; T677-S680 WeakPolarHBondContact CA-OG 3.41Å; T677-S680 PolarHBondContact O-N 3.06Å; T677-S680 PolarHBondContact O-OG 3.12Å; M678-S680 VanDerWaalsContact C-N 3.34Å; M678-S680 PolarHBondContact O-N 3.45Å; S680-V683 PolarHBondContact O-N 3.27Å; S680-E684 PolarHBondContact O-N 2.67Å
681	E	96.7	Very high	93.3	Very high	74 Å²	74	54.4 Å²	54.4	35%	0.346	28%	0.276	S	S	.	.	H	α-helix	trans	-69.9	-39.1	174	-70.2	162.8	-179	0	0	111.1	T677 M678 Y679 V683 E684 L685	T677-E681 WeakPolarHBondContact O-CG 3.38Å; T677-E681 PolarHBondContact O-N 3.23Å; M678-E681 PolarHBondContact O-N 3.36Å; Y679-E681 PolarHBondContact O-N 3.27Å; E681-V683 VanDerWaalsContact C-N 3.32Å; E681-V683 PolarHBondContact O-N 2.93Å; E681-E684 PolarHBondContact O-N 3.46Å; E681-E684 VanDerWaalsContact O-N 3.14Å; E681-L685 PolarHBondContact O-N 2.94Å
682	T	98.3	Very high	94.4	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.018	24%	0.236	C	C	.	.	H	α-helix	trans	-62.4	-38.7	174.2	-53.8	0	0	0	0	111.7	A655 F658 I659 M678 Y679 E684 L685 I686 L718	A655-T682 HydrophobicContact CB-CG2 3.87Å; F658-T682 HydrophobicContact CB-CG2 4.1Å; F658-T682 VanDerWaalsContact CB-OG1 3.31Å; F658-T682 WeakPolarHBondContact CB-OG1 3.42Å; I659-T682 HydrophobicContact CG1-CG2 4.01Å; M678-T682 WeakPolarHBondContact O-CB 3.49Å; M678-T682 PolarHBondContact O-N 3.16Å; M678-T682 PolarHBondContact O-OG1 3.05Å; Y679-T682 PolarHBondContact O-N 3.34Å; T682-E684 VanDerWaalsContact C-N 3.34Å; T682-E684 PolarHBondContact O-N 2.77Å; T682-L685 PolarHBondContact O-N 3.48Å; T682-I686 HydrophobicContact CG2-CD1 4.1Å; T682-I686 WeakPolarHBondContact O-CG1 3.45Å; T682-I686 PolarHBondContact O-N 3.09Å; T682-L718 HydrophobicContact CG2-CD1 4.07Å
683	V	98.1	Very high	95.4	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.012	22%	0.216	C	C	.	.	H	α-helix	trans	-65.1	-33.7	174.3	167.1	0	0	0	0	112	Y679 S680 E681 R687 L715 L718 Y719 M722	Y679-V683 VanDerWaalsContact O-CG2 3.3Å; Y679-V683 WeakPolarHBondContact O-CG2 3.4Å; Y679-V683 PolarHBondContact O-N 3.4Å; S680-V683 PolarHBondContact O-N 3.27Å; E681-V683 VanDerWaalsContact C-N 3.32Å; E681-V683 PolarHBondContact O-N 2.93Å; V683-R687 WeakPolarHBondContact O-CB 3.33Å; V683-R687 WeakPolarHBondContact O-CG 2.98Å; V683-R687 PolarHBondContact O-N 2.91Å; V683-R687 VanDerWaalsContact O-N 3.16Å; V683-R687 PolarHBondContact O-NE 3.22Å; V683-L715 HydrophobicContact CB-CD2 4.26Å; V683-L715 HydrophobicContact CG1-CD2 3.8Å; V683-L715 HydrophobicContact CG2-CD2 4.28Å; V683-L718 HydrophobicContact CG2-CB 3.68Å; V683-L718 HydrophobicContact CG2-CD1 3.86Å; V683-L718 HydrophobicContact CG2-CG 4.36Å; V683-Y719 HydrophobicContact CG1-CE1 3.79Å; V683-Y719 HydrophobicContact CG1-CE2 4.27Å; V683-M722 HydrophobicContact CG2-SD 4.16Å
684	E	97.4	Very high	95.9	Very high	83 Å²	83	47 Å²	47	39%	0.388	23%	0.227	S	C	.	.	H	α-helix	trans	-69.2	-41.8	169.6	-75.6	-61.1	157.7	0	0	112.1	S680 E681 T682 I686 R687 Y688 R691	S680-E684 PolarHBondContact O-N 2.67Å; E681-E684 PolarHBondContact O-N 3.46Å; E681-E684 VanDerWaalsContact O-N 3.14Å; T682-E684 VanDerWaalsContact C-N 3.34Å; T682-E684 PolarHBondContact O-N 2.77Å; E684-I686 PolarHBondContact O-N 3.01Å; E684-R687 VanDerWaalsContact CD-CZ 3.45Å; E684-R687 CarbonylContact O-C 3.54Å; E684-R687 PolarHBondContact O-N 3.09Å; E684-R687 IonicContact OE1-CZ 2.7Å; E684-R687 IonicContact OE1-NH1 3.49Å; E684-R687 PolarHBondContact OE1-NH1 2.77Å; E684-R687 IonicContact OE1-NH2 3.82Å; E684-R687 PolarHBondContact OE1-NH2 3.26Å; E684-R687 IonicContact OE2-CZ 2.71Å; E684-R687 IonicContact OE2-NH1 3.69Å; E684-R687 PolarHBondContact OE2-NH1 3.37Å; E684-R687 IonicContact OE2-NH2 2.79Å; E684-Y688 WeakPolarHBondContact O-CB 3.24Å; E684-Y688 PolarHBondContact O-N 3.24Å; E684-R691 IonicContact OE2-NH2 2.93Å; E684-R691 PolarHBondContact OE2-NH2 2.78Å
685	L	97.9	Very high	95.9	Very high	26 Å²	26	44.5 Å²	44.5	14%	0.136	21%	0.209	C	C	.	.	H	α-helix	trans	-60.2	-45.2	177.6	178.9	61.6	0	0	0	112.1	Y651 A655 F658 E681 T682 Y688 A689	Y651-L685 HydrophobicContact CD1-CD1 3.97Å; Y651-L685 HydrophobicContact CG-CD1 4.35Å; A655-L685 HydrophobicContact CB-CD2 4.09Å; A655-L685 HydrophobicContact CB-CG 4.49Å; F658-L685 HydrophobicContact CD2-CD2 3.77Å; F658-L685 HydrophobicContact CE2-CD2 3.8Å; E681-L685 PolarHBondContact O-N 2.94Å; T682-L685 PolarHBondContact O-N 3.48Å; L685-Y688 WeakPolarHBondContact O-CB 3.4Å; L685-Y688 PolarHBondContact O-N 2.92Å; L685-A689 PolarHBondContact O-N 3.06Å
686	I	98.1	Very high	95.7	Very high	3 Å²	3	46.6 Å²	46.6	2%	0.015	22%	0.222	C	C	.	.	H	α-helix	trans	-65.2	-43.6	176.5	-61.9	160.4	0	0	0	110.3	A655 T682 E684 Y688 A689 M690 C711 C714 L715 L718	A655-I686 HydrophobicContact CB-CD1 4.07Å; A655-I686 HydrophobicContact CB-CG1 3.55Å; T682-I686 HydrophobicContact CG2-CD1 4.1Å; T682-I686 WeakPolarHBondContact O-CG1 3.45Å; T682-I686 PolarHBondContact O-N 3.09Å; E684-I686 PolarHBondContact O-N 3.01Å; I686-Y688 VanDerWaalsContact C-N 3.25Å; I686-Y688 PolarHBondContact O-N 2.77Å; I686-A689 PolarHBondContact O-N 3.49Å; I686-M690 HydrophobicContact CG2-SD 4.24Å; I686-M690 WeakPolarHBondContact O-CG 3.34Å; I686-M690 PolarHBondContact O-N 2.79Å; I686-C711 HydrophobicContact CG2-CB 3.79Å; I686-C714 HydrophobicContact CD1-CB 3.86Å; I686-L715 HydrophobicContact CB-CD2 4Å; I686-L715 HydrophobicContact CB-CG 4.33Å; I686-L715 HydrophobicContact CD1-CD2 4.47Å; I686-L715 HydrophobicContact CG2-CD1 4Å; I686-L715 HydrophobicContact CG2-CD2 3.99Å; I686-L715 HydrophobicContact CG2-CG 3.76Å; I686-L718 HydrophobicContact CD1-CD1 3.58Å
687	R	96.8	Very high	95.5	Very high	67 Å²	67	46.7 Å²	46.7	25%	0.253	23%	0.226	S	C	.	.	H	α-helix	trans	-64.4	-28.1	174.5	-77.1	-172.8	-79	118.8	-5.6	112.7	V683 E684 R691 L715 Y719	V683-R687 WeakPolarHBondContact O-CB 3.33Å; V683-R687 WeakPolarHBondContact O-CG 2.98Å; V683-R687 PolarHBondContact O-N 2.91Å; V683-R687 VanDerWaalsContact O-N 3.16Å; V683-R687 PolarHBondContact O-NE 3.22Å; E684-R687 VanDerWaalsContact CD-CZ 3.45Å; E684-R687 CarbonylContact O-C 3.54Å; E684-R687 PolarHBondContact O-N 3.09Å; E684-R687 IonicContact OE1-CZ 2.7Å; E684-R687 IonicContact OE1-NH1 3.49Å; E684-R687 PolarHBondContact OE1-NH1 2.77Å; E684-R687 IonicContact OE1-NH2 3.82Å; E684-R687 PolarHBondContact OE1-NH2 3.26Å; E684-R687 IonicContact OE2-CZ 2.71Å; E684-R687 IonicContact OE2-NH1 3.69Å; E684-R687 PolarHBondContact OE2-NH1 3.37Å; E684-R687 IonicContact OE2-NH2 2.79Å; R687-R691 WeakPolarHBondContact O-CG 3.32Å; R687-R691 PolarHBondContact O-N 3.45Å; R687-R691 PolarHBondContact O-NE 2.8Å; R687-L715 HydrophobicContact CG-CD1 4.11Å; R687-L715 HydrophobicContact CG-CD2 4.04Å; R687-Y719 PolarHBondContact NE-OH 2.71Å
688	Y	97.4	Very high	95.1	Very high	108 Å²	108	50.7 Å²	50.7	42%	0.424	24%	0.24	S	C	.	.	H	α-helix	trans	-72.6	-46	172.7	171.8	-105.1	0	0	0	111.3	Y651 E684 L685 I686 M690 R691 L692	Y651-Y688 HydrophobicContact CD2-CD1 4.43Å; Y651-Y688 HydrophobicContact CD2-CE1 4.3Å; Y651-Y688 HydrophobicContact CE2-CD1 4.11Å; Y651-Y688 AromaticContact CE2-CE1 3.55Å; Y651-Y688 HydrophobicContact CE2-CE1 3.55Å; Y651-Y688 AromaticContact CZ-CE1 3.78Å; E684-Y688 WeakPolarHBondContact O-CB 3.24Å; E684-Y688 PolarHBondContact O-N 3.24Å; L685-Y688 WeakPolarHBondContact O-CB 3.4Å; L685-Y688 PolarHBondContact O-N 2.92Å; I686-Y688 VanDerWaalsContact C-N 3.25Å; I686-Y688 PolarHBondContact O-N 2.77Å; Y688-M690 VanDerWaalsContact C-N 3.29Å; Y688-M690 PolarHBondContact O-N 3.08Å; Y688-R691 WeakPolarHBondContact O-CA 3.14Å; Y688-R691 WeakPolarHBondContact O-CB 3.49Å; Y688-R691 PolarHBondContact O-N 3.34Å; Y688-L692 HydrophobicContact CE1-CD2 4.18Å; Y688-L692 HydrophobicContact CE2-CD2 4.4Å; Y688-L692 PolarHBondContact O-N 2.92Å
689	A	97.1	Very high	94.8	Very high	2 Å²	2	55.4 Å²	55.4	2%	0.017	27%	0.274	C	S	.	.	H	α-helix	trans	-55.3	-45.6	174.4	0	0	0	0	0	111.4	Y651 L685 I686 R691 L692 F695	Y651-A689 HydrophobicContact CD2-CB 4.23Å; Y651-A689 HydrophobicContact CG-CB 4.44Å; L685-A689 PolarHBondContact O-N 3.06Å; I686-A689 PolarHBondContact O-N 3.49Å; A689-R691 PolarHBondContact O-N 3.34Å; A689-L692 WeakPolarHBondContact O-CG 3.39Å; A689-L692 PolarHBondContact O-N 3.03Å; A689-F695 VanDerWaalsContact O-CE2 3.32Å; A689-F695 WeakPolarHBondContact O-CE2 3.27Å
690	M	95.4	Very high	94.6	Very high	40 Å²	40	56 Å²	56	20%	0.197	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-12.6	174.8	-68.8	177.9	71.8	0	0	114.8	I686 Y688 K693 C711 N712 L715	I686-M690 HydrophobicContact CG2-SD 4.24Å; I686-M690 WeakPolarHBondContact O-CG 3.34Å; I686-M690 PolarHBondContact O-N 2.79Å; Y688-M690 VanDerWaalsContact C-N 3.29Å; Y688-M690 PolarHBondContact O-N 3.08Å; M690-K693 VanDerWaalsContact O-O 3.12Å; M690-C711 HydrophobicContact CG-CB 3.79Å; M690-C711 HydrophobicContact SD-CB 3.53Å; M690-C711 VanDerWaalsContact SD-CB 3.53Å; M690-N712 WeakPolarHBondContact CE-ND2 3.4Å; M690-L715 HydrophobicContact SD-CD1 3.65Å
691	R	95.2	Very high	94.5	Very high	143 Å²	143	57.9 Å²	57.9	54%	0.54	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-9.4	177.3	-85.6	175.9	-84.2	172.4	-5.8	113.7	E684 R687 Y688 A689 K693	E684-R691 IonicContact OE2-NH2 2.93Å; E684-R691 PolarHBondContact OE2-NH2 2.78Å; R687-R691 WeakPolarHBondContact O-CG 3.32Å; R687-R691 PolarHBondContact O-N 3.45Å; R687-R691 PolarHBondContact O-NE 2.8Å; Y688-R691 WeakPolarHBondContact O-CA 3.14Å; Y688-R691 WeakPolarHBondContact O-CB 3.49Å; Y688-R691 PolarHBondContact O-N 3.34Å; A689-R691 PolarHBondContact O-N 3.34Å; R691-K693 VanDerWaalsContact C-N 3.31Å; R691-K693 PolarHBondContact O-N 2.7Å
692	L	93.8	Very high	94.3	Very high	26 Å²	26	57.8 Å²	57.8	14%	0.136	29%	0.293	C	S	.	.	S	Bend	trans	-65	-33.5	-178.7	-63.8	171.6	0	0	0	113.4	K644 K647 A648 Y651 Y688 A689 F695	K644-L692 WeakPolarHBondContact CD-O 3.47Å; K644-L692 WeakPolarHBondContact CE-O 3.44Å; K644-L692 PolarHBondContact NZ-O 2.55Å; K647-L692 HydrophobicContact CB-CD1 4.22Å; K647-L692 HydrophobicContact CD-CD1 4Å; K647-L692 HydrophobicContact CD-CD2 4.29Å; K647-L692 HydrophobicContact CG-CD1 3.79Å; A648-L692 HydrophobicContact CB-CD1 4.12Å; Y651-L692 HydrophobicContact CD2-CD1 3.86Å; Y651-L692 HydrophobicContact CE2-CD1 3.89Å; Y688-L692 HydrophobicContact CE1-CD2 4.18Å; Y688-L692 HydrophobicContact CE2-CD2 4.4Å; Y688-L692 PolarHBondContact O-N 2.92Å; A689-L692 WeakPolarHBondContact O-CG 3.39Å; A689-L692 PolarHBondContact O-N 3.03Å; L692-F695 HydrophobicContact CB-CE2 4.36Å
693	K	92.5	Very high	94.1	Very high	97 Å²	97	59.5 Å²	59.5	42%	0.422	30%	0.302	S	S	.	.	S	Bend	trans	-149	156.1	175.6	-170.7	172	174.5	-173.5	0	107.7	K644 M690 R691 F695 E704	K644-K693 HydrophobicContact CB-CB 4.42Å; K644-K693 HydrophobicContact CD-CB 4.38Å; M690-K693 VanDerWaalsContact O-O 3.12Å; R691-K693 VanDerWaalsContact C-N 3.31Å; R691-K693 PolarHBondContact O-N 2.7Å; K693-F695 VanDerWaalsContact C-N 3.26Å; K693-F695 HydrophobicContact CB-CD2 4.39Å; K693-F695 HydrophobicContact CB-CE1 4.1Å; K693-F695 HydrophobicContact CB-CE2 3.92Å; K693-F695 HydrophobicContact CB-CZ 3.76Å; K693-F695 WeakPolarHBondContact O-CD2 3.3Å; K693-F695 WeakPolarHBondContact O-CE2 3.47Å; K693-F695 PolarHBondContact O-N 2.72Å; K693-E704 WeakPolarHBondContact CD-OE1 3.43Å; K693-E704 WeakPolarHBondContact CE-OE1 3.41Å; K693-E704 IonicContact NZ-OE1 2.67Å; K693-E704 PolarHBondContact NZ-OE1 3.5Å; K693-E704 IonicContact NZ-OE2 3.13Å
694	N	92.3	Very high	94	Very high	98 Å²	98	59.8 Å²	59.8	52%	0.524	30%	0.303	S	S	.	.			trans	-77.8	75.9	174.7	-173.1	3.1	0	0	0	110.8	T696 S697	N694-T696 PolarHBondContact O-N 2.99Å; N694-T696 VanDerWaalsContact O-N 3.09Å; N694-T696 PolarHBondContact OD1-N 3.13Å; N694-T696 PolarHBondContact OD1-OG1 3.43Å; N694-S697 VanDerWaalsContact O-CB 3.32Å; N694-S697 WeakPolarHBondContact O-CB 3.34Å; N694-S697 PolarHBondContact O-N 3.35Å; N694-S697 PolarHBondContact OD1-N 3.2Å
695	F	91.9	Very high	93.9	Very high	5 Å²	5	57.2 Å²	57.2	2%	0.022	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-13.3	179.2	-58.6	-79.9	0	0	0	113.7	F645 A648 A689 L692 K693 A700 E704 L707 A708	F645-F695 HydrophobicContact CD2-CE1 4.1Å; A648-F695 HydrophobicContact CB-CE1 4.25Å; A648-F695 HydrophobicContact CB-CE2 4Å; A648-F695 HydrophobicContact CB-CZ 3.52Å; A689-F695 VanDerWaalsContact O-CE2 3.32Å; A689-F695 WeakPolarHBondContact O-CE2 3.27Å; L692-F695 HydrophobicContact CB-CE2 4.36Å; K693-F695 VanDerWaalsContact C-N 3.26Å; K693-F695 HydrophobicContact CB-CD2 4.39Å; K693-F695 HydrophobicContact CB-CE1 4.1Å; K693-F695 HydrophobicContact CB-CE2 3.92Å; K693-F695 HydrophobicContact CB-CZ 3.76Å; K693-F695 WeakPolarHBondContact O-CD2 3.3Å; K693-F695 WeakPolarHBondContact O-CE2 3.47Å; K693-F695 PolarHBondContact O-N 2.72Å; F695-A700 WeakPolarHBondContact O-CB 3.49Å; F695-E704 HydrophobicContact CD1-CB 3.84Å; F695-E704 HydrophobicContact CD1-CG 3.84Å; F695-E704 HydrophobicContact CE1-CG 4.23Å; F695-L707 HydrophobicContact CD1-CD2 4.4Å; F695-L707 HydrophobicContact CE1-CD2 4.22Å; F695-A708 HydrophobicContact CB-CB 3.98Å
696	T	91.2	Very high	93.8	Very high	65 Å²	65	57.5 Å²	57.5	40%	0.399	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	9	177.3	49.8	0	0	0	0	113.5	N694 A708 L833	N694-T696 PolarHBondContact O-N 2.99Å; N694-T696 VanDerWaalsContact O-N 3.09Å; N694-T696 PolarHBondContact OD1-N 3.13Å; N694-T696 PolarHBondContact OD1-OG1 3.43Å; T696-A708 HydrophobicContact CG2-CB 3.87Å; T696-L833 HydrophobicContact CG2-CD1 3.65Å; T696-L833 HydrophobicContact CG2-CD2 4.13Å
697	S	90.8	Very high	93.7	Very high	27 Å²	27	57.4 Å²	57.4	19%	0.189	29%	0.289	C	S	.	.	S	Bend	trans	-67.5	150.8	175.4	-171.3	0	0	0	0	111.8	N694 S699 A700 K705	N694-S697 VanDerWaalsContact O-CB 3.32Å; N694-S697 WeakPolarHBondContact O-CB 3.34Å; N694-S697 PolarHBondContact O-N 3.35Å; N694-S697 PolarHBondContact OD1-N 3.2Å; S697-S699 PolarHBondContact O-N 2.88Å; S697-S699 PolarHBondContact OG-N 3.35Å; S697-S699 PolarHBondContact OG-OG 3.43Å; S697-A700 VanDerWaalsContact O-CB 3.24Å; S697-A700 WeakPolarHBondContact O-CB 3.38Å; S697-A700 PolarHBondContact O-N 3.2Å; S697-K705 WeakPolarHBondContact O-CE 3.42Å
698	H	87.1	Confident	93.7	Very high	149 Å²	149	54.3 Å²	54.3	69%	0.69	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-33.2	166.3	-56.2	116	0	0	0	111.7	F298 A700	F298-H698 AromaticContact CE1-CE1 3.78Å; F298-H698 AromaticContact CE1-NE2 3.47Å; F298-H698 WeakPolarHBondContact CE1-NE2 3.07Å; F298-H698 AromaticContact CZ-NE2 3.85Å; H698-A700 VanDerWaalsContact C-N 3.34Å
699	S	89.7	Confident	93.6	Very high	108 Å²	108	49.1 Å²	49.1	76%	0.755	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	4.9	174.4	58.6	0	0	0	0	115.1	S697	S697-S699 PolarHBondContact O-N 2.88Å; S697-S699 PolarHBondContact OG-N 3.35Å; S697-S699 PolarHBondContact OG-OG 3.43Å
700	A	93.3	Very high	93.6	Very high	12 Å²	12	49 Å²	49	10%	0.099	26%	0.257	C	S	.	.	S	Bend	trans	-74.4	142.7	173.2	0	0	0	0	0	110.6	F695 S697 H698 E704 K705	F695-A700 WeakPolarHBondContact O-CB 3.49Å; S697-A700 VanDerWaalsContact O-CB 3.24Å; S697-A700 WeakPolarHBondContact O-CB 3.38Å; S697-A700 PolarHBondContact O-N 3.2Å; H698-A700 VanDerWaalsContact C-N 3.34Å; A700-E704 HydrophobicContact CB-CB 4.12Å; A700-K705 HydrophobicContact CB-CG 4.1Å; A700-K705 VanDerWaalsContact O-CE 3.3Å; A700-K705 WeakPolarHBondContact O-CE 3.36Å
701	T	93.8	Very high	93.7	Very high	77 Å²	77	47.4 Å²	47.4	47%	0.472	25%	0.249	S	C	.	.			trans	-67.5	162.2	177.7	61.9	0	0	0	0	111.8	L703 E704 K705	T701-L703 VanDerWaalsContact C-N 3.26Å; T701-L703 PolarHBondContact O-N 3.12Å; T701-E704 WeakPolarHBondContact CB-OE2 3.31Å; T701-E704 WeakPolarHBondContact CG2-OE2 3.43Å; T701-E704 PolarHBondContact N-OE2 2.95Å; T701-E704 WeakPolarHBondContact O-CB 3.36Å; T701-E704 PolarHBondContact O-N 2.87Å; T701-E704 WeakPolarHBondContact OG1-CG 3.32Å; T701-E704 PolarHBondContact OG1-N 3.46Å; T701-E704 PolarHBondContact OG1-OE2 3.2Å; T701-K705 PolarHBondContact O-N 3.4Å
702	V	93.3	Very high	93.7	Very high	73 Å²	73	40.8 Å²	40.8	44%	0.442	22%	0.224	S	C	.	.	H	α-helix	trans	-57.8	-39.1	179.7	-178.5	0	0	0	0	111.9	E704 K705 R706	V702-E704 VanDerWaalsContact C-N 3.33Å; V702-E704 PolarHBondContact O-N 3.38Å; V702-K705 PolarHBondContact O-N 3.5Å; V702-R706 WeakPolarHBondContact O-CB 3.37Å; V702-R706 VanDerWaalsContact O-CG 3.25Å; V702-R706 WeakPolarHBondContact O-CG 3.45Å; V702-R706 PolarHBondContact O-N 2.93Å
703	L	93.7	Very high	93.8	Very high	39 Å²	39	40 Å²	40	20%	0.204	22%	0.22	C	C	.	.	H	α-helix	trans	-65.4	-36.5	176.8	-61.4	174.9	0	0	0	112.2	F645 T701 L707 L868 E871 A872	F645-L703 HydrophobicContact CE2-CB 4.28Å; F645-L703 HydrophobicContact CZ-CB 3.96Å; T701-L703 VanDerWaalsContact C-N 3.26Å; T701-L703 PolarHBondContact O-N 3.12Å; L703-L707 WeakPolarHBondContact O-CB 3.5Å; L703-L707 PolarHBondContact O-N 3.39Å; L703-L868 HydrophobicContact CB-CD2 4.31Å; L703-L868 HydrophobicContact CD2-CD2 3.69Å; L703-E871 HydrophobicContact CD2-CB 3.8Å; L703-A872 HydrophobicContact CD1-CB 4.09Å
704	E	95.2	Very high	94	Very high	7 Å²	7	35.7 Å²	35.7	3%	0.033	20%	0.201	C	C	.	.	H	α-helix	trans	-70.8	-43.2	177	-72.5	172.3	134.9	0	0	112.2	F645 K693 F695 A700 T701 V702 L707 A708	F645-E704 HydrophobicContact CD2-CG 3.68Å; F645-E704 HydrophobicContact CE2-CG 4.07Å; K693-E704 WeakPolarHBondContact CD-OE1 3.43Å; K693-E704 WeakPolarHBondContact CE-OE1 3.41Å; K693-E704 IonicContact NZ-OE1 2.67Å; K693-E704 PolarHBondContact NZ-OE1 3.5Å; K693-E704 IonicContact NZ-OE2 3.13Å; F695-E704 HydrophobicContact CD1-CB 3.84Å; F695-E704 HydrophobicContact CD1-CG 3.84Å; F695-E704 HydrophobicContact CE1-CG 4.23Å; A700-E704 HydrophobicContact CB-CB 4.12Å; T701-E704 WeakPolarHBondContact CB-OE2 3.31Å; T701-E704 WeakPolarHBondContact CG2-OE2 3.43Å; T701-E704 PolarHBondContact N-OE2 2.95Å; T701-E704 WeakPolarHBondContact O-CB 3.36Å; T701-E704 PolarHBondContact O-N 2.87Å; T701-E704 WeakPolarHBondContact OG1-CG 3.32Å; T701-E704 PolarHBondContact OG1-N 3.46Å; T701-E704 PolarHBondContact OG1-OE2 3.2Å; V702-E704 VanDerWaalsContact C-N 3.33Å; V702-E704 PolarHBondContact O-N 3.38Å; E704-L707 PolarHBondContact O-N 2.89Å; E704-A708 PolarHBondContact O-N 2.9Å
705	K	95.4	Very high	94.2	Very high	30 Å²	30	31 Å²	31	13%	0.13	18%	0.176	C	C	.	.	H	α-helix	trans	-61.7	-44.4	173.2	-66.6	-175.5	-175.3	178.9	0	111.3	S697 A700 T701 V702 L707 A708 V709 D836	S697-K705 WeakPolarHBondContact O-CE 3.42Å; A700-K705 HydrophobicContact CB-CG 4.1Å; A700-K705 VanDerWaalsContact O-CE 3.3Å; A700-K705 WeakPolarHBondContact O-CE 3.36Å; T701-K705 PolarHBondContact O-N 3.4Å; V702-K705 PolarHBondContact O-N 3.5Å; K705-L707 PolarHBondContact O-N 3.35Å; K705-A708 WeakPolarHBondContact O-CA 3.29Å; K705-A708 WeakPolarHBondContact O-CB 3.43Å; K705-A708 PolarHBondContact O-N 2.91Å; K705-A708 VanDerWaalsContact O-N 3.12Å; K705-V709 WeakPolarHBondContact O-CG2 3.3Å; K705-V709 PolarHBondContact O-N 3.16Å; K705-D836 HydrophobicContact CD-CB 4.41Å; K705-D836 VanDerWaalsContact CD-OD2 3.29Å; K705-D836 WeakPolarHBondContact CD-OD2 3.09Å; K705-D836 WeakPolarHBondContact CE-OD2 3.45Å; K705-D836 IonicContact NZ-OD2 3.95Å; K705-D836 PolarHBondContact NZ-OD2 2.91Å
706	R	95.6	Very high	94.5	Very high	31 Å²	31	30.8 Å²	30.8	12%	0.117	18%	0.175	C	C	.	.	H	α-helix	trans	-60.3	-42.6	174.4	-72.8	173.5	-172.8	172.1	9.8	112.4	V702 A708 V709 L710 F840 F841 L868 E871	V702-R706 WeakPolarHBondContact O-CB 3.37Å; V702-R706 VanDerWaalsContact O-CG 3.25Å; V702-R706 WeakPolarHBondContact O-CG 3.45Å; V702-R706 PolarHBondContact O-N 2.93Å; R706-A708 VanDerWaalsContact C-N 3.31Å; R706-A708 PolarHBondContact O-N 2.74Å; R706-V709 WeakPolarHBondContact O-CB 3.25Å; R706-V709 PolarHBondContact O-N 3.12Å; R706-L710 WeakPolarHBondContact O-CG 3.5Å; R706-L710 PolarHBondContact O-N 2.91Å; R706-L710 VanDerWaalsContact O-N 3.08Å; R706-F840 HydrophobicContact CB-CE1 4.39Å; R706-F840 HydrophobicContact CG-CD1 4.02Å; R706-F840 HydrophobicContact CG-CE1 4.31Å; R706-F840 HydrophobicContact CG-CG 4.33Å; R706-F841 HydrophobicContact CB-CE2 4.18Å; R706-F841 HydrophobicContact CB-CZ 4.05Å; R706-F841 HydrophobicContact CG-CE2 3.79Å; R706-F841 HydrophobicContact CG-CZ 4.14Å; R706-L868 HydrophobicContact CB-CD1 4.37Å; R706-L868 HydrophobicContact CB-CD2 3.8Å; R706-E871 IonicContact CZ-OE2 2.91Å; R706-E871 VanDerWaalsContact NH1-CD 3.26Å; R706-E871 IonicContact NH1-OE1 3.66Å; R706-E871 PolarHBondContact NH1-OE1 3.04Å; R706-E871 IonicContact NH1-OE2 3.48Å; R706-E871 PolarHBondContact NH1-OE2 3.46Å; R706-E871 IonicContact NH2-OE2 3.22Å
707	L	96.7	Very high	94.6	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-60.8	-40.7	173.2	-179.6	62.4	0	0	0	111.5	F645 A648 V649 A652 F695 L703 E704 K705 L710 C711 L865 L868	F645-L707 HydrophobicContact CD2-CD2 3.87Å; F645-L707 HydrophobicContact CE2-CB 4.03Å; F645-L707 HydrophobicContact CE2-CD2 3.71Å; F645-L707 HydrophobicContact CE2-CG 4.5Å; A648-L707 HydrophobicContact CB-CD2 3.79Å; V649-L707 HydrophobicContact CG2-CD1 4.08Å; V649-L707 HydrophobicContact CG2-CD2 3.81Å; A652-L707 HydrophobicContact CB-CD1 4.45Å; F695-L707 HydrophobicContact CD1-CD2 4.4Å; F695-L707 HydrophobicContact CE1-CD2 4.22Å; L703-L707 WeakPolarHBondContact O-CB 3.5Å; L703-L707 PolarHBondContact O-N 3.39Å; E704-L707 PolarHBondContact O-N 2.89Å; K705-L707 PolarHBondContact O-N 3.35Å; L707-L710 PolarHBondContact O-N 3.42Å; L707-C711 PolarHBondContact O-N 3Å; L707-C711 PolarHBondContact O-SG 2.79Å; L707-C711 VanDerWaalsContact O-SG 3.4Å; L707-L865 HydrophobicContact CD1-CD2 3.64Å; L707-L868 HydrophobicContact CB-CD1 4.09Å; L707-L868 HydrophobicContact CD1-CD1 4.41Å
708	A	96.7	Very high	94.9	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.008	15%	0.148	C	C	.	.	H	α-helix	trans	-63.5	-40.6	175.2	0	0	0	0	0	112.5	F695 T696 E704 K705 R706 C711 N712 L833	F695-A708 HydrophobicContact CB-CB 3.98Å; T696-A708 HydrophobicContact CG2-CB 3.87Å; E704-A708 PolarHBondContact O-N 2.9Å; K705-A708 WeakPolarHBondContact O-CA 3.29Å; K705-A708 WeakPolarHBondContact O-CB 3.43Å; K705-A708 PolarHBondContact O-N 2.91Å; K705-A708 VanDerWaalsContact O-N 3.12Å; R706-A708 VanDerWaalsContact C-N 3.31Å; R706-A708 PolarHBondContact O-N 2.74Å; A708-C711 PolarHBondContact O-N 3.16Å; A708-N712 WeakPolarHBondContact O-CB 3.45Å; A708-N712 PolarHBondContact O-N 2.63Å; A708-N712 PolarHBondContact O-ND2 3.24Å; A708-L833 HydrophobicContact CB-CD1 4.1Å
709	V	96.2	Very high	95.4	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-57.3	-51.7	173.3	174	0	0	0	0	110.6	K705 R706 C711 N712 R713 A830 L833 A834 F841	K705-V709 WeakPolarHBondContact O-CG2 3.3Å; K705-V709 PolarHBondContact O-N 3.16Å; R706-V709 WeakPolarHBondContact O-CB 3.25Å; R706-V709 PolarHBondContact O-N 3.12Å; V709-C711 PolarHBondContact O-N 3.32Å; V709-N712 PolarHBondContact O-N 2.94Å; V709-N712 VanDerWaalsContact O-N 3.16Å; V709-R713 HydrophobicContact CG1-CG 4.45Å; V709-R713 WeakPolarHBondContact O-CG 3.43Å; V709-R713 PolarHBondContact O-N 3.41Å; V709-A830 HydrophobicContact CG1-CB 4.16Å; V709-L833 HydrophobicContact CG2-CB 3.47Å; V709-L833 VanDerWaalsContact CG2-CB 3.47Å; V709-A834 HydrophobicContact CG1-CB 4.15Å; V709-A834 HydrophobicContact CG2-CB 4.08Å; V709-F841 HydrophobicContact CB-CE1 4.16Å; V709-F841 HydrophobicContact CB-CE2 3.85Å; V709-F841 HydrophobicContact CB-CZ 3.49Å; V709-F841 VanDerWaalsContact CB-CZ 3.49Å; V709-F841 HydrophobicContact CG1-CD1 4.17Å; V709-F841 HydrophobicContact CG1-CD2 4.35Å; V709-F841 HydrophobicContact CG1-CE1 3.6Å; V709-F841 HydrophobicContact CG1-CE2 3.78Å; V709-F841 HydrophobicContact CG1-CZ 3.4Å; V709-F841 VanDerWaalsContact CG1-CZ 3.4Å; V709-F841 HydrophobicContact CG2-CE2 3.87Å; V709-F841 HydrophobicContact CG2-CZ 4.05Å
710	L	95.9	Very high	95.6	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-57.4	-47.4	178.9	-67.4	175.5	0	0	0	111.6	R706 L707 N712 R713 C714 F841 L844 Y860 I861 L865 L868	R706-L710 WeakPolarHBondContact O-CG 3.5Å; R706-L710 PolarHBondContact O-N 2.91Å; R706-L710 VanDerWaalsContact O-N 3.08Å; L707-L710 PolarHBondContact O-N 3.42Å; L710-N712 PolarHBondContact O-N 2.88Å; L710-R713 PolarHBondContact O-N 3.47Å; L710-C714 PolarHBondContact O-N 2.78Å; L710-C714 PolarHBondContact O-SG 3.47Å; L710-F841 HydrophobicContact CD2-CE1 3.96Å; L710-F841 HydrophobicContact CG-CE1 4.33Å; L710-L844 HydrophobicContact CD2-CD2 4.06Å; L710-Y860 HydrophobicContact CD2-CE1 3.97Å; L710-I861 HydrophobicContact CB-CD1 3.99Å; L710-I861 HydrophobicContact CB-CG2 4.19Å; L710-I861 HydrophobicContact CD2-CD1 3.76Å; L710-I861 HydrophobicContact CD2-CG2 4.49Å; L710-I861 HydrophobicContact CG-CD1 4.48Å; L710-I861 VanDerWaalsContact O-CD1 3.31Å; L710-I861 WeakPolarHBondContact O-CD1 3.47Å; L710-L865 HydrophobicContact CD1-CD2 4.06Å; L710-L865 HydrophobicContact CD1-CG 4.36Å; L710-L868 HydrophobicContact CD1-CD1 3.59Å
711	C	97.4	Very high	95.7	Very high	6 Å²	6	18.8 Å²	18.8	4%	0.041	10%	0.095	C	C	.	.	H	α-helix	trans	-63.2	-37.9	176.9	-70.7	0	0	0	0	112.8	I686 M690 L707 A708 V709 C714 L715	I686-C711 HydrophobicContact CG2-CB 3.79Å; M690-C711 HydrophobicContact CG-CB 3.79Å; M690-C711 HydrophobicContact SD-CB 3.53Å; M690-C711 VanDerWaalsContact SD-CB 3.53Å; L707-C711 PolarHBondContact O-N 3Å; L707-C711 PolarHBondContact O-SG 2.79Å; L707-C711 VanDerWaalsContact O-SG 3.4Å; A708-C711 PolarHBondContact O-N 3.16Å; V709-C711 PolarHBondContact O-N 3.32Å; C711-C714 WeakPolarHBondContact O-CB 3.28Å; C711-C714 PolarHBondContact O-N 3.11Å; C711-L715 VanDerWaalsContact O-CG 3.3Å; C711-L715 WeakPolarHBondContact O-CG 3.17Å; C711-L715 PolarHBondContact O-N 3.47Å
712	N	96.4	Very high	95.8	Very high	3 Å²	3	15.5 Å²	15.5	2%	0.016	8%	0.075	C	C	.	.	H	α-helix	trans	-66.5	-39.9	174.4	-84.5	-85.2	0	0	0	112.3	M690 A708 V709 L710 C714 L715 S716 T829 A830	M690-N712 WeakPolarHBondContact CE-ND2 3.4Å; A708-N712 WeakPolarHBondContact O-CB 3.45Å; A708-N712 PolarHBondContact O-N 2.63Å; A708-N712 PolarHBondContact O-ND2 3.24Å; V709-N712 PolarHBondContact O-N 2.94Å; V709-N712 VanDerWaalsContact O-N 3.16Å; L710-N712 PolarHBondContact O-N 2.88Å; N712-C714 VanDerWaalsContact C-N 3.35Å; N712-C714 PolarHBondContact O-N 3.09Å; N712-L715 PolarHBondContact O-N 3.29Å; N712-S716 WeakPolarHBondContact O-CB 3.35Å; N712-S716 PolarHBondContact O-N 3.2Å; N712-T829 WeakPolarHBondContact OD1-CG2 3.4Å; N712-A830 HydrophobicContact CB-CB 3.71Å
713	R	95.6	Very high	95.9	Very high	10 Å²	10	13.4 Å²	13.4	4%	0.038	6%	0.06	C	C	.	.	H	α-helix	trans	-59.6	-43.6	172.1	-67.9	-69.4	-166.8	-131.8	-1.3	111.3	V709 L710 S716 L717 W827 A830 D831 L848 Y860 I861	V709-R713 HydrophobicContact CG1-CG 4.45Å; V709-R713 WeakPolarHBondContact O-CG 3.43Å; V709-R713 PolarHBondContact O-N 3.41Å; L710-R713 PolarHBondContact O-N 3.47Å; R713-S716 PolarHBondContact O-N 3.29Å; R713-L717 PolarHBondContact O-N 3.02Å; R713-W827 PolarHBondContact NH1-O 3.23Å; R713-A830 HydrophobicContact CG-CB 4.01Å; R713-D831 IonicContact CZ-OD1 3.53Å; R713-D831 IonicContact NH1-OD1 2.7Å; R713-D831 PolarHBondContact NH1-OD1 2.74Å; R713-D831 IonicContact NH2-OD1 2.66Å; R713-D831 PolarHBondContact NH2-OD1 3.5Å; R713-L848 HydrophobicContact CB-CD2 4.28Å; R713-L848 HydrophobicContact CG-CD2 4.29Å; R713-Y860 HydrophobicContact CG-CE1 4.35Å; R713-I861 HydrophobicContact CB-CD1 4.04Å
714	C	96.4	Very high	95.9	Very high	6 Å²	6	15.6 Å²	15.6	4%	0.041	7%	0.068	C	C	.	.	H	α-helix	trans	-58.5	-52.8	173.6	-62.3	0	0	0	0	112	I686 L710 C711 N712 S716 L717 L718 I861	I686-C714 HydrophobicContact CD1-CB 3.86Å; L710-C714 PolarHBondContact O-N 2.78Å; L710-C714 PolarHBondContact O-SG 3.47Å; C711-C714 WeakPolarHBondContact O-CB 3.28Å; C711-C714 PolarHBondContact O-N 3.11Å; N712-C714 VanDerWaalsContact C-N 3.35Å; N712-C714 PolarHBondContact O-N 3.09Å; C714-S716 VanDerWaalsContact C-N 3.31Å; C714-S716 PolarHBondContact O-N 2.89Å; C714-L717 PolarHBondContact O-N 2.97Å; C714-L718 VanDerWaalsContact O-CB 3.3Å; C714-L718 WeakPolarHBondContact O-CB 3.47Å; C714-L718 WeakPolarHBondContact O-CG 3.37Å; C714-L718 PolarHBondContact O-N 3.47Å; C714-I861 VanDerWaalsContact SG-CG1 3.55Å
715	L	97.1	Very high	95.8	Very high	0 Å²	0	18 Å²	18	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-59	-42.8	-179.4	-72.1	169.1	0	0	0	111.5	V683 I686 R687 M690 C711 N712 L718 Y719 Q826	V683-L715 HydrophobicContact CB-CD2 4.26Å; V683-L715 HydrophobicContact CG1-CD2 3.8Å; V683-L715 HydrophobicContact CG2-CD2 4.28Å; I686-L715 HydrophobicContact CB-CD2 4Å; I686-L715 HydrophobicContact CB-CG 4.33Å; I686-L715 HydrophobicContact CD1-CD2 4.47Å; I686-L715 HydrophobicContact CG2-CD1 4Å; I686-L715 HydrophobicContact CG2-CD2 3.99Å; I686-L715 HydrophobicContact CG2-CG 3.76Å; R687-L715 HydrophobicContact CG-CD1 4.11Å; R687-L715 HydrophobicContact CG-CD2 4.04Å; M690-L715 HydrophobicContact SD-CD1 3.65Å; C711-L715 VanDerWaalsContact O-CG 3.3Å; C711-L715 WeakPolarHBondContact O-CG 3.17Å; C711-L715 PolarHBondContact O-N 3.47Å; N712-L715 PolarHBondContact O-N 3.29Å; L715-L718 PolarHBondContact O-N 3.16Å; L715-Y719 HydrophobicContact CB-CE2 4.44Å; L715-Y719 WeakPolarHBondContact O-CB 3.35Å; L715-Y719 WeakPolarHBondContact O-CD2 3.43Å; L715-Y719 PolarHBondContact O-N 3.35Å; L715-Q826 HydrophobicContact CB-CB 4.29Å; L715-Q826 HydrophobicContact CB-CG 4.1Å
716	S	96.3	Very high	95.8	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.4	-52.3	179.4	177.9	0	0	0	0	112.8	N712 R713 C714 Y719 L720 S823 W827	N712-S716 WeakPolarHBondContact O-CB 3.35Å; N712-S716 PolarHBondContact O-N 3.2Å; R713-S716 PolarHBondContact O-N 3.29Å; C714-S716 VanDerWaalsContact C-N 3.31Å; C714-S716 PolarHBondContact O-N 2.89Å; S716-Y719 PolarHBondContact O-N 2.79Å; S716-L720 PolarHBondContact O-N 3.01Å; S716-L720 VanDerWaalsContact O-N 3.12Å; S716-S823 WeakPolarHBondContact CB-O 3.34Å; S716-S823 VanDerWaalsContact O-CB 3.27Å; S716-S823 WeakPolarHBondContact O-CB 3.47Å; S716-S823 PolarHBondContact O-OG 3.1Å; S716-S823 PolarHBondContact OG-O 2.99Å; S716-S823 PolarHBondContact OG-OG 2.89Å; S716-W827 WeakPolarHBondContact OG-CB 3.32Å
717	L	94.9	Very high	95.7	Very high	3 Å²	3	22.4 Å²	22.4	2%	0.016	10%	0.101	C	C	.	.	H	α-helix	trans	-73.4	-31.6	-178.1	-73.8	-177.1	0	0	0	112.2	R713 C714 L720 R721 W827 L848 Q850 M854 L857	R713-L717 PolarHBondContact O-N 3.02Å; C714-L717 PolarHBondContact O-N 2.97Å; L717-L720 HydrophobicContact CD2-CD2 4.38Å; L717-L720 PolarHBondContact O-N 3.1Å; L717-R721 WeakPolarHBondContact O-CB 3.39Å; L717-R721 PolarHBondContact O-N 3.45Å; L717-W827 HydrophobicContact CD1-CZ3 4.35Å; L717-W827 HydrophobicContact CD2-CZ3 4.35Å; L717-W827 HydrophobicContact CG-CZ3 4.13Å; L717-L848 HydrophobicContact CD1-CD1 4.07Å; L717-L848 HydrophobicContact CD1-CD2 4.49Å; L717-L848 HydrophobicContact CD1-CG 4.48Å; L717-Q850 HydrophobicContact CD2-CG 4.43Å; L717-M854 HydrophobicContact CB-CE 4Å; L717-L857 HydrophobicContact CB-CD2 3.97Å; L717-L857 HydrophobicContact CD1-CB 4.08Å; L717-L857 HydrophobicContact CD1-CD1 4.11Å; L717-L857 HydrophobicContact CD1-CD2 4.45Å; L717-L857 HydrophobicContact CD1-CG 4.43Å
718	L	96.6	Very high	95.6	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.7	-46.1	171.5	-80.2	170.6	0	0	0	112.5	I659 Y679 T682 V683 I686 C714 L715 L720 R721 M722 M854	I659-L718 HydrophobicContact CD1-CD1 3.79Å; I659-L718 HydrophobicContact CD1-CD2 4.06Å; I659-L718 HydrophobicContact CD1-CG 3.98Å; I659-L718 HydrophobicContact CG1-CD1 4.16Å; I659-L718 HydrophobicContact CG1-CD2 4.01Å; I659-L718 HydrophobicContact CG1-CG 4.42Å; I659-L718 HydrophobicContact CG2-CD2 4.36Å; Y679-L718 HydrophobicContact CD1-CD2 3.41Å; Y679-L718 VanDerWaalsContact CD1-CD2 3.41Å; Y679-L718 HydrophobicContact CE1-CD2 4.03Å; Y679-L718 HydrophobicContact CG-CD2 3.88Å; T682-L718 HydrophobicContact CG2-CD1 4.07Å; V683-L718 HydrophobicContact CG2-CB 3.68Å; V683-L718 HydrophobicContact CG2-CD1 3.86Å; V683-L718 HydrophobicContact CG2-CG 4.36Å; I686-L718 HydrophobicContact CD1-CD1 3.58Å; C714-L718 VanDerWaalsContact O-CB 3.3Å; C714-L718 WeakPolarHBondContact O-CB 3.47Å; C714-L718 WeakPolarHBondContact O-CG 3.37Å; C714-L718 PolarHBondContact O-N 3.47Å; L715-L718 PolarHBondContact O-N 3.16Å; L718-L720 VanDerWaalsContact C-N 3.29Å; L718-L720 PolarHBondContact O-N 3.38Å; L718-R721 PolarHBondContact O-N 3.37Å; L718-M722 WeakPolarHBondContact O-CB 3.42Å; L718-M722 WeakPolarHBondContact O-CG 3.46Å; L718-M722 PolarHBondContact O-N 3.01Å; L718-M854 HydrophobicContact CD2-SD 4.45Å
719	Y	97.1	Very high	95.4	Very high	12 Å²	12	31.8 Å²	31.8	5%	0.047	15%	0.148	C	C	.	.	H	α-helix	trans	-60.4	-40.4	174.7	-78.5	-54.5	0	0	0	111.4	V683 R687 L715 S716 M722 F723 N819 R822 Q826	V683-Y719 HydrophobicContact CG1-CE1 3.79Å; V683-Y719 HydrophobicContact CG1-CE2 4.27Å; R687-Y719 PolarHBondContact NE-OH 2.71Å; L715-Y719 HydrophobicContact CB-CE2 4.44Å; L715-Y719 WeakPolarHBondContact O-CB 3.35Å; L715-Y719 WeakPolarHBondContact O-CD2 3.43Å; L715-Y719 PolarHBondContact O-N 3.35Å; S716-Y719 PolarHBondContact O-N 2.79Å; Y719-M722 PolarHBondContact O-N 3.15Å; Y719-F723 PolarHBondContact O-N 2.94Å; Y719-N819 WeakPolarHBondContact CB-O 3.17Å; Y719-N819 HydrophobicContact CD1-CB 4.42Å; Y719-N819 WeakPolarHBondContact O-CB 3.13Å; Y719-R822 HydrophobicContact CD1-CB 4.2Å; Y719-R822 HydrophobicContact CD2-CB 3.66Å; Y719-R822 HydrophobicContact CE1-CB 4.32Å; Y719-R822 HydrophobicContact CE2-CB 3.8Å; Y719-R822 HydrophobicContact CG-CB 3.88Å; Y719-Q826 HydrophobicContact CD2-CG 4.31Å; Y719-Q826 HydrophobicContact CE2-CG 4.17Å
720	L	94.4	Very high	95.2	Very high	18 Å²	18	32 Å²	32	9%	0.094	15%	0.15	C	C	.	.	H	α-helix	trans	-63	-44.1	175	-169.3	59.8	0	0	0	111.6	S716 L717 L718 M722 F723 H724 Q850	S716-L720 PolarHBondContact O-N 3.01Å; S716-L720 VanDerWaalsContact O-N 3.12Å; L717-L720 HydrophobicContact CD2-CD2 4.38Å; L717-L720 PolarHBondContact O-N 3.1Å; L718-L720 VanDerWaalsContact C-N 3.29Å; L718-L720 PolarHBondContact O-N 3.38Å; L720-M722 PolarHBondContact O-N 3.37Å; L720-F723 WeakPolarHBondContact O-CB 3.45Å; L720-F723 PolarHBondContact O-N 2.94Å; L720-F723 VanDerWaalsContact O-N 3.16Å; L720-H724 PolarHBondContact O-CD2 2.65Å; L720-H724 PolarHBondContact O-N 3.38Å; L720-Q850 WeakPolarHBondContact CD2-O 3.39Å
721	R	95.5	Very high	95	Very high	77 Å²	77	33.4 Å²	33.4	29%	0.291	16%	0.159	S	C	.	.	H	α-helix	trans	-61.6	-42.4	176.3	-162	72.5	-173.8	176.6	4.5	112.2	E666 Y679 L717 L718 F723 H724 L725 M854	E666-R721 VanDerWaalsContact CD-NE 3.35Å; E666-R721 VanDerWaalsContact CD-NH2 3.27Å; E666-R721 IonicContact OE1-CZ 3.39Å; E666-R721 IonicContact OE1-NE 3.56Å; E666-R721 PolarHBondContact OE1-NE 3.21Å; E666-R721 IonicContact OE1-NH2 3.47Å; E666-R721 PolarHBondContact OE1-NH2 3.27Å; E666-R721 IonicContact OE2-CZ 2.77Å; E666-R721 VanDerWaalsContact OE2-CZ 3.26Å; E666-R721 IonicContact OE2-NE 3.47Å; E666-R721 PolarHBondContact OE2-NE 2.96Å; E666-R721 IonicContact OE2-NH2 2.72Å; E666-R721 PolarHBondContact OE2-NH2 3.13Å; Y679-R721 HydrophobicContact CD2-CG 4.2Å; Y679-R721 HydrophobicContact CE2-CB 4.49Å; Y679-R721 HydrophobicContact CE2-CG 3.63Å; L717-R721 WeakPolarHBondContact O-CB 3.39Å; L717-R721 PolarHBondContact O-N 3.45Å; L718-R721 PolarHBondContact O-N 3.37Å; R721-F723 VanDerWaalsContact C-N 3.32Å; R721-F723 PolarHBondContact O-N 2.99Å; R721-H724 PolarHBondContact O-N 2.92Å; R721-H724 VanDerWaalsContact O-N 3.13Å; R721-L725 PolarHBondContact O-N 3.28Å; R721-M854 HydrophobicContact CB-CE 4.07Å; R721-M854 HydrophobicContact CB-SD 3.87Å; R721-M854 HydrophobicContact CG-CE 4.34Å; R721-M854 HydrophobicContact CG-CG 4.12Å; R721-M854 HydrophobicContact CG-SD 3.8Å
722	M	95	Very high	94.9	Very high	8 Å²	8	39.2 Å²	39.2	4%	0.039	18%	0.183	C	C	.	.	H	α-helix	trans	-61.3	-37	173.8	-73.2	175.6	61.3	0	0	112.6	Y676 V683 L718 Y719 L720	Y676-M722 HydrophobicContact CD2-CB 4.26Å; Y676-M722 HydrophobicContact CD2-CG 4.43Å; Y676-M722 HydrophobicContact CE1-CE 3.96Å; Y676-M722 HydrophobicContact CE2-CB 3.88Å; Y676-M722 HydrophobicContact CE2-CE 3.98Å; Y676-M722 HydrophobicContact CE2-CG 4.33Å; Y676-M722 WeakPolarHBondContact CE2-O 3.21Å; V683-M722 HydrophobicContact CG2-SD 4.16Å; L718-M722 WeakPolarHBondContact O-CB 3.42Å; L718-M722 WeakPolarHBondContact O-CG 3.46Å; L718-M722 PolarHBondContact O-N 3.01Å; Y719-M722 PolarHBondContact O-N 3.15Å; L720-M722 PolarHBondContact O-N 3.37Å
723	F	95.4	Very high	94.6	Very high	29 Å²	29	41.9 Å²	41.9	13%	0.127	19%	0.194	C	C	.	.	H	α-helix	trans	-62.9	-49.1	169.6	167	-107.1	0	0	0	111.4	Y719 L720 R721 L725 K726 K727 I816 N819 I820	Y719-F723 PolarHBondContact O-N 2.94Å; L720-F723 WeakPolarHBondContact O-CB 3.45Å; L720-F723 PolarHBondContact O-N 2.94Å; L720-F723 VanDerWaalsContact O-N 3.16Å; R721-F723 VanDerWaalsContact C-N 3.32Å; R721-F723 PolarHBondContact O-N 2.99Å; F723-L725 VanDerWaalsContact C-N 3.33Å; F723-L725 PolarHBondContact O-N 2.94Å; F723-K726 CarbonylContact O-C 3.42Å; F723-K726 PolarHBondContact O-N 3.11Å; F723-K727 HydrophobicContact CE1-CB 4.41Å; F723-K727 HydrophobicContact CE1-CD 4.24Å; F723-K727 HydrophobicContact CE1-CG 4.2Å; F723-K727 HydrophobicContact CE2-CB 4.46Å; F723-K727 HydrophobicContact CE2-CG 4.49Å; F723-K727 HydrophobicContact CZ-CB 4.14Å; F723-K727 HydrophobicContact CZ-CD 4.31Å; F723-K727 HydrophobicContact CZ-CG 3.82Å; F723-K727 PolarHBondContact O-N 2.95Å; F723-I816 HydrophobicContact CD2-CG2 3.92Å; F723-I816 HydrophobicContact CE2-CG2 4.36Å; F723-N819 HydrophobicContact CB-CB 4.15Å; F723-I820 HydrophobicContact CB-CG1 4.14Å; F723-I820 HydrophobicContact CD1-CD1 4.05Å; F723-I820 HydrophobicContact CD1-CG1 3.86Å; F723-I820 HydrophobicContact CD2-CD1 3.85Å; F723-I820 HydrophobicContact CD2-CG1 3.73Å; F723-I820 HydrophobicContact CE1-CD1 3.87Å; F723-I820 HydrophobicContact CE1-CG1 4.23Å; F723-I820 HydrophobicContact CE2-CD1 3.69Å; F723-I820 HydrophobicContact CE2-CG1 4.13Å; F723-I820 HydrophobicContact CG-CD1 4.03Å; F723-I820 HydrophobicContact CG-CG1 3.6Å; F723-I820 HydrophobicContact CZ-CD1 3.7Å; F723-I820 HydrophobicContact CZ-CG1 4.36Å
724	H	93.5	Very high	94.4	Very high	84 Å²	84	42.9 Å²	42.9	39%	0.389	20%	0.202	S	C	.	.	H	α-helix	trans	-56.8	-44.6	-179.3	-78.7	-75.2	0	0	0	112.4	L720 R721 K726 K727	L720-H724 PolarHBondContact O-CD2 2.65Å; L720-H724 PolarHBondContact O-N 3.38Å; R721-H724 PolarHBondContact O-N 2.92Å; R721-H724 VanDerWaalsContact O-N 3.13Å; H724-K726 PolarHBondContact O-N 3.36Å; H724-K726 VanDerWaalsContact O-N 3.1Å; H724-K727 WeakPolarHBondContact O-CB 3.47Å; H724-K727 PolarHBondContact O-N 2.9Å
725	L	94.2	Very high	94	Very high	57 Å²	57	50.3 Å²	50.3	30%	0.298	23%	0.229	S	C	.	.	H	α-helix	trans	-58.4	-20.9	175.9	-75.1	174.8	0	0	0	114.8	E666 P675 Y676 Y679 R721 F723	E666-L725 HydrophobicContact CG-CD2 4.22Å; E666-L725 WeakPolarHBondContact OE2-CD2 3.49Å; P675-L725 HydrophobicContact CB-CD1 4.11Å; Y676-L725 HydrophobicContact CD2-CB 4.24Å; Y676-L725 HydrophobicContact CD2-CD1 4.49Å; Y679-L725 HydrophobicContact CD2-CD1 3.7Å; Y679-L725 HydrophobicContact CE2-CD1 3.88Å; R721-L725 PolarHBondContact O-N 3.28Å; F723-L725 VanDerWaalsContact C-N 3.33Å; F723-L725 PolarHBondContact O-N 2.94Å
726	K	94.9	Very high	93.7	Very high	67 Å²	67	53 Å²	53	29%	0.291	25%	0.248	S	C	.	.	H	α-helix	trans	-123	12.7	178.7	-68.7	-172.7	178	167.5	0	113.8	Y676 F723 H724 D728 H729 A730 I816	Y676-K726 HydrophobicContact CD2-CD 3.7Å; Y676-K726 VanDerWaalsContact CD2-CE 3.44Å; Y676-K726 HydrophobicContact CD2-CG 3.9Å; Y676-K726 HydrophobicContact CE2-CD 3.48Å; Y676-K726 VanDerWaalsContact CE2-CD 3.48Å; Y676-K726 HydrophobicContact CE2-CG 3.98Å; Y676-K726 HydrophobicContact CG-CD 4.3Å; F723-K726 CarbonylContact O-C 3.42Å; F723-K726 PolarHBondContact O-N 3.11Å; H724-K726 PolarHBondContact O-N 3.36Å; H724-K726 VanDerWaalsContact O-N 3.1Å; K726-D728 VanDerWaalsContact C-N 3.32Å; K726-D728 PolarHBondContact O-N 3.17Å; K726-H729 WeakPolarHBondContact O-CB 3.32Å; K726-H729 PolarHBondContact O-N 3.44Å; K726-H729 VanDerWaalsContact O-N 3.09Å; K726-A730 PolarHBondContact O-N 3.11Å; K726-I816 HydrophobicContact CB-CD1 3.96Å; K726-I816 HydrophobicContact CB-CG1 3.91Å; K726-I816 HydrophobicContact CB-CG2 3.76Å; K726-I816 HydrophobicContact CD-CD1 4.43Å; K726-I816 HydrophobicContact CD-CG1 4.16Å
727	K	93.6	Very high	93.4	Very high	88 Å²	88	53.8 Å²	53.8	38%	0.383	25%	0.252	S	S	.	.	H	α-helix	trans	-55.4	-44.5	-176.8	179.4	177.9	174.8	-173	0	112.2	F723 H724 H729 A730 V731	F723-K727 HydrophobicContact CE1-CB 4.41Å; F723-K727 HydrophobicContact CE1-CD 4.24Å; F723-K727 HydrophobicContact CE1-CG 4.2Å; F723-K727 HydrophobicContact CE2-CB 4.46Å; F723-K727 HydrophobicContact CE2-CG 4.49Å; F723-K727 HydrophobicContact CZ-CB 4.14Å; F723-K727 HydrophobicContact CZ-CD 4.31Å; F723-K727 HydrophobicContact CZ-CG 3.82Å; F723-K727 PolarHBondContact O-N 2.95Å; H724-K727 WeakPolarHBondContact O-CB 3.47Å; H724-K727 PolarHBondContact O-N 2.9Å; K727-H729 VanDerWaalsContact C-N 3.35Å; K727-H729 PolarHBondContact O-N 2.72Å; K727-A730 PolarHBondContact O-N 3.26Å; K727-V731 WeakPolarHBondContact O-CG2 3.27Å; K727-V731 PolarHBondContact O-N 3.21Å
728	D	93.8	Very high	93	Very high	108 Å²	108	59 Å²	59	58%	0.578	28%	0.278	S	S	*	.	H	α-helix	trans	-71.6	-29	-179.1	-64.7	-40.7	0	0	0	113.1	K726 K732	K726-D728 VanDerWaalsContact C-N 3.32Å; K726-D728 PolarHBondContact O-N 3.17Å; D728-K732 WeakPolarHBondContact O-CB 3.4Å; D728-K732 WeakPolarHBondContact O-CD 3.18Å; D728-K732 WeakPolarHBondContact O-CG 3.45Å; D728-K732 PolarHBondContact O-N 2.89Å
729	H	93.8	Very high	92.7	Very high	91 Å²	91	63.4 Å²	63.4	42%	0.421	30%	0.298	S	S	.	.	H	α-helix	trans	-66.9	-45.4	169.6	-69.3	-93.2	0	0	0	110.8	K726 K727 V731 K732 Y733 I816	K726-H729 WeakPolarHBondContact O-CB 3.32Å; K726-H729 PolarHBondContact O-N 3.44Å; K726-H729 VanDerWaalsContact O-N 3.09Å; K727-H729 VanDerWaalsContact C-N 3.35Å; K727-H729 PolarHBondContact O-N 2.72Å; H729-V731 PolarHBondContact O-N 3.07Å; H729-K732 PolarHBondContact O-N 3.48Å; H729-Y733 HydrophobicContact CB-CE2 4.07Å; H729-Y733 WeakPolarHBondContact O-CB 3.36Å; H729-Y733 VanDerWaalsContact O-CD2 3.27Å; H729-Y733 WeakPolarHBondContact O-CD2 3.47Å; H729-Y733 PolarHBondContact O-N 3.5Å; H729-I816 HydrophobicContact CB-CD1 4.03Å
730	A	91.6	Very high	92.2	Very high	6 Å²	6	64.7 Å²	64.7	5%	0.05	30%	0.303	C	S	.	.	H	α-helix	trans	-59.7	-43.6	174.3	0	0	0	0	0	112.1	K726 K727 Y733 S734 H813 I816 T817	K726-A730 PolarHBondContact O-N 3.11Å; K727-A730 PolarHBondContact O-N 3.26Å; A730-Y733 PolarHBondContact O-N 2.87Å; A730-S734 WeakPolarHBondContact O-CB 3.39Å; A730-S734 PolarHBondContact O-N 2.91Å; A730-H813 PolarHBondContact O-CD2 3.43Å; A730-I816 HydrophobicContact CB-CB 4.2Å; A730-I816 HydrophobicContact CB-CD1 4.43Å; A730-I816 HydrophobicContact CB-CG2 3.74Å; A730-T817 HydrophobicContact CB-CG2 4.49Å
731	V	91.9	Very high	91.8	Very high	29 Å²	29	65.9 Å²	65.9	18%	0.176	31%	0.308	C	S	.	.	H	α-helix	trans	-63.7	-42	176.2	171.2	0	0	0	0	111.8	K727 H729 S734 R735	K727-V731 WeakPolarHBondContact O-CG2 3.27Å; K727-V731 PolarHBondContact O-N 3.21Å; H729-V731 PolarHBondContact O-N 3.07Å; V731-S734 PolarHBondContact O-N 3.04Å; V731-R735 WeakPolarHBondContact O-CG 3.27Å; V731-R735 PolarHBondContact O-N 2.66Å
732	K	93.9	Very high	91.5	Very high	128 Å²	128	66 Å²	66	56%	0.557	31%	0.311	S	S	*	.	H	α-helix	trans	-61.8	-49.9	174.8	-74.3	166.3	-175.8	176.6	0	111.2	D728 H729 S734 R735 S736	D728-K732 WeakPolarHBondContact O-CB 3.4Å; D728-K732 WeakPolarHBondContact O-CD 3.18Å; D728-K732 WeakPolarHBondContact O-CG 3.45Å; D728-K732 PolarHBondContact O-N 2.89Å; H729-K732 PolarHBondContact O-N 3.48Å; K732-S734 PolarHBondContact O-N 2.93Å; K732-R735 PolarHBondContact O-N 3.04Å; K732-S736 PolarHBondContact O-N 3.04Å; K732-S736 PolarHBondContact O-OG 2.92Å
733	Y	91.4	Very high	91.1	Very high	59 Å²	59	69.5 Å²	69.5	23%	0.231	33%	0.332	C	S	.	.	H	α-helix	trans	-61.2	-43.7	177.4	-59	-25.8	0	0	0	111.8	H729 A730 R735 S736 L737 M809 H813 I816	H729-Y733 HydrophobicContact CB-CE2 4.07Å; H729-Y733 WeakPolarHBondContact O-CB 3.36Å; H729-Y733 VanDerWaalsContact O-CD2 3.27Å; H729-Y733 WeakPolarHBondContact O-CD2 3.47Å; H729-Y733 PolarHBondContact O-N 3.5Å; A730-Y733 PolarHBondContact O-N 2.87Å; Y733-R735 PolarHBondContact O-N 3.15Å; Y733-S736 PolarHBondContact O-N 3.28Å; Y733-L737 WeakPolarHBondContact O-CB 3.4Å; Y733-L737 WeakPolarHBondContact O-CG 3.02Å; Y733-L737 PolarHBondContact O-N 3.45Å; Y733-M809 HydrophobicContact CD1-CB 4.48Å; Y733-M809 HydrophobicContact CD1-CE 4.06Å; Y733-M809 HydrophobicContact CD1-CG 4.17Å; Y733-M809 HydrophobicContact CE1-CG 4.42Å; Y733-H813 HydrophobicContact CD2-CB 4.37Å; Y733-I816 HydrophobicContact CD2-CD1 4.22Å; Y733-I816 HydrophobicContact CE2-CD1 3.92Å
734	S	90.6	Very high	90.5	Very high	30 Å²	30	70.4 Å²	70.4	21%	0.21	34%	0.338	C	S	.	.	H	α-helix	trans	-56	-48.9	179.7	-171.1	0	0	0	0	111.9	A730 V731 K732 M738	A730-S734 WeakPolarHBondContact O-CB 3.39Å; A730-S734 PolarHBondContact O-N 2.91Å; V731-S734 PolarHBondContact O-N 3.04Å; K732-S734 PolarHBondContact O-N 2.93Å; S734-M738 VanDerWaalsContact O-CB 3.24Å; S734-M738 WeakPolarHBondContact O-CB 3.21Å; S734-M738 PolarHBondContact O-N 2.97Å
735	R	88.9	Confident	89.5	Confident	163 Å²	163	67.2 Å²	67.2	62%	0.615	32%	0.323	S	S	*	.	H	α-helix	trans	-60.3	-48.5	176.6	-65.4	178.5	-154.8	-174	6.5	112	V731 K732 Y733 M738 E739	V731-R735 WeakPolarHBondContact O-CG 3.27Å; V731-R735 PolarHBondContact O-N 2.66Å; K732-R735 PolarHBondContact O-N 3.04Å; Y733-R735 PolarHBondContact O-N 3.15Å; R735-M738 PolarHBondContact O-N 2.95Å; R735-E739 PolarHBondContact O-N 3.28Å
736	S	91.3	Very high	88.7	Confident	57 Å²	57	68.6 Å²	68.6	40%	0.399	33%	0.331	S	S	.	.	H	α-helix	trans	-66.9	-38.2	-177.8	-60.8	0	0	0	0	113.2	K732 Y733 Y740	K732-S736 PolarHBondContact O-N 3.04Å; K732-S736 PolarHBondContact O-OG 2.92Å; Y733-S736 PolarHBondContact O-N 3.28Å; S736-Y740 WeakPolarHBondContact O-CB 3.47Å; S736-Y740 PolarHBondContact O-N 2.89Å
737	L	88.8	Confident	87.4	Confident	16 Å²	16	68.9 Å²	68.9	8%	0.084	34%	0.341	C	S	.	.	H	α-helix	trans	-65.4	-46.5	174.3	-68.9	167.8	0	0	0	110.5	Y733 E739 Y740 F741 I806 M809 A810 H813	Y733-L737 WeakPolarHBondContact O-CB 3.4Å; Y733-L737 WeakPolarHBondContact O-CG 3.02Å; Y733-L737 PolarHBondContact O-N 3.45Å; L737-E739 PolarHBondContact O-N 2.89Å; L737-Y740 PolarHBondContact O-N 2.86Å; L737-F741 HydrophobicContact CB-CD2 4.47Å; L737-F741 HydrophobicContact CB-CE2 4.38Å; L737-F741 HydrophobicContact CD2-CE2 4.44Å; L737-F741 WeakPolarHBondContact O-CD2 3.19Å; L737-F741 PolarHBondContact O-N 3.39Å; L737-I806 HydrophobicContact CD2-CG2 3.85Å; L737-M809 HydrophobicContact CD2-CB 4.15Å; L737-A810 HydrophobicContact CD1-CB 4.35Å; L737-A810 HydrophobicContact CD2-CB 3.98Å; L737-H813 HydrophobicContact CD1-CB 3.87Å
738	M	87.4	Confident	86	Confident	112 Å²	112	67.4 Å²	67.4	55%	0.552	35%	0.345	S	S	*	.	H	α-helix	trans	-60	-43.9	179.1	-171.2	-179.6	-63.2	0	0	111.9	S734 R735 K742	S734-M738 VanDerWaalsContact O-CB 3.24Å; S734-M738 WeakPolarHBondContact O-CB 3.21Å; S734-M738 PolarHBondContact O-N 2.97Å; R735-M738 PolarHBondContact O-N 2.95Å; M738-K742 WeakPolarHBondContact O-CB 3.46Å; M738-K742 PolarHBondContact O-N 2.93Å
739	E	90	Very high	84.3	Confident	93 Å²	93	68.2 Å²	68.2	44%	0.435	34%	0.344	S	S	.	.	H	α-helix	trans	-67.7	-40.8	176.8	-166	58.2	-143.1	0	0	112	R735 L737 K742 V743	R735-E739 PolarHBondContact O-N 3.28Å; L737-E739 PolarHBondContact O-N 2.89Å; E739-K742 PolarHBondContact O-N 3.45Å; E739-K742 IonicContact OE1-NZ 2.67Å; E739-K742 PolarHBondContact OE1-NZ 2.91Å; E739-K742 IonicContact OE2-NZ 2.71Å; E739-K742 PolarHBondContact OE2-NZ 3.22Å; E739-V743 WeakPolarHBondContact O-CG2 3.25Å; E739-V743 PolarHBondContact O-N 3.24Å
740	Y	86.8	Confident	82.3	Confident	39 Å²	39	68.3 Å²	68.3	15%	0.153	35%	0.354	C	S	.	.	H	α-helix	trans	-59.1	-49.5	174.8	167.8	-93.9	0	0	0	112.6	S736 L737 K742 V743 I744 I802 P803 I806	S736-Y740 WeakPolarHBondContact O-CB 3.47Å; S736-Y740 PolarHBondContact O-N 2.89Å; L737-Y740 PolarHBondContact O-N 2.86Å; Y740-K742 VanDerWaalsContact C-N 3.31Å; Y740-K742 PolarHBondContact O-N 3.41Å; Y740-V743 PolarHBondContact O-N 3.01Å; Y740-I744 HydrophobicContact CE1-CD1 3.78Å; Y740-I744 HydrophobicContact CE2-CD1 3.75Å; Y740-I744 HydrophobicContact CE2-CG1 4.35Å; Y740-I744 PolarHBondContact O-N 3.24Å; Y740-I744 WeakPolarHBondContact OH-CD1 3.35Å; Y740-I802 HydrophobicContact CE1-CG2 4.49Å; Y740-P803 HydrophobicContact CE2-CG 4.28Å; Y740-P803 WeakPolarHBondContact OH-CD 3.49Å; Y740-I806 HydrophobicContact CD1-CG1 4.36Å; Y740-I806 HydrophobicContact CD1-CG2 3.61Å; Y740-I806 HydrophobicContact CD2-CD1 3.92Å; Y740-I806 HydrophobicContact CD2-CG1 3.82Å; Y740-I806 HydrophobicContact CE1-CB 4.47Å; Y740-I806 HydrophobicContact CE1-CG1 4.44Å; Y740-I806 HydrophobicContact CE1-CG2 3.63Å; Y740-I806 HydrophobicContact CE2-CG1 3.9Å; Y740-I806 HydrophobicContact CG-CD1 3.91Å; Y740-I806 HydrophobicContact CG-CG1 4.05Å; Y740-I806 HydrophobicContact CG-CG2 4.1Å
741	F	85.9	Confident	80.1	Confident	42 Å²	42	72.3 Å²	72.3	18%	0.184	38%	0.382	C	S	.	.	H	α-helix	trans	-67.4	-32.2	178.6	-71.7	-63.4	0	0	0	112.3	F536 L737 I744 Q745	F536-F741 HydrophobicContact CE1-CB 4.38Å; F536-F741 HydrophobicContact CZ-CB 4.18Å; L737-F741 HydrophobicContact CB-CD2 4.47Å; L737-F741 HydrophobicContact CB-CE2 4.38Å; L737-F741 HydrophobicContact CD2-CE2 4.44Å; L737-F741 WeakPolarHBondContact O-CD2 3.19Å; L737-F741 PolarHBondContact O-N 3.39Å; F741-I744 PolarHBondContact O-N 3.12Å; F741-Q745 WeakPolarHBondContact O-CB 3.27Å; F741-Q745 WeakPolarHBondContact O-CG 3.3Å; F741-Q745 PolarHBondContact O-N 2.81Å
742	K	88.4	Confident	78	Confident	81 Å²	81	79.4 Å²	79.4	35%	0.352	41%	0.413	S	S	.	.	H	α-helix	trans	-65.9	-42.2	172.3	169.6	168.6	159.8	-95.5	0	112.1	M738 E739 Y740 Q745 N746	M738-K742 WeakPolarHBondContact O-CB 3.46Å; M738-K742 PolarHBondContact O-N 2.93Å; E739-K742 PolarHBondContact O-N 3.45Å; E739-K742 IonicContact OE1-NZ 2.67Å; E739-K742 PolarHBondContact OE1-NZ 2.91Å; E739-K742 IonicContact OE2-NZ 2.71Å; E739-K742 PolarHBondContact OE2-NZ 3.22Å; Y740-K742 VanDerWaalsContact C-N 3.31Å; Y740-K742 PolarHBondContact O-N 3.41Å; K742-Q745 PolarHBondContact O-N 3.29Å; K742-N746 WeakPolarHBondContact O-CB 3.49Å; K742-N746 PolarHBondContact O-N 3.37Å; K742-N746 PolarHBondContact O-ND2 3.04Å
743	V	86.9	Confident	75.5	Confident	81 Å²	81	81.4 Å²	81.4	49%	0.491	42%	0.424	S	S	.	.	H	α-helix	trans	-61.2	-47.9	173.2	168.1	0	0	0	0	110.8	E739 Y740 N746 S747	E739-V743 WeakPolarHBondContact O-CG2 3.25Å; E739-V743 PolarHBondContact O-N 3.24Å; Y740-V743 PolarHBondContact O-N 3.01Å; V743-N746 PolarHBondContact O-N 3.33Å; V743-S747 PolarHBondContact O-N 2.95Å; V743-S747 PolarHBondContact O-OG 3.34Å
744	I	82.4	Confident	72.7	Confident	48 Å²	48	82.3 Å²	82.3	25%	0.246	44%	0.444	C	S	.	.	H	α-helix	trans	-63.4	-42.6	177.6	-75	-168.5	0	0	0	112.5	Y740 F741 N746 S747 A748 V800	Y740-I744 HydrophobicContact CE1-CD1 3.78Å; Y740-I744 HydrophobicContact CE2-CD1 3.75Å; Y740-I744 HydrophobicContact CE2-CG1 4.35Å; Y740-I744 PolarHBondContact O-N 3.24Å; Y740-I744 WeakPolarHBondContact OH-CD1 3.35Å; F741-I744 PolarHBondContact O-N 3.12Å; I744-N746 VanDerWaalsContact C-N 3.28Å; I744-N746 PolarHBondContact O-N 3.25Å; I744-S747 WeakPolarHBondContact CA-OG 3.23Å; I744-S747 PolarHBondContact O-N 3.46Å; I744-S747 PolarHBondContact O-OG 3.32Å; I744-A748 VanDerWaalsContact O-CB 3.31Å; I744-A748 WeakPolarHBondContact O-CB 3.31Å; I744-A748 PolarHBondContact O-N 2.87Å; I744-V800 HydrophobicContact CD1-CG1 4.22Å; I744-V800 HydrophobicContact CG2-CG1 4.43Å
745	Q	72.8	Confident	70.3	Confident	16 Å²	16	86.6 Å²	86.6	8%	0.075	47%	0.471	C	S	.	.	H	α-helix	trans	-58.8	-41.4	173.9	-85.6	-144.7	-10.5	0	0	112.1	C535 F536 F741 K742 A748 K749	C535-Q745 PolarHBondContact O-NE2 3.48Å; F536-Q745 HydrophobicContact CD1-CG 4.19Å; F536-Q745 VanDerWaalsContact CD2-NE2 3.28Å; F536-Q745 HydrophobicContact CE1-CG 3.6Å; F536-Q745 VanDerWaalsContact CE2-NE2 3.34Å; F536-Q745 HydrophobicContact CZ-CG 3.86Å; F536-Q745 VanDerWaalsContact CZ-NE2 3.31Å; F741-Q745 WeakPolarHBondContact O-CB 3.27Å; F741-Q745 WeakPolarHBondContact O-CG 3.3Å; F741-Q745 PolarHBondContact O-N 2.81Å; K742-Q745 PolarHBondContact O-N 3.29Å; Q745-A748 PolarHBondContact O-N 3.17Å; Q745-K749 WeakPolarHBondContact O-CB 3.31Å; Q745-K749 WeakPolarHBondContact O-CD 3.29Å; Q745-K749 WeakPolarHBondContact O-CG 3.4Å; Q745-K749 PolarHBondContact O-N 2.9Å
746	N	77.4	Confident	68	Low	87 Å²	87	83.8 Å²	83.8	47%	0.465	48%	0.477	S	S	.	.	H	α-helix	trans	-72.4	-39	-177.2	-70.1	-10.5	0	0	0	111.5	K742 V743 I744 K749 S750	K742-N746 WeakPolarHBondContact O-CB 3.49Å; K742-N746 PolarHBondContact O-N 3.37Å; K742-N746 PolarHBondContact O-ND2 3.04Å; V743-N746 PolarHBondContact O-N 3.33Å; I744-N746 VanDerWaalsContact C-N 3.28Å; I744-N746 PolarHBondContact O-N 3.25Å; N746-K749 PolarHBondContact O-N 3.42Å; N746-S750 WeakPolarHBondContact O-CB 3.36Å; N746-S750 PolarHBondContact O-N 2.93Å
747	S	68.6	Low	65.8	Low	72 Å²	72	86.6 Å²	86.6	50%	0.503	49%	0.493	S	S	.	.	H	α-helix	trans	-65.6	-39.1	172.1	59.7	0	0	0	0	112.3	V743 I744 S750 S751	V743-S747 PolarHBondContact O-N 2.95Å; V743-S747 PolarHBondContact O-OG 3.34Å; I744-S747 WeakPolarHBondContact CA-OG 3.23Å; I744-S747 PolarHBondContact O-N 3.46Å; I744-S747 PolarHBondContact O-OG 3.32Å; S747-S750 PolarHBondContact O-N 3.09Å; S747-S751 PolarHBondContact O-N 2.95Å; S747-S751 VanDerWaalsContact O-N 3.12Å
748	A	63.3	Low	63.7	Low	57 Å²	57	97 Å²	97	47%	0.471	53%	0.532	S	S	.	.	H	α-helix	trans	-62.7	-46.1	175.7	0	0	0	0	0	111.9	I744 Q745 S750 S751	I744-A748 VanDerWaalsContact O-CB 3.31Å; I744-A748 WeakPolarHBondContact O-CB 3.31Å; I744-A748 PolarHBondContact O-N 2.87Å; Q745-A748 PolarHBondContact O-N 3.17Å; A748-S750 VanDerWaalsContact C-N 3.34Å; A748-S750 PolarHBondContact O-N 2.99Å; A748-S751 WeakPolarHBondContact O-CB 3.04Å; A748-S751 PolarHBondContact O-N 3.43Å; A748-S751 VanDerWaalsContact O-N 3.12Å
749	K	58.1	Low	61.6	Low	126 Å²	126	103.2 Å²	103.2	55%	0.548	55%	0.549	S	S	.	.	H	α-helix	trans	-63.3	-38.1	175.3	-69.1	164.1	-166.2	168.3	0	112	Q745 N746 S751 H752	Q745-K749 WeakPolarHBondContact O-CB 3.31Å; Q745-K749 WeakPolarHBondContact O-CD 3.29Å; Q745-K749 WeakPolarHBondContact O-CG 3.4Å; Q745-K749 PolarHBondContact O-N 2.9Å; N746-K749 PolarHBondContact O-N 3.42Å; K749-S751 PolarHBondContact O-N 3.46Å; K749-H752 PolarHBondContact O-N 3.43Å
750	S	52.2	Low	59.1	Low	92 Å²	92	104.9 Å²	104.9	64%	0.643	57%	0.571	S	S	*	*	H	α-helix	trans	-64.7	-22.9	174.7	-169.7	0	0	0	0	113.4	N746 S747 A748 H752	N746-S750 WeakPolarHBondContact O-CB 3.36Å; N746-S750 PolarHBondContact O-N 2.93Å; S747-S750 PolarHBondContact O-N 3.09Å; A748-S750 VanDerWaalsContact C-N 3.34Å; A748-S750 PolarHBondContact O-N 2.99Å; S750-H752 VanDerWaalsContact C-N 3.27Å; S750-H752 PolarHBondContact O-N 3.39Å
751	S	45.8	Very low	56.9	Low	91 Å²	91	110.9 Å²	110.9	64%	0.636	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-6.4	-176.9	-165.3	0	0	0	0	114.2	S747 A748 K749	S747-S751 PolarHBondContact O-N 2.95Å; S747-S751 VanDerWaalsContact O-N 3.12Å; A748-S751 WeakPolarHBondContact O-CB 3.04Å; A748-S751 PolarHBondContact O-N 3.43Å; A748-S751 VanDerWaalsContact O-N 3.12Å; K749-S751 PolarHBondContact O-N 3.46Å
752	H	46.9	Very low	54.6	Low	178 Å²	178	112.2 Å²	112.2	82%	0.824	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	5.8	176.5	-72	-7.5	0	0	0	114.1	K749 S750	K749-H752 PolarHBondContact O-N 3.43Å; S750-H752 VanDerWaalsContact C-N 3.27Å; S750-H752 PolarHBondContact O-N 3.39Å
753	Q	42.1	Very low	52.5	Low	170 Å²	170	117.8 Å²	117.8	79%	0.794	66%	0.655	S	S	*	*			trans	-120.8	54	170.8	-158	176.5	17.5	0	0	112.4	P755	Q753-P755 WeakPolarHBondContact O-CD 3.49Å
754	A	32.7	Very low	50.2	Low	78 Å²	78	120.5 Å²	120.5	65%	0.645	67%	0.672	S	S	*	*			trans	-67.5	122.3	156.9	0	0	0	0	0	108.7	S756	A754-S756 PolarHBondContact O-N 2.83Å
755	P	39.1	Very low	48.1	Very low	119 Å²	119	126.3 Å²	126.3	77%	0.773	70%	0.703	S	S	*	*			trans	-72.5	95.2	178.9	-18	33.2	0	0	0	110.8	Q753 P757	Q753-P755 WeakPolarHBondContact O-CD 3.49Å; P755-P757 VanDerWaalsContact O-CD 3.25Å; P755-P757 WeakPolarHBondContact O-CD 3.3Å
756	S	40.4	Very low	46.4	Very low	105 Å²	105	128.6 Å²	128.6	73%	0.734	73%	0.731	S	S	*	*			trans	-56.4	116.5	175.5	-64.1	0	0	0	0	110.8	A754 W758	A754-S756 PolarHBondContact O-N 2.83Å; S756-W758 PolarHBondContact O-N 2.99Å
757	P	46.1	Very low	44.5	Very low	116 Å²	116	131.5 Å²	131.5	75%	0.753	75%	0.752	S	S	*	*	S	Bend	trans	-67.6	4.7	-169.6	-25.1	36	0	0	0	117.1	P755	P755-P757 VanDerWaalsContact O-CD 3.25Å; P755-P757 WeakPolarHBondContact O-CD 3.3Å
758	W	44	Very low	43.9	Very low	235 Å²	235	133.3 Å²	133.3	89%	0.89	76%	0.762	S	S	*	*			trans	-125.2	49.5	-163	-64.7	100.7	0	0	0	113.9	S756	S756-W758 PolarHBondContact O-N 2.99Å
759	R	44.5	Very low	42.7	Very low	241 Å²	241	136.1 Å²	136.1	91%	0.909	78%	0.778	S	S	*	*			trans	-140.5	80	158.8	-76.4	-159.2	-173.4	-86.5	5.3	112.1
760	S	36.8	Very low	42.1	Very low	129 Å²	129	135.8 Å²	135.8	90%	0.902	79%	0.789	S	S	*	*			trans	-81.4	148.9	153.4	-64.8	0	0	0	0	109.9
761	N	40.4	Very low	41.9	Very low	165 Å²	165	139.5 Å²	139.5	88%	0.882	80%	0.801	S	S	*	*			trans	-91.1	143.7	-173.7	-170	8.7	0	0	0	111.3
762	G	36.8	Very low	41.6	Very low	69 Å²	69	140.3 Å²	140.3	71%	0.711	81%	0.806	S	S	*	*			trans	-167.7	31.2	-165	0	0	0	0	0	119.5	V764	G762-V764 PolarHBondContact O-N 2.7Å
763	K	45.2	Very low	40.8	Very low	198 Å²	198	139.3 Å²	139.3	86%	0.861	81%	0.806	S	S	*	*			trans	-13.2	110.7	164.7	179.1	-174.3	177.4	-179.5	0	118.4
764	V	38	Very low	40.9	Very low	139 Å²	139	136.2 Å²	136.2	84%	0.842	80%	0.803	S	S	*	*			trans	-145.9	166	152.4	-62.5	0	0	0	0	111.6	G762	G762-V764 PolarHBondContact O-N 2.7Å
765	N	39.3	Very low	41.2	Very low	170 Å²	170	138.4 Å²	138.4	91%	0.909	81%	0.811	S	S	*	*			trans	-86.7	160.2	178.6	-82.6	2.9	0	0	0	113.5
766	G	36.1	Very low	41.1	Very low	64 Å²	64	138.1 Å²	138.1	66%	0.66	81%	0.812	S	S	*	*			trans	128.2	102.1	132.2	0	0	0	0	0	119.9
767	T	37.9	Very low	41.9	Very low	148 Å²	148	139 Å²	139	91%	0.908	82%	0.816	S	S	*	*			trans	63	162.6	144.9	39.7	0	0	0	0	120.6
768	P	56.7	Low	41.3	Very low	110 Å²	110	138.2 Å²	138.2	71%	0.714	82%	0.819	S	S	*	*			trans	-118.6	171.7	-161.7	42.3	-31.6	0	0	0	116.5
769	S	37.8	Very low	40.7	Very low	115 Å²	115	132.5 Å²	132.5	80%	0.804	82%	0.815	S	S	*	*			trans	71.8	162	161.5	-76.6	0	0	0	0	116.3
770	P	45.8	Very low	40.4	Very low	119 Å²	119	126.9 Å²	126.9	77%	0.773	81%	0.812	S	S	*	*			cis	-131.5	-177.6	23.4	43.6	-27.2	0	0	0	117.7
771	L	48.4	Very low	40.3	Very low	170 Å²	170	124.6 Å²	124.6	89%	0.89	81%	0.809	S	S	*	*			trans	-85.9	141.2	171.2	-62.2	166.6	0	0	0	111.6
772	S	37.5	Very low	39.8	Very low	108 Å²	108	120.3 Å²	120.3	76%	0.755	80%	0.804	S	S	*	*			trans	-162.9	150.2	163.7	-70.9	0	0	0	0	109.2
773	L	32	Very low	39.9	Very low	157 Å²	157	122 Å²	122	82%	0.822	81%	0.811	S	S	*	*			cis	-159.8	153.2	-28.7	-116.9	174.7	0	0	0	105.7
774	S	44.1	Very low	40	Very low	105 Å²	105	118.8 Å²	118.8	73%	0.734	81%	0.81	S	S	*	*			trans	-81.7	157.2	175.1	45.6	0	0	0	0	112.4
775	P	39.2	Very low	39.8	Very low	124 Å²	124	117 Å²	117	81%	0.805	81%	0.811	S	S	*	*				-140.5	159.8	129.5	38.3	-26.8	0	0	0	115.1
776	S	35.6	Very low	39.7	Very low	114 Å²	114	113.7 Å²	113.7	80%	0.797	81%	0.807	S	S	*	*			trans	-139.3	-177.6	167.8	-46.3	0	0	0	0	107
777	P	57.8	Low	39.8	Very low	124 Å²	124	115.3 Å²	115.3	81%	0.805	81%	0.814	S	S	*	*			cis	-124.7	176.7	-35.6	38.1	-24.7	0	0	0	111.9
778	A	33.9	Very low	39.7	Very low	99 Å²	99	115.7 Å²	115.7	82%	0.818	82%	0.816	S	S	*	*			trans	-176.2	117.9	144.5	0	0	0	0	0	115.7
779	S	30.8	Very low	38.5	Very low	115 Å²	115	114.5 Å²	114.5	80%	0.804	82%	0.823	S	S	*	*			trans	36.8	132	142.9	-147.5	0	0	0	0	125.4
780	S	38.4	Very low	38.3	Very low	122 Å²	122	112.7 Å²	112.7	85%	0.853	82%	0.823	S	S	*	*			trans	94.4	130.2	139.8	77.3	0	0	0	0	121
781	G	34.3	Very low	38.3	Very low	81 Å²	81	111.1 Å²	111.1	84%	0.835	83%	0.829	S	S	*	*			trans	124.8	80.8	158.7	0	0	0	0	0	119
782	G	31	Very low	37.6	Very low	76 Å²	76	106.4 Å²	106.4	78%	0.784	82%	0.821	S	S	*	*			trans	83.3	100.1	137.5	0	0	0	0	0	122.2
783	A	37.3	Very low	37.7	Very low	104 Å²	104	107.9 Å²	107.9	86%	0.86	83%	0.826	S	S	*	*			trans	66.8	158.4	142.4	0	0	0	0	0	120.1
784	P	48.8	Very low	38.1	Very low	130 Å²	130	106.3 Å²	106.3	84%	0.844	83%	0.828	S	S	*	*			trans	-102.2	147	-160.4	37.6	-33.6	0	0	0	115.7
785	A	32.6	Very low	37.9	Very low	103 Å²	103	104.3 Å²	104.3	85%	0.851	82%	0.824	S	S	*	*			trans	-132.2	138.2	153.9	0	0	0	0	0	108.6
786	A	38.8	Very low	38.1	Very low	100 Å²	100	104 Å²	104	83%	0.826	83%	0.825	S	S	*	*			trans	-94.5	167.5	-169.9	0	0	0	0	0	113.9
787	A	37.9	Very low	38.5	Very low	97 Å²	97	104 Å²	104	80%	0.802	83%	0.825	S	S	*	*			trans	68.2	94.4	163	0	0	0	0	0	118.5
788	T	35.4	Very low	38.4	Very low	157 Å²	157	101.6 Å²	101.6	96%	0.963	82%	0.823	S	S	*	*			trans	-149.7	131.2	136.4	-32.3	0	0	0	0	109.6
789	G	32	Very low	40	Very low	84 Å²	84	102.3 Å²	102.3	87%	0.866	82%	0.822	S	S	*	*			trans	159.3	64.4	-178.2	0	0	0	0	0	115
790	G	33	Very low	41.9	Very low	77 Å²	77	100.1 Å²	100.1	79%	0.794	80%	0.803	S	S	*	*			trans	-173.6	94.3	177.9	0	0	0	0	0	112	G792	G790-G792 PolarHBondContact O-N 3.1Å
791	G	44.8	Very low	43.9	Very low	87 Å²	87	98.7 Å²	98.7	90%	0.897	80%	0.799	S	S	*	*			trans	-76.4	105.1	-177.2	0	0	0	0	0	112.5	T793	G791-T793 PolarHBondContact O-N 3.34Å
792	G	33.6	Very low	46.3	Very low	71 Å²	71	98 Å²	98	73%	0.732	78%	0.775	S	S	*	*			trans	-78.9	113	170.6	0	0	0	0	0	111.7	G790 S794	G790-G792 PolarHBondContact O-N 3.1Å; G792-S794 PolarHBondContact O-N 3.22Å
793	T	40.3	Very low	49.2	Very low	138 Å²	138	97.8 Å²	97.8	85%	0.847	76%	0.76	S	S	*	*			trans	-63.8	124.9	166.4	43.8	0	0	0	0	109	G791 G795	G791-T793 PolarHBondContact O-N 3.34Å; T793-G795 PolarHBondContact O-N 2.77Å
794	S	41.4	Very low	51.8	Low	125 Å²	125	99 Å²	99	87%	0.874	75%	0.748	S	S	*	*			trans	-73.8	75.5	178.6	-69.8	0	0	0	0	110.8	G792 S796	G792-S794 PolarHBondContact O-N 3.22Å; S794-S796 PolarHBondContact O-N 2.96Å
795	G	38.9	Very low	53.8	Low	63 Å²	63	101.6 Å²	101.6	65%	0.649	74%	0.741	S	S	*	*			trans	-58.1	104.1	168.1	0	0	0	0	0	109.2	T793 S797	T793-G795 PolarHBondContact O-N 2.77Å; G795-S797 VanDerWaalsContact C-N 3.35Å; G795-S797 PolarHBondContact O-N 3.49Å
796	S	43.6	Very low	56.5	Low	117 Å²	117	97.8 Å²	97.8	82%	0.818	71%	0.706	S	S	*	*			trans	-66.9	94.3	179.8	-172.6	0	0	0	0	109.5	S794 G798	S794-S796 PolarHBondContact O-N 2.96Å; S796-G798 VanDerWaalsContact C-N 3.33Å; S796-G798 PolarHBondContact O-N 2.93Å
797	S	43.1	Very low	58.9	Low	114 Å²	114	98 Å²	98	80%	0.797	69%	0.69	S	S	*	*			trans	-61.9	95.1	171.3	-69.5	0	0	0	0	108.9	G795 S799	G795-S797 VanDerWaalsContact C-N 3.35Å; G795-S797 PolarHBondContact O-N 3.49Å; S797-S799 PolarHBondContact O-N 3.42Å
798	G	57.1	Low	61.5	Low	74 Å²	74	98.9 Å²	98.9	76%	0.763	68%	0.677	S	S	*	*			trans	-66.3	71.9	-174.3	0	0	0	0	0	113.6	S796 V800	S796-G798 VanDerWaalsContact C-N 3.33Å; S796-G798 PolarHBondContact O-N 2.93Å; G798-V800 PolarHBondContact O-N 2.75Å
799	S	66.8	Low	64.2	Low	114 Å²	114	92.2 Å²	92.2	80%	0.797	64%	0.635	S	S	*	*			trans	-81.4	108.4	174.8	-170.5	0	0	0	0	109.7	S797	S797-S799 PolarHBondContact O-N 3.42Å
800	V	70.6	Confident	66.9	Low	69 Å²	69	89 Å²	89	42%	0.418	60%	0.6	S	S	.	*			trans	-85.4	118.6	174.4	-178.9	0	0	0	0	108.7	I744 G798 I802	I744-V800 HydrophobicContact CD1-CG1 4.22Å; I744-V800 HydrophobicContact CG2-CG1 4.43Å; G798-V800 PolarHBondContact O-N 2.75Å; V800-I802 HydrophobicContact CG1-CG1 4.37Å; V800-I802 PolarHBondContact O-N 3.27Å
801	A	80.5	Confident	69.6	Low	92 Å²	92	87.8 Å²	87.8	76%	0.76	58%	0.583	S	S	*	*			trans	-73.8	113.7	175.6	0	0	0	0	0	110.7
802	I	84.9	Confident	71.9	Confident	66 Å²	66	85.8 Å²	85.8	34%	0.338	56%	0.555	S	S	.	*			trans	-103.7	123.2	-178.2	-60.7	174.8	0	0	0	110	Y740 V800 I806 H807	Y740-I802 HydrophobicContact CE1-CG2 4.49Å; V800-I802 HydrophobicContact CG1-CG1 4.37Å; V800-I802 PolarHBondContact O-N 3.27Å; I802-I806 HydrophobicContact CG2-CB 3.78Å; I802-I806 HydrophobicContact CG2-CG2 3.66Å; I802-H807 HydrophobicContact CG2-CB 4.41Å
803	P	91.4	Very high	74.6	Confident	72 Å²	72	83.4 Å²	83.4	47%	0.468	53%	0.525	S	S	.	.			trans	-59.5	141.9	175.4	-24.7	34.4	0	0	0	112.2	Y740 R805 I806 H807	Y740-P803 HydrophobicContact CE2-CG 4.28Å; Y740-P803 WeakPolarHBondContact OH-CD 3.49Å; P803-R805 VanDerWaalsContact C-N 3.25Å; P803-R805 PolarHBondContact O-N 2.82Å; P803-R805 VanDerWaalsContact O-N 3.1Å; P803-I806 HydrophobicContact CB-CG1 4.34Å; P803-I806 HydrophobicContact CG-CG1 4.48Å; P803-I806 WeakPolarHBondContact O-CA 3.2Å; P803-I806 WeakPolarHBondContact O-CB 3.29Å; P803-I806 PolarHBondContact O-N 3.39Å; P803-H807 PolarHBondContact O-N 3.05Å; P803-H807 VanDerWaalsContact O-N 3.14Å
804	Q	91.5	Very high	77.1	Confident	130 Å²	130	78.6 Å²	78.6	61%	0.607	50%	0.495	S	S	*	.	H	α-helix	trans	-53.8	-38.8	-174.7	-71.8	-64.1	-11.4	0	0	113.6	I806 H807 H808	Q804-I806 VanDerWaalsContact C-N 3.3Å; Q804-I806 PolarHBondContact O-N 2.89Å; Q804-H807 PolarHBondContact O-N 2.89Å; Q804-H808 PolarHBondContact O-N 2.78Å; Q804-H808 PolarHBondContact O-ND1 3.38Å
805	R	91.9	Very high	79.5	Confident	184 Å²	184	77.2 Å²	77.2	69%	0.694	48%	0.478	S	S	*	.	H	α-helix	trans	-57.8	-40.8	175.8	-167.1	-179.9	-168.5	-88.2	7	112.6	P803 M809	P803-R805 VanDerWaalsContact C-N 3.25Å; P803-R805 PolarHBondContact O-N 2.82Å; P803-R805 VanDerWaalsContact O-N 3.1Å; R805-M809 HydrophobicContact CG-SD 4.13Å; R805-M809 PolarHBondContact NH1-SD 3.38Å; R805-M809 WeakPolarHBondContact O-CB 3.27Å; R805-M809 WeakPolarHBondContact O-CG 3.4Å; R805-M809 PolarHBondContact O-N 2.8Å
806	I	88.4	Confident	82	Confident	22 Å²	22	74.6 Å²	74.6	11%	0.113	45%	0.449	C	S	.	.	H	α-helix	trans	-69.8	-42.5	178.3	-59.7	-60.9	0	0	0	110.5	L737 Y740 I802 P803 Q804 H808 M809 A810	L737-I806 HydrophobicContact CD2-CG2 3.85Å; Y740-I806 HydrophobicContact CD1-CG1 4.36Å; Y740-I806 HydrophobicContact CD1-CG2 3.61Å; Y740-I806 HydrophobicContact CD2-CD1 3.92Å; Y740-I806 HydrophobicContact CD2-CG1 3.82Å; Y740-I806 HydrophobicContact CE1-CB 4.47Å; Y740-I806 HydrophobicContact CE1-CG1 4.44Å; Y740-I806 HydrophobicContact CE1-CG2 3.63Å; Y740-I806 HydrophobicContact CE2-CG1 3.9Å; Y740-I806 HydrophobicContact CG-CD1 3.91Å; Y740-I806 HydrophobicContact CG-CG1 4.05Å; Y740-I806 HydrophobicContact CG-CG2 4.1Å; I802-I806 HydrophobicContact CG2-CB 3.78Å; I802-I806 HydrophobicContact CG2-CG2 3.66Å; P803-I806 HydrophobicContact CB-CG1 4.34Å; P803-I806 HydrophobicContact CG-CG1 4.48Å; P803-I806 WeakPolarHBondContact O-CA 3.2Å; P803-I806 WeakPolarHBondContact O-CB 3.29Å; P803-I806 PolarHBondContact O-N 3.39Å; Q804-I806 VanDerWaalsContact C-N 3.3Å; Q804-I806 PolarHBondContact O-N 2.89Å; I806-H808 PolarHBondContact O-N 3.28Å; I806-M809 PolarHBondContact O-N 3.41Å; I806-A810 WeakPolarHBondContact O-CB 3.29Å; I806-A810 PolarHBondContact O-N 2.9Å
807	H	89.1	Confident	84.3	Confident	106 Å²	106	69.6 Å²	69.6	49%	0.491	41%	0.414	S	S	.	.	H	α-helix	trans	-58.7	-47.9	175.4	179.2	-105.8	0	0	0	112	I802 P803 Q804 M809 A810 A811	I802-H807 HydrophobicContact CG2-CB 4.41Å; P803-H807 PolarHBondContact O-N 3.05Å; P803-H807 VanDerWaalsContact O-N 3.14Å; Q804-H807 PolarHBondContact O-N 2.89Å; H807-M809 VanDerWaalsContact C-N 3.34Å; H807-M809 PolarHBondContact O-N 2.88Å; H807-A810 PolarHBondContact O-N 2.84Å; H807-A811 PolarHBondContact O-N 2.9Å
808	H	92.6	Very high	86.7	Confident	114 Å²	114	66.4 Å²	66.4	53%	0.528	39%	0.388	S	S	.	.	H	α-helix	trans	-63.5	-37.1	176.8	-72	83.3	0	0	0	112.5	Q804 I806 S812	Q804-H808 PolarHBondContact O-N 2.78Å; Q804-H808 PolarHBondContact O-ND1 3.38Å; I806-H808 PolarHBondContact O-N 3.28Å; H808-S812 VanDerWaalsContact O-CB 3.23Å; H808-S812 WeakPolarHBondContact O-CB 3.22Å; H808-S812 PolarHBondContact O-N 3.37Å; H808-S812 PolarHBondContact O-OG 3.49Å
809	M	91.8	Very high	88.4	Confident	17 Å²	17	63.2 Å²	63.2	8%	0.084	35%	0.353	C	S	.	.	H	α-helix	trans	-67.3	-38.4	173.9	-72.6	169.5	66.2	0	0	112.4	Y733 L737 R805 I806 H807 H813	Y733-M809 HydrophobicContact CD1-CB 4.48Å; Y733-M809 HydrophobicContact CD1-CE 4.06Å; Y733-M809 HydrophobicContact CD1-CG 4.17Å; Y733-M809 HydrophobicContact CE1-CG 4.42Å; L737-M809 HydrophobicContact CD2-CB 4.15Å; R805-M809 HydrophobicContact CG-SD 4.13Å; R805-M809 PolarHBondContact NH1-SD 3.38Å; R805-M809 WeakPolarHBondContact O-CB 3.27Å; R805-M809 WeakPolarHBondContact O-CG 3.4Å; R805-M809 PolarHBondContact O-N 2.8Å; I806-M809 PolarHBondContact O-N 3.41Å; H807-M809 VanDerWaalsContact C-N 3.34Å; H807-M809 PolarHBondContact O-N 2.88Å; M809-H813 VanDerWaalsContact O-CB 3.25Å; M809-H813 WeakPolarHBondContact O-CB 3.39Å; M809-H813 PolarHBondContact O-N 2.8Å
810	A	88.8	Confident	89.7	Confident	16 Å²	16	58 Å²	58	13%	0.132	32%	0.317	C	S	.	.	H	α-helix	trans	-65.5	-48.7	175.5	0	0	0	0	0	111.4	L737 I806 H807 S812 H813 V814	L737-A810 HydrophobicContact CD1-CB 4.35Å; L737-A810 HydrophobicContact CD2-CB 3.98Å; I806-A810 WeakPolarHBondContact O-CB 3.29Å; I806-A810 PolarHBondContact O-N 2.9Å; H807-A810 PolarHBondContact O-N 2.84Å; A810-S812 VanDerWaalsContact C-N 3.34Å; A810-S812 PolarHBondContact O-N 3.46Å; A810-H813 PolarHBondContact O-N 2.97Å; A810-V814 VanDerWaalsContact O-CG2 3.31Å; A810-V814 WeakPolarHBondContact O-CG2 3.23Å; A810-V814 PolarHBondContact O-N 2.89Å
811	A	91	Very high	90.7	Very high	52 Å²	52	56.8 Å²	56.8	43%	0.43	31%	0.307	S	S	.	.	H	α-helix	trans	-59.4	-43.5	175.3	0	0	0	0	0	112	H807 V814 N815	H807-A811 PolarHBondContact O-N 2.9Å; A811-V814 PolarHBondContact O-N 3.32Å; A811-N815 WeakPolarHBondContact O-CB 3.41Å; A811-N815 PolarHBondContact O-N 2.81Å
812	S	92.6	Very high	91.3	Very high	45 Å²	45	57.6 Å²	57.6	32%	0.315	29%	0.291	S	S	.	.	H	α-helix	trans	-65.7	-42.5	177.6	-60.4	0	0	0	0	112.5	H808 A810 N815 I816	H808-S812 VanDerWaalsContact O-CB 3.23Å; H808-S812 WeakPolarHBondContact O-CB 3.22Å; H808-S812 PolarHBondContact O-N 3.37Å; H808-S812 PolarHBondContact O-OG 3.49Å; A810-S812 VanDerWaalsContact C-N 3.34Å; A810-S812 PolarHBondContact O-N 3.46Å; S812-N815 PolarHBondContact O-N 3.44Å; S812-I816 WeakPolarHBondContact O-CD1 3.29Å; S812-I816 VanDerWaalsContact O-CG1 3.28Å; S812-I816 WeakPolarHBondContact O-CG1 3.24Å; S812-I816 PolarHBondContact O-N 3.21Å
813	H	90.9	Very high	91.7	Very high	22 Å²	22	54.4 Å²	54.4	10%	0.102	27%	0.274	C	S	.	.	H	α-helix	trans	-58.1	-53.7	174	176.4	-80.6	0	0	0	110.7	A730 Y733 L737 M809 A810 N815 I816 T817	A730-H813 PolarHBondContact O-CD2 3.43Å; Y733-H813 HydrophobicContact CD2-CB 4.37Å; L737-H813 HydrophobicContact CD1-CB 3.87Å; M809-H813 VanDerWaalsContact O-CB 3.25Å; M809-H813 WeakPolarHBondContact O-CB 3.39Å; M809-H813 PolarHBondContact O-N 2.8Å; A810-H813 PolarHBondContact O-N 2.97Å; H813-N815 VanDerWaalsContact C-N 3.34Å; H813-N815 PolarHBondContact O-N 3.39Å; H813-I816 PolarHBondContact O-N 3.49Å; H813-T817 PolarHBondContact O-N 3.28Å; H813-T817 PolarHBondContact O-OG1 3.22Å
814	V	92.4	Very high	91.7	Very high	37 Å²	37	53.8 Å²	53.8	22%	0.224	26%	0.263	C	S	.	.	H	α-helix	trans	-55	-48.1	178.3	170.3	0	0	0	0	111.4	L545 A810 A811 I816 T817 N818	L545-V814 HydrophobicContact CD1-CG2 3.32Å; A810-V814 VanDerWaalsContact O-CG2 3.31Å; A810-V814 WeakPolarHBondContact O-CG2 3.23Å; A810-V814 PolarHBondContact O-N 2.89Å; A811-V814 PolarHBondContact O-N 3.32Å; V814-I816 PolarHBondContact O-N 2.77Å; V814-T817 WeakPolarHBondContact CA-OG1 3.48Å; V814-T817 PolarHBondContact O-N 2.86Å; V814-T817 PolarHBondContact O-OG1 3.41Å; V814-T817 VanDerWaalsContact O-OG1 3.09Å; V814-N818 WeakPolarHBondContact CG1-ND2 3.4Å; V814-N818 VanDerWaalsContact O-CB 3.29Å; V814-N818 WeakPolarHBondContact O-CB 3.31Å; V814-N818 PolarHBondContact O-N 2.79Å; V814-N818 PolarHBondContact O-OD1 3.32Å
815	N	91.5	Very high	91.9	Very high	95 Å²	95	52.5 Å²	52.5	51%	0.508	26%	0.257	S	S	.	.	H	α-helix	trans	-60.3	-44.2	-179.7	-169.9	23.2	0	0	0	111.9	A811 S812 H813 N819	A811-N815 WeakPolarHBondContact O-CB 3.41Å; A811-N815 PolarHBondContact O-N 2.81Å; S812-N815 PolarHBondContact O-N 3.44Å; H813-N815 VanDerWaalsContact C-N 3.34Å; H813-N815 PolarHBondContact O-N 3.39Å; N815-N819 PolarHBondContact O-ND2 3.42Å
816	I	91.6	Very high	92	Very high	8 Å²	8	45.8 Å²	45.8	4%	0.041	23%	0.234	C	C	.	.	H	α-helix	trans	-64.8	-47.5	176.7	-62.6	160	0	0	0	110.6	F723 K726 H729 A730 Y733 S812 H813 V814 N818 N819	F723-I816 HydrophobicContact CD2-CG2 3.92Å; F723-I816 HydrophobicContact CE2-CG2 4.36Å; K726-I816 HydrophobicContact CB-CD1 3.96Å; K726-I816 HydrophobicContact CB-CG1 3.91Å; K726-I816 HydrophobicContact CB-CG2 3.76Å; K726-I816 HydrophobicContact CD-CD1 4.43Å; K726-I816 HydrophobicContact CD-CG1 4.16Å; H729-I816 HydrophobicContact CB-CD1 4.03Å; A730-I816 HydrophobicContact CB-CB 4.2Å; A730-I816 HydrophobicContact CB-CD1 4.43Å; A730-I816 HydrophobicContact CB-CG2 3.74Å; Y733-I816 HydrophobicContact CD2-CD1 4.22Å; Y733-I816 HydrophobicContact CE2-CD1 3.92Å; S812-I816 WeakPolarHBondContact O-CD1 3.29Å; S812-I816 VanDerWaalsContact O-CG1 3.28Å; S812-I816 WeakPolarHBondContact O-CG1 3.24Å; S812-I816 PolarHBondContact O-N 3.21Å; H813-I816 PolarHBondContact O-N 3.49Å; V814-I816 PolarHBondContact O-N 2.77Å; I816-N818 PolarHBondContact O-N 2.82Å; I816-N819 PolarHBondContact O-N 3.49Å; I816-N819 PolarHBondContact O-ND2 3.4Å
817	T	92.4	Very high	92.2	Very high	13 Å²	13	46.5 Å²	46.5	8%	0.08	24%	0.235	C	C	.	.	H	α-helix	trans	-69.3	-29.3	-177.4	52.6	0	0	0	0	113.9	L552 A730 H813 V814 N819 I820	L552-T817 HydrophobicContact CD2-CG2 4.16Å; A730-T817 HydrophobicContact CB-CG2 4.49Å; H813-T817 PolarHBondContact O-N 3.28Å; H813-T817 PolarHBondContact O-OG1 3.22Å; V814-T817 WeakPolarHBondContact CA-OG1 3.48Å; V814-T817 PolarHBondContact O-N 2.86Å; V814-T817 PolarHBondContact O-OG1 3.41Å; V814-T817 VanDerWaalsContact O-OG1 3.09Å; T817-N819 PolarHBondContact O-N 3.24Å; T817-I820 WeakPolarHBondContact O-CB 3.26Å; T817-I820 PolarHBondContact O-N 2.86Å
818	N	93.8	Very high	92.5	Very high	47 Å²	47	46.8 Å²	46.8	25%	0.251	24%	0.236	S	C	.	.	H	α-helix	trans	-63.9	-22.8	177.7	-81.2	-4.6	0	0	0	113	V814 I816 I820 L821 R822	V814-N818 WeakPolarHBondContact CG1-ND2 3.4Å; V814-N818 VanDerWaalsContact O-CB 3.29Å; V814-N818 WeakPolarHBondContact O-CB 3.31Å; V814-N818 PolarHBondContact O-N 2.79Å; V814-N818 PolarHBondContact O-OD1 3.32Å; I816-N818 PolarHBondContact O-N 2.82Å; N818-I820 PolarHBondContact O-N 3.2Å; N818-L821 PolarHBondContact O-N 3.14Å; N818-R822 WeakPolarHBondContact O-CG 3.44Å; N818-R822 PolarHBondContact O-N 3.46Å
819	N	92.6	Very high	92.5	Very high	7 Å²	7	42.8 Å²	42.8	4%	0.037	22%	0.22	C	C	.	.	H	α-helix	trans	-63.2	-28.8	172.6	-59.2	-75.3	0	0	0	111.8	Y719 F723 N815 I816 T817 S823	Y719-N819 WeakPolarHBondContact CB-O 3.17Å; Y719-N819 HydrophobicContact CD1-CB 4.42Å; Y719-N819 WeakPolarHBondContact O-CB 3.13Å; F723-N819 HydrophobicContact CB-CB 4.15Å; N815-N819 PolarHBondContact O-ND2 3.42Å; I816-N819 PolarHBondContact O-N 3.49Å; I816-N819 PolarHBondContact O-ND2 3.4Å; T817-N819 PolarHBondContact O-N 3.24Å; N819-S823 WeakPolarHBondContact O-CB 3.36Å; N819-S823 PolarHBondContact O-N 3.47Å
820	I	93.4	Very high	92.6	Very high	5 Å²	5	42 Å²	42	3%	0.026	22%	0.216	C	C	.	.	H	α-helix	trans	-65.2	-49.6	173	-53.3	178.1	0	0	0	110.1	L552 L556 F723 T817 N818 R822 S823 Y824	L552-I820 HydrophobicContact CD1-CB 3.99Å; L552-I820 HydrophobicContact CD1-CD1 4.3Å; L552-I820 HydrophobicContact CD1-CG2 3.84Å; L552-I820 HydrophobicContact CD2-CD1 4.48Å; L556-I820 HydrophobicContact CD1-CD1 4.2Å; L556-I820 HydrophobicContact CD2-CG2 4.08Å; F723-I820 HydrophobicContact CB-CG1 4.14Å; F723-I820 HydrophobicContact CD1-CD1 4.05Å; F723-I820 HydrophobicContact CD1-CG1 3.86Å; F723-I820 HydrophobicContact CD2-CD1 3.85Å; F723-I820 HydrophobicContact CD2-CG1 3.73Å; F723-I820 HydrophobicContact CE1-CD1 3.87Å; F723-I820 HydrophobicContact CE1-CG1 4.23Å; F723-I820 HydrophobicContact CE2-CD1 3.69Å; F723-I820 HydrophobicContact CE2-CG1 4.13Å; F723-I820 HydrophobicContact CG-CD1 4.03Å; F723-I820 HydrophobicContact CG-CG1 3.6Å; F723-I820 HydrophobicContact CZ-CD1 3.7Å; F723-I820 HydrophobicContact CZ-CG1 4.36Å; T817-I820 WeakPolarHBondContact O-CB 3.26Å; T817-I820 PolarHBondContact O-N 2.86Å; N818-I820 PolarHBondContact O-N 3.2Å; I820-R822 PolarHBondContact O-N 2.88Å; I820-S823 WeakPolarHBondContact O-CB 3.39Å; I820-S823 PolarHBondContact O-N 3.36Å; I820-S823 VanDerWaalsContact O-N 3.13Å; I820-Y824 HydrophobicContact CG2-CD2 3.94Å; I820-Y824 HydrophobicContact CG2-CE2 3.69Å; I820-Y824 VanDerWaalsContact O-CD2 3.27Å; I820-Y824 WeakPolarHBondContact O-CD2 3.46Å; I820-Y824 PolarHBondContact O-N 3.41Å
821	L	91.1	Very high	92.8	Very high	43 Å²	43	44.7 Å²	44.7	23%	0.225	23%	0.228	C	C	.	.	H	α-helix	trans	-58.8	-50	179.8	-63.7	175.9	0	0	0	110.8	L552 N818 S823 Y824 E825	L552-L821 HydrophobicContact CB-CD2 4.44Å; L552-L821 HydrophobicContact CD1-CD2 3.77Å; L552-L821 HydrophobicContact CD1-CG 4.15Å; N818-L821 PolarHBondContact O-N 3.14Å; L821-S823 VanDerWaalsContact C-N 3.27Å; L821-S823 PolarHBondContact O-N 3.42Å; L821-Y824 PolarHBondContact O-N 2.84Å; L821-Y824 VanDerWaalsContact O-N 3.12Å; L821-E825 VanDerWaalsContact O-CG 3.3Å; L821-E825 WeakPolarHBondContact O-CG 3.25Å; L821-E825 PolarHBondContact O-N 2.85Å
822	R	93.2	Very high	92.8	Very high	108 Å²	108	48.6 Å²	48.6	41%	0.408	23%	0.232	S	C	.	.	H	α-helix	trans	-58.4	-36	175.2	-67.8	-179.2	179.8	-165.8	1.8	112.9	Y719 N818 I820 Q826	Y719-R822 HydrophobicContact CD1-CB 4.2Å; Y719-R822 HydrophobicContact CD2-CB 3.66Å; Y719-R822 HydrophobicContact CE1-CB 4.32Å; Y719-R822 HydrophobicContact CE2-CB 3.8Å; Y719-R822 HydrophobicContact CG-CB 3.88Å; N818-R822 WeakPolarHBondContact O-CG 3.44Å; N818-R822 PolarHBondContact O-N 3.46Å; I820-R822 PolarHBondContact O-N 2.88Å; R822-Q826 WeakPolarHBondContact O-CB 3.34Å; R822-Q826 WeakPolarHBondContact O-CG 3.2Å; R822-Q826 PolarHBondContact O-N 3.48Å
823	S	93	Very high	92.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.8	-49.6	174.8	178.9	0	0	0	0	111.6	S716 N819 I820 L821 W827 Q850	S716-S823 WeakPolarHBondContact CB-O 3.34Å; S716-S823 VanDerWaalsContact O-CB 3.27Å; S716-S823 WeakPolarHBondContact O-CB 3.47Å; S716-S823 PolarHBondContact O-OG 3.1Å; S716-S823 PolarHBondContact OG-O 2.99Å; S716-S823 PolarHBondContact OG-OG 2.89Å; N819-S823 WeakPolarHBondContact O-CB 3.36Å; N819-S823 PolarHBondContact O-N 3.47Å; I820-S823 WeakPolarHBondContact O-CB 3.39Å; I820-S823 PolarHBondContact O-N 3.36Å; I820-S823 VanDerWaalsContact O-N 3.13Å; L821-S823 VanDerWaalsContact C-N 3.27Å; L821-S823 PolarHBondContact O-N 3.42Å; S823-W827 WeakPolarHBondContact O-CB 3.27Å; S823-W827 PolarHBondContact O-N 3.38Å; S823-Q850 PolarHBondContact OG-NE2 2.89Å
824	Y	92.3	Very high	92.9	Very high	58 Å²	58	47.1 Å²	47.1	23%	0.227	22%	0.223	C	C	.	.	H	α-helix	trans	-67.8	-42.5	178.2	-74.2	-77.3	0	0	0	112.5	N559 I820 L821 Q826 W827 E828 Q850	N559-Y824 HydrophobicContact CB-CE1 4.34Å; N559-Y824 WeakPolarHBondContact ND2-CD1 3.48Å; N559-Y824 WeakPolarHBondContact ND2-CE1 3.28Å; N559-Y824 VanDerWaalsContact ND2-CZ 3.27Å; I820-Y824 HydrophobicContact CG2-CD2 3.94Å; I820-Y824 HydrophobicContact CG2-CE2 3.69Å; I820-Y824 VanDerWaalsContact O-CD2 3.27Å; I820-Y824 WeakPolarHBondContact O-CD2 3.46Å; I820-Y824 PolarHBondContact O-N 3.41Å; L821-Y824 PolarHBondContact O-N 2.84Å; L821-Y824 VanDerWaalsContact O-N 3.12Å; Y824-Q826 VanDerWaalsContact C-N 3.32Å; Y824-Q826 PolarHBondContact O-N 2.8Å; Y824-W827 PolarHBondContact O-N 2.95Å; Y824-W827 VanDerWaalsContact O-N 3.15Å; Y824-E828 PolarHBondContact O-N 3.06Å; Y824-Q850 VanDerWaalsContact CD1-NE2 3.28Å; Y824-Q850 VanDerWaalsContact CE1-NE2 3.31Å
825	E	94.5	Very high	92.7	Very high	103 Å²	103	47.8 Å²	47.8	48%	0.481	23%	0.232	S	C	.	.	H	α-helix	trans	-57.4	-42.7	177.5	-71.8	160.8	-167.7	0	0	112.3	L821 T829	L821-E825 VanDerWaalsContact O-CG 3.3Å; L821-E825 WeakPolarHBondContact O-CG 3.25Å; L821-E825 PolarHBondContact O-N 2.85Å; E825-T829 WeakPolarHBondContact O-CB 3.37Å; E825-T829 PolarHBondContact O-N 3.23Å; E825-T829 VanDerWaalsContact O-N 3.11Å; E825-T829 PolarHBondContact O-OG1 3.32Å
826	Q	94.3	Very high	92.3	Very high	44 Å²	44	48 Å²	48	21%	0.206	23%	0.233	C	C	.	.	H	α-helix	trans	-75	-33.1	176.4	-59.9	-63.6	-98.2	0	0	112.2	L715 Y719 R822 Y824 T829 A830	L715-Q826 HydrophobicContact CB-CB 4.29Å; L715-Q826 HydrophobicContact CB-CG 4.1Å; Y719-Q826 HydrophobicContact CD2-CG 4.31Å; Y719-Q826 HydrophobicContact CE2-CG 4.17Å; R822-Q826 WeakPolarHBondContact O-CB 3.34Å; R822-Q826 WeakPolarHBondContact O-CG 3.2Å; R822-Q826 PolarHBondContact O-N 3.48Å; Y824-Q826 VanDerWaalsContact C-N 3.32Å; Y824-Q826 PolarHBondContact O-N 2.8Å; Q826-T829 PolarHBondContact O-N 2.98Å; Q826-A830 PolarHBondContact O-N 3.44Å
827	W	94.3	Very high	92.1	Very high	36 Å²	36	48 Å²	48	14%	0.136	23%	0.234	C	C	.	.	H	α-helix	trans	-64.6	-48.6	175.1	-166.6	-83.9	0	0	0	111.6	R713 S716 L717 S823 Y824 T829 A830 D831 L848 S849 Q850	R713-W827 PolarHBondContact NH1-O 3.23Å; S716-W827 WeakPolarHBondContact OG-CB 3.32Å; L717-W827 HydrophobicContact CD1-CZ3 4.35Å; L717-W827 HydrophobicContact CD2-CZ3 4.35Å; L717-W827 HydrophobicContact CG-CZ3 4.13Å; S823-W827 WeakPolarHBondContact O-CB 3.27Å; S823-W827 PolarHBondContact O-N 3.38Å; Y824-W827 PolarHBondContact O-N 2.95Å; Y824-W827 VanDerWaalsContact O-N 3.15Å; W827-T829 VanDerWaalsContact C-N 3.25Å; W827-T829 PolarHBondContact O-N 3.35Å; W827-A830 WeakPolarHBondContact O-CB 3.36Å; W827-A830 PolarHBondContact O-N 2.89Å; W827-A830 VanDerWaalsContact O-N 3.11Å; W827-D831 PolarHBondContact NE1-OD2 3.39Å; W827-D831 PolarHBondContact O-N 3.48Å; W827-L848 HydrophobicContact CH2-CD2 3.87Å; W827-L848 HydrophobicContact CH2-CG 4.21Å; W827-L848 HydrophobicContact CZ3-CD2 4.15Å; W827-S849 VanDerWaalsContact CH2-C 3.44Å; W827-Q850 HydrophobicContact CD2-CB 4.17Å; W827-Q850 HydrophobicContact CD2-CG 3.94Å; W827-Q850 HydrophobicContact CE3-CB 4.15Å; W827-Q850 HydrophobicContact CE3-CG 3.8Å; W827-Q850 HydrophobicContact CG-CG 4.38Å; W827-Q850 HydrophobicContact CH2-CB 4.34Å; W827-Q850 HydrophobicContact CZ2-CB 4.36Å; W827-Q850 HydrophobicContact CZ3-CB 4.23Å; W827-Q850 HydrophobicContact CZ3-CG 4.28Å
828	E	93.4	Very high	91.7	Very high	112 Å²	112	55.8 Å²	55.8	52%	0.523	26%	0.262	S	S	.	.	H	α-helix	trans	-64.2	-33.5	177.1	-160	-158.4	125	0	0	111.3	Y824 D831 R832	Y824-E828 PolarHBondContact O-N 3.06Å; E828-D831 PolarHBondContact O-N 2.85Å; E828-R832 WeakPolarHBondContact O-CG 3.23Å; E828-R832 PolarHBondContact O-N 2.8Å; E828-R832 IonicContact OE1-CZ 2.67Å; E828-R832 IonicContact OE1-NH1 3.98Å; E828-R832 PolarHBondContact OE1-NH1 2.83Å
829	T	94	Very high	91.4	Very high	30 Å²	30	59.3 Å²	59.3	18%	0.184	28%	0.281	C	S	.	.	H	α-helix	trans	-67	-37.5	173.8	-58.1	0	0	0	0	112.1	N712 E825 Q826 W827 R832 L833	N712-T829 WeakPolarHBondContact OD1-CG2 3.4Å; E825-T829 WeakPolarHBondContact O-CB 3.37Å; E825-T829 PolarHBondContact O-N 3.23Å; E825-T829 VanDerWaalsContact O-N 3.11Å; E825-T829 PolarHBondContact O-OG1 3.32Å; Q826-T829 PolarHBondContact O-N 2.98Å; W827-T829 VanDerWaalsContact C-N 3.25Å; W827-T829 PolarHBondContact O-N 3.35Å; T829-R832 PolarHBondContact OG1-NH2 2.74Å; T829-L833 HydrophobicContact CG2-CD1 3.99Å; T829-L833 WeakPolarHBondContact O-CB 3.24Å; T829-L833 WeakPolarHBondContact O-CD1 3.36Å; T829-L833 VanDerWaalsContact O-CG 3.25Å; T829-L833 WeakPolarHBondContact O-CG 3.39Å; T829-L833 PolarHBondContact O-N 3.27Å; T829-L833 VanDerWaalsContact O-N 3.17Å
830	A	93.9	Very high	91.2	Very high	0 Å²	0	59 Å²	59	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62.6	-45.4	168.7	0	0	0	0	0	111.8	V709 N712 R713 Q826 W827 R832 L833 A834	V709-A830 HydrophobicContact CG1-CB 4.16Å; N712-A830 HydrophobicContact CB-CB 3.71Å; R713-A830 HydrophobicContact CG-CB 4.01Å; Q826-A830 PolarHBondContact O-N 3.44Å; W827-A830 WeakPolarHBondContact O-CB 3.36Å; W827-A830 PolarHBondContact O-N 2.89Å; W827-A830 VanDerWaalsContact O-N 3.11Å; A830-R832 PolarHBondContact O-N 3.49Å; A830-L833 PolarHBondContact O-N 2.95Å; A830-A834 VanDerWaalsContact O-CB 3.31Å; A830-A834 WeakPolarHBondContact O-CB 3.38Å; A830-A834 PolarHBondContact O-N 3.14Å
831	D	91.6	Very high	91	Very high	73 Å²	73	59 Å²	59	39%	0.39	28%	0.278	S	S	.	.	H	α-helix	trans	-61.1	-42.8	-179.9	-65.2	-30.5	0	0	0	112.4	R713 W827 E828 A834	R713-D831 IonicContact CZ-OD1 3.53Å; R713-D831 IonicContact NH1-OD1 2.7Å; R713-D831 PolarHBondContact NH1-OD1 2.74Å; R713-D831 IonicContact NH2-OD1 2.66Å; R713-D831 PolarHBondContact NH2-OD1 3.5Å; W827-D831 PolarHBondContact NE1-OD2 3.39Å; W827-D831 PolarHBondContact O-N 3.48Å; E828-D831 PolarHBondContact O-N 2.85Å; D831-A834 PolarHBondContact O-N 3.46Å
832	R	92.4	Very high	90.8	Very high	134 Å²	134	64 Å²	64	51%	0.506	30%	0.301	S	S	.	.	H	α-helix	trans	-65.7	-39.1	176.6	-66.7	-172.9	-44.7	-92.7	-9.3	112.3	E828 T829 A830 A835	E828-R832 WeakPolarHBondContact O-CG 3.23Å; E828-R832 PolarHBondContact O-N 2.8Å; E828-R832 IonicContact OE1-CZ 2.67Å; E828-R832 IonicContact OE1-NH1 3.98Å; E828-R832 PolarHBondContact OE1-NH1 2.83Å; T829-R832 PolarHBondContact OG1-NH2 2.74Å; A830-R832 PolarHBondContact O-N 3.49Å; R832-A835 WeakPolarHBondContact O-CB 3.44Å
833	L	92.4	Very high	90.2	Very high	27 Å²	27	61.6 Å²	61.6	14%	0.141	30%	0.296	C	S	.	.	H	α-helix	trans	-74.9	-26.4	177.9	-69.6	166.1	0	0	0	113.1	T696 A708 V709 T829 A830 A835	T696-L833 HydrophobicContact CG2-CD1 3.65Å; T696-L833 HydrophobicContact CG2-CD2 4.13Å; A708-L833 HydrophobicContact CB-CD1 4.1Å; V709-L833 HydrophobicContact CG2-CB 3.47Å; V709-L833 VanDerWaalsContact CG2-CB 3.47Å; T829-L833 HydrophobicContact CG2-CD1 3.99Å; T829-L833 WeakPolarHBondContact O-CB 3.24Å; T829-L833 WeakPolarHBondContact O-CD1 3.36Å; T829-L833 VanDerWaalsContact O-CG 3.25Å; T829-L833 WeakPolarHBondContact O-CG 3.39Å; T829-L833 PolarHBondContact O-N 3.27Å; T829-L833 VanDerWaalsContact O-N 3.17Å; A830-L833 PolarHBondContact O-N 2.95Å; L833-A835 VanDerWaalsContact C-N 3.28Å; L833-A835 PolarHBondContact O-N 3.03Å
834	A	92	Very high	89.6	Confident	10 Å²	10	62 Å²	62	8%	0.083	30%	0.298	C	S	.	.	H	α-helix	trans	-73.7	-17.4	177.6	0	0	0	0	0	113.1	V709 A830 D831 D836 S837 R838 F841	V709-A834 HydrophobicContact CG1-CB 4.15Å; V709-A834 HydrophobicContact CG2-CB 4.08Å; A830-A834 VanDerWaalsContact O-CB 3.31Å; A830-A834 WeakPolarHBondContact O-CB 3.38Å; A830-A834 PolarHBondContact O-N 3.14Å; D831-A834 PolarHBondContact O-N 3.46Å; A834-D836 VanDerWaalsContact C-N 3.31Å; A834-D836 PolarHBondContact O-N 2.79Å; A834-S837 CarbonylContact O-C 3.34Å; A834-S837 PolarHBondContact O-N 3.15Å; A834-R838 PolarHBondContact O-N 3.02Å; A834-R838 VanDerWaalsContact O-N 3.12Å; A834-F841 HydrophobicContact CB-CD2 3.9Å; A834-F841 HydrophobicContact CB-CE2 4.39Å; A834-F841 HydrophobicContact CB-CG 4.38Å
835	A	88.1	Confident	88.5	Confident	51 Å²	51	62.1 Å²	62.1	42%	0.421	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-54.7	-43.6	179.3	0	0	0	0	0	112.8	R832 L833 S837	R832-A835 WeakPolarHBondContact O-CB 3.44Å; L833-A835 VanDerWaalsContact C-N 3.28Å; L833-A835 PolarHBondContact O-N 3.03Å; A835-S837 PolarHBondContact O-N 2.86Å; A835-S837 VanDerWaalsContact O-N 3.16Å
836	D	83	Confident	86.9	Confident	99 Å²	99	61.4 Å²	61.4	53%	0.529	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-68.3	-8	178.4	-66.7	5.7	0	0	0	113.9	K705 A834	K705-D836 HydrophobicContact CD-CB 4.41Å; K705-D836 VanDerWaalsContact CD-OD2 3.29Å; K705-D836 WeakPolarHBondContact CD-OD2 3.09Å; K705-D836 WeakPolarHBondContact CE-OD2 3.45Å; K705-D836 IonicContact NZ-OD2 3.95Å; K705-D836 PolarHBondContact NZ-OD2 2.91Å; A834-D836 VanDerWaalsContact C-N 3.31Å; A834-D836 PolarHBondContact O-N 2.79Å
837	S	88.2	Confident	85.1	Confident	7 Å²	7	62.4 Å²	62.4	5%	0.049	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-146.2	32.3	-170.2	50.7	0	0	0	0	113.4	A834 A835 D839 F840 F841	A834-S837 CarbonylContact O-C 3.34Å; A834-S837 PolarHBondContact O-N 3.15Å; A835-S837 PolarHBondContact O-N 2.86Å; A835-S837 VanDerWaalsContact O-N 3.16Å; S837-D839 VanDerWaalsContact C-N 3.32Å; S837-D839 PolarHBondContact O-N 3.22Å; S837-F840 WeakPolarHBondContact O-CB 3.46Å; S837-F840 PolarHBondContact O-N 2.9Å; S837-F840 VanDerWaalsContact O-N 3.11Å; S837-F841 PolarHBondContact O-N 3.31Å; S837-F841 WeakPolarHBondContact OG-CE2 3.17Å
838	R	85.2	Confident	84.1	Confident	178 Å²	178	61.8 Å²	61.8	67%	0.672	32%	0.324	S	S	*	.	H	α-helix	trans	-48.4	-46.5	-176.1	-82.7	-179.7	170.2	-172.4	-2.1	113.7	A834 F840 F841 Q842	A834-R838 PolarHBondContact O-N 3.02Å; A834-R838 VanDerWaalsContact O-N 3.12Å; R838-F840 VanDerWaalsContact C-N 3.31Å; R838-F840 PolarHBondContact O-N 3.38Å; R838-F841 CarbonylContact O-C 3.52Å; R838-F841 PolarHBondContact O-N 2.89Å; R838-F841 VanDerWaalsContact O-N 3.08Å; R838-Q842 WeakPolarHBondContact O-CB 3.15Å; R838-Q842 PolarHBondContact O-N 3.49Å
839	D	85.9	Confident	83.4	Confident	121 Å²	121	59.1 Å²	59.1	65%	0.647	32%	0.318	S	S	*	.	H	α-helix	trans	-59.5	-40.9	-176.8	-40	-34.2	0	0	0	112.4	S837 F841 Q842 D843	S837-D839 VanDerWaalsContact C-N 3.32Å; S837-D839 PolarHBondContact O-N 3.22Å; D839-F841 VanDerWaalsContact C-N 3.35Å; D839-F841 PolarHBondContact O-N 2.96Å; D839-Q842 PolarHBondContact O-N 3.21Å; D839-D843 PolarHBondContact O-N 2.84Å
840	F	89.1	Confident	82.2	Confident	1 Å²	1	59.3 Å²	59.3	0%	0.004	32%	0.317	C	S	.	.	H	α-helix	trans	-64.5	-40.1	177.1	176	-85.4	0	0	0	111.8	R706 S837 R838 L844 W867 L868	R706-F840 HydrophobicContact CB-CE1 4.39Å; R706-F840 HydrophobicContact CG-CD1 4.02Å; R706-F840 HydrophobicContact CG-CE1 4.31Å; R706-F840 HydrophobicContact CG-CG 4.33Å; S837-F840 WeakPolarHBondContact O-CB 3.46Å; S837-F840 PolarHBondContact O-N 2.9Å; S837-F840 VanDerWaalsContact O-N 3.11Å; R838-F840 VanDerWaalsContact C-N 3.31Å; R838-F840 PolarHBondContact O-N 3.38Å; F840-L844 HydrophobicContact CE1-CD2 4.38Å; F840-W867 HydrophobicContact CD2-CE3 4.23Å; F840-W867 HydrophobicContact CE2-CB 3.69Å; F840-W867 AromaticContact CE2-CE3 3.87Å; F840-W867 HydrophobicContact CE2-CE3 3.87Å; F840-W867 HydrophobicContact CZ-CB 4.07Å; F840-W867 HydrophobicContact CZ-CE3 4.09Å; F840-L868 HydrophobicContact CE2-CD2 4.38Å; F840-L868 HydrophobicContact CZ-CD2 4.17Å; F840-L868 HydrophobicContact CZ-CG 4.05Å
841	F	89.4	Confident	81.2	Confident	3 Å²	3	65.9 Å²	65.9	1%	0.013	35%	0.347	C	S	.	.	H	α-helix	trans	-79.7	-30.9	178.2	-73.1	-67.1	0	0	0	112.6	R706 V709 L710 A834 S837 R838 D839 D843 L844 D845	R706-F841 HydrophobicContact CB-CE2 4.18Å; R706-F841 HydrophobicContact CB-CZ 4.05Å; R706-F841 HydrophobicContact CG-CE2 3.79Å; R706-F841 HydrophobicContact CG-CZ 4.14Å; V709-F841 HydrophobicContact CB-CE1 4.16Å; V709-F841 HydrophobicContact CB-CE2 3.85Å; V709-F841 HydrophobicContact CB-CZ 3.49Å; V709-F841 VanDerWaalsContact CB-CZ 3.49Å; V709-F841 HydrophobicContact CG1-CD1 4.17Å; V709-F841 HydrophobicContact CG1-CD2 4.35Å; V709-F841 HydrophobicContact CG1-CE1 3.6Å; V709-F841 HydrophobicContact CG1-CE2 3.78Å; V709-F841 HydrophobicContact CG1-CZ 3.4Å; V709-F841 VanDerWaalsContact CG1-CZ 3.4Å; V709-F841 HydrophobicContact CG2-CE2 3.87Å; V709-F841 HydrophobicContact CG2-CZ 4.05Å; L710-F841 HydrophobicContact CD2-CE1 3.96Å; L710-F841 HydrophobicContact CG-CE1 4.33Å; A834-F841 HydrophobicContact CB-CD2 3.9Å; A834-F841 HydrophobicContact CB-CE2 4.39Å; A834-F841 HydrophobicContact CB-CG 4.38Å; S837-F841 PolarHBondContact O-N 3.31Å; S837-F841 WeakPolarHBondContact OG-CE2 3.17Å; R838-F841 CarbonylContact O-C 3.52Å; R838-F841 PolarHBondContact O-N 2.89Å; R838-F841 VanDerWaalsContact O-N 3.08Å; D839-F841 VanDerWaalsContact C-N 3.35Å; D839-F841 PolarHBondContact O-N 2.96Å; F841-D843 VanDerWaalsContact C-N 3.35Å; F841-D843 PolarHBondContact O-N 2.66Å; F841-L844 HydrophobicContact CD1-CD2 4.1Å; F841-L844 HydrophobicContact CE1-CD2 4.16Å; F841-L844 CarbonylContact O-C 3.53Å; F841-L844 WeakPolarHBondContact O-CA 3.05Å; F841-L844 WeakPolarHBondContact O-CB 3.09Å; F841-L844 PolarHBondContact O-N 3.02Å; F841-D845 WeakPolarHBondContact O-CA 3.11Å; F841-D845 WeakPolarHBondContact O-CB 3.31Å; F841-D845 PolarHBondContact O-N 2.85Å
842	Q	85.8	Confident	80.8	Confident	149 Å²	149	63.1 Å²	63.1	70%	0.696	33%	0.334	S	S	*	.	H	α-helix	trans	-65.1	-37.8	176	-171	170.9	10	0	0	111.9	R838 D839 L844	R838-Q842 WeakPolarHBondContact O-CB 3.15Å; R838-Q842 PolarHBondContact O-N 3.49Å; D839-Q842 PolarHBondContact O-N 3.21Å; Q842-L844 PolarHBondContact O-N 2.99Å
843	D	80.6	Confident	80.5	Confident	57 Å²	57	58.9 Å²	58.9	31%	0.305	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-21.7	171.2	-71.5	-40	0	0	0	113.2	R612 R614 D839 F841 W867	R612-D843 IonicContact CZ-OD2 2.63Å; R612-D843 IonicContact NH1-OD2 2.8Å; R612-D843 PolarHBondContact NH1-OD2 2.7Å; R612-D843 IonicContact NH2-OD2 3.22Å; R612-D843 PolarHBondContact NH2-OD2 3.14Å; R614-D843 PolarHBondContact NH2-O 3.03Å; D839-D843 PolarHBondContact O-N 2.84Å; F841-D843 VanDerWaalsContact C-N 3.35Å; F841-D843 PolarHBondContact O-N 2.66Å; D843-W867 HydrophobicContact CB-CH2 3.77Å; D843-W867 HydrophobicContact CB-CZ3 3.8Å
844	L	82	Confident	80.4	Confident	9 Å²	9	57.9 Å²	57.9	5%	0.047	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-38.7	-172.1	-162.1	71	0	0	0	113.3	L710 F840 F841 Q842 S846 Y860 Q863 W867	L710-L844 HydrophobicContact CD2-CD2 4.06Å; F840-L844 HydrophobicContact CE1-CD2 4.38Å; F841-L844 HydrophobicContact CD1-CD2 4.1Å; F841-L844 HydrophobicContact CE1-CD2 4.16Å; F841-L844 CarbonylContact O-C 3.53Å; F841-L844 WeakPolarHBondContact O-CA 3.05Å; F841-L844 WeakPolarHBondContact O-CB 3.09Å; F841-L844 PolarHBondContact O-N 3.02Å; Q842-L844 PolarHBondContact O-N 2.99Å; L844-S846 PolarHBondContact O-N 2.98Å; L844-S846 VanDerWaalsContact O-N 3.09Å; L844-Y860 HydrophobicContact CB-CE2 4.1Å; L844-Y860 HydrophobicContact CD2-CD2 4.13Å; L844-Y860 HydrophobicContact CD2-CE1 4.12Å; L844-Y860 HydrophobicContact CD2-CE2 3.66Å; L844-Y860 HydrophobicContact CG-CD2 3.76Å; L844-Y860 HydrophobicContact CG-CE2 3.52Å; L844-Q863 HydrophobicContact CD1-CB 3.84Å; L844-Q863 HydrophobicContact CD1-CG 3.51Å; L844-W867 HydrophobicContact CB-CH2 4.47Å; L844-W867 HydrophobicContact CB-CZ3 3.92Å; L844-W867 HydrophobicContact CD1-CE3 4.06Å; L844-W867 HydrophobicContact CD1-CH2 3.99Å; L844-W867 HydrophobicContact CD1-CZ3 3.69Å; L844-W867 HydrophobicContact CG-CZ3 4.36Å
845	D	67.8	Low	80.4	Confident	61 Å²	61	60.1 Å²	60.1	33%	0.326	33%	0.332	S	S	.	.			trans	-73.3	-1.6	-166.9	-77.6	-0.9	0	0	0	114	F841 A847 L848 Y860	F841-D845 WeakPolarHBondContact O-CA 3.11Å; F841-D845 WeakPolarHBondContact O-CB 3.31Å; F841-D845 PolarHBondContact O-N 2.85Å; D845-A847 PolarHBondContact O-N 3.01Å; D845-L848 PolarHBondContact O-N 3.28Å; D845-Y860 WeakPolarHBondContact OD1-CE2 3.45Å; D845-Y860 VanDerWaalsContact OD1-CZ 3.24Å; D845-Y860 PolarHBondContact OD1-OH 3.3Å
846	S	60.8	Low	80.5	Confident	88 Å²	88	62.1 Å²	62.1	62%	0.615	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-3.8	171.4	59.3	0	0	0	0	116.7	L844	L844-S846 PolarHBondContact O-N 2.98Å; L844-S846 VanDerWaalsContact O-N 3.09Å
847	A	58	Low	81	Confident	64 Å²	64	57.4 Å²	57.4	53%	0.529	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.4	3.1	-175.4	0	0	0	0	0	116.8	D845 S852	D845-A847 PolarHBondContact O-N 3.01Å; A847-S852 PolarHBondContact O-OG 3.5Å
848	L	73.3	Confident	81.2	Confident	23 Å²	23	57.2 Å²	57.2	12%	0.12	31%	0.306	C	S	.	.			trans	-116.3	119.3	-176.7	-159.9	83.6	0	0	0	113.8	R713 L717 W827 D845 L857 Y860	R713-L848 HydrophobicContact CB-CD2 4.28Å; R713-L848 HydrophobicContact CG-CD2 4.29Å; L717-L848 HydrophobicContact CD1-CD1 4.07Å; L717-L848 HydrophobicContact CD1-CD2 4.49Å; L717-L848 HydrophobicContact CD1-CG 4.48Å; W827-L848 HydrophobicContact CH2-CD2 3.87Å; W827-L848 HydrophobicContact CH2-CG 4.21Å; W827-L848 HydrophobicContact CZ3-CD2 4.15Å; D845-L848 PolarHBondContact O-N 3.28Å; L848-L857 HydrophobicContact CD1-CB 4.48Å; L848-Y860 HydrophobicContact CB-CD1 4.44Å; L848-Y860 HydrophobicContact CB-CD2 3.7Å; L848-Y860 HydrophobicContact CB-CE2 3.83Å; L848-Y860 HydrophobicContact CB-CG 4.01Å; L848-Y860 HydrophobicContact CD1-CD1 4.33Å; L848-Y860 HydrophobicContact CD1-CG 4.15Å; L848-Y860 HydrophobicContact CD2-CD1 3.75Å; L848-Y860 HydrophobicContact CD2-CD2 4.47Å; L848-Y860 HydrophobicContact CD2-CE1 3.66Å; L848-Y860 HydrophobicContact CD2-CE2 4.37Å; L848-Y860 HydrophobicContact CD2-CG 4.17Å; L848-Y860 HydrophobicContact CG-CD1 4.39Å; L848-Y860 HydrophobicContact CG-CD2 4.48Å; L848-Y860 HydrophobicContact CG-CG 4.33Å
849	S	77.5	Confident	81.6	Confident	57 Å²	57	52.7 Å²	52.7	40%	0.399	29%	0.289	S	S	.	.			trans	-117.9	167.5	169.3	75.7	0	0	0	0	110.8	W827 Q851 S852	W827-S849 VanDerWaalsContact CH2-C 3.44Å; S849-Q851 PolarHBondContact O-N 3.43Å; S849-Q851 PolarHBondContact OG-N 3.46Å; S849-Q851 VanDerWaalsContact OG-N 3.11Å; S849-S852 PolarHBondContact N-OG 3.39Å; S849-S852 WeakPolarHBondContact O-CB 3.34Å; S849-S852 PolarHBondContact O-N 2.73Å; S849-S852 VanDerWaalsContact O-N 3.08Å; S849-S852 PolarHBondContact O-OG 2.93Å; S849-S852 PolarHBondContact OG-N 3.4Å; S849-S852 PolarHBondContact OG-OG 3.44Å
850	Q	69.3	Low	81.9	Confident	34 Å²	34	47.5 Å²	47.5	16%	0.159	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	2.1	171.6	-152.2	-170.6	0.2	0	0	113.3	L717 L720 S823 Y824 W827	L717-Q850 HydrophobicContact CD2-CG 4.43Å; L720-Q850 WeakPolarHBondContact CD2-O 3.39Å; S823-Q850 PolarHBondContact OG-NE2 2.89Å; Y824-Q850 VanDerWaalsContact CD1-NE2 3.28Å; Y824-Q850 VanDerWaalsContact CE1-NE2 3.31Å; W827-Q850 HydrophobicContact CD2-CB 4.17Å; W827-Q850 HydrophobicContact CD2-CG 3.94Å; W827-Q850 HydrophobicContact CE3-CB 4.15Å; W827-Q850 HydrophobicContact CE3-CG 3.8Å; W827-Q850 HydrophobicContact CG-CG 4.38Å; W827-Q850 HydrophobicContact CH2-CB 4.34Å; W827-Q850 HydrophobicContact CZ2-CB 4.36Å; W827-Q850 HydrophobicContact CZ3-CB 4.23Å; W827-Q850 HydrophobicContact CZ3-CG 4.28Å
851	Q	72.4	Confident	82.1	Confident	137 Å²	137	47.6 Å²	47.6	64%	0.64	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	1.9	172.6	-61.5	-64.5	-92.9	0	0	113	S849	S849-Q851 PolarHBondContact O-N 3.43Å; S849-Q851 PolarHBondContact OG-N 3.46Å; S849-Q851 VanDerWaalsContact OG-N 3.11Å
852	S	83.1	Confident	82.4	Confident	15 Å²	15	49.7 Å²	49.7	11%	0.105	27%	0.269	C	S	.	.			trans	-61.6	146.6	178.4	-68	0	0	0	0	112.2	A847 S849	A847-S852 PolarHBondContact O-OG 3.5Å; S849-S852 PolarHBondContact N-OG 3.39Å; S849-S852 WeakPolarHBondContact O-CB 3.34Å; S849-S852 PolarHBondContact O-N 2.73Å; S849-S852 VanDerWaalsContact O-N 3.08Å; S849-S852 PolarHBondContact O-OG 2.93Å; S849-S852 PolarHBondContact OG-N 3.4Å; S849-S852 PolarHBondContact OG-OG 3.44Å
853	S	87.4	Confident	82.7	Confident	45 Å²	45	43.4 Å²	43.4	32%	0.315	24%	0.239	S	C	.	.			trans	-66.5	164.6	177.6	69.1	0	0	0	0	112.5	V855 E856 L857	S853-V855 PolarHBondContact O-N 3.33Å; S853-V855 PolarHBondContact OG-N 3Å; S853-E856 WeakPolarHBondContact CA-OE2 3.45Å; S853-E856 WeakPolarHBondContact CB-OE2 3.35Å; S853-E856 PolarHBondContact N-OE2 3.3Å; S853-E856 PolarHBondContact O-N 3.48Å; S853-E856 WeakPolarHBondContact OG-CG 3.15Å; S853-E856 PolarHBondContact OG-N 3.38Å; S853-E856 PolarHBondContact OG-OE2 2.92Å; S853-L857 WeakPolarHBondContact O-CB 3.16Å; S853-L857 PolarHBondContact O-N 3.19Å
854	M	90.6	Very high	83.4	Confident	7 Å²	7	40.7 Å²	40.7	3%	0.034	23%	0.225	C	C	.	.	H	α-helix	trans	-61	-27.8	173.2	-60	-63.6	90	0	0	112.3	I659 N663 L717 L718 R721 L857 V858	I659-M854 HydrophobicContact CG2-CB 4Å; I659-M854 HydrophobicContact CG2-CG 4.35Å; I659-M854 HydrophobicContact CG2-SD 4.03Å; N663-M854 HydrophobicContact CB-CB 4.16Å; L717-M854 HydrophobicContact CB-CE 4Å; L718-M854 HydrophobicContact CD2-SD 4.45Å; R721-M854 HydrophobicContact CB-CE 4.07Å; R721-M854 HydrophobicContact CB-SD 3.87Å; R721-M854 HydrophobicContact CG-CE 4.34Å; R721-M854 HydrophobicContact CG-CG 4.12Å; R721-M854 HydrophobicContact CG-SD 3.8Å; M854-L857 HydrophobicContact CE-CD2 4.15Å; M854-L857 HydrophobicContact SD-CD2 4.34Å; M854-V858 WeakPolarHBondContact O-CB 3.37Å; M854-V858 VanDerWaalsContact O-CG2 3.25Å; M854-V858 WeakPolarHBondContact O-CG2 3.49Å; M854-V858 PolarHBondContact O-N 3Å
855	V	90.8	Very high	84	Confident	57 Å²	57	40.3 Å²	40.3	35%	0.345	22%	0.223	S	C	.	.	H	α-helix	trans	-74.4	-44.5	178.3	-178.5	0	0	0	0	111	S853 V858 R859	S853-V855 PolarHBondContact O-N 3.33Å; S853-V855 PolarHBondContact OG-N 3Å; V855-V858 PolarHBondContact O-N 3.47Å; V855-R859 WeakPolarHBondContact O-CG 3.47Å; V855-R859 PolarHBondContact O-N 2.98Å
856	E	90.5	Very high	85.2	Confident	92 Å²	92	39.1 Å²	39.1	43%	0.43	22%	0.215	S	C	.	.	H	α-helix	trans	-64.5	-41.9	175.5	-70.2	155.5	131.6	0	0	111.2	S853 R859 Y860	S853-E856 WeakPolarHBondContact CA-OE2 3.45Å; S853-E856 WeakPolarHBondContact CB-OE2 3.35Å; S853-E856 PolarHBondContact N-OE2 3.3Å; S853-E856 PolarHBondContact O-N 3.48Å; S853-E856 WeakPolarHBondContact OG-CG 3.15Å; S853-E856 PolarHBondContact OG-N 3.38Å; S853-E856 PolarHBondContact OG-OE2 2.92Å; E856-R859 PolarHBondContact O-N 3.35Å; E856-Y860 VanDerWaalsContact O-CB 3.26Å; E856-Y860 WeakPolarHBondContact O-CB 3.43Å; E856-Y860 PolarHBondContact O-N 3.22Å
857	L	92.8	Very high	86.7	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-52.9	-54.5	169.5	168.2	65.6	0	0	0	111.1	I659 L717 L848 S853 M854 R859 Y860 I861	I659-L857 HydrophobicContact CD1-CD2 3.9Å; L717-L857 HydrophobicContact CB-CD2 3.97Å; L717-L857 HydrophobicContact CD1-CB 4.08Å; L717-L857 HydrophobicContact CD1-CD1 4.11Å; L717-L857 HydrophobicContact CD1-CD2 4.45Å; L717-L857 HydrophobicContact CD1-CG 4.43Å; L848-L857 HydrophobicContact CD1-CB 4.48Å; S853-L857 WeakPolarHBondContact O-CB 3.16Å; S853-L857 PolarHBondContact O-N 3.19Å; M854-L857 HydrophobicContact CE-CD2 4.15Å; M854-L857 HydrophobicContact SD-CD2 4.34Å; L857-R859 VanDerWaalsContact C-N 3.33Å; L857-R859 PolarHBondContact O-N 2.99Å; L857-Y860 PolarHBondContact O-N 3.31Å; L857-I861 HydrophobicContact CD1-CD1 4.05Å; L857-I861 HydrophobicContact CD1-CG1 3.58Å; L857-I861 HydrophobicContact CG-CG1 4.38Å; L857-I861 WeakPolarHBondContact O-CG1 3.22Å; L857-I861 PolarHBondContact O-N 3.24Å
858	V	94	Very high	88.3	Confident	3 Å²	3	32.2 Å²	32.2	2%	0.018	16%	0.162	C	C	.	.	H	α-helix	trans	-62.8	-39.5	-177.3	168.1	0	0	0	0	111.9	L656 I659 E660 M854 V855 R862	L656-V858 HydrophobicContact CB-CG1 4.33Å; L656-V858 HydrophobicContact CB-CG2 4.34Å; L656-V858 HydrophobicContact CD2-CG2 4.24Å; I659-V858 HydrophobicContact CB-CG2 4.03Å; I659-V858 HydrophobicContact CG2-CG2 4.02Å; E660-V858 HydrophobicContact CG-CB 4.41Å; E660-V858 HydrophobicContact CG-CG1 3.92Å; E660-V858 HydrophobicContact CG-CG2 4.06Å; M854-V858 WeakPolarHBondContact O-CB 3.37Å; M854-V858 VanDerWaalsContact O-CG2 3.25Å; M854-V858 WeakPolarHBondContact O-CG2 3.49Å; M854-V858 PolarHBondContact O-N 3Å; V855-V858 PolarHBondContact O-N 3.47Å; V858-R862 HydrophobicContact CG1-CG 4.4Å; V858-R862 VanDerWaalsContact CG1-NH1 3.34Å; V858-R862 WeakPolarHBondContact O-CB 3.11Å; V858-R862 WeakPolarHBondContact O-CG 3.31Å; V858-R862 PolarHBondContact O-N 3.22Å
859	R	91.9	Very high	89.2	Confident	84 Å²	84	33 Å²	33	32%	0.317	16%	0.163	S	C	.	.	H	α-helix	trans	-62.8	-51.3	175.6	-71.3	176.6	-175.8	-165.5	-3.7	111.8	F617 D619 V855 E856 L857 I861 R862 Q863	F617-R859 HydrophobicContact CB-CG 4.5Å; F617-R859 HydrophobicContact CD1-CG 3.91Å; F617-R859 HydrophobicContact CD2-CB 4.25Å; F617-R859 HydrophobicContact CD2-CG 3.99Å; F617-R859 HydrophobicContact CE1-CB 4.3Å; F617-R859 HydrophobicContact CE1-CG 4.07Å; F617-R859 HydrophobicContact CE2-CB 3.94Å; F617-R859 HydrophobicContact CE2-CG 4.15Å; F617-R859 HydrophobicContact CG-CG 3.86Å; F617-R859 HydrophobicContact CZ-CB 3.97Å; F617-R859 HydrophobicContact CZ-CG 4.19Å; F617-R859 VanDerWaalsContact CZ-O 3.27Å; F617-R859 WeakPolarHBondContact CZ-O 3.18Å; D619-R859 IonicContact OD1-CZ 3.54Å; D619-R859 IonicContact OD1-NH1 2.69Å; D619-R859 PolarHBondContact OD1-NH1 2.99Å; D619-R859 IonicContact OD1-NH2 2.63Å; D619-R859 PolarHBondContact OD1-NH2 3Å; V855-R859 WeakPolarHBondContact O-CG 3.47Å; V855-R859 PolarHBondContact O-N 2.98Å; E856-R859 PolarHBondContact O-N 3.35Å; L857-R859 VanDerWaalsContact C-N 3.33Å; L857-R859 PolarHBondContact O-N 2.99Å; R859-I861 PolarHBondContact O-N 2.87Å; R859-R862 PolarHBondContact O-N 2.85Å; R859-Q863 WeakPolarHBondContact O-CB 3.16Å; R859-Q863 PolarHBondContact O-N 3.31Å
860	Y	92.1	Very high	89.8	Confident	12 Å²	12	32.7 Å²	32.7	5%	0.047	16%	0.161	C	C	.	.	H	α-helix	trans	-56.5	-48.5	177.6	170.3	-89	0	0	0	111.9	L710 R713 L844 D845 L848 E856 L857 Q863 G864	L710-Y860 HydrophobicContact CD2-CE1 3.97Å; R713-Y860 HydrophobicContact CG-CE1 4.35Å; L844-Y860 HydrophobicContact CB-CE2 4.1Å; L844-Y860 HydrophobicContact CD2-CD2 4.13Å; L844-Y860 HydrophobicContact CD2-CE1 4.12Å; L844-Y860 HydrophobicContact CD2-CE2 3.66Å; L844-Y860 HydrophobicContact CG-CD2 3.76Å; L844-Y860 HydrophobicContact CG-CE2 3.52Å; D845-Y860 WeakPolarHBondContact OD1-CE2 3.45Å; D845-Y860 VanDerWaalsContact OD1-CZ 3.24Å; D845-Y860 PolarHBondContact OD1-OH 3.3Å; L848-Y860 HydrophobicContact CB-CD1 4.44Å; L848-Y860 HydrophobicContact CB-CD2 3.7Å; L848-Y860 HydrophobicContact CB-CE2 3.83Å; L848-Y860 HydrophobicContact CB-CG 4.01Å; L848-Y860 HydrophobicContact CD1-CD1 4.33Å; L848-Y860 HydrophobicContact CD1-CG 4.15Å; L848-Y860 HydrophobicContact CD2-CD1 3.75Å; L848-Y860 HydrophobicContact CD2-CD2 4.47Å; L848-Y860 HydrophobicContact CD2-CE1 3.66Å; L848-Y860 HydrophobicContact CD2-CE2 4.37Å; L848-Y860 HydrophobicContact CD2-CG 4.17Å; L848-Y860 HydrophobicContact CG-CD1 4.39Å; L848-Y860 HydrophobicContact CG-CD2 4.48Å; L848-Y860 HydrophobicContact CG-CG 4.33Å; E856-Y860 VanDerWaalsContact O-CB 3.26Å; E856-Y860 WeakPolarHBondContact O-CB 3.43Å; E856-Y860 PolarHBondContact O-N 3.22Å; L857-Y860 PolarHBondContact O-N 3.31Å; Y860-Q863 PolarHBondContact O-N 3.47Å; Y860-G864 PolarHBondContact O-N 3.37Å
861	I	94.5	Very high	90.8	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-71.9	-39.8	-177.9	-53.2	-73.8	0	0	0	111.4	L656 L710 R713 C714 L857 R859 Q863 G864 L865	L656-I861 HydrophobicContact CD1-CB 3.85Å; L656-I861 HydrophobicContact CD1-CG2 3.71Å; L656-I861 HydrophobicContact CD2-CB 3.83Å; L656-I861 HydrophobicContact CD2-CG1 4.24Å; L656-I861 HydrophobicContact CD2-CG2 3.92Å; L656-I861 HydrophobicContact CG-CB 4.46Å; L656-I861 HydrophobicContact CG-CG2 4.27Å; L710-I861 HydrophobicContact CB-CD1 3.99Å; L710-I861 HydrophobicContact CB-CG2 4.19Å; L710-I861 HydrophobicContact CD2-CD1 3.76Å; L710-I861 HydrophobicContact CD2-CG2 4.49Å; L710-I861 HydrophobicContact CG-CD1 4.48Å; L710-I861 VanDerWaalsContact O-CD1 3.31Å; L710-I861 WeakPolarHBondContact O-CD1 3.47Å; R713-I861 HydrophobicContact CB-CD1 4.04Å; C714-I861 VanDerWaalsContact SG-CG1 3.55Å; L857-I861 HydrophobicContact CD1-CD1 4.05Å; L857-I861 HydrophobicContact CD1-CG1 3.58Å; L857-I861 HydrophobicContact CG-CG1 4.38Å; L857-I861 WeakPolarHBondContact O-CG1 3.22Å; L857-I861 PolarHBondContact O-N 3.24Å; R859-I861 PolarHBondContact O-N 2.87Å; I861-Q863 VanDerWaalsContact C-N 3.28Å; I861-Q863 PolarHBondContact O-N 3.42Å; I861-G864 PolarHBondContact O-N 3.12Å; I861-L865 HydrophobicContact CG2-CD1 4.14Å; I861-L865 HydrophobicContact CG2-CG 4.1Å; I861-L865 WeakPolarHBondContact O-CB 3.38Å; I861-L865 WeakPolarHBondContact O-CG 3.41Å; I861-L865 PolarHBondContact O-N 3.12Å
862	R	94.9	Very high	91.5	Very high	48 Å²	48	29.6 Å²	29.6	18%	0.181	15%	0.151	C	C	.	.	H	α-helix	trans	-61.5	-37.8	174.3	-78.7	-164.3	177.3	125.4	1.3	111.9	L615 F617 D653 L656 S657 E660 V858 R859 L865 H866	L615-R862 HydrophobicContact CD1-CB 4.12Å; F617-R862 HydrophobicContact CE1-CB 3.99Å; F617-R862 HydrophobicContact CZ-CB 4.1Å; D653-R862 IonicContact OD1-NE 2.76Å; D653-R862 PolarHBondContact OD1-NE 3.4Å; L656-R862 HydrophobicContact CD1-CB 4.43Å; L656-R862 HydrophobicContact CD1-CG 3.49Å; L656-R862 VanDerWaalsContact CD1-CG 3.49Å; S657-R862 PolarHBondContact OG-NH2 3.32Å; E660-R862 IonicContact OE1-CZ 3.32Å; E660-R862 IonicContact OE1-NH1 3.4Å; E660-R862 PolarHBondContact OE1-NH1 2.93Å; E660-R862 IonicContact OE2-CZ 3.26Å; E660-R862 VanDerWaalsContact OE2-CZ 3.24Å; E660-R862 IonicContact OE2-NH1 3.97Å; E660-R862 PolarHBondContact OE2-NH1 3.46Å; E660-R862 IonicContact OE2-NH2 3.96Å; E660-R862 PolarHBondContact OE2-NH2 3.47Å; V858-R862 HydrophobicContact CG1-CG 4.4Å; V858-R862 VanDerWaalsContact CG1-NH1 3.34Å; V858-R862 WeakPolarHBondContact O-CB 3.11Å; V858-R862 WeakPolarHBondContact O-CG 3.31Å; V858-R862 PolarHBondContact O-N 3.22Å; R859-R862 PolarHBondContact O-N 2.85Å; R862-L865 PolarHBondContact O-N 3.23Å; R862-H866 WeakPolarHBondContact O-CB 3.31Å; R862-H866 PolarHBondContact O-N 3.4Å
863	Q	93.3	Very high	91.6	Very high	17 Å²	17	37.6 Å²	37.6	8%	0.079	19%	0.187	C	C	.	.	H	α-helix	trans	-63.1	-44.5	174.2	-176.2	63.7	79.9	0	0	111.9	P613 R614 L844 R859 Y860 I861 H866 W867	P613-Q863 PolarHBondContact O-NE2 2.89Å; P613-Q863 VanDerWaalsContact O-NE2 3.15Å; R614-Q863 VanDerWaalsContact CA-OE1 3.28Å; L844-Q863 HydrophobicContact CD1-CB 3.84Å; L844-Q863 HydrophobicContact CD1-CG 3.51Å; R859-Q863 WeakPolarHBondContact O-CB 3.16Å; R859-Q863 PolarHBondContact O-N 3.31Å; Y860-Q863 PolarHBondContact O-N 3.47Å; I861-Q863 VanDerWaalsContact C-N 3.28Å; I861-Q863 PolarHBondContact O-N 3.42Å; Q863-H866 PolarHBondContact O-N 3.5Å; Q863-W867 HydrophobicContact CG-CZ2 4.11Å; Q863-W867 PolarHBondContact O-N 3.29Å; Q863-W867 VanDerWaalsContact O-N 3.15Å
864	G	93.9	Very high	91.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64	-43.7	174.5	0	0	0	0	0	113.3	Y860 I861 H866 W867 L868	Y860-G864 PolarHBondContact O-N 3.37Å; I861-G864 PolarHBondContact O-N 3.12Å; G864-H866 VanDerWaalsContact C-N 3.33Å; G864-H866 PolarHBondContact O-N 2.97Å; G864-W867 PolarHBondContact O-N 2.77Å; G864-L868 WeakPolarHBondContact O-CG 3.46Å; G864-L868 PolarHBondContact O-N 3.36Å
865	L	94.4	Very high	90	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-65.5	-33.5	175.8	-70	-179.5	0	0	0	112.4	A652 D653 L656 L707 L710 I861 R862 L868 R869	A652-L865 HydrophobicContact CB-CD1 3.99Å; A652-L865 HydrophobicContact CB-CD2 4.23Å; D653-L865 HydrophobicContact CB-CD1 4.03Å; L656-L865 HydrophobicContact CD1-CD1 3.93Å; L707-L865 HydrophobicContact CD1-CD2 3.64Å; L710-L865 HydrophobicContact CD1-CD2 4.06Å; L710-L865 HydrophobicContact CD1-CG 4.36Å; I861-L865 HydrophobicContact CG2-CD1 4.14Å; I861-L865 HydrophobicContact CG2-CG 4.1Å; I861-L865 WeakPolarHBondContact O-CB 3.38Å; I861-L865 WeakPolarHBondContact O-CG 3.41Å; I861-L865 PolarHBondContact O-N 3.12Å; R862-L865 PolarHBondContact O-N 3.23Å; L865-L868 HydrophobicContact CD2-CD1 4.48Å; L865-R869 WeakPolarHBondContact O-CD 3.25Å; L865-R869 VanDerWaalsContact O-CG 3.24Å; L865-R869 WeakPolarHBondContact O-CG 3.33Å; L865-R869 PolarHBondContact O-N 3.37Å
866	H	93	Very high	90	Very high	36 Å²	36	45.6 Å²	45.6	17%	0.167	22%	0.222	C	C	.	.	H	α-helix	trans	-64.2	-48.7	173.3	172.8	58.9	0	0	0	111.2	L615 R862 Q863 G864 L868 R869 S870	L615-H866 HydrophobicContact CD1-CB 3.94Å; L615-H866 HydrophobicContact CD2-CB 4.12Å; L615-H866 HydrophobicContact CG-CB 4.11Å; R862-H866 WeakPolarHBondContact O-CB 3.31Å; R862-H866 PolarHBondContact O-N 3.4Å; Q863-H866 PolarHBondContact O-N 3.5Å; G864-H866 VanDerWaalsContact C-N 3.33Å; G864-H866 PolarHBondContact O-N 2.97Å; H866-L868 VanDerWaalsContact C-N 3.35Å; H866-L868 PolarHBondContact O-N 2.98Å; H866-R869 PolarHBondContact O-N 2.78Å; H866-R869 VanDerWaalsContact O-N 3.14Å; H866-S870 PolarHBondContact O-N 3.36Å; H866-S870 PolarHBondContact O-OG 3.33Å
867	W	92.5	Very high	90	Very high	7 Å²	7	43.2 Å²	43.2	3%	0.027	21%	0.211	C	C	.	.	H	α-helix	trans	-61.1	-41.7	175.5	-64.7	-14.3	0	0	0	112.4	R612 P613 F840 D843 L844 Q863 G864 R869 S870 E871	R612-W867 HydrophobicContact CB-CD2 4.12Å; R612-W867 HydrophobicContact CB-CG 4.41Å; R612-W867 HydrophobicContact CB-CZ2 3.77Å; R612-W867 VanDerWaalsContact CD-CD2 3.42Å; R612-W867 HydrophobicContact CG-CD2 4.42Å; P613-W867 PolarHBondContact O-NE1 3.02Å; F840-W867 HydrophobicContact CD2-CE3 4.23Å; F840-W867 HydrophobicContact CE2-CB 3.69Å; F840-W867 AromaticContact CE2-CE3 3.87Å; F840-W867 HydrophobicContact CE2-CE3 3.87Å; F840-W867 HydrophobicContact CZ-CB 4.07Å; F840-W867 HydrophobicContact CZ-CE3 4.09Å; D843-W867 HydrophobicContact CB-CH2 3.77Å; D843-W867 HydrophobicContact CB-CZ3 3.8Å; L844-W867 HydrophobicContact CB-CH2 4.47Å; L844-W867 HydrophobicContact CB-CZ3 3.92Å; L844-W867 HydrophobicContact CD1-CE3 4.06Å; L844-W867 HydrophobicContact CD1-CH2 3.99Å; L844-W867 HydrophobicContact CD1-CZ3 3.69Å; L844-W867 HydrophobicContact CG-CZ3 4.36Å; Q863-W867 HydrophobicContact CG-CZ2 4.11Å; Q863-W867 PolarHBondContact O-N 3.29Å; Q863-W867 VanDerWaalsContact O-N 3.15Å; G864-W867 PolarHBondContact O-N 2.77Å; W867-R869 VanDerWaalsContact C-N 3.3Å; W867-R869 PolarHBondContact O-N 3.07Å; W867-S870 PolarHBondContact O-N 3.04Å; W867-E871 WeakPolarHBondContact O-CG 3.35Å; W867-E871 PolarHBondContact O-N 2.76Å
868	L	93.1	Very high	89.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.2	-34.3	174.5	-71.9	176.7	0	0	0	113.1	L703 R706 L707 L710 F840 G864 L865 H866 A872	L703-L868 HydrophobicContact CB-CD2 4.31Å; L703-L868 HydrophobicContact CD2-CD2 3.69Å; R706-L868 HydrophobicContact CB-CD1 4.37Å; R706-L868 HydrophobicContact CB-CD2 3.8Å; L707-L868 HydrophobicContact CB-CD1 4.09Å; L707-L868 HydrophobicContact CD1-CD1 4.41Å; L710-L868 HydrophobicContact CD1-CD1 3.59Å; F840-L868 HydrophobicContact CE2-CD2 4.38Å; F840-L868 HydrophobicContact CZ-CD2 4.17Å; F840-L868 HydrophobicContact CZ-CG 4.05Å; G864-L868 WeakPolarHBondContact O-CG 3.46Å; G864-L868 PolarHBondContact O-N 3.36Å; L865-L868 HydrophobicContact CD2-CD1 4.48Å; H866-L868 VanDerWaalsContact C-N 3.35Å; H866-L868 PolarHBondContact O-N 2.98Å; L868-A872 WeakPolarHBondContact O-CB 3.39Å; L868-A872 PolarHBondContact O-N 3.23Å
869	R	92.1	Very high	89.6	Confident	38 Å²	38	48.1 Å²	48.1	14%	0.143	24%	0.235	C	C	.	.	H	α-helix	trans	-70.6	-40.1	174.7	-72.6	164.3	-177.5	164.6	0.2	112	V649 D653 L865 H866 W867 A872 Q873 L874 L875	V649-R869 HydrophobicContact CG1-CG 3.91Å; V649-R869 VanDerWaalsContact CG1-NE 3.33Å; V649-R869 PolarHBondContact O-NH2 3.26Å; D653-R869 VanDerWaalsContact CB-NH2 3.28Å; D653-R869 IonicContact OD2-CZ 3.06Å; D653-R869 VanDerWaalsContact OD2-CZ 3.22Å; D653-R869 IonicContact OD2-NH1 3.43Å; D653-R869 PolarHBondContact OD2-NH1 3.33Å; D653-R869 IonicContact OD2-NH2 2.67Å; D653-R869 PolarHBondContact OD2-NH2 2.6Å; L865-R869 WeakPolarHBondContact O-CD 3.25Å; L865-R869 VanDerWaalsContact O-CG 3.24Å; L865-R869 WeakPolarHBondContact O-CG 3.33Å; L865-R869 PolarHBondContact O-N 3.37Å; H866-R869 PolarHBondContact O-N 2.78Å; H866-R869 VanDerWaalsContact O-N 3.14Å; W867-R869 VanDerWaalsContact C-N 3.3Å; W867-R869 PolarHBondContact O-N 3.07Å; R869-A872 PolarHBondContact O-N 3.25Å; R869-Q873 PolarHBondContact O-N 3.41Å; R869-L874 HydrophobicContact CB-CB 4.34Å; R869-L874 HydrophobicContact CG-CB 4.28Å; R869-L874 PolarHBondContact O-N 2.86Å; R869-L875 HydrophobicContact CB-CD2 3.6Å; R869-L875 HydrophobicContact CB-CG 3.95Å; R869-L875 HydrophobicContact CG-CD2 4.5Å
870	S	90.2	Very high	89.4	Confident	51 Å²	51	45.8 Å²	45.8	36%	0.357	23%	0.23	S	C	.	.	H	α-helix	trans	-62.3	-48.7	174.3	-55.7	0	0	0	0	111.7	H866 W867 A872 Q873	H866-S870 PolarHBondContact O-N 3.36Å; H866-S870 PolarHBondContact O-OG 3.33Å; W867-S870 PolarHBondContact O-N 3.04Å; S870-A872 VanDerWaalsContact C-N 3.34Å; S870-A872 PolarHBondContact O-N 3.42Å; S870-Q873 PolarHBondContact O-N 2.96Å
871	E	88.9	Confident	89.2	Confident	80 Å²	80	48.1 Å²	48.1	37%	0.374	24%	0.242	S	C	.	.	H	α-helix	trans	-69.9	-28.1	179.9	-69	-176.7	-133.2	0	0	112.9	R612 L703 R706 W867	R612-E871 IonicContact NE-OE1 3.38Å; L703-E871 HydrophobicContact CD2-CB 3.8Å; R706-E871 IonicContact CZ-OE2 2.91Å; R706-E871 VanDerWaalsContact NH1-CD 3.26Å; R706-E871 IonicContact NH1-OE1 3.66Å; R706-E871 PolarHBondContact NH1-OE1 3.04Å; R706-E871 IonicContact NH1-OE2 3.48Å; R706-E871 PolarHBondContact NH1-OE2 3.46Å; R706-E871 IonicContact NH2-OE2 3.22Å; W867-E871 WeakPolarHBondContact O-CG 3.35Å; W867-E871 PolarHBondContact O-N 2.76Å
872	A	87.8	Confident	88.9	Confident	27 Å²	27	51.4 Å²	51.4	22%	0.223	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	1	177	0	0	0	0	0	114.9	F645 L703 L868 R869 S870 L874	F645-A872 HydrophobicContact CD1-CB 4.46Å; F645-A872 HydrophobicContact CE1-CB 3.68Å; L703-A872 HydrophobicContact CD1-CB 4.09Å; L868-A872 WeakPolarHBondContact O-CB 3.39Å; L868-A872 PolarHBondContact O-N 3.23Å; R869-A872 PolarHBondContact O-N 3.25Å; S870-A872 VanDerWaalsContact C-N 3.34Å; S870-A872 PolarHBondContact O-N 3.42Å; A872-L874 VanDerWaalsContact C-N 3.33Å; A872-L874 HydrophobicContact CB-CD1 3.83Å; A872-L874 HydrophobicContact CB-CG 3.82Å; A872-L874 PolarHBondContact O-N 3.41Å
873	Q	84.8	Confident	88.4	Confident	183 Å²	183	51.6 Å²	51.6	86%	0.855	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	40.4	-175.9	-54.5	178.6	-2.6	0	0	113.5	R869 S870	R869-Q873 PolarHBondContact O-N 3.41Å; S870-Q873 PolarHBondContact O-N 2.96Å
874	L	76.3	Confident	88	Confident	63 Å²	63	54.5 Å²	54.5	33%	0.33	28%	0.28	S	S	.	.			trans	-109.6	27.4	-176.8	-62.9	178.6	0	0	0	114.1	F645 R869 A872	F645-L874 HydrophobicContact CD1-CD1 3.81Å; F645-L874 HydrophobicContact CE1-CD1 3.79Å; R869-L874 HydrophobicContact CB-CB 4.34Å; R869-L874 HydrophobicContact CG-CB 4.28Å; R869-L874 PolarHBondContact O-N 2.86Å; A872-L874 VanDerWaalsContact C-N 3.33Å; A872-L874 HydrophobicContact CB-CD1 3.83Å; A872-L874 HydrophobicContact CB-CG 3.82Å; A872-L874 PolarHBondContact O-N 3.41Å
875	L	68.9	Low	87.4	Confident	168 Å²	168	59.5 Å²	59.5	88%	0.88	31%	0.305	S	S	*	.			trans	-96.7	0	178.7	-70.5	178.4	0	0	0	111.9	R869	R869-L875 HydrophobicContact CB-CD2 3.6Å; R869-L875 HydrophobicContact CB-CG 3.95Å; R869-L875 HydrophobicContact CG-CD2 4.5Å

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