X5D8Z1_HUMAN Loading...

Discs large-associated protein 2 isoform A

AlphaFold DB , UniProt , Accession X5D8Z1, Species HUMAN (Homo sapiens, Human), Gene DLGAP2, Length 975 aa.

						>X5D8Z1_HUMAN|X5D8Z1|DLGAP2
MKGLSGSRTQPPLCSGHTCGLAPPEDCEHLHHGPDARPPYLLSPADSCPGGRHRCSPRSSVHSECVMMPVVLGDHVSSSTFPRMHYSSHYDTCDDCAVAHAGAKINRIPANLLDQFEKQLPLHRDGFHTLQYQRTSAAAEQRSESPGRIRHLVHSVQKLFTKSHSLEGSSKSNANGTKADGRADDHHHAHHAKHSKRSKSKERKPEGKPRPGMSSWWSSDDNLDSDSTYRTPSVLNRHHLGPVAHCYPDALQSPFGDLSLKTSKSNNDVKCSACEGLALTPDAKYLKRSSWSTLTVSQAKEAYRKSSLNLDKPLLHQDAKPALRPCHYLQVPQDEWGGYPTGGKDEEIPCRRMRSGSYIKAMGDEESGESDSSPKTSPKSAILPEPLLKSIGQRPLGEHQTQTYLQAASDVPVGHSLDPAANYNSPKFRSRNQSYMRAVSTLSQASCVSQVSEAEINGQFESVCESVFSEVESQAMDALDLPGCFRTRSHSYLRAIQAGYSQDDECIPMMTPSDITSTIRSTAAVSYTNYKKTPPPVPPRTTSKPLISVTAQSSTESTQDAYQDSRAQRMSPWPQDSRGLYNSTDSLDSNKAMNLALETAAAQRHLPESQSSSVRTSDKAILVSKAEELLKSRCSSIGIQDSEFPEHQPYPRSDVETATDSDTESRGLREYHSVGVQVEDEKRHGRFKRSNSVTAAVQADLELEGFPGHITTEDKGLQFGSSFQRHSEPSTPTQYSAVRTVRTQGLFSYREDYRTQVDTSTLPPPDPWLEPAIDTVETGRMSPCRRDGSWFLKLLHAETKRMEGWCKEMEREAEENDLSEEILGKIRSAVGSAQLLMSQKFQQFYWLCQQNMDPSAMPRPTSQDLAGYWDMLQLSIEDVSMKFDELQRLRLNDWKMMESPERKEERKVPPPIPKKPPKGKFPITREKSLDLPDRQRQEARRRLMAAKRAASFRQNSASERADSIEIYIPEAQTRL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.6	Very low	35.1	Very low	229 Å²	229	146.6 Å²	146.6	100%	1.128	83%	0.825	S	S	*	*				0	151.4	0	-80.6	156.8	54.4	0	0	108.8
2	K	37.4	Very low	35.9	Very low	209 Å²	209	142.7 Å²	142.7	91%	0.909	81%	0.809	S	S	*	*			trans	18.3	137.9	155.3	-52.6	177.6	-179.5	-178.5	0	118.8
3	G	37.6	Very low	35.3	Very low	63 Å²	63	145.5 Å²	145.5	65%	0.649	82%	0.819	S	S	*	*			cis	-175.5	161.4	5	0	0	0	0	0	108.5
4	L	39.8	Very low	34.7	Very low	177 Å²	177	143.9 Å²	143.9	93%	0.927	82%	0.821	S	S	*	*				49.3	132	78.9	-56.8	-179.1	0	0	0	112.9
5	S	34.9	Very low	34.5	Very low	120 Å²	120	142.2 Å²	142.2	84%	0.839	82%	0.821	S	S	*	*			cis	-170.8	174	6.1	41.4	0	0	0	0	107.8
6	G	35	Very low	34.1	Very low	68 Å²	68	137.3 Å²	137.3	70%	0.701	81%	0.811	S	S	*	*			cis	137.7	161.1	7.5	0	0	0	0	0	111
7	S	30.4	Very low	33.9	Very low	119 Å²	119	139.4 Å²	139.4	83%	0.832	81%	0.81	S	S	*	*			trans	74.3	158.3	-178.6	-130.4	0	0	0	0	115.4
8	R	31.8	Very low	33.8	Very low	230 Å²	230	139.1 Å²	139.1	87%	0.868	81%	0.811	S	S	*	*			cis	-146.4	174.1	8.6	-162.3	165.8	176.6	-164.9	-1.9	113.1
9	T	28.1	Very low	33.7	Very low	111 Å²	111	138.8 Å²	138.8	68%	0.681	82%	0.816	S	S	*	*			trans	-85.9	145.5	-168.7	52.8	0	0	0	0	118.1
10	Q	27.5	Very low	33.5	Very low	180 Å²	180	135.3 Å²	135.3	84%	0.841	81%	0.81	S	S	*	*			trans	45.9	166.5	134	-65.2	-141.8	12.3	0	0	122.8
11	P	48.9	Very low	33.6	Very low	107 Å²	107	137.8 Å²	137.8	70%	0.695	82%	0.818	S	S	*	*			cis	-124.8	-116.3	-33.8	31.4	-8.5	0	0	0	110.4
12	P	44.4	Very low	33.5	Very low	99 Å²	99	131.4 Å²	131.4	64%	0.643	80%	0.802	S	S	*	*			cis	-133.2	137.5	-48.8	32.9	-12.8	0	0	0	117.7
13	L	28.6	Very low	33.9	Very low	179 Å²	179	127 Å²	127	94%	0.937	80%	0.795	S	S	*	*			trans	58.2	-176.8	143.6	-61.7	172.4	0	0	0	121.3
14	C	27	Very low	33.9	Very low	124 Å²	124	130.3 Å²	130.3	84%	0.838	81%	0.805	S	S	*	*			trans	-124.9	165.9	-155.8	-52.3	0	0	0	0	116.9
15	S	30.9	Very low	33.5	Very low	118 Å²	118	130.9 Å²	130.9	83%	0.825	80%	0.803	S	S	*	*			trans	106.4	151.4	143.6	-152.2	0	0	0	0	121.2
16	G	28.3	Very low	33.3	Very low	64 Å²	64	132.6 Å²	132.6	66%	0.66	80%	0.803	S	S	*	*			trans	106.1	125.9	176.9	0	0	0	0	0	114.5
17	H	31.4	Very low	33.2	Very low	172 Å²	172	135 Å²	135	80%	0.796	81%	0.807	S	S	*	*			cis	100.5	129.1	23.2	-71.3	-57.3	0	0	0	115.8
18	T	31.8	Very low	33	Very low	134 Å²	134	136.6 Å²	136.6	82%	0.822	80%	0.802	S	S	*	*			trans	150.4	152.9	132.9	47.6	0	0	0	0	117.6
19	C	32.3	Very low	33.6	Very low	134 Å²	134	134.1 Å²	134.1	91%	0.905	80%	0.8	S	S	*	*			trans	66.4	150.7	163.6	-65.5	0	0	0	0	121.6
20	G	29.5	Very low	34.5	Very low	69 Å²	69	134.5 Å²	134.5	71%	0.711	80%	0.797	S	S	*	*			cis	159.8	151.4	-14.6	0	0	0	0	0	117.1
21	L	36.3	Very low	34.9	Very low	187 Å²	187	133.1 Å²	133.1	98%	0.979	79%	0.79	S	S	*	*			trans	88.7	160.5	165.4	-50.8	177.2	0	0	0	121
22	A	32	Very low	34.3	Very low	95 Å²	95	136.2 Å²	136.2	79%	0.785	80%	0.795	S	S	*	*			trans	-162.8	-164.9	-167.1	0	0	0	0	0	112.2
23	P	45.1	Very low	33.8	Very low	118 Å²	118	135 Å²	135	77%	0.766	80%	0.8	S	S	*	*			cis	-122.8	175	-41.4	40.7	-26.6	0	0	0	114
24	P	37.8	Very low	34.9	Very low	131 Å²	131	132.5 Å²	132.5	85%	0.851	80%	0.795	S	S	*	*				-152.9	-171	117.5	40.8	-22.7	0	0	0	115.4
25	E	32.2	Very low	35.3	Very low	190 Å²	190	134.4 Å²	134.4	89%	0.888	80%	0.796	S	S	*	*			trans	-102.8	164.8	-179	-62.7	-167.7	136.2	0	0	115.5
26	D	31	Very low	35.5	Very low	156 Å²	156	132.4 Å²	132.4	83%	0.834	79%	0.787	S	S	*	*			trans	50.4	103.6	167.7	-84.8	-8.1	0	0	0	120.9
27	C	32.7	Very low	36	Very low	117 Å²	117	141 Å²	141	79%	0.791	80%	0.8	S	S	*	*				169.7	107.4	118.6	-93.5	0	0	0	0	113.8
28	E	26.6	Very low	37.4	Very low	154 Å²	154	138.2 Å²	138.2	72%	0.72	80%	0.797	S	S	*	*	S	Bend	trans	33.6	154.9	152.6	-87.1	-59.9	159.2	0	0	125	L30	E28-L30 WeakPolarHBondContact O-CD1 3.14Å; E28-L30 VanDerWaalsContact O-CG 3.29Å; E28-L30 WeakPolarHBondContact O-CG 3.4Å
29	H	44.3	Very low	38	Very low	178 Å²	178	137.1 Å²	137.1	82%	0.824	79%	0.792	S	S	*	*	S	Bend	trans	77.2	4.5	-175.3	-39.9	82.5	0	0	0	116.4
30	L	46.4	Very low	37.9	Very low	119 Å²	119	140.8 Å²	140.8	62%	0.623	79%	0.789	S	S	*	*			trans	-146.7	153.5	-152.9	-52.5	170.2	0	0	0	109.9	E28	E28-L30 WeakPolarHBondContact O-CD1 3.14Å; E28-L30 VanDerWaalsContact O-CG 3.29Å; E28-L30 WeakPolarHBondContact O-CG 3.4Å
31	H	35.3	Very low	38.3	Very low	150 Å²	150	144.7 Å²	144.7	69%	0.694	79%	0.793	S	S	*	*			cis	-161.9	-172.7	-9	-117.9	-31.3	0	0	0	111.3
32	H	36.9	Very low	38	Very low	173 Å²	173	143.9 Å²	143.9	80%	0.801	79%	0.788	S	S	*	*			trans	-56.6	167.5	-178.7	-46	-82.2	0	0	0	117.9
33	G	33.4	Very low	37.9	Very low	73 Å²	73	144.1 Å²	144.1	75%	0.753	78%	0.784	S	S	*	*			trans	159.1	140.1	145.8	0	0	0	0	0	117.9
34	P	52	Low	37.9	Very low	127 Å²	127	144 Å²	144	83%	0.825	78%	0.784	S	S	*	*			trans	-129	151.4	-179.8	41	-27.5	0	0	0	118.4
35	D	36.2	Very low	37.5	Very low	163 Å²	163	142 Å²	142	87%	0.872	78%	0.777	S	S	*	*			trans	63.4	155	144	-144.4	-0.9	0	0	0	124
36	A	34.3	Very low	37.2	Very low	77 Å²	77	139.8 Å²	139.8	64%	0.636	77%	0.772	S	S	*	*			trans	93	86	149.8	0	0	0	0	0	124.9
37	R	38.2	Very low	37.1	Very low	243 Å²	243	137.2 Å²	137.2	92%	0.917	77%	0.766	S	S	*	*				85.7	163.2	119.5	-77.3	-176.2	179.3	177.8	2	123.5
38	P	61.7	Low	37	Very low	115 Å²	115	137.5 Å²	137.5	75%	0.747	77%	0.768	S	S	*	*			trans	-113	-172.1	-154.2	45.2	-37	0	0	0	115.7
39	P	44.7	Very low	37.9	Very low	111 Å²	111	136.1 Å²	136.1	72%	0.721	77%	0.772	S	S	*	*				-157.8	160	99.5	39.9	-20	0	0	0	120.6
40	Y	29.4	Very low	37.3	Very low	211 Å²	211	131.6 Å²	131.6	83%	0.827	77%	0.774	S	S	*	*			trans	34.8	132.7	146.1	-66.8	-61	0	0	0	128
41	L	37.6	Very low	36.4	Very low	151 Å²	151	130 Å²	130	79%	0.791	79%	0.786	S	S	*	*			trans	66	128.9	133.5	-71.1	170.5	0	0	0	123.4
42	L	30.5	Very low	36.2	Very low	169 Å²	169	134 Å²	134	89%	0.885	80%	0.795	S	S	*	*				-165.2	168.2	124.8	-106.8	166.6	0	0	0	112.4
43	S	28.7	Very low	36	Very low	100 Å²	100	133.5 Å²	133.5	70%	0.699	79%	0.793	S	S	*	*			trans	-139.7	178.5	176	-62.1	0	0	0	0	107.6
44	P	45.6	Very low	35.9	Very low	117 Å²	117	140.3 Å²	140.3	76%	0.76	80%	0.796	S	S	*	*			cis	-136.8	-166.6	8.8	43.8	-24.8	0	0	0	114.8
45	A	29.5	Very low	34.7	Very low	87 Å²	87	139.7 Å²	139.7	72%	0.719	79%	0.794	S	S	*	*			trans	40.1	142.3	151.6	0	0	0	0	0	120.7
46	D	26.1	Very low	34.6	Very low	144 Å²	144	136.9 Å²	136.9	77%	0.77	79%	0.787	S	S	*	*				-169.8	172.6	54	-148.3	-51.3	0	0	0	113.1
47	S	28.5	Very low	35.3	Very low	103 Å²	103	138.7 Å²	138.7	72%	0.72	79%	0.792	S	S	*	*			trans	66.6	116.2	148.2	-69.2	0	0	0	0	122.9
48	C	31.5	Very low	35.4	Very low	122 Å²	122	138.5 Å²	138.5	82%	0.824	79%	0.791	S	S	*	*			trans	-86.9	176.7	147	-73.1	0	0	0	0	109.4
49	P	45.6	Very low	33.8	Very low	125 Å²	125	137.9 Å²	137.9	81%	0.812	79%	0.79	S	S	*	*			cis	-152.2	168.8	24.5	43.4	-22.2	0	0	0	120.4
50	G	30.7	Very low	33.4	Very low	84 Å²	84	137.5 Å²	137.5	87%	0.866	79%	0.79	S	S	*	*			trans	84.5	138.6	135.1	0	0	0	0	0	121.7
51	G	28.1	Very low	33.8	Very low	85 Å²	85	133.2 Å²	133.2	88%	0.876	79%	0.785	S	S	*	*			trans	164.6	114	167.3	0	0	0	0	0	115.5
52	R	31.3	Very low	33.4	Very low	233 Å²	233	134 Å²	134	88%	0.879	79%	0.785	S	S	*	*			trans	-88.7	157	-173.8	-50.5	162.4	91.8	-149.2	11.9	113
53	H	33	Very low	33.5	Very low	164 Å²	164	129.7 Å²	129.7	76%	0.759	77%	0.769	S	S	*	*				-176.3	132.3	128	-99.1	-54.4	0	0	0	116.4
54	R	30.7	Very low	33.5	Very low	215 Å²	215	132.6 Å²	132.6	81%	0.811	77%	0.771	S	S	*	*			trans	53.7	150.8	145.3	-65.1	-179.7	-170.8	-96	6.5	120
55	C	27.6	Very low	32.6	Very low	115 Å²	115	132.2 Å²	132.2	78%	0.777	77%	0.77	S	S	*	*			cis	-157.2	177.3	-3.5	-116.7	0	0	0	0	111.2
56	S	32.4	Very low	32.8	Very low	104 Å²	104	134.7 Å²	134.7	73%	0.727	78%	0.776	S	S	*	*			trans	-152.7	156.9	-179.3	171.2	0	0	0	0	113.1
57	P	50.3	Low	33	Very low	115 Å²	115	136.3 Å²	136.3	75%	0.747	78%	0.781	S	S	*	*			trans	-130.1	144.8	131	33.6	-21	0	0	0	112
58	R	40	Very low	33.2	Very low	238 Å²	238	138.9 Å²	138.9	90%	0.898	78%	0.784	S	S	*	*				65	139.1	65.4	-72.2	-171.5	166.4	-158.4	-5.4	113.7
59	S	28.5	Very low	33.9	Very low	102 Å²	102	138.9 Å²	138.9	71%	0.713	78%	0.782	S	S	*	*			cis	-125.4	145.1	28.6	43.7	0	0	0	0	113.7
60	S	36.2	Very low	33.5	Very low	103 Å²	103	139 Å²	139	72%	0.72	78%	0.781	S	S	*	*				70.8	144.7	57.8	84	0	0	0	0	114.3
61	V	36.5	Very low	33.7	Very low	122 Å²	122	141.8 Å²	141.8	74%	0.739	78%	0.78	S	S	*	*			cis	-137.7	-179.9	25.3	-58.8	0	0	0	0	111.5
62	H	29.6	Very low	34.1	Very low	167 Å²	167	145.6 Å²	145.6	77%	0.773	78%	0.78	S	S	*	*			cis	-141.7	-84.9	0.1	-158.1	-89.9	0	0	0	113.7
63	S	32	Very low	34	Very low	79 Å²	79	137.4 Å²	137.4	55%	0.552	77%	0.768	S	S	*	*			trans	-163.8	-165.3	-168.6	58.6	0	0	0	0	109.1
64	E	29	Very low	33.9	Very low	160 Å²	160	137 Å²	137	75%	0.748	77%	0.771	S	S	*	*			cis	-157.2	145.7	8.3	-136.7	141.7	-86.7	0	0	106
65	C	27.5	Very low	34.1	Very low	109 Å²	109	134.7 Å²	134.7	74%	0.736	77%	0.769	S	S	*	*			cis	94.7	107.1	27.6	-165.5	0	0	0	0	115.4
66	V	32.8	Very low	34.3	Very low	140 Å²	140	135.5 Å²	135.5	85%	0.848	77%	0.77	S	S	*	*			trans	-163.5	131.8	138.6	-100.3	0	0	0	0	113.3
67	M	30.2	Very low	34.3	Very low	178 Å²	178	136.3 Å²	136.3	88%	0.877	78%	0.776	S	S	*	*			trans	57.4	123.4	141.2	-136.1	65.4	179	0	0	123.3
68	M	34.8	Very low	33.4	Very low	157 Å²	157	136.8 Å²	136.8	77%	0.773	78%	0.782	S	S	*	*			trans	-102.1	160.8	153.8	-86.1	-77.9	-159.3	0	0	109.9
69	P	45.5	Very low	33.1	Very low	122 Å²	122	131.3 Å²	131.3	79%	0.792	78%	0.78	S	S	*	*				-138.2	153.2	122.7	37.6	-27.7	0	0	0	114.4
70	V	37.6	Very low	33.5	Very low	128 Å²	128	131.5 Å²	131.5	78%	0.776	78%	0.777	S	S	*	*			trans	-104.8	140.5	170.5	171.1	0	0	0	0	109.5
71	V	34.3	Very low	33.4	Very low	141 Å²	141	135.7 Å²	135.7	86%	0.855	78%	0.782	S	S	*	*			trans	-133.9	150.1	163.8	-176.4	0	0	0	0	109.2
72	L	36.7	Very low	33.3	Very low	166 Å²	166	136.1 Å²	136.1	87%	0.869	79%	0.788	S	S	*	*			trans	-89	156.7	-166.5	-163.9	69.3	0	0	0	113
73	G	29.7	Very low	33.4	Very low	61 Å²	61	139.3 Å²	139.3	63%	0.629	79%	0.793	S	S	*	*			trans	-171.6	19.8	-175.8	0	0	0	0	0	122.2
74	D	29.6	Very low	33.5	Very low	155 Å²	155	143.8 Å²	143.8	83%	0.829	81%	0.807	S	S	*	*			trans	57.8	175.8	161.1	-79.8	-36.2	0	0	0	122
75	H	34.7	Very low	33.5	Very low	167 Å²	167	144.6 Å²	144.6	77%	0.773	81%	0.811	S	S	*	*			trans	72.7	82.4	164.4	81.8	-65.8	0	0	0	122.5
76	V	33.3	Very low	33.5	Very low	132 Å²	132	150.3 Å²	150.3	80%	0.8	82%	0.819	S	S	*	*			trans	20	122.9	135.7	-67	0	0	0	0	121.2
77	S	32.2	Very low	33.1	Very low	121 Å²	121	149.2 Å²	149.2	85%	0.846	82%	0.817	S	S	*	*				168.8	145.8	112	-74.8	0	0	0	0	113.4
78	S	31.8	Very low	33	Very low	125 Å²	125	145.4 Å²	145.4	87%	0.874	81%	0.808	S	S	*	*			trans	-84.9	145.2	173.2	-54.4	0	0	0	0	112.6
79	S	32.9	Very low	32.8	Very low	122 Å²	122	146.7 Å²	146.7	85%	0.853	81%	0.812	S	S	*	*			trans	-163.1	173	137.3	-158.5	0	0	0	0	111.3
80	T	35.8	Very low	32	Very low	106 Å²	106	150.8 Å²	150.8	65%	0.65	81%	0.813	S	S	*	*			trans	-131.4	152.6	-166.1	-41.6	0	0	0	0	112.4
81	F	34	Very low	31.7	Very low	191 Å²	191	150 Å²	150	84%	0.838	81%	0.805	S	S	*	*			trans	74	127	174	-57.6	-74.6	0	0	0	118.1
82	P	36.2	Very low	31.4	Very low	132 Å²	132	146.6 Å²	146.6	86%	0.857	78%	0.784	S	S	*	*			trans	-85	142.6	160.2	34.6	-30.9	0	0	0	110.7
83	R	31.7	Very low	31.1	Very low	233 Å²	233	141.6 Å²	141.6	88%	0.879	76%	0.762	S	S	*	*			trans	-125.8	134.9	163.3	-166.7	171.5	-176	120.5	-1.3	109.5
84	M	34.1	Very low	31.2	Very low	173 Å²	173	143.2 Å²	143.2	85%	0.852	76%	0.756	S	S	*	*			trans	-70.5	138.6	-176.6	-57.1	-166.8	-58.7	0	0	111.4
85	H	28.2	Very low	31.2	Very low	177 Å²	177	142.7 Å²	142.7	82%	0.819	75%	0.753	S	S	*	*			trans	-115.1	113.4	162.1	-80.9	-86.5	0	0	0	109.6
86	Y	27	Very low	31	Very low	230 Å²	230	140 Å²	140	90%	0.902	75%	0.753	S	S	*	*			trans	-61.7	143.6	158.7	-115.8	-107.8	0	0	0	108.6
87	S	25.9	Very low	30.8	Very low	117 Å²	117	138.7 Å²	138.7	82%	0.818	76%	0.755	S	S	*	*			trans	-136.9	131.7	175.7	-172.4	0	0	0	0	110.8
88	S	27.7	Very low	30.6	Very low	98 Å²	98	139.8 Å²	139.8	69%	0.685	76%	0.756	S	S	*	*			trans	-139.7	132	167.4	56.1	0	0	0	0	108.7
89	H	29.3	Very low	30.4	Very low	183 Å²	183	137 Å²	137	85%	0.847	74%	0.741	S	S	*	*				-177.4	167.3	117.8	-108.6	-88.9	0	0	0	111.7
90	Y	28.5	Very low	30.2	Very low	208 Å²	208	139.9 Å²	139.9	82%	0.816	74%	0.741	S	S	*	*			trans	-76.4	143.2	-175.3	-102.8	-118.3	0	0	0	114.1
91	D	31.7	Very low	29.9	Very low	113 Å²	113	139.2 Å²	139.2	60%	0.604	75%	0.746	S	S	*	*				38.6	135.5	120.3	-161.4	1.4	0	0	0	119.9
92	T	28.4	Very low	29.6	Very low	69 Å²	69	134 Å²	134	42%	0.423	75%	0.745	S	S	.	*			trans	-172.1	157.3	130.2	19.9	0	0	0	0	113.6	P321	T92-P321 VanDerWaalsContact CG2-CA 3.49Å; T92-P321 HydrophobicContact CG2-CB 3.36Å
93	C	31.1	Very low	29.4	Very low	60 Å²	60	131.4 Å²	131.4	41%	0.405	74%	0.736	S	S	.	*			trans	-105.5	-165.7	-171.9	-124.3	0	0	0	0	112.7	K320 P321	C93-K320 HydrophobicContact CB-CB 4.16Å; C93-K320 HydrophobicContact CB-CD 3.38Å; C93-K320 HydrophobicContact CB-CG 4.21Å; C93-P321 VanDerWaalsContact C-CG 3.47Å; C93-P321 HydrophobicContact CB-CB 4.25Å; C93-P321 HydrophobicContact CB-CG 4.08Å; C93-P321 VanDerWaalsContact N-CB 3.31Å; C93-P321 WeakPolarHBondContact O-CB 3.38Å; C93-P321 VanDerWaalsContact O-CG 3.24Å; C93-P321 WeakPolarHBondContact O-CG 3.32Å
94	D	32.1	Very low	29.5	Very low	95 Å²	95	129.3 Å²	129.3	51%	0.508	73%	0.733	S	S	.	*			cis	-155.7	-165.3	17.8	-139.9	-48	0	0	0	112.9	K320 P321	D94-K320 VanDerWaalsContact CG-NZ 3.29Å; D94-K320 IonicContact OD1-NZ 3.22Å; D94-K320 PolarHBondContact OD1-NZ 3.01Å; D94-K320 VanDerWaalsContact OD2-CD 3.23Å; D94-K320 WeakPolarHBondContact OD2-CD 3.31Å; D94-K320 WeakPolarHBondContact OD2-CE 3.42Å; D94-K320 IonicContact OD2-NZ 2.67Å; D94-K320 PolarHBondContact OD2-NZ 2.88Å; D94-P321 HydrophobicContact CB-CG 4.1Å
95	D	29.6	Very low	29.5	Very low	144 Å²	144	128.2 Å²	128.2	77%	0.77	73%	0.729	S	S	*	*			trans	106.8	159.1	156.3	-125.7	-44.2	0	0	0	119.5
96	C	30.2	Very low	29.8	Very low	112 Å²	112	125.6 Å²	125.6	76%	0.757	72%	0.721	S	S	*	*			trans	-101.5	158	-134.3	-61.4	0	0	0	0	117.7
97	A	29.1	Very low	30.3	Very low	104 Å²	104	125.4 Å²	125.4	86%	0.86	72%	0.719	S	S	*	*			trans	-161.2	166	142.7	0	0	0	0	0	112.1
98	V	28.3	Very low	30.8	Very low	143 Å²	143	126.6 Å²	126.6	87%	0.867	71%	0.714	S	S	*	*			trans	-134.4	159.4	-167.1	168.6	0	0	0	0	112.4
99	A	26.3	Very low	31.3	Very low	66 Å²	66	128.1 Å²	128.1	55%	0.545	72%	0.722	S	S	.	*			trans	88.7	127.5	154.1	0	0	0	0	0	122.7
100	H	28.9	Very low	31.8	Very low	184 Å²	184	123.5 Å²	123.5	85%	0.852	72%	0.716	S	S	*	*			trans	62.6	164.4	139.3	-56.1	-39	0	0	0	120.9
101	A	29.4	Very low	32.5	Very low	91 Å²	91	121.5 Å²	121.5	75%	0.752	72%	0.719	S	S	*	*			cis	-169.1	134.5	-41.2	0	0	0	0	0	111.4
102	G	27.6	Very low	33.1	Very low	81 Å²	81	123.8 Å²	123.8	84%	0.835	73%	0.73	S	S	*	*			trans	80.9	174.2	162	0	0	0	0	0	117.8
103	A	32.9	Very low	33.7	Very low	79 Å²	79	127.6 Å²	127.6	65%	0.653	75%	0.747	S	S	*	*			cis	-167.2	137.6	-13.4	0	0	0	0	0	114.5
104	K	33.1	Very low	34.3	Very low	189 Å²	189	132 Å²	132	82%	0.822	77%	0.767	S	S	*	*			trans	69.9	160.2	152.9	-61.9	158	-170.8	173.1	0	114.3
105	I	33.6	Very low	34.7	Very low	150 Å²	150	136 Å²	136	77%	0.769	78%	0.782	S	S	*	*			cis	-148.9	131.4	44.5	-62.6	139	0	0	0	111.8
106	N	36.2	Very low	35.1	Very low	121 Å²	121	138.1 Å²	138.1	65%	0.647	79%	0.785	S	S	*	*				16.1	154	129.8	-51.6	-59.7	0	0	0	120.9
107	R	36.5	Very low	35.7	Very low	226 Å²	226	140.4 Å²	140.4	85%	0.853	79%	0.785	S	S	*	*			cis	-162.3	159.8	9.9	-129.3	165.8	-172.1	169.7	-0.8	113.3
108	I	36.8	Very low	36	Very low	142 Å²	142	144.9 Å²	144.9	73%	0.728	79%	0.785	S	S	*	*			trans	-50.9	163.2	176.6	-0.1	174	0	0	0	116.8	A110	I108-A110 HydrophobicContact CG2-CB 4.41Å
109	P	37.7	Very low	36.1	Very low	131 Å²	131	146.3 Å²	146.3	85%	0.851	78%	0.782	S	S	*	*				-126.9	160.6	86.3	39.4	-33.4	0	0	0	114.9
110	A	41	Very low	36.4	Very low	86 Å²	86	151.4 Å²	151.4	71%	0.711	80%	0.799	S	S	*	*			trans	-107.7	130.8	-174.4	0	0	0	0	0	112.5	I108	I108-A110 HydrophobicContact CG2-CB 4.41Å
111	N	43.1	Very low	36.5	Very low	165 Å²	165	148.4 Å²	148.4	88%	0.882	80%	0.796	S	S	*	*	S	Bend	trans	-166.7	16.7	159.2	-120.7	8	0	0	0	115.7
112	L	42.9	Very low	36.8	Very low	162 Å²	162	151.9 Å²	151.9	85%	0.848	80%	0.801	S	S	*	*	S	Bend	trans	-133.6	9.1	-173.6	-72.9	177.3	0	0	0	115.6
113	L	42	Very low	36.9	Very low	149 Å²	149	155.8 Å²	155.8	78%	0.78	80%	0.797	S	S	*	*	S	Bend	trans	-100.5	-16.6	-176.1	-134.5	72.9	0	0	0	115	Q115	L113-Q115 PolarHBondContact O-N 2.67Å
114	D	42.4	Very low	36.8	Very low	152 Å²	152	160.7 Å²	160.7	81%	0.813	80%	0.799	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-9.5	-175.2	-165.4	50	0	0	0	114
115	Q	41.2	Very low	36.7	Very low	178 Å²	178	158.3 Å²	158.3	83%	0.832	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	-5.1	-175.9	-149.3	171.8	18.4	0	0	114.6	L113	L113-Q115 PolarHBondContact O-N 2.67Å
116	F	38.4	Very low	36.8	Very low	190 Å²	190	154.1 Å²	154.1	83%	0.833	79%	0.789	S	S	*	*	S	Bend	trans	-117.5	-1.4	176	-78.5	-83.9	0	0	0	114.1	K118	F116-K118 PolarHBondContact O-N 3.13Å
117	E	42.2	Very low	36.9	Very low	160 Å²	160	158.1 Å²	158.1	75%	0.748	80%	0.801	S	S	*	*			trans	-79.8	44.9	-179.7	-155.9	168.1	179.2	0	0	113.6
118	K	34.9	Very low	36.7	Very low	197 Å²	197	156.6 Å²	156.6	86%	0.857	80%	0.803	S	S	*	*	S	Bend	trans	-111.1	72.8	162.4	-84.3	-170.2	173.9	179.8	0	111.9	F116	F116-K118 PolarHBondContact O-N 3.13Å
119	Q	31.9	Very low	36.9	Very low	173 Å²	173	155.3 Å²	155.3	81%	0.808	80%	0.802	S	S	*	*	S	Bend	trans	69.3	70.5	147.1	-60.3	-176.8	-21.3	0	0	117.6
120	L	32.5	Very low	36.6	Very low	173 Å²	173	157.2 Å²	157.2	91%	0.906	81%	0.805	S	S	*	*			trans	-118.5	99.2	140.3	-85.8	173	0	0	0	109.9
121	P	31.3	Very low	36.2	Very low	121 Å²	121	161 Å²	161	79%	0.786	81%	0.807	S	S	*	*			trans	-83.6	129	171.7	-11.2	29.3	0	0	0	111.6
122	L	34.4	Very low	35.5	Very low	165 Å²	165	164.2 Å²	164.2	86%	0.864	81%	0.809	S	S	*	*			trans	-131.8	92.9	176.9	-113.7	174.3	0	0	0	110.8
123	H	30.1	Very low	34.8	Very low	162 Å²	162	165.4 Å²	165.4	75%	0.75	81%	0.81	S	S	*	*			trans	-176	146.1	170.3	-114.4	-149.3	0	0	0	108.7
124	R	30.3	Very low	34.3	Very low	183 Å²	183	169.2 Å²	169.2	69%	0.691	81%	0.814	S	S	*	*			cis	-160.7	179	-8.4	-144	-174.8	-162.7	-115.2	2.6	111
125	D	30.5	Very low	33.7	Very low	138 Å²	138	167.5 Å²	167.5	74%	0.738	81%	0.809	S	S	*	*			trans	73.4	147.7	166.9	-55.8	-19.9	0	0	0	115.6
126	G	37.3	Very low	33.1	Very low	63 Å²	63	163.8 Å²	163.8	65%	0.649	80%	0.803	S	S	*	*			trans	-131.7	160.1	-152	0	0	0	0	0	115.2
127	F	37.3	Very low	32.8	Very low	204 Å²	204	159.3 Å²	159.3	90%	0.895	80%	0.801	S	S	*	*			trans	56.1	112.2	177.8	-62	-83.6	0	0	0	116.1
128	H	33.2	Very low	32.2	Very low	194 Å²	194	156.3 Å²	156.3	90%	0.898	80%	0.804	S	S	*	*				-159	157.8	116.2	-103.2	77.3	0	0	0	109.4
129	T	40.5	Very low	31.9	Very low	116 Å²	116	151.4 Å²	151.4	71%	0.712	80%	0.8	S	S	*	*			trans	-81.3	127	-174.1	50.1	0	0	0	0	113.2
130	L	31.5	Very low	32	Very low	171 Å²	171	152.2 Å²	152.2	90%	0.895	80%	0.803	S	S	*	*			trans	-107.2	109.4	147.2	-60.7	175.2	0	0	0	104.6
131	Q	32.1	Very low	32.2	Very low	165 Å²	165	151.1 Å²	151.1	77%	0.771	79%	0.794	S	S	*	*			cis	55.4	95.8	40.3	-154.1	176.4	36.6	0	0	111.3
132	Y	29.8	Very low	33	Very low	233 Å²	233	156.5 Å²	156.5	91%	0.914	80%	0.798	S	S	*	*			trans	-60.4	132.8	-174.4	-75.4	-95	0	0	0	112.7	R134	Y132-R134 PolarHBondContact O-N 3.2Å
133	Q	27.6	Very low	33.1	Very low	187 Å²	187	152.7 Å²	152.7	87%	0.874	79%	0.786	S	S	*	*			trans	-63.6	122.2	172.5	-172.4	172.2	7.9	0	0	110.1
134	R	31.4	Very low	34	Very low	229 Å²	229	151.5 Å²	151.5	86%	0.864	78%	0.78	S	S	*	*			trans	-113.6	102.3	-180	-170.4	-170.9	-65.4	-148.9	1.5	111.1	Y132	Y132-R134 PolarHBondContact O-N 3.2Å
135	T	28.7	Very low	35	Very low	115 Å²	115	146 Å²	146	71%	0.706	77%	0.77	S	S	*	*			trans	-117.8	78.2	161.9	50.1	0	0	0	0	108.3
136	S	29	Very low	36.6	Very low	101 Å²	101	143.6 Å²	143.6	71%	0.706	76%	0.762	S	S	*	*				71.5	45.9	87.4	78	0	0	0	0	114.8
137	A	31.7	Very low	38.1	Very low	95 Å²	95	141.3 Å²	141.3	79%	0.785	74%	0.738	S	S	*	*	S	Bend	trans	-70.6	160.1	140.7	0	0	0	0	0	109.6
138	A	29.8	Very low	39.7	Very low	98 Å²	98	140.5 Å²	140.5	81%	0.81	73%	0.729	S	S	*	*			trans	-32.6	126.2	-167.4	0	0	0	0	0	117.2	E140	A138-E140 PolarHBondContact O-N 2.91Å
139	A	29.9	Very low	41.7	Very low	93 Å²	93	134.9 Å²	134.9	77%	0.769	71%	0.705	S	S	*	*			trans	-88.5	94.9	162.6	0	0	0	0	0	109.9	Q141	A139-Q141 PolarHBondContact O-N 3.24Å
140	E	34.3	Very low	43.6	Very low	190 Å²	190	137.6 Å²	137.6	89%	0.888	70%	0.702	S	S	*	*			trans	-72.2	86.2	156	-78.7	-153.4	121.9	0	0	108.8	A138	A138-E140 PolarHBondContact O-N 2.91Å
141	Q	35.4	Very low	45.9	Very low	150 Å²	150	136 Å²	136	70%	0.701	69%	0.69	S	S	*	*			trans	-55.3	138.7	161.9	-90	-72.1	-4.1	0	0	109.8	A139 S143	A139-Q141 PolarHBondContact O-N 3.24Å; Q141-S143 WeakPolarHBondContact O-CB 3.2Å; Q141-S143 PolarHBondContact O-N 3.43Å; Q141-S143 PolarHBondContact O-OG 3.01Å
142	R	48.2	Very low	48.6	Very low	234 Å²	234	133.4 Å²	133.4	88%	0.883	68%	0.681	S	S	*	*			trans	-52.6	100.2	170.4	-84.5	177.1	155.4	83.4	-1.6	108.9
143	S	37.2	Very low	51.2	Low	86 Å²	86	126 Å²	126	60%	0.601	66%	0.659	S	S	*	*			trans	-132.2	47.6	-173.3	51.1	0	0	0	0	110.4	Q141 S145	Q141-S143 WeakPolarHBondContact O-CB 3.2Å; Q141-S143 PolarHBondContact O-N 3.43Å; Q141-S143 PolarHBondContact O-OG 3.01Å; S143-S145 PolarHBondContact O-N 2.9Å
144	E	48.8	Very low	53.7	Low	137 Å²	137	122.1 Å²	122.1	64%	0.64	64%	0.641	S	S	*	*			trans	-69.1	73.2	162.2	-169.9	161.6	-137.4	0	0	109.5	I149	E144-I149 HydrophobicContact CG-CD1 4.03Å; E144-I149 HydrophobicContact CG-CG1 3.81Å
145	S	51.9	Low	56.2	Low	67 Å²	67	114.1 Å²	114.1	47%	0.469	62%	0.621	S	S	.	*			trans	-54.9	140.2	-177.7	170	0	0	0	0	110	S143 G147 R148 I149	S143-S145 PolarHBondContact O-N 2.9Å; S145-G147 CarbonylContact O-C 3.56Å; S145-G147 PolarHBondContact O-N 3.18Å; S145-G147 PolarHBondContact OG-N 3.31Å; S145-R148 WeakPolarHBondContact O-CB 3.35Å; S145-R148 PolarHBondContact O-N 3.48Å; S145-I149 PolarHBondContact O-N 3.04Å
146	P	62.9	Low	58.8	Low	88 Å²	88	111.7 Å²	111.7	57%	0.571	61%	0.606	S	S	*	*	H	α-helix	trans	-53.8	-17.3	171.7	-28.3	35.9	0	0	0	113.9	R150	P146-R150 WeakPolarHBondContact O-CB 3.44Å; P146-R150 VanDerWaalsContact O-CG 3.25Å; P146-R150 WeakPolarHBondContact O-CG 3.44Å; P146-R150 PolarHBondContact O-N 2.61Å; P146-R150 PolarHBondContact O-NE 3.09Å
147	G	68.3	Low	61.2	Low	15 Å²	15	112.6 Å²	112.6	16%	0.155	60%	0.599	C	S	.	*	H	α-helix	trans	-62.7	-49.9	165.2	0	0	0	0	0	113.4	S145 I149 R150 H151	S145-G147 CarbonylContact O-C 3.56Å; S145-G147 PolarHBondContact O-N 3.18Å; S145-G147 PolarHBondContact OG-N 3.31Å; G147-I149 PolarHBondContact O-N 2.61Å; G147-R150 PolarHBondContact O-N 3.13Å; G147-H151 PolarHBondContact O-CD2 3.23Å; G147-H151 PolarHBondContact O-N 2.95Å
148	R	71.1	Confident	63.1	Low	186 Å²	186	114.3 Å²	114.3	70%	0.702	59%	0.588	S	S	*	*	H	α-helix	trans	-62.6	-45	-176.7	-144.5	178.6	-163.5	177.2	4.8	111.3	S145 R150 H151 L152	S145-R148 WeakPolarHBondContact O-CB 3.35Å; S145-R148 PolarHBondContact O-N 3.48Å; R148-R150 PolarHBondContact O-N 3.06Å; R148-H151 PolarHBondContact O-N 3Å; R148-L152 PolarHBondContact O-N 3.02Å
149	I	75.1	Confident	65	Low	76 Å²	76	115.5 Å²	115.5	39%	0.39	58%	0.58	S	S	.	*	H	α-helix	trans	-60.7	-45.6	174.4	-58.4	174.5	0	0	0	110.9	E144 S145 G147 H151 L152 V153	E144-I149 HydrophobicContact CG-CD1 4.03Å; E144-I149 HydrophobicContact CG-CG1 3.81Å; S145-I149 PolarHBondContact O-N 3.04Å; G147-I149 PolarHBondContact O-N 2.61Å; I149-H151 VanDerWaalsContact C-N 3.33Å; I149-H151 PolarHBondContact O-N 2.99Å; I149-L152 PolarHBondContact O-N 3.15Å; I149-V153 HydrophobicContact CG2-CG2 4.36Å; I149-V153 WeakPolarHBondContact O-CG2 3.2Å; I149-V153 PolarHBondContact O-N 3.01Å
150	R	81.8	Confident	66.7	Low	173 Å²	173	117.4 Å²	117.4	65%	0.653	57%	0.572	S	S	*	*	H	α-helix	trans	-62.3	-37.7	176.1	-77.7	178.2	-67.5	176.2	1	112.6	P146 G147 R148 H154	P146-R150 WeakPolarHBondContact O-CB 3.44Å; P146-R150 VanDerWaalsContact O-CG 3.25Å; P146-R150 WeakPolarHBondContact O-CG 3.44Å; P146-R150 PolarHBondContact O-N 2.61Å; P146-R150 PolarHBondContact O-NE 3.09Å; G147-R150 PolarHBondContact O-N 3.13Å; R148-R150 PolarHBondContact O-N 3.06Å; R150-H154 VanDerWaalsContact O-CB 3.26Å; R150-H154 WeakPolarHBondContact O-CB 3.31Å; R150-H154 PolarHBondContact O-N 3.1Å
151	H	79.7	Confident	67.7	Low	137 Å²	137	113.6 Å²	113.6	63%	0.634	56%	0.561	S	S	*	*	H	α-helix	trans	-68.6	-36.6	174	-71.7	-59.4	0	0	0	112.7	G147 R148 I149 S155	G147-H151 PolarHBondContact O-CD2 3.23Å; G147-H151 PolarHBondContact O-N 2.95Å; R148-H151 PolarHBondContact O-N 3Å; I149-H151 VanDerWaalsContact C-N 3.33Å; I149-H151 PolarHBondContact O-N 2.99Å; H151-S155 VanDerWaalsContact O-CB 3.3Å; H151-S155 WeakPolarHBondContact O-CB 3.38Å; H151-S155 PolarHBondContact O-N 2.68Å; H151-S155 PolarHBondContact O-OG 3.47Å
152	L	87	Confident	68.2	Low	112 Å²	112	114 Å²	114	59%	0.586	56%	0.561	S	S	*	*	H	α-helix	trans	-64.5	-53.3	174.2	-167	71.5	0	0	0	110.6	R148 I149 H154 S155 V156	R148-L152 PolarHBondContact O-N 3.02Å; I149-L152 PolarHBondContact O-N 3.15Å; L152-H154 VanDerWaalsContact C-N 3.34Å; L152-H154 PolarHBondContact O-N 3.3Å; L152-S155 WeakPolarHBondContact O-CA 3.16Å; L152-S155 WeakPolarHBondContact O-CB 3.25Å; L152-S155 PolarHBondContact O-N 3.41Å; L152-V156 WeakPolarHBondContact O-CG2 3.12Å; L152-V156 PolarHBondContact O-N 2.88Å
153	V	85.2	Confident	68.1	Low	76 Å²	76	106.4 Å²	106.4	46%	0.461	54%	0.544	S	S	.	.	H	α-helix	trans	-57.1	-44.3	177	172.1	0	0	0	0	111.6	I149 S155 V156 Q157	I149-V153 HydrophobicContact CG2-CG2 4.36Å; I149-V153 WeakPolarHBondContact O-CG2 3.2Å; I149-V153 PolarHBondContact O-N 3.01Å; V153-S155 VanDerWaalsContact C-N 3.3Å; V153-S155 PolarHBondContact O-N 2.98Å; V153-V156 PolarHBondContact O-N 3.08Å; V153-Q157 WeakPolarHBondContact O-CB 3.25Å; V153-Q157 WeakPolarHBondContact O-CG 3.4Å; V153-Q157 PolarHBondContact O-N 2.98Å
154	H	79.6	Confident	68.4	Low	106 Å²	106	110.9 Å²	110.9	49%	0.491	55%	0.554	S	S	.	*	H	α-helix	trans	-68.1	-29.4	177.4	-163.3	-23.3	0	0	0	112.3	R150 L152 K158	R150-H154 VanDerWaalsContact O-CB 3.26Å; R150-H154 WeakPolarHBondContact O-CB 3.31Å; R150-H154 PolarHBondContact O-N 3.1Å; L152-H154 VanDerWaalsContact C-N 3.34Å; L152-H154 PolarHBondContact O-N 3.3Å; H154-K158 WeakPolarHBondContact O-CB 3.46Å; H154-K158 WeakPolarHBondContact O-CG 3.49Å; H154-K158 PolarHBondContact O-N 3.5Å
155	S	84.9	Confident	68.3	Low	62 Å²	62	109 Å²	109	43%	0.434	56%	0.556	S	S	.	*	H	α-helix	trans	-74.7	-41.5	175.1	-59.1	0	0	0	0	111.8	H151 L152 V153 K158 L159	H151-S155 VanDerWaalsContact O-CB 3.3Å; H151-S155 WeakPolarHBondContact O-CB 3.38Å; H151-S155 PolarHBondContact O-N 2.68Å; H151-S155 PolarHBondContact O-OG 3.47Å; L152-S155 WeakPolarHBondContact O-CA 3.16Å; L152-S155 WeakPolarHBondContact O-CB 3.25Å; L152-S155 PolarHBondContact O-N 3.41Å; V153-S155 VanDerWaalsContact C-N 3.3Å; V153-S155 PolarHBondContact O-N 2.98Å; S155-K158 WeakPolarHBondContact O-CB 3.06Å; S155-K158 PolarHBondContact O-N 2.89Å; S155-K158 VanDerWaalsContact O-N 3.14Å; S155-L159 PolarHBondContact O-N 3.09Å
156	V	83.8	Confident	68	Low	64 Å²	64	113.1 Å²	113.1	39%	0.388	57%	0.573	S	S	.	*	H	α-helix	trans	-60.5	-46.8	171.7	172.7	0	0	0	0	110.6	L152 V153 K158 L159 F160	L152-V156 WeakPolarHBondContact O-CG2 3.12Å; L152-V156 PolarHBondContact O-N 2.88Å; V153-V156 PolarHBondContact O-N 3.08Å; V156-K158 VanDerWaalsContact C-N 3.28Å; V156-K158 PolarHBondContact O-N 3.04Å; V156-L159 WeakPolarHBondContact O-CB 3.3Å; V156-L159 PolarHBondContact O-N 3.44Å; V156-F160 HydrophobicContact CG1-CD2 3.72Å; V156-F160 HydrophobicContact CG1-CE2 3.74Å; V156-F160 WeakPolarHBondContact O-CD2 3.3Å; V156-F160 PolarHBondContact O-N 2.88Å
157	Q	78.4	Confident	66.8	Low	120 Å²	120	118.7 Å²	118.7	56%	0.561	59%	0.591	S	S	*	*	H	α-helix	trans	-62.1	-32	173.8	-76.6	-177.2	-27	0	0	113.2	V153 L159 T161	V153-Q157 WeakPolarHBondContact O-CB 3.25Å; V153-Q157 WeakPolarHBondContact O-CG 3.4Å; V153-Q157 PolarHBondContact O-N 2.98Å; Q157-L159 VanDerWaalsContact C-N 3.34Å; Q157-T161 WeakPolarHBondContact O-CB 3.09Å; Q157-T161 WeakPolarHBondContact O-CG2 3.37Å; Q157-T161 PolarHBondContact O-N 3.28Å; Q157-T161 PolarHBondContact O-OG1 2.95Å
158	K	72.2	Confident	65.1	Low	130 Å²	130	121.9 Å²	121.9	57%	0.565	62%	0.624	S	S	*	*	H	α-helix	trans	-69.1	-28.1	171.3	-82.4	173.9	178.1	175.6	0	113.2	H154 S155 V156 K162	H154-K158 WeakPolarHBondContact O-CB 3.46Å; H154-K158 WeakPolarHBondContact O-CG 3.49Å; H154-K158 PolarHBondContact O-N 3.5Å; S155-K158 WeakPolarHBondContact O-CB 3.06Å; S155-K158 PolarHBondContact O-N 2.89Å; S155-K158 VanDerWaalsContact O-N 3.14Å; V156-K158 VanDerWaalsContact C-N 3.28Å; V156-K158 PolarHBondContact O-N 3.04Å; K158-K162 WeakPolarHBondContact O-CB 3.29Å; K158-K162 PolarHBondContact O-N 2.98Å
159	L	70.2	Confident	63.1	Low	123 Å²	123	118.2 Å²	118.2	64%	0.644	63%	0.627	S	S	*	*	H	α-helix	trans	-75.1	-50.7	173.7	-70.4	165.2	0	0	0	110.9	S155 V156 Q157 T161 K162 S163	S155-L159 PolarHBondContact O-N 3.09Å; V156-L159 WeakPolarHBondContact O-CB 3.3Å; V156-L159 PolarHBondContact O-N 3.44Å; Q157-L159 VanDerWaalsContact C-N 3.34Å; L159-T161 VanDerWaalsContact C-N 3.29Å; L159-T161 PolarHBondContact O-N 3.4Å; L159-K162 WeakPolarHBondContact O-CA 3.44Å; L159-K162 WeakPolarHBondContact O-CB 3.27Å; L159-K162 PolarHBondContact O-N 3.08Å; L159-S163 PolarHBondContact O-N 3.29Å
160	F	64.5	Low	61	Low	134 Å²	134	120.5 Å²	120.5	59%	0.588	65%	0.649	S	S	*	*	H	α-helix	trans	-63.9	-28.5	177.9	-81.2	-78.6	0	0	0	114	V156 K162 S163	V156-F160 HydrophobicContact CG1-CD2 3.72Å; V156-F160 HydrophobicContact CG1-CE2 3.74Å; V156-F160 WeakPolarHBondContact O-CD2 3.3Å; V156-F160 PolarHBondContact O-N 2.88Å; F160-K162 VanDerWaalsContact C-N 3.3Å; F160-S163 PolarHBondContact O-OG 3.05Å; F160-S163 VanDerWaalsContact O-OG 3.12Å
161	T	54.6	Low	58.8	Low	109 Å²	109	121.7 Å²	121.7	67%	0.669	66%	0.659	S	S	*	*	H	α-helix	trans	-81.5	-5.8	171.5	51.2	0	0	0	0	114.1	Q157 L159	Q157-T161 WeakPolarHBondContact O-CB 3.09Å; Q157-T161 WeakPolarHBondContact O-CG2 3.37Å; Q157-T161 PolarHBondContact O-N 3.28Å; Q157-T161 PolarHBondContact O-OG1 2.95Å; L159-T161 VanDerWaalsContact C-N 3.29Å; L159-T161 PolarHBondContact O-N 3.4Å
162	K	46.9	Very low	56.4	Low	160 Å²	160	120.2 Å²	120.2	70%	0.696	66%	0.664	S	S	*	*	H	α-helix	trans	-100.2	-30.4	176	-158.5	179.8	-176.2	-167.4	0	112.4	K158 L159 F160	K158-K162 WeakPolarHBondContact O-CB 3.29Å; K158-K162 PolarHBondContact O-N 2.98Å; L159-K162 WeakPolarHBondContact O-CA 3.44Å; L159-K162 WeakPolarHBondContact O-CB 3.27Å; L159-K162 PolarHBondContact O-N 3.08Å; F160-K162 VanDerWaalsContact C-N 3.3Å
163	S	45.4	Very low	53.6	Low	74 Å²	74	122.9 Å²	122.9	52%	0.517	68%	0.679	S	S	.	*	H	α-helix	trans	-66.8	-42.7	174.8	52.6	0	0	0	0	112.8	L159 F160 S165	L159-S163 PolarHBondContact O-N 3.29Å; F160-S163 PolarHBondContact O-OG 3.05Å; F160-S163 VanDerWaalsContact O-OG 3.12Å; S163-S165 PolarHBondContact O-N 3.41Å
164	H	45.1	Very low	51.2	Low	179 Å²	179	123.1 Å²	123.1	83%	0.829	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	15.8	176.8	-79.3	-61.1	0	0	0	115.6
165	S	44.8	Very low	48.8	Very low	98 Å²	98	126.1 Å²	126.1	69%	0.685	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.2	8.1	-176.4	-169	0	0	0	0	114.3	S163	S163-S165 PolarHBondContact O-N 3.41Å
166	L	46.1	Very low	46.1	Very low	154 Å²	154	127 Å²	127	81%	0.806	73%	0.728	S	S	*	*	S	Bend	trans	-130.6	15.6	-167.2	-116.2	168.3	0	0	0	116.7
167	E	37.8	Very low	43.7	Very low	204 Å²	204	130 Å²	130	95%	0.953	75%	0.746	S	S	*	*			trans	-121.1	128.5	168.5	-72.7	-174.9	109.9	0	0	111.5
168	G	33	Very low	41.5	Very low	82 Å²	82	133.8 Å²	133.8	85%	0.845	76%	0.761	S	S	*	*			trans	130	71.3	166.6	0	0	0	0	0	117.3
169	S	28.7	Very low	39.5	Very low	110 Å²	110	131.9 Å²	131.9	77%	0.769	77%	0.769	S	S	*	*			trans	-160.3	44.4	154.2	-170.8	0	0	0	0	114.6	K171	S169-K171 PolarHBondContact O-N 3.22Å
170	S	31.2	Very low	37.5	Very low	123 Å²	123	133.8 Å²	133.8	86%	0.86	78%	0.78	S	S	*	*			trans	-80.5	94.3	167.7	41.2	0	0	0	0	110.8	S172	S170-S172 PolarHBondContact O-N 3.37Å
171	K	35.3	Very low	35.9	Very low	198 Å²	198	130.9 Å²	130.9	86%	0.861	79%	0.788	S	S	*	*			trans	-86.7	98.8	174.2	-96.9	-172.9	174	180	0	111.6	S169	S169-K171 PolarHBondContact O-N 3.22Å
172	S	30.7	Very low	34.6	Very low	106 Å²	106	136.8 Å²	136.8	74%	0.741	80%	0.798	S	S	*	*			trans	-61.7	142.6	151.4	174.5	0	0	0	0	109.9	S170	S170-S172 PolarHBondContact O-N 3.37Å
173	N	28.1	Very low	33.8	Very low	168 Å²	168	133.5 Å²	133.5	90%	0.898	80%	0.8	S	S	*	*			trans	-162.3	128	151	-129.4	50	0	0	0	109.4
174	A	33.4	Very low	32.9	Very low	81 Å²	81	137 Å²	137	67%	0.669	81%	0.813	S	S	*	*			trans	-123	157.4	179.4	0	0	0	0	0	111.7
175	N	30	Very low	32	Very low	170 Å²	170	134.7 Å²	134.7	91%	0.909	81%	0.807	S	S	*	*			trans	65.2	126.5	173.4	-67.8	-6.8	0	0	0	118.8
176	G	28.8	Very low	31.2	Very low	80 Å²	80	136.6 Å²	136.6	83%	0.825	81%	0.805	S	S	*	*			trans	-171.6	108.1	165.1	0	0	0	0	0	108.7
177	T	33	Very low	30.5	Very low	126 Å²	126	136.1 Å²	136.1	77%	0.773	80%	0.798	S	S	*	*			trans	-105.1	164.4	-170.7	51.9	0	0	0	0	113.1
178	K	32.1	Very low	29.9	Very low	200 Å²	200	134.3 Å²	134.3	87%	0.87	79%	0.79	S	S	*	*			trans	79.5	157.4	176.4	-51.9	-178	179.8	-172.6	0	116.2
179	A	29.8	Very low	29.5	Very low	90 Å²	90	133.3 Å²	133.3	74%	0.744	77%	0.773	S	S	*	*			cis	179.3	139.6	-38	0	0	0	0	0	108.3
180	D	28.2	Very low	29.5	Very low	164 Å²	164	135.2 Å²	135.2	88%	0.877	77%	0.77	S	S	*	*			trans	65.6	158.8	161.4	-135	-26.5	0	0	0	119.2
181	G	29.8	Very low	29.5	Very low	72 Å²	72	136 Å²	136	74%	0.742	76%	0.759	S	S	*	*			trans	128.4	119.6	-177.3	0	0	0	0	0	113
182	R	29.3	Very low	29.4	Very low	233 Å²	233	130.8 Å²	130.8	88%	0.879	75%	0.753	S	S	*	*			trans	-116.9	158	-172.3	-65.8	-175.5	177.3	-170.8	-1.1	114.2
183	A	28.4	Very low	29.4	Very low	91 Å²	91	133.1 Å²	133.1	75%	0.752	75%	0.75	S	S	*	*			trans	64.5	106.6	138.3	0	0	0	0	0	121.5
184	D	27	Very low	29.5	Very low	148 Å²	148	133.6 Å²	133.6	79%	0.791	75%	0.747	S	S	*	*				86.4	160.5	106	-149.7	19.3	0	0	0	122.2
185	D	25.9	Very low	29.2	Very low	131 Å²	131	133 Å²	133	70%	0.701	74%	0.738	S	S	*	*			trans	88.4	162.1	162.2	-130.3	-14.2	0	0	0	121.3
186	H	29.3	Very low	29.5	Very low	137 Å²	137	134.2 Å²	134.2	63%	0.634	74%	0.735	S	S	*	*			trans	-116.4	179.6	-139.4	-70.4	82.3	0	0	0	116.8
187	H	29.8	Very low	29.6	Very low	144 Å²	144	141.4 Å²	141.4	67%	0.667	74%	0.737	S	S	*	*			trans	88.6	118.8	146.6	-63.1	-58.3	0	0	0	120.9
188	H	26.9	Very low	29.7	Very low	167 Å²	167	140.2 Å²	140.2	77%	0.773	73%	0.734	S	S	*	*				57.4	147.5	128.3	-57.6	-39	0	0	0	121.8
189	A	24.3	Very low	29.6	Very low	61 Å²	61	139.8 Å²	139.8	50%	0.504	73%	0.732	S	S	.	*			cis	-172.4	-175.6	-15.4	0	0	0	0	0	110
190	H	28.9	Very low	29.6	Very low	149 Å²	149	140 Å²	140	69%	0.69	73%	0.728	S	S	*	*			trans	76.3	111.7	162.6	-51	-63.4	0	0	0	117.2
191	H	30.8	Very low	29.9	Very low	139 Å²	139	140.5 Å²	140.5	64%	0.644	72%	0.722	S	S	*	*				90.7	158.1	89.8	-66.8	-13.4	0	0	0	113.1	K193	H191-K193 PolarHBondContact CD2-NZ 2.91Å; H191-K193 PolarHBondContact CE1-NZ 3.46Å; H191-K193 WeakPolarHBondContact ND1-CE 3.37Å; H191-K193 PolarHBondContact NE2-NZ 3.29Å
192	A	31.9	Very low	29.9	Very low	89 Å²	89	145.2 Å²	145.2	74%	0.736	73%	0.725	S	S	*	*			cis	-157.4	175.3	6.3	0	0	0	0	0	111.5
193	K	31.5	Very low	30.2	Very low	155 Å²	155	144.6 Å²	144.6	67%	0.674	72%	0.723	S	S	*	*			cis	-175.5	96.9	-30.9	-101.3	170.7	-163	172.3	0	107.9	H191	H191-K193 PolarHBondContact CD2-NZ 2.91Å; H191-K193 PolarHBondContact CE1-NZ 3.46Å; H191-K193 WeakPolarHBondContact ND1-CE 3.37Å; H191-K193 PolarHBondContact NE2-NZ 3.29Å
194	H	31.2	Very low	30.4	Very low	179 Å²	179	149.5 Å²	149.5	83%	0.829	73%	0.727	S	S	*	*			trans	-137.4	106.3	170.6	-151.6	-111.8	0	0	0	109.9
195	S	27.1	Very low	31	Very low	68 Å²	68	148.2 Å²	148.2	48%	0.476	73%	0.727	S	S	.	*				92.5	127.1	68.9	-179.5	0	0	0	0	110.5
196	K	35	Very low	31	Very low	195 Å²	195	151.1 Å²	151.1	85%	0.848	74%	0.736	S	S	*	*			cis	-162.2	178.9	7.3	-118.3	169.3	-161	170.5	0	111.3
197	R	31.6	Very low	31	Very low	232 Å²	232	148.2 Å²	148.2	88%	0.875	74%	0.744	S	S	*	*			trans	86.3	104.6	166.5	-154.1	165.6	-168.2	168.6	4.8	114.1
198	S	34.4	Very low	31.2	Very low	101 Å²	101	151 Å²	151	71%	0.706	75%	0.753	S	S	*	*				64.9	139.6	51.9	-56.1	0	0	0	0	113.6
199	K	30.8	Very low	31.9	Very low	191 Å²	191	148.1 Å²	148.1	83%	0.83	75%	0.75	S	S	*	*			cis	-169	162.8	-4.3	-111.9	-167.3	171.7	-174.8	0	105.3
200	S	29.6	Very low	32.2	Very low	94 Å²	94	156.5 Å²	156.5	66%	0.657	77%	0.769	S	S	*	*			cis	167.1	160.5	-21.5	53.1	0	0	0	0	107.6
201	K	34	Very low	32.5	Very low	175 Å²	175	155.4 Å²	155.4	76%	0.761	78%	0.775	S	S	*	*			trans	138.8	144.7	152.5	-170	165	-169.6	167.3	0	113.2
202	E	30.4	Very low	32.4	Very low	171 Å²	171	152.1 Å²	152.1	80%	0.799	78%	0.778	S	S	*	*			trans	-81.1	160.5	-177.7	-52.3	142.4	104.6	0	0	113.4
203	R	36.5	Very low	32.2	Very low	219 Å²	219	156.2 Å²	156.2	83%	0.826	78%	0.784	S	S	*	*				-175.9	145.6	126	-97.1	149.7	-172.3	166.5	-4.5	111.9
204	K	32.7	Very low	32.1	Very low	194 Å²	194	154.2 Å²	154.2	84%	0.843	79%	0.79	S	S	*	*			trans	-84.1	150	153.4	-78.9	-80.4	-173.3	171.5	0	108.6
205	P	37.9	Very low	32	Very low	121 Å²	121	150 Å²	150	79%	0.786	78%	0.781	S	S	*	*				-136.6	-165.3	101.3	38.8	-27.1	0	0	0	113
206	E	27.1	Very low	32.1	Very low	192 Å²	192	157 Å²	157	90%	0.897	80%	0.797	S	S	*	*			trans	-71	158.9	178.2	-77.1	-164.7	90.3	0	0	114.9
207	G	28.9	Very low	32	Very low	77 Å²	77	158.3 Å²	158.3	79%	0.794	80%	0.797	S	S	*	*			trans	177.4	121.4	168.2	0	0	0	0	0	112.7
208	K	33.1	Very low	31.7	Very low	201 Å²	201	152.1 Å²	152.1	87%	0.874	79%	0.789	S	S	*	*			trans	-83.2	168.7	173.2	-65.6	174.2	-178.8	169.6	0	110.3
209	P	41.9	Very low	31.4	Very low	108 Å²	108	151.8 Å²	151.8	70%	0.701	79%	0.787	S	S	*	*			cis	-142	-176.8	-47.9	41.7	-25.8	0	0	0	114.1
210	R	31.7	Very low	31.3	Very low	237 Å²	237	149.2 Å²	149.2	89%	0.894	78%	0.782	S	S	*	*			trans	83.2	155.2	157.4	-70.8	-156.4	174.6	-139.6	-4.4	119.6
211	P	35.5	Very low	31.4	Very low	126 Å²	126	151.5 Å²	151.5	82%	0.818	79%	0.787	S	S	*	*			trans	-127.6	176.6	-144.8	43.6	-29.6	0	0	0	115.9
212	G	27.2	Very low	31.2	Very low	70 Å²	70	149.3 Å²	149.3	72%	0.722	78%	0.783	S	S	*	*			trans	-150	121.9	170	0	0	0	0	0	115.3
213	M	28.7	Very low	31.5	Very low	175 Å²	175	148.3 Å²	148.3	86%	0.862	78%	0.782	S	S	*	*			trans	66.1	134.9	143.5	-143.8	63.8	73.1	0	0	122.9
214	S	29.2	Very low	31.1	Very low	113 Å²	113	145.1 Å²	145.1	79%	0.79	78%	0.782	S	S	*	*			trans	67.2	149.1	157	68.7	0	0	0	0	118.8
215	S	28.3	Very low	31.2	Very low	91 Å²	91	141.8 Å²	141.8	64%	0.636	78%	0.783	S	S	*	*			cis	-171.1	176.4	-18.3	178.9	0	0	0	0	108.3
216	W	29.1	Very low	30.7	Very low	215 Å²	215	143.1 Å²	143.1	81%	0.814	78%	0.784	S	S	*	*			trans	68	144.3	176.3	-41.3	79.2	0	0	0	113
217	W	33	Very low	30.9	Very low	222 Å²	222	138.8 Å²	138.8	84%	0.841	78%	0.775	S	S	*	*			cis	-134.1	153.2	14	-69.5	75.1	0	0	0	109.1
218	S	25.8	Very low	31	Very low	102 Å²	102	140.6 Å²	140.6	71%	0.713	77%	0.771	S	S	*	*				67.3	139.8	83.6	-149.2	0	0	0	0	117.5
219	S	27.9	Very low	30.7	Very low	94 Å²	94	140.9 Å²	140.9	66%	0.657	77%	0.767	S	S	*	*			trans	76.2	118.4	167.9	-82.7	0	0	0	0	121.6
220	D	28.4	Very low	30.1	Very low	137 Å²	137	145.6 Å²	145.6	73%	0.733	77%	0.771	S	S	*	*				59.3	149.6	120.2	-59	-70.8	0	0	0	123.6
221	D	31.6	Very low	29.9	Very low	141 Å²	141	140.1 Å²	140.1	75%	0.754	77%	0.765	S	S	*	*			trans	63.1	151.2	159.9	-76.6	-43.1	0	0	0	118.6
222	N	30.7	Very low	30	Very low	129 Å²	129	140.2 Å²	140.2	69%	0.69	77%	0.765	S	S	*	*			cis	-165.8	-172.9	-30	-151.3	-54.2	0	0	0	107.1
223	L	36.8	Very low	30.2	Very low	150 Å²	150	142 Å²	142	79%	0.785	77%	0.766	S	S	*	*			trans	77.5	132.4	163	-50.8	-176	0	0	0	119.6
224	D	28.8	Very low	30.3	Very low	152 Å²	152	140 Å²	140	81%	0.813	76%	0.764	S	S	*	*			trans	-48.5	153.6	149.7	-63	-74.1	0	0	0	113.2
225	S	32.9	Very low	30.5	Very low	125 Å²	125	142 Å²	142	87%	0.874	77%	0.765	S	S	*	*				-169.3	127.3	121.2	-81.4	0	0	0	0	111.2
226	D	28.7	Very low	30.3	Very low	148 Å²	148	145.1 Å²	145.1	79%	0.791	77%	0.774	S	S	*	*			trans	-82.7	158.1	174.5	-143.1	-23.7	0	0	0	112
227	S	31.2	Very low	30.3	Very low	102 Å²	102	144.2 Å²	144.2	71%	0.713	77%	0.771	S	S	*	*			trans	137.5	95.1	142.3	67	0	0	0	0	118.3
228	T	30.6	Very low	30.2	Very low	115 Å²	115	139.4 Å²	139.4	71%	0.706	76%	0.757	S	S	*	*				37.7	108.9	111.8	-51.9	0	0	0	0	120.6
229	Y	26.5	Very low	30.4	Very low	206 Å²	206	142.2 Å²	142.2	81%	0.808	76%	0.759	S	S	*	*			trans	-167.3	140.8	142	-94.4	-86	0	0	0	108.3
230	R	29.2	Very low	30.5	Very low	207 Å²	207	146.4 Å²	146.4	78%	0.781	77%	0.773	S	S	*	*			cis	-162.5	160.5	-22.3	-128.9	-168.1	-151.3	-94.1	3	108.5
231	T	27.7	Very low	30.3	Very low	123 Å²	123	142.9 Å²	142.9	76%	0.755	77%	0.769	S	S	*	*			trans	-101	147.8	163.4	46.1	0	0	0	0	111.9
232	P	38.5	Very low	31.2	Very low	127 Å²	127	142.3 Å²	142.3	83%	0.825	77%	0.773	S	S	*	*			trans	-119.5	165.7	152.9	37.6	-27.7	0	0	0	111.7
233	S	30.4	Very low	31	Very low	107 Å²	107	143.3 Å²	143.3	75%	0.748	78%	0.783	S	S	*	*			trans	-136.2	168.1	-167.2	-57.7	0	0	0	0	113.7
234	V	30.7	Very low	30.6	Very low	133 Å²	133	139.4 Å²	139.4	81%	0.806	77%	0.773	S	S	*	*			trans	82.7	100.1	160.9	-170.1	0	0	0	0	118.9
235	L	33.4	Very low	30.8	Very low	157 Å²	157	140.7 Å²	140.7	82%	0.822	77%	0.774	S	S	*	*				45.6	126.8	127.9	-166.2	69.1	0	0	0	122.2
236	N	24.5	Very low	30.3	Very low	156 Å²	156	140.9 Å²	140.9	83%	0.834	77%	0.774	S	S	*	*			trans	-146.6	-178.1	142.2	-155.3	-5	0	0	0	111.3
237	R	29.7	Very low	30.3	Very low	196 Å²	196	143.2 Å²	143.2	74%	0.74	77%	0.773	S	S	*	*			trans	-137.8	152.3	-144.7	-143.9	-179.6	173	-154	-6.4	114.7
238	H	29.3	Very low	31.4	Very low	120 Å²	120	144.2 Å²	144.2	56%	0.556	78%	0.777	S	S	*	*			trans	79.1	122.2	151.9	-69.8	-47	0	0	0	125
239	H	31.4	Very low	31.4	Very low	161 Å²	161	144.4 Å²	144.4	75%	0.745	77%	0.774	S	S	*	*				59.5	130.5	127.9	-60.2	-43.6	0	0	0	124.7
240	L	30.2	Very low	31.5	Very low	183 Å²	183	138.2 Å²	138.2	96%	0.958	77%	0.765	S	S	*	*				-169.8	165.6	123.4	-100	158.9	0	0	0	110.9
241	G	23.6	Very low	31.6	Very low	63 Å²	63	136 Å²	136	65%	0.649	77%	0.768	S	S	*	*			trans	-150.1	-147.3	174.4	0	0	0	0	0	109.1
242	P	51.3	Low	31.6	Very low	128 Å²	128	139.3 Å²	139.3	83%	0.831	78%	0.775	S	S	*	*			cis	-129.7	-171.2	-30.4	42.1	-27	0	0	0	111.8
243	V	25.9	Very low	30.9	Very low	150 Å²	150	138.3 Å²	138.3	91%	0.909	77%	0.771	S	S	*	*			trans	-173.4	158.1	148.7	132.3	0	0	0	0	112.4
244	A	27.8	Very low	31.8	Very low	69 Å²	69	137.8 Å²	137.8	57%	0.57	77%	0.765	S	S	*	*			trans	-106.1	-168.5	-175.1	0	0	0	0	0	112.9
245	H	32.5	Very low	31.7	Very low	178 Å²	178	141.5 Å²	141.5	82%	0.824	77%	0.77	S	S	*	*			cis	-157.7	156.2	8.7	-101.4	-58.1	0	0	0	109.7
246	C	23.3	Very low	31.6	Very low	130 Å²	130	137.1 Å²	137.1	88%	0.878	76%	0.764	S	S	*	*				170.8	158.7	127.1	-94.5	0	0	0	0	113.8
247	Y	28	Very low	31.7	Very low	196 Å²	196	137.5 Å²	137.5	77%	0.769	77%	0.765	S	S	*	*			trans	-94.8	177.8	-173.1	-106.7	-123.5	0	0	0	113	D249	Y247-D249 HydrophobicContact CD1-CB 3.78Å; Y247-D249 HydrophobicContact CE1-CB 3.88Å
248	P	55.8	Low	31.9	Very low	123 Å²	123	135.8 Å²	135.8	80%	0.799	77%	0.77	S	S	*	*			cis	-132.2	-150.7	9.6	43	-25	0	0	0	114.2
249	D	28.8	Very low	31.8	Very low	120 Å²	120	134.3 Å²	134.3	64%	0.642	77%	0.774	S	S	*	*				-174.9	163.3	-75.5	-170.3	25.2	0	0	0	111.7	Y247	Y247-D249 HydrophobicContact CD1-CB 3.78Å; Y247-D249 HydrophobicContact CE1-CB 3.88Å
250	A	29.6	Very low	31.8	Very low	76 Å²	76	133.3 Å²	133.3	63%	0.628	77%	0.773	S	S	*	*			trans	65.6	148.9	159.9	0	0	0	0	0	121.3
251	L	31.4	Very low	31.6	Very low	161 Å²	161	133 Å²	133	84%	0.843	76%	0.764	S	S	*	*			cis	-167.7	173.8	-19.9	-111	177.8	0	0	0	110.4
252	Q	26.6	Very low	31.6	Very low	192 Å²	192	136.7 Å²	136.7	90%	0.897	77%	0.774	S	S	*	*			trans	107.1	160.5	158.5	-54.2	-165.7	15	0	0	120.5
253	S	24.3	Very low	30.5	Very low	106 Å²	106	134.8 Å²	134.8	74%	0.741	76%	0.764	S	S	*	*			trans	-153	-170.1	-170.4	-151.7	0	0	0	0	106.7
254	P	50.6	Low	30.7	Very low	95 Å²	95	136.9 Å²	136.9	62%	0.617	76%	0.761	S	S	*	*			cis	-138.1	-169.5	-10	25.6	1.6	0	0	0	115
255	F	28.4	Very low	30.8	Very low	211 Å²	211	138.2 Å²	138.2	93%	0.925	77%	0.766	S	S	*	*			trans	65.9	159	159.7	-71.4	-69.6	0	0	0	121.3
256	G	29.8	Very low	30.7	Very low	66 Å²	66	136.4 Å²	136.4	68%	0.68	76%	0.762	S	S	*	*			trans	176.1	-15.5	165.8	0	0	0	0	0	126.3
257	D	28	Very low	31.1	Very low	163 Å²	163	136.1 Å²	136.1	87%	0.872	75%	0.752	S	S	*	*			trans	54.3	177.2	168.4	-85.3	-42.1	0	0	0	122.3
258	L	34	Very low	31.2	Very low	160 Å²	160	132.8 Å²	132.8	84%	0.838	75%	0.747	S	S	*	*			trans	81.2	141.1	168.7	-59.7	165.1	0	0	0	118.6
259	S	25.6	Very low	30	Very low	90 Å²	90	132.5 Å²	132.5	63%	0.629	74%	0.743	S	S	*	*			cis	-167.1	152.7	-22.3	-152.7	0	0	0	0	112.3
260	L	31.7	Very low	30	Very low	139 Å²	139	135.8 Å²	135.8	73%	0.728	75%	0.752	S	S	*	*			trans	40	113.5	155.2	-62.1	168.8	0	0	0	120.2
261	K	26	Very low	30.2	Very low	177 Å²	177	138.5 Å²	138.5	77%	0.77	77%	0.765	S	S	*	*				82.3	142.5	72.5	-82.1	-167.5	-174.2	174.6	0	116.5
262	T	24.7	Very low	30	Very low	140 Å²	140	135.7 Å²	135.7	86%	0.859	76%	0.759	S	S	*	*			trans	68.5	155.6	160.7	50.5	0	0	0	0	118.2
263	S	27.3	Very low	30	Very low	89 Å²	89	131.4 Å²	131.4	62%	0.622	76%	0.756	S	S	*	*			cis	179.4	147	-18	172.4	0	0	0	0	110.9
264	K	30.2	Very low	30.6	Very low	194 Å²	194	132.5 Å²	132.5	84%	0.843	76%	0.762	S	S	*	*			trans	63.6	166.2	159.5	-78.7	174.2	-177.4	-177.2	0	117
265	S	30.6	Very low	29.3	Very low	96 Å²	96	137.7 Å²	137.7	67%	0.671	78%	0.778	S	S	*	*			cis	-170.2	155.2	-23.6	51	0	0	0	0	112.1
266	N	31	Very low	29.4	Very low	141 Å²	141	130.8 Å²	130.8	75%	0.754	77%	0.766	S	S	*	*			trans	64.1	126.2	149.8	-87.6	23.9	0	0	0	122.5
267	N	29.8	Very low	29.5	Very low	123 Å²	123	135.9 Å²	135.9	66%	0.658	78%	0.777	S	S	*	*				87.4	134.5	127.5	-79.1	40.8	0	0	0	124
268	D	30.7	Very low	29.5	Very low	126 Å²	126	132.2 Å²	132.2	67%	0.674	77%	0.77	S	S	*	*			trans	74.1	100.5	136.8	-71.2	-48.7	0	0	0	122.6
269	V	31.9	Very low	29.5	Very low	118 Å²	118	133 Å²	133	72%	0.715	77%	0.774	S	S	*	*				83.2	146.4	116.3	165.8	0	0	0	0	119.9
270	K	27.7	Very low	29.7	Very low	188 Å²	188	134.7 Å²	134.7	82%	0.817	78%	0.78	S	S	*	*			trans	75.2	96.4	169.4	-86.5	163.9	178.8	173.8	0	117.7
271	C	34.9	Very low	30.2	Very low	134 Å²	134	133.4 Å²	133.4	91%	0.905	78%	0.78	S	S	*	*			trans	-58.3	138.6	144.7	179.1	0	0	0	0	110.5
272	S	27.3	Very low	30.1	Very low	102 Å²	102	129.3 Å²	129.3	71%	0.713	77%	0.767	S	S	*	*			trans	-155.5	126.7	168.5	59.9	0	0	0	0	111.7
273	A	24.5	Very low	30.3	Very low	101 Å²	101	127.5 Å²	127.5	84%	0.835	77%	0.766	S	S	*	*			trans	41.8	137.9	153.2	0	0	0	0	0	121.4
274	C	37.3	Very low	30.5	Very low	129 Å²	129	131.3 Å²	131.3	87%	0.872	77%	0.771	S	S	*	*			trans	-86.8	135.3	177.8	-46	0	0	0	0	112.7
275	E	24.3	Very low	30.6	Very low	204 Å²	204	130.4 Å²	130.4	95%	0.953	76%	0.764	S	S	*	*			trans	-173	140.3	149.3	-108.3	171.2	159.6	0	0	108.6
276	G	29.7	Very low	30.6	Very low	66 Å²	66	132.3 Å²	132.3	68%	0.68	77%	0.766	S	S	*	*			cis	-179.6	-179.4	-6.1	0	0	0	0	0	111.7
277	L	31.6	Very low	30.5	Very low	173 Å²	173	132.7 Å²	132.7	91%	0.906	76%	0.761	S	S	*	*			trans	47.4	101.6	159.1	-61.5	165.4	0	0	0	118.3
278	A	29.3	Very low	30.7	Very low	87 Å²	87	135.6 Å²	135.6	72%	0.719	76%	0.762	S	S	*	*				78.5	117.6	69	0	0	0	0	0	116
279	L	32.8	Very low	30.7	Very low	177 Å²	177	133 Å²	133	93%	0.927	75%	0.754	S	S	*	*			trans	-131.5	154.2	157.7	-84	171.1	0	0	0	109.2
280	T	30.1	Very low	31.3	Very low	125 Å²	125	133.4 Å²	133.4	77%	0.767	76%	0.763	S	S	*	*			trans	-131.9	-175.8	-167.4	62.8	0	0	0	0	109
281	P	42.2	Very low	31.4	Very low	112 Å²	112	133.1 Å²	133.1	73%	0.727	76%	0.756	S	S	*	*			cis	-141	179.4	4.5	43.4	-24.6	0	0	0	117.8
282	D	24.9	Very low	31.3	Very low	90 Å²	90	131.5 Å²	131.5	48%	0.481	75%	0.746	S	S	.	*			trans	46.3	115	151.1	-102.1	-28.1	0	0	0	123.1	T511	D282-T511 PolarHBondContact OD2-OG1 3.21Å
283	A	29.1	Very low	32	Very low	102 Å²	102	132.3 Å²	132.3	84%	0.843	75%	0.747	S	S	*	*			trans	-148.1	81.2	135.6	0	0	0	0	0	110.2
284	K	30.6	Very low	32.4	Very low	170 Å²	170	134.1 Å²	134.1	74%	0.739	74%	0.742	S	S	*	*			trans	-98.2	99.8	177.2	-74	174.9	-178.1	165	0	112.4
285	Y	31.7	Very low	32.5	Very low	175 Å²	175	133.2 Å²	133.2	69%	0.686	73%	0.733	S	S	*	*			trans	-105.4	118.7	155.2	-87.4	-87	0	0	0	110.9
286	L	31.3	Very low	33	Very low	136 Å²	136	129.4 Å²	129.4	71%	0.712	72%	0.723	S	S	*	*			trans	-60.1	156.1	156.6	-90.7	61.7	0	0	0	108.4
287	K	29.7	Very low	33	Very low	149 Å²	149	131 Å²	131	65%	0.648	72%	0.724	S	S	*	*			cis	-165.8	159.3	21.6	-137.1	164.4	-175.2	165.4	0	109.5
288	R	32.4	Very low	33.2	Very low	183 Å²	183	131.6 Å²	131.6	69%	0.691	72%	0.722	S	S	*	*			trans	59.3	109.3	147.4	-82.4	164.1	-164.7	-150.4	-4.3	117.2
289	S	31	Very low	33.2	Very low	72 Å²	72	131.7 Å²	131.7	50%	0.503	72%	0.723	S	S	.	*				77.1	129.4	86.5	85.1	0	0	0	0	111.5	W291	S289-W291 PolarHBondContact O-N 2.88Å
290	S	44.7	Very low	33.2	Very low	127 Å²	127	130.6 Å²	130.6	89%	0.888	71%	0.711	S	S	*	*				38.7	73.7	84.6	-68.7	0	0	0	0	111.1
291	W	29.8	Very low	33.5	Very low	182 Å²	182	132.1 Å²	132.1	69%	0.689	71%	0.709	S	S	*	*			trans	-128.8	154.3	157.8	-82.4	91	0	0	0	105.6	S289	S289-W291 PolarHBondContact O-N 2.88Å
292	S	32.2	Very low	32.9	Very low	99 Å²	99	130.6 Å²	130.6	69%	0.692	71%	0.706	S	S	*	*			cis	-132.7	130.6	18.2	-56.7	0	0	0	0	113.5
293	T	42.1	Very low	33	Very low	120 Å²	120	136.1 Å²	136.1	74%	0.736	72%	0.721	S	S	*	*			trans	-79.8	140.8	146.1	-38.4	0	0	0	0	108.8
294	L	32.9	Very low	32.9	Very low	139 Å²	139	142.7 Å²	142.7	73%	0.728	72%	0.724	S	S	*	*			trans	-146.3	133.8	160.2	-68.8	-179.8	0	0	0	106.6
295	T	39.5	Very low	32.7	Very low	110 Å²	110	143.4 Å²	143.4	68%	0.675	73%	0.727	S	S	*	*			cis	-152.3	137.1	1.5	13.9	0	0	0	0	107.7
296	V	34.9	Very low	32.5	Very low	123 Å²	123	140.4 Å²	140.4	75%	0.745	73%	0.732	S	S	*	*				63.8	123.7	83	177	0	0	0	0	111.3
297	S	30.6	Very low	32.3	Very low	100 Å²	100	138.9 Å²	138.9	70%	0.699	73%	0.733	S	S	*	*				-153.7	132.3	74	47	0	0	0	0	119.2
298	Q	35.6	Very low	32.1	Very low	186 Å²	186	139 Å²	139	87%	0.869	74%	0.739	S	S	*	*			trans	60.6	155.9	135.3	-56.3	-175.5	10.9	0	0	119.2
299	A	29.9	Very low	31.8	Very low	89 Å²	89	136.2 Å²	136.2	74%	0.736	74%	0.738	S	S	*	*			cis	-161.4	-177.5	9.9	0	0	0	0	0	109.1
300	K	32.3	Very low	31.6	Very low	154 Å²	154	137.5 Å²	137.5	67%	0.67	74%	0.739	S	S	*	*			cis	-177.8	128.5	-25.3	170.2	179.8	-174.6	-72.8	0	109.3
301	E	37	Very low	30.7	Very low	157 Å²	157	136.7 Å²	136.7	73%	0.734	73%	0.725	S	S	*	*			trans	63.8	164.2	165.2	-75.8	155	-147.5	0	0	118.5
302	A	29.3	Very low	30.6	Very low	79 Å²	79	136.8 Å²	136.8	65%	0.653	73%	0.73	S	S	*	*			cis	-167.6	163.3	-24.7	0	0	0	0	0	114.7
303	Y	26.2	Very low	31.4	Very low	207 Å²	207	137.2 Å²	137.2	81%	0.812	73%	0.73	S	S	*	*			trans	55.3	116.7	147.2	-96.1	-71.9	0	0	0	123.8
304	R	26.3	Very low	30.7	Very low	239 Å²	239	138.2 Å²	138.2	90%	0.902	73%	0.731	S	S	*	*				174.2	-167.4	99.4	-106.1	-169.1	-178	-143.7	1.5	113.6
305	K	28	Very low	30.4	Very low	185 Å²	185	138.7 Å²	138.7	80%	0.804	73%	0.733	S	S	*	*			trans	-139.1	170	-158.3	-57.3	-179.3	178.5	-178.4	0	114.3
306	S	26.4	Very low	29.9	Very low	113 Å²	113	140.5 Å²	140.5	79%	0.79	73%	0.734	S	S	*	*			trans	79.7	159.6	153	75.9	0	0	0	0	118.9
307	S	27.2	Very low	29.5	Very low	103 Å²	103	142.6 Å²	142.6	72%	0.72	74%	0.735	S	S	*	*			cis	-177.7	174.1	-27.9	-84.4	0	0	0	0	109.5
308	L	26.7	Very low	29.2	Very low	151 Å²	151	144 Å²	144	79%	0.791	74%	0.735	S	S	*	*			trans	79.6	123.1	163.6	-58.3	177.8	0	0	0	116
309	N	25.7	Very low	29.1	Very low	125 Å²	125	138.4 Å²	138.4	67%	0.668	72%	0.72	S	S	*	*				74.3	141.3	82.1	-87.4	-72.2	0	0	0	113.8
310	L	27.2	Very low	28.9	Very low	99 Å²	99	140.4 Å²	140.4	52%	0.518	71%	0.713	S	S	.	*			cis	-169.9	161.6	6	173.3	65.4	0	0	0	110	L975	L310-L975 HydrophobicContact CB-CD2 4.42Å; L310-L975 CarbonylContact O-C 3.18Å; L310-L975 WeakPolarHBondContact O-CA 3Å; L310-L975 VanDerWaalsContact O-CB 3.28Å; L310-L975 WeakPolarHBondContact O-CB 3.48Å; L310-L975 WeakPolarHBondContact O-CD2 3.46Å
311	D	24	Very low	29.4	Very low	111 Å²	111	136.3 Å²	136.3	59%	0.594	70%	0.702	S	S	*	*			trans	99.3	-173.5	153.2	-121.6	-54.9	0	0	0	121.6	L975	D311-L975 HydrophobicContact CB-CB 4.1Å; D311-L975 HydrophobicContact CB-CD2 4.21Å
312	K	28.8	Very low	29	Very low	184 Å²	184	132 Å²	132	80%	0.8	69%	0.693	S	S	*	*			trans	-159.3	-173.6	-155.7	-119.5	178.5	-179	177.3	0	109.7
313	P	49.2	Very low	29.1	Very low	107 Å²	107	135.6 Å²	135.6	70%	0.695	70%	0.7	S	S	*	*			cis	-130.3	-158.3	-21.9	38.7	-19.3	0	0	0	112.3
314	L	26.1	Very low	29.7	Very low	142 Å²	142	135.7 Å²	135.7	74%	0.743	70%	0.699	S	S	*	*				146.1	112.1	117.6	-164.9	72.6	0	0	0	117.4
315	L	27.7	Very low	30.3	Very low	149 Å²	149	130.4 Å²	130.4	78%	0.78	70%	0.696	S	S	*	*			trans	59.9	160.8	150.5	-62.9	175.1	0	0	0	121.5
316	H	28.1	Very low	30.4	Very low	148 Å²	148	125.6 Å²	125.6	69%	0.685	68%	0.684	S	S	*	*			cis	-175	-171.8	-26	-171.5	32.8	0	0	0	111.5	D318	H316-D318 IonicContact CE1-OD2 3.9Å; H316-D318 IonicContact NE2-OD2 3.92Å
317	Q	27.6	Very low	30.5	Very low	166 Å²	166	129.8 Å²	129.8	78%	0.776	69%	0.691	S	S	*	*			trans	77.8	135.9	175.8	-62.1	-175.7	-29.6	0	0	117.1
318	D	24.9	Very low	30.5	Very low	129 Å²	129	134.5 Å²	134.5	69%	0.69	70%	0.695	S	S	*	*			cis	96.2	146.6	29.1	-68.7	-45.7	0	0	0	114.1	H316	H316-D318 IonicContact CE1-OD2 3.9Å; H316-D318 IonicContact NE2-OD2 3.92Å
319	A	32.5	Very low	30.8	Very low	69 Å²	69	133 Å²	133	57%	0.57	69%	0.687	S	S	*	*			cis	-171.9	135.6	-28.3	0	0	0	0	0	112.6
320	K	26.2	Very low	30.8	Very low	131 Å²	131	134.9 Å²	134.9	57%	0.57	69%	0.692	S	S	*	*			trans	70.6	-149.6	153.3	-57.1	-178.2	-105.5	154.1	0	119.8	C93 D94	C93-K320 HydrophobicContact CB-CB 4.16Å; C93-K320 HydrophobicContact CB-CD 3.38Å; C93-K320 HydrophobicContact CB-CG 4.21Å; D94-K320 VanDerWaalsContact CG-NZ 3.29Å; D94-K320 IonicContact OD1-NZ 3.22Å; D94-K320 PolarHBondContact OD1-NZ 3.01Å; D94-K320 VanDerWaalsContact OD2-CD 3.23Å; D94-K320 WeakPolarHBondContact OD2-CD 3.31Å; D94-K320 WeakPolarHBondContact OD2-CE 3.42Å; D94-K320 IonicContact OD2-NZ 2.67Å; D94-K320 PolarHBondContact OD2-NZ 2.88Å
321	P	42	Very low	30.9	Very low	68 Å²	68	136.6 Å²	136.6	44%	0.442	71%	0.706	S	S	.	*				-122.5	-165.2	-100.8	42.8	-28.1	0	0	0	118.3	T92 C93 D94	T92-P321 VanDerWaalsContact CG2-CA 3.49Å; T92-P321 HydrophobicContact CG2-CB 3.36Å; C93-P321 VanDerWaalsContact C-CG 3.47Å; C93-P321 HydrophobicContact CB-CB 4.25Å; C93-P321 HydrophobicContact CB-CG 4.08Å; C93-P321 VanDerWaalsContact N-CB 3.31Å; C93-P321 WeakPolarHBondContact O-CB 3.38Å; C93-P321 VanDerWaalsContact O-CG 3.24Å; C93-P321 WeakPolarHBondContact O-CG 3.32Å; D94-P321 HydrophobicContact CB-CG 4.1Å
322	A	29.2	Very low	31.5	Very low	66 Å²	66	137.2 Å²	137.2	55%	0.545	72%	0.716	S	S	.	*			cis	-162.7	153.1	10.5	0	0	0	0	0	118.4
323	L	31.7	Very low	31.8	Very low	155 Å²	155	137 Å²	137	81%	0.812	72%	0.718	S	S	*	*			trans	55.6	171.9	146.6	-73.3	174.6	0	0	0	128.4
324	R	38.9	Very low	31.5	Very low	210 Å²	210	137.1 Å²	137.1	79%	0.792	71%	0.713	S	S	*	*			trans	-85.5	172.4	-165.1	-88.7	-107.3	-163.2	154.9	7.6	116.6	C326	R324-C326 PolarHBondContact NH1-SG 3.43Å
325	P	37.5	Very low	31.7	Very low	128 Å²	128	137.1 Å²	137.1	83%	0.831	71%	0.709	S	S	*	*			cis	-149.2	-153.1	46.7	42.4	-17.5	0	0	0	118.8
326	C	31.5	Very low	32.2	Very low	83 Å²	83	141.9 Å²	141.9	56%	0.561	72%	0.717	S	S	*	*			trans	-126	175.1	-158.3	-49.4	0	0	0	0	116.6	R324	R324-C326 PolarHBondContact NH1-SG 3.43Å
327	H	28	Very low	32.2	Very low	202 Å²	202	138.6 Å²	138.6	94%	0.935	72%	0.723	S	S	*	*			trans	-167.7	-162.3	151.3	-103.1	87.9	0	0	0	114.2
328	Y	26.8	Very low	32.2	Very low	201 Å²	201	134.5 Å²	134.5	79%	0.788	73%	0.725	S	S	*	*			trans	-146.4	153.9	-134.7	-162.2	-135.4	0	0	0	118.9
329	L	33.1	Very low	32.3	Very low	120 Å²	120	139.7 Å²	139.7	63%	0.628	74%	0.737	S	S	*	*			trans	75.6	126.9	158.1	-77.2	172.7	0	0	0	127.6
330	Q	26.6	Very low	33.5	Very low	165 Å²	165	141.2 Å²	141.2	77%	0.771	74%	0.741	S	S	*	*				73.8	138.4	124.1	-161	164.9	4.2	0	0	125.9
331	V	28.8	Very low	33.6	Very low	134 Å²	134	141.5 Å²	141.5	81%	0.812	75%	0.754	S	S	*	*			trans	-151.5	146.2	169.7	-170.2	0	0	0	0	112.2
332	P	37.5	Very low	33	Very low	124 Å²	124	142 Å²	142	81%	0.805	77%	0.771	S	S	*	*			trans	-114	-173.6	174.2	41	-31.7	0	0	0	115.9
333	Q	34.8	Very low	33	Very low	179 Å²	179	142.2 Å²	142.2	84%	0.836	78%	0.78	S	S	*	*			trans	-148.5	146.7	-170.6	171.1	-178.9	-11.2	0	0	113
334	D	42.5	Very low	33	Very low	111 Å²	111	144 Å²	144	59%	0.594	78%	0.781	S	S	*	*			trans	158.9	166.6	134	-160.4	21.4	0	0	0	115.2	R578	D334-R578 WeakPolarHBondContact O-CD 3.43Å; D334-R578 PolarHBondContact O-NE 2.69Å; D334-R578 PolarHBondContact O-NH1 2.79Å; D334-R578 PolarHBondContact O-NH2 3.32Å
335	E	30.3	Very low	32.8	Very low	142 Å²	142	140.5 Å²	140.5	66%	0.664	78%	0.778	S	S	*	*			trans	96	144.4	165.5	-61.4	-168.6	139.7	0	0	122.1	R578	E335-R578 PolarHBondContact O-NE 2.94Å
336	W	37.2	Very low	32.7	Very low	248 Å²	248	143 Å²	143	94%	0.939	78%	0.778	S	S	*	*			trans	-120.7	155	-177.1	-82.3	85.3	0	0	0	113.5
337	G	28.8	Very low	33	Very low	79 Å²	79	147.7 Å²	147.7	81%	0.814	79%	0.792	S	S	*	*			trans	153.5	151.8	152.8	0	0	0	0	0	117.7
338	G	26.8	Very low	33.5	Very low	80 Å²	80	145 Å²	145	83%	0.825	78%	0.783	S	S	*	*			trans	115.5	121.4	158.3	0	0	0	0	0	119.2
339	Y	27.2	Very low	34.1	Very low	238 Å²	238	141 Å²	141	93%	0.933	78%	0.782	S	S	*	*			trans	-122.4	178.8	165.4	-109.8	-93.4	0	0	0	107
340	P	57.4	Low	34	Very low	102 Å²	102	140.2 Å²	140.2	66%	0.662	79%	0.785	S	S	*	*			cis	-135.9	-148	-5.1	41.2	-20.5	0	0	0	113.3
341	T	30.1	Very low	34.5	Very low	137 Å²	137	144.2 Å²	144.2	84%	0.84	79%	0.793	S	S	*	*			trans	92.9	136.2	162.1	-29.2	0	0	0	0	116.4
342	G	29.2	Very low	34.9	Very low	78 Å²	78	147.6 Å²	147.6	80%	0.804	79%	0.791	S	S	*	*			cis	158.3	124.1	-11.7	0	0	0	0	0	114.3
343	G	29.3	Very low	34.8	Very low	70 Å²	70	149 Å²	149	72%	0.722	79%	0.789	S	S	*	*			trans	152.7	124.8	179.1	0	0	0	0	0	109.9
344	K	30.3	Very low	35.3	Very low	192 Å²	192	151.5 Å²	151.5	84%	0.835	79%	0.791	S	S	*	*				63.7	127.7	70.6	-73.4	-163.6	172.7	-158.6	0	113.3
345	D	35	Very low	34.9	Very low	137 Å²	137	150.8 Å²	150.8	73%	0.733	79%	0.794	S	S	*	*			cis	-133.8	-176.4	-18.4	-81.6	-55.1	0	0	0	104.9
346	E	36.2	Very low	35.1	Very low	180 Å²	180	147.7 Å²	147.7	84%	0.841	80%	0.8	S	S	*	*			cis	-167.1	149.8	32	-168.6	165.3	-146.2	0	0	110.5
347	E	37.5	Very low	34.8	Very low	183 Å²	183	141.7 Å²	141.7	86%	0.855	80%	0.796	S	S	*	*			trans	49.9	143.8	163.2	-153.9	147.6	-128	0	0	123.2
348	I	37.6	Very low	34.8	Very low	146 Å²	146	143.9 Å²	143.9	75%	0.749	78%	0.781	S	S	*	*			trans	-140.9	130.8	-168.5	-68.4	161.6	0	0	0	107
349	P	40.7	Very low	35.2	Very low	116 Å²	116	148.5 Å²	148.5	75%	0.753	79%	0.785	S	S	*	*				-151.6	131.1	107.2	34.5	-14.5	0	0	0	118.4
350	C	31	Very low	35.8	Very low	103 Å²	103	145.9 Å²	145.9	70%	0.696	78%	0.778	S	S	*	*				42	118.4	130	-61.1	0	0	0	0	122.3
351	R	36.6	Very low	35	Very low	250 Å²	250	143.8 Å²	143.8	94%	0.943	77%	0.77	S	S	*	*			trans	62.5	120.3	136.6	-61.3	174.4	171	179.3	-1.9	118.6
352	R	37.3	Very low	35.5	Very low	205 Å²	205	145.9 Å²	145.9	77%	0.774	77%	0.772	S	S	*	*				-166.7	148.2	112.7	-173.8	155.8	152.7	-157.5	-7.2	111.6
353	M	34.6	Very low	36.2	Very low	153 Å²	153	145.1 Å²	145.1	75%	0.754	76%	0.764	S	S	*	*			trans	-85.5	150.2	177.4	-63.3	161.1	60.5	0	0	112.1
354	R	45.6	Very low	36.5	Very low	232 Å²	232	148.2 Å²	148.2	88%	0.875	76%	0.764	S	S	*	*			trans	61.5	121.2	162.8	-72.5	178.1	164.7	154.4	-5.6	118.6
355	S	35.3	Very low	37.3	Very low	96 Å²	96	146.5 Å²	146.5	67%	0.671	76%	0.759	S	S	*	*				-156.9	170.3	127.3	63.7	0	0	0	0	108.3
356	G	33	Very low	37.6	Very low	76 Å²	76	147.8 Å²	147.8	78%	0.784	76%	0.761	S	S	*	*	S	Bend	cis	-56.2	143.2	10.4	0	0	0	0	0	115.6
357	S	31.3	Very low	37.6	Very low	122 Å²	122	144.8 Å²	144.8	85%	0.853	76%	0.76	S	S	*	*			cis	-137.2	125	-4.6	-68.8	0	0	0	0	110.2
358	Y	28	Very low	37.7	Very low	126 Å²	126	138.8 Å²	138.8	49%	0.494	75%	0.747	S	S	.	*			trans	-132.8	61.5	166.1	-169.9	-112.4	0	0	0	110.7	K360 A361	Y358-K360 VanDerWaalsContact C-N 3.34Å; Y358-K360 WeakPolarHBondContact CE2-O 3.42Å; Y358-K360 PolarHBondContact OH-O 3.36Å; Y358-K360 VanDerWaalsContact OH-O 3.13Å; Y358-A361 HydrophobicContact CE1-CB 3.78Å
359	I	36.8	Very low	37.7	Very low	177 Å²	177	140.7 Å²	140.7	91%	0.908	75%	0.753	S	S	*	*			trans	-98.3	74	153.3	-58	-178.6	0	0	0	106.7
360	K	39.8	Very low	37.4	Very low	182 Å²	182	140.2 Å²	140.2	79%	0.791	75%	0.753	S	S	*	*			trans	-151.3	63.4	153	-162.8	177.2	179.4	178.4	0	109.5	Y358	Y358-K360 VanDerWaalsContact C-N 3.34Å; Y358-K360 WeakPolarHBondContact CE2-O 3.42Å; Y358-K360 PolarHBondContact OH-O 3.36Å; Y358-K360 VanDerWaalsContact OH-O 3.13Å
361	A	39.6	Very low	37.3	Very low	59 Å²	59	142.1 Å²	142.1	49%	0.488	76%	0.756	S	S	.	*			trans	-122.4	106	160.1	0	0	0	0	0	107.3	Y358	Y358-A361 HydrophobicContact CE1-CB 3.78Å
362	M	41.2	Very low	37	Very low	180 Å²	180	134.3 Å²	134.3	89%	0.887	74%	0.739	S	S	*	*			trans	-156.2	129.6	159.9	-70.1	-54.2	-63.7	0	0	103.3
363	G	44	Very low	36.7	Very low	63 Å²	63	130.2 Å²	130.2	65%	0.649	74%	0.742	S	S	*	*			trans	82.3	89.8	-149.4	0	0	0	0	0	109.1
364	D	35.3	Very low	37.2	Very low	134 Å²	134	128 Å²	128	72%	0.717	74%	0.739	S	S	*	*			cis	71.8	150.6	17.6	-140.9	-5.1	0	0	0	114.7
365	E	47.9	Very low	36.5	Very low	157 Å²	157	126.5 Å²	126.5	73%	0.734	74%	0.739	S	S	*	*			trans	62.2	154	-171.1	-38.9	-59	175.4	0	0	116.7
366	E	40	Very low	36.5	Very low	163 Å²	163	128.9 Å²	128.9	76%	0.762	75%	0.75	S	S	*	*			cis	-170.9	145.9	-41.1	171.1	173.3	-136.6	0	0	106.5
367	S	36.7	Very low	36.1	Very low	118 Å²	118	130.5 Å²	130.5	83%	0.825	75%	0.749	S	S	*	*			trans	60.3	169.3	166.6	-75.1	0	0	0	0	117.3
368	G	38.5	Very low	37	Very low	57 Å²	57	129.6 Å²	129.6	59%	0.588	74%	0.741	S	S	*	*			cis	-176.7	178.9	-5	0	0	0	0	0	110.4
369	E	37.4	Very low	37	Very low	185 Å²	185	132.6 Å²	132.6	86%	0.864	76%	0.756	S	S	*	*			trans	57.8	145.4	-177.7	68	174.5	-157.2	0	0	116.4
370	S	35.4	Very low	36.5	Very low	107 Å²	107	128.9 Å²	128.9	75%	0.748	75%	0.746	S	S	*	*			cis	67.8	143.5	38.9	-49.2	0	0	0	0	111.9
371	D	29.3	Very low	36	Very low	142 Å²	142	124.8 Å²	124.8	76%	0.759	75%	0.746	S	S	*	*			cis	-157.5	174.7	36.6	179.7	40.7	0	0	0	113.7
372	S	29.1	Very low	35.3	Very low	86 Å²	86	130.1 Å²	130.1	60%	0.601	76%	0.764	S	S	*	*			trans	32.7	133.7	154.6	64.2	0	0	0	0	123.8
373	S	32.3	Very low	34.8	Very low	119 Å²	119	129.1 Å²	129.1	83%	0.832	76%	0.762	S	S	*	*			trans	-82.1	148.6	142.1	-60.5	0	0	0	0	109.9
374	P	44.7	Very low	34.3	Very low	107 Å²	107	131.6 Å²	131.6	70%	0.695	77%	0.767	S	S	*	*				-148.2	155.4	111.6	36.1	-20.7	0	0	0	117
375	K	29.7	Very low	33.8	Very low	200 Å²	200	133.4 Å²	133.4	87%	0.87	77%	0.771	S	S	*	*			trans	22.3	133.2	137.8	-55.4	172.4	-176.4	172.8	0	117.6
376	T	35.2	Very low	34	Very low	146 Å²	146	130.5 Å²	130.5	90%	0.896	77%	0.766	S	S	*	*				-138.5	161.5	84.9	42.1	0	0	0	0	116
377	S	26.6	Very low	33.4	Very low	111 Å²	111	129.5 Å²	129.5	78%	0.776	77%	0.765	S	S	*	*			trans	-110.3	-157.8	171.5	-149	0	0	0	0	107.6
378	P	50	Low	33.1	Very low	103 Å²	103	130.2 Å²	130.2	67%	0.669	76%	0.759	S	S	*	*			cis	-138.7	174	-12.6	40.1	-22.5	0	0	0	116
379	K	27.5	Very low	32.7	Very low	188 Å²	188	135.8 Å²	135.8	82%	0.817	77%	0.767	S	S	*	*				177.6	107.9	123.3	-98.1	171.8	-179.1	-179.6	0	111.1
380	S	26.7	Very low	32.3	Very low	100 Å²	100	132.1 Å²	132.1	70%	0.699	76%	0.761	S	S	*	*				55.8	103.2	107.2	66.5	0	0	0	0	113.8
381	A	28.6	Very low	31.9	Very low	96 Å²	96	134.6 Å²	134.6	79%	0.793	76%	0.764	S	S	*	*			cis	66.5	125.8	40	0	0	0	0	0	114.7
382	I	25.5	Very low	31.7	Very low	170 Å²	170	131 Å²	131	87%	0.872	76%	0.761	S	S	*	*			trans	-168.9	132.5	155.5	-100.6	151.7	0	0	0	109.1
383	L	29.2	Very low	31.6	Very low	160 Å²	160	136.5 Å²	136.5	84%	0.838	78%	0.777	S	S	*	*			trans	-102.6	157.7	158.8	-132.9	90.3	0	0	0	105.9
384	P	34.5	Very low	31.3	Very low	115 Å²	115	141.9 Å²	141.9	75%	0.747	78%	0.779	S	S	*	*				-153.8	-176.6	58.4	41	-18.6	0	0	0	117.7
385	E	24.1	Very low	30.9	Very low	172 Å²	172	142 Å²	142	80%	0.804	78%	0.78	S	S	*	*			trans	-68.1	-176.7	155.7	-110.6	-162.1	132.2	0	0	112.9
386	P	52.2	Low	30.8	Very low	96 Å²	96	140.3 Å²	140.3	62%	0.623	78%	0.78	S	S	*	*			cis	-136.7	-162.8	-21.2	30.5	-7.4	0	0	0	113.7
387	L	27.8	Very low	30.4	Very low	142 Å²	142	136.5 Å²	136.5	74%	0.743	77%	0.77	S	S	*	*				123	107.8	125.2	-160.3	68.4	0	0	0	120.5
388	L	30.8	Very low	30.2	Very low	133 Å²	133	139 Å²	139	70%	0.696	77%	0.769	S	S	*	*			trans	68.9	157.2	156.1	-62.9	170.7	0	0	0	118.5
389	K	29.2	Very low	29.2	Very low	174 Å²	174	141.6 Å²	141.6	76%	0.757	77%	0.772	S	S	*	*			cis	-159.3	140.1	13	-142.2	158.1	-170.8	174.8	0	114.2
390	S	30.6	Very low	28.9	Very low	107 Å²	107	140.5 Å²	140.5	75%	0.748	77%	0.77	S	S	*	*			trans	65.3	154.7	148.7	-107.9	0	0	0	0	120.9
391	I	25.9	Very low	28.8	Very low	159 Å²	159	141.4 Å²	141.4	82%	0.815	77%	0.772	S	S	*	*			cis	-153.9	149.9	3.3	-156.4	162.9	0	0	0	113.6
392	G	26.3	Very low	28.6	Very low	67 Å²	67	145.5 Å²	145.5	69%	0.691	77%	0.774	S	S	*	*			trans	78.8	140.1	159.5	0	0	0	0	0	118.5
393	Q	26.3	Very low	28.5	Very low	201 Å²	201	142.7 Å²	142.7	94%	0.939	77%	0.765	S	S	*	*			cis	-142	175.2	-10.7	-81.3	-165.3	-20.4	0	0	110.9
394	R	25.8	Very low	28.3	Very low	232 Å²	232	145.3 Å²	145.3	88%	0.875	77%	0.765	S	S	*	*			trans	-130.5	179.8	-171.6	-107.1	-171.7	-179.5	-175.5	-1.7	110.1
395	P	37.1	Very low	28.2	Very low	111 Å²	111	145.6 Å²	145.6	72%	0.721	76%	0.76	S	S	*	*			cis	-120.3	-162.7	6.3	34.7	-12.2	0	0	0	112.3
396	L	26.6	Very low	28.4	Very low	163 Å²	163	145 Å²	145	85%	0.853	76%	0.757	S	S	*	*			cis	-167.6	138	26.9	180	65.8	0	0	0	113.6
397	G	26.5	Very low	27.4	Very low	67 Å²	67	144.8 Å²	144.8	69%	0.691	76%	0.764	S	S	*	*			trans	62.1	132.4	155.7	0	0	0	0	0	119.9
398	E	23.4	Very low	27.4	Very low	163 Å²	163	142 Å²	142	76%	0.762	76%	0.762	S	S	*	*			cis	85.7	136.6	2.6	-142.7	170.3	-164.8	0	0	119.4
399	H	28.4	Very low	27.3	Very low	157 Å²	157	140.6 Å²	140.6	73%	0.727	76%	0.762	S	S	*	*			trans	64.8	142.6	-177.3	-50.6	-70	0	0	0	117.2
400	Q	22	Very low	27.2	Very low	165 Å²	165	139.9 Å²	139.9	77%	0.771	77%	0.767	S	S	*	*			cis	94.7	88.4	11.6	-155.4	179	26.8	0	0	118.1
401	T	24.4	Very low	27.3	Very low	120 Å²	120	141 Å²	141	74%	0.736	77%	0.769	S	S	*	*			trans	73.7	151.3	150.4	61.1	0	0	0	0	122
402	Q	24.1	Very low	28.2	Very low	181 Å²	181	138.4 Å²	138.4	85%	0.846	76%	0.763	S	S	*	*			trans	76.7	144.8	166.8	-62.6	-166.4	0.3	0	0	117.5
403	T	24	Very low	28.4	Very low	112 Å²	112	141.1 Å²	141.1	69%	0.687	77%	0.766	S	S	*	*			cis	-168.2	146.4	-7.6	-101.2	0	0	0	0	112.5
404	Y	25.5	Very low	28.5	Very low	214 Å²	214	135 Å²	135	84%	0.839	76%	0.756	S	S	*	*			trans	62.8	142.8	165.6	-117.6	-161	0	0	0	117.4
405	L	30.7	Very low	28.6	Very low	121 Å²	121	132.3 Å²	132.3	63%	0.634	75%	0.753	S	S	*	*			cis	-153.1	170.8	33.4	-95.5	171.8	0	0	0	108.5
406	Q	29.1	Very low	28	Very low	159 Å²	159	131.7 Å²	131.7	74%	0.743	75%	0.751	S	S	*	*			cis	-167.3	157.8	-10.8	-170.1	178.4	-15.2	0	0	109.4
407	A	30.2	Very low	28.1	Very low	93 Å²	93	131.7 Å²	131.7	77%	0.769	75%	0.751	S	S	*	*			trans	63.4	137.6	158.8	0	0	0	0	0	120.1
408	A	29	Very low	28.5	Very low	84 Å²	84	135.1 Å²	135.1	69%	0.694	75%	0.754	S	S	*	*			cis	-162.8	159.2	-10.3	0	0	0	0	0	111.7
409	S	28.6	Very low	29.1	Very low	102 Å²	102	132.7 Å²	132.7	71%	0.713	75%	0.752	S	S	*	*			trans	55.8	138.4	160	50	0	0	0	0	119.6
410	D	27.2	Very low	29.1	Very low	159 Å²	159	129.4 Å²	129.4	85%	0.85	75%	0.752	S	S	*	*			cis	-156.4	179.6	-4	-112.5	-40.3	0	0	0	112.8
411	V	32.8	Very low	29.3	Very low	130 Å²	130	126.2 Å²	126.2	79%	0.788	75%	0.754	S	S	*	*			trans	-114.4	167.7	-170.2	153.6	0	0	0	0	109.1
412	P	44.7	Very low	29.3	Very low	106 Å²	106	127.6 Å²	127.6	69%	0.688	76%	0.757	S	S	*	*			cis	-138.6	173.4	19.4	17.7	11.1	0	0	0	119.7
413	V	29.4	Very low	29.4	Very low	124 Å²	124	128.9 Å²	128.9	75%	0.752	76%	0.755	S	S	*	*			trans	41.7	129	138.4	-178.3	0	0	0	0	119.4
414	G	28.7	Very low	29.5	Very low	71 Å²	71	131.1 Å²	131.1	73%	0.732	76%	0.763	S	S	*	*			cis	-179.4	-157.8	8.9	0	0	0	0	0	110.7
415	H	29.3	Very low	29.9	Very low	177 Å²	177	126.3 Å²	126.3	82%	0.819	76%	0.761	S	S	*	*			cis	-146.2	-133.5	0.1	-127.2	-44.6	0	0	0	111.1
416	S	24	Very low	29.8	Very low	98 Å²	98	126.2 Å²	126.2	69%	0.685	77%	0.768	S	S	*	*			trans	-163.6	150.6	-173	177.5	0	0	0	0	113.2
417	L	27.9	Very low	29.7	Very low	162 Å²	162	128.2 Å²	128.2	85%	0.848	77%	0.774	S	S	*	*				172.5	134.2	125.1	-92.7	173.7	0	0	0	114
418	D	34.3	Very low	29.7	Very low	140 Å²	140	133.7 Å²	133.7	75%	0.749	78%	0.78	S	S	*	*			trans	-144	133.9	157.1	170.2	25.3	0	0	0	106.6	A420	D418-A420 PolarHBondContact OD1-N 3.02Å
419	P	37.3	Very low	29.9	Very low	112 Å²	112	141.4 Å²	141.4	73%	0.727	79%	0.792	S	S	*	*				-147.2	110.7	129.1	32.8	-14.4	0	0	0	115.6
420	A	27.7	Very low	30.2	Very low	88 Å²	88	141.6 Å²	141.6	73%	0.727	79%	0.793	S	S	*	*				30.4	125.4	128.3	0	0	0	0	0	121.5	D418	D418-A420 PolarHBondContact OD1-N 3.02Å
421	A	26.5	Very low	30.7	Very low	97 Å²	97	146.1 Å²	146.1	80%	0.802	80%	0.798	S	S	*	*			trans	-151.4	116.2	152.8	0	0	0	0	0	114.8
422	N	24.8	Very low	30.8	Very low	149 Å²	149	146.2 Å²	146.2	80%	0.797	79%	0.794	S	S	*	*			trans	38.3	116.4	152.3	-75.7	-43.6	0	0	0	123.3
423	Y	26.7	Very low	30.5	Very low	209 Å²	209	148.2 Å²	148.2	82%	0.82	79%	0.794	S	S	*	*				30.2	116.8	123.6	-81.9	-88	0	0	0	120.1
424	N	25.4	Very low	31	Very low	158 Å²	158	146.8 Å²	146.8	85%	0.845	79%	0.79	S	S	*	*				-163.8	137.2	120	-111.5	-75.4	0	0	0	112.2
425	S	33.1	Very low	31.6	Very low	114 Å²	114	152.2 Å²	152.2	80%	0.797	79%	0.79	S	S	*	*			trans	-116.8	121.4	175.9	-68	0	0	0	0	112.5
426	P	29.3	Very low	32.3	Very low	119 Å²	119	150.5 Å²	150.5	77%	0.773	78%	0.784	S	S	*	*			trans	-116.8	98.4	167.8	34.6	-22	0	0	0	113
427	K	27.2	Very low	33.4	Very low	200 Å²	200	154.3 Å²	154.3	87%	0.87	78%	0.783	S	S	*	*			trans	25.7	124.9	135.6	-59.4	172.2	-176.7	174.9	0	118.5
428	F	29.8	Very low	34.2	Very low	208 Å²	208	149.4 Å²	149.4	91%	0.912	77%	0.766	S	S	*	*			trans	-35.4	142.3	164.8	-86.7	-99.7	0	0	0	115.2
429	R	32.6	Very low	34.7	Very low	247 Å²	247	146.3 Å²	146.3	93%	0.932	75%	0.752	S	S	*	*			trans	-120.3	153.2	148.7	-78.3	-167.8	175.3	-118.9	2.5	110
430	S	35.1	Very low	34.8	Very low	106 Å²	106	145 Å²	145	74%	0.741	75%	0.746	S	S	*	*			trans	-83.4	142.7	-160.3	44	0	0	0	0	115	N432	S430-N432 PolarHBondContact O-N 3.21Å
431	R	38.6	Very low	35.5	Very low	254 Å²	254	145.9 Å²	145.9	96%	0.958	74%	0.742	S	S	*	*	S	Bend	trans	-73.7	39.8	178.3	-165.6	-174.2	176	175	-1.1	112.9
432	N	34.9	Very low	36.2	Very low	132 Å²	132	147.4 Å²	147.4	71%	0.706	74%	0.736	S	S	*	*			trans	-132.1	37.1	-169.6	-149.4	-14.1	0	0	0	114.2	S430	S430-N432 PolarHBondContact O-N 3.21Å
433	Q	37.8	Very low	36.9	Very low	148 Å²	148	144.8 Å²	144.8	69%	0.692	73%	0.729	S	S	*	*	S	Bend	trans	-133.2	-7.8	172.6	-137.5	179.4	54.5	0	0	114.5
434	S	40.7	Very low	37.5	Very low	94 Å²	94	142.8 Å²	142.8	66%	0.657	73%	0.727	S	S	*	*	S	Bend	trans	-83.8	-35.2	178.1	-48.4	0	0	0	0	112.9	R437 A438	S434-R437 PolarHBondContact O-N 2.73Å; S434-R437 VanDerWaalsContact O-N 3.09Å; S434-A438 PolarHBondContact O-N 2.82Å
435	Y	41.3	Very low	38.1	Very low	185 Å²	185	138.8 Å²	138.8	73%	0.725	72%	0.717	S	S	*	*	H	α-helix	trans	-60	-52.2	-176	-167.5	-106.3	0	0	0	111.8	R437 A438 V439	Y435-R437 PolarHBondContact O-N 2.73Å; Y435-A438 PolarHBondContact O-N 3.44Å; Y435-V439 VanDerWaalsContact O-CG2 3.25Å; Y435-V439 WeakPolarHBondContact O-CG2 3.33Å; Y435-V439 PolarHBondContact O-N 2.75Å
436	M	43.7	Very low	38.4	Very low	141 Å²	141	138 Å²	138	70%	0.695	71%	0.711	S	S	*	*	H	α-helix	trans	-53	-27.2	174.1	-77	-68.5	-70.2	0	0	114.3	S440	M436-S440 PolarHBondContact O-OG 2.88Å
437	R	46.4	Very low	38.8	Very low	177 Å²	177	137 Å²	137	67%	0.668	71%	0.706	S	S	*	*	H	α-helix	trans	-85.3	-26.8	-179	-155.6	179.9	-59.7	-175.8	3.6	112.8	S434 Y435	S434-R437 PolarHBondContact O-N 2.73Å; S434-R437 VanDerWaalsContact O-N 3.09Å; Y435-R437 PolarHBondContact O-N 2.73Å
438	A	44.9	Very low	39.6	Very low	59 Å²	59	133.7 Å²	133.7	49%	0.488	70%	0.702	S	S	.	*	H	α-helix	trans	-76.5	-39.7	179	0	0	0	0	0	112.8	S434 Y435 S440 T441 L442	S434-A438 PolarHBondContact O-N 2.82Å; Y435-A438 PolarHBondContact O-N 3.44Å; A438-S440 VanDerWaalsContact C-N 3.32Å; A438-S440 PolarHBondContact O-N 3.22Å; A438-T441 PolarHBondContact O-N 2.85Å; A438-T441 PolarHBondContact O-OG1 3.3Å; A438-L442 PolarHBondContact O-N 3.42Å
439	V	44.3	Very low	40.1	Very low	76 Å²	76	128.6 Å²	128.6	46%	0.461	69%	0.692	S	S	.	*	H	α-helix	trans	-64.6	-34.7	176.8	-107.8	0	0	0	0	112.5	Y435 T441 L442 S443	Y435-V439 VanDerWaalsContact O-CG2 3.25Å; Y435-V439 WeakPolarHBondContact O-CG2 3.33Å; Y435-V439 PolarHBondContact O-N 2.75Å; V439-T441 VanDerWaalsContact C-N 3.29Å; V439-T441 PolarHBondContact O-N 3.35Å; V439-L442 PolarHBondContact O-N 3.38Å; V439-S443 PolarHBondContact O-N 2.79Å
440	S	39	Very low	40.5	Very low	85 Å²	85	125.3 Å²	125.3	59%	0.594	69%	0.687	S	S	*	*	H	α-helix	trans	-64.8	-28.5	177.4	-60.5	0	0	0	0	114	M436 A438	M436-S440 PolarHBondContact O-OG 2.88Å; A438-S440 VanDerWaalsContact C-N 3.32Å; A438-S440 PolarHBondContact O-N 3.22Å
441	T	44.2	Very low	40.7	Very low	106 Å²	106	126.2 Å²	126.2	65%	0.65	69%	0.688	S	S	*	*	H	α-helix	trans	-81.8	-32.4	177	40.5	0	0	0	0	113.1	A438 V439	A438-T441 PolarHBondContact O-N 2.85Å; A438-T441 PolarHBondContact O-OG1 3.3Å; V439-T441 VanDerWaalsContact C-N 3.29Å; V439-T441 PolarHBondContact O-N 3.35Å
442	L	40.9	Very low	41	Very low	129 Å²	129	118.2 Å²	118.2	68%	0.675	67%	0.671	S	S	*	*	H	α-helix	trans	-72.3	-36.7	177.7	-173.6	59.4	0	0	0	112	A438 V439 Q444 A445	A438-L442 PolarHBondContact O-N 3.42Å; V439-L442 PolarHBondContact O-N 3.38Å; L442-Q444 PolarHBondContact O-N 3.39Å; L442-A445 PolarHBondContact O-N 3.19Å; L442-A445 VanDerWaalsContact O-N 3.15Å
443	S	39	Very low	41.2	Very low	94 Å²	94	119.5 Å²	119.5	66%	0.657	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	-12.5	179.7	-174.6	0	0	0	0	114.8	V439	V439-S443 PolarHBondContact O-N 2.79Å
444	Q	39.2	Very low	41.6	Very low	166 Å²	166	116.8 Å²	116.8	78%	0.776	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	-8	179.7	-160.9	163.4	104.1	0	0	113.7	L442	L442-Q444 PolarHBondContact O-N 3.39Å
445	A	38	Very low	41.7	Very low	75 Å²	75	119.7 Å²	119.7	62%	0.62	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-20.7	173	0	0	0	0	0	113.2	L442 C447	L442-A445 PolarHBondContact O-N 3.19Å; L442-A445 VanDerWaalsContact O-N 3.15Å; A445-C447 PolarHBondContact O-N 3.23Å; A445-C447 VanDerWaalsContact O-N 3.09Å
446	S	38.8	Very low	42	Very low	96 Å²	96	116.8 Å²	116.8	67%	0.671	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	20.2	-169.9	-167.3	0	0	0	0	115.4
447	C	39.4	Very low	42.1	Very low	100 Å²	100	115.3 Å²	115.3	68%	0.676	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.2	12.5	-170.8	57.5	0	0	0	0	115.3	A445	A445-C447 PolarHBondContact O-N 3.23Å; A445-C447 VanDerWaalsContact O-N 3.09Å
448	V	42.9	Very low	42.2	Very low	129 Å²	129	109.3 Å²	109.3	78%	0.782	66%	0.663	S	S	*	*	S	Bend	trans	-118.1	-2.3	-179.4	-169	0	0	0	0	112.9
449	S	41.1	Very low	42.1	Very low	101 Å²	101	113.9 Å²	113.9	71%	0.706	67%	0.674	S	S	*	*	S	Bend	trans	-125.3	48.2	-172.9	-166.3	0	0	0	0	114
450	Q	39.5	Very low	42	Very low	179 Å²	179	117.5 Å²	117.5	84%	0.836	68%	0.684	S	S	*	*			trans	-136.7	52.7	172.9	-74.9	-165.7	-22	0	0	112.2
451	V	39.7	Very low	42.5	Very low	125 Å²	125	120.3 Å²	120.3	76%	0.758	69%	0.687	S	S	*	*	S	Bend	trans	-139.7	26.4	177.5	-150.3	0	0	0	0	112.8
452	S	45.9	Very low	42.5	Very low	85 Å²	85	118.8 Å²	118.8	59%	0.594	68%	0.681	S	S	*	*	S	Bend	trans	-148.4	17.3	-172.2	62.2	0	0	0	0	116.8
453	E	38.8	Very low	42.9	Very low	159 Å²	159	117 Å²	117	74%	0.743	68%	0.675	S	S	*	*	S	Bend	trans	-116.3	-16.6	173.8	-69.9	-175.7	117.1	0	0	113.8
454	A	45.7	Very low	43.1	Very low	91 Å²	91	115.4 Å²	115.4	75%	0.752	66%	0.664	S	S	*	*	H	α-helix	trans	-81.2	-35.5	-177	0	0	0	0	0	113.9
455	E	42.5	Very low	43.4	Very low	155 Å²	155	114.7 Å²	114.7	72%	0.724	66%	0.661	S	S	*	*	H	α-helix	trans	-79.2	-20.9	-174.9	-69.7	-178.8	132.1	0	0	113.4
456	I	48.2	Very low	43.8	Very low	125 Å²	125	115.1 Å²	115.1	64%	0.641	66%	0.659	S	S	*	*	H	α-helix	trans	-80.6	-36.3	-178.3	-73.2	173.6	0	0	0	112.4
457	N	46.5	Very low	44.3	Very low	110 Å²	110	115.4 Å²	115.4	59%	0.588	66%	0.656	S	S	*	*	H	α-helix	trans	-72.8	-39.6	-178.1	-71	-23	0	0	0	112.7	Q459 F460	N457-Q459 PolarHBondContact O-N 2.69Å; N457-Q459 VanDerWaalsContact O-N 3.12Å; N457-F460 PolarHBondContact O-N 3.38Å; N457-F460 VanDerWaalsContact O-N 3.12Å
458	G	46.9	Very low	44.5	Very low	51 Å²	51	117.9 Å²	117.9	53%	0.526	66%	0.656	S	S	.	*	H	α-helix	trans	-64.6	-17.2	-178.5	0	0	0	0	0	114.8
459	Q	43.7	Very low	44.5	Very low	155 Å²	155	115.3 Å²	115.3	72%	0.724	64%	0.644	S	S	*	*	H	α-helix	trans	-91	-9.6	178.7	-152.9	167.6	19.3	0	0	113.5	N457 V463	N457-Q459 PolarHBondContact O-N 2.69Å; N457-Q459 VanDerWaalsContact O-N 3.12Å; Q459-V463 WeakPolarHBondContact O-CG2 3.47Å
460	F	43	Very low	44.5	Very low	151 Å²	151	118.2 Å²	118.2	66%	0.662	65%	0.646	S	S	*	*	H	α-helix	trans	-92.5	-46.9	176.9	-171.5	-106.7	0	0	0	112.2	N457 S462 V463 C464	N457-F460 PolarHBondContact O-N 3.38Å; N457-F460 VanDerWaalsContact O-N 3.12Å; F460-S462 VanDerWaalsContact C-N 3.32Å; F460-S462 PolarHBondContact O-N 3.1Å; F460-V463 PolarHBondContact O-N 3.24Å; F460-V463 VanDerWaalsContact O-N 3.12Å; F460-C464 PolarHBondContact O-N 3.01Å
461	E	48.8	Very low	44.8	Very low	144 Å²	144	115.6 Å²	115.6	67%	0.673	64%	0.642	S	S	*	*	H	α-helix	trans	-58.1	-42.2	178	-76	-178.6	127.3	0	0	112.2	V463 C464 E465	E461-V463 VanDerWaalsContact C-N 3.26Å; E461-V463 PolarHBondContact O-N 2.93Å; E461-C464 PolarHBondContact O-N 3.41Å; E461-C464 VanDerWaalsContact O-N 3.15Å; E461-E465 PolarHBondContact O-N 2.85Å
462	S	44.3	Very low	44.9	Very low	74 Å²	74	117.4 Å²	117.4	52%	0.517	64%	0.642	S	S	.	*	H	α-helix	trans	-59.7	-31.8	177.7	173.4	0	0	0	0	113.8	F460 S466	F460-S462 VanDerWaalsContact C-N 3.32Å; F460-S462 PolarHBondContact O-N 3.1Å; S462-S466 WeakPolarHBondContact O-CB 3.46Å; S462-S466 PolarHBondContact O-N 3.34Å
463	V	49.2	Very low	44.7	Very low	91 Å²	91	118.1 Å²	118.1	55%	0.552	65%	0.647	S	S	*	*	H	α-helix	trans	-77.8	-36	178.2	176.3	0	0	0	0	110.7	Q459 F460 E461 V467	Q459-V463 WeakPolarHBondContact O-CG2 3.47Å; F460-V463 PolarHBondContact O-N 3.24Å; F460-V463 VanDerWaalsContact O-N 3.12Å; E461-V463 VanDerWaalsContact C-N 3.26Å; E461-V463 PolarHBondContact O-N 2.93Å; V463-V467 WeakPolarHBondContact O-CG2 3.33Å
464	C	42.9	Very low	44.8	Very low	62 Å²	62	119.6 Å²	119.6	42%	0.419	65%	0.654	S	S	.	*	H	α-helix	trans	-66.7	-44.9	172.7	-66	0	0	0	0	112	F460 E461 S466 V467 F468	F460-C464 PolarHBondContact O-N 3.01Å; E461-C464 PolarHBondContact O-N 3.41Å; E461-C464 VanDerWaalsContact O-N 3.15Å; C464-S466 PolarHBondContact O-N 2.94Å; C464-V467 PolarHBondContact O-N 3.1Å; C464-F468 WeakPolarHBondContact O-CD2 3.34Å
465	E	46.5	Very low	44.5	Very low	151 Å²	151	118.9 Å²	118.9	71%	0.706	65%	0.648	S	S	*	*	H	α-helix	trans	-63.1	-40.6	-179.5	-166.6	170.6	-145.3	0	0	111.9	E461 V467 F468 S469	E461-E465 PolarHBondContact O-N 2.85Å; E465-V467 VanDerWaalsContact C-N 3.3Å; E465-V467 PolarHBondContact O-N 2.93Å; E465-F468 PolarHBondContact O-N 2.81Å; E465-S469 PolarHBondContact O-N 2.9Å; E465-S469 VanDerWaalsContact O-N 3.11Å
466	S	46.3	Very low	44.4	Very low	84 Å²	84	120.2 Å²	120.2	59%	0.587	66%	0.657	S	S	*	*	H	α-helix	trans	-65.5	-25.7	-179.8	-170.9	0	0	0	0	114.7	S462 C464	S462-S466 WeakPolarHBondContact O-CB 3.46Å; S462-S466 PolarHBondContact O-N 3.34Å; C464-S466 PolarHBondContact O-N 2.94Å
467	V	47.6	Very low	44.2	Very low	101 Å²	101	122.1 Å²	122.1	61%	0.612	67%	0.668	S	S	*	*	H	α-helix	trans	-86.3	-24.9	-178.8	175.8	0	0	0	0	112	V463 C464 E465	V463-V467 WeakPolarHBondContact O-CG2 3.33Å; C464-V467 PolarHBondContact O-N 3.1Å; E465-V467 VanDerWaalsContact C-N 3.3Å; E465-V467 PolarHBondContact O-N 2.93Å
468	F	45.3	Very low	43.7	Very low	152 Å²	152	121.2 Å²	121.2	67%	0.667	68%	0.676	S	S	*	*	H	α-helix	trans	-93.4	-25.2	178.2	-75.7	-79	0	0	0	113.8	C464 E465 E470 V471	C464-F468 WeakPolarHBondContact O-CD2 3.34Å; E465-F468 PolarHBondContact O-N 2.81Å; F468-E470 VanDerWaalsContact C-N 3.27Å; F468-E470 PolarHBondContact O-N 2.64Å; F468-V471 PolarHBondContact O-N 2.86Å
469	S	42.3	Very low	43.2	Very low	76 Å²	76	127.6 Å²	127.6	53%	0.531	70%	0.697	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.4	-24.5	177.8	-172.9	0	0	0	0	114.2	E465 S473	E465-S469 PolarHBondContact O-N 2.9Å; E465-S469 VanDerWaalsContact O-N 3.11Å; S469-S473 PolarHBondContact O-OG 2.74Å; S469-S473 VanDerWaalsContact O-OG 3.14Å
470	E	41.1	Very low	42.7	Very low	162 Å²	162	127.1 Å²	127.1	76%	0.757	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-27.7	-179.8	-165.8	167.5	-170	0	0	112.1	F468	F468-E470 VanDerWaalsContact C-N 3.27Å; F468-E470 PolarHBondContact O-N 2.64Å
471	V	45.1	Very low	42.4	Very low	123 Å²	123	126.8 Å²	126.8	75%	0.745	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-11.9	-174.4	90.8	0	0	0	0	114.6	F468	F468-V471 PolarHBondContact O-N 2.86Å
472	E	41.4	Very low	41.9	Very low	164 Å²	164	125.6 Å²	125.6	77%	0.766	71%	0.709	S	S	*	*	S	Bend	trans	-95.8	-11.4	176	-164.2	162.6	-150.4	0	0	112.8	Q474	E472-Q474 VanDerWaalsContact C-N 3.27Å; E472-Q474 PolarHBondContact O-N 2.76Å
473	S	42.3	Very low	41.3	Very low	100 Å²	100	126 Å²	126	70%	0.699	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	3.6	-173.8	-64.3	0	0	0	0	115.1	S469	S469-S473 PolarHBondContact O-OG 2.74Å; S469-S473 VanDerWaalsContact O-OG 3.14Å
474	Q	41.7	Very low	40.6	Very low	190 Å²	190	127.5 Å²	127.5	89%	0.888	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.1	38.8	-173.5	-154.2	177.8	8.2	0	0	114.1	E472	E472-Q474 VanDerWaalsContact C-N 3.27Å; E472-Q474 PolarHBondContact O-N 2.76Å
475	A	39.6	Very low	40.2	Very low	76 Å²	76	132.8 Å²	132.8	63%	0.628	75%	0.754	S	S	*	*	S	Bend	trans	-136.4	13.7	-177.9	0	0	0	0	0	115.8
476	M	40.5	Very low	39.7	Very low	183 Å²	183	137.1 Å²	137.1	90%	0.901	76%	0.763	S	S	*	*			trans	-131.7	52.5	-172.2	-69.7	-67.4	153.7	0	0	114.2
477	D	42.8	Very low	39.3	Very low	164 Å²	164	139.3 Å²	139.3	88%	0.877	77%	0.773	S	S	*	*	S	Bend	trans	-145.3	56.9	167.2	-166.6	24.4	0	0	0	111.9
478	A	36.3	Very low	38.7	Very low	92 Å²	92	146.1 Å²	146.1	76%	0.76	79%	0.788	S	S	*	*			trans	-159.5	45.2	-178.6	0	0	0	0	0	115.6
479	L	35.7	Very low	38	Very low	184 Å²	184	144 Å²	144	96%	0.963	79%	0.792	S	S	*	*			trans	-155.7	108.2	156.7	-83.8	-167.4	0	0	0	110.8
480	D	33.8	Very low	38.4	Very low	146 Å²	146	147 Å²	147	78%	0.781	80%	0.798	S	S	*	*			trans	-116.9	162.8	168.4	-173.4	24.6	0	0	0	110.2
481	L	36.3	Very low	38.6	Very low	144 Å²	144	143.4 Å²	143.4	75%	0.754	79%	0.79	S	S	*	*			trans	72.9	146.6	-179	-49.1	177.7	0	0	0	116.2
482	P	38.8	Very low	38.7	Very low	119 Å²	119	146.2 Å²	146.2	77%	0.773	79%	0.789	S	S	*	*			cis	-130.6	146.8	-38.6	36.2	-22.6	0	0	0	111.9
483	G	31.1	Very low	39.4	Very low	82 Å²	82	144 Å²	144	85%	0.845	78%	0.782	S	S	*	*			trans	-79.8	151.8	179.3	0	0	0	0	0	114.1
484	C	34.3	Very low	39.9	Very low	122 Å²	122	146.9 Å²	146.9	82%	0.824	78%	0.777	S	S	*	*				-156.6	134.7	126.3	-155.6	0	0	0	0	113.7
485	F	35	Very low	40.3	Very low	173 Å²	173	141.5 Å²	141.5	76%	0.759	77%	0.765	S	S	*	*			trans	-51.6	158.9	177	-58.9	-100.2	0	0	0	115.8
486	R	36.3	Very low	40.9	Very low	242 Å²	242	143.1 Å²	143.1	91%	0.913	76%	0.762	S	S	*	*				-159.9	88.2	124	-105.1	148.9	-157.6	-78.2	-2.2	114.6
487	T	37.4	Very low	41	Very low	130 Å²	130	142.4 Å²	142.4	80%	0.798	76%	0.756	S	S	*	*			trans	-63.7	142.4	157.8	47.1	0	0	0	0	111
488	R	34.6	Very low	41.1	Very low	245 Å²	245	138.9 Å²	138.9	93%	0.925	75%	0.75	S	S	*	*			trans	-138.9	80.7	-179.9	-163.8	-176.2	-172.1	-95.4	5.4	115.2
489	S	32.6	Very low	41.5	Very low	107 Å²	107	137.6 Å²	137.6	75%	0.748	75%	0.746	S	S	*	*			trans	-145	149.3	138.4	75.2	0	0	0	0	110
490	H	49.7	Very low	41.6	Very low	140 Å²	140	140.1 Å²	140.1	65%	0.648	74%	0.744	S	S	*	*			trans	-126.9	42.7	-156.5	-165.4	75.9	0	0	0	112.4	R494	H490-R494 PolarHBondContact O-NH2 2.94Å
491	S	44.6	Very low	41.9	Very low	86 Å²	86	138.2 Å²	138.2	60%	0.601	74%	0.742	S	S	*	*	S	Bend	trans	-99.1	-48.8	-180	47.1	0	0	0	0	112.6	L493	S491-L493 PolarHBondContact O-N 2.85Å
492	Y	47.2	Very low	41.8	Very low	182 Å²	182	139 Å²	139	71%	0.714	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	-46.7	-166.4	-162.1	-107.4	0	0	0	114.5	R494 A495 I496	Y492-R494 VanDerWaalsContact C-N 3.25Å; Y492-R494 PolarHBondContact O-N 3.25Å; Y492-R494 VanDerWaalsContact O-N 3.13Å; Y492-A495 PolarHBondContact O-N 2.83Å; Y492-A495 VanDerWaalsContact O-N 3.1Å; Y492-I496 HydrophobicContact CD1-CD1 4.24Å; Y492-I496 HydrophobicContact CE1-CD1 4Å
493	L	56.6	Low	41.4	Very low	117 Å²	117	139.1 Å²	139.1	61%	0.613	74%	0.736	S	S	*	*	H	α-helix	trans	-60.5	-27.7	-173.3	-71.5	171	0	0	0	114.5	S491 A495	S491-L493 PolarHBondContact O-N 2.85Å; L493-A495 VanDerWaalsContact C-N 3.35Å
494	R	52.1	Low	41.7	Very low	161 Å²	161	141.9 Å²	141.9	61%	0.608	73%	0.732	S	S	*	*	H	α-helix	trans	-77.1	-16.8	179.3	-87.9	-175.5	-69.3	-136.7	-9.8	114.4	H490 Y492	H490-R494 PolarHBondContact O-NH2 2.94Å; Y492-R494 VanDerWaalsContact C-N 3.25Å; Y492-R494 PolarHBondContact O-N 3.25Å; Y492-R494 VanDerWaalsContact O-N 3.13Å
495	A	50.7	Low	41.7	Very low	77 Å²	77	144 Å²	144	64%	0.636	73%	0.729	S	S	*	*	H	α-helix	trans	-74.1	-30.9	176	0	0	0	0	0	112.1	Y492 L493	Y492-A495 PolarHBondContact O-N 2.83Å; Y492-A495 VanDerWaalsContact O-N 3.1Å; L493-A495 VanDerWaalsContact C-N 3.35Å
496	I	51.8	Low	41.5	Very low	109 Å²	109	141.6 Å²	141.6	56%	0.559	73%	0.733	S	S	*	*	H	α-helix	trans	-77.4	-33	-173.5	-56.5	175.9	0	0	0	111.6	Y492 A498	Y492-I496 HydrophobicContact CD1-CD1 4.24Å; Y492-I496 HydrophobicContact CE1-CD1 4Å; I496-A498 VanDerWaalsContact C-N 3.25Å; I496-A498 PolarHBondContact O-N 3.27Å
497	Q	43.1	Very low	41.3	Very low	168 Å²	168	136.4 Å²	136.4	79%	0.785	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	2.2	-175.4	-64.2	-175.4	-66.9	0	0	115.1
498	A	44.4	Very low	41.5	Very low	91 Å²	91	135.4 Å²	135.4	75%	0.752	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.3	12.9	-170.5	0	0	0	0	0	114.6	I496	I496-A498 VanDerWaalsContact C-N 3.25Å; I496-A498 PolarHBondContact O-N 3.27Å
499	G	45.7	Very low	41.2	Very low	64 Å²	64	130.3 Å²	130.3	66%	0.66	71%	0.706	S	S	*	*			trans	-147	40.6	-168	0	0	0	0	0	116.1
500	Y	37.2	Very low	41	Very low	237 Å²	237	132.7 Å²	132.7	93%	0.929	71%	0.707	S	S	*	*			trans	-135.8	114.3	177.4	-125.9	-92.6	0	0	0	113
501	S	39.8	Very low	40.2	Very low	107 Å²	107	130.1 Å²	130.1	75%	0.748	70%	0.701	S	S	*	*			trans	-174.1	134.6	173.8	54.7	0	0	0	0	107.1
502	Q	35.6	Very low	39.9	Very low	160 Å²	160	132 Å²	132	75%	0.748	71%	0.712	S	S	*	*			cis	-161	-179.1	-5.2	-151	-179.6	-88.1	0	0	107.9
503	D	30.1	Very low	39	Very low	122 Å²	122	127.7 Å²	127.7	65%	0.652	71%	0.708	S	S	*	*			trans	70	143.2	159.5	-39.5	-34.4	0	0	0	119.4
504	D	36.3	Very low	37.6	Very low	139 Å²	139	129.2 Å²	129.2	74%	0.743	72%	0.717	S	S	*	*			cis	-160.4	167.6	-39.2	-130.1	-38.1	0	0	0	114.1
505	E	34.7	Very low	36.6	Very low	167 Å²	167	129.5 Å²	129.5	78%	0.78	73%	0.728	S	S	*	*			trans	57.5	135.3	155.7	-64.5	-163.6	127.8	0	0	126.3
506	C	31.8	Very low	35.5	Very low	122 Å²	122	131.7 Å²	131.7	82%	0.824	73%	0.734	S	S	*	*			trans	94.7	141.8	141.5	-81.5	0	0	0	0	125.2
507	I	31.2	Very low	34.3	Very low	133 Å²	133	131.4 Å²	131.4	68%	0.682	74%	0.742	S	S	*	*			trans	-144.8	158.2	-165.7	-95.9	171.5	0	0	0	105.4
508	P	41.8	Very low	33.7	Very low	109 Å²	109	128.9 Å²	128.9	71%	0.708	74%	0.738	S	S	*	*			cis	-145.1	172.6	38.7	26.2	1	0	0	0	120.4
509	M	28.8	Very low	33	Very low	138 Å²	138	131 Å²	131	68%	0.68	74%	0.735	S	S	*	*			trans	1.7	141.2	147.2	-52.9	164.9	106.1	0	0	121.8
510	M	28.3	Very low	32.3	Very low	158 Å²	158	138.5 Å²	138.5	78%	0.778	74%	0.744	S	S	*	*				180	159.6	104.5	-94.2	-64.7	148.7	0	0	113.8
511	T	33	Very low	31.9	Very low	85 Å²	85	131.9 Å²	131.9	52%	0.521	73%	0.732	S	S	.	*			trans	-101.2	178.4	169.6	46.6	0	0	0	0	109.6	D282	D282-T511 PolarHBondContact OD2-OG1 3.21Å
512	P	37.7	Very low	31.4	Very low	127 Å²	127	133.1 Å²	133.1	83%	0.825	74%	0.735	S	S	*	*			cis	-136.9	-121.5	16.9	42.1	-18.6	0	0	0	115.5
513	S	29.3	Very low	31.2	Very low	91 Å²	91	130.4 Å²	130.4	64%	0.636	74%	0.74	S	S	*	*			trans	-120.1	167	-147.2	-41	0	0	0	0	117.8
514	D	26.6	Very low	31.1	Very low	148 Å²	148	128.6 Å²	128.6	79%	0.791	74%	0.742	S	S	*	*			trans	74.4	177.4	145.6	-63.6	-42	0	0	0	122.4
515	I	30.1	Very low	31	Very low	167 Å²	167	128.4 Å²	128.4	86%	0.856	75%	0.746	S	S	*	*			trans	72.2	169.6	175	53.2	171.2	0	0	0	120.6
516	T	28	Very low	30.9	Very low	123 Å²	123	124.6 Å²	124.6	76%	0.755	74%	0.738	S	S	*	*			trans	-136.7	135.8	-131.3	-32.4	0	0	0	0	114.7
517	S	27.6	Very low	30.8	Very low	104 Å²	104	128.6 Å²	128.6	73%	0.727	74%	0.737	S	S	*	*			trans	69.7	158.5	153.7	77	0	0	0	0	122.1
518	T	29	Very low	30.8	Very low	114 Å²	114	127.3 Å²	127.3	70%	0.699	74%	0.736	S	S	*	*			trans	105.4	92.6	143.7	-54.2	0	0	0	0	122.2
519	I	30.7	Very low	30.1	Very low	136 Å²	136	127.1 Å²	127.1	70%	0.697	73%	0.729	S	S	*	*			trans	52.5	112.3	131	-50	172.2	0	0	0	123
520	R	30	Very low	30.3	Very low	222 Å²	222	129.6 Å²	129.6	84%	0.838	73%	0.732	S	S	*	*				-173.8	127.9	120.5	-113.2	159.7	-91	-131.4	-2.7	110.3
521	S	29.6	Very low	30.3	Very low	98 Å²	98	130.8 Å²	130.8	69%	0.685	73%	0.732	S	S	*	*				65.5	142	84.7	-42.3	0	0	0	0	114
522	T	30.1	Very low	30.2	Very low	133 Å²	133	135.3 Å²	135.3	82%	0.816	75%	0.745	S	S	*	*			cis	-157.6	165	39.5	44.1	0	0	0	0	115.2
523	A	31	Very low	29.8	Very low	103 Å²	103	135.4 Å²	135.4	85%	0.851	74%	0.743	S	S	*	*			trans	62.4	149.9	154.1	0	0	0	0	0	120.4
524	A	28	Very low	31.3	Very low	84 Å²	84	136.5 Å²	136.5	69%	0.694	75%	0.748	S	S	*	*			cis	-138.1	138.2	-4.5	0	0	0	0	0	109.8
525	V	33.4	Very low	32.9	Very low	135 Å²	135	134.9 Å²	134.9	82%	0.818	75%	0.746	S	S	*	*				40.8	131	86.3	-110.9	0	0	0	0	115.3
526	S	32.8	Very low	33.9	Very low	87 Å²	87	132 Å²	132	61%	0.608	74%	0.738	S	S	*	*			cis	-142.4	-161	17.3	-52.1	0	0	0	0	111.6
527	Y	29.1	Very low	34	Very low	205 Å²	205	132.9 Å²	132.9	80%	0.804	74%	0.743	S	S	*	*			cis	-164.1	171.7	6.9	-129.6	-19.4	0	0	0	112.7
528	T	31.8	Very low	35.5	Very low	107 Å²	107	133.2 Å²	133.2	66%	0.656	74%	0.743	S	S	*	*			trans	41.2	139.9	151.6	55.2	0	0	0	0	123.9
529	N	28.1	Very low	36.7	Very low	105 Å²	105	132.5 Å²	132.5	56%	0.561	74%	0.74	S	S	*	*			cis	-175.8	152.5	-23.4	-128.9	-26.4	0	0	0	112.8
530	Y	31.9	Very low	37.1	Very low	190 Å²	190	137.2 Å²	137.2	75%	0.745	75%	0.749	S	S	*	*			trans	64.6	152.9	157.3	-55.6	-40	0	0	0	120.7
531	K	29	Very low	37.5	Very low	182 Å²	182	133 Å²	133	79%	0.791	75%	0.748	S	S	*	*			cis	-173.9	146.4	-27.5	-150.2	-178.3	-174.9	170.7	0	112.3
532	K	30.6	Very low	37.7	Very low	181 Å²	181	134.4 Å²	134.4	79%	0.787	75%	0.752	S	S	*	*			trans	82	103.8	142.4	-146.9	174.1	-175.6	-166.4	0	125
533	T	29.4	Very low	37.7	Very low	129 Å²	129	133.1 Å²	133.1	79%	0.791	75%	0.749	S	S	*	*			trans	41	161.1	130.5	25.7	0	0	0	0	126.6
534	P	60	Low	37.9	Very low	113 Å²	113	137.8 Å²	137.8	73%	0.734	75%	0.75	S	S	*	*			trans	-96.5	-161.6	-162.3	44.6	-43.3	0	0	0	115.1
535	P	60.6	Low	39.6	Very low	115 Å²	115	139.2 Å²	139.2	75%	0.747	75%	0.752	S	S	*	*			cis	-129.3	-131.5	8.4	31	-1.8	0	0	0	113.3
536	P	52.1	Low	39.6	Very low	106 Å²	106	140.9 Å²	140.9	69%	0.688	76%	0.756	S	S	*	*			cis	-149.5	127.5	-8.6	36.9	-10.8	0	0	0	121.9
537	V	29.5	Very low	39.7	Very low	142 Å²	142	144.3 Å²	144.3	86%	0.861	77%	0.766	S	S	*	*			trans	62.7	-173.7	146.6	-121.9	0	0	0	0	121.6
538	P	58.1	Low	39.9	Very low	111 Å²	111	139.8 Å²	139.8	72%	0.721	76%	0.764	S	S	*	*			trans	-131.4	-135.2	-137.9	47.2	-23.3	0	0	0	113.9
539	P	54.5	Low	39.9	Very low	98 Å²	98	140.9 Å²	140.9	64%	0.636	77%	0.77	S	S	*	*			cis	-130.9	-179.7	-33.6	40.4	-25.1	0	0	0	114.7
540	R	38.5	Very low	40	Very low	235 Å²	235	142.4 Å²	142.4	89%	0.887	78%	0.783	S	S	*	*			trans	-177.6	168.2	149	-109.8	168.9	-166.4	87.7	-4.8	119.1
541	T	39.9	Very low	40.1	Very low	134 Å²	134	138.3 Å²	138.3	82%	0.822	79%	0.789	S	S	*	*			trans	-142.2	158.9	168.4	53.4	0	0	0	0	110.1
542	T	32.3	Very low	40.2	Very low	127 Å²	127	138.9 Å²	138.9	78%	0.779	79%	0.794	S	S	*	*			trans	158.9	141.9	145.8	-168.3	0	0	0	0	118
543	S	30.3	Very low	40.2	Very low	107 Å²	107	136.1 Å²	136.1	75%	0.748	80%	0.798	S	S	*	*			trans	54.2	149.5	144	57.9	0	0	0	0	126.6
544	K	37	Very low	40.9	Very low	200 Å²	200	134.5 Å²	134.5	87%	0.87	79%	0.792	S	S	*	*			trans	-113.5	-161.8	170.7	-33.4	174	-177.8	176.9	0	110.1
545	P	62.6	Low	39.8	Very low	114 Å²	114	136.2 Å²	136.2	74%	0.74	80%	0.8	S	S	*	*			cis	-133.8	179	-35.6	40.3	-24.2	0	0	0	114.6
546	L	34.4	Very low	38.7	Very low	170 Å²	170	138.6 Å²	138.6	89%	0.89	80%	0.802	S	S	*	*			trans	175.1	174.4	138.1	-97.2	162.5	0	0	0	113.8
547	I	34.6	Very low	37.9	Very low	160 Å²	160	138.7 Å²	138.7	82%	0.821	81%	0.805	S	S	*	*			trans	-139.4	145.1	-155.1	-59.5	161.7	0	0	0	114.3
548	S	32.1	Very low	38.5	Very low	109 Å²	109	137.5 Å²	137.5	76%	0.762	80%	0.798	S	S	*	*			trans	-162.7	108	151.8	62.8	0	0	0	0	117.7
549	V	32	Very low	37.2	Very low	130 Å²	130	140.5 Å²	140.5	79%	0.788	80%	0.802	S	S	*	*			trans	49	119.3	138.4	-171.6	0	0	0	0	122.6
550	T	29.8	Very low	36.1	Very low	137 Å²	137	142.2 Å²	142.2	84%	0.84	81%	0.806	S	S	*	*				-170.4	146.6	122.2	11.2	0	0	0	0	114.3
551	A	34.9	Very low	35.6	Very low	104 Å²	104	135.5 Å²	135.5	86%	0.86	80%	0.801	S	S	*	*			trans	63.9	159.6	164.5	0	0	0	0	0	120.1
552	Q	32.1	Very low	34.7	Very low	195 Å²	195	139.2 Å²	139.2	91%	0.911	80%	0.802	S	S	*	*			trans	-134.2	121.4	-173.2	-63.4	172.4	-95.8	0	0	112.8
553	S	30.1	Very low	34.6	Very low	122 Å²	122	140.6 Å²	140.6	85%	0.853	80%	0.799	S	S	*	*			trans	-179.9	119.8	148.9	56.2	0	0	0	0	109.6
554	S	42.6	Very low	34.4	Very low	95 Å²	95	141.6 Å²	141.6	66%	0.664	80%	0.796	S	S	*	*			trans	-128.2	133.8	-165.8	-59.1	0	0	0	0	114.4
555	T	38.5	Very low	33.9	Very low	150 Å²	150	136.2 Å²	136.2	92%	0.92	78%	0.783	S	S	*	*			trans	-153.8	116.5	156	46.3	0	0	0	0	109.1
556	E	36.9	Very low	32.2	Very low	165 Å²	165	142.1 Å²	142.1	77%	0.771	79%	0.791	S	S	*	*			trans	-172	138.5	-140.6	-173.8	177.1	-9.6	0	0	109
557	S	35.9	Very low	31.8	Very low	108 Å²	108	137.7 Å²	137.7	76%	0.755	78%	0.779	S	S	*	*			cis	-158.8	-178.7	-13.9	-167.7	0	0	0	0	110.1
558	T	41.8	Very low	31.4	Very low	117 Å²	117	138.3 Å²	138.3	72%	0.718	78%	0.778	S	S	*	*			trans	-95.2	173	159.5	46	0	0	0	0	111.6
559	Q	31.1	Very low	31.1	Very low	173 Å²	173	143.4 Å²	143.4	81%	0.808	78%	0.781	S	S	*	*			trans	79.1	158.3	-179	-52.4	-171.3	-99.7	0	0	114.5
560	D	31.2	Very low	30.8	Very low	134 Å²	134	144.9 Å²	144.9	72%	0.717	78%	0.781	S	S	*	*			cis	-161.8	178.5	-10.8	-129.9	-52.4	0	0	0	113.5
561	A	27.5	Very low	30.6	Very low	95 Å²	95	143.5 Å²	143.5	79%	0.785	78%	0.777	S	S	*	*			trans	75.4	-171.3	146.5	0	0	0	0	0	122.5
562	Y	21.5	Very low	30.2	Very low	212 Å²	212	143.7 Å²	143.7	83%	0.831	77%	0.77	S	S	*	*			trans	-114.1	-171.8	-144.7	-130.5	-110.1	0	0	0	114.7
563	Q	30.6	Very low	30.1	Very low	155 Å²	155	145.9 Å²	145.9	72%	0.724	77%	0.77	S	S	*	*			trans	-49.7	171.5	175.7	-53.6	175.6	0.4	0	0	114.7
564	D	25.1	Very low	30.1	Very low	129 Å²	129	146.1 Å²	146.1	69%	0.69	77%	0.768	S	S	*	*			cis	-167.2	165	34.2	-175.6	35.6	0	0	0	114.1
565	S	26.6	Very low	29.6	Very low	86 Å²	86	149.2 Å²	149.2	60%	0.601	77%	0.772	S	S	*	*			trans	35.8	145.6	153.3	70.2	0	0	0	0	121.2
566	R	26.7	Very low	29	Very low	238 Å²	238	149.5 Å²	149.5	90%	0.898	77%	0.768	S	S	*	*				173.5	152.3	60.3	-174.3	178.6	-171	165.6	4.1	108.7
567	A	26.8	Very low	28.4	Very low	77 Å²	77	144.2 Å²	144.2	64%	0.636	75%	0.75	S	S	*	*			cis	-168.7	176.2	-30.1	0	0	0	0	0	107.2
568	Q	25.5	Very low	28.1	Very low	174 Å²	174	145.8 Å²	145.8	81%	0.813	74%	0.739	S	S	*	*			trans	42.7	111.7	159.3	-64	-177.9	-11.4	0	0	118.5
569	R	26	Very low	27.4	Very low	215 Å²	215	143.3 Å²	143.3	81%	0.811	74%	0.737	S	S	*	*				174.2	161.9	97.6	-98.8	-152.8	-112.4	-155.5	1.9	114
570	M	25	Very low	27.3	Very low	161 Å²	161	140.7 Å²	140.7	79%	0.793	73%	0.728	S	S	*	*			trans	63.8	104	164.7	-57	-59.7	176.1	0	0	118.2
571	S	25.7	Very low	27.1	Very low	108 Å²	108	143.6 Å²	143.6	76%	0.755	73%	0.73	S	S	*	*			trans	-76.5	160.6	131.7	-163	0	0	0	0	107.9
572	P	27.4	Very low	27.1	Very low	109 Å²	109	146.3 Å²	146.3	71%	0.708	73%	0.732	S	S	*	*			cis	-127.4	166.5	8.6	41.7	-27.5	0	0	0	115.9
573	W	30.6	Very low	27.5	Very low	241 Å²	241	141.5 Å²	141.5	91%	0.913	73%	0.729	S	S	*	*			trans	-89.5	151.8	153.7	-65.3	97.4	0	0	0	109.9
574	P	29	Very low	27.3	Very low	126 Å²	126	141.5 Å²	141.5	82%	0.818	74%	0.739	S	S	*	*			trans	-104.2	131.8	133.3	32.4	-28.2	0	0	0	109.1
575	Q	32.6	Very low	27.8	Very low	160 Å²	160	142.2 Å²	142.2	75%	0.748	74%	0.743	S	S	*	*			trans	-117.8	134.2	174.4	174.7	-174.2	-16.6	0	0	108.7	S577	Q575-S577 PolarHBondContact NE2-O 3.02Å; Q575-S577 VanDerWaalsContact NE2-O 3.13Å
576	D	24.6	Very low	28	Very low	157 Å²	157	142.2 Å²	142.2	84%	0.84	74%	0.743	S	S	*	*			trans	-143	125.2	163.4	-103.7	-48.4	0	0	0	109.5
577	S	26.1	Very low	28.5	Very low	54 Å²	54	138.2 Å²	138.2	38%	0.378	74%	0.739	S	S	.	*			cis	-133	-123.3	-11	-43.1	0	0	0	0	107.7	Q575	Q575-S577 PolarHBondContact NE2-O 3.02Å; Q575-S577 VanDerWaalsContact NE2-O 3.13Å
578	R	28.3	Very low	28.7	Very low	140 Å²	140	141.4 Å²	141.4	53%	0.528	75%	0.745	S	S	.	*			cis	-146.2	136.1	-33.1	-138.5	-159.6	-61.5	-73.3	30	109.2	D334 E335	D334-R578 WeakPolarHBondContact O-CD 3.43Å; D334-R578 PolarHBondContact O-NE 2.69Å; D334-R578 PolarHBondContact O-NH1 2.79Å; D334-R578 PolarHBondContact O-NH2 3.32Å; E335-R578 PolarHBondContact O-NE 2.94Å
579	G	27.7	Very low	29.3	Very low	66 Å²	66	138.2 Å²	138.2	68%	0.68	74%	0.742	S	S	*	*			trans	74.8	156	160.3	0	0	0	0	0	117.8
580	L	29.2	Very low	29.7	Very low	118 Å²	118	135.5 Å²	135.5	62%	0.618	74%	0.744	S	S	*	*			cis	-150	176.4	-2.2	-78.1	103.8	0	0	0	111
581	Y	27.3	Very low	30.1	Very low	195 Å²	195	138.1 Å²	138.1	77%	0.765	75%	0.751	S	S	*	*			trans	96.7	113	154.2	-41.6	-62.1	0	0	0	120.3
582	N	27.3	Very low	30.6	Very low	152 Å²	152	138.1 Å²	138.1	81%	0.813	76%	0.757	S	S	*	*			trans	83.3	126.7	142	-74.8	13.4	0	0	0	123.9
583	S	28.5	Very low	30.8	Very low	110 Å²	110	141.2 Å²	141.2	77%	0.769	76%	0.764	S	S	*	*			trans	83.3	98.4	142	-58.7	0	0	0	0	120.7
584	T	27.4	Very low	31	Very low	155 Å²	155	137.1 Å²	137.1	95%	0.951	76%	0.76	S	S	*	*			trans	-134.5	166.4	142.7	50.2	0	0	0	0	110.1
585	D	36	Very low	31.5	Very low	145 Å²	145	139.7 Å²	139.7	78%	0.775	77%	0.766	S	S	*	*			trans	-111.2	176.6	-156.5	-161.3	-87.2	0	0	0	114.4
586	S	30.6	Very low	31.7	Very low	85 Å²	85	136.8 Å²	136.8	59%	0.594	77%	0.77	S	S	*	*			trans	77.2	119.8	152.3	-79.8	0	0	0	0	122.6
587	L	37.8	Very low	32.1	Very low	154 Å²	154	137.5 Å²	137.5	81%	0.806	77%	0.773	S	S	*	*			trans	64.7	159.8	133.8	-54.2	177.3	0	0	0	118.4
588	D	31.2	Very low	32.5	Very low	144 Å²	144	143.7 Å²	143.7	77%	0.77	80%	0.796	S	S	*	*			cis	-147.3	164	13.2	-153.7	-12.2	0	0	0	112.4
589	S	37.1	Very low	32.6	Very low	108 Å²	108	144.2 Å²	144.2	76%	0.755	82%	0.815	S	S	*	*			trans	-99.5	113.6	-174.7	-78.4	0	0	0	0	113.5
590	N	34.7	Very low	32.7	Very low	158 Å²	158	146.1 Å²	146.1	85%	0.845	82%	0.824	S	S	*	*			trans	-157.3	18.6	169.5	-126.9	-61.8	0	0	0	117.9
591	K	32.7	Very low	32.6	Very low	215 Å²	215	145.1 Å²	145.1	94%	0.935	83%	0.833	S	S	*	*	S	Bend	trans	-142.9	48.7	-179	-70.6	-166.5	175.9	-177.3	0	114.9
592	A	36.5	Very low	32.6	Very low	108 Å²	108	140.1 Å²	140.1	89%	0.893	83%	0.832	S	S	*	*			trans	-132	27	-177.4	0	0	0	0	0	114.8
593	M	31.9	Very low	32.7	Very low	174 Å²	174	139.5 Å²	139.5	86%	0.857	82%	0.824	S	S	*	*	S	Bend	trans	-141.6	61.4	-178.6	-170.2	-162.4	137.4	0	0	111.8
594	N	35.5	Very low	32.7	Very low	155 Å²	155	143 Å²	143	83%	0.829	82%	0.821	S	S	*	*	S	Bend	trans	-163.2	25.8	170.9	-126.1	-96.9	0	0	0	116
595	L	38.7	Very low	32.8	Very low	180 Å²	180	144.5 Å²	144.5	94%	0.942	82%	0.816	S	S	*	*			trans	-141	56.9	-176	-72.4	175	0	0	0	112.7
596	A	36.5	Very low	32.3	Very low	100 Å²	100	144.6 Å²	144.6	83%	0.826	82%	0.816	S	S	*	*	S	Bend	trans	-148.1	12.9	178.4	0	0	0	0	0	114.8
597	L	34	Very low	32.7	Very low	172 Å²	172	146.4 Å²	146.4	90%	0.901	83%	0.826	S	S	*	*	S	Bend	trans	-140.5	163.2	175.1	-91.5	164	0	0	0	109.1
598	E	33.6	Very low	32.1	Very low	183 Å²	183	147.3 Å²	147.3	86%	0.855	83%	0.826	S	S	*	*			trans	71.3	62.1	173.6	-154.9	-178.2	-179.3	0	0	118.3
599	T	30.1	Very low	31.8	Very low	151 Å²	151	146.3 Å²	146.3	93%	0.926	83%	0.83	S	S	*	*			trans	-154.7	60.9	144.9	-29.8	0	0	0	0	114.5
600	A	29.3	Very low	31.4	Very low	107 Å²	107	150 Å²	150	88%	0.884	84%	0.835	S	S	*	*			trans	-158.8	55.8	172.6	0	0	0	0	0	114.7
601	A	27.6	Very low	31	Very low	96 Å²	96	147.5 Å²	147.5	79%	0.793	83%	0.831	S	S	*	*			trans	-140.8	145.5	172.4	0	0	0	0	0	111.5
602	A	28.6	Very low	30.7	Very low	91 Å²	91	142.5 Å²	142.5	75%	0.752	82%	0.823	S	S	*	*			trans	67.2	137.9	-169.3	0	0	0	0	0	115.1
603	Q	29.4	Very low	30.2	Very low	139 Å²	139	142.7 Å²	142.7	65%	0.65	82%	0.817	S	S	*	*			cis	-156.9	138.1	-3.3	-119.5	172.2	41.7	0	0	112.2
604	R	28.4	Very low	30	Very low	183 Å²	183	140.3 Å²	140.3	69%	0.691	81%	0.812	S	S	*	*			trans	51.8	128.5	156.4	-46.6	-172.4	-164.8	92.6	7.3	119.7
605	H	28.8	Very low	29.6	Very low	187 Å²	187	143.7 Å²	143.7	87%	0.866	81%	0.814	S	S	*	*				-173.4	157.7	94.9	-98.3	-78.9	0	0	0	111.1
606	L	26	Very low	29.1	Very low	146 Å²	146	141 Å²	141	76%	0.764	81%	0.805	S	S	*	*			trans	-132	135.7	-173.5	175.1	57.1	0	0	0	107.6
607	P	38.6	Very low	28.8	Very low	124 Å²	124	141.3 Å²	141.3	81%	0.805	80%	0.801	S	S	*	*				-146.5	169.7	99.9	38.4	-20.9	0	0	0	116.3
608	E	25.5	Very low	28.5	Very low	172 Å²	172	139 Å²	139	80%	0.804	79%	0.789	S	S	*	*			trans	-78.3	162.9	176.9	-53.6	162.9	98.1	0	0	113.4
609	S	24.9	Very low	28.4	Very low	124 Å²	124	138.6 Å²	138.6	87%	0.867	79%	0.785	S	S	*	*				-174.2	161.3	128.4	33.1	0	0	0	0	112.6
610	Q	28.2	Very low	28.4	Very low	184 Å²	184	135 Å²	135	86%	0.86	77%	0.771	S	S	*	*			trans	-103.2	162.7	-175.8	-56.5	168	-3.2	0	0	111.8
611	S	27.1	Very low	28.3	Very low	106 Å²	106	138.1 Å²	138.1	74%	0.741	77%	0.77	S	S	*	*				143.9	147.5	119.4	64.3	0	0	0	0	116.6
612	S	25.3	Very low	28.5	Very low	111 Å²	111	140.7 Å²	140.7	78%	0.776	77%	0.77	S	S	*	*			trans	57.8	134.1	162.1	49.2	0	0	0	0	119.7
613	S	26.4	Very low	28.5	Very low	111 Å²	111	142.8 Å²	142.8	78%	0.776	77%	0.774	S	S	*	*			cis	98.3	159.3	30.3	-166.9	0	0	0	0	114.1
614	V	28	Very low	28.6	Very low	124 Å²	124	141 Å²	141	75%	0.752	78%	0.776	S	S	*	*			trans	74	115.3	-167	-170.6	0	0	0	0	112.3
615	R	27.6	Very low	28.6	Very low	226 Å²	226	140.2 Å²	140.2	85%	0.853	78%	0.778	S	S	*	*			cis	86.7	157.5	35.2	-61	-164.2	82.4	166	6.1	115.2
616	T	27.3	Very low	28.6	Very low	124 Å²	124	134.7 Å²	134.7	76%	0.761	77%	0.765	S	S	*	*			trans	76	121.9	-174.5	68.9	0	0	0	0	114.2
617	S	29.4	Very low	28.6	Very low	106 Å²	106	134 Å²	134	74%	0.741	76%	0.757	S	S	*	*			cis	87.1	152.4	35.5	83.3	0	0	0	0	112.9
618	D	28.6	Very low	28	Very low	123 Å²	123	136.1 Å²	136.1	66%	0.658	76%	0.756	S	S	*	*			cis	-168.2	173.8	18.6	-161.9	6.7	0	0	0	112.9
619	K	31.6	Very low	28.1	Very low	175 Å²	175	134.2 Å²	134.2	76%	0.761	75%	0.751	S	S	*	*			trans	73.5	159.8	154.7	-53.4	-157.8	-175.1	-174.3	0	122.1
620	A	29.5	Very low	28.4	Very low	76 Å²	76	134.7 Å²	134.7	63%	0.628	74%	0.743	S	S	*	*			cis	-177.4	149.4	-35.5	0	0	0	0	0	110.8
621	I	28.3	Very low	28.5	Very low	172 Å²	172	134.3 Å²	134.3	88%	0.882	74%	0.739	S	S	*	*			trans	-136.6	145.6	146	-63.3	-173.2	0	0	0	107.6
622	L	30.3	Very low	28.6	Very low	151 Å²	151	134.3 Å²	134.3	79%	0.791	74%	0.739	S	S	*	*			trans	-128.1	-169.6	-172.7	-79.3	169.1	0	0	0	111.2
623	V	28.4	Very low	28.7	Very low	135 Å²	135	140 Å²	140	82%	0.818	74%	0.744	S	S	*	*			trans	100.5	125.4	165.6	179.5	0	0	0	0	114.8
624	S	33	Very low	28.9	Very low	100 Å²	100	140.1 Å²	140.1	70%	0.699	74%	0.743	S	S	*	*			cis	-169	163.2	-12	-103.4	0	0	0	0	113.5
625	K	27.6	Very low	28.8	Very low	167 Å²	167	140.1 Å²	140.1	73%	0.726	75%	0.749	S	S	*	*			trans	70.1	153.2	155.3	-103	-175.8	171.8	-74.2	0	117.9	E627	K625-E627 IonicContact NZ-OE1 2.67Å; K625-E627 PolarHBondContact NZ-OE1 2.93Å; K625-E627 IonicContact NZ-OE2 2.88Å; K625-E627 PolarHBondContact NZ-OE2 2.85Å
626	A	28.7	Very low	28.8	Very low	72 Å²	72	134.8 Å²	134.8	60%	0.595	75%	0.746	S	S	*	*			cis	-144.8	164.5	5.3	0	0	0	0	0	113.7
627	E	26.6	Very low	29	Very low	131 Å²	131	137.1 Å²	137.1	61%	0.612	75%	0.752	S	S	*	*			trans	7	120.4	155.5	-63.1	90.2	-94.7	0	0	118.2	K625	K625-E627 IonicContact NZ-OE1 2.67Å; K625-E627 PolarHBondContact NZ-OE1 2.93Å; K625-E627 IonicContact NZ-OE2 2.88Å; K625-E627 PolarHBondContact NZ-OE2 2.85Å
628	E	25	Very low	28.9	Very low	168 Å²	168	134.8 Å²	134.8	79%	0.785	75%	0.745	S	S	*	*				71.5	121.1	65.9	-173.8	176.6	-163.9	0	0	114.6
629	L	27.6	Very low	29	Very low	133 Å²	133	136.5 Å²	136.5	70%	0.696	75%	0.752	S	S	*	*				161.8	91.6	118.7	-165.6	77.8	0	0	0	115.2
630	L	32.5	Very low	28.8	Very low	133 Å²	133	136.8 Å²	136.8	70%	0.696	76%	0.756	S	S	*	*			trans	63.7	169.9	144.9	-54.1	179.2	0	0	0	118.2
631	K	29.9	Very low	28.8	Very low	176 Å²	176	140.2 Å²	140.2	77%	0.765	76%	0.764	S	S	*	*			cis	-160.4	156.1	-6.9	-123.9	162.5	177.1	175.1	0	105.6
632	S	28.3	Very low	28.9	Very low	107 Å²	107	136.8 Å²	136.8	75%	0.748	76%	0.755	S	S	*	*			cis	-176.3	164.6	-18	44.2	0	0	0	0	108.8
633	R	29.3	Very low	28.8	Very low	231 Å²	231	138.4 Å²	138.4	87%	0.872	76%	0.759	S	S	*	*	S	Bend	trans	-114.4	140.9	165.8	-161.6	-161.7	-177	-168.3	1.9	110.3
634	C	29.3	Very low	28.8	Very low	112 Å²	112	141.6 Å²	141.6	76%	0.757	76%	0.762	S	S	*	*			trans	62	138.8	169.6	-65.7	0	0	0	0	118.3
635	S	27	Very low	29.3	Very low	125 Å²	125	141.6 Å²	141.6	87%	0.874	76%	0.759	S	S	*	*			trans	-163.2	125.2	134	-154.8	0	0	0	0	109.9
636	S	26.6	Very low	29.3	Very low	114 Å²	114	141.1 Å²	141.1	80%	0.797	76%	0.76	S	S	*	*			trans	-146.7	125.4	172	54.3	0	0	0	0	110.3
637	I	30.6	Very low	29.4	Very low	172 Å²	172	145.5 Å²	145.5	88%	0.882	77%	0.768	S	S	*	*			trans	-71.8	157.2	165.4	-114.5	70.9	0	0	0	108.5
638	G	28.7	Very low	29.4	Very low	58 Å²	58	147.7 Å²	147.7	60%	0.598	78%	0.778	S	S	*	*			cis	151.4	129.4	-6.9	0	0	0	0	0	112.6
639	I	30.1	Very low	30.3	Very low	159 Å²	159	145.3 Å²	145.3	82%	0.815	78%	0.777	S	S	*	*			trans	64.1	115.5	168.2	-54.8	174.7	0	0	0	117.3
640	Q	28.3	Very low	30.2	Very low	181 Å²	181	148 Å²	148	85%	0.846	78%	0.779	S	S	*	*				-169.5	171.2	109	-148.5	129.8	89.2	0	0	111.3
641	D	28.9	Very low	31	Very low	147 Å²	147	146.9 Å²	146.9	79%	0.786	78%	0.78	S	S	*	*			trans	-92.6	-176.2	-176.2	-59.6	-84.1	0	0	0	114.1
642	S	30.2	Very low	31.1	Very low	100 Å²	100	147.8 Å²	147.8	70%	0.699	78%	0.778	S	S	*	*			trans	98.8	117.8	156.3	-59.5	0	0	0	0	121.1
643	E	27.8	Very low	31.3	Very low	186 Å²	186	146.5 Å²	146.5	87%	0.869	77%	0.77	S	S	*	*			trans	74.5	144.6	130.5	-62.5	175.5	139.8	0	0	123.1
644	F	27.9	Very low	31.3	Very low	202 Å²	202	142.6 Å²	142.6	89%	0.886	77%	0.766	S	S	*	*			trans	-77.2	176.9	162.1	-87.6	-104.5	0	0	0	110.1
645	P	45.2	Very low	31.5	Very low	99 Å²	99	143 Å²	143	64%	0.643	77%	0.765	S	S	*	*			cis	-138.1	-175.1	6.7	37.4	-16	0	0	0	116.5
646	E	27.4	Very low	31.8	Very low	158 Å²	158	144.9 Å²	144.9	74%	0.738	76%	0.76	S	S	*	*			trans	70.9	143.6	136.8	-89.6	173.4	168.5	0	0	126.6
647	H	30	Very low	32.2	Very low	164 Å²	164	145.1 Å²	145.1	76%	0.759	76%	0.757	S	S	*	*			trans	78.4	158.5	147.3	-79.5	-59.6	0	0	0	124.5
648	Q	26.5	Very low	32.3	Very low	177 Å²	177	140.5 Å²	140.5	83%	0.827	74%	0.744	S	S	*	*			trans	-82.4	-178.5	-178.4	-60.9	179.7	-32	0	0	111.4
649	P	44.4	Very low	32.4	Very low	117 Å²	117	144.2 Å²	144.2	76%	0.76	76%	0.755	S	S	*	*			cis	-143.7	-168.3	11.9	40.4	-17	0	0	0	117.9
650	Y	25.8	Very low	32.5	Very low	189 Å²	189	143.4 Å²	143.4	74%	0.741	75%	0.753	S	S	*	*			trans	-46.5	177.5	156.2	-82.2	-81.1	0	0	0	115.9
651	P	48.6	Very low	32.7	Very low	110 Å²	110	139.6 Å²	139.6	71%	0.714	75%	0.746	S	S	*	*			cis	-141	-174.8	-5.5	34.5	-11.9	0	0	0	117.6
652	R	31.6	Very low	32.9	Very low	195 Å²	195	139.8 Å²	139.8	74%	0.736	75%	0.747	S	S	*	*			trans	81	144.9	137.9	-125.4	-176	-170.6	163.7	5.4	124.3	E704	R652-E704 IonicContact NH2-OE1 3.78Å; R652-E704 PolarHBondContact NH2-OE1 3.33Å
653	S	32.6	Very low	33.2	Very low	81 Å²	81	141.1 Å²	141.1	57%	0.566	75%	0.751	S	S	*	*			trans	72.7	107.7	140.3	50.9	0	0	0	0	123.7
654	D	30.9	Very low	33.5	Very low	149 Å²	149	139 Å²	139	80%	0.797	74%	0.741	S	S	*	*				82.7	148.8	111.9	-53.4	-24.8	0	0	0	124.8
655	V	33.3	Very low	33.9	Very low	120 Å²	120	132.9 Å²	132.9	73%	0.727	72%	0.723	S	S	*	*			trans	74.5	106.8	151.8	161.4	0	0	0	0	118.9
656	E	33.4	Very low	33.6	Very low	164 Å²	164	138.6 Å²	138.6	77%	0.766	73%	0.732	S	S	*	*				45.6	159	111.4	-63.7	-171.5	134.5	0	0	121
657	T	33.3	Very low	33.8	Very low	120 Å²	120	134.6 Å²	134.6	74%	0.736	73%	0.733	S	S	*	*			cis	-155.3	-170.8	9.8	-4.8	0	0	0	0	111.1
658	A	32.4	Very low	34	Very low	74 Å²	74	134.6 Å²	134.6	61%	0.612	74%	0.738	S	S	*	*			trans	93.2	114.8	149.2	0	0	0	0	0	117.8
659	T	32.5	Very low	34.7	Very low	136 Å²	136	134.9 Å²	134.9	83%	0.834	73%	0.732	S	S	*	*				94	142.9	95.4	51.4	0	0	0	0	113.6
660	D	31.3	Very low	34.2	Very low	142 Å²	142	135.9 Å²	135.9	76%	0.759	73%	0.726	S	S	*	*			cis	-167.4	180	-8.4	173.1	53.6	0	0	0	109.2
661	S	31.8	Very low	34.9	Very low	101 Å²	101	135.3 Å²	135.3	71%	0.706	72%	0.724	S	S	*	*			trans	108.2	99.3	146.2	-57.8	0	0	0	0	118
662	D	34.1	Very low	34.1	Very low	152 Å²	152	139.3 Å²	139.3	81%	0.813	73%	0.733	S	S	*	*			trans	-85.3	173.2	168.6	-114.6	-48	0	0	0	113.3
663	T	36.3	Very low	34.4	Very low	128 Å²	128	135.3 Å²	135.3	79%	0.785	74%	0.735	S	S	*	*			trans	168.1	120	138.6	29	0	0	0	0	110
664	E	35.1	Very low	34.7	Very low	141 Å²	141	138 Å²	138	66%	0.659	75%	0.748	S	S	*	*				69.5	145.1	67.2	-78.9	-131.1	95.4	0	0	117	R666	E664-R666 IonicContact OE1-CZ 2.7Å; E664-R666 IonicContact OE1-NE 3.47Å; E664-R666 PolarHBondContact OE1-NE 3.42Å; E664-R666 IonicContact OE1-NH2 3.96Å; E664-R666 PolarHBondContact OE1-NH2 2.97Å; E664-R666 IonicContact OE2-NH2 3.53Å
665	S	36.1	Very low	34.8	Very low	73 Å²	73	133.9 Å²	133.9	51%	0.51	74%	0.74	S	S	.	*			cis	179.5	173	-33.6	57.6	0	0	0	0	112.6
666	R	37.5	Very low	35.1	Very low	220 Å²	220	134.3 Å²	134.3	83%	0.83	74%	0.743	S	S	*	*			trans	72.7	160.6	159.9	-23.5	-163.4	-177.5	-131.2	-4.2	118.2	E664	E664-R666 IonicContact OE1-CZ 2.7Å; E664-R666 IonicContact OE1-NE 3.47Å; E664-R666 PolarHBondContact OE1-NE 3.42Å; E664-R666 IonicContact OE1-NH2 3.96Å; E664-R666 PolarHBondContact OE1-NH2 2.97Å; E664-R666 IonicContact OE2-NH2 3.53Å
667	G	32.8	Very low	35	Very low	74 Å²	74	134.9 Å²	134.9	76%	0.763	75%	0.745	S	S	*	*			cis	-137.2	-138.6	4.7	0	0	0	0	0	113.6
668	L	34	Very low	35.4	Very low	164 Å²	164	135.3 Å²	135.3	86%	0.859	75%	0.747	S	S	*	*			cis	-150.9	-103.4	1.2	-139.3	178.8	0	0	0	114.8
669	R	41	Very low	35.5	Very low	183 Å²	183	140.5 Å²	140.5	69%	0.691	76%	0.759	S	S	*	*			trans	-151.6	178.3	-167.9	-77.8	171.4	167	-116.8	2.1	111.4
670	E	33.5	Very low	35.6	Very low	138 Å²	138	141.1 Å²	141.1	65%	0.645	76%	0.757	S	S	*	*			cis	-155.7	-169.5	20.8	-156.5	111.8	-124.9	0	0	114.1
671	Y	41.4	Very low	35.7	Very low	176 Å²	176	138.7 Å²	138.7	69%	0.69	74%	0.741	S	S	*	*			trans	-82.4	173.5	-163	-58	-80.2	0	0	0	119.1
672	H	30.9	Very low	35.8	Very low	194 Å²	194	141 Å²	141	90%	0.898	74%	0.739	S	S	*	*				-166.6	167.6	111	-92.7	85.7	0	0	0	111.6
673	S	38	Very low	35.8	Very low	112 Å²	112	142.5 Å²	142.5	78%	0.783	73%	0.733	S	S	*	*			trans	-117.7	-175	-169.7	-56.9	0	0	0	0	112.8
674	V	37.9	Very low	35.5	Very low	138 Å²	138	144.3 Å²	144.3	84%	0.836	73%	0.732	S	S	*	*			cis	-158.4	166.2	29.3	178	0	0	0	0	107.2
675	G	33.2	Very low	35.3	Very low	62 Å²	62	141.2 Å²	141.2	64%	0.639	74%	0.738	S	S	*	*			cis	141.1	174.1	-0.5	0	0	0	0	0	112.3
676	V	39.9	Very low	35	Very low	129 Å²	129	149.7 Å²	149.7	78%	0.782	76%	0.759	S	S	*	*			trans	75.1	141.6	176.9	-168.9	0	0	0	0	114.4
677	Q	31.9	Very low	34.5	Very low	175 Å²	175	147.3 Å²	147.3	82%	0.818	75%	0.754	S	S	*	*			cis	-141.9	122.4	13.8	-149.1	154.8	-58.3	0	0	110.9
678	V	41.1	Very low	34.8	Very low	129 Å²	129	152.8 Å²	152.8	78%	0.782	76%	0.757	S	S	*	*				62.1	104.4	99.4	-171.4	0	0	0	0	119
679	E	35.8	Very low	34.7	Very low	183 Å²	183	155.1 Å²	155.1	86%	0.855	76%	0.755	S	S	*	*				175	108.9	121.2	-88.5	-162.7	140.4	0	0	107.4
680	D	34.8	Very low	34.3	Very low	149 Å²	149	151.6 Å²	151.6	80%	0.797	76%	0.758	S	S	*	*				65.2	140.9	86	-115.1	-7	0	0	0	115.4
681	E	32.6	Very low	34	Very low	91 Å²	91	152.2 Å²	152.2	43%	0.425	77%	0.766	S	S	.	*			cis	-134.4	-138.7	10.9	-142.1	-164.1	132.3	0	0	110.3	R683	E681-R683 IonicContact OE1-CZ 2.93Å; E681-R683 VanDerWaalsContact OE1-CZ 3.28Å; E681-R683 IonicContact OE1-NE 3.02Å; E681-R683 PolarHBondContact OE1-NE 3.27Å; E681-R683 IonicContact OE1-NH2 3.96Å; E681-R683 PolarHBondContact OE1-NH2 3.47Å
682	K	33.5	Very low	33.5	Very low	151 Å²	151	148.6 Å²	148.6	66%	0.657	77%	0.767	S	S	*	*			cis	-142.8	24.7	2.2	-156.5	135.8	-173.7	70.9	0	115.9
683	R	35.4	Very low	33.6	Very low	183 Å²	183	145 Å²	145	69%	0.691	76%	0.758	S	S	*	*			trans	75.2	172.2	152.3	-38.4	165.8	-160.8	-148.6	-3.9	120.8	E681	E681-R683 IonicContact OE1-CZ 2.93Å; E681-R683 VanDerWaalsContact OE1-CZ 3.28Å; E681-R683 IonicContact OE1-NE 3.02Å; E681-R683 PolarHBondContact OE1-NE 3.27Å; E681-R683 IonicContact OE1-NH2 3.96Å; E681-R683 PolarHBondContact OE1-NH2 3.47Å
684	H	29.6	Very low	33.5	Very low	166 Å²	166	145.7 Å²	145.7	77%	0.769	76%	0.757	S	S	*	*			trans	77.6	122.1	163.7	-34.6	106.8	0	0	0	117.4
685	G	29.5	Very low	33.5	Very low	75 Å²	75	143.6 Å²	143.6	77%	0.773	76%	0.755	S	S	*	*			cis	115	97.9	-16.5	0	0	0	0	0	116.5
686	R	31	Very low	33.5	Very low	252 Å²	252	145.4 Å²	145.4	95%	0.951	76%	0.763	S	S	*	*			trans	-160.3	136.8	154.2	-119.2	179.5	-167	-145.5	2.6	113.7
687	F	27.8	Very low	33.3	Very low	169 Å²	169	145.5 Å²	145.5	74%	0.741	76%	0.764	S	S	*	*			trans	-109	134.3	168	164.4	-84.2	0	0	0	109.2	R689	F687-R689 HydrophobicContact CZ-CG 4.37Å
688	K	37.9	Very low	33.2	Very low	190 Å²	190	145.7 Å²	145.7	83%	0.826	77%	0.765	S	S	*	*			trans	-158	139.3	155.2	-92.4	-56.6	-176.7	173.7	0	110.4
689	R	32.7	Very low	32.8	Very low	213 Å²	213	143.5 Å²	143.5	80%	0.804	76%	0.76	S	S	*	*			trans	-76.9	156.1	163.6	-64	171.5	165.4	-175.3	-6.7	110.5	F687	F687-R689 HydrophobicContact CZ-CG 4.37Å
690	S	31.8	Very low	32.5	Very low	109 Å²	109	141.7 Å²	141.7	76%	0.762	76%	0.757	S	S	*	*				-178.1	146.3	126.3	-96.1	0	0	0	0	112.8
691	N	27.5	Very low	32.5	Very low	150 Å²	150	141.7 Å²	141.7	80%	0.802	76%	0.756	S	S	*	*			trans	15	147.1	130.6	-62.3	16.1	0	0	0	118.8
692	S	31.4	Very low	32.4	Very low	101 Å²	101	145.5 Å²	145.5	71%	0.706	77%	0.774	S	S	*	*			cis	-169.8	161.1	19.2	27.5	0	0	0	0	112.9
693	V	33.3	Very low	32.4	Very low	119 Å²	119	145.4 Å²	145.4	72%	0.721	78%	0.78	S	S	*	*			trans	47.8	114.3	139.9	176.4	0	0	0	0	117.6
694	T	35.4	Very low	32.3	Very low	125 Å²	125	143.4 Å²	143.4	77%	0.767	78%	0.778	S	S	*	*			cis	71.6	159.2	46.2	79	0	0	0	0	115.9
695	A	36.9	Very low	32.3	Very low	95 Å²	95	139.3 Å²	139.3	79%	0.785	78%	0.781	S	S	*	*			trans	66.6	125.8	-166.3	0	0	0	0	0	114.4
696	A	33	Very low	32.2	Very low	99 Å²	99	144.4 Å²	144.4	82%	0.818	78%	0.782	S	S	*	*			cis	86.2	115.7	16.9	0	0	0	0	0	116.9
697	V	36.1	Very low	32.7	Very low	132 Å²	132	138.3 Å²	138.3	80%	0.8	78%	0.775	S	S	*	*			trans	-151.2	111.7	159.7	-169.5	0	0	0	0	102.4
698	Q	29.7	Very low	32.7	Very low	179 Å²	179	133.8 Å²	133.8	84%	0.836	78%	0.776	S	S	*	*				67	132.8	68.5	-159.6	175	8.9	0	0	110.5
699	A	33.1	Very low	32.1	Very low	82 Å²	82	133.3 Å²	133.3	68%	0.678	78%	0.776	S	S	*	*			cis	-126.1	-175.3	13.2	0	0	0	0	0	110.9
700	D	30.7	Very low	31.9	Very low	146 Å²	146	130 Å²	130	78%	0.781	77%	0.773	S	S	*	*			cis	-149	178.9	12.8	-148.9	-1.5	0	0	0	114.3
701	L	32.9	Very low	31.9	Very low	149 Å²	149	130 Å²	130	78%	0.78	77%	0.768	S	S	*	*			trans	-63.4	147.5	-157.8	-106.6	60.6	0	0	0	120
702	E	30.8	Very low	32.3	Very low	171 Å²	171	128.9 Å²	128.9	80%	0.799	77%	0.767	S	S	*	*			trans	-77.6	160.3	146.6	63.7	-149.7	113.4	0	0	112.1
703	L	34.9	Very low	32.2	Very low	149 Å²	149	131.6 Å²	131.6	78%	0.78	77%	0.769	S	S	*	*				168.7	168.3	124.9	-159.8	54.1	0	0	0	113.7
704	E	32.6	Very low	31.8	Very low	141 Å²	141	132 Å²	132	66%	0.659	77%	0.767	S	S	*	*			trans	-36.3	159.1	179.8	-62.4	169	90.9	0	0	120.6	R652	R652-E704 IonicContact NH2-OE1 3.78Å; R652-E704 PolarHBondContact NH2-OE1 3.33Å
705	G	28.6	Very low	31.6	Very low	80 Å²	80	134.9 Å²	134.9	83%	0.825	77%	0.769	S	S	*	*			trans	156.4	113.9	144.4	0	0	0	0	0	119.2
706	F	27.6	Very low	31.2	Very low	181 Å²	181	133.8 Å²	133.8	79%	0.794	77%	0.766	S	S	*	*			trans	-95.3	170.8	154.4	-75.1	-88.3	0	0	0	109.3
707	P	42.4	Very low	31.2	Very low	125 Å²	125	135.6 Å²	135.6	81%	0.812	76%	0.762	S	S	*	*			cis	-132.3	-173.3	-14.9	39.8	-22.1	0	0	0	114.6
708	G	26.8	Very low	31.1	Very low	73 Å²	73	138.2 Å²	138.2	75%	0.753	77%	0.765	S	S	*	*			trans	93.7	133	165.2	0	0	0	0	0	114.4
709	H	26.9	Very low	31.1	Very low	180 Å²	180	137.6 Å²	137.6	83%	0.833	76%	0.76	S	S	*	*			cis	99.1	143.8	40.3	-171.3	-121.5	0	0	0	113.3
710	I	28.4	Very low	30.9	Very low	143 Å²	143	136.8 Å²	136.8	73%	0.733	76%	0.76	S	S	*	*			trans	92.9	145.6	177.4	-51.9	-171.4	0	0	0	117.1
711	T	31.3	Very low	30.6	Very low	109 Å²	109	135.1 Å²	135.1	67%	0.669	76%	0.759	S	S	*	*			trans	-93.2	156.6	-160.8	49.5	0	0	0	0	115.8
712	T	34.5	Very low	30.3	Very low	128 Å²	128	132 Å²	132	79%	0.785	75%	0.75	S	S	*	*				-150.5	135.3	120.3	45.9	0	0	0	0	106.3
713	E	29.3	Very low	30.1	Very low	158 Å²	158	132.3 Å²	132.3	74%	0.738	75%	0.749	S	S	*	*			cis	100	118.4	22.3	100.7	-175.2	94.5	0	0	116.2
714	D	25	Very low	29.8	Very low	128 Å²	128	132 Å²	132	68%	0.684	74%	0.744	S	S	*	*			trans	75.7	145.6	155.4	-152	13.2	0	0	0	121.4
715	K	32.6	Very low	29.7	Very low	185 Å²	185	136 Å²	136	80%	0.804	75%	0.753	S	S	*	*			trans	65.2	140.6	167.3	-39.9	-175.7	-169.1	175.8	0	117.7
716	G	27.7	Very low	29.7	Very low	71 Å²	71	139.5 Å²	139.5	73%	0.732	75%	0.747	S	S	*	*			cis	153.8	140.7	-6.7	0	0	0	0	0	113.5
717	L	32.2	Very low	29.7	Very low	138 Å²	138	136.4 Å²	136.4	72%	0.723	75%	0.748	S	S	*	*			trans	20.1	120.8	153.7	-61.4	168.2	0	0	0	120	F719	L717-F719 HydrophobicContact CB-CD2 4.25Å; L717-F719 HydrophobicContact CB-CE2 4.3Å; L717-F719 HydrophobicContact CD1-CE2 4.21Å; L717-F719 HydrophobicContact CD2-CE2 4.2Å; L717-F719 HydrophobicContact CG-CE2 4.48Å
718	Q	36.1	Very low	28.8	Very low	187 Å²	187	139 Å²	139	87%	0.874	75%	0.75	S	S	*	*				-159.4	108.9	113.4	-103	155.7	105	0	0	109.3
719	F	28.2	Very low	29.6	Very low	166 Å²	166	140.7 Å²	140.7	73%	0.728	75%	0.747	S	S	*	*				77.6	122	80	-88.9	-72.4	0	0	0	113.1	L717	L717-F719 HydrophobicContact CB-CD2 4.25Å; L717-F719 HydrophobicContact CB-CE2 4.3Å; L717-F719 HydrophobicContact CD1-CE2 4.21Å; L717-F719 HydrophobicContact CD2-CE2 4.2Å; L717-F719 HydrophobicContact CG-CE2 4.48Å
720	G	29.1	Very low	29.6	Very low	65 Å²	65	137.9 Å²	137.9	67%	0.67	75%	0.748	S	S	*	*			cis	172.4	-163.8	-5.2	0	0	0	0	0	114.5
721	S	25.2	Very low	30	Very low	110 Å²	110	137.3 Å²	137.3	77%	0.769	75%	0.751	S	S	*	*			trans	24.5	134.3	155.3	-69.2	0	0	0	0	120.3
722	S	26.6	Very low	30	Very low	85 Å²	85	138.1 Å²	138.1	59%	0.594	76%	0.758	S	S	*	*			cis	174.5	174.9	9.8	44.2	0	0	0	0	111.5
723	F	26.9	Very low	29.9	Very low	177 Å²	177	137.9 Å²	137.9	78%	0.776	76%	0.757	S	S	*	*			trans	69	103.9	153.2	-65.1	-56.9	0	0	0	121.4
724	Q	27.5	Very low	29.9	Very low	141 Å²	141	139 Å²	139	66%	0.659	76%	0.762	S	S	*	*				73.6	101.2	108.3	-168.1	173.3	3.7	0	0	119.8
725	R	30	Very low	30	Very low	227 Å²	227	143.7 Å²	143.7	86%	0.857	77%	0.771	S	S	*	*				-168	166.8	110.9	-110.3	168	-71.1	-177.8	0.2	116.6
726	H	29.2	Very low	29.8	Very low	152 Å²	152	140.5 Å²	140.5	70%	0.704	77%	0.772	S	S	*	*			trans	-58.1	147.1	-174.1	-49.5	-73.9	0	0	0	117
727	S	27.1	Very low	29.9	Very low	116 Å²	116	141.4 Å²	141.4	81%	0.811	77%	0.773	S	S	*	*				60.3	137.3	127.8	-55.7	0	0	0	0	123.1
728	E	23.7	Very low	30.1	Very low	181 Å²	181	141.2 Å²	141.2	85%	0.846	78%	0.777	S	S	*	*			trans	-42.3	173.5	153.5	-81	-170.1	115	0	0	117.1
729	P	45.2	Very low	30	Very low	108 Å²	108	143.7 Å²	143.7	70%	0.701	78%	0.779	S	S	*	*			cis	-130.7	174.8	-0.8	23.9	-1.6	0	0	0	114.8
730	S	25.7	Very low	30.3	Very low	120 Å²	120	142.1 Å²	142.1	84%	0.839	78%	0.783	S	S	*	*			trans	-169.6	145.7	135.8	-85.3	0	0	0	0	113.4
731	T	37.4	Very low	31	Very low	132 Å²	132	145.8 Å²	145.8	81%	0.81	79%	0.792	S	S	*	*			trans	-72.3	150.7	178.7	50.5	0	0	0	0	114.1
732	P	30.6	Very low	31.2	Very low	125 Å²	125	149.9 Å²	149.9	81%	0.812	79%	0.79	S	S	*	*			trans	-119.2	112.5	149.3	34.1	-23.1	0	0	0	112.4
733	T	32.3	Very low	32.2	Very low	124 Å²	124	152.3 Å²	152.3	76%	0.761	80%	0.802	S	S	*	*			trans	-74	125.5	155.1	-58.6	0	0	0	0	108.9
734	Q	29.2	Very low	32.4	Very low	180 Å²	180	150.9 Å²	150.9	84%	0.841	80%	0.798	S	S	*	*			trans	-156.8	148.2	150.4	-93.4	-47.7	-44.8	0	0	110.6
735	Y	28.5	Very low	33	Very low	227 Å²	227	148.1 Å²	148.1	89%	0.89	81%	0.807	S	S	*	*			trans	-87.8	141.8	175.3	-116.8	-120.4	0	0	0	110.3
736	S	27.5	Very low	32.9	Very low	118 Å²	118	144.5 Å²	144.5	83%	0.825	80%	0.804	S	S	*	*			trans	-150.4	140.1	152.9	59.4	0	0	0	0	111.7
737	A	30.9	Very low	32.8	Very low	90 Å²	90	147.4 Å²	147.4	74%	0.744	82%	0.815	S	S	*	*			trans	-83.4	170.2	172.6	0	0	0	0	0	109.5
738	V	35.2	Very low	32.9	Very low	134 Å²	134	146.5 Å²	146.5	81%	0.812	81%	0.809	S	S	*	*			cis	-143.2	144.2	26	177.5	0	0	0	0	110.2
739	R	33.3	Very low	33.1	Very low	240 Å²	240	145.8 Å²	145.8	91%	0.906	80%	0.799	S	S	*	*			trans	-79.3	115.9	166	-78.5	-176.8	170.5	178.4	-2.8	110.5
740	T	35.1	Very low	32.3	Very low	133 Å²	133	150.2 Å²	150.2	82%	0.816	80%	0.802	S	S	*	*			trans	-74.9	134.7	152.2	39.5	0	0	0	0	109	R742	T740-R742 PolarHBondContact O-N 2.9Å
741	V	43.7	Very low	32.4	Very low	142 Å²	142	149.3 Å²	149.3	86%	0.861	79%	0.785	S	S	*	*			trans	-75.9	110	177.7	178.4	0	0	0	0	109.2
742	R	30.1	Very low	31.9	Very low	195 Å²	195	148.7 Å²	148.7	74%	0.736	78%	0.776	S	S	*	*			trans	-129.8	117.6	162.4	-171.4	-179.9	-179	104.3	-0	109.1	T740 Q744	T740-R742 PolarHBondContact O-N 2.9Å; R742-Q744 PolarHBondContact O-N 3.31Å; R742-Q744 VanDerWaalsContact O-N 3.08Å
743	T	46.5	Very low	32	Very low	137 Å²	137	151.4 Å²	151.4	84%	0.84	77%	0.771	S	S	*	*			trans	-77.3	88.3	176.9	44.1	0	0	0	0	110.7
744	Q	31.6	Very low	31.9	Very low	147 Å²	147	156.1 Å²	156.1	69%	0.687	78%	0.775	S	S	*	*			trans	-148.8	140.7	166	-108	159	-9.3	0	0	108.9	R742	R742-Q744 PolarHBondContact O-N 3.31Å; R742-Q744 VanDerWaalsContact O-N 3.08Å
745	G	39.5	Very low	31.7	Very low	82 Å²	82	154.4 Å²	154.4	85%	0.845	78%	0.777	S	S	*	*			trans	-73.4	151.4	-167.4	0	0	0	0	0	114.3
746	L	28.6	Very low	31.6	Very low	152 Å²	152	152.2 Å²	152.2	80%	0.796	78%	0.775	S	S	*	*			trans	-116.5	62.9	175.8	-166.6	70.2	0	0	0	111.6	S748	L746-S748 WeakPolarHBondContact CD1-OG 3.32Å
747	F	28	Very low	31.7	Very low	213 Å²	213	152.8 Å²	152.8	93%	0.934	77%	0.774	S	S	*	*			trans	-100.3	79.8	153.9	-84.7	-76.4	0	0	0	107.8	Y749	F747-Y749 PolarHBondContact O-N 3.02Å
748	S	27.4	Very low	31.4	Very low	97 Å²	97	155.3 Å²	155.3	68%	0.678	78%	0.775	S	S	*	*			trans	-72.8	93	178.5	-74.3	0	0	0	0	111.3	L746 R750	L746-S748 WeakPolarHBondContact CD1-OG 3.32Å; S748-R750 PolarHBondContact O-N 3.03Å
749	Y	29.3	Very low	31.4	Very low	166 Å²	166	155.4 Å²	155.4	65%	0.651	78%	0.775	S	S	*	*			trans	-12.6	120.3	144.6	-160.3	-125.7	0	0	0	114	F747 E751	F747-Y749 PolarHBondContact O-N 3.02Å; Y749-E751 HydrophobicContact CD1-CB 3.76Å; Y749-E751 HydrophobicContact CD2-CB 4.23Å; Y749-E751 HydrophobicContact CE1-CB 3.31Å; Y749-E751 HydrophobicContact CE1-CG 4.07Å; Y749-E751 HydrophobicContact CE2-CB 3.83Å; Y749-E751 HydrophobicContact CE2-CG 4.45Å; Y749-E751 WeakPolarHBondContact CE2-OE2 3.39Å; Y749-E751 HydrophobicContact CG-CB 4.21Å; Y749-E751 PolarHBondContact OH-OE1 2.82Å; Y749-E751 PolarHBondContact OH-OE2 3.15Å
750	R	28.1	Very low	31.4	Very low	201 Å²	201	148.5 Å²	148.5	76%	0.758	76%	0.764	S	S	*	*			trans	-120.8	65.4	169.6	-136.1	-62.3	179.9	-151.4	-6.4	108.5	S748 D752	S748-R750 PolarHBondContact O-N 3.03Å; R750-D752 WeakPolarHBondContact CD-OD2 3.49Å; R750-D752 IonicContact CZ-OD2 3.33Å; R750-D752 IonicContact NE-OD2 3.34Å; R750-D752 IonicContact NH1-OD1 3.22Å; R750-D752 PolarHBondContact NH1-OD1 3.23Å; R750-D752 IonicContact NH1-OD2 2.78Å; R750-D752 PolarHBondContact NH1-OD2 3.39Å
751	E	27	Very low	31.1	Very low	101 Å²	101	148.5 Å²	148.5	47%	0.472	76%	0.764	S	S	.	*			trans	-90.7	113.3	176.7	-173.8	120.1	157.7	0	0	109.7	Y749	Y749-E751 HydrophobicContact CD1-CB 3.76Å; Y749-E751 HydrophobicContact CD2-CB 4.23Å; Y749-E751 HydrophobicContact CE1-CB 3.31Å; Y749-E751 HydrophobicContact CE1-CG 4.07Å; Y749-E751 HydrophobicContact CE2-CB 3.83Å; Y749-E751 HydrophobicContact CE2-CG 4.45Å; Y749-E751 WeakPolarHBondContact CE2-OE2 3.39Å; Y749-E751 HydrophobicContact CG-CB 4.21Å; Y749-E751 PolarHBondContact OH-OE1 2.82Å; Y749-E751 PolarHBondContact OH-OE2 3.15Å
752	D	27.8	Very low	30.7	Very low	118 Å²	118	149.5 Å²	149.5	63%	0.631	76%	0.764	S	S	*	*			trans	-99.1	128	166.3	-70.9	-73.7	0	0	0	108.4	R750	R750-D752 WeakPolarHBondContact CD-OD2 3.49Å; R750-D752 IonicContact CZ-OD2 3.33Å; R750-D752 IonicContact NE-OD2 3.34Å; R750-D752 IonicContact NH1-OD1 3.22Å; R750-D752 PolarHBondContact NH1-OD1 3.23Å; R750-D752 IonicContact NH1-OD2 2.78Å; R750-D752 PolarHBondContact NH1-OD2 3.39Å
753	Y	32.8	Very low	31.1	Very low	182 Å²	182	145.5 Å²	145.5	71%	0.714	76%	0.763	S	S	*	*			trans	-81.3	139.7	-153.6	-83.8	-101.7	0	0	0	116.2
754	R	28.9	Very low	30.7	Very low	224 Å²	224	144.4 Å²	144.4	85%	0.845	76%	0.758	S	S	*	*			trans	58.1	127.2	147	-79.7	-176.3	165.3	-166.3	-4.1	120.1
755	T	26.1	Very low	31.3	Very low	143 Å²	143	143.4 Å²	143.4	88%	0.877	77%	0.765	S	S	*	*				-134.7	-176.3	124.3	-27.6	0	0	0	0	109.2
756	Q	25.3	Very low	30.8	Very low	181 Å²	181	145.5 Å²	145.5	85%	0.846	76%	0.756	S	S	*	*			trans	-95.2	147.3	-153.2	-60.2	179.4	8.2	0	0	115.5
757	V	30.1	Very low	31.3	Very low	131 Å²	131	143.1 Å²	143.1	79%	0.794	75%	0.75	S	S	*	*			trans	22.2	117.1	141.5	-176.8	0	0	0	0	118
758	D	24.5	Very low	32.1	Very low	143 Å²	143	143 Å²	143	77%	0.765	74%	0.744	S	S	*	*				-153	154.4	113.6	-145.5	-23.4	0	0	0	111.6
759	T	35.9	Very low	32.7	Very low	135 Å²	135	146.4 Å²	146.4	83%	0.828	75%	0.753	S	S	*	*			trans	-116.1	81.2	-179.6	45.1	0	0	0	0	111.6
760	S	33.9	Very low	32.6	Very low	96 Å²	96	146.3 Å²	146.3	67%	0.671	76%	0.759	S	S	*	*			trans	-157.8	161	161.4	61.7	0	0	0	0	112.1
761	T	29	Very low	33.2	Very low	133 Å²	133	141.6 Å²	141.6	82%	0.816	75%	0.754	S	S	*	*			trans	75.9	107.4	179.7	-37	0	0	0	0	115.9
762	L	34.1	Very low	33.4	Very low	162 Å²	162	141.2 Å²	141.2	85%	0.848	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-77.1	138.1	166.1	-67.4	163.4	0	0	0	110.2
763	P	38.4	Very low	34.2	Very low	112 Å²	112	142.9 Å²	142.9	73%	0.727	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-75.3	142.8	157.8	32.1	-31.7	0	0	0	110.1
764	P	39.3	Very low	34.3	Very low	114 Å²	114	141.8 Å²	141.8	74%	0.74	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-70	157.7	170.8	31	-34.8	0	0	0	111.3
765	P	42.4	Very low	34.4	Very low	126 Å²	126	136.7 Å²	136.7	82%	0.818	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-67.2	136.5	173.6	28.8	-34.4	0	0	0	111.3
766	D	30.9	Very low	35.1	Very low	125 Å²	125	135.6 Å²	135.6	67%	0.668	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-82.3	121.1	-168.7	-152.8	28.7	0	0	0	111.7	W768	D766-W768 VanDerWaalsContact CG-NE1 3.32Å; D766-W768 PolarHBondContact O-N 2.89Å; D766-W768 PolarHBondContact OD2-NE1 3.1Å
767	P	39.1	Very low	35.5	Very low	103 Å²	103	135.3 Å²	135.3	67%	0.669	77%	0.768	S	S	*	*			trans	-87.4	96.8	-164.7	33.1	-35.4	0	0	0	113.7
768	W	44.1	Very low	35.7	Very low	210 Å²	210	135.6 Å²	135.6	80%	0.795	77%	0.77	S	S	*	*			trans	-115.6	28.8	-176.2	-70.6	104.7	0	0	0	115.9	D766	D766-W768 VanDerWaalsContact CG-NE1 3.32Å; D766-W768 PolarHBondContact O-N 2.89Å; D766-W768 PolarHBondContact OD2-NE1 3.1Å
769	L	39.4	Very low	36.7	Very low	169 Å²	169	132.2 Å²	132.2	89%	0.885	77%	0.769	S	S	*	*			trans	-130.5	25	175	-74.7	178.6	0	0	0	114.5
770	E	27.6	Very low	37	Very low	164 Å²	164	137.5 Å²	137.5	77%	0.766	77%	0.773	S	S	*	*			trans	-100.9	128.1	168.1	-73.8	-61.1	156	0	0	111.1	A772	E770-A772 PolarHBondContact O-N 3.33Å; E770-A772 VanDerWaalsContact O-N 3.15Å
771	P	40.9	Very low	37.2	Very low	101 Å²	101	141 Å²	141	66%	0.656	78%	0.781	S	S	*	*			trans	-76.2	101.6	174.7	30.7	-31.8	0	0	0	109.7	I773	P771-I773 PolarHBondContact O-N 2.67Å
772	A	31.5	Very low	38.1	Very low	93 Å²	93	137.4 Å²	137.4	77%	0.769	76%	0.762	S	S	*	*			trans	-59.6	100.1	-178.6	0	0	0	0	0	112.7	E770 D774	E770-A772 PolarHBondContact O-N 3.33Å; E770-A772 VanDerWaalsContact O-N 3.15Å; A772-D774 VanDerWaalsContact C-N 3.3Å; A772-D774 PolarHBondContact O-N 3.44Å
773	I	43.3	Very low	38.9	Very low	154 Å²	154	135 Å²	135	79%	0.79	76%	0.755	S	S	*	*			trans	-85.8	74.7	166.3	-50.6	177.6	0	0	0	108	P771	P771-I773 PolarHBondContact O-N 2.67Å
774	D	35.3	Very low	39.6	Very low	159 Å²	159	134.9 Å²	134.9	85%	0.85	76%	0.756	S	S	*	*			trans	-99.8	142.5	165.1	-97.1	-48.9	0	0	0	110.6	A772	A772-D774 VanDerWaalsContact C-N 3.3Å; A772-D774 PolarHBondContact O-N 3.44Å
775	T	32.1	Very low	41	Very low	117 Å²	117	138.5 Å²	138.5	72%	0.718	76%	0.755	S	S	*	*			trans	-120.5	156.6	-162.8	-48.4	0	0	0	0	111.4
776	V	39.3	Very low	42.9	Very low	119 Å²	119	140 Å²	140	72%	0.721	75%	0.745	S	S	*	*			trans	89.2	97	172.5	-169.4	0	0	0	0	116.2
777	E	35.1	Very low	45.6	Very low	176 Å²	176	136.8 Å²	136.8	82%	0.822	73%	0.727	S	S	*	*			trans	54.7	105.5	142.7	-59.4	-175.1	-145.2	0	0	119.7
778	T	34	Very low	48.2	Very low	137 Å²	137	131.9 Å²	131.9	84%	0.84	70%	0.695	S	S	*	*				-144.3	153.3	79.2	-70.4	0	0	0	0	112.4
779	G	46	Very low	50.6	Low	72 Å²	72	124.2 Å²	124.2	74%	0.742	67%	0.674	S	S	*	*	S	Bend	trans	-59.5	139.8	-168.4	0	0	0	0	0	116.1
780	R	41.8	Very low	53.3	Low	245 Å²	245	121 Å²	121	93%	0.925	65%	0.65	S	S	*	*			trans	75.1	54.5	-180	-56.2	-148.3	-75.3	-117.5	5.4	116.6	S782	R780-S782 VanDerWaalsContact C-N 3.32Å; R780-S782 PolarHBondContact O-N 3.17Å
781	M	37.8	Very low	56.6	Low	171 Å²	171	113.3 Å²	113.3	84%	0.842	61%	0.614	S	S	*	*			trans	-54.8	101.9	137.7	-174.5	71	88.8	0	0	108.1
782	S	48	Very low	59.2	Low	57 Å²	57	110.6 Å²	110.6	40%	0.399	59%	0.593	S	S	.	*			trans	-61.5	141.4	166.2	177.4	0	0	0	0	107.7	R780 C784	R780-S782 VanDerWaalsContact C-N 3.32Å; R780-S782 PolarHBondContact O-N 3.17Å; S782-C784 PolarHBondContact O-N 3Å; S782-C784 VanDerWaalsContact O-N 3.16Å
783	P	50	Low	62.3	Low	111 Å²	111	113.4 Å²	113.4	72%	0.721	59%	0.588	S	S	*	*			trans	-49.1	128.7	161.2	-23.2	33.2	0	0	0	108.2	R785	P783-R785 PolarHBondContact O-N 2.8Å
784	C	52.9	Low	64.8	Low	110 Å²	110	109 Å²	109	74%	0.743	57%	0.566	S	S	*	*			trans	-56.4	109.2	179.1	-60.4	0	0	0	0	107.7	S782 R786	S782-C784 PolarHBondContact O-N 3Å; S782-C784 VanDerWaalsContact O-N 3.16Å; C784-R786 PolarHBondContact O-N 3.12Å
785	R	69.4	Low	67.8	Low	189 Å²	189	101.8 Å²	101.8	71%	0.713	53%	0.527	S	S	*	.			trans	-67.7	123.7	-176	-67	-171.2	179.5	-84.8	-1.3	107.2	P783 D787	P783-R785 PolarHBondContact O-N 2.8Å; R785-D787 PolarHBondContact O-N 3.29Å
786	R	82.1	Confident	70.9	Confident	159 Å²	159	102.3 Å²	102.3	60%	0.6	52%	0.521	S	S	*	.			trans	-73.4	69.6	170.1	-56.3	-173	-158.5	169.5	3.9	108	C784 W790 F791 S862	C784-R786 PolarHBondContact O-N 3.12Å; R786-W790 HydrophobicContact CB-CD2 4.39Å; R786-W790 HydrophobicContact CB-CE3 3.92Å; R786-W790 HydrophobicContact CB-CZ3 4.4Å; R786-W790 HydrophobicContact CG-CD2 4.26Å; R786-W790 HydrophobicContact CG-CE3 4.02Å; R786-W790 HydrophobicContact CG-CZ3 4.23Å; R786-F791 HydrophobicContact CB-CD2 4.43Å; R786-F791 HydrophobicContact CB-CE2 3.72Å; R786-F791 HydrophobicContact CB-CZ 4.13Å; R786-F791 VanDerWaalsContact O-CE2 3.29Å; R786-F791 WeakPolarHBondContact O-CE2 3.39Å; R786-S862 WeakPolarHBondContact O-CB 3.45Å
787	D	88.5	Confident	73.6	Confident	56 Å²	56	99.4 Å²	99.4	30%	0.299	51%	0.51	S	S	.	.			trans	-88.3	176.9	174.6	62.2	37.1	0	0	0	110.6	R785 S789 W790 F791	R785-D787 PolarHBondContact O-N 3.29Å; D787-S789 PolarHBondContact O-N 3.15Å; D787-S789 VanDerWaalsContact O-N 3.1Å; D787-S789 WeakPolarHBondContact OD1-CA 3.47Å; D787-S789 VanDerWaalsContact OD1-CB 3.23Å; D787-S789 WeakPolarHBondContact OD1-CB 3.28Å; D787-S789 PolarHBondContact OD1-N 3.2Å; D787-S789 PolarHBondContact OD1-OG 2.87Å; D787-W790 PolarHBondContact O-N 2.88Å; D787-W790 PolarHBondContact OD1-N 3.29Å; D787-F791 WeakPolarHBondContact O-CD2 3.27Å; D787-F791 PolarHBondContact O-N 3.11Å
788	G	93.1	Very high	76.6	Confident	0 Å²	0	92 Å²	92	0%	0	48%	0.476	C	S	.	.	H	α-helix	trans	-55.9	-25.1	178	0	0	0	0	0	113.6	L792 N851	G788-L792 WeakPolarHBondContact O-CB 3.44Å; G788-L792 PolarHBondContact O-N 3.34Å; G788-N851 PolarHBondContact N-OD1 3.18Å
789	S	94.6	Very high	79.6	Confident	49 Å²	49	86.9 Å²	86.9	34%	0.343	44%	0.444	S	S	.	.	H	α-helix	trans	-75.7	-34.1	176.9	84.7	0	0	0	0	112.4	D787 K793	D787-S789 PolarHBondContact O-N 3.15Å; D787-S789 VanDerWaalsContact O-N 3.1Å; D787-S789 WeakPolarHBondContact OD1-CA 3.47Å; D787-S789 VanDerWaalsContact OD1-CB 3.23Å; D787-S789 WeakPolarHBondContact OD1-CB 3.28Å; D787-S789 PolarHBondContact OD1-N 3.2Å; D787-S789 PolarHBondContact OD1-OG 2.87Å; S789-K793 WeakPolarHBondContact O-CG 3.45Å; S789-K793 PolarHBondContact O-N 2.78Å
790	W	95.1	Very high	82.1	Confident	103 Å²	103	90.7 Å²	90.7	39%	0.39	44%	0.44	S	S	.	.	H	α-helix	trans	-69.9	-49.9	173.2	-176.1	83.8	0	0	0	110.8	R786 D787 L792 K793 L794	R786-W790 HydrophobicContact CB-CD2 4.39Å; R786-W790 HydrophobicContact CB-CE3 3.92Å; R786-W790 HydrophobicContact CB-CZ3 4.4Å; R786-W790 HydrophobicContact CG-CD2 4.26Å; R786-W790 HydrophobicContact CG-CE3 4.02Å; R786-W790 HydrophobicContact CG-CZ3 4.23Å; D787-W790 PolarHBondContact O-N 2.88Å; D787-W790 PolarHBondContact OD1-N 3.29Å; W790-L792 VanDerWaalsContact C-N 3.34Å; W790-L792 PolarHBondContact O-N 2.91Å; W790-K793 PolarHBondContact O-N 3.46Å; W790-L794 HydrophobicContact CH2-CD2 3.66Å; W790-L794 HydrophobicContact CZ2-CD2 4.31Å; W790-L794 HydrophobicContact CZ3-CD2 3.84Å; W790-L794 PolarHBondContact O-N 2.86Å; W790-L794 VanDerWaalsContact O-N 3.17Å
791	F	96.8	Very high	84.8	Confident	2 Å²	2	83.1 Å²	83.1	1%	0.009	41%	0.412	C	S	.	.	H	α-helix	trans	-63.4	-36.4	178.2	-79	-69.6	0	0	0	112.8	R786 D787 L794 L795 F844 C848 L865 A866 W869	R786-F791 HydrophobicContact CB-CD2 4.43Å; R786-F791 HydrophobicContact CB-CE2 3.72Å; R786-F791 HydrophobicContact CB-CZ 4.13Å; R786-F791 VanDerWaalsContact O-CE2 3.29Å; R786-F791 WeakPolarHBondContact O-CE2 3.39Å; D787-F791 WeakPolarHBondContact O-CD2 3.27Å; D787-F791 PolarHBondContact O-N 3.11Å; F791-L794 PolarHBondContact O-N 2.91Å; F791-L795 VanDerWaalsContact O-CB 3.31Å; F791-L795 WeakPolarHBondContact O-CB 3.29Å; F791-L795 PolarHBondContact O-N 3.15Å; F791-F844 HydrophobicContact CB-CE1 3.84Å; F791-F844 HydrophobicContact CB-CZ 3.72Å; F791-F844 HydrophobicContact CD1-CE1 4.12Å; F791-F844 AromaticContact CD1-CZ 3.61Å; F791-F844 HydrophobicContact CD1-CZ 3.61Å; F791-F844 HydrophobicContact CE1-CZ 4.36Å; F791-F844 HydrophobicContact CG-CE1 4.31Å; F791-F844 AromaticContact CG-CZ 3.79Å; F791-F844 HydrophobicContact CG-CZ 3.79Å; F791-C848 VanDerWaalsContact CB-SG 3.57Å; F791-L865 HydrophobicContact CB-CD1 4.49Å; F791-L865 HydrophobicContact CD2-CB 3.62Å; F791-L865 HydrophobicContact CD2-CD1 3.69Å; F791-L865 HydrophobicContact CD2-CG 4.33Å; F791-L865 HydrophobicContact CE2-CB 3.57Å; F791-L865 HydrophobicContact CE2-CD1 4.32Å; F791-L865 HydrophobicContact CG-CB 4.25Å; F791-L865 HydrophobicContact CG-CD1 4.39Å; F791-L865 HydrophobicContact CZ-CB 4.17Å; F791-A866 HydrophobicContact CZ-CB 3.9Å; F791-W869 HydrophobicContact CD1-CB 4.01Å; F791-W869 HydrophobicContact CD1-CD2 4.36Å; F791-W869 HydrophobicContact CD1-CG 4.03Å; F791-W869 HydrophobicContact CE1-CB 3.64Å; F791-W869 AromaticContact CE1-CG 3.8Å; F791-W869 HydrophobicContact CE1-CG 3.8Å
792	L	96.6	Very high	87.6	Confident	43 Å²	43	75 Å²	75	23%	0.225	37%	0.371	C	S	.	.	H	α-helix	trans	-65.5	-37.4	176.5	179	61.3	0	0	0	112.9	G788 W790 H796 Y845 C848 M852	G788-L792 WeakPolarHBondContact O-CB 3.44Å; G788-L792 PolarHBondContact O-N 3.34Å; W790-L792 VanDerWaalsContact C-N 3.34Å; W790-L792 PolarHBondContact O-N 2.91Å; L792-H796 WeakPolarHBondContact O-CB 3.42Å; L792-H796 PolarHBondContact O-N 2.81Å; L792-Y845 HydrophobicContact CD1-CD2 3.38Å; L792-Y845 HydrophobicContact CD1-CE2 3.66Å; L792-Y845 HydrophobicContact CD1-CG 4.43Å; L792-C848 HydrophobicContact CB-CB 4.39Å; L792-M852 HydrophobicContact CD2-CE 4.01Å
793	K	96.3	Very high	90	Very high	153 Å²	153	76.1 Å²	76.1	67%	0.665	37%	0.371	S	S	*	.	H	α-helix	trans	-65	-44.7	173.8	-72.7	170.3	-177.4	177.7	0	111.4	S789 W790 H796 A797	S789-K793 WeakPolarHBondContact O-CG 3.45Å; S789-K793 PolarHBondContact O-N 2.78Å; W790-K793 PolarHBondContact O-N 3.46Å; K793-H796 PolarHBondContact O-N 3.22Å; K793-A797 PolarHBondContact O-N 2.7Å
794	L	96.3	Very high	92.2	Very high	62 Å²	62	72.6 Å²	72.6	33%	0.325	36%	0.355	S	S	.	.	H	α-helix	trans	-64.7	-44	179.1	-172.4	61.4	0	0	0	111.3	W790 F791 H796 A797 E798 W869	W790-L794 HydrophobicContact CH2-CD2 3.66Å; W790-L794 HydrophobicContact CZ2-CD2 4.31Å; W790-L794 HydrophobicContact CZ3-CD2 3.84Å; W790-L794 PolarHBondContact O-N 2.86Å; W790-L794 VanDerWaalsContact O-N 3.17Å; F791-L794 PolarHBondContact O-N 2.91Å; L794-H796 PolarHBondContact O-N 3.47Å; L794-A797 PolarHBondContact O-N 3.22Å; L794-E798 WeakPolarHBondContact O-CB 3.38Å; L794-E798 PolarHBondContact O-N 3.15Å; L794-W869 HydrophobicContact CD1-CZ2 4.35Å; L794-W869 HydrophobicContact CD2-CD2 4.29Å; L794-W869 VanDerWaalsContact CD2-CE2 3.47Å; L794-W869 HydrophobicContact CD2-CH2 4.12Å; L794-W869 HydrophobicContact CD2-CZ2 3.37Å; L794-W869 HydrophobicContact CG-CH2 3.77Å; L794-W869 HydrophobicContact CG-CZ2 3.44Å; L794-W869 VanDerWaalsContact CG-CZ2 3.44Å
795	L	97.6	Very high	94.3	Very high	6 Å²	6	70 Å²	70	3%	0.031	33%	0.329	C	S	.	.	H	α-helix	trans	-56.5	-46.2	171.2	-179.5	66.4	0	0	0	111.7	F791 E798 T799 F841 F844 W869 L872	F791-L795 VanDerWaalsContact O-CB 3.31Å; F791-L795 WeakPolarHBondContact O-CB 3.29Å; F791-L795 PolarHBondContact O-N 3.15Å; L795-E798 WeakPolarHBondContact O-CB 3.15Å; L795-E798 PolarHBondContact O-N 3.06Å; L795-T799 PolarHBondContact O-N 3.31Å; L795-T799 PolarHBondContact O-OG1 3.15Å; L795-F841 HydrophobicContact CD1-CB 3.78Å; L795-F841 HydrophobicContact CD1-CD1 4.24Å; L795-F841 HydrophobicContact CD1-CD2 3.53Å; L795-F841 HydrophobicContact CD1-CE2 4.14Å; L795-F841 HydrophobicContact CD1-CG 3.58Å; L795-F841 HydrophobicContact CG-CD2 4.47Å; L795-F844 HydrophobicContact CB-CD1 4.26Å; L795-F844 HydrophobicContact CD1-CD1 4.05Å; L795-F844 HydrophobicContact CD2-CD1 4.01Å; L795-F844 HydrophobicContact CG-CD1 4.32Å; L795-W869 HydrophobicContact CB-CZ3 4.36Å; L795-W869 HydrophobicContact CD1-CZ3 4.22Å; L795-L872 HydrophobicContact CD1-CD2 4.1Å
796	H	97.3	Very high	95.7	Very high	128 Å²	128	61.1 Å²	61.1	59%	0.593	30%	0.297	S	S	*	.	H	α-helix	trans	-67.5	-39.2	-178	-176.3	67.2	0	0	0	113.1	L792 K793 L794 E798 T799 K800	L792-H796 WeakPolarHBondContact O-CB 3.42Å; L792-H796 PolarHBondContact O-N 2.81Å; K793-H796 PolarHBondContact O-N 3.22Å; L794-H796 PolarHBondContact O-N 3.47Å; H796-E798 VanDerWaalsContact C-N 3.27Å; H796-E798 PolarHBondContact O-N 3.06Å; H796-T799 PolarHBondContact O-N 3.34Å; H796-K800 WeakPolarHBondContact O-CB 3.33Å; H796-K800 PolarHBondContact O-N 3.23Å
797	A	97.1	Very high	96.4	Very high	59 Å²	59	59.2 Å²	59.2	49%	0.488	29%	0.292	S	S	.	.	H	α-helix	trans	-59.5	-42.2	172.1	0	0	0	0	0	111.1	K793 L794 K800 R801	K793-A797 PolarHBondContact O-N 2.7Å; L794-A797 PolarHBondContact O-N 3.22Å; A797-K800 PolarHBondContact O-N 3.46Å; A797-R801 WeakPolarHBondContact O-CB 3.42Å; A797-R801 PolarHBondContact O-N 2.95Å
798	E	97	Very high	96.8	Very high	20 Å²	20	59.2 Å²	59.2	9%	0.093	29%	0.291	C	S	.	.	H	α-helix	trans	-68.7	-41.9	178.5	-176.1	52.8	-142.1	0	0	113	L794 L795 H796 K800 R801 M802 F841 W869 I876	L794-E798 WeakPolarHBondContact O-CB 3.38Å; L794-E798 PolarHBondContact O-N 3.15Å; L795-E798 WeakPolarHBondContact O-CB 3.15Å; L795-E798 PolarHBondContact O-N 3.06Å; H796-E798 VanDerWaalsContact C-N 3.27Å; H796-E798 PolarHBondContact O-N 3.06Å; E798-K800 VanDerWaalsContact C-N 3.33Å; E798-K800 PolarHBondContact O-N 3.26Å; E798-R801 WeakPolarHBondContact O-CB 3.46Å; E798-R801 PolarHBondContact O-N 3.45Å; E798-R801 IonicContact OE1-CZ 3.02Å; E798-R801 IonicContact OE1-NE 3.21Å; E798-R801 PolarHBondContact OE1-NE 3.2Å; E798-R801 IonicContact OE1-NH2 2.69Å; E798-R801 PolarHBondContact OE1-NH2 2.9Å; E798-R801 IonicContact OE2-CZ 3.76Å; E798-R801 IonicContact OE2-NE 3.69Å; E798-R801 PolarHBondContact OE2-NE 2.75Å; E798-R801 IonicContact OE2-NH2 3.96Å; E798-R801 PolarHBondContact OE2-NH2 3.43Å; E798-M802 WeakPolarHBondContact O-CB 3.28Å; E798-M802 PolarHBondContact O-N 3.01Å; E798-F841 HydrophobicContact CB-CE2 4.39Å; E798-F841 HydrophobicContact CG-CE2 3.9Å; E798-F841 HydrophobicContact CG-CZ 3.75Å; E798-W869 HydrophobicContact CB-CH2 4.29Å; E798-W869 HydrophobicContact CG-CH2 4.41Å; E798-I876 HydrophobicContact CG-CD1 3.59Å; E798-I876 HydrophobicContact CG-CG1 4.21Å; E798-I876 WeakPolarHBondContact OE1-CG2 3.41Å
799	T	97.8	Very high	96.9	Very high	29 Å²	29	59.4 Å²	59.4	18%	0.178	29%	0.292	C	S	.	.	H	α-helix	trans	-55.9	-49.1	170.6	-50.6	0	0	0	0	110.5	L795 H796 R801 M802 E803 M837 F841	L795-T799 PolarHBondContact O-N 3.31Å; L795-T799 PolarHBondContact O-OG1 3.15Å; H796-T799 PolarHBondContact O-N 3.34Å; T799-R801 VanDerWaalsContact C-N 3.32Å; T799-R801 PolarHBondContact O-N 3.11Å; T799-M802 PolarHBondContact O-N 2.82Å; T799-E803 HydrophobicContact CG2-CG 4.34Å; T799-E803 WeakPolarHBondContact O-CB 3.45Å; T799-E803 WeakPolarHBondContact O-CG 3.38Å; T799-E803 PolarHBondContact O-N 2.8Å; T799-M837 HydrophobicContact CG2-SD 3.88Å; T799-F841 WeakPolarHBondContact OG1-CD2 3.31Å
800	K	97.8	Very high	96.9	Very high	153 Å²	153	60.4 Å²	60.4	67%	0.665	29%	0.291	S	S	*	.	H	α-helix	trans	-63.1	-38.1	-178.5	-174.6	179.4	178.4	-177.2	0	112.1	H796 A797 E798 G804	H796-K800 WeakPolarHBondContact O-CB 3.33Å; H796-K800 PolarHBondContact O-N 3.23Å; A797-K800 PolarHBondContact O-N 3.46Å; E798-K800 VanDerWaalsContact C-N 3.33Å; E798-K800 PolarHBondContact O-N 3.26Å; K800-G804 PolarHBondContact O-N 3.11Å
801	R	97.7	Very high	96.9	Very high	85 Å²	85	59.5 Å²	59.5	32%	0.321	29%	0.287	S	S	.	.	H	α-helix	trans	-62.1	-51.1	175.2	-168.6	-176.2	77.1	81	1.7	110.9	A797 E798 T799 G804 W805 S880	A797-R801 WeakPolarHBondContact O-CB 3.42Å; A797-R801 PolarHBondContact O-N 2.95Å; E798-R801 WeakPolarHBondContact O-CB 3.46Å; E798-R801 PolarHBondContact O-N 3.45Å; E798-R801 IonicContact OE1-CZ 3.02Å; E798-R801 IonicContact OE1-NE 3.21Å; E798-R801 PolarHBondContact OE1-NE 3.2Å; E798-R801 IonicContact OE1-NH2 2.69Å; E798-R801 PolarHBondContact OE1-NH2 2.9Å; E798-R801 IonicContact OE2-CZ 3.76Å; E798-R801 IonicContact OE2-NE 3.69Å; E798-R801 PolarHBondContact OE2-NE 2.75Å; E798-R801 IonicContact OE2-NH2 3.96Å; E798-R801 PolarHBondContact OE2-NH2 3.43Å; T799-R801 VanDerWaalsContact C-N 3.32Å; T799-R801 PolarHBondContact O-N 3.11Å; R801-G804 PolarHBondContact O-N 3.49Å; R801-W805 VanDerWaalsContact NH1-CZ2 3.27Å; R801-W805 PolarHBondContact O-N 2.98Å; R801-W805 VanDerWaalsContact O-N 3.15Å; R801-S880 PolarHBondContact NH2-OG 2.94Å; R801-S880 VanDerWaalsContact NH2-OG 3.17Å
802	M	97.5	Very high	96.7	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-68.8	-40.2	-178.3	-165.7	69.2	71.1	0	0	112.6	E798 T799 G804 W805 C806 A833 M837 I876 V879 F883	E798-M802 WeakPolarHBondContact O-CB 3.28Å; E798-M802 PolarHBondContact O-N 3.01Å; T799-M802 PolarHBondContact O-N 2.82Å; M802-G804 VanDerWaalsContact C-N 3.34Å; M802-G804 PolarHBondContact O-N 3.35Å; M802-W805 PolarHBondContact O-N 3.01Å; M802-W805 HydrophobicContact SD-CE3 3.9Å; M802-W805 HydrophobicContact SD-CZ3 4.39Å; M802-C806 PolarHBondContact O-N 3.38Å; M802-C806 PolarHBondContact O-SG 3.09Å; M802-C806 VanDerWaalsContact O-SG 3.42Å; M802-A833 HydrophobicContact CG-CB 3.71Å; M802-A833 HydrophobicContact SD-CB 3.84Å; M802-M837 HydrophobicContact CB-CE 4.32Å; M802-M837 HydrophobicContact CB-SD 3.76Å; M802-M837 HydrophobicContact CG-CE 3.96Å; M802-M837 HydrophobicContact CG-CG 4.34Å; M802-M837 HydrophobicContact CG-SD 3.9Å; M802-I876 HydrophobicContact CE-CG2 4.14Å; M802-V879 HydrophobicContact CE-CB 4.16Å; M802-V879 HydrophobicContact CE-CG1 3.83Å; M802-V879 HydrophobicContact SD-CB 4.41Å; M802-V879 HydrophobicContact SD-CG1 3.45Å; M802-V879 WeakPolarHBondContact SD-CG1 3.47Å; M802-F883 HydrophobicContact SD-CD2 4.33Å; M802-F883 HydrophobicContact SD-CE2 4.02Å
803	E	97.8	Very high	96.5	Very high	81 Å²	81	59.6 Å²	59.6	38%	0.379	29%	0.292	S	S	.	.	H	α-helix	trans	-60.5	-40.6	171.2	-82.7	-169.8	-149.9	0	0	112.7	T799 W805 C806 K807 M837	T799-E803 HydrophobicContact CG2-CG 4.34Å; T799-E803 WeakPolarHBondContact O-CB 3.45Å; T799-E803 WeakPolarHBondContact O-CG 3.38Å; T799-E803 PolarHBondContact O-N 2.8Å; E803-W805 VanDerWaalsContact C-N 3.33Å; E803-C806 PolarHBondContact O-N 2.66Å; E803-K807 WeakPolarHBondContact O-CD 3.44Å; E803-K807 WeakPolarHBondContact O-CG 3.49Å; E803-K807 PolarHBondContact O-N 2.86Å; E803-K807 IonicContact OE2-NZ 3.32Å; E803-K807 PolarHBondContact OE2-NZ 3.01Å; E803-M837 HydrophobicContact CG-CE 4.14Å; E803-M837 HydrophobicContact CG-SD 3.95Å
804	G	97.5	Very high	96.4	Very high	38 Å²	38	60.3 Å²	60.3	39%	0.392	30%	0.297	S	S	.	.	H	α-helix	trans	-61.6	-43.1	177.3	0	0	0	0	0	111.6	K800 R801 M802 K807 E808	K800-G804 PolarHBondContact O-N 3.11Å; R801-G804 PolarHBondContact O-N 3.49Å; M802-G804 VanDerWaalsContact C-N 3.34Å; M802-G804 PolarHBondContact O-N 3.35Å; G804-K807 PolarHBondContact O-N 2.94Å; G804-E808 WeakPolarHBondContact O-CB 3.39Å; G804-E808 PolarHBondContact O-N 3.19Å
805	W	97.2	Very high	96.1	Very high	54 Å²	54	63.1 Å²	63.1	21%	0.205	31%	0.309	C	S	.	.	H	α-helix	trans	-64.1	-41.2	173.7	-76.7	-9.6	0	0	0	113.8	R801 M802 E803 E808 M809 S880 F883	R801-W805 VanDerWaalsContact NH1-CZ2 3.27Å; R801-W805 PolarHBondContact O-N 2.98Å; R801-W805 VanDerWaalsContact O-N 3.15Å; M802-W805 PolarHBondContact O-N 3.01Å; M802-W805 HydrophobicContact SD-CE3 3.9Å; M802-W805 HydrophobicContact SD-CZ3 4.39Å; E803-W805 VanDerWaalsContact C-N 3.33Å; W805-E808 PolarHBondContact O-N 3.12Å; W805-M809 WeakPolarHBondContact O-CG 3.15Å; W805-M809 PolarHBondContact O-N 3.49Å; W805-S880 WeakPolarHBondContact CZ3-OG 3.48Å; W805-F883 HydrophobicContact CB-CD1 3.81Å; W805-F883 HydrophobicContact CB-CD2 4.43Å; W805-F883 HydrophobicContact CB-CE1 3.83Å; W805-F883 HydrophobicContact CB-CE2 4.46Å; W805-F883 HydrophobicContact CB-CG 4.12Å; W805-F883 HydrophobicContact CB-CZ 4.16Å; W805-F883 HydrophobicContact CD2-CB 4.18Å; W805-F883 HydrophobicContact CD2-CD2 4.46Å; W805-F883 HydrophobicContact CD2-CG 4.17Å; W805-F883 HydrophobicContact CE3-CB 3.89Å; W805-F883 AromaticContact CE3-CD2 3.7Å; W805-F883 HydrophobicContact CE3-CD2 3.7Å; W805-F883 HydrophobicContact CE3-CE2 4.42Å; W805-F883 AromaticContact CE3-CG 3.81Å; W805-F883 HydrophobicContact CE3-CG 3.81Å; W805-F883 HydrophobicContact CG-CD1 4.39Å; W805-F883 HydrophobicContact CG-CG 4.4Å; W805-F883 HydrophobicContact CH2-CB 4.34Å; W805-F883 HydrophobicContact CZ3-CB 4Å; W805-F883 HydrophobicContact CZ3-CD2 4.17Å; W805-F883 HydrophobicContact CZ3-CG 4.32Å; W805-F883 WeakPolarHBondContact O-CE1 3.3Å
806	C	97.8	Very high	95.6	Very high	4 Å²	4	65.6 Å²	65.6	3%	0.027	32%	0.322	C	S	.	.	H	α-helix	trans	-56.7	-55.9	172.5	-70.8	0	0	0	0	110.7	M802 E803 E808 M809 E810 V830 A833	M802-C806 PolarHBondContact O-N 3.38Å; M802-C806 PolarHBondContact O-SG 3.09Å; M802-C806 VanDerWaalsContact O-SG 3.42Å; E803-C806 PolarHBondContact O-N 2.66Å; C806-E808 VanDerWaalsContact C-N 3.27Å; C806-E808 PolarHBondContact O-N 2.92Å; C806-M809 PolarHBondContact O-N 3.42Å; C806-M809 VanDerWaalsContact O-N 3.15Å; C806-E810 VanDerWaalsContact O-CB 3.32Å; C806-E810 WeakPolarHBondContact O-CB 3.45Å; C806-E810 VanDerWaalsContact O-CG 3.27Å; C806-E810 WeakPolarHBondContact O-CG 3.24Å; C806-E810 PolarHBondContact O-N 3.17Å; C806-V830 HydrophobicContact CB-CG1 4.24Å; C806-A833 VanDerWaalsContact SG-CB 3.54Å
807	K	97.1	Very high	95.2	Very high	118 Å²	118	68.3 Å²	68.3	51%	0.513	34%	0.341	S	S	.	.	H	α-helix	trans	-59.4	-36.5	-178.3	-69.5	159.7	-175.7	161.9	0	112.5	E803 G804 R811	E803-K807 WeakPolarHBondContact O-CD 3.44Å; E803-K807 WeakPolarHBondContact O-CG 3.49Å; E803-K807 PolarHBondContact O-N 2.86Å; E803-K807 IonicContact OE2-NZ 3.32Å; E803-K807 PolarHBondContact OE2-NZ 3.01Å; G804-K807 PolarHBondContact O-N 2.94Å; K807-R811 VanDerWaalsContact O-CB 3.23Å; K807-R811 WeakPolarHBondContact O-CB 3.27Å; K807-R811 PolarHBondContact O-N 3.3Å
808	E	96.1	Very high	94.9	Very high	56 Å²	56	66.5 Å²	66.5	26%	0.262	32%	0.323	S	S	.	.	H	α-helix	trans	-67.9	-43.4	177	-172.1	66.8	-168.8	0	0	112.4	G804 W805 C806 R811 E812 R890	G804-E808 WeakPolarHBondContact O-CB 3.39Å; G804-E808 PolarHBondContact O-N 3.19Å; W805-E808 PolarHBondContact O-N 3.12Å; C806-E808 VanDerWaalsContact C-N 3.27Å; C806-E808 PolarHBondContact O-N 2.92Å; E808-R811 VanDerWaalsContact CD-NH2 3.33Å; E808-R811 IonicContact OE1-CZ 3.93Å; E808-R811 IonicContact OE1-NH1 2.73Å; E808-R811 IonicContact OE1-NH2 2.74Å; E808-R811 PolarHBondContact OE1-NH2 2.82Å; E808-R811 IonicContact OE2-CZ 2.69Å; E808-R811 IonicContact OE2-NH1 3.05Å; E808-R811 PolarHBondContact OE2-NH1 2.87Å; E808-R811 IonicContact OE2-NH2 3.13Å; E808-R811 PolarHBondContact OE2-NH2 3.19Å; E808-E812 WeakPolarHBondContact O-CB 3.42Å; E808-E812 WeakPolarHBondContact O-CG 3.48Å; E808-E812 PolarHBondContact O-N 3.48Å; E808-R890 IonicContact OE1-CZ 3.22Å; E808-R890 IonicContact OE1-NH1 2.73Å; E808-R890 PolarHBondContact OE1-NH1 3.45Å; E808-R890 IonicContact OE1-NH2 3.16Å; E808-R890 PolarHBondContact OE1-NH2 3.17Å
809	M	95.7	Very high	94.6	Very high	4 Å²	4	68.4 Å²	68.4	2%	0.02	34%	0.339	C	S	.	.	H	α-helix	trans	-80	-30.9	179.3	-62.4	-63.8	86.8	0	0	113	W805 C806 E812 A813 I826 V830 F883 L886 W894	W805-M809 WeakPolarHBondContact O-CG 3.15Å; W805-M809 PolarHBondContact O-N 3.49Å; C806-M809 PolarHBondContact O-N 3.42Å; C806-M809 VanDerWaalsContact O-N 3.15Å; M809-E812 HydrophobicContact CE-CG 4.27Å; M809-A813 WeakPolarHBondContact O-CB 3.49Å; M809-A813 PolarHBondContact O-N 3.39Å; M809-A813 VanDerWaalsContact O-N 3.11Å; M809-I826 HydrophobicContact CB-CG2 4.05Å; M809-I826 WeakPolarHBondContact O-CG2 3.4Å; M809-V830 HydrophobicContact CB-CG2 4.24Å; M809-F883 HydrophobicContact CB-CE1 4.15Å; M809-F883 HydrophobicContact CG-CD1 3.58Å; M809-F883 HydrophobicContact CG-CE1 3.59Å; M809-L886 HydrophobicContact CG-CD1 4.27Å; M809-L886 HydrophobicContact SD-CB 3.72Å; M809-L886 HydrophobicContact SD-CD1 4.39Å; M809-W894 HydrophobicContact SD-CH2 4.3Å
810	E	95.8	Very high	94.4	Very high	70 Å²	70	74.8 Å²	74.8	33%	0.327	37%	0.366	S	S	.	.	H	α-helix	trans	-62	-49.5	170.1	-73.7	170.3	139.3	0	0	109.7	C806 E812 A813 E814 V830 Q834	C806-E810 VanDerWaalsContact O-CB 3.32Å; C806-E810 WeakPolarHBondContact O-CB 3.45Å; C806-E810 VanDerWaalsContact O-CG 3.27Å; C806-E810 WeakPolarHBondContact O-CG 3.24Å; C806-E810 PolarHBondContact O-N 3.17Å; E810-E812 PolarHBondContact O-N 3.28Å; E810-A813 WeakPolarHBondContact O-CB 3.45Å; E810-A813 PolarHBondContact O-N 3.1Å; E810-A813 VanDerWaalsContact O-N 3.11Å; E810-E814 PolarHBondContact O-N 3.29Å; E810-V830 HydrophobicContact CG-CG1 3.83Å; E810-V830 HydrophobicContact CG-CG2 4.14Å; E810-V830 VanDerWaalsContact OE1-CG1 3.31Å; E810-V830 WeakPolarHBondContact OE1-CG1 3.49Å; E810-Q834 PolarHBondContact OE1-NE2 3.24Å
811	R	95.1	Very high	94.1	Very high	85 Å²	85	72.2 Å²	72.2	32%	0.321	36%	0.357	S	S	.	.	H	α-helix	trans	-62.8	-43.7	177.3	-163.6	-164.8	68.4	-107.2	-8.1	112.4	K807 E808 A813 E814 E815	K807-R811 VanDerWaalsContact O-CB 3.23Å; K807-R811 WeakPolarHBondContact O-CB 3.27Å; K807-R811 PolarHBondContact O-N 3.3Å; E808-R811 VanDerWaalsContact CD-NH2 3.33Å; E808-R811 IonicContact OE1-CZ 3.93Å; E808-R811 IonicContact OE1-NH1 2.73Å; E808-R811 IonicContact OE1-NH2 2.74Å; E808-R811 PolarHBondContact OE1-NH2 2.82Å; E808-R811 IonicContact OE2-CZ 2.69Å; E808-R811 IonicContact OE2-NH1 3.05Å; E808-R811 PolarHBondContact OE2-NH1 2.87Å; E808-R811 IonicContact OE2-NH2 3.13Å; E808-R811 PolarHBondContact OE2-NH2 3.19Å; R811-A813 PolarHBondContact O-N 2.61Å; R811-E814 CarbonylContact O-C 3.53Å; R811-E814 PolarHBondContact O-N 3.02Å; R811-E815 VanDerWaalsContact CD-OE1 3.28Å; R811-E815 WeakPolarHBondContact CD-OE1 3.42Å; R811-E815 WeakPolarHBondContact CD-OE2 3.34Å; R811-E815 VanDerWaalsContact CG-CD 3.49Å; R811-E815 HydrophobicContact CG-CG 4.03Å; R811-E815 IonicContact CZ-OE2 3.16Å; R811-E815 VanDerWaalsContact NE-CD 3.33Å; R811-E815 IonicContact NE-OE1 2.71Å; R811-E815 PolarHBondContact NE-OE1 2.88Å; R811-E815 IonicContact NE-OE2 3.56Å; R811-E815 PolarHBondContact NE-OE2 3.25Å; R811-E815 IonicContact NH2-OE2 2.64Å; R811-E815 WeakPolarHBondContact O-CB 3.33Å; R811-E815 WeakPolarHBondContact O-CG 3.35Å; R811-E815 PolarHBondContact O-N 2.81Å
812	E	92.3	Very high	93.9	Very high	19 Å²	19	68.4 Å²	68.4	9%	0.089	34%	0.343	C	S	.	.	H	α-helix	trans	-62.1	-26.3	175	-76.8	-79.8	148.8	0	0	113.3	E808 M809 E810 N816 R890 W894	E808-E812 WeakPolarHBondContact O-CB 3.42Å; E808-E812 WeakPolarHBondContact O-CG 3.48Å; E808-E812 PolarHBondContact O-N 3.48Å; M809-E812 HydrophobicContact CE-CG 4.27Å; E810-E812 PolarHBondContact O-N 3.28Å; E812-N816 WeakPolarHBondContact O-CB 3.39Å; E812-N816 PolarHBondContact O-N 3.4Å; E812-N816 PolarHBondContact O-ND2 2.92Å; E812-N816 PolarHBondContact OE2-ND2 2.76Å; E812-R890 IonicContact OE1-CZ 2.75Å; E812-R890 IonicContact OE1-NE 3.44Å; E812-R890 PolarHBondContact OE1-NE 2.88Å; E812-R890 IonicContact OE1-NH2 2.73Å; E812-R890 PolarHBondContact OE1-NH2 2.6Å; E812-R890 IonicContact OE2-NE 2.68Å; E812-R890 PolarHBondContact OE2-NE 3.31Å; E812-W894 HydrophobicContact CB-CH2 4.42Å; E812-W894 HydrophobicContact CB-CZ2 3.77Å; E812-W894 HydrophobicContact CG-CZ2 4.09Å; E812-W894 WeakPolarHBondContact OE2-CZ2 3.46Å; E812-W894 PolarHBondContact OE2-NE1 3.41Å
813	A	92.9	Very high	93.7	Very high	28 Å²	28	69.8 Å²	69.8	23%	0.231	35%	0.35	C	S	.	.	H	α-helix	trans	-81.1	-12.1	173.4	0	0	0	0	0	114.3	M809 E810 R811 L818 L823 I826	M809-A813 WeakPolarHBondContact O-CB 3.49Å; M809-A813 PolarHBondContact O-N 3.39Å; M809-A813 VanDerWaalsContact O-N 3.11Å; E810-A813 WeakPolarHBondContact O-CB 3.45Å; E810-A813 PolarHBondContact O-N 3.1Å; E810-A813 VanDerWaalsContact O-N 3.11Å; R811-A813 PolarHBondContact O-N 2.61Å; A813-L818 HydrophobicContact CB-CD1 4.35Å; A813-L823 HydrophobicContact CB-CD2 3.71Å; A813-I826 HydrophobicContact CB-CD1 3.94Å; A813-I826 HydrophobicContact CB-CG2 4.16Å
814	E	92.1	Very high	93.6	Very high	168 Å²	168	67.6 Å²	67.6	79%	0.785	35%	0.349	S	S	*	.	H	α-helix	trans	-98.2	-32.4	172	-67.2	179.4	171.6	0	0	111.8	E810 R811	E810-E814 PolarHBondContact O-N 3.29Å; R811-E814 CarbonylContact O-C 3.53Å; R811-E814 PolarHBondContact O-N 3.02Å
815	E	90.8	Very high	93.6	Very high	121 Å²	121	68.6 Å²	68.6	57%	0.565	34%	0.342	S	S	*	.	H	α-helix	trans	-84.1	-20	-178.8	-71.2	176.9	154.1	0	0	113.9	R811	R811-E815 VanDerWaalsContact CD-OE1 3.28Å; R811-E815 WeakPolarHBondContact CD-OE1 3.42Å; R811-E815 WeakPolarHBondContact CD-OE2 3.34Å; R811-E815 VanDerWaalsContact CG-CD 3.49Å; R811-E815 HydrophobicContact CG-CG 4.03Å; R811-E815 IonicContact CZ-OE2 3.16Å; R811-E815 VanDerWaalsContact NE-CD 3.33Å; R811-E815 IonicContact NE-OE1 2.71Å; R811-E815 PolarHBondContact NE-OE1 2.88Å; R811-E815 IonicContact NE-OE2 3.56Å; R811-E815 PolarHBondContact NE-OE2 3.25Å; R811-E815 IonicContact NH2-OE2 2.64Å; R811-E815 WeakPolarHBondContact O-CB 3.33Å; R811-E815 WeakPolarHBondContact O-CG 3.35Å; R811-E815 PolarHBondContact O-N 2.81Å
816	N	86.9	Confident	93.5	Very high	58 Å²	58	66.2 Å²	66.2	31%	0.31	33%	0.334	S	S	.	.	S	Bend	trans	-122	140.8	-179.5	-58.3	-95.1	0	0	0	112.2	E812 L818	E812-N816 WeakPolarHBondContact O-CB 3.39Å; E812-N816 PolarHBondContact O-N 3.4Å; E812-N816 PolarHBondContact O-ND2 2.92Å; E812-N816 PolarHBondContact OE2-ND2 2.76Å; N816-L818 HydrophobicContact CB-CD2 3.53Å; N816-L818 HydrophobicContact CB-CG 3.81Å; N816-L818 PolarHBondContact O-N 3.24Å
817	D	89.4	Confident	93.5	Very high	185 Å²	185	73.7 Å²	73.7	99%	0.989	36%	0.361	S	S	*	.			trans	-72	74.9	167.2	-83.9	-45.2	0	0	0	111.2
818	L	90.5	Very high	93.5	Very high	20 Å²	20	71.8 Å²	71.8	11%	0.105	36%	0.363	C	S	.	.			trans	-79.3	147.2	-179	-57	-175.9	0	0	0	112.4	A813 N816 I822 L823 I826 W894	A813-L818 HydrophobicContact CB-CD1 4.35Å; N816-L818 HydrophobicContact CB-CD2 3.53Å; N816-L818 HydrophobicContact CB-CG 3.81Å; N816-L818 PolarHBondContact O-N 3.24Å; L818-I822 HydrophobicContact CB-CB 4.43Å; L818-I822 HydrophobicContact CB-CG2 4.29Å; L818-I822 HydrophobicContact CD1-CG2 3.93Å; L818-L823 HydrophobicContact CB-CD2 3.85Å; L818-L823 HydrophobicContact CB-CG 3.89Å; L818-L823 HydrophobicContact CD1-CD2 4.26Å; L818-L823 HydrophobicContact CG-CD2 4.49Å; L818-L823 WeakPolarHBondContact O-CD1 3.23Å; L818-I826 HydrophobicContact CD1-CD1 3.45Å; L818-I826 VanDerWaalsContact CD1-CD1 3.45Å; L818-W894 HydrophobicContact CD1-CD2 4.28Å; L818-W894 HydrophobicContact CD1-CE3 4.36Å; L818-W894 HydrophobicContact CD1-CH2 4.48Å; L818-W894 HydrophobicContact CD1-CZ2 4.43Å; L818-W894 HydrophobicContact CD1-CZ3 4.45Å; L818-W894 HydrophobicContact CD2-CB 3.7Å; L818-W894 HydrophobicContact CD2-CD2 3.54Å; L818-W894 HydrophobicContact CD2-CE3 4.17Å; L818-W894 HydrophobicContact CD2-CG 3.29Å
819	S	90.8	Very high	93.6	Very high	61 Å²	61	69.2 Å²	69.2	43%	0.427	35%	0.351	S	S	.	.			trans	-66.7	151	174.6	69.7	0	0	0	0	111.8	E821 I822 L823	S819-E821 PolarHBondContact O-N 2.97Å; S819-E821 VanDerWaalsContact O-N 3.1Å; S819-I822 PolarHBondContact O-N 2.92Å; S819-I822 WeakPolarHBondContact OG-CG1 3.32Å; S819-L823 PolarHBondContact O-N 3.12Å
820	E	92.9	Very high	93.7	Very high	162 Å²	162	69.3 Å²	69.3	76%	0.757	35%	0.352	S	S	*	.	H	α-helix	trans	-57.1	-29.8	-177.2	-74.3	-150.2	120.4	0	0	114.3	G824	E820-G824 PolarHBondContact O-N 3.29Å
821	E	92.6	Very high	93.8	Very high	100 Å²	100	67.5 Å²	67.5	47%	0.467	35%	0.352	S	S	.	.	H	α-helix	trans	-68.3	-39.4	175.1	-170.3	177.7	148.4	0	0	111.5	S819 G824 K825 M896	S819-E821 PolarHBondContact O-N 2.97Å; S819-E821 VanDerWaalsContact O-N 3.1Å; E821-G824 PolarHBondContact O-N 3.41Å; E821-K825 WeakPolarHBondContact O-CG 3.35Å; E821-K825 PolarHBondContact O-N 3.45Å; E821-K825 IonicContact OE1-NZ 3.02Å; E821-M896 VanDerWaalsContact CD-CE 3.46Å; E821-M896 WeakPolarHBondContact OE1-CE 3Å; E821-M896 VanDerWaalsContact OE2-CE 3.3Å; E821-M896 WeakPolarHBondContact OE2-CE 3.48Å
822	I	93.1	Very high	94	Very high	5 Å²	5	64.8 Å²	64.8	3%	0.026	35%	0.346	C	S	.	.	H	α-helix	trans	-71.3	-43.9	177.3	-62.1	174.6	0	0	0	110	L818 S819 G824 K825 I826 W894	L818-I822 HydrophobicContact CB-CB 4.43Å; L818-I822 HydrophobicContact CB-CG2 4.29Å; L818-I822 HydrophobicContact CD1-CG2 3.93Å; S819-I822 PolarHBondContact O-N 2.92Å; S819-I822 WeakPolarHBondContact OG-CG1 3.32Å; I822-G824 PolarHBondContact O-N 2.96Å; I822-K825 PolarHBondContact O-N 3.42Å; I822-K825 VanDerWaalsContact O-N 3.11Å; I822-I826 HydrophobicContact CG2-CD1 4.16Å; I822-I826 WeakPolarHBondContact O-CG1 3.27Å; I822-I826 PolarHBondContact O-N 3.46Å; I822-W894 HydrophobicContact CD1-CB 4.27Å; I822-W894 WeakPolarHBondContact CD1-O 3.34Å; I822-W894 HydrophobicContact CG2-CE3 3.6Å; I822-W894 HydrophobicContact CG2-CZ3 3.79Å
823	L	94.5	Very high	94.3	Very high	29 Å²	29	63.9 Å²	63.9	15%	0.152	34%	0.342	C	S	.	.	H	α-helix	trans	-58.5	-37.8	171.4	-67.4	174.8	0	0	0	111.6	A813 L818 S819 I826 R827	A813-L823 HydrophobicContact CB-CD2 3.71Å; L818-L823 HydrophobicContact CB-CD2 3.85Å; L818-L823 HydrophobicContact CB-CG 3.89Å; L818-L823 HydrophobicContact CD1-CD2 4.26Å; L818-L823 HydrophobicContact CG-CD2 4.49Å; L818-L823 WeakPolarHBondContact O-CD1 3.23Å; S819-L823 PolarHBondContact O-N 3.12Å; L823-I826 PolarHBondContact O-N 3.23Å; L823-R827 WeakPolarHBondContact O-CB 3.43Å; L823-R827 WeakPolarHBondContact O-CD 3.28Å; L823-R827 WeakPolarHBondContact O-CG 3.43Å; L823-R827 PolarHBondContact O-N 3.46Å
824	G	95.7	Very high	94.5	Very high	34 Å²	34	66.8 Å²	66.8	35%	0.351	35%	0.351	S	S	.	.	H	α-helix	trans	-62.3	-44.4	172.9	0	0	0	0	0	112.7	E820 E821 I822 S828	E820-G824 PolarHBondContact O-N 3.29Å; E821-G824 PolarHBondContact O-N 3.41Å; I822-G824 PolarHBondContact O-N 2.96Å; G824-S828 VanDerWaalsContact O-CB 3.25Å; G824-S828 WeakPolarHBondContact O-CB 3.47Å; G824-S828 PolarHBondContact O-N 3.43Å
825	K	95.9	Very high	94.8	Very high	59 Å²	59	63.1 Å²	63.1	26%	0.257	34%	0.336	S	S	.	.	H	α-helix	trans	-64.4	-42.9	174.5	-71.7	-178.9	-179.3	-170.8	0	112.4	E821 I822 S828 A829 E885 L886 L889	E821-K825 WeakPolarHBondContact O-CG 3.35Å; E821-K825 PolarHBondContact O-N 3.45Å; E821-K825 IonicContact OE1-NZ 3.02Å; I822-K825 PolarHBondContact O-N 3.42Å; I822-K825 VanDerWaalsContact O-N 3.11Å; K825-S828 PolarHBondContact O-N 2.86Å; K825-A829 WeakPolarHBondContact O-CB 3.38Å; K825-A829 PolarHBondContact O-N 3.06Å; K825-E885 IonicContact NZ-OE1 3.28Å; K825-E885 PolarHBondContact NZ-OE1 3.42Å; K825-L886 HydrophobicContact CB-CD2 3.79Å; K825-L889 HydrophobicContact CD-CD1 4.23Å
826	I	96.6	Very high	95.1	Very high	5 Å²	5	58.2 Å²	58.2	3%	0.026	31%	0.313	C	S	.	.	H	α-helix	trans	-60.1	-54.9	175.5	-68.7	172.8	0	0	0	110.1	M809 A813 L818 I822 L823 S828 A829 V830 L886 W894	M809-I826 HydrophobicContact CB-CG2 4.05Å; M809-I826 WeakPolarHBondContact O-CG2 3.4Å; A813-I826 HydrophobicContact CB-CD1 3.94Å; A813-I826 HydrophobicContact CB-CG2 4.16Å; L818-I826 HydrophobicContact CD1-CD1 3.45Å; L818-I826 VanDerWaalsContact CD1-CD1 3.45Å; I822-I826 HydrophobicContact CG2-CD1 4.16Å; I822-I826 WeakPolarHBondContact O-CG1 3.27Å; I822-I826 PolarHBondContact O-N 3.46Å; L823-I826 PolarHBondContact O-N 3.23Å; I826-S828 PolarHBondContact O-N 2.98Å; I826-A829 PolarHBondContact O-N 3.39Å; I826-V830 HydrophobicContact CG2-CG2 4Å; I826-V830 VanDerWaalsContact O-CB 3.27Å; I826-V830 WeakPolarHBondContact O-CB 3.47Å; I826-V830 VanDerWaalsContact O-CG2 3.24Å; I826-V830 WeakPolarHBondContact O-CG2 3.39Å; I826-V830 PolarHBondContact O-N 3.43Å; I826-L886 HydrophobicContact CB-CD1 4.49Å; I826-L886 HydrophobicContact CG1-CD1 3.99Å; I826-L886 HydrophobicContact CG1-CD2 3.56Å; I826-L886 HydrophobicContact CG1-CG 4.37Å; I826-W894 HydrophobicContact CD1-CH2 4.2Å; I826-W894 HydrophobicContact CD1-CZ3 4.29Å
827	R	97.1	Very high	95.7	Very high	160 Å²	160	56.7 Å²	56.7	60%	0.604	31%	0.305	S	S	*	.	H	α-helix	trans	-56.3	-36	177.1	-69.2	164.2	-172.3	159.6	3.2	112.3	L823 G831	L823-R827 WeakPolarHBondContact O-CB 3.43Å; L823-R827 WeakPolarHBondContact O-CD 3.28Å; L823-R827 WeakPolarHBondContact O-CG 3.43Å; L823-R827 PolarHBondContact O-N 3.46Å; R827-G831 WeakPolarHBondContact O-CA 3.43Å; R827-G831 PolarHBondContact O-N 3.4Å
828	S	97.7	Very high	96	Very high	78 Å²	78	50.6 Å²	50.6	55%	0.545	28%	0.277	S	S	.	.	H	α-helix	trans	-71.6	-45.1	177	-174.9	0	0	0	0	113.1	G824 K825 I826 S832	G824-S828 VanDerWaalsContact O-CB 3.25Å; G824-S828 WeakPolarHBondContact O-CB 3.47Å; G824-S828 PolarHBondContact O-N 3.43Å; K825-S828 PolarHBondContact O-N 2.86Å; I826-S828 PolarHBondContact O-N 2.98Å; S828-S832 WeakPolarHBondContact O-CB 3.25Å; S828-S832 PolarHBondContact O-N 3.03Å; S828-S832 PolarHBondContact O-OG 2.98Å
829	A	97.9	Very high	96.3	Very high	2 Å²	2	54.5 Å²	54.5	2%	0.017	30%	0.295	C	S	.	.	H	α-helix	trans	-65.3	-54.1	178	0	0	0	0	0	111	K825 I826 G831 S832 A833 K882 F883 L886	K825-A829 WeakPolarHBondContact O-CB 3.38Å; K825-A829 PolarHBondContact O-N 3.06Å; I826-A829 PolarHBondContact O-N 3.39Å; A829-G831 PolarHBondContact O-N 3.07Å; A829-S832 PolarHBondContact O-N 2.82Å; A829-S832 VanDerWaalsContact O-N 3.12Å; A829-S832 PolarHBondContact O-OG 3.47Å; A829-A833 PolarHBondContact O-N 3.01Å; A829-K882 HydrophobicContact CB-CB 3.81Å; A829-F883 HydrophobicContact CB-CE2 4.3Å; A829-F883 HydrophobicContact CB-CZ 4.27Å; A829-L886 HydrophobicContact CB-CD1 3.52Å
830	V	98.1	Very high	96.6	Very high	6 Å²	6	55.7 Å²	55.7	4%	0.036	29%	0.292	C	S	.	.	H	α-helix	trans	-57.4	-47.6	177.4	173.3	0	0	0	0	111	C806 M809 E810 I826 S832 A833 Q834 F883	C806-V830 HydrophobicContact CB-CG1 4.24Å; M809-V830 HydrophobicContact CB-CG2 4.24Å; E810-V830 HydrophobicContact CG-CG1 3.83Å; E810-V830 HydrophobicContact CG-CG2 4.14Å; E810-V830 VanDerWaalsContact OE1-CG1 3.31Å; E810-V830 WeakPolarHBondContact OE1-CG1 3.49Å; I826-V830 HydrophobicContact CG2-CG2 4Å; I826-V830 VanDerWaalsContact O-CB 3.27Å; I826-V830 WeakPolarHBondContact O-CB 3.47Å; I826-V830 VanDerWaalsContact O-CG2 3.24Å; I826-V830 WeakPolarHBondContact O-CG2 3.39Å; I826-V830 PolarHBondContact O-N 3.43Å; V830-S832 VanDerWaalsContact C-N 3.34Å; V830-S832 PolarHBondContact O-N 3.34Å; V830-A833 WeakPolarHBondContact O-CB 3.48Å; V830-A833 PolarHBondContact O-N 2.66Å; V830-Q834 HydrophobicContact CG1-CG 4.34Å; V830-Q834 VanDerWaalsContact CG1-NE2 3.29Å; V830-Q834 WeakPolarHBondContact O-CB 3.46Å; V830-Q834 WeakPolarHBondContact O-CG 3.42Å; V830-Q834 PolarHBondContact O-N 3.3Å; V830-F883 HydrophobicContact CG2-CE1 4.26Å; V830-F883 HydrophobicContact CG2-CZ 4.21Å
831	G	98	Very high	96.9	Very high	32 Å²	32	48.3 Å²	48.3	33%	0.33	26%	0.257	S	S	.	.	H	α-helix	trans	-60.9	-40.1	175.8	0	0	0	0	0	112.8	R827 A829 L835	R827-G831 WeakPolarHBondContact O-CA 3.43Å; R827-G831 PolarHBondContact O-N 3.4Å; A829-G831 PolarHBondContact O-N 3.07Å; G831-L835 VanDerWaalsContact O-CB 3.25Å; G831-L835 WeakPolarHBondContact O-CB 3.3Å; G831-L835 PolarHBondContact O-N 3.01Å
832	S	98.1	Very high	97.1	Very high	29 Å²	29	48.7 Å²	48.7	20%	0.203	26%	0.259	C	S	.	.	H	α-helix	trans	-68.1	-36.2	176.5	71.4	0	0	0	0	113	S828 A829 V830 L836	S828-S832 WeakPolarHBondContact O-CB 3.25Å; S828-S832 PolarHBondContact O-N 3.03Å; S828-S832 PolarHBondContact O-OG 2.98Å; A829-S832 PolarHBondContact O-N 2.82Å; A829-S832 VanDerWaalsContact O-N 3.12Å; A829-S832 PolarHBondContact O-OG 3.47Å; V830-S832 VanDerWaalsContact C-N 3.34Å; V830-S832 PolarHBondContact O-N 3.34Å; S832-L836 VanDerWaalsContact O-CB 3.31Å; S832-L836 WeakPolarHBondContact O-CB 3.45Å; S832-L836 PolarHBondContact O-N 3.24Å
833	A	98.3	Very high	97.3	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-66.7	-49	173	0	0	0	0	0	112.8	M802 C806 A829 V830 L835 L836 M837 V879 F883	M802-A833 HydrophobicContact CG-CB 3.71Å; M802-A833 HydrophobicContact SD-CB 3.84Å; C806-A833 VanDerWaalsContact SG-CB 3.54Å; A829-A833 PolarHBondContact O-N 3.01Å; V830-A833 WeakPolarHBondContact O-CB 3.48Å; V830-A833 PolarHBondContact O-N 2.66Å; A833-L835 VanDerWaalsContact C-N 3.27Å; A833-L835 PolarHBondContact O-N 3.38Å; A833-L836 PolarHBondContact O-N 2.99Å; A833-M837 HydrophobicContact CB-CE 4.35Å; A833-M837 WeakPolarHBondContact O-CB 3.33Å; A833-M837 WeakPolarHBondContact O-CG 3.42Å; A833-M837 PolarHBondContact O-N 3.2Å; A833-V879 HydrophobicContact CB-CG1 3.73Å; A833-F883 HydrophobicContact CB-CE2 3.92Å; A833-F883 HydrophobicContact CB-CZ 4.23Å
834	Q	98	Very high	97.4	Very high	88 Å²	88	51.7 Å²	51.7	41%	0.411	27%	0.272	S	S	.	.	H	α-helix	trans	-61.3	-37.2	177.2	-70.9	173.3	-0.7	0	0	111.1	E810 V830 S838	E810-Q834 PolarHBondContact OE1-NE2 3.24Å; V830-Q834 HydrophobicContact CG1-CG 4.34Å; V830-Q834 VanDerWaalsContact CG1-NE2 3.29Å; V830-Q834 WeakPolarHBondContact O-CB 3.46Å; V830-Q834 WeakPolarHBondContact O-CG 3.42Å; V830-Q834 PolarHBondContact O-N 3.3Å; Q834-S838 VanDerWaalsContact O-CB 3.26Å; Q834-S838 WeakPolarHBondContact O-CB 3.44Å; Q834-S838 PolarHBondContact O-N 2.99Å; Q834-S838 PolarHBondContact O-OG 3.28Å
835	L	98.1	Very high	97.5	Very high	92 Å²	92	54.8 Å²	54.8	48%	0.482	27%	0.274	S	S	.	.	H	α-helix	trans	-67.5	-44.1	173.5	-165.9	69.5	0	0	0	112.1	G831 A833 M837 S838 Q839	G831-L835 VanDerWaalsContact O-CB 3.25Å; G831-L835 WeakPolarHBondContact O-CB 3.3Å; G831-L835 PolarHBondContact O-N 3.01Å; A833-L835 VanDerWaalsContact C-N 3.27Å; A833-L835 PolarHBondContact O-N 3.38Å; L835-M837 PolarHBondContact O-N 3.44Å; L835-S838 WeakPolarHBondContact CA-OG 3.12Å; L835-S838 PolarHBondContact O-N 2.81Å; L835-S838 PolarHBondContact O-OG 2.95Å; L835-Q839 HydrophobicContact CD1-CG 4.19Å; L835-Q839 HydrophobicContact CG-CG 4.48Å; L835-Q839 WeakPolarHBondContact O-CB 3.47Å; L835-Q839 WeakPolarHBondContact O-CG 3.39Å; L835-Q839 PolarHBondContact O-N 3.35Å
836	L	98.2	Very high	97.6	Very high	17 Å²	17	59.2 Å²	59.2	9%	0.089	29%	0.289	C	S	.	.	H	α-helix	trans	-61.7	-43.3	177.7	-171.8	69.3	0	0	0	111.7	S832 A833 K840 F841 L872 I876 V879	S832-L836 VanDerWaalsContact O-CB 3.31Å; S832-L836 WeakPolarHBondContact O-CB 3.45Å; S832-L836 PolarHBondContact O-N 3.24Å; A833-L836 PolarHBondContact O-N 2.99Å; L836-K840 HydrophobicContact CD1-CB 3.83Å; L836-K840 HydrophobicContact CD1-CG 3.91Å; L836-K840 PolarHBondContact O-N 3Å; L836-F841 HydrophobicContact CD2-CE1 3.71Å; L836-F841 HydrophobicContact CD2-CZ 4.31Å; L836-F841 HydrophobicContact CG-CD1 4.02Å; L836-F841 HydrophobicContact CG-CE1 3.65Å; L836-F841 WeakPolarHBondContact O-CD1 3.49Å; L836-F841 PolarHBondContact O-N 3.48Å; L836-L872 HydrophobicContact CD1-CD1 4.25Å; L836-I876 HydrophobicContact CD2-CG1 3.96Å; L836-V879 HydrophobicContact CD2-CG2 4.01Å
837	M	98.1	Very high	97.5	Very high	26 Å²	26	61.1 Å²	61.1	13%	0.128	30%	0.299	C	S	.	.	I	π-helix	trans	-70.4	-40.3	177.7	-69.4	-173.1	-70.9	0	0	112.8	T799 M802 E803 A833 L835 F841	T799-M837 HydrophobicContact CG2-SD 3.88Å; M802-M837 HydrophobicContact CB-CE 4.32Å; M802-M837 HydrophobicContact CB-SD 3.76Å; M802-M837 HydrophobicContact CG-CE 3.96Å; M802-M837 HydrophobicContact CG-CG 4.34Å; M802-M837 HydrophobicContact CG-SD 3.9Å; E803-M837 HydrophobicContact CG-CE 4.14Å; E803-M837 HydrophobicContact CG-SD 3.95Å; A833-M837 HydrophobicContact CB-CE 4.35Å; A833-M837 WeakPolarHBondContact O-CB 3.33Å; A833-M837 WeakPolarHBondContact O-CG 3.42Å; A833-M837 PolarHBondContact O-N 3.2Å; L835-M837 PolarHBondContact O-N 3.44Å; M837-F841 HydrophobicContact CB-CD2 4.41Å; M837-F841 HydrophobicContact CG-CD2 3.85Å; M837-F841 HydrophobicContact CG-CE2 3.89Å; M837-F841 HydrophobicContact CG-CG 4.3Å; M837-F841 HydrophobicContact CG-CZ 4.39Å; M837-F841 WeakPolarHBondContact O-CB 3.44Å
838	S	97	Very high	97.5	Very high	57 Å²	57	53.5 Å²	53.5	40%	0.399	27%	0.271	S	S	.	.	I	π-helix	trans	-75.1	-25.9	178.8	56.3	0	0	0	0	113.7	Q834 L835 Q842	Q834-S838 VanDerWaalsContact O-CB 3.26Å; Q834-S838 WeakPolarHBondContact O-CB 3.44Å; Q834-S838 PolarHBondContact O-N 2.99Å; Q834-S838 PolarHBondContact O-OG 3.28Å; L835-S838 WeakPolarHBondContact CA-OG 3.12Å; L835-S838 PolarHBondContact O-N 2.81Å; L835-S838 PolarHBondContact O-OG 2.95Å; S838-Q842 WeakPolarHBondContact O-CG 3.32Å; S838-Q842 PolarHBondContact O-OE1 3.42Å
839	Q	96.5	Very high	97.4	Very high	103 Å²	103	53.5 Å²	53.5	48%	0.481	26%	0.262	S	S	.	.	I	π-helix	trans	-104.2	-71.6	-180	-61.1	-173.4	-12.1	0	0	112.8	L835 Q842 Q843	L835-Q839 HydrophobicContact CD1-CG 4.19Å; L835-Q839 HydrophobicContact CG-CG 4.48Å; L835-Q839 WeakPolarHBondContact O-CB 3.47Å; L835-Q839 WeakPolarHBondContact O-CG 3.39Å; L835-Q839 PolarHBondContact O-N 3.35Å; Q839-Q842 PolarHBondContact O-N 3.41Å; Q839-Q843 WeakPolarHBondContact O-CG 3.37Å; Q839-Q843 PolarHBondContact O-N 2.88Å
840	K	97	Very high	97.2	Very high	86 Å²	86	57.6 Å²	57.6	37%	0.374	28%	0.281	S	S	.	.	I	π-helix	trans	-73.1	-35.7	-168.6	-66.5	-67	179.4	-174.8	0	112.9	L836 Q843 F844 Y868 L872	L836-K840 HydrophobicContact CD1-CB 3.83Å; L836-K840 HydrophobicContact CD1-CG 3.91Å; L836-K840 PolarHBondContact O-N 3Å; K840-Q843 PolarHBondContact O-N 3.41Å; K840-F844 WeakPolarHBondContact O-CB 3.43Å; K840-F844 PolarHBondContact O-N 3.32Å; K840-Y868 WeakPolarHBondContact CD-OH 3.29Å; K840-L872 HydrophobicContact CB-CD1 3.55Å
841	F	98.1	Very high	97	Very high	6 Å²	6	57.9 Å²	57.9	3%	0.026	28%	0.282	C	S	.	.	I	π-helix	trans	-70.7	-37.2	175.9	-71.7	30.8	0	0	0	110.6	L795 E798 T799 L836 M837 F844 Y845 L872 I876	L795-F841 HydrophobicContact CD1-CB 3.78Å; L795-F841 HydrophobicContact CD1-CD1 4.24Å; L795-F841 HydrophobicContact CD1-CD2 3.53Å; L795-F841 HydrophobicContact CD1-CE2 4.14Å; L795-F841 HydrophobicContact CD1-CG 3.58Å; L795-F841 HydrophobicContact CG-CD2 4.47Å; E798-F841 HydrophobicContact CB-CE2 4.39Å; E798-F841 HydrophobicContact CG-CE2 3.9Å; E798-F841 HydrophobicContact CG-CZ 3.75Å; T799-F841 WeakPolarHBondContact OG1-CD2 3.31Å; L836-F841 HydrophobicContact CD2-CE1 3.71Å; L836-F841 HydrophobicContact CD2-CZ 4.31Å; L836-F841 HydrophobicContact CG-CD1 4.02Å; L836-F841 HydrophobicContact CG-CE1 3.65Å; L836-F841 WeakPolarHBondContact O-CD1 3.49Å; L836-F841 PolarHBondContact O-N 3.48Å; M837-F841 HydrophobicContact CB-CD2 4.41Å; M837-F841 HydrophobicContact CG-CD2 3.85Å; M837-F841 HydrophobicContact CG-CE2 3.89Å; M837-F841 HydrophobicContact CG-CG 4.3Å; M837-F841 HydrophobicContact CG-CZ 4.39Å; M837-F841 WeakPolarHBondContact O-CB 3.44Å; F841-F844 PolarHBondContact O-N 2.98Å; F841-Y845 VanDerWaalsContact O-CB 3.31Å; F841-Y845 WeakPolarHBondContact O-CB 3.42Å; F841-Y845 PolarHBondContact O-N 3.06Å; F841-L872 HydrophobicContact CD1-CD1 3.83Å; F841-L872 HydrophobicContact CD1-CD2 4.03Å; F841-L872 HydrophobicContact CD1-CG 4.25Å; F841-L872 HydrophobicContact CE1-CD1 3.88Å; F841-L872 HydrophobicContact CE1-CD2 4.21Å; F841-L872 HydrophobicContact CE1-CG 4.09Å; F841-I876 HydrophobicContact CE1-CD1 3.99Å; F841-I876 HydrophobicContact CE1-CG1 3.85Å; F841-I876 HydrophobicContact CZ-CD1 3.88Å; F841-I876 HydrophobicContact CZ-CG1 3.79Å
842	Q	97.6	Very high	96.8	Very high	109 Å²	109	59.4 Å²	59.4	51%	0.509	28%	0.281	S	S	.	.	H	α-helix	trans	-65.3	-42.6	172.7	-67.1	-166.1	13.1	0	0	112.1	S838 Q839 F844 Y845 W846	S838-Q842 WeakPolarHBondContact O-CG 3.32Å; S838-Q842 PolarHBondContact O-OE1 3.42Å; Q839-Q842 PolarHBondContact O-N 3.41Å; Q842-F844 VanDerWaalsContact C-N 3.33Å; Q842-F844 PolarHBondContact O-N 3.47Å; Q842-Y845 WeakPolarHBondContact O-CB 3.45Å; Q842-Y845 PolarHBondContact O-N 3.01Å; Q842-W846 PolarHBondContact O-N 2.94Å; Q842-W846 VanDerWaalsContact O-N 3.07Å
843	Q	96.7	Very high	96.4	Very high	96 Å²	96	60.9 Å²	60.9	45%	0.449	29%	0.287	S	S	.	.	H	α-helix	trans	-57.1	-46.4	172.5	-75.4	-179.9	-10.8	0	0	111.3	Q839 K840 W846 L847 Y868	Q839-Q843 WeakPolarHBondContact O-CG 3.37Å; Q839-Q843 PolarHBondContact O-N 2.88Å; K840-Q843 PolarHBondContact O-N 3.41Å; Q843-W846 PolarHBondContact O-N 3.02Å; Q843-L847 WeakPolarHBondContact O-CG 3.33Å; Q843-L847 PolarHBondContact O-N 3.14Å; Q843-Y868 VanDerWaalsContact CB-OH 3.3Å; Q843-Y868 WeakPolarHBondContact CB-OH 3.39Å; Q843-Y868 PolarHBondContact OE1-OH 2.97Å
844	F	97.8	Very high	95.9	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-68.7	-36.7	178.8	-167.6	-120.1	0	0	0	113.8	F791 L795 K840 F841 Q842 W846 L847 C848 L865 Y868 W869 L872	F791-F844 HydrophobicContact CB-CE1 3.84Å; F791-F844 HydrophobicContact CB-CZ 3.72Å; F791-F844 HydrophobicContact CD1-CE1 4.12Å; F791-F844 AromaticContact CD1-CZ 3.61Å; F791-F844 HydrophobicContact CD1-CZ 3.61Å; F791-F844 HydrophobicContact CE1-CZ 4.36Å; F791-F844 HydrophobicContact CG-CE1 4.31Å; F791-F844 AromaticContact CG-CZ 3.79Å; F791-F844 HydrophobicContact CG-CZ 3.79Å; L795-F844 HydrophobicContact CB-CD1 4.26Å; L795-F844 HydrophobicContact CD1-CD1 4.05Å; L795-F844 HydrophobicContact CD2-CD1 4.01Å; L795-F844 HydrophobicContact CG-CD1 4.32Å; K840-F844 WeakPolarHBondContact O-CB 3.43Å; K840-F844 PolarHBondContact O-N 3.32Å; F841-F844 PolarHBondContact O-N 2.98Å; Q842-F844 VanDerWaalsContact C-N 3.33Å; Q842-F844 PolarHBondContact O-N 3.47Å; F844-W846 VanDerWaalsContact C-N 3.35Å; F844-W846 PolarHBondContact O-N 2.98Å; F844-L847 PolarHBondContact O-N 3.01Å; F844-C848 WeakPolarHBondContact O-CB 3.35Å; F844-C848 PolarHBondContact O-N 2.85Å; F844-C848 PolarHBondContact O-SG 3.49Å; F844-L865 HydrophobicContact CE2-CB 4.24Å; F844-L865 HydrophobicContact CE2-CD2 3.95Å; F844-L865 WeakPolarHBondContact CE2-O 3.46Å; F844-L865 HydrophobicContact CZ-CB 4.46Å; F844-Y868 HydrophobicContact CB-CD1 3.97Å; F844-Y868 HydrophobicContact CB-CE1 3.79Å; F844-Y868 AromaticContact CD2-CD1 3.32Å; F844-Y868 HydrophobicContact CD2-CD1 3.32Å; F844-Y868 HydrophobicContact CD2-CE1 4.05Å; F844-Y868 AromaticContact CD2-CG 3.86Å; F844-Y868 HydrophobicContact CD2-CG 3.86Å; F844-Y868 HydrophobicContact CE2-CD1 4.1Å; F844-Y868 HydrophobicContact CE2-CG 4.4Å; F844-Y868 AromaticContact CG-CD1 3.93Å; F844-Y868 HydrophobicContact CG-CD1 3.93Å; F844-Y868 HydrophobicContact CG-CE1 4.27Å; F844-W869 AromaticContact CD1-CE3 3.91Å; F844-W869 HydrophobicContact CD1-CE3 3.91Å; F844-W869 HydrophobicContact CD1-CZ3 4.28Å; F844-W869 HydrophobicContact CE1-CD2 4.31Å; F844-W869 AromaticContact CE1-CE3 3.39Å; F844-W869 HydrophobicContact CE1-CE3 3.39Å; F844-W869 HydrophobicContact CE1-CZ3 4.02Å; F844-W869 HydrophobicContact CE2-CB 4.28Å; F844-W869 HydrophobicContact CZ-CB 3.86Å; F844-W869 HydrophobicContact CZ-CD2 4.5Å; F844-W869 AromaticContact CZ-CE3 3.95Å; F844-W869 HydrophobicContact CZ-CE3 3.95Å; F844-L872 HydrophobicContact CB-CD2 3.96Å; F844-L872 HydrophobicContact CD1-CD2 4.01Å; F844-L872 HydrophobicContact CG-CD2 4.05Å
845	Y	97.4	Very high	95.6	Very high	100 Å²	100	66.5 Å²	66.5	39%	0.392	33%	0.333	S	S	.	.	H	α-helix	trans	-55.7	-48.8	172.1	173.7	-85.8	0	0	0	111	L792 F841 Q842 C848 Q849	L792-Y845 HydrophobicContact CD1-CD2 3.38Å; L792-Y845 HydrophobicContact CD1-CE2 3.66Å; L792-Y845 HydrophobicContact CD1-CG 4.43Å; F841-Y845 VanDerWaalsContact O-CB 3.31Å; F841-Y845 WeakPolarHBondContact O-CB 3.42Å; F841-Y845 PolarHBondContact O-N 3.06Å; Q842-Y845 WeakPolarHBondContact O-CB 3.45Å; Q842-Y845 PolarHBondContact O-N 3.01Å; Y845-C848 WeakPolarHBondContact O-CB 3.47Å; Y845-C848 PolarHBondContact O-N 3.31Å; Y845-Q849 PolarHBondContact O-N 3.48Å
846	W	96.8	Very high	95.3	Very high	152 Å²	152	62.9 Å²	62.9	58%	0.576	32%	0.317	S	S	*	.	H	α-helix	trans	-66.6	-38.4	178.6	-73	117.2	0	0	0	112.7	Q842 Q843 F844 Q849 Q850	Q842-W846 PolarHBondContact O-N 2.94Å; Q842-W846 VanDerWaalsContact O-N 3.07Å; Q843-W846 PolarHBondContact O-N 3.02Å; F844-W846 VanDerWaalsContact C-N 3.35Å; F844-W846 PolarHBondContact O-N 2.98Å; W846-Q849 HydrophobicContact CE3-CB 4.48Å; W846-Q849 PolarHBondContact O-N 2.89Å; W846-Q850 WeakPolarHBondContact O-CB 3.37Å; W846-Q850 VanDerWaalsContact O-CG 3.31Å; W846-Q850 WeakPolarHBondContact O-CG 3.4Å; W846-Q850 PolarHBondContact O-N 3.43Å
847	L	96.1	Very high	94.4	Very high	45 Å²	45	70.5 Å²	70.5	24%	0.236	35%	0.354	C	S	.	.	H	α-helix	trans	-62.3	-41.6	172.7	-70.3	170.4	0	0	0	111.9	Q843 F844 Q850 N851 P860 L865 Y868	Q843-L847 WeakPolarHBondContact O-CG 3.33Å; Q843-L847 PolarHBondContact O-N 3.14Å; F844-L847 PolarHBondContact O-N 3.01Å; L847-Q850 PolarHBondContact O-N 3.34Å; L847-N851 WeakPolarHBondContact O-CB 3.39Å; L847-N851 PolarHBondContact O-N 2.88Å; L847-P860 HydrophobicContact CD2-CB 4.5Å; L847-P860 HydrophobicContact CD2-CG 3.95Å; L847-L865 HydrophobicContact CB-CD2 3.77Å; L847-Y868 HydrophobicContact CD1-CD2 3.5Å; L847-Y868 VanDerWaalsContact CD1-CD2 3.5Å; L847-Y868 HydrophobicContact CD1-CE2 3.76Å; L847-Y868 HydrophobicContact CD1-CG 3.95Å
848	C	95.8	Very high	93.8	Very high	0 Å²	0	75.1 Å²	75.1	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-63.1	-41.3	174.5	-68.7	0	0	0	0	111.7	F791 L792 F844 Y845 N851 M852	F791-C848 VanDerWaalsContact CB-SG 3.57Å; L792-C848 HydrophobicContact CB-CB 4.39Å; F844-C848 WeakPolarHBondContact O-CB 3.35Å; F844-C848 PolarHBondContact O-N 2.85Å; F844-C848 PolarHBondContact O-SG 3.49Å; Y845-C848 WeakPolarHBondContact O-CB 3.47Å; Y845-C848 PolarHBondContact O-N 3.31Å; C848-N851 PolarHBondContact O-N 3.4Å; C848-M852 WeakPolarHBondContact O-CG 3.42Å; C848-M852 PolarHBondContact O-N 3.08Å; C848-M852 VanDerWaalsContact O-N 3.14Å
849	Q	95.2	Very high	93.5	Very high	77 Å²	77	78.1 Å²	78.1	36%	0.36	39%	0.389	S	S	.	.	H	α-helix	trans	-66.2	-42.5	177.1	-169	58.5	50.5	0	0	111.9	Y845 W846 N851 M852 D853	Y845-Q849 PolarHBondContact O-N 3.48Å; W846-Q849 HydrophobicContact CE3-CB 4.48Å; W846-Q849 PolarHBondContact O-N 2.89Å; Q849-N851 VanDerWaalsContact C-N 3.34Å; Q849-M852 PolarHBondContact O-N 3.08Å; Q849-M852 VanDerWaalsContact O-N 3.17Å; Q849-D853 PolarHBondContact O-N 2.87Å
850	Q	94.7	Very high	93.4	Very high	88 Å²	88	74 Å²	74	41%	0.411	37%	0.371	S	S	.	.	H	α-helix	trans	-65.8	-33.1	173.8	-73.2	173.9	-11.1	0	0	112.7	W846 L847 M852 D853 A856 P860	W846-Q850 WeakPolarHBondContact O-CB 3.37Å; W846-Q850 VanDerWaalsContact O-CG 3.31Å; W846-Q850 WeakPolarHBondContact O-CG 3.4Å; W846-Q850 PolarHBondContact O-N 3.43Å; L847-Q850 PolarHBondContact O-N 3.34Å; Q850-M852 VanDerWaalsContact C-N 3.31Å; Q850-D853 PolarHBondContact O-N 3.02Å; Q850-A856 HydrophobicContact CB-CB 4.41Å; Q850-P860 HydrophobicContact CB-CG 3.94Å
851	N	94.3	Very high	93.2	Very high	12 Å²	12	73.1 Å²	73.1	6%	0.064	37%	0.373	C	S	.	.	H	α-helix	trans	-65.9	-32.9	171.7	174.1	-96.8	0	0	0	112.2	G788 L847 C848 Q849 R859 P860 L865	G788-N851 PolarHBondContact N-OD1 3.18Å; L847-N851 WeakPolarHBondContact O-CB 3.39Å; L847-N851 PolarHBondContact O-N 2.88Å; C848-N851 PolarHBondContact O-N 3.4Å; Q849-N851 VanDerWaalsContact C-N 3.34Å; N851-R859 PolarHBondContact O-NE 3.12Å; N851-R859 PolarHBondContact O-NH2 3.21Å; N851-P860 PolarHBondContact ND2-O 2.81Å; N851-L865 HydrophobicContact CB-CD1 3.64Å; N851-L865 HydrophobicContact CB-CD2 4.49Å; N851-L865 HydrophobicContact CB-CG 4.23Å
852	M	92.4	Very high	93	Very high	64 Å²	64	75.9 Å²	75.9	32%	0.315	39%	0.393	S	S	.	.	H	α-helix	trans	-77.2	-29.6	176.7	-68.8	-174.8	-68.8	0	0	112.8	L792 C848 Q849 Q850 P854	L792-M852 HydrophobicContact CD2-CE 4.01Å; C848-M852 WeakPolarHBondContact O-CG 3.42Å; C848-M852 PolarHBondContact O-N 3.08Å; C848-M852 VanDerWaalsContact O-N 3.14Å; Q849-M852 PolarHBondContact O-N 3.08Å; Q849-M852 VanDerWaalsContact O-N 3.17Å; Q850-M852 VanDerWaalsContact C-N 3.31Å; M852-P854 WeakPolarHBondContact O-CD 3.46Å
853	D	91.5	Very high	92.8	Very high	61 Å²	61	78.1 Å²	78.1	33%	0.326	40%	0.403	S	S	.	.			trans	-69.3	119.9	176.7	-172.1	-12.4	0	0	0	111.9	Q849 Q850 S855 A856 R859	Q849-D853 PolarHBondContact O-N 2.87Å; Q850-D853 PolarHBondContact O-N 3.02Å; D853-S855 VanDerWaalsContact C-N 3.26Å; D853-S855 PolarHBondContact O-N 2.94Å; D853-S855 WeakPolarHBondContact OD1-CA 3.44Å; D853-S855 WeakPolarHBondContact OD1-CB 3.33Å; D853-S855 PolarHBondContact OD1-N 2.93Å; D853-S855 PolarHBondContact OD1-OG 3.2Å; D853-S855 PolarHBondContact OD2-OG 3.38Å; D853-A856 HydrophobicContact CB-CB 4.15Å; D853-R859 WeakPolarHBondContact O-CD 3.39Å; D853-R859 PolarHBondContact O-NE 2.92Å
854	P	87.6	Confident	92.7	Very high	115 Å²	115	77.9 Å²	77.9	75%	0.747	41%	0.405	S	S	*	.	S	Bend	trans	-75.2	-10.7	176.2	32.7	-36.4	0	0	0	114	M852	M852-P854 WeakPolarHBondContact O-CD 3.46Å
855	S	91.9	Very high	92.6	Very high	90 Å²	90	77.9 Å²	77.9	63%	0.629	41%	0.405	S	S	*	.	S	Bend	trans	-98.5	-13.4	-178.4	73.9	0	0	0	0	114.5	D853	D853-S855 VanDerWaalsContact C-N 3.26Å; D853-S855 PolarHBondContact O-N 2.94Å; D853-S855 WeakPolarHBondContact OD1-CA 3.44Å; D853-S855 WeakPolarHBondContact OD1-CB 3.33Å; D853-S855 PolarHBondContact OD1-N 2.93Å; D853-S855 PolarHBondContact OD1-OG 3.2Å; D853-S855 PolarHBondContact OD2-OG 3.38Å
856	A	89.9	Confident	92.6	Very high	17 Å²	17	74.1 Å²	74.1	14%	0.14	40%	0.395	C	S	.	.			trans	-62.2	134.8	178.5	0	0	0	0	0	111.9	Q850 D853 R859	Q850-A856 HydrophobicContact CB-CB 4.41Å; D853-A856 HydrophobicContact CB-CB 4.15Å; A856-R859 WeakPolarHBondContact O-CB 3.46Å; A856-R859 PolarHBondContact O-N 2.93Å
857	M	80.8	Confident	92.6	Very high	176 Å²	176	68.5 Å²	68.5	87%	0.867	38%	0.384	S	S	*	.	S	Bend	trans	-141.7	119.9	179.7	-76.3	-64.8	-71	0	0	110.9
858	P	85.5	Confident	92.6	Very high	124 Å²	124	68.2 Å²	68.2	81%	0.805	38%	0.38	S	S	*	.	S	Bend	cis	-67	135.1	-9.7	30.1	-34.5	0	0	0	111.3	P860	P858-P860 WeakPolarHBondContact O-CD 3.48Å
859	R	90.3	Very high	92.7	Very high	120 Å²	120	69.3 Å²	69.3	45%	0.453	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-75.9	123	173.6	-171.1	172.4	172.4	-169.3	1.1	109.8	N851 D853 A856 T861	N851-R859 PolarHBondContact O-NE 3.12Å; N851-R859 PolarHBondContact O-NH2 3.21Å; D853-R859 WeakPolarHBondContact O-CD 3.39Å; D853-R859 PolarHBondContact O-NE 2.92Å; A856-R859 WeakPolarHBondContact O-CB 3.46Å; A856-R859 PolarHBondContact O-N 2.93Å; R859-T861 PolarHBondContact O-N 3.06Å
860	P	93.3	Very high	92.8	Very high	17 Å²	17	70.4 Å²	70.4	11%	0.11	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-58	133.9	171.4	-21.9	32.9	0	0	0	110	L847 Q850 N851 P858	L847-P860 HydrophobicContact CD2-CB 4.5Å; L847-P860 HydrophobicContact CD2-CG 3.95Å; Q850-P860 HydrophobicContact CB-CG 3.94Å; N851-P860 PolarHBondContact ND2-O 2.81Å; P858-P860 WeakPolarHBondContact O-CD 3.48Å
861	T	93.2	Very high	92.9	Very high	67 Å²	67	71.8 Å²	71.8	41%	0.411	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-83.5	166.3	176.9	73.9	0	0	0	0	111.5	R859 Q863 D864 L865	R859-T861 PolarHBondContact O-N 3.06Å; T861-Q863 PolarHBondContact O-N 2.89Å; T861-Q863 PolarHBondContact OG1-N 2.85Å; T861-D864 WeakPolarHBondContact CA-OD2 3.37Å; T861-D864 WeakPolarHBondContact CB-OD2 3.38Å; T861-D864 WeakPolarHBondContact CG2-OD2 3.41Å; T861-D864 PolarHBondContact N-OD2 3.16Å; T861-D864 PolarHBondContact O-N 2.9Å; T861-D864 PolarHBondContact OG1-N 2.98Å; T861-D864 VanDerWaalsContact OG1-N 3.16Å; T861-D864 PolarHBondContact OG1-OD2 3.34Å; T861-L865 PolarHBondContact O-N 3.42Å
862	S	93.4	Very high	93.1	Very high	64 Å²	64	71.4 Å²	71.4	45%	0.448	40%	0.398	S	S	.	.	H	α-helix	trans	-60.3	-20.5	170.3	48.9	0	0	0	0	113.6	R786 A866	R786-S862 WeakPolarHBondContact O-CB 3.45Å; S862-A866 PolarHBondContact O-N 3.17Å
863	Q	94.4	Very high	93.3	Very high	155 Å²	155	71 Å²	71	72%	0.724	40%	0.396	S	S	*	.	H	α-helix	trans	-84.1	-36	176.3	-175.9	170.6	-17.3	0	0	111.5	T861 L865 A866 G867	T861-Q863 PolarHBondContact O-N 2.89Å; T861-Q863 PolarHBondContact OG1-N 2.85Å; Q863-L865 VanDerWaalsContact C-N 3.33Å; Q863-A866 WeakPolarHBondContact O-CB 3.46Å; Q863-A866 PolarHBondContact O-N 2.92Å; Q863-G867 PolarHBondContact O-N 3.27Å
864	D	95	Very high	93.6	Very high	91 Å²	91	73.7 Å²	73.7	49%	0.487	41%	0.409	S	S	.	.	H	α-helix	trans	-66.6	-38.5	173.8	-51.2	-52.9	0	0	0	110.9	T861 G867 Y868	T861-D864 WeakPolarHBondContact CA-OD2 3.37Å; T861-D864 WeakPolarHBondContact CB-OD2 3.38Å; T861-D864 WeakPolarHBondContact CG2-OD2 3.41Å; T861-D864 PolarHBondContact N-OD2 3.16Å; T861-D864 PolarHBondContact O-N 2.9Å; T861-D864 PolarHBondContact OG1-N 2.98Å; T861-D864 VanDerWaalsContact OG1-N 3.16Å; T861-D864 PolarHBondContact OG1-OD2 3.34Å; D864-G867 PolarHBondContact O-N 3.35Å; D864-Y868 PolarHBondContact O-N 2.97Å
865	L	96.2	Very high	94.1	Very high	1 Å²	1	70.3 Å²	70.3	1%	0.005	39%	0.389	C	S	.	.	H	α-helix	trans	-61.9	-40.7	170.7	-67.1	-172	0	0	0	112.4	F791 F844 L847 N851 T861 Q863 W869	F791-L865 HydrophobicContact CB-CD1 4.49Å; F791-L865 HydrophobicContact CD2-CB 3.62Å; F791-L865 HydrophobicContact CD2-CD1 3.69Å; F791-L865 HydrophobicContact CD2-CG 4.33Å; F791-L865 HydrophobicContact CE2-CB 3.57Å; F791-L865 HydrophobicContact CE2-CD1 4.32Å; F791-L865 HydrophobicContact CG-CB 4.25Å; F791-L865 HydrophobicContact CG-CD1 4.39Å; F791-L865 HydrophobicContact CZ-CB 4.17Å; F844-L865 HydrophobicContact CE2-CB 4.24Å; F844-L865 HydrophobicContact CE2-CD2 3.95Å; F844-L865 WeakPolarHBondContact CE2-O 3.46Å; F844-L865 HydrophobicContact CZ-CB 4.46Å; L847-L865 HydrophobicContact CB-CD2 3.77Å; N851-L865 HydrophobicContact CB-CD1 3.64Å; N851-L865 HydrophobicContact CB-CD2 4.49Å; N851-L865 HydrophobicContact CB-CG 4.23Å; T861-L865 PolarHBondContact O-N 3.42Å; Q863-L865 VanDerWaalsContact C-N 3.33Å; L865-W869 VanDerWaalsContact O-CB 3.24Å; L865-W869 WeakPolarHBondContact O-CB 3.24Å; L865-W869 PolarHBondContact O-N 2.82Å
866	A	96	Very high	94.3	Very high	21 Å²	21	66.2 Å²	66.2	17%	0.174	36%	0.359	C	S	.	.	H	α-helix	trans	-63	-48.8	175.9	0	0	0	0	0	111.4	F791 S862 Q863 Y868 W869 D870	F791-A866 HydrophobicContact CZ-CB 3.9Å; S862-A866 PolarHBondContact O-N 3.17Å; Q863-A866 WeakPolarHBondContact O-CB 3.46Å; Q863-A866 PolarHBondContact O-N 2.92Å; A866-Y868 PolarHBondContact O-N 3.28Å; A866-W869 WeakPolarHBondContact O-CB 3.47Å; A866-W869 PolarHBondContact O-N 3.01Å; A866-W869 VanDerWaalsContact O-N 3.12Å; A866-D870 PolarHBondContact O-N 3.25Å
867	G	96.4	Very high	94.7	Very high	34 Å²	34	70.4 Å²	70.4	35%	0.351	38%	0.376	S	S	.	.	H	α-helix	trans	-62.2	-38.2	178.2	0	0	0	0	0	113.6	Q863 D864 M871	Q863-G867 PolarHBondContact O-N 3.27Å; D864-G867 PolarHBondContact O-N 3.35Å; G867-M871 PolarHBondContact O-N 3.05Å
868	Y	96.9	Very high	95.5	Very high	39 Å²	39	65.8 Å²	65.8	15%	0.153	36%	0.355	C	S	.	.	H	α-helix	trans	-67.8	-41.3	172.6	-163.7	-71	0	0	0	111.4	K840 Q843 F844 L847 D864 A866 D870 M871 L872	K840-Y868 WeakPolarHBondContact CD-OH 3.29Å; Q843-Y868 VanDerWaalsContact CB-OH 3.3Å; Q843-Y868 WeakPolarHBondContact CB-OH 3.39Å; Q843-Y868 PolarHBondContact OE1-OH 2.97Å; F844-Y868 HydrophobicContact CB-CD1 3.97Å; F844-Y868 HydrophobicContact CB-CE1 3.79Å; F844-Y868 AromaticContact CD2-CD1 3.32Å; F844-Y868 HydrophobicContact CD2-CD1 3.32Å; F844-Y868 HydrophobicContact CD2-CE1 4.05Å; F844-Y868 AromaticContact CD2-CG 3.86Å; F844-Y868 HydrophobicContact CD2-CG 3.86Å; F844-Y868 HydrophobicContact CE2-CD1 4.1Å; F844-Y868 HydrophobicContact CE2-CG 4.4Å; F844-Y868 AromaticContact CG-CD1 3.93Å; F844-Y868 HydrophobicContact CG-CD1 3.93Å; F844-Y868 HydrophobicContact CG-CE1 4.27Å; L847-Y868 HydrophobicContact CD1-CD2 3.5Å; L847-Y868 VanDerWaalsContact CD1-CD2 3.5Å; L847-Y868 HydrophobicContact CD1-CE2 3.76Å; L847-Y868 HydrophobicContact CD1-CG 3.95Å; D864-Y868 PolarHBondContact O-N 2.97Å; A866-Y868 PolarHBondContact O-N 3.28Å; Y868-D870 PolarHBondContact O-N 3.43Å; Y868-M871 HydrophobicContact CD2-CE 4.48Å; Y868-M871 PolarHBondContact O-N 3.31Å; Y868-L872 HydrophobicContact CD1-CB 4.45Å; Y868-L872 WeakPolarHBondContact O-CB 3.35Å; Y868-L872 PolarHBondContact O-N 3.45Å
869	W	97.5	Very high	96.1	Very high	22 Å²	22	60.1 Å²	60.1	8%	0.083	32%	0.318	C	S	.	.	H	α-helix	trans	-61.8	-41	177.7	180	-101.5	0	0	0	112.5	F791 L794 L795 E798 F844 L865 A866 M871 L872 Q873 I876	F791-W869 HydrophobicContact CD1-CB 4.01Å; F791-W869 HydrophobicContact CD1-CD2 4.36Å; F791-W869 HydrophobicContact CD1-CG 4.03Å; F791-W869 HydrophobicContact CE1-CB 3.64Å; F791-W869 AromaticContact CE1-CG 3.8Å; F791-W869 HydrophobicContact CE1-CG 3.8Å; L794-W869 HydrophobicContact CD1-CZ2 4.35Å; L794-W869 HydrophobicContact CD2-CD2 4.29Å; L794-W869 VanDerWaalsContact CD2-CE2 3.47Å; L794-W869 HydrophobicContact CD2-CH2 4.12Å; L794-W869 HydrophobicContact CD2-CZ2 3.37Å; L794-W869 HydrophobicContact CG-CH2 3.77Å; L794-W869 HydrophobicContact CG-CZ2 3.44Å; L794-W869 VanDerWaalsContact CG-CZ2 3.44Å; L795-W869 HydrophobicContact CB-CZ3 4.36Å; L795-W869 HydrophobicContact CD1-CZ3 4.22Å; E798-W869 HydrophobicContact CB-CH2 4.29Å; E798-W869 HydrophobicContact CG-CH2 4.41Å; F844-W869 AromaticContact CD1-CE3 3.91Å; F844-W869 HydrophobicContact CD1-CE3 3.91Å; F844-W869 HydrophobicContact CD1-CZ3 4.28Å; F844-W869 HydrophobicContact CE1-CD2 4.31Å; F844-W869 AromaticContact CE1-CE3 3.39Å; F844-W869 HydrophobicContact CE1-CE3 3.39Å; F844-W869 HydrophobicContact CE1-CZ3 4.02Å; F844-W869 HydrophobicContact CE2-CB 4.28Å; F844-W869 HydrophobicContact CZ-CB 3.86Å; F844-W869 HydrophobicContact CZ-CD2 4.5Å; F844-W869 AromaticContact CZ-CE3 3.95Å; F844-W869 HydrophobicContact CZ-CE3 3.95Å; L865-W869 VanDerWaalsContact O-CB 3.24Å; L865-W869 WeakPolarHBondContact O-CB 3.24Å; L865-W869 PolarHBondContact O-N 2.82Å; A866-W869 WeakPolarHBondContact O-CB 3.47Å; A866-W869 PolarHBondContact O-N 3.01Å; A866-W869 VanDerWaalsContact O-N 3.12Å; W869-M871 PolarHBondContact O-N 3.43Å; W869-L872 HydrophobicContact CE3-CD2 3.97Å; W869-L872 HydrophobicContact CZ3-CD2 3.96Å; W869-L872 CarbonylContact O-C 3.59Å; W869-L872 WeakPolarHBondContact O-CA 3.31Å; W869-L872 WeakPolarHBondContact O-CB 3.44Å; W869-L872 PolarHBondContact O-N 3.14Å; W869-L872 VanDerWaalsContact O-N 3.08Å; W869-Q873 HydrophobicContact CD2-CG 4.41Å; W869-Q873 HydrophobicContact CZ2-CG 4.08Å; W869-Q873 WeakPolarHBondContact O-CG 3.39Å; W869-Q873 PolarHBondContact O-N 2.81Å; W869-I876 HydrophobicContact CH2-CD1 4.4Å
870	D	97.4	Very high	96.4	Very high	101 Å²	101	55.1 Å²	55.1	54%	0.54	30%	0.302	S	S	.	.	H	α-helix	trans	-64.8	-40.4	178.4	-63	-19.9	0	0	0	111	A866 Y868 L872 Q873 L874	A866-D870 PolarHBondContact O-N 3.25Å; Y868-D870 PolarHBondContact O-N 3.43Å; D870-L872 VanDerWaalsContact C-N 3.32Å; D870-L872 PolarHBondContact O-N 3.49Å; D870-Q873 PolarHBondContact O-N 2.77Å; D870-L874 PolarHBondContact O-N 3.38Å
871	M	96.9	Very high	96.6	Very high	117 Å²	117	60.2 Å²	60.2	58%	0.576	33%	0.325	S	S	*	.	H	α-helix	trans	-66.2	-33.2	170.3	-67.6	-169	-63.8	0	0	113	G867 Y868 W869 S875	G867-M871 PolarHBondContact O-N 3.05Å; Y868-M871 HydrophobicContact CD2-CE 4.48Å; Y868-M871 PolarHBondContact O-N 3.31Å; W869-M871 PolarHBondContact O-N 3.43Å; M871-S875 PolarHBondContact O-N 3.19Å; M871-S875 PolarHBondContact O-OG 3.04Å; M871-S875 VanDerWaalsContact O-OG 3.08Å
872	L	97.6	Very high	96.8	Very high	3 Å²	3	59.8 Å²	59.8	2%	0.016	32%	0.318	C	S	.	.	H	α-helix	trans	-69.9	-38.7	177.3	-167.4	57.7	0	0	0	111.1	L795 L836 K840 F841 F844 Y868 W869 D870 S875 I876	L795-L872 HydrophobicContact CD1-CD2 4.1Å; L836-L872 HydrophobicContact CD1-CD1 4.25Å; K840-L872 HydrophobicContact CB-CD1 3.55Å; F841-L872 HydrophobicContact CD1-CD1 3.83Å; F841-L872 HydrophobicContact CD1-CD2 4.03Å; F841-L872 HydrophobicContact CD1-CG 4.25Å; F841-L872 HydrophobicContact CE1-CD1 3.88Å; F841-L872 HydrophobicContact CE1-CD2 4.21Å; F841-L872 HydrophobicContact CE1-CG 4.09Å; F844-L872 HydrophobicContact CB-CD2 3.96Å; F844-L872 HydrophobicContact CD1-CD2 4.01Å; F844-L872 HydrophobicContact CG-CD2 4.05Å; Y868-L872 HydrophobicContact CD1-CB 4.45Å; Y868-L872 WeakPolarHBondContact O-CB 3.35Å; Y868-L872 PolarHBondContact O-N 3.45Å; W869-L872 HydrophobicContact CE3-CD2 3.97Å; W869-L872 HydrophobicContact CZ3-CD2 3.96Å; W869-L872 CarbonylContact O-C 3.59Å; W869-L872 WeakPolarHBondContact O-CA 3.31Å; W869-L872 WeakPolarHBondContact O-CB 3.44Å; W869-L872 PolarHBondContact O-N 3.14Å; W869-L872 VanDerWaalsContact O-N 3.08Å; D870-L872 VanDerWaalsContact C-N 3.32Å; D870-L872 PolarHBondContact O-N 3.49Å; L872-S875 CarbonylContact O-C 3.57Å; L872-S875 WeakPolarHBondContact O-CA 3.37Å; L872-S875 WeakPolarHBondContact O-CB 3.46Å; L872-S875 PolarHBondContact O-N 3.41Å; L872-S875 VanDerWaalsContact O-N 3.1Å; L872-I876 HydrophobicContact CG-CD1 4Å; L872-I876 WeakPolarHBondContact O-CD1 3.45Å; L872-I876 VanDerWaalsContact O-CG1 3.3Å; L872-I876 WeakPolarHBondContact O-CG1 3.25Å; L872-I876 PolarHBondContact O-N 3.31Å
873	Q	97.6	Very high	97	Very high	56 Å²	56	56.8 Å²	56.8	26%	0.262	30%	0.297	S	S	.	.	H	α-helix	trans	-60.1	-45	174.5	-78.9	-68.3	-62	0	0	112	W869 D870 S875 I876 E877	W869-Q873 HydrophobicContact CD2-CG 4.41Å; W869-Q873 HydrophobicContact CZ2-CG 4.08Å; W869-Q873 WeakPolarHBondContact O-CG 3.39Å; W869-Q873 PolarHBondContact O-N 2.81Å; D870-Q873 PolarHBondContact O-N 2.77Å; Q873-S875 PolarHBondContact O-N 3.26Å; Q873-I876 VanDerWaalsContact NE2-CD1 3.34Å; Q873-I876 CarbonylContact O-C 3.58Å; Q873-I876 WeakPolarHBondContact O-CA 3.46Å; Q873-I876 WeakPolarHBondContact O-CB 3.31Å; Q873-I876 PolarHBondContact O-N 2.88Å; Q873-E877 WeakPolarHBondContact O-CG 3.39Å; Q873-E877 PolarHBondContact O-N 3.49Å
874	L	97.4	Very high	97.1	Very high	118 Å²	118	53.3 Å²	53.3	62%	0.618	28%	0.283	S	S	*	.	H	α-helix	trans	-57.2	-34.8	173.5	-65.3	173.4	0	0	0	112.8	D870 D878	D870-L874 PolarHBondContact O-N 3.38Å; L874-D878 PolarHBondContact O-N 2.89Å
875	S	97.6	Very high	97.1	Very high	44 Å²	44	52.1 Å²	52.1	31%	0.308	28%	0.275	S	S	.	.	H	α-helix	trans	-75.1	-33.9	176.8	-50.7	0	0	0	0	112.2	M871 L872 Q873 V879	M871-S875 PolarHBondContact O-N 3.19Å; M871-S875 PolarHBondContact O-OG 3.04Å; M871-S875 VanDerWaalsContact O-OG 3.08Å; L872-S875 CarbonylContact O-C 3.57Å; L872-S875 WeakPolarHBondContact O-CA 3.37Å; L872-S875 WeakPolarHBondContact O-CB 3.46Å; L872-S875 PolarHBondContact O-N 3.41Å; L872-S875 VanDerWaalsContact O-N 3.1Å; Q873-S875 PolarHBondContact O-N 3.26Å; S875-V879 WeakPolarHBondContact O-CG2 3.26Å; S875-V879 PolarHBondContact O-N 3.16Å
876	I	97.8	Very high	97.1	Very high	3 Å²	3	52.2 Å²	52.2	2%	0.015	28%	0.275	C	S	.	.	H	α-helix	trans	-68	-40.1	173.6	-72.8	158	0	0	0	110.9	E798 M802 L836 F841 W869 L872 Q873 V879 S880	E798-I876 HydrophobicContact CG-CD1 3.59Å; E798-I876 HydrophobicContact CG-CG1 4.21Å; E798-I876 WeakPolarHBondContact OE1-CG2 3.41Å; M802-I876 HydrophobicContact CE-CG2 4.14Å; L836-I876 HydrophobicContact CD2-CG1 3.96Å; F841-I876 HydrophobicContact CE1-CD1 3.99Å; F841-I876 HydrophobicContact CE1-CG1 3.85Å; F841-I876 HydrophobicContact CZ-CD1 3.88Å; F841-I876 HydrophobicContact CZ-CG1 3.79Å; W869-I876 HydrophobicContact CH2-CD1 4.4Å; L872-I876 HydrophobicContact CG-CD1 4Å; L872-I876 WeakPolarHBondContact O-CD1 3.45Å; L872-I876 VanDerWaalsContact O-CG1 3.3Å; L872-I876 WeakPolarHBondContact O-CG1 3.25Å; L872-I876 PolarHBondContact O-N 3.31Å; Q873-I876 VanDerWaalsContact NE2-CD1 3.34Å; Q873-I876 CarbonylContact O-C 3.58Å; Q873-I876 WeakPolarHBondContact O-CA 3.46Å; Q873-I876 WeakPolarHBondContact O-CB 3.31Å; Q873-I876 PolarHBondContact O-N 2.88Å; I876-V879 PolarHBondContact O-N 3.21Å; I876-S880 VanDerWaalsContact O-CB 3.28Å; I876-S880 WeakPolarHBondContact O-CB 3.48Å; I876-S880 PolarHBondContact O-N 2.95Å; I876-S880 PolarHBondContact O-OG 3.18Å
877	E	97.7	Very high	97	Very high	106 Å²	106	54.5 Å²	54.5	50%	0.495	28%	0.282	S	S	.	.	H	α-helix	trans	-64.8	-45.1	177.3	-73.7	177.7	171.2	0	0	111.7	Q873 V879 S880 M881	Q873-E877 WeakPolarHBondContact O-CG 3.39Å; Q873-E877 PolarHBondContact O-N 3.49Å; E877-V879 VanDerWaalsContact C-N 3.32Å; E877-V879 PolarHBondContact O-N 2.7Å; E877-S880 PolarHBondContact O-N 2.96Å; E877-S880 VanDerWaalsContact O-N 3.1Å; E877-M881 WeakPolarHBondContact O-CG 3.25Å; E877-M881 PolarHBondContact O-N 3.01Å
878	D	97.8	Very high	96.9	Very high	79 Å²	79	58.6 Å²	58.6	42%	0.422	29%	0.287	S	S	.	.	H	α-helix	trans	-59.7	-39.2	174.5	172.2	56.7	0	0	0	112.8	L874 K882	L874-D878 PolarHBondContact O-N 2.89Å; D878-K882 WeakPolarHBondContact O-CD 3.3Å; D878-K882 WeakPolarHBondContact O-CE 3.48Å; D878-K882 WeakPolarHBondContact O-CG 3.26Å; D878-K882 PolarHBondContact O-NZ 3.22Å; D878-K882 WeakPolarHBondContact OD1-CE 3.49Å; D878-K882 IonicContact OD1-NZ 2.77Å; D878-K882 PolarHBondContact OD1-NZ 3.19Å; D878-K882 IonicContact OD2-NZ 2.79Å; D878-K882 PolarHBondContact OD2-NZ 3.44Å
879	V	97.9	Very high	96.6	Very high	4 Å²	4	57.1 Å²	57.1	2%	0.024	28%	0.282	C	S	.	.	H	α-helix	trans	-70.4	-39.8	172.7	176.4	0	0	0	0	111.2	M802 A833 L836 S875 I876 E877 K882 F883	M802-V879 HydrophobicContact CE-CB 4.16Å; M802-V879 HydrophobicContact CE-CG1 3.83Å; M802-V879 HydrophobicContact SD-CB 4.41Å; M802-V879 HydrophobicContact SD-CG1 3.45Å; M802-V879 WeakPolarHBondContact SD-CG1 3.47Å; A833-V879 HydrophobicContact CB-CG1 3.73Å; L836-V879 HydrophobicContact CD2-CG2 4.01Å; S875-V879 WeakPolarHBondContact O-CG2 3.26Å; S875-V879 PolarHBondContact O-N 3.16Å; I876-V879 PolarHBondContact O-N 3.21Å; E877-V879 VanDerWaalsContact C-N 3.32Å; E877-V879 PolarHBondContact O-N 2.7Å; V879-K882 WeakPolarHBondContact O-CB 3.38Å; V879-K882 PolarHBondContact O-N 3.29Å; V879-K882 VanDerWaalsContact O-N 3.15Å; V879-F883 HydrophobicContact CG1-CD2 3.98Å; V879-F883 HydrophobicContact CG1-CE2 3.74Å; V879-F883 WeakPolarHBondContact O-CD2 3.44Å; V879-F883 PolarHBondContact O-N 3.35Å
880	S	97.6	Very high	96.2	Very high	16 Å²	16	60 Å²	60	11%	0.112	29%	0.292	C	S	.	.	H	α-helix	trans	-62.7	-43.9	-179.8	-59.2	0	0	0	0	112.4	R801 W805 I876 E877 K882 F883 D884	R801-S880 PolarHBondContact NH2-OG 2.94Å; R801-S880 VanDerWaalsContact NH2-OG 3.17Å; W805-S880 WeakPolarHBondContact CZ3-OG 3.48Å; I876-S880 VanDerWaalsContact O-CB 3.28Å; I876-S880 WeakPolarHBondContact O-CB 3.48Å; I876-S880 PolarHBondContact O-N 2.95Å; I876-S880 PolarHBondContact O-OG 3.18Å; E877-S880 PolarHBondContact O-N 2.96Å; E877-S880 VanDerWaalsContact O-N 3.1Å; S880-K882 PolarHBondContact O-N 3.06Å; S880-K882 VanDerWaalsContact O-N 3.12Å; S880-F883 CarbonylContact O-C 3.55Å; S880-F883 WeakPolarHBondContact O-CA 3.48Å; S880-F883 PolarHBondContact O-N 2.94Å; S880-D884 PolarHBondContact O-N 2.94Å
881	M	97.4	Very high	95.9	Very high	124 Å²	124	62.3 Å²	62.3	61%	0.611	30%	0.304	S	S	*	.	H	α-helix	trans	-56.8	-30.1	175.3	-73	-172.1	-71.2	0	0	113.4	E877 E885	E877-M881 WeakPolarHBondContact O-CG 3.25Å; E877-M881 PolarHBondContact O-N 3.01Å; M881-E885 PolarHBondContact O-N 2.93Å
882	K	96.8	Very high	95.6	Very high	58 Å²	58	59.8 Å²	59.8	25%	0.252	29%	0.293	S	S	.	.	H	α-helix	trans	-74.8	-38.7	176.5	-60.9	161.6	-162.8	153.2	0	111.4	A829 D878 V879 S880 E885 L886	A829-K882 HydrophobicContact CB-CB 3.81Å; D878-K882 WeakPolarHBondContact O-CD 3.3Å; D878-K882 WeakPolarHBondContact O-CE 3.48Å; D878-K882 WeakPolarHBondContact O-CG 3.26Å; D878-K882 PolarHBondContact O-NZ 3.22Å; D878-K882 WeakPolarHBondContact OD1-CE 3.49Å; D878-K882 IonicContact OD1-NZ 2.77Å; D878-K882 PolarHBondContact OD1-NZ 3.19Å; D878-K882 IonicContact OD2-NZ 2.79Å; D878-K882 PolarHBondContact OD2-NZ 3.44Å; V879-K882 WeakPolarHBondContact O-CB 3.38Å; V879-K882 PolarHBondContact O-N 3.29Å; V879-K882 VanDerWaalsContact O-N 3.15Å; S880-K882 PolarHBondContact O-N 3.06Å; S880-K882 VanDerWaalsContact O-N 3.12Å; K882-E885 PolarHBondContact O-N 3.26Å; K882-L886 WeakPolarHBondContact O-CG 3.37Å; K882-L886 PolarHBondContact O-N 3.47Å; K882-L886 VanDerWaalsContact O-N 3.1Å
883	F	97.4	Very high	95.1	Very high	1 Å²	1	65 Å²	65	0%	0.004	32%	0.321	C	S	.	.	H	α-helix	trans	-67.3	-35.5	171	-77.1	-77	0	0	0	112.2	M802 W805 M809 A829 V830 A833 V879 S880 L886 Q887	M802-F883 HydrophobicContact SD-CD2 4.33Å; M802-F883 HydrophobicContact SD-CE2 4.02Å; W805-F883 HydrophobicContact CB-CD1 3.81Å; W805-F883 HydrophobicContact CB-CD2 4.43Å; W805-F883 HydrophobicContact CB-CE1 3.83Å; W805-F883 HydrophobicContact CB-CE2 4.46Å; W805-F883 HydrophobicContact CB-CG 4.12Å; W805-F883 HydrophobicContact CB-CZ 4.16Å; W805-F883 HydrophobicContact CD2-CB 4.18Å; W805-F883 HydrophobicContact CD2-CD2 4.46Å; W805-F883 HydrophobicContact CD2-CG 4.17Å; W805-F883 HydrophobicContact CE3-CB 3.89Å; W805-F883 AromaticContact CE3-CD2 3.7Å; W805-F883 HydrophobicContact CE3-CD2 3.7Å; W805-F883 HydrophobicContact CE3-CE2 4.42Å; W805-F883 AromaticContact CE3-CG 3.81Å; W805-F883 HydrophobicContact CE3-CG 3.81Å; W805-F883 HydrophobicContact CG-CD1 4.39Å; W805-F883 HydrophobicContact CG-CG 4.4Å; W805-F883 HydrophobicContact CH2-CB 4.34Å; W805-F883 HydrophobicContact CZ3-CB 4Å; W805-F883 HydrophobicContact CZ3-CD2 4.17Å; W805-F883 HydrophobicContact CZ3-CG 4.32Å; W805-F883 WeakPolarHBondContact O-CE1 3.3Å; M809-F883 HydrophobicContact CB-CE1 4.15Å; M809-F883 HydrophobicContact CG-CD1 3.58Å; M809-F883 HydrophobicContact CG-CE1 3.59Å; A829-F883 HydrophobicContact CB-CE2 4.3Å; A829-F883 HydrophobicContact CB-CZ 4.27Å; V830-F883 HydrophobicContact CG2-CE1 4.26Å; V830-F883 HydrophobicContact CG2-CZ 4.21Å; A833-F883 HydrophobicContact CB-CE2 3.92Å; A833-F883 HydrophobicContact CB-CZ 4.23Å; V879-F883 HydrophobicContact CG1-CD2 3.98Å; V879-F883 HydrophobicContact CG1-CE2 3.74Å; V879-F883 WeakPolarHBondContact O-CD2 3.44Å; V879-F883 PolarHBondContact O-N 3.35Å; S880-F883 CarbonylContact O-C 3.55Å; S880-F883 WeakPolarHBondContact O-CA 3.48Å; S880-F883 PolarHBondContact O-N 2.94Å; F883-L886 PolarHBondContact O-N 2.79Å; F883-Q887 WeakPolarHBondContact O-CB 3.09Å; F883-Q887 WeakPolarHBondContact O-CG 3.35Å; F883-Q887 PolarHBondContact O-N 3.43Å
884	D	96.8	Very high	94.7	Very high	81 Å²	81	63.7 Å²	63.7	43%	0.433	31%	0.314	S	S	.	.	H	α-helix	trans	-66.3	-37.3	174.2	-63.7	-30.7	0	0	0	111.7	S880 R888	S880-D884 PolarHBondContact O-N 2.94Å; D884-R888 VanDerWaalsContact O-CB 3.25Å; D884-R888 WeakPolarHBondContact O-CB 3.47Å; D884-R888 PolarHBondContact O-N 3.38Å
885	E	95.6	Very high	93.7	Very high	67 Å²	67	64.2 Å²	64.2	31%	0.313	31%	0.311	S	S	.	.	H	α-helix	trans	-62.7	-42.6	171.4	-159.3	-161.4	155.4	0	0	111.6	K825 M881 K882 R888 L889	K825-E885 IonicContact NZ-OE1 3.28Å; K825-E885 PolarHBondContact NZ-OE1 3.42Å; M881-E885 PolarHBondContact O-N 2.93Å; K882-E885 PolarHBondContact O-N 3.26Å; E885-R888 PolarHBondContact O-N 2.69Å; E885-L889 WeakPolarHBondContact O-CG 3.45Å; E885-L889 PolarHBondContact O-N 3.1Å
886	L	95.2	Very high	92.2	Very high	2 Å²	2	66.9 Å²	66.9	1%	0.01	32%	0.32	C	S	.	.	H	α-helix	trans	-68	-43.2	178.6	-70.5	171	0	0	0	112.6	M809 K825 I826 A829 K882 F883 R888 L889 R890	M809-L886 HydrophobicContact CG-CD1 4.27Å; M809-L886 HydrophobicContact SD-CB 3.72Å; M809-L886 HydrophobicContact SD-CD1 4.39Å; K825-L886 HydrophobicContact CB-CD2 3.79Å; I826-L886 HydrophobicContact CB-CD1 4.49Å; I826-L886 HydrophobicContact CG1-CD1 3.99Å; I826-L886 HydrophobicContact CG1-CD2 3.56Å; I826-L886 HydrophobicContact CG1-CG 4.37Å; A829-L886 HydrophobicContact CB-CD1 3.52Å; K882-L886 WeakPolarHBondContact O-CG 3.37Å; K882-L886 PolarHBondContact O-N 3.47Å; K882-L886 VanDerWaalsContact O-N 3.1Å; F883-L886 PolarHBondContact O-N 2.79Å; L886-R888 VanDerWaalsContact C-N 3.3Å; L886-R888 PolarHBondContact O-N 3.04Å; L886-L889 HydrophobicContact CD2-CD1 4.42Å; L886-L889 WeakPolarHBondContact O-CB 3.39Å; L886-L889 PolarHBondContact O-N 3.2Å; L886-L889 VanDerWaalsContact O-N 3.08Å; L886-R890 PolarHBondContact O-N 3.35Å
887	Q	94.1	Very high	89.9	Confident	69 Å²	69	72.5 Å²	72.5	32%	0.322	35%	0.347	S	S	.	.	H	α-helix	trans	-61.3	-39.7	173	-72.7	180	44.2	0	0	111.1	F883 L889 R890 L891	F883-Q887 WeakPolarHBondContact O-CB 3.09Å; F883-Q887 WeakPolarHBondContact O-CG 3.35Å; F883-Q887 PolarHBondContact O-N 3.43Å; Q887-L889 VanDerWaalsContact C-N 3.29Å; Q887-L889 PolarHBondContact O-N 2.82Å; Q887-R890 WeakPolarHBondContact O-CB 3.32Å; Q887-R890 PolarHBondContact O-N 3.47Å; Q887-L891 WeakPolarHBondContact O-CB 3.37Å; Q887-L891 VanDerWaalsContact O-CG 3.29Å; Q887-L891 WeakPolarHBondContact O-CG 3.5Å; Q887-L891 PolarHBondContact O-N 2.86Å
888	R	93.2	Very high	87.4	Confident	121 Å²	121	73.2 Å²	73.2	46%	0.457	35%	0.351	S	S	.	.	H	α-helix	trans	-66	-28	173.7	-172.6	-179.5	64.8	95.7	4.3	113.2	D884 E885 L886	D884-R888 VanDerWaalsContact O-CB 3.25Å; D884-R888 WeakPolarHBondContact O-CB 3.47Å; D884-R888 PolarHBondContact O-N 3.38Å; E885-R888 PolarHBondContact O-N 2.69Å; L886-R888 VanDerWaalsContact C-N 3.3Å; L886-R888 PolarHBondContact O-N 3.04Å
889	L	91.6	Very high	84.5	Confident	7 Å²	7	72 Å²	72	4%	0.037	35%	0.348	C	S	.	.	H	α-helix	trans	-75.1	-43.3	171.3	-72.7	166.4	0	0	0	111.5	K825 E885 L886 Q887 L891 N892 W894	K825-L889 HydrophobicContact CD-CD1 4.23Å; E885-L889 WeakPolarHBondContact O-CG 3.45Å; E885-L889 PolarHBondContact O-N 3.1Å; L886-L889 HydrophobicContact CD2-CD1 4.42Å; L886-L889 WeakPolarHBondContact O-CB 3.39Å; L886-L889 PolarHBondContact O-N 3.2Å; L886-L889 VanDerWaalsContact O-N 3.08Å; Q887-L889 VanDerWaalsContact C-N 3.29Å; Q887-L889 PolarHBondContact O-N 2.82Å; L889-L891 PolarHBondContact O-N 2.89Å; L889-N892 CarbonylContact O-C 3.59Å; L889-N892 WeakPolarHBondContact O-CA 3.48Å; L889-N892 WeakPolarHBondContact O-CB 3.31Å; L889-N892 PolarHBondContact O-N 2.95Å; L889-W894 HydrophobicContact CB-CE3 3.91Å; L889-W894 HydrophobicContact CB-CZ3 4.07Å; L889-W894 VanDerWaalsContact O-CA 3.27Å; L889-W894 WeakPolarHBondContact O-CA 3.48Å; L889-W894 PolarHBondContact O-N 3.27Å
890	R	89.5	Confident	82	Confident	82 Å²	82	76.8 Å²	76.8	31%	0.309	38%	0.379	S	S	.	.	H	α-helix	trans	-56.2	-47	173.5	-171.1	-179.9	-178.3	-164	6.7	112	E808 E812 L886 Q887 N892 D893 W894	E808-R890 IonicContact OE1-CZ 3.22Å; E808-R890 IonicContact OE1-NH1 2.73Å; E808-R890 PolarHBondContact OE1-NH1 3.45Å; E808-R890 IonicContact OE1-NH2 3.16Å; E808-R890 PolarHBondContact OE1-NH2 3.17Å; E812-R890 IonicContact OE1-CZ 2.75Å; E812-R890 IonicContact OE1-NE 3.44Å; E812-R890 PolarHBondContact OE1-NE 2.88Å; E812-R890 IonicContact OE1-NH2 2.73Å; E812-R890 PolarHBondContact OE1-NH2 2.6Å; E812-R890 IonicContact OE2-NE 2.68Å; E812-R890 PolarHBondContact OE2-NE 3.31Å; L886-R890 PolarHBondContact O-N 3.35Å; Q887-R890 WeakPolarHBondContact O-CB 3.32Å; Q887-R890 PolarHBondContact O-N 3.47Å; R890-N892 PolarHBondContact O-N 3.05Å; R890-N892 VanDerWaalsContact O-N 3.08Å; R890-D893 PolarHBondContact O-N 3.47Å; R890-D893 VanDerWaalsContact O-N 3.1Å; R890-W894 HydrophobicContact CB-CD2 4.38Å; R890-W894 HydrophobicContact CB-CH2 3.74Å; R890-W894 HydrophobicContact CB-CZ2 3.53Å; R890-W894 HydrophobicContact CB-CZ3 4.23Å; R890-W894 HydrophobicContact CG-CH2 4.25Å; R890-W894 HydrophobicContact CG-CZ2 3.57Å
891	L	91	Very high	79.5	Confident	151 Å²	151	83.3 Å²	83.3	79%	0.791	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-7	174.8	-70	172.1	0	0	0	114.4	Q887 L889	Q887-L891 WeakPolarHBondContact O-CB 3.37Å; Q887-L891 VanDerWaalsContact O-CG 3.29Å; Q887-L891 WeakPolarHBondContact O-CG 3.5Å; Q887-L891 PolarHBondContact O-N 2.86Å; L889-L891 PolarHBondContact O-N 2.89Å
892	N	90.7	Very high	77.1	Confident	64 Å²	64	88.1 Å²	88.1	34%	0.342	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	22.4	176.3	-119.5	-24.4	0	0	0	111.6	L889 R890 W894 K895	L889-N892 CarbonylContact O-C 3.59Å; L889-N892 WeakPolarHBondContact O-CA 3.48Å; L889-N892 WeakPolarHBondContact O-CB 3.31Å; L889-N892 PolarHBondContact O-N 2.95Å; R890-N892 PolarHBondContact O-N 3.05Å; R890-N892 VanDerWaalsContact O-N 3.08Å; N892-W894 PolarHBondContact O-N 2.73Å; N892-K895 WeakPolarHBondContact O-CB 3.35Å; N892-K895 WeakPolarHBondContact O-CD 3.37Å; N892-K895 WeakPolarHBondContact O-CG 3.23Å; N892-K895 PolarHBondContact O-N 2.97Å
893	D	86.9	Confident	74.4	Confident	113 Å²	113	91.5 Å²	91.5	60%	0.604	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	37.6	-171.7	-44.5	-53	0	0	0	112.7	R890 K895	R890-D893 PolarHBondContact O-N 3.47Å; R890-D893 VanDerWaalsContact O-N 3.1Å; D893-K895 HydrophobicContact CB-CD 4.17Å; D893-K895 HydrophobicContact CB-CG 4.46Å; D893-K895 PolarHBondContact O-N 3.28Å; D893-K895 IonicContact OD2-NZ 2.61Å; D893-K895 PolarHBondContact OD2-NZ 2.86Å
894	W	88.6	Confident	71.9	Confident	28 Å²	28	98.2 Å²	98.2	11%	0.106	47%	0.466	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.3	14.7	-173.3	-58.7	109.1	0	0	0	114.9	M809 E812 L818 I822 I826 L889 R890 N892 M896	M809-W894 HydrophobicContact SD-CH2 4.3Å; E812-W894 HydrophobicContact CB-CH2 4.42Å; E812-W894 HydrophobicContact CB-CZ2 3.77Å; E812-W894 HydrophobicContact CG-CZ2 4.09Å; E812-W894 WeakPolarHBondContact OE2-CZ2 3.46Å; E812-W894 PolarHBondContact OE2-NE1 3.41Å; L818-W894 HydrophobicContact CD1-CD2 4.28Å; L818-W894 HydrophobicContact CD1-CE3 4.36Å; L818-W894 HydrophobicContact CD1-CH2 4.48Å; L818-W894 HydrophobicContact CD1-CZ2 4.43Å; L818-W894 HydrophobicContact CD1-CZ3 4.45Å; L818-W894 HydrophobicContact CD2-CB 3.7Å; L818-W894 HydrophobicContact CD2-CD2 3.54Å; L818-W894 HydrophobicContact CD2-CE3 4.17Å; L818-W894 HydrophobicContact CD2-CG 3.29Å; I822-W894 HydrophobicContact CD1-CB 4.27Å; I822-W894 WeakPolarHBondContact CD1-O 3.34Å; I822-W894 HydrophobicContact CG2-CE3 3.6Å; I822-W894 HydrophobicContact CG2-CZ3 3.79Å; I826-W894 HydrophobicContact CD1-CH2 4.2Å; I826-W894 HydrophobicContact CD1-CZ3 4.29Å; L889-W894 HydrophobicContact CB-CE3 3.91Å; L889-W894 HydrophobicContact CB-CZ3 4.07Å; L889-W894 VanDerWaalsContact O-CA 3.27Å; L889-W894 WeakPolarHBondContact O-CA 3.48Å; L889-W894 PolarHBondContact O-N 3.27Å; R890-W894 HydrophobicContact CB-CD2 4.38Å; R890-W894 HydrophobicContact CB-CH2 3.74Å; R890-W894 HydrophobicContact CB-CZ2 3.53Å; R890-W894 HydrophobicContact CB-CZ3 4.23Å; R890-W894 HydrophobicContact CG-CH2 4.25Å; R890-W894 HydrophobicContact CG-CZ2 3.57Å; N892-W894 PolarHBondContact O-N 2.73Å; W894-M896 PolarHBondContact O-N 3.49Å
895	K	76.6	Confident	69.5	Low	128 Å²	128	103.5 Å²	103.5	56%	0.557	49%	0.488	S	S	*	.			trans	-72.6	115.6	177.2	-64.7	158.3	-171.1	155	0	109.3	N892 D893 M897	N892-K895 WeakPolarHBondContact O-CB 3.35Å; N892-K895 WeakPolarHBondContact O-CD 3.37Å; N892-K895 WeakPolarHBondContact O-CG 3.23Å; N892-K895 PolarHBondContact O-N 2.97Å; D893-K895 HydrophobicContact CB-CD 4.17Å; D893-K895 HydrophobicContact CB-CG 4.46Å; D893-K895 PolarHBondContact O-N 3.28Å; D893-K895 IonicContact OD2-NZ 2.61Å; D893-K895 PolarHBondContact OD2-NZ 2.86Å; K895-M897 PolarHBondContact O-N 3.23Å
896	M	65.3	Low	67.4	Low	100 Å²	100	111.4 Å²	111.4	49%	0.493	52%	0.515	S	S	.	.			trans	-59.7	111	176.4	-174.8	-176.2	-179	0	0	110.3	E821 W894 E898	E821-M896 VanDerWaalsContact CD-CE 3.46Å; E821-M896 WeakPolarHBondContact OE1-CE 3Å; E821-M896 VanDerWaalsContact OE2-CE 3.3Å; E821-M896 WeakPolarHBondContact OE2-CE 3.48Å; W894-M896 PolarHBondContact O-N 3.49Å; M896-E898 PolarHBondContact O-N 3.43Å
897	M	50.8	Low	64.7	Low	122 Å²	122	118.9 Å²	118.9	60%	0.601	55%	0.547	S	S	*	.			trans	-73.9	92.6	175.7	-168	-179.2	-159.5	0	0	109.7	K895 S899	K895-M897 PolarHBondContact O-N 3.23Å; M897-S899 PolarHBondContact O-N 2.77Å; M897-S899 VanDerWaalsContact O-N 3.09Å
898	E	44.3	Very low	62.7	Low	120 Å²	120	122 Å²	122	56%	0.561	57%	0.57	S	S	*	*			trans	-50.2	116.8	163.7	-94.9	-167.7	110.1	0	0	108.8	M896 K903	M896-E898 PolarHBondContact O-N 3.43Å; E898-K903 VanDerWaalsContact CD-NZ 3.35Å; E898-K903 WeakPolarHBondContact OE1-CE 3.34Å; E898-K903 IonicContact OE1-NZ 3.51Å; E898-K903 WeakPolarHBondContact OE2-CE 3.44Å; E898-K903 IonicContact OE2-NZ 2.61Å; E898-K903 PolarHBondContact OE2-NZ 3.02Å
899	S	38.1	Very low	60.4	Low	53 Å²	53	121.2 Å²	121.2	37%	0.371	58%	0.581	S	S	.	*			trans	-63.8	137.2	169.9	93.6	0	0	0	0	108.5	M897 E901	M897-S899 PolarHBondContact O-N 2.77Å; M897-S899 VanDerWaalsContact O-N 3.09Å; S899-E901 PolarHBondContact O-N 3.48Å; S899-E901 PolarHBondContact OG-OE2 3.21Å
900	P	45.1	Very low	58.3	Low	105 Å²	105	126.3 Å²	126.3	68%	0.682	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-65.1	-13.3	-177.5	25.3	-33.9	0	0	0	113.1	R902 K903	P900-R902 VanDerWaalsContact C-N 3.3Å; P900-R902 PolarHBondContact O-N 2.89Å; P900-K903 PolarHBondContact O-N 2.75Å
901	E	45.1	Very low	56.2	Low	154 Å²	154	128.4 Å²	128.4	72%	0.72	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-59.4	-36.6	-177.5	-58.6	173.6	120.1	0	0	112.6	S899 K903 E904	S899-E901 PolarHBondContact O-N 3.48Å; S899-E901 PolarHBondContact OG-OE2 3.21Å; E901-K903 PolarHBondContact O-N 2.89Å; E901-K903 VanDerWaalsContact O-N 3.15Å; E901-E904 PolarHBondContact O-N 3.21Å
902	R	46.8	Very low	53.7	Low	224 Å²	224	128.4 Å²	128.4	85%	0.845	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-70.6	-5.4	177.3	-80.9	-168.8	170.6	-175.2	-0.1	114.6	P900	P900-R902 VanDerWaalsContact C-N 3.3Å; P900-R902 PolarHBondContact O-N 2.89Å
903	K	40.3	Very low	52.1	Low	130 Å²	130	131.1 Å²	131.1	57%	0.565	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-101.7	-5.2	-179.9	-73.2	173.4	-177.1	164.9	0	114.7	E898 P900 E901	E898-K903 VanDerWaalsContact CD-NZ 3.35Å; E898-K903 WeakPolarHBondContact OE1-CE 3.34Å; E898-K903 IonicContact OE1-NZ 3.51Å; E898-K903 WeakPolarHBondContact OE2-CE 3.44Å; E898-K903 IonicContact OE2-NZ 2.61Å; E898-K903 PolarHBondContact OE2-NZ 3.02Å; P900-K903 PolarHBondContact O-N 2.75Å; E901-K903 PolarHBondContact O-N 2.89Å; E901-K903 VanDerWaalsContact O-N 3.15Å
904	E	44.2	Very low	50.1	Low	141 Å²	141	135.2 Å²	135.2	66%	0.659	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-31	178.7	-169.3	136.1	-121	0	0	114.1	E901 R906 K907	E901-E904 PolarHBondContact O-N 3.21Å; E904-R906 VanDerWaalsContact C-N 3.26Å; E904-R906 PolarHBondContact O-N 2.61Å; E904-K907 IonicContact OE1-NZ 3.83Å
905	E	46.8	Very low	47.5	Very low	192 Å²	192	143.5 Å²	143.5	90%	0.897	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-12.8	-178.3	-73.1	-155.7	125.4	0	0	115.4
906	R	51.3	Low	46.1	Very low	234 Å²	234	143 Å²	143	88%	0.883	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	44.9	179.9	-76.7	-166.2	174	-170.8	1.7	114.7	E904	E904-R906 VanDerWaalsContact C-N 3.26Å; E904-R906 PolarHBondContact O-N 2.61Å
907	K	39.2	Very low	45.4	Very low	159 Å²	159	143 Å²	143	69%	0.691	73%	0.726	S	S	*	*			trans	-100.2	80.1	165.3	-75.6	178.6	-177	161.2	0	112.1	E904	E904-K907 IonicContact OE1-NZ 3.83Å
908	V	51.8	Low	44.6	Very low	133 Å²	133	147.2 Å²	147.2	81%	0.806	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-67.8	129.4	163.5	-179.7	0	0	0	0	108.6
909	P	44	Very low	44.1	Very low	105 Å²	105	145.2 Å²	145.2	68%	0.682	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-69.6	145.9	179.2	28.3	-34.7	0	0	0	111.7
910	P	48	Very low	44.5	Very low	114 Å²	114	151.5 Å²	151.5	74%	0.74	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-71.3	143.4	-174.8	28.8	-35.3	0	0	0	112.6
911	P	45.5	Very low	43.9	Very low	127 Å²	127	155.8 Å²	155.8	83%	0.825	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-73	134	178.1	29.7	-34.2	0	0	0	111.9
912	I	39.1	Very low	43.8	Very low	150 Å²	150	153.9 Å²	153.9	77%	0.769	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-73	127.4	179	-59.8	172.3	0	0	0	110
913	P	56	Low	43.4	Very low	121 Å²	121	150.8 Å²	150.8	79%	0.786	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-72.9	130.4	178.1	29.4	-34.3	0	0	0	111.7
914	K	44.6	Very low	43.7	Very low	200 Å²	200	151.5 Å²	151.5	87%	0.87	80%	0.796	S	S	*	*			trans	-115.9	139.8	166	-72	-168.5	176.4	-175.6	0	110.6
915	K	35.3	Very low	43.5	Very low	201 Å²	201	155.4 Å²	155.4	87%	0.874	81%	0.805	S	S	*	*			trans	-82.1	156	-170.3	-66.3	180	-179.7	179	0	112.2
916	P	47.2	Very low	43.1	Very low	117 Å²	117	154.9 Å²	154.9	76%	0.76	80%	0.802	S	S	*	*			trans	-82.9	-166.9	171.2	42.7	-41.2	0	0	0	109.6
917	P	49.4	Very low	42.5	Very low	102 Å²	102	154 Å²	154	66%	0.662	81%	0.805	S	S	*	*			cis	-141.8	-168.4	5.7	30.5	-4.4	0	0	0	116.3
918	K	34.7	Very low	43.1	Very low	210 Å²	210	150.7 Å²	150.7	91%	0.913	80%	0.802	S	S	*	*			trans	91.5	124.5	155.9	-56.3	179.1	-176.3	178.2	0	119
919	G	34.6	Very low	42.7	Very low	77 Å²	77	152 Å²	152	79%	0.794	80%	0.804	S	S	*	*			trans	159.4	129.5	171.8	0	0	0	0	0	108.5
920	K	45.4	Very low	43	Very low	186 Å²	186	151.8 Å²	151.8	81%	0.809	80%	0.797	S	S	*	*			trans	-126.3	163.6	-174.2	-79.8	-168.9	178	-175.9	0	112.4
921	F	33.4	Very low	43.2	Very low	194 Å²	194	151.7 Å²	151.7	85%	0.851	79%	0.789	S	S	*	*			trans	91.6	149.3	166.7	-57.2	-67.8	0	0	0	117.3
922	P	42.8	Very low	43.6	Very low	115 Å²	115	149.6 Å²	149.6	75%	0.747	78%	0.776	S	S	*	*			trans	-118.3	140.3	-146.5	37.9	-24.7	0	0	0	114.4
923	I	38.5	Very low	44.5	Very low	159 Å²	159	146.4 Å²	146.4	82%	0.815	76%	0.76	S	S	*	*			trans	-134.1	128.5	161.5	-65.4	-177.7	0	0	0	108.3	R925	I923-R925 PolarHBondContact O-N 2.77Å
924	T	45.4	Very low	45	Very low	145 Å²	145	148.5 Å²	148.5	89%	0.89	75%	0.753	S	S	*	*			trans	-71.5	104.3	172.6	43.7	0	0	0	0	110.3
925	R	39.7	Very low	46.1	Very low	222 Å²	222	145.9 Å²	145.9	84%	0.838	74%	0.743	S	S	*	*			trans	-145.7	92.2	167.9	-159.3	172.2	-177	109.6	-0.1	112.5	I923	I923-R925 PolarHBondContact O-N 2.77Å
926	E	38.3	Very low	48	Very low	181 Å²	181	143.6 Å²	143.6	85%	0.846	73%	0.729	S	S	*	*			trans	27.8	130.1	145.3	-64.1	173.5	-124.5	0	0	120.3	S928	E926-S928 PolarHBondContact O-N 3.4Å
927	K	39.6	Very low	49.4	Very low	215 Å²	215	144 Å²	144	94%	0.935	72%	0.721	S	S	*	*			trans	-66.7	92.5	-167.6	-63.1	167.6	-176.7	171.5	0	113.5	L929	K927-L929 PolarHBondContact O-N 2.75Å
928	S	52	Low	50.9	Low	91 Å²	91	141 Å²	141	64%	0.636	70%	0.698	S	S	*	*			trans	-83	84.4	173.7	169	0	0	0	0	112.5	E926 L931	E926-S928 PolarHBondContact O-N 3.4Å; S928-L931 VanDerWaalsContact OG-CD1 3.31Å; S928-L931 WeakPolarHBondContact OG-CD1 3.22Å
929	L	44.3	Very low	53	Low	160 Å²	160	133.7 Å²	133.7	84%	0.838	68%	0.677	S	S	*	*			trans	-127.4	-3.7	169.5	-103.7	168.9	0	0	0	114.8	K927	K927-L929 PolarHBondContact O-N 2.75Å
930	D	49.8	Very low	55.3	Low	100 Å²	100	138.1 Å²	138.1	54%	0.535	67%	0.669	S	S	.	*			trans	-98.8	-4.4	-174	-172.2	50	0	0	0	114.1	D933 R934	D930-D933 PolarHBondContact O-N 3.07Å; D930-R934 WeakPolarHBondContact O-CB 3.48Å; D930-R934 PolarHBondContact O-N 2.74Å
931	L	52.2	Low	57.2	Low	112 Å²	112	136 Å²	136	59%	0.586	66%	0.656	S	S	*	*	H	α-helix	trans	-56.2	-47.2	-176.6	-88.7	90.5	0	0	0	115.5	S928 Q935	S928-L931 VanDerWaalsContact OG-CD1 3.31Å; S928-L931 WeakPolarHBondContact OG-CD1 3.22Å; L931-Q935 WeakPolarHBondContact O-CB 3.31Å; L931-Q935 PolarHBondContact O-N 3.17Å
932	P	54	Low	59.8	Low	83 Å²	83	134.4 Å²	134.4	54%	0.539	65%	0.645	S	S	.	*	H	α-helix	trans	-68.4	-38.3	-175	26.3	-33.5	0	0	0	112.3	Q935 R936	P932-Q935 PolarHBondContact O-N 3.14Å; P932-R936 VanDerWaalsContact O-CB 3.31Å; P932-R936 WeakPolarHBondContact O-CB 3.4Å; P932-R936 PolarHBondContact O-N 3.39Å
933	D	58.2	Low	61.8	Low	83 Å²	83	134.7 Å²	134.7	44%	0.444	64%	0.639	S	S	.	*	H	α-helix	trans	-79.7	-34.7	178.7	-81.8	-54.3	0	0	0	112.6	D930 Q935 R936 Q937	D930-D933 PolarHBondContact O-N 3.07Å; D933-Q935 VanDerWaalsContact C-N 3.3Å; D933-Q935 PolarHBondContact O-N 2.84Å; D933-R936 PolarHBondContact O-N 3.34Å; D933-Q937 WeakPolarHBondContact O-CB 3.42Å; D933-Q937 WeakPolarHBondContact O-CG 3.44Å; D933-Q937 PolarHBondContact O-N 2.88Å
934	R	64.8	Low	63.8	Low	165 Å²	165	132.8 Å²	132.8	62%	0.623	63%	0.629	S	S	*	*	H	α-helix	trans	-58.6	-43.2	166.2	-174.7	170.6	176.9	165.4	-1.2	111.1	D930 Q937 E938	D930-R934 WeakPolarHBondContact O-CB 3.48Å; D930-R934 PolarHBondContact O-N 2.74Å; R934-Q937 PolarHBondContact O-N 3.27Å; R934-E938 WeakPolarHBondContact O-CB 3.4Å; R934-E938 PolarHBondContact O-N 2.92Å
935	Q	68.8	Low	65.6	Low	145 Å²	145	128.5 Å²	128.5	68%	0.678	61%	0.607	S	S	*	*	H	α-helix	trans	-67.6	-35.3	176.6	-164.6	174.3	25.4	0	0	112.2	L931 P932 D933 A939	L931-Q935 WeakPolarHBondContact O-CB 3.31Å; L931-Q935 PolarHBondContact O-N 3.17Å; P932-Q935 PolarHBondContact O-N 3.14Å; D933-Q935 VanDerWaalsContact C-N 3.3Å; D933-Q935 PolarHBondContact O-N 2.84Å; Q935-A939 VanDerWaalsContact O-CB 3.3Å; Q935-A939 WeakPolarHBondContact O-CB 3.24Å; Q935-A939 PolarHBondContact O-N 3.07Å
936	R	75.1	Confident	67.5	Low	153 Å²	153	120.5 Å²	120.5	58%	0.577	59%	0.589	S	S	*	*	H	α-helix	trans	-68	-41.7	173.5	-177.4	177.2	-75.3	-158.6	-4.9	112.6	P932 D933 R940	P932-R936 VanDerWaalsContact O-CB 3.31Å; P932-R936 WeakPolarHBondContact O-CB 3.4Å; P932-R936 PolarHBondContact O-N 3.39Å; D933-R936 PolarHBondContact O-N 3.34Å; R936-R940 WeakPolarHBondContact O-CG 3.43Å; R936-R940 PolarHBondContact O-N 2.77Å
937	Q	76.6	Confident	69.6	Low	125 Å²	125	119.1 Å²	119.1	58%	0.584	58%	0.58	S	S	*	*	H	α-helix	trans	-69.2	-40.3	173.7	-71.2	-172.9	16.5	0	0	111.8	D933 R934 A939 R940 R941	D933-Q937 WeakPolarHBondContact O-CB 3.42Å; D933-Q937 WeakPolarHBondContact O-CG 3.44Å; D933-Q937 PolarHBondContact O-N 2.88Å; R934-Q937 PolarHBondContact O-N 3.27Å; Q937-A939 VanDerWaalsContact C-N 3.35Å; Q937-R940 PolarHBondContact O-N 3.23Å; Q937-R941 WeakPolarHBondContact O-CB 3.38Å; Q937-R941 PolarHBondContact O-N 3.03Å
938	E	80.3	Confident	71.3	Confident	41 Å²	41	118 Å²	118	19%	0.192	57%	0.57	C	S	.	*	H	α-helix	trans	-59.2	-44.6	172.9	-174.6	72.4	-143.7	0	0	111	R934 R941 R942	R934-E938 WeakPolarHBondContact O-CB 3.4Å; R934-E938 PolarHBondContact O-N 2.92Å; E938-R941 PolarHBondContact O-N 3.28Å; E938-R941 IonicContact OE1-CZ 3.4Å; E938-R941 IonicContact OE1-NH1 3.95Å; E938-R941 PolarHBondContact OE1-NH1 2.81Å; E938-R941 IonicContact OE2-CZ 2.9Å; E938-R941 IonicContact OE2-NH1 2.61Å; E938-R941 PolarHBondContact OE2-NH1 3.42Å; E938-R941 IonicContact OE2-NH2 2.66Å; E938-R941 PolarHBondContact OE2-NH2 2.86Å; E938-R942 VanDerWaalsContact CD-NH2 3.29Å; E938-R942 VanDerWaalsContact CG-CZ 3.45Å; E938-R942 VanDerWaalsContact CG-NH2 3.33Å; E938-R942 WeakPolarHBondContact O-CB 3.48Å; E938-R942 VanDerWaalsContact O-CG 3.27Å; E938-R942 WeakPolarHBondContact O-CG 3.37Å; E938-R942 PolarHBondContact O-N 2.86Å; E938-R942 IonicContact OE1-CZ 3.41Å; E938-R942 IonicContact OE1-NE 2.76Å; E938-R942 PolarHBondContact OE1-NE 3.12Å; E938-R942 IonicContact OE1-NH2 3.36Å; E938-R942 PolarHBondContact OE1-NH2 3.12Å
939	A	79.4	Confident	72.1	Confident	55 Å²	55	116.2 Å²	116.2	46%	0.455	56%	0.561	S	S	.	*	H	α-helix	trans	-63.1	-43.9	173.6	0	0	0	0	0	112.4	Q935 Q937 R941 R942 L943	Q935-A939 VanDerWaalsContact O-CB 3.3Å; Q935-A939 WeakPolarHBondContact O-CB 3.24Å; Q935-A939 PolarHBondContact O-N 3.07Å; Q937-A939 VanDerWaalsContact C-N 3.35Å; A939-R941 PolarHBondContact O-N 3.08Å; A939-R942 PolarHBondContact O-N 2.71Å; A939-L943 WeakPolarHBondContact O-CB 3.38Å; A939-L943 PolarHBondContact O-N 3.31Å
940	R	82.3	Confident	73.1	Confident	170 Å²	170	111 Å²	111	64%	0.642	54%	0.542	S	S	*	.	H	α-helix	trans	-60.4	-41.7	173.1	-75.4	173.3	172.3	-176.2	-3.8	111.9	R936 Q937 L943 M944	R936-R940 WeakPolarHBondContact O-CG 3.43Å; R936-R940 PolarHBondContact O-N 2.77Å; Q937-R940 PolarHBondContact O-N 3.23Å; R940-L943 PolarHBondContact O-N 3.28Å; R940-M944 WeakPolarHBondContact O-CG 3.4Å; R940-M944 PolarHBondContact O-N 3.42Å
941	R	86.6	Confident	73.7	Confident	141 Å²	141	109.2 Å²	109.2	53%	0.532	54%	0.537	S	S	.	.	H	α-helix	trans	-63.4	-44.7	176.5	-155.3	-165.4	-45.1	120.9	12.4	111.3	Q937 E938 A939 M944 A945	Q937-R941 WeakPolarHBondContact O-CB 3.38Å; Q937-R941 PolarHBondContact O-N 3.03Å; E938-R941 PolarHBondContact O-N 3.28Å; E938-R941 IonicContact OE1-CZ 3.4Å; E938-R941 IonicContact OE1-NH1 3.95Å; E938-R941 PolarHBondContact OE1-NH1 2.81Å; E938-R941 IonicContact OE2-CZ 2.9Å; E938-R941 IonicContact OE2-NH1 2.61Å; E938-R941 PolarHBondContact OE2-NH1 3.42Å; E938-R941 IonicContact OE2-NH2 2.66Å; E938-R941 PolarHBondContact OE2-NH2 2.86Å; A939-R941 PolarHBondContact O-N 3.08Å; R941-M944 PolarHBondContact O-N 3.44Å; R941-A945 WeakPolarHBondContact O-CB 3.44Å; R941-A945 PolarHBondContact O-N 3.23Å
942	R	87	Confident	74	Confident	161 Å²	161	111.6 Å²	111.6	61%	0.608	54%	0.542	S	S	*	.	H	α-helix	trans	-66.1	-39.6	177	-71	171.2	-169.2	-176	2.6	112.1	E938 A939 A945 A946	E938-R942 VanDerWaalsContact CD-NH2 3.29Å; E938-R942 VanDerWaalsContact CG-CZ 3.45Å; E938-R942 VanDerWaalsContact CG-NH2 3.33Å; E938-R942 WeakPolarHBondContact O-CB 3.48Å; E938-R942 VanDerWaalsContact O-CG 3.27Å; E938-R942 WeakPolarHBondContact O-CG 3.37Å; E938-R942 PolarHBondContact O-N 2.86Å; E938-R942 IonicContact OE1-CZ 3.41Å; E938-R942 IonicContact OE1-NE 2.76Å; E938-R942 PolarHBondContact OE1-NE 3.12Å; E938-R942 IonicContact OE1-NH2 3.36Å; E938-R942 PolarHBondContact OE1-NH2 3.12Å; A939-R942 PolarHBondContact O-N 2.71Å; R942-A945 PolarHBondContact O-N 3.25Å; R942-A946 VanDerWaalsContact O-CB 3.28Å; R942-A946 WeakPolarHBondContact O-CB 3.14Å; R942-A946 PolarHBondContact O-N 3.22Å
943	L	86.1	Confident	74.3	Confident	122 Å²	122	117 Å²	117	64%	0.639	55%	0.552	S	S	*	*	H	α-helix	trans	-62.9	-42.9	173.9	-178.2	61.9	0	0	0	111.8	A939 R940 A946 K947	A939-L943 WeakPolarHBondContact O-CB 3.38Å; A939-L943 PolarHBondContact O-N 3.31Å; R940-L943 PolarHBondContact O-N 3.28Å; L943-A946 PolarHBondContact O-N 2.67Å; L943-K947 WeakPolarHBondContact O-CB 3.23Å; L943-K947 PolarHBondContact O-N 3.25Å
944	M	80.6	Confident	74.1	Confident	119 Å²	119	119.9 Å²	119.9	59%	0.586	56%	0.563	S	S	*	*	H	α-helix	trans	-67.6	-36.7	176.3	-69.5	-68.9	-88.9	0	0	112.4	R940 R941 R948	R940-M944 WeakPolarHBondContact O-CG 3.4Å; R940-M944 PolarHBondContact O-N 3.42Å; R941-M944 PolarHBondContact O-N 3.44Å; M944-R948 PolarHBondContact O-N 3.07Å
945	A	82.6	Confident	73.3	Confident	54 Å²	54	117.2 Å²	117.2	45%	0.446	56%	0.561	S	S	.	*	H	α-helix	trans	-66.2	-46.2	172.6	0	0	0	0	0	111.9	R941 R942 K947 R948 A949	R941-A945 WeakPolarHBondContact O-CB 3.44Å; R941-A945 PolarHBondContact O-N 3.23Å; R942-A945 PolarHBondContact O-N 3.25Å; A945-K947 VanDerWaalsContact C-N 3.31Å; A945-K947 PolarHBondContact O-N 3.23Å; A945-R948 PolarHBondContact O-N 3.08Å; A945-A949 PolarHBondContact O-N 3.34Å
946	A	80	Confident	72.5	Confident	55 Å²	55	113.4 Å²	113.4	46%	0.455	55%	0.55	S	S	.	*	H	α-helix	trans	-61	-38.8	175.5	0	0	0	0	0	111.9	R942 L943 R948 A949 A950	R942-A946 VanDerWaalsContact O-CB 3.28Å; R942-A946 WeakPolarHBondContact O-CB 3.14Å; R942-A946 PolarHBondContact O-N 3.22Å; L943-A946 PolarHBondContact O-N 2.67Å; A946-R948 PolarHBondContact O-N 2.96Å; A946-A949 PolarHBondContact O-N 2.9Å; A946-A950 WeakPolarHBondContact O-CB 3.45Å; A946-A950 PolarHBondContact O-N 3.15Å
947	K	81.9	Confident	71.3	Confident	151 Å²	151	109.2 Å²	109.2	66%	0.657	55%	0.549	S	S	*	.	H	α-helix	trans	-64	-37.6	175.6	-169.3	169.7	-177	174.3	0	112.5	L943 A945 S951	L943-K947 WeakPolarHBondContact O-CB 3.23Å; L943-K947 PolarHBondContact O-N 3.25Å; A945-K947 VanDerWaalsContact C-N 3.31Å; A945-K947 PolarHBondContact O-N 3.23Å; K947-S951 WeakPolarHBondContact O-CB 3.46Å; K947-S951 PolarHBondContact O-N 2.77Å
948	R	75.3	Confident	70	Confident	191 Å²	191	106.9 Å²	106.9	72%	0.721	55%	0.546	S	S	*	.	H	α-helix	trans	-65.6	-45.6	170.9	-67.7	178.8	-168.8	155.2	1.8	111.8	M944 A945 A946 A950 S951 F952	M944-R948 PolarHBondContact O-N 3.07Å; A945-R948 PolarHBondContact O-N 3.08Å; A946-R948 PolarHBondContact O-N 2.96Å; R948-A950 VanDerWaalsContact C-N 3.33Å; R948-A950 PolarHBondContact O-N 3.25Å; R948-S951 WeakPolarHBondContact O-CB 3.37Å; R948-S951 PolarHBondContact O-N 3.08Å; R948-F952 PolarHBondContact O-N 3.12Å
949	A	68.8	Low	68.5	Low	55 Å²	55	112.9 Å²	112.9	46%	0.455	57%	0.574	S	S	.	*	H	α-helix	trans	-64.3	-35.4	178.8	0	0	0	0	0	112.9	A945 A946 R953	A945-A949 PolarHBondContact O-N 3.34Å; A946-A949 PolarHBondContact O-N 2.9Å; A949-R953 PolarHBondContact O-N 3.2Å
950	A	64.8	Low	67	Low	51 Å²	51	120.4 Å²	120.4	42%	0.421	59%	0.591	S	S	.	*	H	α-helix	trans	-69.5	-41.9	172.6	0	0	0	0	0	111.9	A946 R948 F952 R953 Q954	A946-A950 WeakPolarHBondContact O-CB 3.45Å; A946-A950 PolarHBondContact O-N 3.15Å; R948-A950 VanDerWaalsContact C-N 3.33Å; R948-A950 PolarHBondContact O-N 3.25Å; A950-F952 VanDerWaalsContact C-N 3.29Å; A950-F952 PolarHBondContact O-N 2.67Å; A950-R953 CarbonylContact O-C 3.55Å; A950-R953 WeakPolarHBondContact O-CA 3.41Å; A950-R953 WeakPolarHBondContact O-CB 3.47Å; A950-R953 PolarHBondContact O-N 3.45Å; A950-Q954 PolarHBondContact O-N 3.29Å
951	S	63.3	Low	65.3	Low	62 Å²	62	115.2 Å²	115.2	43%	0.434	58%	0.584	S	S	.	*	H	α-helix	trans	-59	-40.4	174.3	-163.9	0	0	0	0	111.9	K947 R948 R953 Q954 N955	K947-S951 WeakPolarHBondContact O-CB 3.46Å; K947-S951 PolarHBondContact O-N 2.77Å; R948-S951 WeakPolarHBondContact O-CB 3.37Å; R948-S951 PolarHBondContact O-N 3.08Å; S951-R953 VanDerWaalsContact C-N 3.28Å; S951-R953 PolarHBondContact O-N 3.36Å; S951-Q954 PolarHBondContact O-N 3.37Å; S951-Q954 VanDerWaalsContact O-N 3.14Å; S951-N955 PolarHBondContact O-N 3.3Å; S951-N955 PolarHBondContact O-OD1 3.32Å
952	F	56.7	Low	63.4	Low	161 Å²	161	116.3 Å²	116.3	71%	0.706	60%	0.601	S	S	*	*	H	α-helix	trans	-62.8	-33.5	175.1	-169.6	-98.5	0	0	0	112.7	R948 A950 S956	R948-F952 PolarHBondContact O-N 3.12Å; A950-F952 VanDerWaalsContact C-N 3.29Å; A950-F952 PolarHBondContact O-N 2.67Å; F952-S956 PolarHBondContact O-N 3.47Å; F952-S956 PolarHBondContact O-OG 3.19Å
953	R	60.5	Low	61.5	Low	196 Å²	196	113.4 Å²	113.4	74%	0.74	61%	0.605	S	S	*	*	H	α-helix	trans	-76.9	-20.5	173.9	-70.9	177.5	178.9	-97.1	1.5	114	A949 A950 S951 S956	A949-R953 PolarHBondContact O-N 3.2Å; A950-R953 CarbonylContact O-C 3.55Å; A950-R953 WeakPolarHBondContact O-CA 3.41Å; A950-R953 WeakPolarHBondContact O-CB 3.47Å; A950-R953 PolarHBondContact O-N 3.45Å; S951-R953 VanDerWaalsContact C-N 3.28Å; S951-R953 PolarHBondContact O-N 3.36Å; R953-S956 WeakPolarHBondContact CA-OG 3.45Å; R953-S956 PolarHBondContact O-OG 3.42Å
954	Q	55.4	Low	59.7	Low	145 Å²	145	114.2 Å²	114.2	68%	0.678	61%	0.608	S	S	*	*	H	α-helix	trans	-82.9	-41.5	172.5	-71.6	-166.7	-65.5	0	0	112	A950 S951 S956 A957 S958	A950-Q954 PolarHBondContact O-N 3.29Å; S951-Q954 PolarHBondContact O-N 3.37Å; S951-Q954 VanDerWaalsContact O-N 3.14Å; Q954-S956 PolarHBondContact O-N 3.36Å; Q954-A957 WeakPolarHBondContact O-CB 3.28Å; Q954-A957 PolarHBondContact O-N 3.21Å; Q954-S958 PolarHBondContact O-N 3.31Å; Q954-S958 PolarHBondContact O-OG 3.14Å
955	N	48	Very low	58.2	Low	109 Å²	109	117.9 Å²	117.9	58%	0.583	62%	0.624	S	S	*	*	H	α-helix	trans	-59.2	-35.1	175.3	-81.3	50.1	0	0	0	112.7	S951 A957 S958	S951-N955 PolarHBondContact O-N 3.3Å; S951-N955 PolarHBondContact O-OD1 3.32Å; N955-A957 VanDerWaalsContact C-N 3.26Å; N955-A957 PolarHBondContact O-N 3.35Å; N955-S958 PolarHBondContact O-OG 3.11Å
956	S	51.3	Low	56.4	Low	64 Å²	64	122.1 Å²	122.1	45%	0.448	64%	0.638	S	S	.	*	H	α-helix	trans	-80.3	0.4	175.9	44.2	0	0	0	0	114.4	F952 R953 Q954	F952-S956 PolarHBondContact O-N 3.47Å; F952-S956 PolarHBondContact O-OG 3.19Å; R953-S956 WeakPolarHBondContact CA-OG 3.45Å; R953-S956 PolarHBondContact O-OG 3.42Å; Q954-S956 PolarHBondContact O-N 3.36Å
957	A	49.6	Very low	54.6	Low	66 Å²	66	129.2 Å²	129.2	55%	0.545	65%	0.654	S	S	.	*	H	α-helix	trans	-98.4	-33.1	170.1	0	0	0	0	0	112.2	Q954 N955 E959	Q954-A957 WeakPolarHBondContact O-CB 3.28Å; Q954-A957 PolarHBondContact O-N 3.21Å; N955-A957 VanDerWaalsContact C-N 3.26Å; N955-A957 PolarHBondContact O-N 3.35Å; A957-E959 VanDerWaalsContact C-N 3.34Å
958	S	50.4	Low	52.9	Low	75 Å²	75	128.6 Å²	128.6	52%	0.524	66%	0.657	S	S	.	*	H	α-helix	trans	-66.1	-32.7	175	37.3	0	0	0	0	113.4	Q954 N955 R960 A961	Q954-S958 PolarHBondContact O-N 3.31Å; Q954-S958 PolarHBondContact O-OG 3.14Å; N955-S958 PolarHBondContact O-OG 3.11Å; S958-R960 PolarHBondContact O-N 3.21Å; S958-A961 PolarHBondContact O-N 3.27Å
959	E	47.3	Very low	51.3	Low	167 Å²	167	123.8 Å²	123.8	78%	0.78	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	3.4	-178.3	-157.8	171.7	-159.1	0	0	114.1	A957	A957-E959 VanDerWaalsContact C-N 3.34Å
960	R	47.5	Very low	50	Low	214 Å²	214	130.2 Å²	130.2	81%	0.808	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.4	7.6	175.7	-90.3	-177	170.9	151.4	-1.6	114.4	S958	S958-R960 PolarHBondContact O-N 3.21Å
961	A	47.7	Very low	48.9	Very low	61 Å²	61	132.5 Å²	132.5	50%	0.504	69%	0.69	S	S	.	*	S	Bend	trans	-88.9	-24.6	-179.2	0	0	0	0	0	113.9	S958 S963	S958-A961 PolarHBondContact O-N 3.27Å; A961-S963 PolarHBondContact O-N 3.1Å; A961-S963 VanDerWaalsContact O-N 3.08Å
962	D	47.5	Very low	47.8	Very low	164 Å²	164	137.7 Å²	137.7	88%	0.877	71%	0.707	S	S	*	*	S	Bend	trans	-76.6	9.9	-173.8	-69.8	-18.5	0	0	0	114.6
963	S	46.7	Very low	47.2	Very low	99 Å²	99	136 Å²	136	69%	0.692	71%	0.71	S	S	*	*			trans	-116.1	65.9	176.8	67.6	0	0	0	0	111.9	A961	A961-S963 PolarHBondContact O-N 3.1Å; A961-S963 VanDerWaalsContact O-N 3.08Å
964	I	48.1	Very low	46.6	Very low	140 Å²	140	137.6 Å²	137.6	72%	0.718	72%	0.716	S	S	*	*			trans	-127.1	106.3	165.3	-58.9	-179.3	0	0	0	108	I966	I964-I966 PolarHBondContact O-N 3.44Å
965	E	49.2	Very low	45.9	Very low	196 Å²	196	138.5 Å²	138.5	92%	0.916	73%	0.725	S	S	*	*			trans	-72.6	108.1	175.6	-63.8	179.8	144.7	0	0	109.8	Y967	E965-Y967 PolarHBondContact O-N 3.13Å
966	I	44.4	Very low	45.8	Very low	143 Å²	143	140 Å²	140	73%	0.733	73%	0.732	S	S	*	*			trans	-83.3	100.4	175	-59.4	-179.6	0	0	0	108.7	I964 I968	I964-I966 PolarHBondContact O-N 3.44Å; I966-I968 HydrophobicContact CG2-CG1 4.37Å; I966-I968 PolarHBondContact O-N 2.92Å
967	Y	41.8	Very low	45.5	Very low	203 Å²	203	143.9 Å²	143.9	80%	0.796	75%	0.747	S	S	*	*			trans	-65.1	117	169	-179	-94.1	0	0	0	110.1	E965 P969	E965-Y967 PolarHBondContact O-N 3.13Å; Y967-P969 HydrophobicContact CD1-CG 4.19Å; Y967-P969 HydrophobicContact CE1-CB 4.47Å; Y967-P969 HydrophobicContact CE1-CG 4.03Å
968	I	45.7	Very low	45.2	Very low	139 Å²	139	148.3 Å²	148.3	71%	0.713	76%	0.758	S	S	*	*			trans	-101.9	113.4	175.5	-58.2	176.4	0	0	0	108.3	I966	I966-I968 HydrophobicContact CG2-CG1 4.37Å; I966-I968 PolarHBondContact O-N 2.92Å
969	P	43.7	Very low	44.9	Very low	90 Å²	90	152.6 Å²	152.6	58%	0.584	77%	0.771	S	S	*	*			trans	-67.9	137.2	169.2	-14.6	29.2	0	0	0	110.5	Y967 A971	Y967-P969 HydrophobicContact CD1-CG 4.19Å; Y967-P969 HydrophobicContact CE1-CB 4.47Å; Y967-P969 HydrophobicContact CE1-CG 4.03Å; P969-A971 PolarHBondContact O-N 3.24Å; P969-A971 VanDerWaalsContact O-N 3.08Å
970	E	40.2	Very low	44.8	Very low	190 Å²	190	151.7 Å²	151.7	89%	0.888	77%	0.771	S	S	*	*			trans	-65.9	108.5	174.9	-68.9	-172	131	0	0	111.2	Q972	E970-Q972 PolarHBondContact O-N 3.37Å
971	A	41.9	Very low	44.6	Very low	99 Å²	99	147.5 Å²	147.5	82%	0.818	77%	0.768	S	S	*	*			trans	-72.8	103.7	164.5	0	0	0	0	0	108.9	P969 T973	P969-A971 PolarHBondContact O-N 3.24Å; P969-A971 VanDerWaalsContact O-N 3.08Å; A971-T973 PolarHBondContact O-N 2.88Å
972	Q	40	Very low	44.4	Very low	171 Å²	171	153.7 Å²	153.7	80%	0.799	79%	0.787	S	S	*	*			trans	-61.4	120	176.4	-74.3	-172.6	-19.5	0	0	110.9	E970 R974	E970-Q972 PolarHBondContact O-N 3.37Å; Q972-R974 PolarHBondContact O-N 3.21Å
973	T	44.2	Very low	44.2	Very low	124 Å²	124	152.9 Å²	152.9	76%	0.761	78%	0.78	S	S	*	*			trans	-64.9	126.5	165.5	42.1	0	0	0	0	110	A971	A971-T973 PolarHBondContact O-N 2.88Å
974	R	47.8	Very low	43.9	Very low	230 Å²	230	157.4 Å²	157.4	87%	0.868	79%	0.788	S	S	*	*			trans	-138.3	88.7	160	-81.8	-155.8	167	-138.9	-7.1	110.6	Q972	Q972-R974 PolarHBondContact O-N 3.21Å
975	L	40.3	Very low	43.6	Very low	164 Å²	164	159 Å²	159	86%	0.859	79%	0.794	S	S	*	*			trans	65.9	0	169.9	-54	172	0	0	0	113.2	L310 D311	L310-L975 HydrophobicContact CB-CD2 4.42Å; L310-L975 CarbonylContact O-C 3.18Å; L310-L975 WeakPolarHBondContact O-CA 3Å; L310-L975 VanDerWaalsContact O-CB 3.28Å; L310-L975 WeakPolarHBondContact O-CB 3.48Å; L310-L975 WeakPolarHBondContact O-CD2 3.46Å; D311-L975 HydrophobicContact CB-CB 4.1Å; D311-L975 HydrophobicContact CB-CD2 4.21Å

Retrieved 975 of 975 residues in 550.4 ms (Link to these results)

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