A0A3Q0KL47_SCHMA Loading...

KH domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KL47, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,081 aa.

						>A0A3Q0KL47_SCHMA|A0A3Q0KL47
MSANFMYSNTALSSLIPHQQQQHIVTQRSRSASTSNAGPNVHTQYQVALSQPYQNLGPMDGSWTQTQGMYVNGLNKMINVFPGQSMTDMEQTPISQSSESYKYAPNIKLNELNSRSCTHSFQPSNGNTGGNHGSITLGAQQVHFAVAATPNGLVQPHTGLQNPSTSIRSEQTGVLHPNAQHPSGSLGQPFLIPGIVGQPTIRTLTQDNLSPAYRESGSTQPLLTSGSKQVNNLNNTNTARDLHPRILDVNVSMNQSAYVPSVPVQQHPVVSHHQLYTSPTLQPPSLHGMVEYVQAVYPTNPNVHVPYTQQSAALFGHYPAQMNTGFDSTMNTNFNSRIRHNTWAGLEDNMSSAINHDSSARKIKNEKVLVPNDFPSTVNDYNLNSHGSFTQYTATPYFSGFNQSSFYQTDGQKPDISKLPGSVTFHHGETQKHPCSYQNPASLQFNSSSAMTNKVDFPSNDVSYMTSVPVGQLPSRSNYQVHNNSYLSSVPSCIPVQSNNNYIGSNNNHTVSSHAYVFNSDNSKTLQQSAYPIKDNYPRTSHKPREWNKSKDAIHYKPLSSSHHSRLNNTKSRNVIKNFSSDKQASFNDRKPTSSSINDRLTQTEKNTNSFTVQTTSSFLSSGSQGFISSLSTANQDFNPNHQLNTKPTHFDYPQAYTNVHGTVNQANKQCVGGPPKHLQNYQSSLANNNLLSSYVQGLPENLIASLKLSGFRLVLDSCPTRLLLSTSLVGSIIGRGGRTIRQITTKTGAKIGMKQDIITFSQFSLPGKGKKTFKSSDSNGINHIASTNHFRGEEEEGEKEETCQPPDSKDTFTNVNDNTKVDQPSETCPNTNTESILTNKSQSNLEVQSDESQLAILFGSREQCSAALCEILTICFRESKHRGFSDPCLGLLVEQHIYAQLIMNKGKKYFNAIHTATGARISVTGTPLQIRPSSDVEQCNLAPTDRVLVVRGQLHSICAAEAFLSEQIRWATIESSIPSNFWPLLNHLPPLPMNNNNNNNRSSKSSNLSFSYDPQSVCSLIMSLGSIFWPQSVCAKLGKNTNFQYYNKRSLIRSMTTQKIDNTPSKNISGNIENDNNVDNENDPNKQDQDKNINDDDDDDDHSDNLKTINDSDEKNGIDLETKDPIDNTLNHSSMNIELSVDGGDDEEEEAEDQDQEEIHSKTIGSIVSSDYEQDKNESTVVLEMSDENKETELHLPSNNCIDSEIQKSDKLDQLKPDQCAFERLTRSTNPKETNPTMVTAVQQSLIAAVGPIAWLATGGMLYMRVSYNEAGSLIGSEGSRIQQLMQATGAEIHVGKVPISPPYALNPTPKRTDSNNNNNNNNNNNNNNNNNNVQSNEKSPTCISLVDSFFNDDTVTAINCDSSSNVNNKIDQSLSKINNDNINDNTTDNNHIDTNQSINIINDQLSSMDINETNDNDDGDDDDDDDEEEVEGDSTKQQPNELINNGINEETICTNKISLVDNECTQMISSMNNDTHINEIAADQTSDMLSNCYNHHLVKSSSIHSDCTVVEKMPDHQISESVEQKTSNTTTTTTVTSTSNQSYRLVCLSGSVQSQIMAQWQIFQRLKNLHKRQMTTGSSSNDNSSQKLFCLATLICLPYRFLWWLTTHNPGFIETSRSSSVLTSTVFSKFFDSGNTNNNNKSGTSPLNWIQSLASRRLNANLSSNDAVKKFIHVLPEPRRRKRLVQQQLKRINATLRGQQQQLNYTGGNCLSKSLILPPRGLTNDGLDQLWAHPNRIPLEIYADFETTQLILTNLHHMLALWLYGQSLAGTSVQSFIQAPIVYVLPNGRPTNISTSDSANGRPYSKSNRHNTDQPDYWTLMPGRQDAFLNSLRQPFHIPLFPGGIPNFGSSTAGAPNYSTPMLPDRSNCTNLAQPFFYPRYPLINWHGIANSKYSGQTMTSDPTTTRPVRIGPPTLYGCWPRGRFSDTIDDKHNIEIDQSCSQSTRFPSAGPGYTFIANLPFPPPVRPPTSLNHVHTSTHSQVVPGSGYRGSSISSHPNKFRFRNPCNTGNHSVEPFILNSMPLLDTPNQINHHSNFIHNSKQTIHSTVNGDKNQGVRTKQNSQESRRNKEDLVVGGDS
					

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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	30.9	Very low	29.1	Very low	148 Å²	148	129.9 Å²	129.9	73%	0.729	73%	0.725	S	S	*	*				0	96.9	0	-60.5	132.3	173	0	0	107.2	L112	M1-L112 HydrophobicContact CE-CB 4.23Å; M1-L112 HydrophobicContact CE-CD1 4.07Å; M1-L112 HydrophobicContact CE-CD2 4.45Å; M1-L112 HydrophobicContact CE-CG 4.49Å
2	S	28.1	Very low	29.3	Very low	80 Å²	80	133.1 Å²	133.1	56%	0.559	74%	0.738	S	S	*	*				63.9	121.4	79.7	59.3	0	0	0	0	112.9
3	A	31.9	Very low	29.3	Very low	94 Å²	94	132.4 Å²	132.4	78%	0.777	75%	0.748	S	S	*	*			cis	-147.4	144.5	-17.9	0	0	0	0	0	107.6
4	N	27.5	Very low	29.3	Very low	149 Å²	149	130.1 Å²	130.1	80%	0.797	75%	0.745	S	S	*	*			cis	66.9	85.1	49.9	-84.3	7.6	0	0	0	115.9
5	F	32	Very low	29.3	Very low	189 Å²	189	131.5 Å²	131.5	83%	0.829	75%	0.748	S	S	*	*				178	129.2	117.7	-103.4	-83.3	0	0	0	106.7
6	M	27.3	Very low	29.4	Very low	126 Å²	126	132.9 Å²	132.9	62%	0.621	75%	0.75	S	S	*	*			cis	59.3	119.7	49.8	-64.1	-87	-88.4	0	0	110.7
7	Y	31.1	Very low	29.8	Very low	189 Å²	189	130.8 Å²	130.8	74%	0.741	74%	0.743	S	S	*	*			cis	-132	162	16.5	-90.8	-107.5	0	0	0	109.8
8	S	28.3	Very low	29.8	Very low	86 Å²	86	133.1 Å²	133.1	60%	0.601	75%	0.747	S	S	*	*			cis	77.5	82.7	31.9	-58.4	0	0	0	0	116.4
9	N	25.1	Very low	29.9	Very low	153 Å²	153	133.7 Å²	133.7	82%	0.818	74%	0.743	S	S	*	*				62.3	159.2	126.4	-88.8	-32.8	0	0	0	123.2
10	T	29.1	Very low	29.9	Very low	127 Å²	127	134.5 Å²	134.5	78%	0.779	74%	0.741	S	S	*	*			trans	55.2	109.2	165	47.4	0	0	0	0	116.8
11	A	29.3	Very low	29.8	Very low	88 Å²	88	135.5 Å²	135.5	73%	0.727	74%	0.74	S	S	*	*			cis	76.9	116.1	24.1	0	0	0	0	0	117.1
12	L	30.6	Very low	29.7	Very low	168 Å²	168	136.7 Å²	136.7	88%	0.88	74%	0.744	S	S	*	*			trans	61.2	133.2	150	-62.1	170.3	0	0	0	121.7
13	S	30.3	Very low	29.7	Very low	124 Å²	124	141 Å²	141	87%	0.867	76%	0.755	S	S	*	*				-166.5	155.3	124.8	-85.6	0	0	0	0	109.7
14	S	28.8	Very low	29.6	Very low	101 Å²	101	143.2 Å²	143.2	71%	0.706	75%	0.752	S	S	*	*	S	Bend	cis	-142.7	165.2	19.6	60.8	0	0	0	0	111.1
15	L	29.6	Very low	29.7	Very low	150 Å²	150	142.9 Å²	142.9	79%	0.785	76%	0.755	S	S	*	*	S	Bend	cis	-132.3	172	-5	-43.3	69.3	0	0	0	106.9
16	I	31.1	Very low	29.6	Very low	154 Å²	154	139.7 Å²	139.7	79%	0.79	75%	0.751	S	S	*	*			cis	-151.9	160.6	-6.6	-138.6	164.1	0	0	0	107.3
17	P	34.9	Very low	29.7	Very low	97 Å²	97	141.5 Å²	141.5	63%	0.63	76%	0.758	S	S	*	*			trans	-119.3	159.9	-159.3	41.1	-31.3	0	0	0	118.2
18	H	30.9	Very low	29.5	Very low	173 Å²	173	142.5 Å²	142.5	80%	0.801	76%	0.76	S	S	*	*			trans	62.1	156.2	150.5	-77	-48.7	0	0	0	119.5
19	Q	30.5	Very low	29.5	Very low	144 Å²	144	143.1 Å²	143.1	67%	0.673	77%	0.765	S	S	*	*			cis	-141.3	-174.4	1.8	-122.3	172.1	50.9	0	0	107.5
20	Q	30.3	Very low	29.6	Very low	150 Å²	150	146.4 Å²	146.4	70%	0.701	77%	0.766	S	S	*	*			cis	-133.1	-111.6	12.9	-151.7	170.3	63.7	0	0	115.4
21	Q	27.3	Very low	29.4	Very low	155 Å²	155	145.2 Å²	145.2	72%	0.724	76%	0.763	S	S	*	*			trans	-163.8	170.4	-144	-166.1	174.1	16.7	0	0	114.5
22	Q	30.4	Very low	29.3	Very low	173 Å²	173	145.7 Å²	145.7	81%	0.808	77%	0.767	S	S	*	*			trans	78.5	157.9	169.5	-49.3	-173.8	18.7	0	0	117.8
23	H	26.5	Very low	29.1	Very low	172 Å²	172	141.9 Å²	141.9	80%	0.796	75%	0.754	S	S	*	*				-167.8	173.1	-51.8	-153.3	-110.9	0	0	0	107.9
24	I	30.2	Very low	29	Very low	139 Å²	139	142.4 Å²	142.4	71%	0.713	75%	0.752	S	S	*	*			trans	73	131.4	167	-56.3	173.2	0	0	0	116.8
25	V	29.7	Very low	29	Very low	142 Å²	142	142 Å²	142	86%	0.861	75%	0.749	S	S	*	*			trans	-98.9	128.6	169	170.4	0	0	0	0	109
26	T	31.3	Very low	29.1	Very low	123 Å²	123	142.4 Å²	142.4	76%	0.755	75%	0.752	S	S	*	*			trans	-142.4	149.3	155	-13.2	0	0	0	0	113.5
27	Q	29.2	Very low	29.3	Very low	163 Å²	163	139.7 Å²	139.7	76%	0.762	75%	0.753	S	S	*	*			trans	-49.4	167.6	169.3	-66.9	-171.3	47.2	0	0	114.7
28	R	25.5	Very low	29.1	Very low	210 Å²	210	138.3 Å²	138.3	79%	0.792	76%	0.756	S	S	*	*			cis	177.7	160.9	-19.4	-178.1	-176.3	-168.5	-167.4	5.1	105.6
29	S	29.3	Very low	29.9	Very low	99 Å²	99	136 Å²	136	69%	0.692	76%	0.756	S	S	*	*			trans	70.5	151.5	169.9	-60.6	0	0	0	0	115.5
30	R	26.2	Very low	29.9	Very low	223 Å²	223	135.3 Å²	135.3	84%	0.842	76%	0.757	S	S	*	*			cis	149.4	157.2	-19.7	-106.4	-174.8	169.6	-156.8	0.8	106
31	S	25.3	Very low	30.1	Very low	102 Å²	102	133.6 Å²	133.6	71%	0.713	76%	0.757	S	S	*	*			trans	72.5	116.9	164.5	-1	0	0	0	0	114.6
32	A	26.5	Very low	30.4	Very low	98 Å²	98	133.6 Å²	133.6	81%	0.81	76%	0.757	S	S	*	*				87.4	-176.9	65.8	0	0	0	0	0	110.4
33	S	26.5	Very low	30.4	Very low	87 Å²	87	130.3 Å²	130.3	61%	0.608	75%	0.749	S	S	*	*			cis	-165.1	173.2	22.4	-32.2	0	0	0	0	113
34	T	29.7	Very low	30.6	Very low	136 Å²	136	130.4 Å²	130.4	83%	0.834	75%	0.749	S	S	*	*			trans	62.1	178	148.1	54.5	0	0	0	0	116.6
35	S	29.2	Very low	30.6	Very low	92 Å²	92	134.7 Å²	134.7	64%	0.643	76%	0.758	S	S	*	*			cis	-141.2	-177.4	7.8	-39.9	0	0	0	0	109.4
36	N	31.6	Very low	30.4	Very low	159 Å²	159	136.1 Å²	136.1	85%	0.85	76%	0.755	S	S	*	*			cis	-168.2	174.9	25.7	-120.3	-16.6	0	0	0	107
37	A	33.8	Very low	30.4	Very low	96 Å²	96	137.1 Å²	137.1	79%	0.793	76%	0.761	S	S	*	*			cis	-149.8	-178.5	-2.9	0	0	0	0	0	107.2
38	G	31.9	Very low	30.3	Very low	68 Å²	68	132.9 Å²	132.9	70%	0.701	75%	0.754	S	S	*	*			cis	-171.5	-163.4	19.8	0	0	0	0	0	114.7
39	P	46.2	Very low	30.5	Very low	125 Å²	125	130.8 Å²	130.8	81%	0.812	76%	0.758	S	S	*	*			trans	-114.8	-168.6	-133.7	44.5	-36.6	0	0	0	114.8
40	N	32.1	Very low	30.6	Very low	129 Å²	129	131.7 Å²	131.7	69%	0.69	76%	0.764	S	S	*	*			cis	-141.8	-141	13.9	-152.4	-2.4	0	0	0	110.5
41	V	34.6	Very low	30.8	Very low	115 Å²	115	130 Å²	130	70%	0.697	77%	0.765	S	S	*	*			cis	-155.7	132.9	10.5	-145.7	0	0	0	0	110.7
42	H	32.1	Very low	31.4	Very low	155 Å²	155	129.5 Å²	129.5	72%	0.718	76%	0.76	S	S	*	*			trans	52	151.7	146.3	-77.2	41	0	0	0	121.6
43	T	31.5	Very low	31.6	Very low	104 Å²	104	135.1 Å²	135.1	64%	0.638	76%	0.762	S	S	*	*			cis	-161	149.7	-11	13.7	0	0	0	0	112.8
44	Q	30.8	Very low	31.8	Very low	173 Å²	173	138.1 Å²	138.1	81%	0.808	77%	0.766	S	S	*	*			trans	26.5	133.7	147.6	-67.2	179.2	-52.7	0	0	123.4
45	Y	28.8	Very low	31.7	Very low	230 Å²	230	138.1 Å²	138.1	90%	0.902	76%	0.761	S	S	*	*				-155.8	163	101.8	-120.8	-84.5	0	0	0	112
46	Q	26.2	Very low	31.8	Very low	172 Å²	172	142.5 Å²	142.5	80%	0.804	78%	0.776	S	S	*	*			trans	-154.1	134	-169.8	-179.1	-173.2	22.5	0	0	112.1
47	V	31	Very low	31.7	Very low	143 Å²	143	138.1 Å²	138.1	87%	0.867	77%	0.769	S	S	*	*			trans	-144.4	155.6	164.7	-174.8	0	0	0	0	108.7
48	A	28.7	Very low	32.2	Very low	75 Å²	75	139.9 Å²	139.9	62%	0.62	77%	0.772	S	S	*	*			trans	-149.7	-174.8	-168.6	0	0	0	0	0	114
49	L	29.1	Very low	32.1	Very low	166 Å²	166	145.6 Å²	145.6	87%	0.869	78%	0.783	S	S	*	*			trans	79.9	113.6	163.1	-58	157.9	0	0	0	118.6
50	S	31.4	Very low	31.1	Very low	118 Å²	118	147.6 Å²	147.6	83%	0.825	79%	0.787	S	S	*	*				167.8	155.8	93.7	50.2	0	0	0	0	115.2
51	Q	30.7	Very low	31.1	Very low	186 Å²	186	145.3 Å²	145.3	87%	0.869	79%	0.794	S	S	*	*			trans	-133.7	179.5	159.9	-77.6	-163.4	1	0	0	105.8
52	P	36.9	Very low	30.6	Very low	93 Å²	93	144.8 Å²	144.8	60%	0.604	80%	0.795	S	S	*	*			cis	-137.5	-164.8	6.7	44.1	-25.6	0	0	0	114.2
53	Y	31	Very low	30.3	Very low	215 Å²	215	148.2 Å²	148.2	84%	0.843	80%	0.802	S	S	*	*				-170	-176.8	120.1	-108.2	-72.1	0	0	0	112.2
54	Q	30	Very low	30.2	Very low	151 Å²	151	148.5 Å²	148.5	71%	0.706	80%	0.804	S	S	*	*			trans	-134.1	167.5	-152.5	-57.9	179.7	-30.9	0	0	116.7
55	N	28.3	Very low	30	Very low	136 Å²	136	147.8 Å²	147.8	73%	0.727	80%	0.8	S	S	*	*			trans	73.6	123.2	148.4	-67.3	-35.2	0	0	0	121.2
56	L	31.3	Very low	30	Very low	183 Å²	183	141.6 Å²	141.6	96%	0.958	79%	0.787	S	S	*	*				-161.2	171.1	99.4	-100.9	167.1	0	0	0	111.7
57	G	30.3	Very low	30	Very low	68 Å²	68	141.1 Å²	141.1	70%	0.701	78%	0.784	S	S	*	*			trans	-109.5	-174.1	-163	0	0	0	0	0	117.8
58	P	42.9	Very low	29.9	Very low	133 Å²	133	137.9 Å²	137.9	86%	0.864	78%	0.78	S	S	*	*			trans	-109.7	171.3	-161.4	41.4	-36.1	0	0	0	116
59	M	29.8	Very low	29.7	Very low	188 Å²	188	140.8 Å²	140.8	93%	0.926	78%	0.782	S	S	*	*			trans	-157.9	164.4	151.6	-128.9	-179.1	-178.8	0	0	113.7
60	D	26.9	Very low	29.6	Very low	167 Å²	167	141.2 Å²	141.2	89%	0.893	77%	0.773	S	S	*	*			trans	-86.1	162.6	-170.5	-57.9	-82	0	0	0	115.9
61	G	30.4	Very low	29.4	Very low	81 Å²	81	141.8 Å²	141.8	84%	0.835	77%	0.772	S	S	*	*			trans	177.3	116.1	164.9	0	0	0	0	0	114.2
62	S	24.8	Very low	29.3	Very low	103 Å²	103	140.3 Å²	140.3	72%	0.72	77%	0.769	S	S	*	*			trans	-107.4	154.5	171.2	57.7	0	0	0	0	111.3
63	W	26.4	Very low	28.9	Very low	228 Å²	228	139.3 Å²	139.3	86%	0.864	78%	0.776	S	S	*	*			trans	164.4	97.6	142.1	-88.8	108.2	0	0	0	112.1
64	T	28.4	Very low	28.6	Very low	109 Å²	109	137 Å²	137	67%	0.669	78%	0.778	S	S	*	*			trans	47.6	128.9	137.9	63.5	0	0	0	0	124.4
65	Q	27.8	Very low	28.4	Very low	158 Å²	158	135.4 Å²	135.4	74%	0.738	77%	0.774	S	S	*	*				106.6	122.9	123.1	-122.7	-177	6.3	0	0	122.9
66	T	27.8	Very low	28.3	Very low	101 Å²	101	137.7 Å²	137.7	62%	0.62	78%	0.777	S	S	*	*				122.6	92.5	129.2	-47.6	0	0	0	0	119.6
67	Q	26.5	Very low	28	Very low	162 Å²	162	136.7 Å²	136.7	76%	0.757	77%	0.77	S	S	*	*			trans	53.4	137.9	134	-58.2	-179	-81.9	0	0	124.2
68	G	28.8	Very low	27.9	Very low	74 Å²	74	139.9 Å²	139.9	76%	0.763	77%	0.769	S	S	*	*			trans	146	122.7	156.4	0	0	0	0	0	114.1
69	M	25.4	Very low	27	Very low	136 Å²	136	141.2 Å²	141.2	67%	0.67	77%	0.769	S	S	*	*			cis	174.7	115.8	-41.1	-95.8	-75.4	-71.2	0	0	106.6
70	Y	25.3	Very low	26.9	Very low	176 Å²	176	138.6 Å²	138.6	69%	0.69	76%	0.763	S	S	*	*			trans	67.9	165.1	158.6	-75.8	-125.5	0	0	0	117.8
71	V	28.8	Very low	27	Very low	130 Å²	130	140 Å²	140	79%	0.788	76%	0.762	S	S	*	*			cis	-134.3	163.7	11.4	-167.4	0	0	0	0	112
72	N	27.5	Very low	27	Very low	154 Å²	154	142.2 Å²	142.2	82%	0.824	76%	0.761	S	S	*	*			trans	-68.6	166.7	173.2	-52	-52.9	0	0	0	115.3
73	G	27.7	Very low	27.2	Very low	72 Å²	72	140.8 Å²	140.8	74%	0.742	76%	0.764	S	S	*	*			trans	-174.5	51.8	171.4	0	0	0	0	0	122.5
74	L	25.9	Very low	27.5	Very low	168 Å²	168	139.7 Å²	139.7	88%	0.88	77%	0.768	S	S	*	*			trans	59.1	157.7	152	-77.5	166.9	0	0	0	124
75	N	26.2	Very low	27.4	Very low	116 Å²	116	139.7 Å²	139.7	62%	0.62	77%	0.772	S	S	*	*			trans	77.8	114.1	153.6	-87.8	-42.7	0	0	0	123.9
76	K	26.2	Very low	27.5	Very low	185 Å²	185	140.7 Å²	140.7	80%	0.804	78%	0.779	S	S	*	*			trans	73	150	137.9	-72.9	175.8	-177.9	170.3	0	122.4
77	M	24.5	Very low	27.7	Very low	162 Å²	162	140.7 Å²	140.7	80%	0.798	78%	0.779	S	S	*	*			trans	77.1	114.6	155.7	-79	-175.8	165	0	0	122.4
78	I	27.7	Very low	27.8	Very low	134 Å²	134	139.7 Å²	139.7	69%	0.687	78%	0.779	S	S	*	*				73.2	132	124.8	-64.8	170.1	0	0	0	120	V80	I78-V80 HydrophobicContact CG2-CG2 4.39Å
79	N	24.3	Very low	28	Very low	162 Å²	162	143.5 Å²	143.5	87%	0.866	78%	0.779	S	S	*	*			trans	-66.5	121.1	165.9	-61.4	-25.7	0	0	0	112
80	V	27.5	Very low	28.2	Very low	132 Å²	132	144.2 Å²	144.2	80%	0.8	78%	0.781	S	S	*	*			trans	-139.5	154.9	148.3	-174.2	0	0	0	0	109.4	I78	I78-V80 HydrophobicContact CG2-CG2 4.39Å
81	F	28.4	Very low	28.5	Very low	196 Å²	196	143.5 Å²	143.5	86%	0.86	78%	0.783	S	S	*	*			trans	-66.2	156.2	-176	-76.8	-110.3	0	0	0	114.5
82	P	31.2	Very low	28.4	Very low	128 Å²	128	143.4 Å²	143.4	83%	0.831	78%	0.783	S	S	*	*			trans	-89	143.2	173.1	35.1	-33.8	0	0	0	113.8
83	G	29.7	Very low	28.7	Very low	74 Å²	74	140.9 Å²	140.9	76%	0.763	78%	0.775	S	S	*	*			trans	128.5	134.8	173.1	0	0	0	0	0	111.9
84	Q	32.8	Very low	28.7	Very low	205 Å²	205	144.8 Å²	144.8	96%	0.958	78%	0.777	S	S	*	*			cis	-133.9	-177	6.2	-61.7	-174	3.7	0	0	111.7
85	S	24.6	Very low	28.9	Very low	108 Å²	108	142.1 Å²	142.1	76%	0.755	77%	0.773	S	S	*	*			trans	-103	141.1	-172.5	54.2	0	0	0	0	114.4
86	M	30.1	Very low	28.9	Very low	179 Å²	179	144.3 Å²	144.3	88%	0.882	78%	0.779	S	S	*	*			trans	169.8	151.2	150.2	-100.4	179.6	-170.8	0	0	108.5
87	T	32.1	Very low	29.1	Very low	101 Å²	101	138.1 Å²	138.1	62%	0.62	76%	0.759	S	S	*	*			cis	-167.9	134.7	-25.1	13.5	0	0	0	0	106.8
88	D	29.7	Very low	29.3	Very low	142 Å²	142	133.1 Å²	133.1	76%	0.759	74%	0.741	S	S	*	*			trans	59.5	166.7	164.9	-45	-40.9	0	0	0	115.7
89	M	31.7	Very low	29.4	Very low	153 Å²	153	134.5 Å²	134.5	75%	0.754	74%	0.744	S	S	*	*			cis	-152.8	156.1	10.2	-153.9	171.3	-61.9	0	0	109
90	E	30.7	Very low	29.7	Very low	152 Å²	152	130.5 Å²	130.5	71%	0.71	73%	0.729	S	S	*	*			trans	20.8	148.1	151.4	-62.7	-171.8	127.4	0	0	122.5
91	Q	31.6	Very low	29.8	Very low	160 Å²	160	134 Å²	134	75%	0.748	73%	0.729	S	S	*	*			cis	-161.5	176.8	2.6	-114	175.4	41.5	0	0	109.6
92	T	26.8	Very low	29.9	Very low	129 Å²	129	130.9 Å²	130.9	79%	0.791	72%	0.715	S	S	*	*			trans	-98.9	-169.7	175.8	59.5	0	0	0	0	110.9
93	P	33.5	Very low	30	Very low	101 Å²	101	134.4 Å²	134.4	66%	0.656	71%	0.713	S	S	*	*			cis	-146.6	173.3	-0.2	39.6	-17.2	0	0	0	119.3
94	I	27.9	Very low	30.3	Very low	153 Å²	153	133.8 Å²	133.8	79%	0.785	70%	0.701	S	S	*	*			trans	47.5	118.6	135.7	-62.8	165.8	0	0	0	120.1
95	S	28.8	Very low	30.3	Very low	112 Å²	112	130.2 Å²	130.2	78%	0.783	70%	0.696	S	S	*	*				157.8	-179.2	74.6	36.5	0	0	0	0	111.7
96	Q	28	Very low	30.6	Very low	162 Å²	162	131.4 Å²	131.4	76%	0.757	69%	0.694	S	S	*	*				-172.2	156.4	-57	-161.5	175.5	14.6	0	0	112.8
97	S	28.6	Very low	30.7	Very low	55 Å²	55	128.5 Å²	128.5	39%	0.385	68%	0.68	S	S	.	*			trans	62.9	157	155	35.5	0	0	0	0	119	I1482 A1483	S97-I1482 CarbonylContact O-C 3.58Å; S97-I1482 VanDerWaalsContact O-CA 3.3Å; S97-I1482 WeakPolarHBondContact O-CA 3.35Å; S97-A1483 VanDerWaalsContact C-N 3.27Å; S97-A1483 CarbonylContact C-O 3.54Å; S97-A1483 PolarHBondContact O-N 3.35Å
98	S	28.9	Very low	30.5	Very low	58 Å²	58	132 Å²	132	41%	0.406	69%	0.687	S	S	.	*			cis	-168.2	-164.2	-7.9	47.5	0	0	0	0	109.3	I1482 A1483	S98-I1482 WeakPolarHBondContact O-CG2 3.31Å; S98-A1483 CarbonylContact C-O 3.41Å; S98-A1483 WeakPolarHBondContact CA-O 3.4Å; S98-A1483 PolarHBondContact N-O 2.88Å; S98-A1483 VanDerWaalsContact O-O 3.12Å
99	E	30.9	Very low	30.4	Very low	163 Å²	163	131.4 Å²	131.4	76%	0.762	68%	0.683	S	S	*	*			trans	84	139.4	171.7	-58.9	-149.9	-159.3	0	0	119
100	S	30.4	Very low	30.3	Very low	78 Å²	78	130.2 Å²	130.2	55%	0.545	68%	0.68	S	S	.	*			cis	-165	138.8	-18.6	-82.4	0	0	0	0	106.7
101	Y	29.6	Very low	30	Very low	204 Å²	204	130.5 Å²	130.5	80%	0.8	68%	0.681	S	S	*	*				-177.6	147.7	61.6	-111.5	-64.2	0	0	0	112.8
102	K	30.5	Very low	30	Very low	132 Å²	132	129.4 Å²	129.4	57%	0.574	68%	0.68	S	S	*	*			trans	61.1	134.1	157.2	-56.2	-149.1	170.4	-163.5	0	119.3
103	Y	33.1	Very low	30	Very low	201 Å²	201	129.1 Å²	129.1	79%	0.788	67%	0.674	S	S	*	*			cis	-149.9	168.9	-13.6	-130.2	-89.8	0	0	0	110.6
104	A	35.6	Very low	29.7	Very low	61 Å²	61	127.8 Å²	127.8	50%	0.504	67%	0.666	S	S	.	*			trans	-102.3	176.6	-162.4	0	0	0	0	0	116.1
105	P	32.3	Very low	29.7	Very low	131 Å²	131	130 Å²	130	85%	0.851	67%	0.665	S	S	*	*				-121.9	153.3	112.3	36.1	-34.4	0	0	0	114.2
106	N	31.6	Very low	29.6	Very low	133 Å²	133	129.7 Å²	129.7	71%	0.711	66%	0.663	S	S	*	*			trans	-152.9	163.6	-171.1	-92.2	-34.4	0	0	0	111
107	I	32.1	Very low	29.5	Very low	117 Å²	117	128 Å²	128	60%	0.6	67%	0.668	S	S	*	*			cis	-173.3	139.4	-31.8	-153.4	175.9	0	0	0	109
108	K	28.4	Very low	29.4	Very low	176 Å²	176	130.6 Å²	130.6	77%	0.765	68%	0.681	S	S	*	*			trans	54.4	169.9	148.2	-79.6	172.8	-169.8	170.6	0	119.2
109	L	27.4	Very low	29.5	Very low	129 Å²	129	135.6 Å²	135.6	68%	0.675	70%	0.698	S	S	*	*			cis	-164.3	-171.6	4.7	-128.9	172.6	0	0	0	111.5
110	N	29.5	Very low	29.2	Very low	128 Å²	128	132.3 Å²	132.3	68%	0.684	69%	0.693	S	S	*	*			trans	75.7	116.6	161.7	-57.3	-18	0	0	0	116.7
111	E	25.7	Very low	29.1	Very low	157 Å²	157	138.9 Å²	138.9	73%	0.734	71%	0.712	S	S	*	*			cis	72.3	124.6	45.7	-63.2	-154.2	149.2	0	0	116.2
112	L	30.3	Very low	29	Very low	137 Å²	137	136.8 Å²	136.8	72%	0.717	71%	0.709	S	S	*	*			trans	-160.4	138.2	131.9	-116.1	173.2	0	0	0	111	M1	M1-L112 HydrophobicContact CE-CB 4.23Å; M1-L112 HydrophobicContact CE-CD1 4.07Å; M1-L112 HydrophobicContact CE-CD2 4.45Å; M1-L112 HydrophobicContact CE-CG 4.49Å
113	N	26.8	Very low	29.4	Very low	124 Å²	124	136.7 Å²	136.7	66%	0.663	72%	0.722	S	S	*	*			trans	-106.7	173.9	-174.7	-148.7	-23.8	0	0	0	112.1
114	S	27.5	Very low	29.2	Very low	72 Å²	72	131.3 Å²	131.3	50%	0.503	71%	0.714	S	S	.	*			trans	-60.5	150.8	-169.3	64.4	0	0	0	0	117.2
115	R	28.5	Very low	29	Very low	200 Å²	200	135.5 Å²	135.5	76%	0.755	73%	0.728	S	S	*	*			trans	-146.3	148.7	140	-109.2	-175.2	-171.7	-171.6	5.1	110.7
116	S	25.7	Very low	28.9	Very low	105 Å²	105	132.6 Å²	132.6	73%	0.734	72%	0.721	S	S	*	*			trans	-119.3	159	177.8	51.6	0	0	0	0	110.5
117	C	26.7	Very low	28.9	Very low	128 Å²	128	133.4 Å²	133.4	87%	0.865	73%	0.726	S	S	*	*				169.5	163.3	129.4	-91.1	0	0	0	0	111.6
118	T	26.2	Very low	29	Very low	109 Å²	109	134.5 Å²	134.5	67%	0.669	74%	0.738	S	S	*	*			trans	-107.6	149.2	-175.7	43.6	0	0	0	0	111.9
119	H	29.9	Very low	29.1	Very low	163 Å²	163	129.6 Å²	129.6	76%	0.755	74%	0.738	S	S	*	*				173.9	130.5	107.9	-96.2	-69	0	0	0	115.3
120	S	24.8	Very low	29.3	Very low	93 Å²	93	127 Å²	127	65%	0.65	74%	0.741	S	S	*	*			trans	35.2	122.1	132.2	-50.1	0	0	0	0	121.5
121	F	30.1	Very low	29.4	Very low	217 Å²	217	127 Å²	127	95%	0.952	74%	0.742	S	S	*	*				-159.4	159.6	115.3	-107.5	-70.6	0	0	0	111.5
122	Q	26.9	Very low	29.5	Very low	159 Å²	159	127.7 Å²	127.7	74%	0.743	75%	0.745	S	S	*	*			trans	-144.3	149.9	-167.2	179.4	-173.6	-0.3	0	0	110.7
123	P	38.1	Very low	29.5	Very low	130 Å²	130	124.8 Å²	124.8	84%	0.844	75%	0.747	S	S	*	*			trans	-132.7	-179.5	138.6	26.3	-7.2	0	0	0	113.5
124	S	29.6	Very low	29.5	Very low	88 Å²	88	123.9 Å²	123.9	62%	0.615	75%	0.751	S	S	*	*			trans	-150.8	177.7	-157.8	173.6	0	0	0	0	113.1
125	N	30.4	Very low	29.4	Very low	150 Å²	150	127.8 Å²	127.8	80%	0.802	77%	0.765	S	S	*	*			trans	105	145.1	160.6	-50.6	-14.8	0	0	0	115
126	G	31.7	Very low	29.4	Very low	69 Å²	69	123.9 Å²	123.9	71%	0.711	76%	0.763	S	S	*	*			cis	-171.4	-172.8	-0	0	0	0	0	0	108.9
127	N	31.2	Very low	29.4	Very low	150 Å²	150	127.2 Å²	127.2	80%	0.802	77%	0.772	S	S	*	*			cis	-148.5	172.8	-5.4	-77.8	-26.8	0	0	0	106.1
128	T	32.9	Very low	29.7	Very low	141 Å²	141	124.9 Å²	124.9	87%	0.865	77%	0.77	S	S	*	*			cis	-157.2	157.6	26.3	-48.1	0	0	0	0	106.9
129	G	30.8	Very low	29.8	Very low	73 Å²	73	124 Å²	124	75%	0.753	77%	0.773	S	S	*	*			cis	-174.3	-150.9	3	0	0	0	0	0	107.7
130	G	32.7	Very low	29.9	Very low	73 Å²	73	124.5 Å²	124.5	75%	0.753	78%	0.776	S	S	*	*			cis	133.7	121.2	-6.4	0	0	0	0	0	113.1
131	N	30.2	Very low	30.1	Very low	129 Å²	129	128.4 Å²	128.4	69%	0.69	78%	0.784	S	S	*	*			cis	-164.3	152.3	-15.7	-137	-2.7	0	0	0	112.7
132	H	28.7	Very low	30.1	Very low	172 Å²	172	124.1 Å²	124.1	80%	0.796	78%	0.775	S	S	*	*			trans	39.9	139.3	158.8	-50.1	-48.2	0	0	0	124
133	G	30	Very low	30	Very low	75 Å²	75	124 Å²	124	77%	0.773	77%	0.774	S	S	*	*			trans	143.8	110.5	132.7	0	0	0	0	0	122.3
134	S	27.4	Very low	29.6	Very low	105 Å²	105	127 Å²	127	73%	0.734	77%	0.774	S	S	*	*			trans	64.8	105.6	130.5	-174.2	0	0	0	0	124.9
135	I	25	Very low	29.4	Very low	155 Å²	155	127 Å²	127	80%	0.795	78%	0.78	S	S	*	*			trans	58.4	129.5	135.4	-41.2	166.5	0	0	0	120.8
136	T	27.5	Very low	29.1	Very low	118 Å²	118	126.4 Å²	126.4	72%	0.724	78%	0.781	S	S	*	*				153.2	114.4	125.1	-60.4	0	0	0	0	116.8
137	L	27.4	Very low	28.8	Very low	174 Å²	174	127.6 Å²	127.6	91%	0.911	78%	0.784	S	S	*	*			trans	51.9	126.7	150.3	-63	169.6	0	0	0	126.1
138	G	31	Very low	28.6	Very low	80 Å²	80	125.1 Å²	125.1	83%	0.825	78%	0.784	S	S	*	*			trans	98.1	153.8	140.7	0	0	0	0	0	119
139	A	29	Very low	28.4	Very low	89 Å²	89	124.7 Å²	124.7	74%	0.736	78%	0.782	S	S	*	*			cis	-168.3	161	-21.3	0	0	0	0	0	111.6
140	Q	32.1	Very low	28.7	Very low	175 Å²	175	126.3 Å²	126.3	82%	0.818	78%	0.779	S	S	*	*			trans	67.9	132	169.4	-71.6	165.1	-31.4	0	0	117.3
141	Q	29.2	Very low	28.4	Very low	175 Å²	175	130.6 Å²	130.6	82%	0.818	78%	0.784	S	S	*	*				70.5	140.5	68.4	-67.3	-175.9	-21.6	0	0	113.4
142	V	30.7	Very low	28.3	Very low	126 Å²	126	127.9 Å²	127.9	76%	0.764	79%	0.787	S	S	*	*			cis	-147	170.5	41.5	176	0	0	0	0	113.1
143	H	25.1	Very low	28.2	Very low	158 Å²	158	127.9 Å²	127.9	73%	0.731	79%	0.792	S	S	*	*			trans	-67.1	165.1	175	-66.2	-161.3	0	0	0	115.8
144	F	28.3	Very low	28.3	Very low	193 Å²	193	130.6 Å²	130.6	85%	0.846	79%	0.793	S	S	*	*				-179.8	177.4	102.1	-97.9	-69	0	0	0	113.6
145	A	25.2	Very low	28.4	Very low	88 Å²	88	133.8 Å²	133.8	73%	0.727	80%	0.797	S	S	*	*			trans	-156	-179.1	-163.1	0	0	0	0	0	114.4
146	V	25.7	Very low	28.9	Very low	137 Å²	137	131.3 Å²	131.3	83%	0.83	79%	0.791	S	S	*	*			trans	89.3	100.4	163.6	-171.2	0	0	0	0	118.7
147	A	24.9	Very low	28.9	Very low	93 Å²	93	133.8 Å²	133.8	77%	0.769	79%	0.794	S	S	*	*				43	145.1	129.7	0	0	0	0	0	125.1
148	A	26.3	Very low	29.1	Very low	98 Å²	98	132.7 Å²	132.7	81%	0.81	80%	0.795	S	S	*	*			trans	91.3	124.4	144.7	0	0	0	0	0	121.2
149	T	28.9	Very low	29.1	Very low	133 Å²	133	132.2 Å²	132.2	82%	0.816	79%	0.789	S	S	*	*			trans	-53	172.1	165	50.4	0	0	0	0	116.3
150	P	37.2	Very low	29.1	Very low	107 Å²	107	136 Å²	136	70%	0.695	80%	0.797	S	S	*	*			cis	-136.3	-174.3	1.7	32.6	-10.1	0	0	0	116.1
151	N	27.6	Very low	29	Very low	162 Å²	162	136.7 Å²	136.7	87%	0.866	80%	0.799	S	S	*	*			trans	60.8	118.6	151.7	-68.4	-7	0	0	0	122
152	G	27.9	Very low	29	Very low	72 Å²	72	135.5 Å²	135.5	74%	0.742	80%	0.799	S	S	*	*				111.1	105.2	126.2	0	0	0	0	0	119.7
153	L	26.2	Very low	29.5	Very low	172 Å²	172	134.5 Å²	134.5	90%	0.901	80%	0.795	S	S	*	*			trans	47.4	121.8	142.7	-76.6	157.6	0	0	0	120.8
154	V	31	Very low	29.7	Very low	132 Å²	132	132 Å²	132	80%	0.8	80%	0.796	S	S	*	*				178.4	158.3	102.4	156.5	0	0	0	0	111.2
155	Q	29.9	Very low	29.9	Very low	173 Å²	173	129.3 Å²	129.3	81%	0.808	80%	0.795	S	S	*	*			trans	-51.3	165	-172.8	-66.2	160.2	-21	0	0	119.5
156	P	35.1	Very low	29.9	Very low	103 Å²	103	130.4 Å²	130.4	67%	0.669	80%	0.797	S	S	*	*			trans	-89.9	125.5	-177.2	34.2	-35.1	0	0	0	117.1
157	H	29	Very low	30	Very low	169 Å²	169	131.6 Å²	131.6	78%	0.782	80%	0.797	S	S	*	*			trans	38.8	135.7	134.1	-26.1	-57.1	0	0	0	123.3
158	T	30.9	Very low	30.1	Very low	152 Å²	152	137.6 Å²	137.6	93%	0.933	80%	0.8	S	S	*	*				-170.1	149.1	124.2	12.8	0	0	0	0	113.5
159	G	31.6	Very low	30.2	Very low	69 Å²	69	137.1 Å²	137.1	71%	0.711	79%	0.791	S	S	*	*			trans	85.2	109.3	172.5	0	0	0	0	0	115.5
160	L	28.1	Very low	30.2	Very low	170 Å²	170	137.6 Å²	137.6	89%	0.89	78%	0.784	S	S	*	*			cis	98.1	143.8	31.8	-75.2	168.3	0	0	0	115.7
161	Q	31.1	Very low	29.6	Very low	188 Å²	188	140.8 Å²	140.8	88%	0.879	79%	0.789	S	S	*	*			trans	76	109.7	-172.1	-51.1	-177.2	12.8	0	0	114.2
162	N	29.3	Very low	29.8	Very low	151 Å²	151	139.7 Å²	139.7	81%	0.807	79%	0.789	S	S	*	*			cis	87.9	151.6	8	-127.9	28.1	0	0	0	116.3
163	P	39.8	Very low	29.9	Very low	104 Å²	104	139.4 Å²	139.4	68%	0.675	79%	0.786	S	S	*	*				-140.5	167.2	-80.6	42.5	-27.5	0	0	0	117.2
164	S	30	Very low	30.1	Very low	107 Å²	107	137.6 Å²	137.6	75%	0.748	78%	0.782	S	S	*	*			trans	-171.1	110.1	160.3	53	0	0	0	0	111.7
165	T	31.4	Very low	30.2	Very low	136 Å²	136	138.4 Å²	138.4	83%	0.834	78%	0.78	S	S	*	*				81.8	87	74.4	59.6	0	0	0	0	118.3
166	S	26.4	Very low	30	Very low	111 Å²	111	138.7 Å²	138.7	78%	0.776	78%	0.782	S	S	*	*			trans	31.9	131.8	136.8	-161.1	0	0	0	0	122.8
167	I	27.3	Very low	30	Very low	162 Å²	162	138.5 Å²	138.5	83%	0.831	78%	0.78	S	S	*	*				168.9	147.8	125	-88.7	156.8	0	0	0	111.2
168	R	28	Very low	30.1	Very low	218 Å²	218	136 Å²	136	82%	0.823	77%	0.772	S	S	*	*			trans	113.9	154.6	155.1	-153.2	161.3	-179.6	148.1	1.7	118.8
169	S	26.7	Very low	30	Very low	88 Å²	88	130.2 Å²	130.2	62%	0.615	74%	0.74	S	S	*	*			trans	-59.5	-169.9	-173	-41.5	0	0	0	0	118.8
170	E	29.9	Very low	30	Very low	143 Å²	143	132 Å²	132	67%	0.668	73%	0.73	S	S	*	*			trans	78.9	125.5	164.8	-72.1	135.1	-114.4	0	0	113.7
171	Q	24.2	Very low	30.1	Very low	174 Å²	174	129.9 Å²	129.9	81%	0.813	72%	0.716	S	S	*	*				68.7	136.8	64.8	-70.8	-169.4	-14.3	0	0	112.6
172	T	32.6	Very low	30.4	Very low	140 Å²	140	124.8 Å²	124.8	86%	0.859	70%	0.698	S	S	*	*			trans	63.5	130.3	-162.7	74.1	0	0	0	0	112.3
173	G	28.9	Very low	30.6	Very low	66 Å²	66	123.2 Å²	123.2	68%	0.68	70%	0.699	S	S	*	*			cis	95.3	157.2	2.9	0	0	0	0	0	113
174	V	30.6	Very low	30	Very low	134 Å²	134	121.5 Å²	121.5	81%	0.812	70%	0.701	S	S	*	*			trans	67.9	88	175.2	-159.3	0	0	0	0	114.6
175	L	32.9	Very low	30.1	Very low	148 Å²	148	122.3 Å²	122.3	78%	0.775	71%	0.706	S	S	*	*				-177.8	96	109	-91.6	-179	0	0	0	112
176	H	27.2	Very low	30	Very low	180 Å²	180	124.5 Å²	124.5	83%	0.833	71%	0.712	S	S	*	*			trans	-72.5	140.9	136.6	-94.6	-124.7	0	0	0	107.3
177	P	33.5	Very low	30.1	Very low	98 Å²	98	122 Å²	122	64%	0.636	70%	0.703	S	S	*	*				-142.5	168.5	109.2	22.8	-2.1	0	0	0	112.3
178	N	32.4	Very low	30.9	Very low	116 Å²	116	121.7 Å²	121.7	62%	0.62	70%	0.699	S	S	*	*			cis	-158.1	171.7	-13.6	-101.4	-5.9	0	0	0	107.2	P263	N178-P263 CarbonylContact C-O 3.27Å; N178-P263 VanDerWaalsContact C-O 3.27Å; N178-P263 CarbonylContact O-C 3.48Å; N178-P263 VanDerWaalsContact O-CA 3.27Å; N178-P263 WeakPolarHBondContact O-CA 3.23Å
179	A	27.7	Very low	31.1	Very low	31 Å²	31	117 Å²	117	26%	0.256	70%	0.696	S	S	.	*			cis	119.5	36.9	-2.1	0	0	0	0	0	118.7	V262 P263	A179-V262 CarbonylContact C-O 3.06Å; A179-V262 VanDerWaalsContact C-O 3.23Å; A179-V262 VanDerWaalsContact CA-C 3.43Å; A179-V262 WeakPolarHBondContact CA-O 3.27Å; A179-V262 PolarHBondContact N-O 2.96Å; A179-P263 CarbonylContact C-O 3.49Å; A179-P263 PolarHBondContact N-O 2.82Å
180	Q	32.4	Very low	31.3	Very low	106 Å²	106	119.7 Å²	119.7	50%	0.495	70%	0.697	S	S	.	*			trans	-148	150.1	142.3	-90.8	124.2	91.9	0	0	110.3	V262 P263 V264	Q180-V262 CarbonylContact C-O 2.88Å; Q180-V262 VanDerWaalsContact CA-O 3.23Å; Q180-V262 WeakPolarHBondContact CA-O 3.17Å; Q180-V262 PolarHBondContact N-O 3.03Å; Q180-V262 CarbonylContact O-C 3.53Å; Q180-P263 PolarHBondContact N-O 2.83Å; Q180-P263 CarbonylContact O-C 3.23Å; Q180-P263 WeakPolarHBondContact O-CA 3.45Å; Q180-P263 WeakPolarHBondContact O-CD 3.3Å; Q180-P263 VanDerWaalsContact O-N 3.12Å; Q180-V264 HydrophobicContact CB-CB 3.86Å; Q180-V264 HydrophobicContact CB-CG1 4.12Å; Q180-V264 HydrophobicContact CB-CG2 3.87Å; Q180-V264 WeakPolarHBondContact O-CB 3.27Å; Q180-V264 VanDerWaalsContact O-CG2 3.27Å; Q180-V264 WeakPolarHBondContact O-CG2 3.42Å; Q180-V264 PolarHBondContact O-N 2.98Å
181	H	30.8	Very low	31.4	Very low	127 Å²	127	120.4 Å²	120.4	59%	0.588	71%	0.705	S	S	*	*			cis	71.6	68	9.7	-49.4	-58.9	0	0	0	117.5	V262	H181-V262 PolarHBondContact CD2-O 2.94Å; H181-V262 PolarHBondContact NE2-N 3.3Å; H181-V262 PolarHBondContact NE2-O 2.77Å
182	P	35.6	Very low	32	Very low	80 Å²	80	117.7 Å²	117.7	52%	0.519	70%	0.695	S	S	.	*			trans	-122.7	143.8	142.9	19.3	0.1	0	0	0	113.4	V264	P182-V264 HydrophobicContact CG-CG2 3.95Å
183	S	33.9	Very low	31.8	Very low	118 Å²	118	116.7 Å²	116.7	83%	0.825	69%	0.691	S	S	*	*			trans	35.7	121.9	143	-47.7	0	0	0	0	119.2
184	G	28.1	Very low	31.6	Very low	69 Å²	69	116.2 Å²	116.2	71%	0.711	69%	0.686	S	S	*	*			cis	82.8	99.7	21.8	0	0	0	0	0	111.8
185	S	31	Very low	31.7	Very low	123 Å²	123	118 Å²	118	86%	0.86	69%	0.689	S	S	*	*			trans	42	83.5	145.6	-176.9	0	0	0	0	118.9
186	L	30.4	Very low	31.9	Very low	182 Å²	182	116.8 Å²	116.8	95%	0.953	69%	0.687	S	S	*	*			trans	-147.7	147.8	131.5	-94.1	165.4	0	0	0	105.5
187	G	29	Very low	32.3	Very low	58 Å²	58	111.3 Å²	111.3	60%	0.598	68%	0.68	S	S	*	*			cis	145.5	125.8	10.5	0	0	0	0	0	106.6	P189	G187-P189 WeakPolarHBondContact O-CD 3.18Å
188	Q	42.6	Very low	32	Very low	157 Å²	157	114.3 Å²	114.3	73%	0.734	69%	0.685	S	S	*	*			trans	-68.9	140.3	-174.2	-64.6	179.5	-2.2	0	0	111.9	F190	Q188-F190 HydrophobicContact CB-CB 4.35Å; Q188-F190 HydrophobicContact CB-CD2 3.93Å
189	P	33.1	Very low	32	Very low	119 Å²	119	113.5 Å²	113.5	77%	0.773	69%	0.686	S	S	*	*			trans	-96.4	118	136.2	32.2	-23.6	0	0	0	107.7	G187	G187-P189 WeakPolarHBondContact O-CD 3.18Å
190	F	30.5	Very low	32.1	Very low	144 Å²	144	117.2 Å²	117.2	63%	0.632	71%	0.706	S	S	*	*			cis	57.6	55.1	15.6	-92.2	-44.5	0	0	0	115.5	Q188 I192	Q188-F190 HydrophobicContact CB-CB 4.35Å; Q188-F190 HydrophobicContact CB-CD2 3.93Å; F190-I192 HydrophobicContact CD1-CD1 3.8Å; F190-I192 HydrophobicContact CD1-CG1 3.98Å; F190-I192 HydrophobicContact CE1-CD1 4.46Å
191	L	32.4	Very low	32.2	Very low	159 Å²	159	117 Å²	117	83%	0.832	71%	0.707	S	S	*	*			trans	-127.2	119	138.4	-75.8	174.5	0	0	0	105.2
192	I	35.3	Very low	32.1	Very low	117 Å²	117	120.1 Å²	120.1	60%	0.6	71%	0.714	S	S	*	*			cis	59.1	111.6	35.1	-43.2	177.8	0	0	0	109.1	F190	F190-I192 HydrophobicContact CD1-CD1 3.8Å; F190-I192 HydrophobicContact CD1-CG1 3.98Å; F190-I192 HydrophobicContact CE1-CD1 4.46Å
193	P	29.1	Very low	32.1	Very low	118 Å²	118	122.3 Å²	122.3	77%	0.766	73%	0.726	S	S	*	*			cis	-103.3	170.8	36.5	9.7	12.2	0	0	0	113.6
194	G	25.5	Very low	31.9	Very low	56 Å²	56	122.4 Å²	122.4	58%	0.577	72%	0.716	S	S	*	*			cis	102.5	147	17.7	0	0	0	0	0	110.8
195	I	31.8	Very low	32.4	Very low	171 Å²	171	124.4 Å²	124.4	88%	0.877	72%	0.715	S	S	*	*			trans	70.4	126.2	-165.7	-44.7	157.4	0	0	0	110.4
196	V	36.6	Very low	32.7	Very low	123 Å²	123	126.5 Å²	126.5	75%	0.745	71%	0.711	S	S	*	*			cis	-106.8	137.2	-6.1	179.4	0	0	0	0	106.7	Q198	V196-Q198 WeakPolarHBondContact CG1-O 3.23Å
197	G	36.7	Very low	32.4	Very low	65 Å²	65	124.1 Å²	124.1	67%	0.67	70%	0.7	S	S	*	*				80.5	152.8	81.4	0	0	0	0	0	111.6
198	Q	26.3	Very low	32.5	Very low	162 Å²	162	128.1 Å²	128.1	76%	0.757	71%	0.707	S	S	*	*				50.5	133.2	50.6	-71.6	-93.3	5.5	0	0	111.9	V196	V196-Q198 WeakPolarHBondContact CG1-O 3.23Å
199	P	33.8	Very low	31.7	Very low	98 Å²	98	127.4 Å²	127.4	64%	0.636	71%	0.707	S	S	*	*			cis	-108.2	-152.7	10.6	27.7	-4.9	0	0	0	109
200	T	29.8	Very low	32	Very low	110 Å²	110	126.9 Å²	126.9	68%	0.675	71%	0.707	S	S	*	*			cis	-153.8	106.2	16.1	-27	0	0	0	0	105.9
201	I	34	Very low	32.1	Very low	102 Å²	102	125.7 Å²	125.7	52%	0.523	71%	0.714	S	S	.	*				88.6	116.3	97.9	-86	-175.2	0	0	0	110.1
202	R	27.8	Very low	31.7	Very low	191 Å²	191	121.7 Å²	121.7	72%	0.721	70%	0.704	S	S	*	*				48.9	132.2	103.5	-43.7	164.1	-169.6	158.8	-0.2	111.3	L204	R202-L204 HydrophobicContact CB-CD1 4.22Å; R202-L204 HydrophobicContact CB-CG 4.49Å; R202-L204 HydrophobicContact CG-CD1 4.44Å
203	T	36.1	Very low	31.3	Very low	126 Å²	126	126 Å²	126	77%	0.773	71%	0.714	S	S	*	*			cis	-110.5	145.3	38.8	47	0	0	0	0	111.7
204	L	30.8	Very low	31.4	Very low	120 Å²	120	130.4 Å²	130.4	63%	0.628	72%	0.715	S	S	*	*				52.5	122.5	64.3	-58.6	160.6	0	0	0	108.8	R202	R202-L204 HydrophobicContact CB-CD1 4.22Å; R202-L204 HydrophobicContact CB-CG 4.49Å; R202-L204 HydrophobicContact CG-CD1 4.44Å
205	T	37.4	Very low	31.4	Very low	111 Å²	111	133.6 Å²	133.6	68%	0.681	72%	0.715	S	S	*	*			cis	-144.2	168.7	28	46.4	0	0	0	0	110.9
206	Q	37	Very low	31.1	Very low	168 Å²	168	130.6 Å²	130.6	79%	0.785	71%	0.709	S	S	*	*			cis	-150	135.1	-4.9	-128.1	147.3	-24.4	0	0	109.3
207	D	25.8	Very low	30.8	Very low	132 Å²	132	127.7 Å²	127.7	71%	0.706	70%	0.704	S	S	*	*			trans	-64.1	147.9	158.2	-48.5	-94.6	0	0	0	109.6
208	N	29.6	Very low	30.4	Very low	141 Å²	141	129.7 Å²	129.7	75%	0.754	71%	0.708	S	S	*	*				-163.7	132.5	102.4	-103.3	-73.8	0	0	0	113.4
209	L	26.5	Very low	30.8	Very low	142 Å²	142	127.7 Å²	127.7	74%	0.743	71%	0.707	S	S	*	*			trans	-6.9	138.8	134.8	-63.8	158.5	0	0	0	116.7
210	S	39.5	Very low	30.7	Very low	109 Å²	109	131 Å²	131	76%	0.762	71%	0.714	S	S	*	*			trans	17.1	138.7	131.7	-48.7	0	0	0	0	118.2
211	P	31.7	Very low	30.8	Very low	119 Å²	119	130.3 Å²	130.3	77%	0.773	71%	0.711	S	S	*	*				-146.3	-178.3	95.3	41.2	-28.7	0	0	0	115.4
212	A	24.2	Very low	30.3	Very low	75 Å²	75	132.1 Å²	132.1	62%	0.62	72%	0.721	S	S	*	*			trans	84	128.2	138.7	0	0	0	0	0	119.6
213	Y	26.7	Very low	30.3	Very low	207 Å²	207	129.7 Å²	129.7	81%	0.812	72%	0.722	S	S	*	*			trans	28	111.6	130.2	-58.6	-88.3	0	0	0	115.6
214	R	32	Very low	29.9	Very low	210 Å²	210	129.3 Å²	129.3	79%	0.792	72%	0.719	S	S	*	*				-141	149	51.1	-81.1	-159.6	112.2	140.5	6	111.2
215	E	25.2	Very low	29.9	Very low	124 Å²	124	129.9 Å²	129.9	58%	0.579	73%	0.733	S	S	*	*				44.8	141.7	74.3	-60.7	-170.7	106.1	0	0	112.1
216	S	26	Very low	29.7	Very low	108 Å²	108	128.3 Å²	128.3	76%	0.755	74%	0.739	S	S	*	*			cis	-166.8	-177.8	-11.4	-95.2	0	0	0	0	104.5
217	G	30.7	Very low	29.6	Very low	62 Å²	62	125.1 Å²	125.1	64%	0.639	74%	0.736	S	S	*	*			trans	92.9	98.8	-165.8	0	0	0	0	0	108.4
218	S	27	Very low	30	Very low	107 Å²	107	128 Å²	128	75%	0.748	74%	0.742	S	S	*	*			cis	58.9	139	29.1	114	0	0	0	0	111.6
219	T	36.5	Very low	30.2	Very low	120 Å²	120	129.4 Å²	129.4	74%	0.736	74%	0.744	S	S	*	*			cis	-146	140.2	17.8	-19.3	0	0	0	0	110.4
220	Q	31.4	Very low	30.5	Very low	168 Å²	168	128.5 Å²	128.5	79%	0.785	74%	0.744	S	S	*	*			trans	-45.1	141.3	138.5	-71	-87.5	-1.1	0	0	107.6
221	P	30.7	Very low	30.2	Very low	95 Å²	95	130.4 Å²	130.4	62%	0.617	75%	0.746	S	S	*	*				-157.4	-169.9	52.7	38	-14.1	0	0	0	116.4
222	L	24.5	Very low	29.9	Very low	139 Å²	139	130.3 Å²	130.3	73%	0.728	74%	0.739	S	S	*	*			trans	60.6	116.1	137.9	-96.6	49.5	0	0	0	120.2
223	L	26.4	Very low	30.2	Very low	141 Å²	141	130.2 Å²	130.2	74%	0.738	73%	0.727	S	S	*	*			trans	98.8	126.7	130.7	-65.4	162.9	0	0	0	121.2
224	T	28.1	Very low	30.3	Very low	118 Å²	118	124 Å²	124	72%	0.724	71%	0.708	S	S	*	*			trans	68.6	115.6	140.8	50.8	0	0	0	0	121.4
225	S	31.4	Very low	30	Very low	131 Å²	131	120.7 Å²	120.7	92%	0.916	71%	0.706	S	S	*	*			trans	70.7	146.1	152.9	75.6	0	0	0	0	118.1
226	G	33.9	Very low	30.2	Very low	78 Å²	78	120.6 Å²	120.6	80%	0.804	71%	0.714	S	S	*	*			trans	144.3	73.7	177.4	0	0	0	0	0	115.5
227	S	34.1	Very low	30.3	Very low	102 Å²	102	122.2 Å²	122.2	71%	0.713	71%	0.714	S	S	*	*			trans	-39.4	139.7	176.2	54.5	0	0	0	0	120
228	K	33.9	Very low	30.3	Very low	192 Å²	192	126 Å²	126	84%	0.835	73%	0.725	S	S	*	*			trans	71.8	148	151.3	-60.2	166.3	-176.9	178.3	0	116.4
229	Q	33.8	Very low	30.3	Very low	171 Å²	171	124.7 Å²	124.7	80%	0.799	72%	0.721	S	S	*	*			cis	-152.7	122.7	11.7	-153.4	166.9	-16.4	0	0	114.1
230	V	33.7	Very low	30	Very low	122 Å²	122	129.5 Å²	129.5	74%	0.739	73%	0.725	S	S	*	*			trans	34	138.1	136.3	-169.3	0	0	0	0	120.9
231	N	31.6	Very low	29.8	Very low	150 Å²	150	127.1 Å²	127.1	80%	0.802	72%	0.718	S	S	*	*			cis	-177.8	137.3	-35.2	-99.7	-2.5	0	0	0	110.2
232	N	27	Very low	29.9	Very low	117 Å²	117	130.5 Å²	130.5	63%	0.626	73%	0.73	S	S	*	*			trans	-167.3	135.8	156.9	-132.2	1.5	0	0	0	105.1
233	L	29.3	Very low	30	Very low	73 Å²	73	130.7 Å²	130.7	38%	0.382	73%	0.727	S	S	.	*			cis	-158.3	164.7	44.2	-75.8	158.6	0	0	0	111.6	C435	L233-C435 HydrophobicContact CD2-CB 3.66Å
234	N	28.4	Very low	30.6	Very low	77 Å²	77	129.1 Å²	129.1	41%	0.412	73%	0.726	S	S	.	*			trans	51.4	137.3	145	-69.1	2.9	0	0	0	125.3	C435	N234-C435 WeakPolarHBondContact OD1-CB 3.12Å
235	N	25.6	Very low	30.9	Very low	140 Å²	140	132.9 Å²	132.9	75%	0.749	73%	0.726	S	S	*	*			trans	95.6	143.7	140.7	-77.1	1.4	0	0	0	123.5
236	T	31	Very low	31.1	Very low	122 Å²	122	132.2 Å²	132.2	75%	0.748	71%	0.711	S	S	*	*			trans	62.2	103.4	158.9	44.3	0	0	0	0	120.6
237	N	27.6	Very low	30.9	Very low	141 Å²	141	134.3 Å²	134.3	75%	0.754	70%	0.704	S	S	*	*				45.3	142.5	119.5	-65.1	-7.4	0	0	0	122
238	T	31	Very low	30.7	Very low	142 Å²	142	134.7 Å²	134.7	87%	0.871	70%	0.697	S	S	*	*			trans	71.1	149.7	168.4	70.2	0	0	0	0	116.6
239	A	26.5	Very low	30.5	Very low	80 Å²	80	131 Å²	131	66%	0.661	69%	0.691	S	S	*	*			cis	-170.9	168.9	-28.6	0	0	0	0	0	107.8
240	R	29.3	Very low	30.3	Very low	220 Å²	220	129 Å²	129	83%	0.83	69%	0.686	S	S	*	*			trans	67.9	152.3	165.2	-64.6	-174.1	170.6	151.7	1	115.9
241	D	28.9	Very low	30.2	Very low	118 Å²	118	128 Å²	128	63%	0.631	68%	0.679	S	S	*	*			cis	-146.2	150.3	-20.9	-96.1	-31.4	0	0	0	105.2
242	L	32.8	Very low	30.2	Very low	167 Å²	167	125.6 Å²	125.6	87%	0.874	68%	0.675	S	S	*	*				-158.7	133.5	75.4	-95.8	137.9	0	0	0	113.1
243	H	25.6	Very low	30.3	Very low	142 Å²	142	126.5 Å²	126.5	66%	0.657	68%	0.677	S	S	*	*			trans	-48.8	151.4	149.7	-102.9	-92.9	0	0	0	111.2	R245	H243-R245 PolarHBondContact ND1-N 2.95Å
244	P	39.1	Very low	30.3	Very low	109 Å²	109	128.7 Å²	128.7	71%	0.708	69%	0.689	S	S	*	*				-127	136.5	64	4.2	20.6	0	0	0	114.5
245	R	34.2	Very low	30.3	Very low	197 Å²	197	132.2 Å²	132.2	74%	0.743	70%	0.703	S	S	*	*				75.9	148.9	95.3	-68.4	177.5	-177.5	-123	4.3	112.9	H243	H243-R245 PolarHBondContact ND1-N 2.95Å
246	I	36.2	Very low	30.5	Very low	117 Å²	117	130.6 Å²	130.6	60%	0.6	70%	0.703	S	S	*	*			cis	-148.3	136.5	-1.9	-114.6	158	0	0	0	103.4
247	L	29.1	Very low	30.3	Very low	122 Å²	122	128.1 Å²	128.1	64%	0.639	69%	0.694	S	S	*	*				58.8	153.7	71.3	-58.3	170	0	0	0	111.2
248	D	30.1	Very low	30.3	Very low	109 Å²	109	132.2 Å²	132.2	58%	0.583	70%	0.701	S	S	*	*			cis	-135	144.3	-7.7	-95.6	-37.2	0	0	0	106.3
249	V	28.8	Very low	30.2	Very low	115 Å²	115	131.9 Å²	131.9	70%	0.697	70%	0.698	S	S	*	*				72.5	164.5	56.9	177.3	0	0	0	0	112
250	N	30.4	Very low	30.8	Very low	130 Å²	130	133.1 Å²	133.1	70%	0.695	70%	0.699	S	S	*	*			trans	93.1	138.5	166.9	-72.9	-29.5	0	0	0	119.4
251	V	32	Very low	30.7	Very low	100 Å²	100	126.7 Å²	126.7	61%	0.606	69%	0.688	S	S	*	*			cis	-169.1	158.4	-30.5	100.5	0	0	0	0	110	M253	V251-M253 HydrophobicContact CG1-CE 3.98Å
252	S	30.5	Very low	30.8	Very low	100 Å²	100	125.2 Å²	125.2	70%	0.699	68%	0.683	S	S	*	*			trans	146.8	140.6	137.8	-71.9	0	0	0	0	113.1
253	M	30	Very low	31.3	Very low	136 Å²	136	121 Å²	121	67%	0.67	67%	0.666	S	S	*	*			cis	-168.9	147.4	-20.3	-123.5	-178.9	-139	0	0	109.5	V251	V251-M253 HydrophobicContact CG1-CE 3.98Å
254	N	29.1	Very low	31.5	Very low	118 Å²	118	117.6 Å²	117.6	63%	0.631	66%	0.655	S	S	*	*			trans	66	154.2	148.6	-59.1	-24.9	0	0	0	120.5
255	Q	29.2	Very low	31.1	Very low	151 Å²	151	119.4 Å²	119.4	71%	0.706	65%	0.654	S	S	*	*			cis	-167.9	152.8	-20.9	-110.8	173.2	49.5	0	0	110.9
256	S	28.2	Very low	31	Very low	107 Å²	107	118 Å²	118	75%	0.748	66%	0.656	S	S	*	*			trans	50.1	162.9	139.5	-51.2	0	0	0	0	123.4
257	A	26.8	Very low	30.5	Very low	69 Å²	69	120.4 Å²	120.4	57%	0.57	66%	0.664	S	S	*	*			cis	-178.5	172.3	-32.4	0	0	0	0	0	110.8
258	Y	29	Very low	30.9	Very low	228 Å²	228	120.2 Å²	120.2	89%	0.894	67%	0.67	S	S	*	*			trans	73.1	167.6	165.9	-57	-69.7	0	0	0	119.7
259	V	28.2	Very low	31	Very low	134 Å²	134	120.8 Å²	120.8	81%	0.812	68%	0.677	S	S	*	*				-161.6	161.8	-51.8	109.5	0	0	0	0	111.2
260	P	39.6	Very low	31.2	Very low	107 Å²	107	121.6 Å²	121.6	70%	0.695	68%	0.682	S	S	*	*			trans	-124.7	174.7	-165.1	43.9	-33.5	0	0	0	119.3
261	S	27.7	Very low	31.1	Very low	85 Å²	85	119.3 Å²	119.3	59%	0.594	68%	0.676	S	S	*	*			trans	-178.7	157.3	151	-78	0	0	0	0	114.9
262	V	29.4	Very low	31.1	Very low	87 Å²	87	122 Å²	122	53%	0.527	68%	0.682	S	S	.	*			trans	-151.2	-162.4	-168.2	-144.5	0	0	0	0	114.4	A179 Q180 H181	A179-V262 CarbonylContact C-O 3.06Å; A179-V262 VanDerWaalsContact C-O 3.23Å; A179-V262 VanDerWaalsContact CA-C 3.43Å; A179-V262 WeakPolarHBondContact CA-O 3.27Å; A179-V262 PolarHBondContact N-O 2.96Å; Q180-V262 CarbonylContact C-O 2.88Å; Q180-V262 VanDerWaalsContact CA-O 3.23Å; Q180-V262 WeakPolarHBondContact CA-O 3.17Å; Q180-V262 PolarHBondContact N-O 3.03Å; Q180-V262 CarbonylContact O-C 3.53Å; H181-V262 PolarHBondContact CD2-O 2.94Å; H181-V262 PolarHBondContact NE2-N 3.3Å; H181-V262 PolarHBondContact NE2-O 2.77Å
263	P	43.6	Very low	31	Very low	79 Å²	79	124.3 Å²	124.3	51%	0.513	68%	0.682	S	S	.	*				-82.7	-116.6	-82.8	42.3	-38.1	0	0	0	119.7	N178 A179 Q180	N178-P263 CarbonylContact C-O 3.27Å; N178-P263 VanDerWaalsContact C-O 3.27Å; N178-P263 CarbonylContact O-C 3.48Å; N178-P263 VanDerWaalsContact O-CA 3.27Å; N178-P263 WeakPolarHBondContact O-CA 3.23Å; A179-P263 CarbonylContact C-O 3.49Å; A179-P263 PolarHBondContact N-O 2.82Å; Q180-P263 PolarHBondContact N-O 2.83Å; Q180-P263 CarbonylContact O-C 3.23Å; Q180-P263 WeakPolarHBondContact O-CA 3.45Å; Q180-P263 WeakPolarHBondContact O-CD 3.3Å; Q180-P263 VanDerWaalsContact O-N 3.12Å
264	V	30.5	Very low	30.9	Very low	70 Å²	70	125.3 Å²	125.3	42%	0.424	69%	0.685	S	S	.	*			trans	122.9	121.4	161	124	0	0	0	0	123.1	Q180 P182	Q180-V264 HydrophobicContact CB-CB 3.86Å; Q180-V264 HydrophobicContact CB-CG1 4.12Å; Q180-V264 HydrophobicContact CB-CG2 3.87Å; Q180-V264 WeakPolarHBondContact O-CB 3.27Å; Q180-V264 VanDerWaalsContact O-CG2 3.27Å; Q180-V264 WeakPolarHBondContact O-CG2 3.42Å; Q180-V264 PolarHBondContact O-N 2.98Å; P182-V264 HydrophobicContact CG-CG2 3.95Å
265	Q	31.6	Very low	30.7	Very low	147 Å²	147	126.6 Å²	126.6	69%	0.687	69%	0.691	S	S	*	*			trans	59.1	159.4	154.1	-77.7	179	3.5	0	0	122.4
266	Q	31.1	Very low	30.6	Very low	166 Å²	166	129 Å²	129	78%	0.776	69%	0.694	S	S	*	*			cis	-147.7	173.9	9.3	-139.4	169.5	75.6	0	0	114.1
267	H	25.9	Very low	30.6	Very low	169 Å²	169	129.9 Å²	129.9	78%	0.782	70%	0.696	S	S	*	*			trans	-107.1	158.8	-170.5	-110.3	-89.1	0	0	0	115.9
268	P	37.1	Very low	30.5	Very low	117 Å²	117	132 Å²	132	76%	0.76	71%	0.707	S	S	*	*			trans	-107.3	178.7	142.3	-12.5	32.1	0	0	0	115.3
269	V	31.9	Very low	31	Very low	122 Å²	122	126.5 Å²	126.5	74%	0.739	70%	0.699	S	S	*	*			trans	-149.9	176.7	-167.2	166.1	0	0	0	0	111.5
270	V	33	Very low	31.1	Very low	131 Å²	131	126 Å²	126	79%	0.794	70%	0.696	S	S	*	*			trans	107.6	144	165.3	-171.7	0	0	0	0	116
271	S	28.2	Very low	30.8	Very low	82 Å²	82	128.3 Å²	128.3	57%	0.573	70%	0.702	S	S	*	*				175.2	162.3	-63.3	-81.6	0	0	0	0	113
272	H	31.7	Very low	30.8	Very low	157 Å²	157	132.9 Å²	132.9	73%	0.727	71%	0.714	S	S	*	*			trans	97	116	152.6	-55.2	-60.5	0	0	0	124.3
273	H	30.3	Very low	31	Very low	149 Å²	149	134.1 Å²	134.1	69%	0.69	72%	0.723	S	S	*	*			trans	43.6	120.7	137.2	-58.3	-74.7	0	0	0	126.5
274	Q	26.1	Very low	30.8	Very low	157 Å²	157	136.4 Å²	136.4	73%	0.734	74%	0.739	S	S	*	*				13	131.8	122	-53.2	162.8	-53.7	0	0	120.3
275	L	26.6	Very low	30.5	Very low	145 Å²	145	138.3 Å²	138.3	76%	0.759	76%	0.755	S	S	*	*				165.6	136.6	101.9	-81.8	178.2	0	0	0	113.4
276	Y	26.4	Very low	30.3	Very low	200 Å²	200	138 Å²	138	78%	0.784	76%	0.757	S	S	*	*			trans	57	122	149.1	-82.3	-107.7	0	0	0	124.7
277	T	28.3	Very low	30.2	Very low	126 Å²	126	138.8 Å²	138.8	77%	0.773	76%	0.761	S	S	*	*			trans	69.3	122.7	141.4	48.6	0	0	0	0	123.1
278	S	24.6	Very low	30.3	Very low	115 Å²	115	134.1 Å²	134.1	80%	0.804	76%	0.758	S	S	*	*			trans	-67	171.5	167.1	-15.3	0	0	0	0	113.3
279	P	38.8	Very low	29.9	Very low	111 Å²	111	137 Å²	137	72%	0.721	76%	0.763	S	S	*	*			cis	-149.4	-178.4	49	42.2	-20.7	0	0	0	119.3
280	T	30.7	Very low	29.8	Very low	124 Å²	124	136.7 Å²	136.7	76%	0.761	76%	0.762	S	S	*	*			trans	62.6	101.6	157.2	43.8	0	0	0	0	120.8
281	L	34.1	Very low	29.3	Very low	156 Å²	156	138.2 Å²	138.2	82%	0.817	76%	0.76	S	S	*	*				176.8	108.5	114	-95	162.6	0	0	0	113.9
282	Q	27.5	Very low	29.4	Very low	180 Å²	180	143.9 Å²	143.9	84%	0.841	77%	0.77	S	S	*	*			trans	56.8	-178.7	163.7	-54.2	-178.9	-94.1	0	0	117.6
283	P	33.5	Very low	29.1	Very low	113 Å²	113	141.6 Å²	141.6	73%	0.734	77%	0.767	S	S	*	*				-106.8	154.1	-91	38.5	-26.9	0	0	0	113
284	P	38.2	Very low	28.8	Very low	128 Å²	128	143 Å²	143	83%	0.831	77%	0.774	S	S	*	*				-156.1	155.1	88.8	39.2	-20.3	0	0	0	117.3
285	S	24.6	Very low	28.6	Very low	109 Å²	109	139.8 Å²	139.8	76%	0.762	77%	0.774	S	S	*	*			trans	-165.8	171.6	161.7	63.8	0	0	0	0	113.7
286	L	28.8	Very low	28.7	Very low	141 Å²	141	139.8 Å²	139.8	74%	0.738	78%	0.78	S	S	*	*			trans	82.1	129.4	171.7	-89.2	74.6	0	0	0	121
287	H	28.7	Very low	28.5	Very low	183 Å²	183	140.5 Å²	140.5	85%	0.847	78%	0.783	S	S	*	*			trans	64.1	132	143.5	-80.2	67.7	0	0	0	121.9
288	G	28	Very low	28.8	Very low	70 Å²	70	139.9 Å²	139.9	72%	0.722	78%	0.781	S	S	*	*			trans	157.4	80.3	152.9	0	0	0	0	0	118.9
289	M	28.2	Very low	29.2	Very low	177 Å²	177	140.7 Å²	140.7	87%	0.872	78%	0.781	S	S	*	*			trans	55.9	123.2	145.7	-57.4	-55.1	-154.3	0	0	123.4
290	V	28.9	Very low	28.5	Very low	117 Å²	117	142.4 Å²	142.4	71%	0.709	78%	0.784	S	S	*	*				65.2	104.6	128.5	-176.3	0	0	0	0	120.5
291	E	23.3	Very low	28.6	Very low	163 Å²	163	142.4 Å²	142.4	76%	0.762	79%	0.786	S	S	*	*				55.6	121.8	129.6	-156.8	171.9	-135.1	0	0	121.6
292	Y	29.4	Very low	28.2	Very low	200 Å²	200	142.4 Å²	142.4	78%	0.784	79%	0.787	S	S	*	*				178	127.7	117.5	-112.1	-105.2	0	0	0	113.6
293	V	27.1	Very low	28.4	Very low	109 Å²	109	140.2 Å²	140.2	66%	0.661	79%	0.785	S	S	*	*			trans	44.9	98.9	139.3	-176.9	0	0	0	0	121.7
294	Q	23	Very low	28.3	Very low	179 Å²	179	142.3 Å²	142.3	84%	0.836	79%	0.785	S	S	*	*				76.8	132	117.2	-160.1	166.7	5.4	0	0	124.5
295	A	22.5	Very low	27.8	Very low	89 Å²	89	141.9 Å²	141.9	74%	0.736	78%	0.78	S	S	*	*			trans	74	129.1	154.2	0	0	0	0	0	122.6
296	V	29.2	Very low	28.2	Very low	145 Å²	145	142 Å²	142	88%	0.879	78%	0.778	S	S	*	*				-174	157.4	121.8	144.8	0	0	0	0	110.6
297	Y	22.4	Very low	28.3	Very low	216 Å²	216	146.3 Å²	146.3	85%	0.847	79%	0.786	S	S	*	*			trans	-74.5	169.4	-176.2	-78.2	-98.8	0	0	0	115.1
298	P	33.4	Very low	28.1	Very low	113 Å²	113	143.1 Å²	143.1	73%	0.734	78%	0.779	S	S	*	*				-144.2	135.2	113.1	37.6	-23.4	0	0	0	118.1
299	T	32.1	Very low	28.2	Very low	132 Å²	132	147.9 Å²	147.9	81%	0.81	78%	0.783	S	S	*	*			trans	50.4	127.2	137.7	61.6	0	0	0	0	125.6
300	N	25.5	Very low	28.1	Very low	147 Å²	147	148.3 Å²	148.3	79%	0.786	78%	0.783	S	S	*	*			trans	-40.9	172	146.2	-108.2	-28.8	0	0	0	115.7
301	P	32.3	Very low	27.8	Very low	123 Å²	123	147.5 Å²	147.5	80%	0.799	78%	0.783	S	S	*	*			cis	-140.8	-173.2	23.6	40.5	-19.2	0	0	0	118
302	N	26	Very low	28	Very low	156 Å²	156	143.1 Å²	143.1	83%	0.834	77%	0.774	S	S	*	*			trans	-76.3	136.4	-175.3	-77.8	-42	0	0	0	117.2
303	V	32	Very low	27.9	Very low	134 Å²	134	137.4 Å²	137.4	81%	0.812	77%	0.768	S	S	*	*			trans	-174.4	140	161.9	126.4	0	0	0	0	106.9
304	H	30.4	Very low	27.8	Very low	158 Å²	158	139.2 Å²	139.2	73%	0.731	77%	0.774	S	S	*	*			cis	-160.8	155	-0.3	-140.1	-153.4	0	0	0	111.3
305	V	27.1	Very low	27.9	Very low	118 Å²	118	139.9 Å²	139.9	72%	0.715	77%	0.774	S	S	*	*			trans	48	143.6	131	171.7	0	0	0	0	121.4
306	P	34.7	Very low	28	Very low	111 Å²	111	138.9 Å²	138.9	72%	0.721	77%	0.772	S	S	*	*			trans	-115.6	172.2	-134.3	42.9	-36.6	0	0	0	117.4
307	Y	29.9	Very low	28	Very low	233 Å²	233	140.4 Å²	140.4	91%	0.914	77%	0.769	S	S	*	*			trans	-144.5	170.3	160.4	-109.4	-83.4	0	0	0	113
308	T	24.5	Very low	28.3	Very low	115 Å²	115	140.7 Å²	140.7	71%	0.706	77%	0.77	S	S	*	*			trans	-106.9	145.6	-167.5	51.8	0	0	0	0	114
309	Q	29.6	Very low	28.1	Very low	171 Å²	171	141.3 Å²	141.3	80%	0.799	78%	0.775	S	S	*	*				166.5	139.4	126.3	-92.7	176	21.1	0	0	114.3
310	Q	26.7	Very low	27.8	Very low	186 Å²	186	139.4 Å²	139.4	87%	0.869	77%	0.772	S	S	*	*			trans	41	170.6	137.9	-63.4	-176.5	-13.8	0	0	122.9
311	S	23.6	Very low	28	Very low	100 Å²	100	140.8 Å²	140.8	70%	0.699	77%	0.774	S	S	*	*			trans	-98.5	170.1	-162.3	-48.2	0	0	0	0	115.6
312	A	26	Very low	27.8	Very low	71 Å²	71	142.3 Å²	142.3	59%	0.587	77%	0.772	S	S	*	*			trans	99.6	142.3	155.5	0	0	0	0	0	119.8	E701	A312-E701 WeakPolarHBondContact CA-OE2 3.38Å; A312-E701 VanDerWaalsContact CB-OE2 3.31Å; A312-E701 WeakPolarHBondContact CB-OE2 3.44Å
313	A	27.1	Very low	27.9	Very low	80 Å²	80	142.6 Å²	142.6	66%	0.661	77%	0.773	S	S	*	*			trans	63.1	93.9	156	0	0	0	0	0	123.5
314	L	26.2	Very low	27.6	Very low	147 Å²	147	143.1 Å²	143.1	77%	0.77	78%	0.777	S	S	*	*				84.8	141.2	108.2	-146.3	68.5	0	0	0	123.6
315	F	23.6	Very low	27.3	Very low	193 Å²	193	138.8 Å²	138.8	85%	0.846	78%	0.775	S	S	*	*			trans	77.2	134.3	164.5	-78.7	-59.6	0	0	0	121.8
316	G	25.9	Very low	27.3	Very low	67 Å²	67	143.5 Å²	143.5	69%	0.691	79%	0.786	S	S	*	*			trans	-170.8	28	-173.7	0	0	0	0	0	117.5
317	H	29.7	Very low	26.7	Very low	178 Å²	178	145.2 Å²	145.2	82%	0.824	79%	0.789	S	S	*	*			trans	58.6	122.2	163.8	-60.6	90.4	0	0	0	121.8
318	Y	27.5	Very low	26.4	Very low	221 Å²	221	138.3 Å²	138.3	87%	0.867	78%	0.775	S	S	*	*			trans	-84.9	151.1	145.4	-92.2	-96.7	0	0	0	110
319	P	29.1	Very low	26.3	Very low	127 Å²	127	139.2 Å²	139.2	83%	0.825	78%	0.781	S	S	*	*			trans	-110.2	122.4	149.8	33.6	-23.9	0	0	0	111
320	A	26.8	Very low	26.1	Very low	91 Å²	91	138.6 Å²	138.6	75%	0.752	78%	0.78	S	S	*	*			trans	-145.8	105.2	168.9	0	0	0	0	0	110.5
321	Q	28.3	Very low	26.1	Very low	177 Å²	177	135.8 Å²	135.8	83%	0.827	77%	0.771	S	S	*	*			trans	-150.3	147	171.5	-76.2	-165.7	-8.6	0	0	106.6
322	M	28.4	Very low	26.3	Very low	155 Å²	155	136.2 Å²	136.2	76%	0.764	77%	0.769	S	S	*	*			cis	-133.8	154.2	14.7	-70.5	-174.7	171.3	0	0	114.3
323	N	27.8	Very low	26.4	Very low	161 Å²	161	139.3 Å²	139.3	86%	0.861	78%	0.776	S	S	*	*			trans	46.6	150.9	142	-70.5	8.7	0	0	0	124.7
324	T	25.8	Very low	26.5	Very low	146 Å²	146	144.5 Å²	144.5	90%	0.896	78%	0.784	S	S	*	*			trans	-106.5	153	172.1	51.6	0	0	0	0	111.5
325	G	24.3	Very low	26.6	Very low	66 Å²	66	144.4 Å²	144.4	68%	0.68	78%	0.784	S	S	*	*			trans	158.8	122.4	154.1	0	0	0	0	0	117.2
326	F	27.2	Very low	26.9	Very low	218 Å²	218	139.3 Å²	139.3	96%	0.956	77%	0.773	S	S	*	*			trans	65.8	179.6	163.2	-72.1	-79.9	0	0	0	118.3
327	D	22.5	Very low	27.1	Very low	146 Å²	146	142.2 Å²	142.2	78%	0.781	76%	0.763	S	S	*	*				-146.9	170.5	-121.9	-163.7	4.1	0	0	0	112.8
328	S	22.9	Very low	27.1	Very low	88 Å²	88	139.1 Å²	139.1	62%	0.615	75%	0.751	S	S	*	*			trans	71.2	103.5	167.7	70.6	0	0	0	0	119.6
329	T	22.9	Very low	27.1	Very low	134 Å²	134	136.7 Å²	136.7	82%	0.822	74%	0.74	S	S	*	*			trans	73	156.7	140.4	67.3	0	0	0	0	122.4
330	M	26.4	Very low	27.1	Very low	158 Å²	158	134.9 Å²	134.9	78%	0.778	72%	0.721	S	S	*	*			trans	77.9	95.5	166.2	-66.7	-62.2	168.7	0	0	121.7
331	N	27	Very low	27.2	Very low	128 Å²	128	138.5 Å²	138.5	68%	0.684	73%	0.727	S	S	*	*				81.1	96.9	123	-78.7	2.4	0	0	0	123.5
332	T	26.4	Very low	27.3	Very low	108 Å²	108	132.8 Å²	132.8	66%	0.663	71%	0.705	S	S	*	*				47.5	117.7	113.2	61	0	0	0	0	121
333	N	28.2	Very low	27.3	Very low	137 Å²	137	137.1 Å²	137.1	73%	0.733	71%	0.713	S	S	*	*				-170.1	149.5	119.2	-96.5	-32.4	0	0	0	108.8
334	F	30.1	Very low	27.1	Very low	189 Å²	189	133.4 Å²	133.4	83%	0.829	71%	0.705	S	S	*	*			cis	-137.8	172.3	4.7	-121.4	-74.2	0	0	0	110.2
335	N	27.7	Very low	27.1	Very low	145 Å²	145	130 Å²	130	78%	0.775	70%	0.698	S	S	*	*			trans	-149	160.9	170	-162.7	-4.4	0	0	0	111.8
336	S	30.5	Very low	27.1	Very low	86 Å²	86	134.6 Å²	134.6	60%	0.601	71%	0.706	S	S	*	*			trans	79.3	157.8	168.9	89.7	0	0	0	0	116.9
337	R	28.9	Very low	27.1	Very low	128 Å²	128	131.9 Å²	131.9	48%	0.483	70%	0.697	S	S	.	*			cis	-163.4	173.1	21.7	-137.1	154.7	-162.1	175.6	1.3	113.2	D823 Q824 P825	R337-D823 PolarHBondContact NH1-O 2.79Å; R337-Q824 WeakPolarHBondContact CD-O 3.35Å; R337-Q824 PolarHBondContact NE-O 3Å; R337-Q824 VanDerWaalsContact NH1-C 3.26Å; R337-Q824 PolarHBondContact NH1-O 2.81Å; R337-P825 VanDerWaalsContact CZ-N 3.29Å; R337-P825 VanDerWaalsContact NE-CD 3.34Å; R337-P825 PolarHBondContact NE-O 2.85Å; R337-P825 PolarHBondContact NH2-O 3.35Å
338	I	30.3	Very low	27.3	Very low	113 Å²	113	131.1 Å²	131.1	58%	0.579	69%	0.693	S	S	*	*			trans	76	132.7	153.3	-73.5	163.8	0	0	0	117.9	P825	I338-P825 HydrophobicContact CG1-CG 4.37Å
339	R	28.6	Very low	27.4	Very low	169 Å²	169	133.3 Å²	133.3	64%	0.638	70%	0.698	S	S	*	*			cis	-157.9	176.5	-13.4	-128.7	-177.2	-75.6	-161.8	-4.5	112.3	E827	R339-E827 VanDerWaalsContact CD-OE2 3.23Å; R339-E827 WeakPolarHBondContact CD-OE2 3.21Å; R339-E827 VanDerWaalsContact CG-OE2 3.3Å; R339-E827 WeakPolarHBondContact CG-OE2 3.47Å
340	H	27.6	Very low	27.5	Very low	90 Å²	90	134.5 Å²	134.5	42%	0.417	70%	0.696	S	S	.	*			trans	-99.6	170.3	-173	-86.3	-99.4	0	0	0	115.5	T828	H340-T828 PolarHBondContact CD2-N 2.92Å; H340-T828 VanDerWaalsContact CD2-N 3.27Å; H340-T828 PolarHBondContact CE1-O 3.24Å; H340-T828 PolarHBondContact ND1-O 2.78Å; H340-T828 PolarHBondContact NE2-N 3.38Å
341	N	29.3	Very low	27.4	Very low	166 Å²	166	131.3 Å²	131.3	89%	0.888	69%	0.689	S	S	*	*				-156.2	161	127.2	-113.2	-27.4	0	0	0	112.6
342	T	29.7	Very low	27.2	Very low	58 Å²	58	130.6 Å²	130.6	36%	0.356	69%	0.694	S	S	.	*			trans	-148	157.6	-159.8	-48.2	0	0	0	0	110.9	C829 P830	T342-C829 PolarHBondContact OG1-SG 3.41Å; T342-P830 HydrophobicContact CG2-CG 4.48Å
343	W	28.4	Very low	27.2	Very low	245 Å²	245	129.4 Å²	129.4	93%	0.928	70%	0.695	S	S	*	*			trans	-170.5	167.5	134.3	-115.9	75	0	0	0	111.6
344	A	25.2	Very low	27	Very low	84 Å²	84	129.5 Å²	129.5	69%	0.694	69%	0.694	S	S	*	*			trans	-150.3	157.8	-177.3	0	0	0	0	0	111.4
345	G	24.5	Very low	26.8	Very low	74 Å²	74	126.5 Å²	126.5	76%	0.763	69%	0.687	S	S	*	*			trans	162.6	89.3	171.5	0	0	0	0	0	118.1
346	L	26	Very low	26.6	Very low	162 Å²	162	126.5 Å²	126.5	85%	0.848	68%	0.682	S	S	*	*			trans	65.9	160.6	132.1	-132.8	67.7	0	0	0	123.3
347	E	26.7	Very low	26.4	Very low	162 Å²	162	127.8 Å²	127.8	76%	0.757	68%	0.682	S	S	*	*			trans	76.8	101.6	160.2	-56.6	-166.3	-165.2	0	0	121.6
348	D	26.5	Very low	26.3	Very low	130 Å²	130	127.2 Å²	127.2	70%	0.695	70%	0.698	S	S	*	*				72.8	105	118.9	-82	48.7	0	0	0	124.9
349	N	25.4	Very low	26.2	Very low	134 Å²	134	126.2 Å²	126.2	72%	0.717	70%	0.701	S	S	*	*				73.2	153.7	116.4	-90.2	-46.7	0	0	0	122.9
350	M	24.2	Very low	26.3	Very low	159 Å²	159	122 Å²	122	78%	0.783	70%	0.702	S	S	*	*			trans	69.1	95.6	159.2	-70.3	-76.2	172	0	0	120.1
351	S	23.6	Very low	26.4	Very low	90 Å²	90	127.9 Å²	127.9	63%	0.629	72%	0.721	S	S	*	*				73.3	106.9	112.3	-59.1	0	0	0	0	122.1
352	S	23.6	Very low	26.4	Very low	113 Å²	113	128.7 Å²	128.7	79%	0.79	72%	0.716	S	S	*	*				81.3	-175.4	121	82.9	0	0	0	0	119.3
353	A	26.5	Very low	26.5	Very low	84 Å²	84	132.1 Å²	132.1	69%	0.694	73%	0.731	S	S	*	*			trans	61.1	96.9	-171.1	0	0	0	0	0	114.4
354	I	24.4	Very low	26.6	Very low	138 Å²	138	129.3 Å²	129.3	71%	0.708	73%	0.725	S	S	*	*				71.4	87.9	59.5	-54.8	173.8	0	0	0	112.8
355	N	24.7	Very low	26.6	Very low	127 Å²	127	131.5 Å²	131.5	68%	0.679	73%	0.725	S	S	*	*				59.9	163.5	125.4	-50.5	0.9	0	0	0	123
356	H	24.9	Very low	26.7	Very low	144 Å²	144	134.9 Å²	134.9	67%	0.667	72%	0.721	S	S	*	*				105.5	129.1	129.3	-84.9	-54.3	0	0	0	119.6
357	D	25.5	Very low	26.7	Very low	113 Å²	113	135.1 Å²	135.1	60%	0.604	72%	0.715	S	S	*	*			trans	61.9	125.1	135.4	-62.1	1.8	0	0	0	120.6
358	S	27.6	Very low	26.5	Very low	117 Å²	117	133.3 Å²	133.3	82%	0.818	72%	0.715	S	S	*	*				-157.5	131.8	89.9	-81.3	0	0	0	0	111.6
359	S	27.8	Very low	26.5	Very low	92 Å²	92	134.4 Å²	134.4	64%	0.643	72%	0.72	S	S	*	*			cis	85.4	156.7	44.1	-67.1	0	0	0	0	113.4
360	A	30.9	Very low	26.9	Very low	80 Å²	80	134.4 Å²	134.4	66%	0.661	73%	0.725	S	S	*	*			trans	109.6	135.5	176	0	0	0	0	0	115.3
361	R	29.2	Very low	27.2	Very low	214 Å²	214	131.6 Å²	131.6	81%	0.808	72%	0.718	S	S	*	*			cis	-165.7	135.1	-2.8	-116.8	168.7	-139.7	-165.4	3.8	113.3
362	K	28.7	Very low	27.3	Very low	182 Å²	182	133.3 Å²	133.3	79%	0.791	72%	0.721	S	S	*	*				70.3	164.6	127.1	-120.8	174.6	-161.8	-179.4	0	115.7
363	I	31.8	Very low	27.4	Very low	131 Å²	131	134.6 Å²	134.6	67%	0.672	72%	0.718	S	S	*	*			cis	-154.4	131.8	23.7	-61	-179	0	0	0	111.9
364	K	31.1	Very low	27.3	Very low	185 Å²	185	139.3 Å²	139.3	80%	0.804	72%	0.723	S	S	*	*			trans	54.8	-179.9	152.1	-67.8	175.4	-176.6	-175.1	0	120.2
365	N	26	Very low	28	Very low	130 Å²	130	137.7 Å²	137.7	70%	0.695	72%	0.722	S	S	*	*				-177	151.2	-54.7	-99.4	27.8	0	0	0	106.9
366	E	25.4	Very low	27.9	Very low	145 Å²	145	136.1 Å²	136.1	68%	0.678	72%	0.721	S	S	*	*			trans	65.8	156.1	164.9	-68.4	172.2	-122.6	0	0	115.9
367	K	25.3	Very low	27.8	Very low	167 Å²	167	135.3 Å²	135.3	73%	0.726	73%	0.726	S	S	*	*			cis	-157	155.2	-1.5	-127.8	165.5	-176.5	147.8	0	110.7
368	V	23.8	Very low	27.9	Very low	124 Å²	124	135.5 Å²	135.5	75%	0.752	73%	0.732	S	S	*	*			trans	36.2	116.9	143.6	173.2	0	0	0	0	119.9
369	L	25.8	Very low	27.7	Very low	154 Å²	154	136.2 Å²	136.2	81%	0.806	73%	0.726	S	S	*	*				-164.1	144.5	114.3	-149.7	68.3	0	0	0	112.7
370	V	33.6	Very low	27.7	Very low	133 Å²	133	137.5 Å²	137.5	81%	0.806	73%	0.726	S	S	*	*			trans	-146.5	124.6	167.3	168.9	0	0	0	0	105.6
371	P	31.5	Very low	27.6	Very low	100 Å²	100	143.9 Å²	143.9	65%	0.649	73%	0.734	S	S	*	*				-152.9	160.6	109	38.9	-20.7	0	0	0	117.7
372	N	24.5	Very low	27.4	Very low	127 Å²	127	139.3 Å²	139.3	68%	0.679	73%	0.726	S	S	*	*			trans	13.3	136.6	142.5	-44.7	-11.4	0	0	0	121.6
373	D	27	Very low	27.5	Very low	139 Å²	139	138.6 Å²	138.6	74%	0.743	73%	0.73	S	S	*	*				-171.2	135.1	95.6	-85.7	-24.6	0	0	0	109
374	F	24.5	Very low	27.1	Very low	183 Å²	183	138.9 Å²	138.9	80%	0.803	73%	0.732	S	S	*	*				63.8	146.9	82.3	-78.7	-75.4	0	0	0	114.9
375	P	37.6	Very low	27.1	Very low	104 Å²	104	135.9 Å²	135.9	68%	0.675	74%	0.735	S	S	*	*				-139.6	-167.8	-125.5	36.3	-12.8	0	0	0	116.2
376	S	22.8	Very low	27.1	Very low	95 Å²	95	139 Å²	139	66%	0.664	75%	0.745	S	S	*	*			trans	96.7	151.6	136.7	81	0	0	0	0	123.1
377	T	24	Very low	27.2	Very low	126 Å²	126	135.4 Å²	135.4	77%	0.773	75%	0.747	S	S	*	*			trans	84.2	158.1	152.2	65	0	0	0	0	122.9
378	V	26.5	Very low	27.3	Very low	118 Å²	118	132.8 Å²	132.8	72%	0.715	75%	0.749	S	S	*	*			trans	75.8	96.8	166.6	-167.2	0	0	0	0	114.3
379	N	24.9	Very low	27.3	Very low	132 Å²	132	135.8 Å²	135.8	71%	0.706	75%	0.753	S	S	*	*				73.7	148.9	75.2	-71.1	43.5	0	0	0	113
380	D	27.5	Very low	27.4	Very low	118 Å²	118	133.1 Å²	133.1	63%	0.631	74%	0.743	S	S	*	*			cis	-135.6	-145.7	2.4	-131.6	-55.9	0	0	0	108.5
381	Y	28.7	Very low	26.9	Very low	215 Å²	215	134.4 Å²	134.4	84%	0.843	74%	0.74	S	S	*	*			cis	-149.5	-172.5	7.4	-138.6	-13.3	0	0	0	112.2
382	N	23.9	Very low	26.7	Very low	117 Å²	117	138.3 Å²	138.3	63%	0.626	74%	0.743	S	S	*	*			trans	-137.8	148.7	-166.7	-179.6	7.8	0	0	0	111
383	L	30.9	Very low	26.7	Very low	168 Å²	168	138.4 Å²	138.4	88%	0.88	75%	0.748	S	S	*	*			trans	-174.3	152.6	146.5	-105	166.3	0	0	0	113.4
384	N	24.6	Very low	26.6	Very low	136 Å²	136	134 Å²	134	73%	0.727	73%	0.731	S	S	*	*			trans	-110.6	161.4	-176.3	-63.6	-69.7	0	0	0	113.1
385	S	29.5	Very low	26.7	Very low	122 Å²	122	129.6 Å²	129.6	85%	0.853	72%	0.72	S	S	*	*			trans	-174.5	166.1	138	38.1	0	0	0	0	113
386	H	26.4	Very low	26.3	Very low	197 Å²	197	127.8 Å²	127.8	91%	0.912	71%	0.708	S	S	*	*			trans	-103.7	157.7	-171.4	-69.2	-128.8	0	0	0	113
387	G	28.4	Very low	26.6	Very low	69 Å²	69	134.1 Å²	134.1	71%	0.711	72%	0.719	S	S	*	*			trans	173.4	79.7	166.4	0	0	0	0	0	119.9
388	S	26.1	Very low	26.6	Very low	111 Å²	111	137.7 Å²	137.7	78%	0.776	72%	0.724	S	S	*	*			trans	50.8	121.6	144.5	53.4	0	0	0	0	124.8
389	F	25.6	Very low	26.6	Very low	188 Å²	188	137.9 Å²	137.9	83%	0.825	73%	0.73	S	S	*	*			trans	90.3	109.8	131.4	-90.1	-107.5	0	0	0	125.3
390	T	26	Very low	26.6	Very low	98 Å²	98	134.5 Å²	134.5	60%	0.601	73%	0.727	S	S	*	*			trans	75	119.9	133.9	46	0	0	0	0	126.4
391	Q	24.8	Very low	26.5	Very low	160 Å²	160	138.7 Å²	138.7	75%	0.748	74%	0.74	S	S	*	*			trans	69.6	152.5	134.4	-63.9	-175.1	12.5	0	0	120.4
392	Y	25.8	Very low	26.4	Very low	182 Å²	182	134.4 Å²	134.4	71%	0.714	73%	0.731	S	S	*	*			cis	-164.4	136.8	-14.9	-120.6	-47	0	0	0	112.1
393	T	25.8	Very low	26.5	Very low	129 Å²	129	137.4 Å²	137.4	79%	0.791	74%	0.742	S	S	*	*			trans	58.8	175.4	157.7	46.3	0	0	0	0	117.9
394	A	25.4	Very low	26.2	Very low	46 Å²	46	134.8 Å²	134.8	38%	0.38	74%	0.737	S	S	.	*			cis	-149.3	-125.5	17.6	0	0	0	0	0	116	C1712 L1713	A394-C1712 PolarHBondContact N-SG 2.95Å; A394-C1712 WeakPolarHBondContact O-CB 3.42Å; A394-L1713 PolarHBondContact O-N 3.13Å; A394-L1713 VanDerWaalsContact O-N 3.16Å
395	T	25.5	Very low	26.1	Very low	91 Å²	91	133 Å²	133	56%	0.558	74%	0.736	S	S	*	*			trans	-159	148	-146.1	51.7	0	0	0	0	114	S1714	T395-S1714 WeakPolarHBondContact CB-OG 3.11Å
396	P	30	Very low	25.8	Very low	66 Å²	66	135.9 Å²	135.9	43%	0.429	73%	0.733	S	S	.	*			trans	-115	-163.8	174	44.6	-28.3	0	0	0	111.3	C1712 S1714	P396-C1712 WeakPolarHBondContact CD-O 3.41Å; P396-C1712 WeakPolarHBondContact CG-O 3.47Å; P396-S1714 WeakPolarHBondContact CD-OG 3.27Å; P396-S1714 PolarHBondContact O-OG 2.57Å
397	Y	28.1	Very low	25.8	Very low	228 Å²	228	135.9 Å²	135.9	89%	0.894	73%	0.727	S	S	*	*			trans	-144.7	169.5	174.7	-109.8	-94.9	0	0	0	113.6
398	F	25	Very low	25.6	Very low	200 Å²	200	139.9 Å²	139.9	88%	0.877	73%	0.727	S	S	*	*			trans	-105.6	142.6	176.4	-131.3	-79.9	0	0	0	110.6
399	S	24.9	Very low	25.5	Very low	122 Å²	122	139.4 Å²	139.4	85%	0.853	72%	0.719	S	S	*	*			trans	-163.5	146.6	156.1	55.3	0	0	0	0	108.6
400	G	24.8	Very low	25.4	Very low	61 Å²	61	138 Å²	138	63%	0.629	72%	0.72	S	S	*	*			cis	162.1	160.7	-6.4	0	0	0	0	0	108.8
401	F	27.3	Very low	25.5	Very low	206 Å²	206	137.1 Å²	137.1	90%	0.904	73%	0.73	S	S	*	*			trans	-177.9	-171.1	152.6	-106.9	-65.4	0	0	0	113
402	N	26.6	Very low	25.7	Very low	125 Å²	125	138.6 Å²	138.6	67%	0.668	74%	0.737	S	S	*	*			trans	-107.3	149.9	-150.4	-74.8	-42.2	0	0	0	117.5
403	Q	25.2	Very low	25.7	Very low	181 Å²	181	137.8 Å²	137.8	85%	0.846	74%	0.738	S	S	*	*			trans	44.8	136	140.1	-56.8	-173.7	19.2	0	0	123.3
404	S	23.9	Very low	25.9	Very low	112 Å²	112	137.2 Å²	137.2	78%	0.783	74%	0.736	S	S	*	*			trans	-37.4	158.7	168.4	56	0	0	0	0	118.5
405	S	23.3	Very low	25.9	Very low	100 Å²	100	140.5 Å²	140.5	70%	0.699	75%	0.747	S	S	*	*			cis	-173	176.1	44.4	68.9	0	0	0	0	115.5
406	F	23.7	Very low	26.2	Very low	182 Å²	182	143.9 Å²	143.9	80%	0.798	76%	0.76	S	S	*	*			trans	54.9	111.7	159	-78	-80.7	0	0	0	124.2
407	Y	25.5	Very low	26.1	Very low	197 Å²	197	145 Å²	145	77%	0.773	77%	0.77	S	S	*	*				34.8	118.5	127.8	-81.6	-81	0	0	0	124.2
408	Q	24.3	Very low	26.2	Very low	153 Å²	153	143.8 Å²	143.8	72%	0.715	77%	0.769	S	S	*	*				112.9	111.8	111.5	-162.5	133	17.5	0	0	122.7
409	T	24.1	Very low	26.2	Very low	100 Å²	100	142.1 Å²	142.1	61%	0.613	77%	0.768	S	S	*	*			trans	66.1	122.8	147.7	47.2	0	0	0	0	124.7
410	D	23.5	Very low	26.7	Very low	159 Å²	159	142.3 Å²	142.3	85%	0.85	77%	0.767	S	S	*	*			trans	62.5	124.3	130	-54.8	-23	0	0	0	123.2
411	G	27.4	Very low	27	Very low	79 Å²	79	143.3 Å²	143.3	81%	0.814	78%	0.777	S	S	*	*			trans	-178.2	105.1	171.5	0	0	0	0	0	112.5
412	Q	29.1	Very low	26.9	Very low	192 Å²	192	139.2 Å²	139.2	90%	0.897	77%	0.774	S	S	*	*			trans	-55.5	142.8	-165.9	-64.4	170.4	-13.7	0	0	118.1
413	K	26.8	Very low	27	Very low	165 Å²	165	138.9 Å²	138.9	72%	0.717	78%	0.776	S	S	*	*			trans	18.4	142.8	137.5	-110.7	-166.8	171.2	-148.9	0	120.4	D415	K413-D415 IonicContact NZ-OD1 2.87Å; K413-D415 PolarHBondContact NZ-OD1 3.22Å
414	P	29.6	Very low	27.1	Very low	117 Å²	117	135.2 Å²	135.2	76%	0.76	77%	0.766	S	S	*	*				-127.3	-173.6	98	38.9	-34.8	0	0	0	114.9
415	D	25.8	Very low	27.3	Very low	115 Å²	115	138.1 Å²	138.1	62%	0.615	77%	0.765	S	S	*	*			trans	-71.6	167.8	-169	-52.5	-71	0	0	0	114.7	K413	K413-D415 IonicContact NZ-OD1 2.87Å; K413-D415 PolarHBondContact NZ-OD1 3.22Å
416	I	31	Very low	27.5	Very low	162 Å²	162	140.5 Å²	140.5	83%	0.831	77%	0.765	S	S	*	*				-144.4	125	72.1	-78.9	162.8	0	0	0	113.5
417	S	28.2	Very low	27.5	Very low	90 Å²	90	140.5 Å²	140.5	63%	0.629	77%	0.767	S	S	*	*			trans	22.2	139.9	153.7	77.2	0	0	0	0	125.2
418	K	30.5	Very low	27.9	Very low	202 Å²	202	134.2 Å²	134.2	88%	0.878	76%	0.762	S	S	*	*			trans	78.1	93.3	141.9	-74.2	174.3	179.4	-179.2	0	121.4
419	L	25.3	Very low	28.1	Very low	164 Å²	164	136.5 Å²	136.5	86%	0.859	77%	0.773	S	S	*	*				-71.6	177.6	129.9	-77.3	161.8	0	0	0	110.5
420	P	34.2	Very low	28.2	Very low	127 Å²	127	138.8 Å²	138.8	83%	0.825	79%	0.787	S	S	*	*			cis	-127.3	174.7	-2.9	40.7	-25.9	0	0	0	115
421	G	30.7	Very low	28.4	Very low	82 Å²	82	138.9 Å²	138.9	85%	0.845	78%	0.782	S	S	*	*			trans	177.7	128.5	165.5	0	0	0	0	0	111.6
422	S	25.7	Very low	28.6	Very low	120 Å²	120	143.7 Å²	143.7	84%	0.839	78%	0.781	S	S	*	*			trans	-124.5	179.8	-175.2	-170	0	0	0	0	111.5
423	V	29.4	Very low	28.7	Very low	118 Å²	118	143 Å²	143	72%	0.715	78%	0.777	S	S	*	*			trans	95.7	96.2	168.4	-173.5	0	0	0	0	116.7
424	T	27.1	Very low	29	Very low	103 Å²	103	141.3 Å²	141.3	63%	0.632	78%	0.783	S	S	*	*			trans	38.1	155.3	134.5	71.2	0	0	0	0	122.1
425	F	27.8	Very low	28.8	Very low	173 Å²	173	138.4 Å²	138.4	76%	0.759	76%	0.764	S	S	*	*			cis	-149.1	161	19.8	-104	-70.3	0	0	0	111.8
426	H	27.1	Very low	29	Very low	151 Å²	151	138.2 Å²	138.2	70%	0.699	77%	0.772	S	S	*	*			trans	31.8	136.1	150.3	-78.7	-21.2	0	0	0	125.1
427	H	25.2	Very low	29.1	Very low	181 Å²	181	139.8 Å²	139.8	84%	0.838	77%	0.769	S	S	*	*			trans	61.7	102.4	147.5	-69.4	94.5	0	0	0	119.3
428	G	32.6	Very low	29.2	Very low	65 Å²	65	142.2 Å²	142.2	67%	0.67	77%	0.77	S	S	*	*			trans	175.2	110.1	166.6	0	0	0	0	0	110	T430	G428-T430 PolarHBondContact O-N 2.91Å; G428-T430 VanDerWaalsContact O-N 3.13Å
429	E	28.1	Very low	28.9	Very low	202 Å²	202	139.7 Å²	139.7	94%	0.944	77%	0.767	S	S	*	*			trans	-77.8	100.9	-165.5	-62.7	-179.9	124.3	0	0	112.7	Q431	E429-Q431 PolarHBondContact O-N 3.26Å
430	T	27.7	Very low	29.3	Very low	148 Å²	148	137.2 Å²	137.2	91%	0.908	76%	0.761	S	S	*	*			trans	-72.7	95.6	-178.4	48	0	0	0	0	112.8	G428	G428-T430 PolarHBondContact O-N 2.91Å; G428-T430 VanDerWaalsContact O-N 3.13Å
431	Q	27.7	Very low	28.9	Very low	160 Å²	160	135.3 Å²	135.3	75%	0.748	76%	0.755	S	S	*	*			trans	-86.6	155.3	164.1	-155.8	-173.9	86.4	0	0	110.7	E429	E429-Q431 PolarHBondContact O-N 3.26Å
432	K	30.1	Very low	28.6	Very low	180 Å²	180	136.1 Å²	136.1	78%	0.783	75%	0.748	S	S	*	*			trans	80	98.2	166.8	-53.3	177.3	-176.4	174.4	0	117.7
433	H	31.5	Very low	28.7	Very low	179 Å²	179	136.9 Å²	136.9	83%	0.829	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-69.5	159.6	147.3	-72	-95.6	0	0	0	110.7
434	P	33.8	Very low	28.4	Very low	129 Å²	129	138 Å²	138	84%	0.838	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-67	152.6	178.1	-18.6	32.6	0	0	0	113.5
435	C	26.2	Very low	28.3	Very low	55 Å²	55	140.6 Å²	140.6	37%	0.372	74%	0.742	S	S	.	*	P	Polyproline II helix	trans	-93.8	141.9	-174.9	-45.7	0	0	0	0	113.4	L233 N234	L233-C435 HydrophobicContact CD2-CB 3.66Å; N234-C435 WeakPolarHBondContact OD1-CB 3.12Å
436	S	29.6	Very low	28.1	Very low	111 Å²	111	138.5 Å²	138.5	78%	0.776	74%	0.739	S	S	*	*			trans	-135.7	87.5	162	63.2	0	0	0	0	111.9
437	Y	32.1	Very low	28	Very low	195 Å²	195	135.6 Å²	135.6	77%	0.765	74%	0.735	S	S	*	*			trans	55.7	159.7	158.4	-78.5	-89.3	0	0	0	121
438	Q	31.3	Very low	28	Very low	141 Å²	141	132.7 Å²	132.7	66%	0.659	74%	0.735	S	S	*	*			trans	-114.1	153.5	-168.5	-72.6	165.9	-118.5	0	0	112.7
439	N	24.7	Very low	27.8	Very low	150 Å²	150	135.2 Å²	135.2	80%	0.802	74%	0.743	S	S	*	*			trans	-43.6	162.2	150.5	-107.2	-38.8	0	0	0	112.5
440	P	32.6	Very low	27.8	Very low	112 Å²	112	130.2 Å²	130.2	73%	0.727	74%	0.736	S	S	*	*			cis	-147.3	170.4	41.5	42.8	-24.5	0	0	0	118.6
441	A	25.9	Very low	27.7	Very low	86 Å²	86	130.7 Å²	130.7	71%	0.711	73%	0.73	S	S	*	*			trans	62.5	147.4	143.7	0	0	0	0	0	119.4
442	S	23.7	Very low	28	Very low	99 Å²	99	129.9 Å²	129.9	69%	0.692	74%	0.736	S	S	*	*			cis	-166.4	-170.1	-13	51.2	0	0	0	0	108.4
443	L	27.9	Very low	27.9	Very low	136 Å²	136	127.1 Å²	127.1	71%	0.712	73%	0.73	S	S	*	*			trans	72.4	107.4	164	-61	167.5	0	0	0	118.7
444	Q	24.2	Very low	27.8	Very low	142 Å²	142	127.5 Å²	127.5	66%	0.664	73%	0.729	S	S	*	*				82.9	138.5	119.6	-77.6	177.2	-28.8	0	0	123.2
445	F	25	Very low	27.7	Very low	157 Å²	157	127 Å²	127	69%	0.689	72%	0.723	S	S	*	*			trans	68.3	101.4	144.6	-67.6	-48.2	0	0	0	121.9
446	N	23.8	Very low	27.9	Very low	129 Å²	129	131 Å²	131	69%	0.69	74%	0.742	S	S	*	*				71.1	112.7	112.4	-75.5	17.4	0	0	0	121.5
447	S	24.4	Very low	27.8	Very low	90 Å²	90	135 Å²	135	63%	0.629	75%	0.745	S	S	*	*				81.9	117.5	111.4	-56.8	0	0	0	0	120.9
448	S	24.7	Very low	28	Very low	120 Å²	120	130.9 Å²	130.9	84%	0.839	74%	0.742	S	S	*	*				74.7	136.4	125.5	-56	0	0	0	0	119.9
449	S	28	Very low	28	Very low	119 Å²	119	128.8 Å²	128.8	83%	0.832	74%	0.743	S	S	*	*	S	Bend	trans	-76.1	144.2	-176	-50.1	0	0	0	0	114
450	A	29.1	Very low	28.2	Very low	97 Å²	97	127.3 Å²	127.3	80%	0.802	74%	0.735	S	S	*	*			trans	55.2	97	150.1	0	0	0	0	0	118.4
451	M	26	Very low	28.1	Very low	158 Å²	158	128.3 Å²	128.3	78%	0.778	73%	0.734	S	S	*	*			trans	-68	140.5	154.5	-62.1	166.9	69	0	0	110.8	N453	M451-N453 WeakPolarHBondContact CE-OD1 3.46Å
452	T	32.5	Very low	28.2	Very low	143 Å²	143	130 Å²	130	88%	0.877	74%	0.736	S	S	*	*			trans	-105.3	109.9	151.6	52.3	0	0	0	0	108.7
453	N	28.9	Very low	28.3	Very low	122 Å²	122	129.9 Å²	129.9	65%	0.652	74%	0.735	S	S	*	*			trans	-63.7	169	174.1	-67.5	-71.5	0	0	0	110.7	M451	M451-N453 WeakPolarHBondContact CE-OD1 3.46Å
454	K	29.9	Very low	28.4	Very low	186 Å²	186	134.1 Å²	134.1	81%	0.809	74%	0.743	S	S	*	*			cis	-172.2	177.1	35.6	-156.1	168.8	-173.9	-176.6	0	110.9
455	V	31	Very low	28.6	Very low	118 Å²	118	134.6 Å²	134.6	72%	0.715	75%	0.747	S	S	*	*			trans	77.2	123.8	166	-176.2	0	0	0	0	114.4
456	D	29.8	Very low	28.8	Very low	141 Å²	141	133.1 Å²	133.1	75%	0.754	75%	0.751	S	S	*	*			cis	-152	177.2	-6.7	-112.6	-7.1	0	0	0	113.5
457	F	28.1	Very low	28.9	Very low	194 Å²	194	131.8 Å²	131.8	85%	0.851	75%	0.752	S	S	*	*			trans	-88.7	-175.5	-175.3	-80.3	-91.9	0	0	0	113.2
458	P	36.7	Very low	29.1	Very low	108 Å²	108	133.4 Å²	133.4	70%	0.701	76%	0.758	S	S	*	*			cis	-144.1	172.7	12.2	45.5	-26.9	0	0	0	119.8
459	S	30.3	Very low	29.5	Very low	97 Å²	97	133.6 Å²	133.6	68%	0.678	76%	0.756	S	S	*	*			trans	62.9	152	140.3	-69.1	0	0	0	0	122.9
460	N	30.7	Very low	29.7	Very low	120 Å²	120	134.7 Å²	134.7	64%	0.642	76%	0.757	S	S	*	*			cis	-160.9	157.9	-12	-112.2	31.9	0	0	0	110.5
461	D	29.3	Very low	29.8	Very low	132 Å²	132	133.3 Å²	133.3	71%	0.706	75%	0.753	S	S	*	*			trans	47.7	160.5	137.8	-57.9	-19.6	0	0	0	124.4
462	V	28.7	Very low	30	Very low	121 Å²	121	134.3 Å²	134.3	73%	0.733	76%	0.756	S	S	*	*			cis	-167.5	148.7	-45.6	115.7	0	0	0	0	109.3
463	S	25.4	Very low	29.8	Very low	97 Å²	97	135 Å²	135	68%	0.678	75%	0.753	S	S	*	*			trans	25	135.3	160.7	-54.4	0	0	0	0	123
464	Y	30.1	Very low	30.1	Very low	225 Å²	225	134 Å²	134	88%	0.882	75%	0.754	S	S	*	*			trans	-146.6	161.4	130.9	-108.5	-77.9	0	0	0	113
465	M	27.5	Very low	30	Very low	152 Å²	152	130.2 Å²	130.2	75%	0.749	75%	0.75	S	S	*	*			trans	-62.5	177.9	-168.7	-51	169	94	0	0	114.9
466	T	29.9	Very low	29.8	Very low	126 Å²	126	135.9 Å²	135.9	77%	0.773	76%	0.759	S	S	*	*			cis	-158.3	174.2	19.6	-25.3	0	0	0	0	111.6
467	S	25.2	Very low	29.6	Very low	102 Å²	102	133.7 Å²	133.7	71%	0.713	76%	0.755	S	S	*	*			trans	-84.4	155.5	172	51.6	0	0	0	0	114.6
468	V	30.2	Very low	29.5	Very low	123 Å²	123	129.4 Å²	129.4	75%	0.745	74%	0.741	S	S	*	*				167.9	135.8	129.7	151.5	0	0	0	0	110.9	V470	V468-V470 HydrophobicContact CG1-CG2 4.16Å
469	P	32.5	Very low	29	Very low	124 Å²	124	130.4 Å²	130.4	81%	0.805	73%	0.732	S	S	*	*			trans	-104.3	135.8	174.9	36.8	-30	0	0	0	113.9
470	V	31.6	Very low	28.9	Very low	142 Å²	142	132.2 Å²	132.2	86%	0.861	73%	0.729	S	S	*	*			trans	-149.8	148.2	170.2	-175	0	0	0	0	109.4	V468	V468-V470 HydrophobicContact CG1-CG2 4.16Å
471	G	31.3	Very low	28.7	Very low	69 Å²	69	131.6 Å²	131.6	71%	0.711	73%	0.73	S	S	*	*			trans	116.2	111.9	156.8	0	0	0	0	0	116.7
472	Q	30.8	Very low	28.7	Very low	178 Å²	178	133 Å²	133	83%	0.832	73%	0.731	S	S	*	*			trans	-67.3	151.7	176.6	-68	137.7	-50.6	0	0	114.4
473	L	27.1	Very low	28.8	Very low	157 Å²	157	132.4 Å²	132.4	82%	0.822	72%	0.724	S	S	*	*			trans	26.8	154.5	134	-64.5	139.7	0	0	0	120.9
474	P	35.7	Very low	29.1	Very low	102 Å²	102	131.4 Å²	131.4	66%	0.662	71%	0.711	S	S	*	*			cis	-143.4	-179	-27.7	37.3	-17.6	0	0	0	115.6
475	S	28.4	Very low	29.2	Very low	106 Å²	106	123.6 Å²	123.6	74%	0.741	69%	0.689	S	S	*	*			trans	99.7	119.7	150.2	-46	0	0	0	0	122.6
476	R	26.2	Very low	29.5	Very low	237 Å²	237	123.9 Å²	123.9	89%	0.894	68%	0.683	S	S	*	*			trans	51.1	115.5	136.6	-76.4	-173.5	171.3	-176.5	-2.5	123.4
477	S	26.2	Very low	29.6	Very low	96 Å²	96	125.1 Å²	125.1	67%	0.671	68%	0.684	S	S	*	*				55.3	137.7	128	67.1	0	0	0	0	121.2
478	N	25.2	Very low	29.8	Very low	104 Å²	104	125.5 Å²	125.5	56%	0.556	69%	0.687	S	S	*	*			cis	-158.9	-174.4	21.5	-79.8	-47.8	0	0	0	111.2
479	Y	27.1	Very low	29.9	Very low	129 Å²	129	124.4 Å²	124.4	51%	0.506	69%	0.685	S	S	.	*			trans	85	148.5	165.2	-52.2	-58.7	0	0	0	118	Y516	Y479-Y516 PolarHBondContact OH-O 3.24Å
480	Q	27.2	Very low	29.7	Very low	135 Å²	135	125.1 Å²	125.1	63%	0.631	69%	0.687	S	S	*	*			cis	100.1	142.9	20.8	-78	-159.4	56.3	0	0	115.3	H514	Q480-H514 PolarHBondContact NE2-O 3.35Å
481	V	27.4	Very low	29.8	Very low	107 Å²	107	123.4 Å²	123.4	65%	0.648	68%	0.678	S	S	*	*			cis	-169.6	-175.4	-10.4	65.3	0	0	0	0	110.9
482	H	29.5	Very low	29.7	Very low	161 Å²	161	125.1 Å²	125.1	75%	0.745	68%	0.68	S	S	*	*			trans	74.6	156.2	175.7	-72.1	-57.8	0	0	0	118.4
483	N	30.2	Very low	29.4	Very low	108 Å²	108	122 Å²	122	58%	0.578	68%	0.676	S	S	*	*			cis	-166.6	164.9	-37	-130.2	-3.7	0	0	0	112.6	Q497	N483-Q497 PolarHBondContact OD1-NE2 3.08Å
484	N	30.8	Very low	29.4	Very low	76 Å²	76	122.4 Å²	122.4	41%	0.406	68%	0.677	S	S	.	*			trans	78.9	153	164.5	-75	3.4	0	0	0	121.1	S498 N499	N484-S498 VanDerWaalsContact OD1-CB 3.26Å; N484-S498 WeakPolarHBondContact OD1-CB 3.48Å; N484-S498 PolarHBondContact OD1-OG 3.2Å; N484-N499 PolarHBondContact ND2-OD1 2.95Å; N484-N499 PolarHBondContact OD1-OD1 3.27Å
485	S	32.1	Very low	29.1	Very low	61 Å²	61	122.4 Å²	122.4	43%	0.427	68%	0.678	S	S	.	*			cis	-171	154.1	-8.1	51.3	0	0	0	0	117.2	Q497 S498	S485-Q497 CarbonylContact C-O 3.51Å; S485-Q497 VanDerWaalsContact CA-O 3.24Å; S485-Q497 WeakPolarHBondContact CA-O 3.16Å; S485-S498 VanDerWaalsContact CA-OG 3.24Å; S485-S498 WeakPolarHBondContact CA-OG 3.38Å; S485-S498 WeakPolarHBondContact CB-OG 3.17Å
486	Y	34.9	Very low	29.1	Very low	159 Å²	159	123.3 Å²	123.3	62%	0.624	68%	0.678	S	S	*	*			trans	94	119.5	154.1	-72.6	-63.6	0	0	0	123.8	Q497 S498 N499	Y486-Q497 PolarHBondContact N-O 3.49Å; Y486-S498 WeakPolarHBondContact CA-O 3.17Å; Y486-S498 PolarHBondContact N-O 3.02Å; Y486-N499 HydrophobicContact CD1-CB 4.32Å; Y486-N499 HydrophobicContact CE1-CB 3.98Å; Y486-N499 HydrophobicContact CE2-CB 4.38Å
487	L	32.2	Very low	29.3	Very low	151 Å²	151	116.3 Å²	116.3	79%	0.791	66%	0.656	S	S	*	*			trans	68.4	95.9	141.5	-73.5	165.7	0	0	0	124.8
488	S	29.7	Very low	29.5	Very low	110 Å²	110	114 Å²	114	77%	0.769	64%	0.639	S	S	*	*			trans	37.1	115.5	131.1	-164.7	0	0	0	0	123
489	S	32.2	Very low	29.7	Very low	101 Å²	101	111.5 Å²	111.5	71%	0.706	63%	0.626	S	S	*	*				174.9	126.4	102.6	42.5	0	0	0	0	115.2
490	V	28.5	Very low	29.8	Very low	138 Å²	138	110.6 Å²	110.6	84%	0.836	63%	0.63	S	S	*	*			trans	49.9	135.6	147.5	-170	0	0	0	0	120.5
491	P	33.3	Very low	29.9	Very low	106 Å²	106	110.7 Å²	110.7	69%	0.688	64%	0.635	S	S	*	*			cis	-126.8	177	-22.6	38.9	-22.7	0	0	0	113.8
492	S	27.9	Very low	30.1	Very low	106 Å²	106	115.2 Å²	115.2	74%	0.741	64%	0.642	S	S	*	*	S	Bend	trans	60.7	115.7	168.2	63.2	0	0	0	0	118.4
493	C	25.8	Very low	30.1	Very low	112 Å²	112	112.9 Å²	112.9	76%	0.757	63%	0.634	S	S	*	*	S	Bend	trans	62.7	78.1	151.8	-53.6	0	0	0	0	119.6
494	I	26.6	Very low	30.1	Very low	165 Å²	165	109.7 Å²	109.7	85%	0.846	63%	0.626	S	S	*	*			trans	73.4	142	137.4	-59.7	164	0	0	0	116.1
495	P	29.2	Very low	30.1	Very low	103 Å²	103	109.6 Å²	109.6	67%	0.669	63%	0.632	S	S	*	*			cis	-133.5	160.9	-12.5	36.9	-19.1	0	0	0	117.1
496	V	28.3	Very low	29.9	Very low	125 Å²	125	111.3 Å²	111.3	76%	0.758	64%	0.636	S	S	*	*			trans	66.8	140.4	138.1	168.8	0	0	0	0	118.3
497	Q	31.3	Very low	29.6	Very low	89 Å²	89	110.3 Å²	110.3	42%	0.416	64%	0.641	S	S	.	*			cis	-156.6	140.3	32.6	-151.5	148.4	9.3	0	0	115.6	N483 S485 Y486	N483-Q497 PolarHBondContact OD1-NE2 3.08Å; S485-Q497 CarbonylContact C-O 3.51Å; S485-Q497 VanDerWaalsContact CA-O 3.24Å; S485-Q497 WeakPolarHBondContact CA-O 3.16Å; Y486-Q497 PolarHBondContact N-O 3.49Å
498	S	30.4	Very low	29.4	Very low	47 Å²	47	109.3 Å²	109.3	33%	0.329	64%	0.637	S	S	.	*			trans	65.7	154.1	147.2	142.3	0	0	0	0	120.2	N484 S485 Y486	N484-S498 VanDerWaalsContact OD1-CB 3.26Å; N484-S498 WeakPolarHBondContact OD1-CB 3.48Å; N484-S498 PolarHBondContact OD1-OG 3.2Å; S485-S498 VanDerWaalsContact CA-OG 3.24Å; S485-S498 WeakPolarHBondContact CA-OG 3.38Å; S485-S498 WeakPolarHBondContact CB-OG 3.17Å; Y486-S498 WeakPolarHBondContact CA-O 3.17Å; Y486-S498 PolarHBondContact N-O 3.02Å
499	N	28.7	Very low	29.4	Very low	53 Å²	53	112 Å²	112	28%	0.283	64%	0.637	S	S	.	*			cis	-152.6	147.9	48.4	-147.2	-0.7	0	0	0	117.3	N484 Y486	N484-N499 PolarHBondContact ND2-OD1 2.95Å; N484-N499 PolarHBondContact OD1-OD1 3.27Å; Y486-N499 HydrophobicContact CD1-CB 4.32Å; Y486-N499 HydrophobicContact CE1-CB 3.98Å; Y486-N499 HydrophobicContact CE2-CB 4.38Å
500	N	30.2	Very low	29.2	Very low	110 Å²	110	112.6 Å²	112.6	59%	0.588	64%	0.637	S	S	*	*			trans	57	110.3	154.8	-70.8	-20.8	0	0	0	124.3
501	N	29.6	Very low	29.3	Very low	136 Å²	136	112.4 Å²	112.4	73%	0.727	64%	0.635	S	S	*	*				93	141.5	123	-68.9	-18	0	0	0	124.1
502	Y	30.2	Very low	29.1	Very low	202 Å²	202	111.9 Å²	111.9	79%	0.792	63%	0.634	S	S	*	*			trans	76.4	97.2	165.4	-82.3	-79.7	0	0	0	121.6
503	I	29.7	Very low	29.1	Very low	113 Å²	113	111.4 Å²	111.4	58%	0.579	63%	0.631	S	S	*	*			trans	39.9	113.6	138.8	-45	177.9	0	0	0	117.3
504	G	30.6	Very low	29.4	Very low	40 Å²	40	112.9 Å²	112.9	41%	0.412	63%	0.626	S	S	.	*			cis	177.5	-111.2	14.4	0	0	0	0	0	115.8	A1801 N1802	G504-A1801 VanDerWaalsContact C-C 3.43Å; G504-A1801 CarbonylContact C-O 3.14Å; G504-A1801 PolarHBondContact N-O 2.93Å; G504-A1801 CarbonylContact O-C 3.56Å; G504-A1801 PolarHBondContact O-N 2.85Å; G504-N1802 CarbonylContact C-O 3.57Å; G504-N1802 WeakPolarHBondContact CA-O 3.36Å; G504-N1802 PolarHBondContact N-O 3.44Å
505	S	29.7	Very low	29.5	Very low	75 Å²	75	107.5 Å²	107.5	52%	0.524	61%	0.606	S	S	.	*	B	Isolated β-bridge	trans	-88.1	138.6	-154.1	61.9	0	0	0	0	118.6	A1801 N1802	S505-A1801 VanDerWaalsContact C-CB 3.45Å; S505-A1801 WeakPolarHBondContact O-CB 3.45Å; S505-N1802 PolarHBondContact N-O 3.24Å; S505-N1802 WeakPolarHBondContact O-CB 3.37Å; S505-N1802 PolarHBondContact O-N 3.22Å; S505-N1802 PolarHBondContact O-ND2 2.97Å
506	N	28.8	Very low	29.3	Very low	96 Å²	96	110.4 Å²	110.4	51%	0.513	61%	0.605	S	S	.	*			trans	-144.3	177.8	144.9	-107.8	-27.2	0	0	0	109	A1801	N506-A1801 HydrophobicContact CB-CB 3.45Å; N506-A1801 VanDerWaalsContact CB-CB 3.45Å; N506-A1801 WeakPolarHBondContact ND2-CB 3.39Å
507	N	29.6	Very low	29.3	Very low	139 Å²	139	109.7 Å²	109.7	74%	0.743	60%	0.601	S	S	*	*			trans	-77.8	128.6	-157.7	-60.3	-49.8	0	0	0	115.5
508	N	26.9	Very low	29.1	Very low	129 Å²	129	114 Å²	114	69%	0.69	62%	0.619	S	S	*	*			trans	77.3	120.5	136	-62.9	-8.8	0	0	0	122.3
509	H	29.5	Very low	29.1	Very low	166 Å²	166	118.1 Å²	118.1	77%	0.769	64%	0.637	S	S	*	*			trans	72	145	150.5	-60.3	-48.6	0	0	0	118.1
510	T	28.5	Very low	29.1	Very low	115 Å²	115	120.1 Å²	120.1	71%	0.706	66%	0.655	S	S	*	*			cis	-157.2	146.9	16.7	-4.8	0	0	0	0	112.1
511	V	29.9	Very low	29.2	Very low	134 Å²	134	121.7 Å²	121.7	81%	0.812	66%	0.663	S	S	*	*			trans	60.8	134.4	139.5	171.2	0	0	0	0	118.8
512	S	29.9	Very low	29.4	Very low	95 Å²	95	122 Å²	122	66%	0.664	67%	0.665	S	S	*	*			cis	-160.2	161.4	7.6	-143.6	0	0	0	0	113.9
513	S	28.6	Very low	29.4	Very low	96 Å²	96	116.9 Å²	116.9	67%	0.671	66%	0.659	S	S	*	*			trans	63.4	142.9	143.1	-60.6	0	0	0	0	121.1
514	H	30.9	Very low	29.5	Very low	143 Å²	143	120.8 Å²	120.8	66%	0.662	67%	0.671	S	S	*	*			cis	-150.2	153.8	3.8	-135.7	-70.9	0	0	0	113.1	Q480	Q480-H514 PolarHBondContact NE2-O 3.35Å
515	A	28.8	Very low	29.5	Very low	51 Å²	51	126 Å²	126	42%	0.421	70%	0.695	S	S	.	*			trans	-58.2	174.2	-178.3	0	0	0	0	0	116.1
516	Y	25.9	Very low	29.5	Very low	164 Å²	164	130.5 Å²	130.5	64%	0.643	71%	0.713	S	S	*	*			cis	-161.6	-174.5	33.3	-76.8	-93.9	0	0	0	112.8	Y479	Y479-Y516 PolarHBondContact OH-O 3.24Å
517	V	26.8	Very low	29.5	Very low	110 Å²	110	134.5 Å²	134.5	67%	0.667	73%	0.728	S	S	*	*			trans	76	134.3	154.1	-171.5	0	0	0	0	116.4
518	F	28.1	Very low	29.4	Very low	181 Å²	181	136.1 Å²	136.1	79%	0.794	73%	0.731	S	S	*	*			cis	-143.3	168.6	-1.7	-122.1	-46.1	0	0	0	109
519	N	30.5	Very low	29.4	Very low	132 Å²	132	135.3 Å²	135.3	71%	0.706	74%	0.736	S	S	*	*			trans	63.5	109.8	157.4	-66.4	2.6	0	0	0	118.5
520	S	28.5	Very low	29.4	Very low	95 Å²	95	132.1 Å²	132.1	66%	0.664	74%	0.738	S	S	*	*				68.8	114.4	98.8	74	0	0	0	0	113.7
521	D	32.3	Very low	29.3	Very low	144 Å²	144	137.5 Å²	137.5	77%	0.77	75%	0.747	S	S	*	*				-154.3	174.3	52.4	-84.5	-40.7	0	0	0	115.7
522	N	33.2	Very low	29.5	Very low	142 Å²	142	136.1 Å²	136.1	76%	0.759	74%	0.741	S	S	*	*			trans	64.4	91	158.4	-67.3	-33.5	0	0	0	120.2
523	S	31.2	Very low	29.4	Very low	94 Å²	94	138.7 Å²	138.7	66%	0.657	75%	0.746	S	S	*	*				29.4	143.3	120.8	64.2	0	0	0	0	121.5
524	K	30.9	Very low	29.4	Very low	195 Å²	195	141.6 Å²	141.6	85%	0.848	75%	0.746	S	S	*	*			cis	-170.3	129.3	-0.7	-112.6	171.4	-175.6	174	0	108.8
525	T	31.3	Very low	29.3	Very low	149 Å²	149	139 Å²	139	91%	0.914	74%	0.738	S	S	*	*			trans	-165.6	125.1	148.2	9.9	0	0	0	0	108.9
526	L	29.2	Very low	29.6	Very low	171 Å²	171	143.2 Å²	143.2	90%	0.895	75%	0.753	S	S	*	*			trans	-150.6	175.6	177.4	-150.5	119.7	0	0	0	111.4
527	Q	29.4	Very low	29.7	Very low	180 Å²	180	143.9 Å²	143.9	84%	0.841	76%	0.755	S	S	*	*			trans	-81.4	-175.3	-161.7	-64.7	174	-25.7	0	0	115.3
528	Q	27.5	Very low	30.3	Very low	172 Å²	172	143.3 Å²	143.3	80%	0.804	75%	0.754	S	S	*	*			trans	-68.6	139	-178.3	-66.6	167.6	-23	0	0	113.8
529	S	27.2	Very low	30.4	Very low	113 Å²	113	145.1 Å²	145.1	79%	0.79	76%	0.756	S	S	*	*			trans	29.4	108.9	144.7	62.4	0	0	0	0	120.4
530	A	30.1	Very low	30.7	Very low	98 Å²	98	144.6 Å²	144.6	81%	0.81	76%	0.758	S	S	*	*				-165.6	142.7	106.4	0	0	0	0	0	110.7
531	Y	26	Very low	30.5	Very low	228 Å²	228	143.7 Å²	143.7	89%	0.894	75%	0.751	S	S	*	*			trans	-82.2	149.1	168.9	-76.7	-91.5	0	0	0	109.9
532	P	34	Very low	30.4	Very low	106 Å²	106	144.3 Å²	144.3	69%	0.688	75%	0.749	S	S	*	*				-143.2	155.5	94.5	38.9	-25.8	0	0	0	115
533	I	27.4	Very low	30.1	Very low	148 Å²	148	146.5 Å²	146.5	76%	0.759	75%	0.752	S	S	*	*			trans	61.8	127.3	141.2	-68.1	170.2	0	0	0	117.9
534	K	28.4	Very low	30.5	Very low	158 Å²	158	147.7 Å²	147.7	69%	0.687	76%	0.757	S	S	*	*			cis	-165.6	168.9	-6.8	-119.9	174.5	160.4	-108.5	0	109.3
535	D	28.4	Very low	30.3	Very low	89 Å²	89	147.7 Å²	147.7	48%	0.476	75%	0.752	S	S	.	*			trans	31.6	126	143	-44.9	-21.8	0	0	0	118.6
536	N	34.7	Very low	30	Very low	139 Å²	139	146.8 Å²	146.8	74%	0.743	74%	0.737	S	S	*	*			cis	-142.9	142.6	29.7	-83	-70.7	0	0	0	110.9
537	Y	28.2	Very low	29.9	Very low	177 Å²	177	149 Å²	149	69%	0.694	73%	0.734	S	S	*	*				63.1	154	68.6	-77.7	-72.4	0	0	0	113.6
538	P	40.2	Very low	29.8	Very low	99 Å²	99	146.2 Å²	146.2	64%	0.643	73%	0.725	S	S	*	*			cis	-138.2	145.5	4.5	27.2	-3.9	0	0	0	118.7
539	R	29.9	Very low	30	Very low	218 Å²	218	146.2 Å²	146.2	82%	0.823	72%	0.722	S	S	*	*			trans	59.5	176.1	135.8	-53.4	171	-177.4	-174.3	-1	117.9
540	T	35.9	Very low	30	Very low	122 Å²	122	145.8 Å²	145.8	75%	0.748	72%	0.719	S	S	*	*			cis	-123.8	144.1	-8.8	44.3	0	0	0	0	108.7
541	S	25.3	Very low	30.1	Very low	75 Å²	75	149 Å²	149	52%	0.524	72%	0.715	S	S	.	*			cis	91.7	140.1	25.3	81.4	0	0	0	0	116.5
542	H	30.1	Very low	30.4	Very low	158 Å²	158	144 Å²	144	73%	0.731	70%	0.703	S	S	*	*			trans	82.8	131	179.4	-48.6	-76.5	0	0	0	115.8
543	K	26.7	Very low	30.3	Very low	188 Å²	188	142.6 Å²	142.6	82%	0.817	70%	0.701	S	S	*	*			cis	77.1	150	37.2	-70.1	-171.1	174.4	-172.3	0	113.5
544	P	39.5	Very low	30.7	Very low	118 Å²	118	142.9 Å²	142.9	77%	0.766	70%	0.702	S	S	*	*			cis	-138.4	-160.8	-21.9	34.4	-12	0	0	0	113.3
545	R	27.2	Very low	30.8	Very low	196 Å²	196	142.3 Å²	142.3	74%	0.74	70%	0.702	S	S	*	*			trans	91	120.6	142.2	-160.6	171.8	-171.8	-155.4	-13.1	120.7
546	E	25.2	Very low	30.7	Very low	129 Å²	129	147.9 Å²	147.9	60%	0.603	72%	0.718	S	S	*	*			trans	67.1	145.8	148.4	-75.3	161.5	-159.2	0	0	124.7
547	W	27.4	Very low	30.3	Very low	217 Å²	217	150.2 Å²	150.2	82%	0.822	72%	0.721	S	S	*	*			trans	83.3	110.6	148.2	-125.9	-97.8	0	0	0	122.7
548	N	26.9	Very low	30.6	Very low	123 Å²	123	147 Å²	147	66%	0.658	72%	0.722	S	S	*	*			trans	86.8	135.2	143.2	-108.9	-13	0	0	0	123.4
549	K	30.3	Very low	29.9	Very low	172 Å²	172	148.6 Å²	148.6	75%	0.748	73%	0.725	S	S	*	*			trans	64.7	103.5	158.9	-65.4	178.6	-178.2	-179.4	0	116
550	S	28	Very low	29.6	Very low	104 Å²	104	140.1 Å²	140.1	73%	0.727	70%	0.699	S	S	*	*				70.7	135.1	79.5	83.4	0	0	0	0	112.8
551	K	32.5	Very low	29.1	Very low	165 Å²	165	138.4 Å²	138.4	72%	0.717	69%	0.691	S	S	*	*			cis	-142.1	159.6	27.3	-104	-179.3	160.4	-88.3	0	112.1
552	D	31.9	Very low	29	Very low	122 Å²	122	136.9 Å²	136.9	65%	0.652	68%	0.681	S	S	*	*			trans	39	136.8	133.5	-45.8	-10.1	0	0	0	120.6
553	A	32.7	Very low	28.9	Very low	78 Å²	78	134 Å²	134	65%	0.645	67%	0.668	S	S	*	*			cis	-170.3	-178.7	-11.2	0	0	0	0	0	109.4
554	I	35.1	Very low	29.1	Very low	153 Å²	153	132.3 Å²	132.3	79%	0.785	66%	0.662	S	S	*	*			trans	69.7	127.4	154.8	-64.9	156.2	0	0	0	116.3
555	H	30.3	Very low	28.6	Very low	147 Å²	147	130.9 Å²	130.9	68%	0.681	66%	0.655	S	S	*	*			cis	-161.2	145.6	-18.5	-124.7	-149.9	0	0	0	109.7
556	Y	26.9	Very low	28.5	Very low	205 Å²	205	131.9 Å²	131.9	80%	0.804	66%	0.659	S	S	*	*			trans	61.6	131.5	145.6	-80	-116	0	0	0	122.7
557	K	25.5	Very low	28.7	Very low	188 Å²	188	132.1 Å²	132.1	82%	0.817	66%	0.664	S	S	*	*			trans	-76.2	162.7	156.5	-81.3	179.6	173.8	179.2	0	110.5
558	P	34.9	Very low	28.7	Very low	109 Å²	109	127.8 Å²	127.8	71%	0.708	66%	0.656	S	S	*	*			trans	-75.9	152.8	164.7	34.1	-36.1	0	0	0	111.8
559	L	25.4	Very low	28.8	Very low	134 Å²	134	128.3 Å²	128.3	70%	0.702	66%	0.659	S	S	*	*			trans	-163.6	153.7	144.3	-141.5	75.7	0	0	0	112.8	N1327 N1328	L559-N1327 CarbonylContact O-C 3.34Å; L559-N1328 PolarHBondContact O-N 3.41Å
560	S	24.7	Very low	28.8	Very low	40 Å²	40	124.7 Å²	124.7	28%	0.28	65%	0.651	S	S	.	*			trans	58.2	135.5	145.3	58.9	0	0	0	0	118.5	N1326 N1327 N1328	S560-N1326 PolarHBondContact OG-N 2.88Å; S560-N1327 CarbonylContact O-C 3.38Å; S560-N1327 WeakPolarHBondContact O-CA 3.25Å; S560-N1328 PolarHBondContact O-N 2.97Å
561	S	24.3	Very low	28.9	Very low	85 Å²	85	127.9 Å²	127.9	59%	0.594	65%	0.652	S	S	*	*				41.5	131.9	75.6	97.2	0	0	0	0	112	N1326	S561-N1326 WeakPolarHBondContact O-CA 3.38Å; S561-N1326 PolarHBondContact O-N 3.13Å; S561-N1326 PolarHBondContact O-OD1 2.92Å
562	S	24.3	Very low	28.5	Very low	43 Å²	43	124.5 Å²	124.5	30%	0.301	65%	0.65	S	S	.	*			cis	-172.4	161.4	31.4	23	0	0	0	0	108.9	N1326	S562-N1326 PolarHBondContact N-OD1 3Å; S562-N1326 PolarHBondContact O-ND2 3.31Å; S562-N1326 VanDerWaalsContact O-ND2 3.09Å; S562-N1326 PolarHBondContact O-OD1 2.84Å; S562-N1326 PolarHBondContact OG-OD1 3.39Å
563	H	27.7	Very low	28.4	Very low	98 Å²	98	129.8 Å²	129.8	45%	0.454	66%	0.66	S	S	.	*				177.3	174.4	107.9	-106.6	-61.6	0	0	0	113.7	N1325	H563-N1325 PolarHBondContact CD2-ND2 3.48Å; H563-N1325 VanDerWaalsContact NE2-CG 3.31Å; H563-N1325 PolarHBondContact NE2-ND2 3.05Å; H563-N1325 PolarHBondContact NE2-OD1 2.9Å
564	H	30.6	Very low	28.1	Very low	153 Å²	153	132.1 Å²	132.1	71%	0.708	66%	0.662	S	S	*	*			trans	44.9	94.4	156	-58.5	-37.2	0	0	0	116.9
565	S	29	Very low	27.8	Very low	87 Å²	87	129.7 Å²	129.7	61%	0.608	65%	0.654	S	S	*	*				80.7	149.5	64.6	73.1	0	0	0	0	114.7
566	R	26	Very low	27.7	Very low	218 Å²	218	127.9 Å²	127.9	82%	0.823	65%	0.648	S	S	*	*			trans	73.4	156.2	143	-96.2	178.2	173.2	179.9	-3.1	117.2
567	L	29.8	Very low	27.9	Very low	134 Å²	134	125.5 Å²	125.5	70%	0.702	64%	0.642	S	S	*	*			trans	62.3	99.1	159.8	-63.6	163.3	0	0	0	113.6
568	N	27	Very low	28	Very low	125 Å²	125	122.4 Å²	122.4	67%	0.668	63%	0.634	S	S	*	*				82.2	141.2	73	-82.7	23.7	0	0	0	111.2
569	N	28.3	Very low	27.7	Very low	135 Å²	135	125.7 Å²	125.7	72%	0.722	64%	0.638	S	S	*	*			trans	68.9	150.4	147.1	-65.8	-1.3	0	0	0	116.5
570	T	29.4	Very low	27.8	Very low	95 Å²	95	124.1 Å²	124.1	58%	0.583	64%	0.638	S	S	*	*			cis	-165.8	161.8	-19.2	21.6	0	0	0	0	107
571	K	31	Very low	27.9	Very low	172 Å²	172	127.5 Å²	127.5	75%	0.748	66%	0.662	S	S	*	*			trans	53	109	143	-65.8	162.6	-175.7	176.7	0	116.7
572	S	24.8	Very low	28.4	Very low	94 Å²	94	129 Å²	129	66%	0.657	66%	0.663	S	S	*	*				56.1	94.6	73.3	82.8	0	0	0	0	114.4
573	R	30	Very low	28.7	Very low	233 Å²	233	133.1 Å²	133.1	88%	0.879	68%	0.675	S	S	*	*			trans	-167	113.9	132.8	-100	160.1	-177.5	-175.5	-1.1	105.5
574	N	25.5	Very low	28.6	Very low	126 Å²	126	136.6 Å²	136.6	67%	0.674	69%	0.692	S	S	*	*				85.2	139.4	65.2	-79.9	29.6	0	0	0	111
575	V	29.3	Very low	28.6	Very low	102 Å²	102	133.6 Å²	133.6	62%	0.618	69%	0.694	S	S	*	*			trans	77.6	119.4	144.2	152.1	0	0	0	0	113.5
576	I	28.3	Very low	28.5	Very low	109 Å²	109	133.7 Å²	133.7	56%	0.559	69%	0.694	S	S	*	*			cis	-176.4	158.9	22.2	-139.6	-178	0	0	0	116.3
577	K	29.9	Very low	28.7	Very low	156 Å²	156	131.7 Å²	131.7	68%	0.678	69%	0.692	S	S	*	*			trans	67.8	125.4	151.2	-73.4	174.2	-166.8	148.3	0	123.7
578	N	27.2	Very low	28.8	Very low	123 Å²	123	131.7 Å²	131.7	66%	0.658	69%	0.693	S	S	*	*				74.4	150.4	120.1	-62.4	2.2	0	0	0	124.3
579	F	28.6	Very low	29.3	Very low	177 Å²	177	132.1 Å²	132.1	78%	0.776	70%	0.695	S	S	*	*			trans	37	111.1	146.9	-64.7	-55.9	0	0	0	119.1
580	S	27.6	Very low	29.6	Very low	101 Å²	101	137.2 Å²	137.2	71%	0.706	70%	0.704	S	S	*	*				68.5	107.2	86.2	-71.6	0	0	0	0	116.1
581	S	28.3	Very low	29.8	Very low	111 Å²	111	142.2 Å²	142.2	78%	0.776	72%	0.718	S	S	*	*			trans	85.3	144.3	137.5	-52.6	0	0	0	0	121.1
582	D	33.7	Very low	29.8	Very low	116 Å²	116	139.1 Å²	139.1	62%	0.62	72%	0.715	S	S	*	*			trans	84.1	98.2	146.6	-83.6	10.2	0	0	0	123.9
583	K	31.3	Very low	29.8	Very low	130 Å²	130	140.2 Å²	140.2	57%	0.565	72%	0.718	S	S	*	*				85.1	118.8	114.5	-73.8	179.8	-179.3	79.3	0	121.5
584	Q	26.1	Very low	29.6	Very low	172 Å²	172	133.7 Å²	133.7	80%	0.804	71%	0.708	S	S	*	*				55.3	110.2	123.1	-59.4	176.6	-5.7	0	0	120.8
585	A	30.6	Very low	29.5	Very low	90 Å²	90	132 Å²	132	74%	0.744	71%	0.706	S	S	*	*				-169.1	121	106.6	0	0	0	0	0	107.9
586	S	26.6	Very low	29.4	Very low	89 Å²	89	132.4 Å²	132.4	62%	0.622	71%	0.713	S	S	*	*				58.9	108.9	64.1	-169.7	0	0	0	0	113.5
587	F	29.7	Very low	29.4	Very low	175 Å²	175	133.9 Å²	133.9	77%	0.768	72%	0.721	S	S	*	*				-178.4	151.9	101	-100.9	-69.3	0	0	0	112.9
588	N	31.8	Very low	29.2	Very low	134 Å²	134	133.1 Å²	133.1	72%	0.717	73%	0.725	S	S	*	*			trans	67.6	144.6	161.6	-53	-20.8	0	0	0	116.6
589	D	36.9	Very low	29.3	Very low	135 Å²	135	133.8 Å²	133.8	72%	0.722	73%	0.728	S	S	*	*			cis	-154.1	112	1.2	-137.7	-33	0	0	0	112.4
590	R	35.6	Very low	29.3	Very low	242 Å²	242	135 Å²	135	91%	0.913	73%	0.727	S	S	*	*	S	Bend	trans	-173.2	89.6	136.6	-107.5	175.2	-177	-171.6	1.3	115.6
591	K	32.9	Very low	29.3	Very low	199 Å²	199	136.5 Å²	136.5	87%	0.865	73%	0.727	S	S	*	*			trans	64.3	128.2	144.4	-102.8	-177.2	175.7	-175.5	0	121.2
592	P	30.7	Very low	29.1	Very low	107 Å²	107	136 Å²	136	70%	0.695	72%	0.719	S	S	*	*			trans	-135.6	-156.8	-161.5	28.6	0.5	0	0	0	112.8
593	T	26.1	Very low	28.9	Very low	118 Å²	118	137.8 Å²	137.8	72%	0.724	72%	0.724	S	S	*	*			trans	23	147.4	136.7	57.7	0	0	0	0	121.1
594	S	24.3	Very low	28.8	Very low	95 Å²	95	136.1 Å²	136.1	66%	0.664	73%	0.725	S	S	*	*			cis	-180	178.1	-8.9	51.7	0	0	0	0	109.1
595	S	24.8	Very low	28.8	Very low	91 Å²	91	134.7 Å²	134.7	64%	0.636	72%	0.718	S	S	*	*			trans	53.4	126.7	141.3	62	0	0	0	0	121.3
596	S	26.5	Very low	28.8	Very low	110 Å²	110	137.9 Å²	137.9	77%	0.769	72%	0.715	S	S	*	*			trans	72.1	163.1	153.7	84.8	0	0	0	0	116.3
597	I	28.7	Very low	28.7	Very low	140 Å²	140	140.4 Å²	140.4	72%	0.718	72%	0.722	S	S	*	*			cis	-142.2	159.5	7.4	-145.1	148.5	0	0	0	111.4
598	N	25.1	Very low	28.7	Very low	141 Å²	141	138.6 Å²	138.6	75%	0.754	73%	0.725	S	S	*	*			trans	-10.3	134.5	166.3	-42.1	-24.2	0	0	0	117.8
599	D	29.6	Very low	28.6	Very low	137 Å²	137	139.6 Å²	139.6	73%	0.733	73%	0.731	S	S	*	*				-155.6	153.1	104.2	-143.7	-2	0	0	0	114.3
600	R	28.5	Very low	28.1	Very low	201 Å²	201	138.3 Å²	138.3	76%	0.758	73%	0.732	S	S	*	*			trans	41.5	135.8	150.4	-83.1	165.8	179.6	-139	-5.7	124
601	L	27.7	Very low	27.6	Very low	133 Å²	133	135.8 Å²	135.8	70%	0.696	73%	0.728	S	S	*	*			trans	73.5	125.4	141.8	-93.8	70.8	0	0	0	118.9
602	T	24.4	Very low	27.4	Very low	101 Å²	101	132 Å²	132	62%	0.62	72%	0.722	S	S	*	*				13.5	149.7	113.9	77	0	0	0	0	117.4
603	Q	29.4	Very low	27.4	Very low	154 Å²	154	132.9 Å²	132.9	72%	0.72	73%	0.725	S	S	*	*				-174.4	154.4	50.7	-145.1	158.3	105.1	0	0	110.6
604	T	28.4	Very low	27.6	Very low	95 Å²	95	135 Å²	135	58%	0.583	73%	0.727	S	S	*	*			trans	34.7	126.1	146.3	51.4	0	0	0	0	121.6
605	E	25.8	Very low	27.9	Very low	142 Å²	142	135.4 Å²	135.4	66%	0.664	73%	0.725	S	S	*	*			trans	73	163.4	131	-63.5	179.2	141.7	0	0	117.8
606	K	31.9	Very low	28.2	Very low	157 Å²	157	137.4 Å²	137.4	68%	0.683	73%	0.734	S	S	*	*			cis	-148.2	175.4	4	-134	146.3	-164.5	151.7	0	110.8
607	N	24.4	Very low	28.3	Very low	142 Å²	142	137 Å²	137	76%	0.759	73%	0.731	S	S	*	*			trans	-44.2	153.5	162.4	-53.7	-38.9	0	0	0	111.6
608	T	30.1	Very low	28.4	Very low	136 Å²	136	134.6 Å²	134.6	83%	0.834	73%	0.726	S	S	*	*				-162.2	160	65.1	38.8	0	0	0	0	115.2
609	N	28.6	Very low	28.5	Very low	156 Å²	156	136.7 Å²	136.7	83%	0.834	73%	0.729	S	S	*	*			trans	-96.3	143.7	164.9	-70.7	-50	0	0	0	111.6
610	S	26.5	Very low	28.5	Very low	108 Å²	108	137.4 Å²	137.4	76%	0.755	73%	0.732	S	S	*	*			trans	-157.6	116.2	154.3	53.4	0	0	0	0	108.2
611	F	25.3	Very low	28.5	Very low	188 Å²	188	132.8 Å²	132.8	83%	0.825	73%	0.731	S	S	*	*				53.2	132.4	70.9	-77.6	-91.7	0	0	0	112.6
612	T	29.3	Very low	28.6	Very low	121 Å²	121	132 Å²	132	74%	0.742	74%	0.736	S	S	*	*				-155.9	168.1	58.8	39.2	0	0	0	0	115.3
613	V	30.1	Very low	28.8	Very low	124 Å²	124	130.6 Å²	130.6	75%	0.752	74%	0.742	S	S	*	*			trans	72.9	144.4	154.8	153.1	0	0	0	0	116.7
614	Q	31.2	Very low	28.8	Very low	164 Å²	164	128.7 Å²	128.7	77%	0.766	75%	0.746	S	S	*	*			cis	178.6	156.7	-24.6	-116.7	-174	-35.2	0	0	106.7
615	T	29.9	Very low	28.8	Very low	103 Å²	103	133.7 Å²	133.7	63%	0.632	76%	0.763	S	S	*	*			cis	-161.8	170.8	-14	-12.2	0	0	0	0	109.3
616	T	30.7	Very low	29.1	Very low	132 Å²	132	130 Å²	130	81%	0.81	76%	0.763	S	S	*	*			trans	62.6	138.8	158.6	48.2	0	0	0	0	119.6
617	S	29.9	Very low	28.8	Very low	102 Å²	102	132.4 Å²	132.4	71%	0.713	77%	0.773	S	S	*	*			cis	-164	171.5	-6.2	55.8	0	0	0	0	113.4
618	S	29	Very low	28.9	Very low	89 Å²	89	132.6 Å²	132.6	62%	0.622	77%	0.773	S	S	*	*			trans	74.9	91.6	151.2	42.8	0	0	0	0	123.2
619	F	27.5	Very low	28.6	Very low	186 Å²	186	130.8 Å²	130.8	82%	0.816	77%	0.766	S	S	*	*				78.7	112.9	120.3	-58.3	-53.2	0	0	0	125.6
620	L	29.6	Very low	28.4	Very low	152 Å²	152	128.4 Å²	128.4	80%	0.796	76%	0.762	S	S	*	*				66.3	142.8	122.3	-62.2	168.8	0	0	0	121.7
621	S	28.1	Very low	28.3	Very low	103 Å²	103	131.2 Å²	131.2	72%	0.72	77%	0.767	S	S	*	*			cis	-165.3	170.9	-21.2	-152.5	0	0	0	0	112.8
622	S	30.6	Very low	28.3	Very low	116 Å²	116	126.9 Å²	126.9	81%	0.811	76%	0.76	S	S	*	*			trans	-81.2	-168.3	167.5	65.9	0	0	0	0	111.6
623	G	28.2	Very low	28.2	Very low	73 Å²	73	127.1 Å²	127.1	75%	0.753	76%	0.762	S	S	*	*			cis	174.2	-175.7	10.6	0	0	0	0	0	110.7
624	S	29.1	Very low	28.1	Very low	113 Å²	113	125.7 Å²	125.7	79%	0.79	76%	0.763	S	S	*	*			trans	-123.3	130	-172	61.3	0	0	0	0	115.1
625	Q	28.7	Very low	27.8	Very low	201 Å²	201	125.2 Å²	125.2	94%	0.939	77%	0.765	S	S	*	*			trans	168.7	178.6	135.1	-93.5	-172.8	22.6	0	0	108.3
626	G	32.8	Very low	27.8	Very low	64 Å²	64	129.3 Å²	129.3	66%	0.66	78%	0.777	S	S	*	*			trans	-169.9	168.8	179.3	0	0	0	0	0	114.6
627	F	26.1	Very low	27.5	Very low	208 Å²	208	130.1 Å²	130.1	91%	0.912	78%	0.777	S	S	*	*			trans	-156.4	176.9	168.9	-102.5	-62.7	0	0	0	111.2
628	I	25.1	Very low	27.4	Very low	145 Å²	145	135.1 Å²	135.1	74%	0.744	79%	0.786	S	S	*	*			trans	-40	156.6	-174.5	-20.3	178.9	0	0	0	117.2
629	S	24.2	Very low	27.3	Very low	98 Å²	98	138.1 Å²	138.1	69%	0.685	80%	0.795	S	S	*	*			trans	94.7	102.4	149.9	-52	0	0	0	0	119.4
630	S	24.1	Very low	27.8	Very low	107 Å²	107	133.8 Å²	133.8	75%	0.748	79%	0.786	S	S	*	*			trans	46.9	136.8	130.1	63	0	0	0	0	123.1
631	L	24.6	Very low	27.7	Very low	166 Å²	166	132.6 Å²	132.6	87%	0.869	78%	0.78	S	S	*	*			trans	80	106.7	153.4	-116.2	70.7	0	0	0	118.6
632	S	25.2	Very low	27.8	Very low	97 Å²	97	134.9 Å²	134.9	68%	0.678	78%	0.779	S	S	*	*			trans	-56.4	152.7	142.6	54.5	0	0	0	0	109.5
633	T	26.8	Very low	27.6	Very low	127 Å²	127	136.1 Å²	136.1	78%	0.779	77%	0.772	S	S	*	*				-173.9	163.8	54.6	-41.3	0	0	0	0	109.8
634	A	29.6	Very low	27.6	Very low	93 Å²	93	139.4 Å²	139.4	77%	0.769	77%	0.772	S	S	*	*			trans	78.2	148.2	160.4	0	0	0	0	0	118.2
635	N	24.7	Very low	27.4	Very low	154 Å²	154	140.9 Å²	140.9	82%	0.824	77%	0.771	S	S	*	*			trans	-88.4	148.2	-179.2	-35.8	-80.5	0	0	0	111
636	Q	29.7	Very low	27.5	Very low	189 Å²	189	137.1 Å²	137.1	88%	0.883	76%	0.762	S	S	*	*				-165.2	120.8	128.8	-110	167.1	23.9	0	0	110.6
637	D	23.2	Very low	27.2	Very low	149 Å²	149	143.6 Å²	143.6	80%	0.797	77%	0.772	S	S	*	*			trans	-67.5	147.4	160.9	-52.3	-87.9	0	0	0	109.7
638	F	29.1	Very low	27.5	Very low	207 Å²	207	138.7 Å²	138.7	91%	0.908	76%	0.761	S	S	*	*			trans	-154.7	135.2	135.3	-109.4	-66.9	0	0	0	114.2
639	N	25.9	Very low	27.7	Very low	152 Å²	152	137.8 Å²	137.8	81%	0.813	76%	0.762	S	S	*	*			trans	-51.9	169.1	-176.3	-101.8	-26.5	0	0	0	118.2
640	P	39	Very low	27.9	Very low	96 Å²	96	139.9 Å²	139.9	62%	0.623	76%	0.761	S	S	*	*			trans	-100.8	-178.4	-171.2	42	-38	0	0	0	113.7
641	N	26.4	Very low	28.2	Very low	127 Å²	127	142 Å²	142	68%	0.679	76%	0.757	S	S	*	*				-177.9	150.9	121	-103.4	-58.3	0	0	0	114.4
642	H	30.1	Very low	28.3	Very low	151 Å²	151	140 Å²	140	70%	0.699	75%	0.747	S	S	*	*			trans	68.5	152.4	146.6	-68.7	-10.1	0	0	0	119.2
643	Q	27.6	Very low	28.3	Very low	141 Å²	141	145.7 Å²	145.7	66%	0.659	76%	0.755	S	S	*	*			cis	-155.5	159.5	-7.7	-124.1	174.1	48.1	0	0	113.8
644	L	27.6	Very low	28.6	Very low	143 Å²	143	144.1 Å²	144.1	75%	0.749	75%	0.747	S	S	*	*			trans	23.9	116.6	140.2	-73.4	169.9	0	0	0	121.5
645	N	24.1	Very low	28.4	Very low	144 Å²	144	148.1 Å²	148.1	77%	0.77	75%	0.75	S	S	*	*				95.9	160.5	114.6	-158.2	23.8	0	0	0	120.6
646	T	30.9	Very low	28.4	Very low	122 Å²	122	144.4 Å²	144.4	75%	0.748	74%	0.74	S	S	*	*			trans	72.3	100	172.3	41.4	0	0	0	0	119.8
647	K	27.9	Very low	28	Very low	199 Å²	199	145.7 Å²	145.7	87%	0.865	74%	0.739	S	S	*	*			trans	-22.1	154.1	143.7	-99.1	-179	179.6	-178.6	0	115.6
648	P	30.9	Very low	28	Very low	105 Å²	105	144.2 Å²	144.2	68%	0.682	74%	0.736	S	S	*	*				-147.4	-173.6	57.3	43.5	-25.3	0	0	0	117.7
649	T	29.9	Very low	27.7	Very low	127 Å²	127	138 Å²	138	78%	0.779	71%	0.711	S	S	*	*			trans	67.3	147.8	157.4	45.8	0	0	0	0	119.2
650	H	29	Very low	27.5	Very low	141 Å²	141	135.2 Å²	135.2	65%	0.653	70%	0.7	S	S	*	*			cis	-166	124.3	-20.6	-170.4	-112.6	0	0	0	110.4
651	F	29.3	Very low	26.7	Very low	151 Å²	151	134.6 Å²	134.6	66%	0.662	69%	0.689	S	S	*	*			trans	68.8	145.2	144.6	-81.9	-144.5	0	0	0	122.6
652	D	28.5	Very low	26.7	Very low	126 Å²	126	130.5 Å²	130.5	67%	0.674	68%	0.677	S	S	*	*			trans	68.7	109	133.4	-61.5	11.2	0	0	0	118.2
653	Y	23.7	Very low	26.7	Very low	216 Å²	216	127.8 Å²	127.8	85%	0.847	67%	0.671	S	S	*	*			cis	59.5	144.1	30.6	-106.2	-115.4	0	0	0	112.3
654	P	34.5	Very low	26.7	Very low	93 Å²	93	127.3 Å²	127.3	60%	0.604	68%	0.677	S	S	*	*			cis	-143.5	-156.2	-23.8	38.7	-17.6	0	0	0	113.1
655	Q	25.2	Very low	26.8	Very low	177 Å²	177	126.4 Å²	126.4	83%	0.827	67%	0.673	S	S	*	*			trans	74	121.7	165.4	-70.4	170.2	-4.1	0	0	115.3
656	A	23.1	Very low	27.1	Very low	76 Å²	76	127.4 Å²	127.4	63%	0.628	67%	0.673	S	S	*	*			cis	99.9	155	42.8	0	0	0	0	0	111.3
657	Y	22.9	Very low	26.9	Very low	216 Å²	216	125.5 Å²	125.5	85%	0.847	67%	0.669	S	S	*	*			trans	64.5	151.5	-156.2	-51.1	-88	0	0	0	111.1
658	T	23.4	Very low	26.9	Very low	119 Å²	119	122.4 Å²	122.4	73%	0.73	66%	0.662	S	S	*	*			cis	-161.5	-166	-14.7	17.9	0	0	0	0	106.3
659	N	21.7	Very low	26.6	Very low	75 Å²	75	126 Å²	126	40%	0.401	67%	0.667	S	S	.	*			trans	-41.2	169.7	145	-42.3	2.8	0	0	0	113.6	E1159 I1160	N659-E1159 WeakPolarHBondContact CB-O 3.45Å; N659-I1160 HydrophobicContact CB-CB 4.45Å; N659-I1160 HydrophobicContact CB-CD1 4.09Å; N659-I1160 HydrophobicContact CB-CG1 3.94Å; N659-I1160 WeakPolarHBondContact ND2-CB 3.35Å; N659-I1160 PolarHBondContact ND2-N 3.4Å; N659-I1160 WeakPolarHBondContact OD1-CD1 3.32Å
660	V	22.1	Very low	26.7	Very low	95 Å²	95	129.2 Å²	129.2	58%	0.576	67%	0.674	S	S	*	*			trans	94.8	119.1	158	178.6	0	0	0	0	118.7	E1158 E1159	V660-E1158 WeakPolarHBondContact CA-O 3.05Å; V660-E1159 WeakPolarHBondContact CG2-O 3.42Å
661	H	22.4	Very low	26.4	Very low	83 Å²	83	127.9 Å²	127.9	38%	0.384	68%	0.679	S	S	.	*			trans	54.9	126.3	158.6	-97.9	-101.9	0	0	0	122	D1156 Q1157 E1158 S1928 D1929	H661-D1156 PolarHBondContact CE1-O 2.79Å; H661-D1156 PolarHBondContact NE2-O 3.39Å; H661-D1156 VanDerWaalsContact NE2-O 3.09Å; H661-Q1157 PolarHBondContact CD2-O 3.29Å; H661-Q1157 WeakPolarHBondContact CE1-CB 3.12Å; H661-Q1157 VanDerWaalsContact NE2-CA 3.34Å; H661-Q1157 WeakPolarHBondContact NE2-CA 3.45Å; H661-Q1157 PolarHBondContact NE2-O 3.11Å; H661-E1158 VanDerWaalsContact C-OE1 3.31Å; H661-E1158 WeakPolarHBondContact CA-OE1 3.36Å; H661-E1158 WeakPolarHBondContact CA-OE2 3.28Å; H661-E1158 PolarHBondContact CD2-O 3.18Å; H661-E1158 PolarHBondContact N-O 3.22Å; H661-S1928 WeakPolarHBondContact NE2-CA 3.24Å; H661-S1928 WeakPolarHBondContact NE2-CB 3.07Å; H661-D1929 PolarHBondContact NE2-N 3.02Å
662	G	26.7	Very low	26.2	Very low	41 Å²	41	127.9 Å²	127.9	42%	0.423	69%	0.691	S	S	.	*				122	119.5	78.8	0	0	0	0	0	119.4	E1158	G662-E1158 PolarHBondContact N-OE1 2.92Å; G662-E1158 VanDerWaalsContact N-OE1 3.12Å; G662-E1158 PolarHBondContact N-OE2 3.2Å
663	T	29.9	Very low	26	Very low	94 Å²	94	125.3 Å²	125.3	58%	0.577	69%	0.694	S	S	*	*			trans	-14.3	142.1	163.5	44.7	0	0	0	0	120.9
664	V	28.2	Very low	26.3	Very low	131 Å²	131	118.5 Å²	118.5	79%	0.794	69%	0.69	S	S	*	*				-146.4	110.9	126.1	173.3	0	0	0	0	110.9
665	N	28.7	Very low	26	Very low	124 Å²	124	120.3 Å²	120.3	66%	0.663	70%	0.701	S	S	*	*			trans	39.7	149.7	138.4	-68.1	-74.7	0	0	0	121.9
666	Q	29.6	Very low	26.3	Very low	165 Å²	165	117.2 Å²	117.2	77%	0.771	70%	0.697	S	S	*	*			cis	-163.4	164.9	13.8	-134.5	155.7	57.6	0	0	113.1
667	A	28.3	Very low	26.5	Very low	81 Å²	81	123.6 Å²	123.6	67%	0.669	71%	0.71	S	S	*	*			trans	-7.2	163	156.1	0	0	0	0	0	121.4
668	N	27.1	Very low	26.8	Very low	134 Å²	134	121.6 Å²	121.6	72%	0.717	71%	0.708	S	S	*	*			cis	-164.8	164.9	24.6	-144.2	-30.3	0	0	0	114.2
669	K	25.5	Very low	26.8	Very low	181 Å²	181	121.6 Å²	121.6	79%	0.787	70%	0.703	S	S	*	*			trans	-26.9	139.8	172.8	-61	153.9	-170.6	178.2	0	119.2
670	Q	30.3	Very low	26.9	Very low	195 Å²	195	125.4 Å²	125.4	91%	0.911	72%	0.718	S	S	*	*				-160.6	163.9	126.9	-115.6	171.9	34.6	0	0	113.6
671	C	24.1	Very low	27.2	Very low	113 Å²	113	127.3 Å²	127.3	76%	0.764	73%	0.725	S	S	*	*			trans	-134.3	168.3	-173.6	-56	0	0	0	0	112.3
672	V	24.9	Very low	27.4	Very low	150 Å²	150	133.1 Å²	133.1	91%	0.909	75%	0.746	S	S	*	*			trans	78.1	127.6	165.2	-168.7	0	0	0	0	117.3
673	G	24.8	Very low	27.2	Very low	72 Å²	72	139.6 Å²	139.6	74%	0.742	77%	0.765	S	S	*	*			trans	116.8	93.8	149.5	0	0	0	0	0	117.4
674	G	28.2	Very low	26.9	Very low	74 Å²	74	140.7 Å²	140.7	76%	0.763	78%	0.776	S	S	*	*			trans	-84.3	165	156.5	0	0	0	0	0	111.4
675	P	28.8	Very low	26.7	Very low	130 Å²	130	139.5 Å²	139.5	84%	0.844	77%	0.774	S	S	*	*				-139.9	-142	112.4	39	-21	0	0	0	112.5
676	P	31	Very low	26.7	Very low	112 Å²	112	141.7 Å²	141.7	73%	0.727	78%	0.784	S	S	*	*				-128.8	150.8	-116.3	36.5	-15.9	0	0	0	118.1
677	K	27.8	Very low	26.4	Very low	210 Å²	210	138.4 Å²	138.4	91%	0.913	79%	0.786	S	S	*	*			trans	39.6	105.4	149.4	-63.3	-177.7	179.8	178.4	0	118.7
678	H	28.8	Very low	26.3	Very low	175 Å²	175	140.9 Å²	140.9	81%	0.81	79%	0.788	S	S	*	*			trans	-127.1	151	142.2	-168.6	-94.7	0	0	0	111.8
679	L	23.8	Very low	26.4	Very low	119 Å²	119	142.2 Å²	142.2	62%	0.623	80%	0.795	S	S	*	*			trans	-51.4	136.8	-169.9	-69.8	167.3	0	0	0	117.6
680	Q	24.8	Very low	26.4	Very low	154 Å²	154	140 Å²	140	72%	0.72	79%	0.791	S	S	*	*				70.4	107.5	112.6	-166.1	175.2	29.9	0	0	120
681	N	27	Very low	26.3	Very low	135 Å²	135	137 Å²	137	72%	0.722	78%	0.781	S	S	*	*				-178.9	150.5	125.9	-98.1	-45.3	0	0	0	113
682	Y	26.8	Very low	26.5	Very low	206 Å²	206	139 Å²	139	81%	0.808	78%	0.783	S	S	*	*			trans	34.5	122.4	169.8	-63.3	-76.6	0	0	0	119.8
683	Q	23.4	Very low	26.7	Very low	176 Å²	176	136 Å²	136	82%	0.822	77%	0.769	S	S	*	*			cis	71.7	117.9	25.4	-163	174	-24.2	0	0	116.6
684	S	23.6	Very low	26.8	Very low	117 Å²	117	135.7 Å²	135.7	82%	0.818	76%	0.756	S	S	*	*			trans	72	147.7	-179.3	82	0	0	0	0	115
685	S	24.3	Very low	26.9	Very low	107 Å²	107	141.4 Å²	141.4	75%	0.748	76%	0.756	S	S	*	*			cis	-147	139.8	15	59	0	0	0	0	114.2
686	L	27.1	Very low	27	Very low	169 Å²	169	140.5 Å²	140.5	89%	0.885	75%	0.747	S	S	*	*			trans	-159.3	50.1	136.5	-155.3	75.4	0	0	0	112	N688	L686-N688 PolarHBondContact O-N 3.21Å; L686-N688 VanDerWaalsContact O-N 3.15Å
687	A	24.8	Very low	26.7	Very low	97 Å²	97	143.9 Å²	143.9	80%	0.802	75%	0.753	S	S	*	*			trans	-80.8	86.6	169.2	0	0	0	0	0	109.5
688	N	25.8	Very low	26.7	Very low	133 Å²	133	137 Å²	137	71%	0.711	74%	0.742	S	S	*	*			trans	-151.6	65.5	173.8	-108.1	-21.9	0	0	0	113.4	L686	L686-N688 PolarHBondContact O-N 3.21Å; L686-N688 VanDerWaalsContact O-N 3.15Å
689	N	28.3	Very low	26.6	Very low	162 Å²	162	133.3 Å²	133.3	87%	0.866	73%	0.728	S	S	*	*			trans	-134.1	32.3	163.3	-93.7	-43.2	0	0	0	111.9
690	N	26	Very low	26.8	Very low	133 Å²	133	131.4 Å²	131.4	71%	0.711	72%	0.722	S	S	*	*			trans	-102.3	26.6	178.8	-83	-10.6	0	0	0	113.5	S694	N690-S694 PolarHBondContact O-OG 3.12Å
691	L	28.5	Very low	27.2	Very low	134 Å²	134	129 Å²	129	70%	0.702	71%	0.712	S	S	*	*	S	Bend	trans	-101.2	-6	-179.2	-96.1	163.4	0	0	0	115.2
692	L	29	Very low	27.7	Very low	154 Å²	154	128 Å²	128	81%	0.806	71%	0.706	S	S	*	*	S	Bend	trans	-108.6	-26.3	172.9	-123	73	0	0	0	114	S694	L692-S694 VanDerWaalsContact C-N 3.33Å
693	S	27.9	Very low	27.9	Very low	86 Å²	86	122 Å²	122	60%	0.601	69%	0.688	S	S	*	*	S	Bend	trans	-81.3	-11.7	177.3	-166.7	0	0	0	0	113.9
694	S	26.9	Very low	28.6	Very low	67 Å²	67	119.7 Å²	119.7	47%	0.469	68%	0.679	S	S	.	*	S	Bend	trans	-92.4	-16.8	179.4	43	0	0	0	0	113.3	N690 L692	N690-S694 PolarHBondContact O-OG 3.12Å; L692-S694 VanDerWaalsContact C-N 3.33Å
695	Y	29.7	Very low	29	Very low	193 Å²	193	116.9 Å²	116.9	76%	0.757	66%	0.664	S	S	*	*	S	Bend	trans	-83.9	-12.2	178.7	-123.1	-91	0	0	0	114
696	V	30.9	Very low	29.3	Very low	111 Å²	111	116.4 Å²	116.4	67%	0.673	66%	0.66	S	S	*	*	S	Bend	trans	-97.6	-17.6	-176.5	-175.6	0	0	0	0	112.5
697	Q	26.5	Very low	29.6	Very low	183 Å²	183	113.3 Å²	113.3	86%	0.855	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	14.9	177.3	-69.3	-174.9	-36.9	0	0	113.9
698	G	27.3	Very low	30.2	Very low	65 Å²	65	116.1 Å²	116.1	67%	0.67	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.9	-1	179	0	0	0	0	0	115.5
699	L	26.9	Very low	30.9	Very low	99 Å²	99	112.9 Å²	112.9	52%	0.518	62%	0.62	S	S	.	*	S	Bend	trans	-98	124.2	179.4	-82	162.3	0	0	0	110.4	E701 L703	L699-E701 PolarHBondContact O-N 2.92Å; L699-L703 HydrophobicContact CD2-CD1 3.83Å
700	P	28.5	Very low	31.4	Very low	78 Å²	78	108.4 Å²	108.4	51%	0.506	60%	0.601	S	S	.	*			trans	-65.6	134.6	173	27.3	-34	0	0	0	110.3	N702 L703	P700-N702 PolarHBondContact O-N 3.1Å; P700-L703 HydrophobicContact CG-CD1 4.14Å; P700-L703 PolarHBondContact O-N 3.09Å
701	E	32.5	Very low	31.9	Very low	105 Å²	105	102.6 Å²	102.6	49%	0.491	57%	0.573	S	S	.	*	H	α-helix	trans	-51.9	-30.3	-174.3	-61.2	177	151.1	0	0	113.2	A312 L699 L703 I704 A705	A312-E701 WeakPolarHBondContact CA-OE2 3.38Å; A312-E701 VanDerWaalsContact CB-OE2 3.31Å; A312-E701 WeakPolarHBondContact CB-OE2 3.44Å; L699-E701 PolarHBondContact O-N 2.92Å; E701-L703 PolarHBondContact O-N 2.99Å; E701-I704 PolarHBondContact O-N 2.91Å; E701-I704 VanDerWaalsContact O-N 3.12Å; E701-A705 PolarHBondContact O-N 3.07Å; E701-A705 VanDerWaalsContact O-N 3.13Å
702	N	37.4	Very low	32.6	Very low	113 Å²	113	98 Å²	98	60%	0.604	55%	0.547	S	S	*	.	H	α-helix	trans	-55.5	-29.4	174.1	-70.3	-23.6	0	0	0	114.2	P700 S706	P700-N702 PolarHBondContact O-N 3.1Å; N702-S706 WeakPolarHBondContact O-CB 3.45Å; N702-S706 PolarHBondContact O-N 2.87Å; N702-S706 PolarHBondContact O-OG 3.44Å
703	L	31.4	Very low	33.5	Very low	81 Å²	81	95.9 Å²	95.9	42%	0.424	53%	0.529	S	S	.	.	H	α-helix	trans	-73.4	-36.1	177.2	-90.3	168.9	0	0	0	112.4	L699 P700 E701 S706 L707	L699-L703 HydrophobicContact CD2-CD1 3.83Å; P700-L703 HydrophobicContact CG-CD1 4.14Å; P700-L703 PolarHBondContact O-N 3.09Å; E701-L703 PolarHBondContact O-N 2.99Å; L703-S706 PolarHBondContact O-N 2.6Å; L703-L707 WeakPolarHBondContact O-CB 3.48Å; L703-L707 WeakPolarHBondContact O-CG 3.5Å; L703-L707 PolarHBondContact O-N 3.47Å
704	I	38.1	Very low	34.7	Very low	126 Å²	126	95.6 Å²	95.6	65%	0.646	52%	0.52	S	S	*	.	H	α-helix	trans	-71.4	-35.8	175.6	-57.9	176.5	0	0	0	109.8	E701	E701-I704 PolarHBondContact O-N 2.91Å; E701-I704 VanDerWaalsContact O-N 3.12Å
705	A	31.4	Very low	36.1	Very low	59 Å²	59	92.7 Å²	92.7	49%	0.488	50%	0.499	S	S	.	.	H	α-helix	trans	-71.1	-28.1	173.1	0	0	0	0	0	114	E701 K708	E701-A705 PolarHBondContact O-N 3.07Å; E701-A705 VanDerWaalsContact O-N 3.13Å; A705-K708 WeakPolarHBondContact O-CG 3.38Å
706	S	31.3	Very low	37.6	Very low	96 Å²	96	84.9 Å²	84.9	67%	0.671	47%	0.47	S	S	*	.	H	α-helix	trans	-88.8	-31.7	179.6	-57.8	0	0	0	0	113.1	N702 L703 K708	N702-S706 WeakPolarHBondContact O-CB 3.45Å; N702-S706 PolarHBondContact O-N 2.87Å; N702-S706 PolarHBondContact O-OG 3.44Å; L703-S706 PolarHBondContact O-N 2.6Å; S706-K708 PolarHBondContact O-N 3.48Å
707	L	32.4	Very low	39.2	Very low	104 Å²	104	81.5 Å²	81.5	55%	0.545	45%	0.449	S	S	.	.	S	Bend	trans	-75	44	164	-71.2	170.5	0	0	0	111.3	L703 L709	L703-L707 WeakPolarHBondContact O-CB 3.48Å; L703-L707 WeakPolarHBondContact O-CG 3.5Å; L703-L707 PolarHBondContact O-N 3.47Å; L707-L709 PolarHBondContact O-N 3.25Å
708	K	36.7	Very low	41.1	Very low	157 Å²	157	74.6 Å²	74.6	68%	0.683	42%	0.421	S	S	*	.			trans	-61.9	113.1	165.9	-98.4	173.6	179.7	173.7	0	108	A705 S706 S710	A705-K708 WeakPolarHBondContact O-CG 3.38Å; S706-K708 PolarHBondContact O-N 3.48Å; K708-S710 PolarHBondContact O-N 3.33Å; K708-S710 PolarHBondContact O-OG 3.27Å
709	L	41.5	Very low	43.1	Very low	65 Å²	65	71.7 Å²	71.7	34%	0.34	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	29.7	162.1	-98.1	69.7	0	0	0	112.3	L707 G711 F712 R713 L1025	L707-L709 PolarHBondContact O-N 3.25Å; L709-G711 PolarHBondContact O-N 3.35Å; L709-G711 VanDerWaalsContact O-N 3.16Å; L709-F712 HydrophobicContact CB-CB 4.39Å; L709-F712 HydrophobicContact CD2-CB 4.4Å; L709-F712 HydrophobicContact CG-CB 4.39Å; L709-F712 PolarHBondContact O-N 2.84Å; L709-R713 PolarHBondContact O-N 2.89Å; L709-L1025 HydrophobicContact CD2-CD2 4.33Å
710	S	39.2	Very low	45.6	Very low	67 Å²	67	69 Å²	69	47%	0.469	38%	0.379	S	S	.	.	H	α-helix	trans	-53.8	-36.7	179.5	49.5	0	0	0	0	111.9	K708 R713 L714	K708-S710 PolarHBondContact O-N 3.33Å; K708-S710 PolarHBondContact O-OG 3.27Å; S710-R713 PolarHBondContact O-N 3.23Å; S710-L714 WeakPolarHBondContact O-CB 3.4Å; S710-L714 VanDerWaalsContact O-CG 3.25Å; S710-L714 WeakPolarHBondContact O-CG 3.48Å; S710-L714 PolarHBondContact O-N 3.23Å
711	G	36.4	Very low	48.3	Very low	11 Å²	11	65.8 Å²	65.8	11%	0.113	36%	0.357	C	S	.	.	H	α-helix	trans	-58.9	-54.4	171.9	0	0	0	0	0	113.4	L709 R713 L714 V715	L709-G711 PolarHBondContact O-N 3.35Å; L709-G711 VanDerWaalsContact O-N 3.16Å; G711-R713 VanDerWaalsContact C-N 3.32Å; G711-R713 PolarHBondContact O-N 3.16Å; G711-L714 PolarHBondContact O-N 2.84Å; G711-V715 WeakPolarHBondContact O-CG2 3.35Å; G711-V715 PolarHBondContact O-N 3.36Å; G711-V715 VanDerWaalsContact O-N 3.16Å
712	F	42.6	Very low	51	Low	38 Å²	38	63.3 Å²	63.3	17%	0.167	34%	0.344	C	S	.	.	H	α-helix	trans	-65.4	-34.5	176.5	-84.3	-83.4	0	0	0	113	L709 V715 L716 I978 L986	L709-F712 HydrophobicContact CB-CB 4.39Å; L709-F712 HydrophobicContact CD2-CB 4.4Å; L709-F712 HydrophobicContact CG-CB 4.39Å; L709-F712 PolarHBondContact O-N 2.84Å; F712-V715 PolarHBondContact O-N 3.04Å; F712-L716 WeakPolarHBondContact O-CB 3.46Å; F712-L716 WeakPolarHBondContact O-CG 3.2Å; F712-L716 PolarHBondContact O-N 2.72Å; F712-I978 HydrophobicContact CE1-CD1 4.35Å; F712-L986 HydrophobicContact CE1-CD1 4.36Å; F712-L986 HydrophobicContact CE2-CD1 4.37Å; F712-L986 HydrophobicContact CE2-CD2 3.83Å; F712-L986 HydrophobicContact CZ-CD1 3.58Å; F712-L986 HydrophobicContact CZ-CD2 3.64Å; F712-L986 HydrophobicContact CZ-CG 4.22Å
713	R	48.6	Very low	53.4	Low	109 Å²	109	58 Å²	58	41%	0.411	32%	0.315	S	S	.	.	H	α-helix	trans	-64.6	-44.9	175.2	-151.8	-177.5	-169.7	174.6	4.7	110.7	L709 S710 G711 V715 L716 D717 E863	L709-R713 PolarHBondContact O-N 2.89Å; S710-R713 PolarHBondContact O-N 3.23Å; G711-R713 VanDerWaalsContact C-N 3.32Å; G711-R713 PolarHBondContact O-N 3.16Å; R713-V715 VanDerWaalsContact C-N 3.28Å; R713-V715 PolarHBondContact O-N 3.14Å; R713-L716 CarbonylContact O-C 3.59Å; R713-L716 PolarHBondContact O-N 3Å; R713-D717 WeakPolarHBondContact O-CB 3.15Å; R713-D717 PolarHBondContact O-N 2.75Å; R713-E863 IonicContact CZ-OE1 2.74Å; R713-E863 IonicContact NE-OE1 3.72Å; R713-E863 IonicContact NH2-OE1 3.59Å; R713-E863 PolarHBondContact NH2-OE1 3.13Å; R713-E863 IonicContact NH2-OE2 3.59Å
714	L	52.9	Low	56.1	Low	81 Å²	81	54.2 Å²	54.2	42%	0.424	30%	0.296	S	S	.	.	H	α-helix	trans	-59.1	-36.6	173.7	-73.6	167.3	0	0	0	112.9	S710 G711 S718 A1249	S710-L714 WeakPolarHBondContact O-CB 3.4Å; S710-L714 VanDerWaalsContact O-CG 3.25Å; S710-L714 WeakPolarHBondContact O-CG 3.48Å; S710-L714 PolarHBondContact O-N 3.23Å; G711-L714 PolarHBondContact O-N 2.84Å; L714-S718 WeakPolarHBondContact O-CB 3.09Å; L714-S718 PolarHBondContact O-N 3.29Å; L714-S718 VanDerWaalsContact O-N 3.07Å; L714-S718 PolarHBondContact O-OG 2.82Å; L714-A1249 HydrophobicContact CD1-CB 4.31Å
715	V	55.3	Low	58.4	Low	5 Å²	5	48.7 Å²	48.7	3%	0.03	27%	0.267	C	S	.	.	H	α-helix	trans	-68.7	-47.1	173.8	-177.8	0	0	0	0	111.1	G711 F712 R713 D717 S718 C719 I974 V1243	G711-V715 WeakPolarHBondContact O-CG2 3.35Å; G711-V715 PolarHBondContact O-N 3.36Å; G711-V715 VanDerWaalsContact O-N 3.16Å; F712-V715 PolarHBondContact O-N 3.04Å; R713-V715 VanDerWaalsContact C-N 3.28Å; R713-V715 PolarHBondContact O-N 3.14Å; V715-D717 VanDerWaalsContact C-N 3.32Å; V715-D717 PolarHBondContact O-N 3.14Å; V715-S718 WeakPolarHBondContact O-CB 3.17Å; V715-S718 PolarHBondContact O-N 3.1Å; V715-S718 VanDerWaalsContact O-N 3.16Å; V715-C719 PolarHBondContact O-N 3.24Å; V715-C719 PolarHBondContact O-SG 3.45Å; V715-C719 VanDerWaalsContact O-SG 3.4Å; V715-I974 HydrophobicContact CB-CD1 4.25Å; V715-I974 HydrophobicContact CG1-CD1 3.64Å; V715-I974 HydrophobicContact CG1-CG1 3.86Å; V715-V1243 HydrophobicContact CG1-CG1 4.39Å; V715-V1243 HydrophobicContact CG1-CG2 4.18Å
716	L	61.2	Low	60.9	Low	29 Å²	29	46.9 Å²	46.9	15%	0.152	25%	0.251	C	S	.	.	H	α-helix	trans	-61.6	-36.8	175.7	-76.1	162.5	0	0	0	113	F712 R713 S718 C719 R970 W971 I974	F712-L716 WeakPolarHBondContact O-CB 3.46Å; F712-L716 WeakPolarHBondContact O-CG 3.2Å; F712-L716 PolarHBondContact O-N 2.72Å; R713-L716 CarbonylContact O-C 3.59Å; R713-L716 PolarHBondContact O-N 3Å; L716-S718 VanDerWaalsContact C-N 3.29Å; L716-C719 PolarHBondContact O-N 3.14Å; L716-R970 HydrophobicContact CD2-CB 3.96Å; L716-R970 PolarHBondContact O-NH1 2.88Å; L716-W971 HydrophobicContact CD1-CH2 4.04Å; L716-W971 HydrophobicContact CD1-CZ2 3.9Å; L716-W971 HydrophobicContact CD2-CD2 4.25Å; L716-I974 HydrophobicContact CB-CD1 4.34Å; L716-I974 HydrophobicContact CD2-CD1 3.44Å; L716-I974 VanDerWaalsContact CD2-CD1 3.44Å; L716-I974 HydrophobicContact CG-CD1 3.55Å
717	D	66.2	Low	63.3	Low	40 Å²	40	44.7 Å²	44.7	21%	0.214	23%	0.233	C	C	.	.	H	α-helix	trans	-76.8	-18.8	179	-61.9	-11.7	0	0	0	111.6	R713 V715 G860 S861	R713-D717 WeakPolarHBondContact O-CB 3.15Å; R713-D717 PolarHBondContact O-N 2.75Å; V715-D717 VanDerWaalsContact C-N 3.32Å; V715-D717 PolarHBondContact O-N 3.14Å; D717-G860 CarbonylContact O-C 3.58Å; D717-G860 VanDerWaalsContact O-O 3.11Å; D717-S861 VanDerWaalsContact CG-CA 3.46Å; D717-S861 VanDerWaalsContact CG-CB 3.41Å; D717-S861 WeakPolarHBondContact OD1-CA 3.29Å; D717-S861 WeakPolarHBondContact OD1-CB 3.29Å
718	S	64.6	Low	65.6	Low	38 Å²	38	41.5 Å²	41.5	27%	0.266	22%	0.22	S	C	.	.	H	α-helix	trans	-80.3	-21.2	172.3	-64.3	0	0	0	0	113.4	L714 V715 L716 P720 S1246	L714-S718 WeakPolarHBondContact O-CB 3.09Å; L714-S718 PolarHBondContact O-N 3.29Å; L714-S718 VanDerWaalsContact O-N 3.07Å; L714-S718 PolarHBondContact O-OG 2.82Å; V715-S718 WeakPolarHBondContact O-CB 3.17Å; V715-S718 PolarHBondContact O-N 3.1Å; V715-S718 VanDerWaalsContact O-N 3.16Å; L716-S718 VanDerWaalsContact C-N 3.29Å; S718-P720 WeakPolarHBondContact O-CD 3.25Å; S718-S1246 PolarHBondContact OG-OG 3.29Å; S718-S1246 VanDerWaalsContact OG-OG 3.13Å
719	C	70.3	Confident	67.9	Low	4 Å²	4	34.6 Å²	34.6	3%	0.027	19%	0.191	C	C	.	.	S	Bend	trans	-74.7	117	-179.1	-66.7	0	0	0	0	111.3	V715 L716 R970	V715-C719 PolarHBondContact O-N 3.24Å; V715-C719 PolarHBondContact O-SG 3.45Å; V715-C719 VanDerWaalsContact O-SG 3.4Å; L716-C719 PolarHBondContact O-N 3.14Å; C719-R970 HydrophobicContact CB-CB 4.43Å; C719-R970 HydrophobicContact CB-CG 3.81Å; C719-R970 PolarHBondContact O-NE 3.19Å; C719-R970 PolarHBondContact O-NH1 2.95Å; C719-R970 PolarHBondContact O-NH2 3.48Å
720	P	79.9	Confident	70	Confident	43 Å²	43	31.8 Å²	31.8	28%	0.279	18%	0.176	S	C	.	.			trans	-77.2	135.6	-176.7	29.4	-33.3	0	0	0	112.8	S718 I857 L858 F859	S718-P720 WeakPolarHBondContact O-CD 3.25Å; P720-I857 HydrophobicContact CB-CG2 3.56Å; P720-L858 VanDerWaalsContact CA-O 3.32Å; P720-L858 WeakPolarHBondContact CA-O 3.39Å; P720-F859 HydrophobicContact CB-CD1 3.93Å; P720-F859 HydrophobicContact CB-CE1 3.76Å; P720-F859 HydrophobicContact CB-CZ 4.29Å; P720-F859 HydrophobicContact CG-CE1 4.34Å
721	T	85.4	Confident	72.2	Confident	10 Å²	10	31.2 Å²	31.2	6%	0.061	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	115.7	168.3	-58.2	0	0	0	0	109.1	L858 L892 R970	T721-L858 PolarHBondContact N-O 3.32Å; T721-L858 PolarHBondContact O-N 2.91Å; T721-L892 HydrophobicContact CG2-CD2 4.05Å; T721-R970 PolarHBondContact OG1-NH2 3.16Å
722	R	87.5	Confident	74.5	Confident	53 Å²	53	31.7 Å²	31.7	20%	0.2	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	123.9	176.6	-63	168.2	75.3	-162.2	2.4	109.5	L855 L893 D946	R722-L855 HydrophobicContact CB-CD1 4.2Å; R722-L893 HydrophobicContact CB-CB 4.01Å; R722-L893 PolarHBondContact O-N 3.29Å; R722-D946 IonicContact CZ-OD1 3.56Å; R722-D946 IonicContact CZ-OD2 4Å; R722-D946 VanDerWaalsContact CZ-OD2 3.3Å; R722-D946 VanDerWaalsContact NH1-CG 3.25Å; R722-D946 IonicContact NH1-OD1 2.76Å; R722-D946 PolarHBondContact NH1-OD1 3.01Å; R722-D946 IonicContact NH1-OD2 2.82Å; R722-D946 PolarHBondContact NH1-OD2 3.26Å; R722-D946 IonicContact NH2-OD1 3.76Å; R722-D946 IonicContact NH2-OD2 2.72Å; R722-D946 PolarHBondContact NH2-OD2 3.1Å
723	L	89.5	Confident	76.7	Confident	2 Å²	2	29.9 Å²	29.9	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	150.3	-177.3	69.8	85.8	0	0	0	112.3	L725 A856 L858 L869 L890 G891 L892	L723-L725 HydrophobicContact CD1-CD1 3.87Å; L723-L725 HydrophobicContact CD1-CD2 3.73Å; L723-L725 HydrophobicContact CD1-CG 3.49Å; L723-L725 VanDerWaalsContact CD1-CG 3.49Å; L723-A856 HydrophobicContact CD1-CB 3.73Å; L723-A856 HydrophobicContact CG-CB 4.12Å; L723-A856 PolarHBondContact N-O 3.25Å; L723-A856 PolarHBondContact O-N 2.95Å; L723-A856 VanDerWaalsContact O-O 3.12Å; L723-L858 HydrophobicContact CD2-CD1 3.56Å; L723-L858 HydrophobicContact CD2-CD2 4.37Å; L723-L858 HydrophobicContact CD2-CG 3.75Å; L723-L869 HydrophobicContact CD2-CD1 3.93Å; L723-L890 HydrophobicContact CB-CD1 4.5Å; L723-G891 CarbonylContact C-O 3.56Å; L723-G891 WeakPolarHBondContact CA-O 3.36Å; L723-L892 HydrophobicContact CB-CD2 4.37Å
724	L	87.4	Confident	78.7	Confident	2 Å²	2	27.5 Å²	27.5	1%	0.01	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	135.4	176.4	-72.2	-174.9	0	0	0	110.6	I759 F761 F764 G891 L893 V948	L724-I759 HydrophobicContact CD2-CB 4.29Å; L724-I759 HydrophobicContact CD2-CD1 3.68Å; L724-F761 HydrophobicContact CD1-CD1 4.29Å; L724-F764 HydrophobicContact CB-CE2 3.92Å; L724-F764 HydrophobicContact CB-CZ 3.71Å; L724-F764 HydrophobicContact CD1-CE2 4.18Å; L724-G891 PolarHBondContact N-O 3.02Å; L724-L893 HydrophobicContact CD1-CD1 3.85Å; L724-L893 HydrophobicContact CD2-CD1 3.86Å; L724-L893 HydrophobicContact CG-CD1 3.79Å; L724-V948 HydrophobicContact CD1-CG1 3.91Å; L724-V948 HydrophobicContact CD1-CG2 3.74Å
725	L	86.2	Confident	80.3	Confident	10 Å²	10	24.4 Å²	24.4	5%	0.052	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.3	174.7	-61.2	167.3	0	0	0	109.2	L723 T727 V730 I733 M754 S853 Q854 A856 I872	L723-L725 HydrophobicContact CD1-CD1 3.87Å; L723-L725 HydrophobicContact CD1-CD2 3.73Å; L723-L725 HydrophobicContact CD1-CG 3.49Å; L723-L725 VanDerWaalsContact CD1-CG 3.49Å; L725-T727 PolarHBondContact O-N 2.93Å; L725-V730 HydrophobicContact CB-CG2 3.82Å; L725-V730 HydrophobicContact CD1-CG2 4.38Å; L725-I733 HydrophobicContact CD1-CD1 3.76Å; L725-I733 HydrophobicContact CD2-CD1 3.91Å; L725-I733 HydrophobicContact CG-CD1 4.26Å; L725-M754 HydrophobicContact CD1-CE 3.93Å; L725-M754 HydrophobicContact CD1-SD 4.22Å; L725-S853 CarbonylContact O-C 3.55Å; L725-S853 VanDerWaalsContact O-CA 3.31Å; L725-S853 WeakPolarHBondContact O-CA 2.97Å; L725-Q854 PolarHBondContact N-O 2.91Å; L725-Q854 VanDerWaalsContact N-O 3.1Å; L725-Q854 PolarHBondContact O-N 3.11Å; L725-A856 HydrophobicContact CD1-CB 4.07Å; L725-I872 HydrophobicContact CD2-CG2 3.91Å
726	S	83.3	Confident	81.9	Confident	21 Å²	21	35.9 Å²	35.9	15%	0.147	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	126.5	168.6	178.9	0	0	0	0	109.6	S728 L729 V730	S726-S728 PolarHBondContact O-N 3.29Å; S726-S728 VanDerWaalsContact O-N 3.1Å; S726-S728 PolarHBondContact OG-OG 2.93Å; S726-L729 PolarHBondContact O-N 3.21Å; S726-V730 PolarHBondContact O-N 3.25Å
727	T	82.7	Confident	83	Confident	49 Å²	49	38.1 Å²	38.1	30%	0.301	23%	0.229	S	C	.	.	H	α-helix	trans	-50.8	-35.3	-179.1	44.9	0	0	0	0	112.2	L725 L729 V730 E852 Q854	L725-T727 PolarHBondContact O-N 2.93Å; T727-L729 PolarHBondContact O-N 2.92Å; T727-L729 VanDerWaalsContact O-N 3.11Å; T727-V730 PolarHBondContact O-N 3.27Å; T727-V730 VanDerWaalsContact O-N 3.14Å; T727-E852 WeakPolarHBondContact CB-O 3.07Å; T727-E852 HydrophobicContact CG2-CB 3.99Å; T727-E852 VanDerWaalsContact CG2-O 3.24Å; T727-E852 WeakPolarHBondContact CG2-O 3.45Å; T727-E852 PolarHBondContact N-O 3.04Å; T727-E852 PolarHBondContact OG1-O 3.38Å; T727-E852 VanDerWaalsContact OG1-O 3.07Å; T727-Q854 HydrophobicContact CG2-CB 4.12Å
728	S	81.6	Confident	84.1	Confident	37 Å²	37	36.7 Å²	36.7	26%	0.259	23%	0.225	S	C	.	.	H	α-helix	trans	-50.8	-30.9	174.4	67.8	0	0	0	0	114.6	S726	S726-S728 PolarHBondContact O-N 3.29Å; S726-S728 VanDerWaalsContact O-N 3.1Å; S726-S728 PolarHBondContact OG-OG 2.93Å
729	L	84.1	Confident	85.3	Confident	13 Å²	13	44.2 Å²	44.2	7%	0.068	25%	0.247	C	C	.	.	H	α-helix	trans	-101.4	-19.9	-178.6	-64.7	175.6	0	0	0	113.3	S726 T727 G731 S732 I733 C876 E879 F885 P888	S726-L729 PolarHBondContact O-N 3.21Å; T727-L729 PolarHBondContact O-N 2.92Å; T727-L729 VanDerWaalsContact O-N 3.11Å; L729-G731 VanDerWaalsContact C-N 3.27Å; L729-G731 PolarHBondContact O-N 2.92Å; L729-S732 PolarHBondContact O-N 2.91Å; L729-I733 HydrophobicContact CB-CD1 4.32Å; L729-I733 WeakPolarHBondContact O-CG1 3.27Å; L729-I733 PolarHBondContact O-N 3.16Å; L729-I733 VanDerWaalsContact O-N 3.16Å; L729-C876 HydrophobicContact CD1-CB 4.01Å; L729-E879 HydrophobicContact CD2-CB 3.84Å; L729-F885 HydrophobicContact CD2-CD2 4.28Å; L729-P888 HydrophobicContact CD1-CB 4.19Å
730	V	84.9	Confident	86.3	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.03	26%	0.257	C	S	.	.	H	α-helix	trans	-57.6	-39.2	-176.2	177.1	0	0	0	0	112.1	L725 S726 T727 S732 I733 I734 M754 Q854	L725-V730 HydrophobicContact CB-CG2 3.82Å; L725-V730 HydrophobicContact CD1-CG2 4.38Å; S726-V730 PolarHBondContact O-N 3.25Å; T727-V730 PolarHBondContact O-N 3.27Å; T727-V730 VanDerWaalsContact O-N 3.14Å; V730-S732 PolarHBondContact O-N 3.16Å; V730-I733 PolarHBondContact O-N 3.11Å; V730-I733 VanDerWaalsContact O-N 3.16Å; V730-I734 HydrophobicContact CG1-CD1 3.66Å; V730-I734 HydrophobicContact CG1-CG1 4.09Å; V730-I734 WeakPolarHBondContact O-CG1 3.37Å; V730-I734 PolarHBondContact O-N 3.39Å; V730-M754 HydrophobicContact CG1-CE 4.07Å; V730-M754 HydrophobicContact CG1-SD 4.21Å; V730-Q854 HydrophobicContact CG2-CB 4.04Å
731	G	86	Confident	86.9	Confident	55 Å²	55	45 Å²	45	57%	0.567	25%	0.25	S	C	*	.	H	α-helix	trans	-56.8	-36.1	176.8	0	0	0	0	0	113.6	L729 G735	L729-G731 VanDerWaalsContact C-N 3.27Å; L729-G731 PolarHBondContact O-N 2.92Å; G731-G735 WeakPolarHBondContact O-CA 3.42Å; G731-G735 PolarHBondContact O-N 3.36Å
732	S	85.8	Confident	87.3	Confident	21 Å²	21	53 Å²	53	15%	0.147	28%	0.279	C	S	.	.	H	α-helix	trans	-80.9	-31.4	177.9	-61.9	0	0	0	0	113.2	L729 V730 E879 R883	L729-S732 PolarHBondContact O-N 2.91Å; V730-S732 PolarHBondContact O-N 3.16Å; S732-E879 WeakPolarHBondContact CB-OE2 3.17Å; S732-E879 PolarHBondContact OG-OE2 2.94Å; S732-R883 PolarHBondContact OG-NH2 3.19Å; S732-R883 VanDerWaalsContact OG-NH2 3.07Å
733	I	87.6	Confident	87.5	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-68.5	-40.5	175	-61.5	162.9	0	0	0	110.7	L725 L729 V730 T740 I741 M754 I872 I875	L725-I733 HydrophobicContact CD1-CD1 3.76Å; L725-I733 HydrophobicContact CD2-CD1 3.91Å; L725-I733 HydrophobicContact CG-CD1 4.26Å; L729-I733 HydrophobicContact CB-CD1 4.32Å; L729-I733 WeakPolarHBondContact O-CG1 3.27Å; L729-I733 PolarHBondContact O-N 3.16Å; L729-I733 VanDerWaalsContact O-N 3.16Å; V730-I733 PolarHBondContact O-N 3.11Å; V730-I733 VanDerWaalsContact O-N 3.16Å; I733-T740 WeakPolarHBondContact O-CB 3.43Å; I733-T740 WeakPolarHBondContact O-CG2 3.45Å; I733-I741 PolarHBondContact O-N 2.95Å; I733-M754 HydrophobicContact CG2-CE 3.91Å; I733-I872 HydrophobicContact CD1-CG2 3.97Å; I733-I872 HydrophobicContact CG1-CG2 4.3Å; I733-I872 HydrophobicContact CG2-CG1 4.16Å; I733-I872 HydrophobicContact CG2-CG2 4.08Å; I733-I875 HydrophobicContact CG1-CG2 4.43Å
734	I	90.1	Very high	87.6	Confident	58 Å²	58	56.7 Å²	56.7	30%	0.297	30%	0.299	S	S	.	.	H	α-helix	trans	-69	-50.6	171.6	-64	175	0	0	0	109.8	V730 G738 T740 I741 M754	V730-I734 HydrophobicContact CG1-CD1 3.66Å; V730-I734 HydrophobicContact CG1-CG1 4.09Å; V730-I734 WeakPolarHBondContact O-CG1 3.37Å; V730-I734 PolarHBondContact O-N 3.39Å; I734-G738 CarbonylContact O-C 3.55Å; I734-G738 VanDerWaalsContact O-C 3.24Å; I734-G738 VanDerWaalsContact O-CA 3.26Å; I734-G738 WeakPolarHBondContact O-CA 3.39Å; I734-T740 WeakPolarHBondContact O-CB 3.47Å; I734-T740 PolarHBondContact O-N 3.21Å; I734-T740 VanDerWaalsContact O-N 3.17Å; I734-I741 HydrophobicContact CB-CG2 4.5Å; I734-I741 HydrophobicContact CG2-CG2 4.21Å; I734-I741 PolarHBondContact O-N 2.82Å; I734-M754 HydrophobicContact CD1-CG 4.43Å; I734-M754 HydrophobicContact CG1-CE 4.11Å
735	G	88	Confident	87.8	Confident	17 Å²	17	58.8 Å²	58.8	18%	0.175	31%	0.311	C	S	.	.			trans	72.8	167.2	-175.9	0	0	0	0	0	113.7	G731 G737 G738 T740	G731-G735 WeakPolarHBondContact O-CA 3.42Å; G731-G735 PolarHBondContact O-N 3.36Å; G735-G737 PolarHBondContact O-N 2.89Å; G735-G738 PolarHBondContact O-N 2.93Å; G735-T740 WeakPolarHBondContact CA-OG1 3.4Å
736	R	87.6	Confident	88	Confident	246 Å²	246	64.1 Å²	64.1	93%	0.928	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-55.2	125.4	179.4	-70.8	-178.4	176.4	165.3	-1.4	110.6	G738 R739	R736-G738 PolarHBondContact O-N 3.19Å; R736-R739 WeakPolarHBondContact O-CB 3.44Å; R736-R739 PolarHBondContact O-N 3.45Å; R736-R739 VanDerWaalsContact O-N 3.14Å
737	G	85	Confident	88.5	Confident	75 Å²	75	69.6 Å²	69.6	77%	0.773	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	64.3	14.8	-177.1	0	0	0	0	0	115.5	G735 R739	G735-G737 PolarHBondContact O-N 2.89Å; G737-R739 VanDerWaalsContact C-N 3.26Å; G737-R739 PolarHBondContact O-N 3.39Å
738	G	88.2	Confident	88.8	Confident	11 Å²	11	68.2 Å²	68.2	11%	0.113	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	71.7	16.9	-171.8	0	0	0	0	0	113.8	I734 G735 R736 T740 I741 R742	I734-G738 CarbonylContact O-C 3.55Å; I734-G738 VanDerWaalsContact O-C 3.24Å; I734-G738 VanDerWaalsContact O-CA 3.26Å; I734-G738 WeakPolarHBondContact O-CA 3.39Å; G735-G738 PolarHBondContact O-N 2.93Å; R736-G738 PolarHBondContact O-N 3.19Å; G738-T740 VanDerWaalsContact C-N 3.32Å; G738-T740 PolarHBondContact O-N 3.26Å; G738-I741 VanDerWaalsContact O-CG2 3.31Å; G738-I741 WeakPolarHBondContact O-CG2 3.31Å; G738-R742 WeakPolarHBondContact O-CB 3.41Å; G738-R742 WeakPolarHBondContact O-CG 3.49Å; G738-R742 PolarHBondContact O-N 3.17Å
739	R	91	Very high	89.1	Confident	196 Å²	196	68.7 Å²	68.7	74%	0.74	37%	0.368	S	S	*	.	H	α-helix	trans	-61.2	-39.4	-175.6	-173.9	175.5	179.9	171.1	1.3	112.4	R736 G737 Q743	R736-R739 WeakPolarHBondContact O-CB 3.44Å; R736-R739 PolarHBondContact O-N 3.45Å; R736-R739 VanDerWaalsContact O-N 3.14Å; G737-R739 VanDerWaalsContact C-N 3.26Å; G737-R739 PolarHBondContact O-N 3.39Å; R739-Q743 VanDerWaalsContact O-CB 3.31Å; R739-Q743 WeakPolarHBondContact O-CB 3.39Å; R739-Q743 PolarHBondContact O-N 3.03Å
740	T	91.9	Very high	89.3	Confident	37 Å²	37	68.1 Å²	68.1	23%	0.227	37%	0.365	C	S	.	.	H	α-helix	trans	-68.6	-53.3	-178.5	-52.1	0	0	0	0	110.9	I733 I734 G735 G738 R742 Q743 I744 I875	I733-T740 WeakPolarHBondContact O-CB 3.43Å; I733-T740 WeakPolarHBondContact O-CG2 3.45Å; I734-T740 WeakPolarHBondContact O-CB 3.47Å; I734-T740 PolarHBondContact O-N 3.21Å; I734-T740 VanDerWaalsContact O-N 3.17Å; G735-T740 WeakPolarHBondContact CA-OG1 3.4Å; G738-T740 VanDerWaalsContact C-N 3.32Å; G738-T740 PolarHBondContact O-N 3.26Å; T740-R742 VanDerWaalsContact C-N 3.33Å; T740-R742 PolarHBondContact O-N 3.39Å; T740-Q743 WeakPolarHBondContact O-CB 3.18Å; T740-Q743 PolarHBondContact O-N 2.86Å; T740-I744 HydrophobicContact CG2-CD1 4.22Å; T740-I744 WeakPolarHBondContact O-CG1 3.38Å; T740-I744 PolarHBondContact O-N 3.05Å; T740-I875 HydrophobicContact CG2-CD1 3.54Å
741	I	92.4	Very high	89.4	Confident	26 Å²	26	75.1 Å²	75.1	13%	0.133	40%	0.395	C	S	.	.	H	α-helix	trans	-62.1	-38.1	179.3	-170.9	171.2	0	0	0	112.5	I733 I734 G738 I744 T745 I752 M754	I733-I741 PolarHBondContact O-N 2.95Å; I734-I741 HydrophobicContact CB-CG2 4.5Å; I734-I741 HydrophobicContact CG2-CG2 4.21Å; I734-I741 PolarHBondContact O-N 2.82Å; G738-I741 VanDerWaalsContact O-CG2 3.31Å; G738-I741 WeakPolarHBondContact O-CG2 3.31Å; I741-I744 PolarHBondContact O-N 3.34Å; I741-T745 PolarHBondContact O-N 2.99Å; I741-I752 HydrophobicContact CD1-CB 4.05Å; I741-I752 HydrophobicContact CD1-CG2 3.77Å; I741-I752 HydrophobicContact CG1-CB 4.12Å; I741-I752 HydrophobicContact CG1-CD1 3.91Å; I741-I752 HydrophobicContact CG1-CG2 4.21Å; I741-M754 HydrophobicContact CD1-CE 4.11Å; I741-M754 HydrophobicContact CD1-CG 4.33Å
742	R	91.8	Very high	89.6	Confident	178 Å²	178	73.6 Å²	73.6	67%	0.672	37%	0.374	S	S	*	.	H	α-helix	trans	-60.8	-46.3	171.3	-72.1	172.9	-169.9	-141	4.6	111.4	G738 T740 I744 T745 T746	G738-R742 WeakPolarHBondContact O-CB 3.41Å; G738-R742 WeakPolarHBondContact O-CG 3.49Å; G738-R742 PolarHBondContact O-N 3.17Å; T740-R742 VanDerWaalsContact C-N 3.33Å; T740-R742 PolarHBondContact O-N 3.39Å; R742-I744 PolarHBondContact O-N 3.33Å; R742-T745 PolarHBondContact O-N 3.05Å; R742-T746 WeakPolarHBondContact O-CB 3.31Å; R742-T746 PolarHBondContact O-N 3.31Å; R742-T746 PolarHBondContact O-OG1 2.7Å; R742-T746 VanDerWaalsContact O-OG1 3.05Å
743	Q	92	Very high	89.6	Confident	128 Å²	128	74 Å²	74	60%	0.598	38%	0.381	S	S	*	.	H	α-helix	trans	-62.6	-39.5	178.8	-177	173.5	-9.3	0	0	112.3	R739 T740 T746 K747	R739-Q743 VanDerWaalsContact O-CB 3.31Å; R739-Q743 WeakPolarHBondContact O-CB 3.39Å; R739-Q743 PolarHBondContact O-N 3.03Å; T740-Q743 WeakPolarHBondContact O-CB 3.18Å; T740-Q743 PolarHBondContact O-N 2.86Å; Q743-T746 PolarHBondContact O-N 3.49Å; Q743-K747 VanDerWaalsContact O-CB 3.25Å; Q743-K747 WeakPolarHBondContact O-CB 3.33Å; Q743-K747 PolarHBondContact O-N 2.86Å
744	I	92.8	Very high	89.5	Confident	5 Å²	5	76.1 Å²	76.1	3%	0.026	39%	0.392	C	S	.	.	H	α-helix	trans	-62	-54	174.2	-60.1	160.4	0	0	0	109.8	T740 I741 R742 T746 K747 T748 I752 A868 E871 I872 I875	T740-I744 HydrophobicContact CG2-CD1 4.22Å; T740-I744 WeakPolarHBondContact O-CG1 3.38Å; T740-I744 PolarHBondContact O-N 3.05Å; I741-I744 PolarHBondContact O-N 3.34Å; R742-I744 PolarHBondContact O-N 3.33Å; I744-T746 VanDerWaalsContact C-N 3.29Å; I744-T746 PolarHBondContact O-N 2.97Å; I744-K747 PolarHBondContact O-N 3.43Å; I744-T748 HydrophobicContact CG2-CG2 4.28Å; I744-T748 PolarHBondContact O-N 3.37Å; I744-T748 PolarHBondContact O-OG1 3.48Å; I744-I752 HydrophobicContact CB-CD1 4.04Å; I744-I752 HydrophobicContact CG2-CD1 3.75Å; I744-A868 HydrophobicContact CG2-CB 4.23Å; I744-E871 HydrophobicContact CG1-CB 4.15Å; I744-E871 HydrophobicContact CG2-CB 3.91Å; I744-E871 HydrophobicContact CG2-CG 4.4Å; I744-I872 HydrophobicContact CD1-CG1 4Å; I744-I875 HydrophobicContact CD1-CD1 3.74Å; I744-I875 HydrophobicContact CG1-CD1 4.28Å
745	T	91.3	Very high	88.9	Confident	46 Å²	46	77.6 Å²	77.6	28%	0.282	40%	0.396	S	S	.	.	H	α-helix	trans	-57	-39.3	178.4	-79.8	0	0	0	0	112.7	I741 R742 G749 A750	I741-T745 PolarHBondContact O-N 2.99Å; R742-T745 PolarHBondContact O-N 3.05Å; T745-G749 VanDerWaalsContact O-CA 3.32Å; T745-G749 WeakPolarHBondContact O-CA 3.39Å; T745-G749 PolarHBondContact O-N 3.46Å; T745-A750 WeakPolarHBondContact CA-O 3.26Å; T745-A750 WeakPolarHBondContact CB-O 3.39Å; T745-A750 WeakPolarHBondContact CG2-O 3.32Å; T745-A750 PolarHBondContact OG1-O 2.93Å
746	T	90.9	Very high	87.9	Confident	122 Å²	122	85 Å²	85	75%	0.748	43%	0.426	S	S	*	.	H	α-helix	trans	-69.6	-35.1	175	-57.5	0	0	0	0	112.7	R742 Q743 I744	R742-T746 WeakPolarHBondContact O-CB 3.31Å; R742-T746 PolarHBondContact O-N 3.31Å; R742-T746 PolarHBondContact O-OG1 2.7Å; R742-T746 VanDerWaalsContact O-OG1 3.05Å; Q743-T746 PolarHBondContact O-N 3.49Å; I744-T746 VanDerWaalsContact C-N 3.29Å; I744-T746 PolarHBondContact O-N 2.97Å
747	K	92.2	Very high	86.9	Confident	135 Å²	135	74.3 Å²	74.3	59%	0.587	39%	0.387	S	S	*	.	H	α-helix	trans	-74	-37.6	-179.9	-169.6	-169.5	-171.5	-171.2	0	112.7	Q743 I744 E871	Q743-K747 VanDerWaalsContact O-CB 3.25Å; Q743-K747 WeakPolarHBondContact O-CB 3.33Å; Q743-K747 PolarHBondContact O-N 2.86Å; I744-K747 PolarHBondContact O-N 3.43Å; K747-E871 HydrophobicContact CD-CG 4.31Å; K747-E871 WeakPolarHBondContact CD-OE2 3.33Å; K747-E871 IonicContact NZ-OE1 3.71Å; K747-E871 PolarHBondContact NZ-OE1 2.86Å; K747-E871 IonicContact NZ-OE2 3.86Å; K747-E871 PolarHBondContact NZ-OE2 3.38Å
748	T	90.4	Very high	85.9	Confident	20 Å²	20	75.2 Å²	75.2	12%	0.123	37%	0.374	C	S	.	.	H	α-helix	trans	-106.5	-15.5	-170.6	66.3	0	0	0	0	113.6	I744 A750 Q864 A867 A868 E871	I744-T748 HydrophobicContact CG2-CG2 4.28Å; I744-T748 PolarHBondContact O-N 3.37Å; I744-T748 PolarHBondContact O-OG1 3.48Å; T748-A750 PolarHBondContact O-N 3.4Å; T748-A750 PolarHBondContact OG1-N 2.93Å; T748-Q864 WeakPolarHBondContact O-CB 3.47Å; T748-Q864 WeakPolarHBondContact O-CG 3.48Å; T748-A867 HydrophobicContact CG2-CB 3.98Å; T748-A868 HydrophobicContact CG2-CB 4.29Å; T748-E871 HydrophobicContact CG2-CG 4.07Å
749	G	87.5	Confident	84.9	Confident	48 Å²	48	75.4 Å²	75.4	50%	0.495	37%	0.372	S	S	.	.			trans	76.2	-9.3	-174.3	0	0	0	0	0	114.7	T745	T745-G749 VanDerWaalsContact O-CA 3.32Å; T745-G749 WeakPolarHBondContact O-CA 3.39Å; T745-G749 PolarHBondContact O-N 3.46Å
750	A	87.8	Confident	83.4	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	37%	0.365	C	S	.	.			trans	-75.9	135.3	179	0	0	0	0	0	111.6	T745 T748 F859 Q864 A868	T745-A750 WeakPolarHBondContact CA-O 3.26Å; T745-A750 WeakPolarHBondContact CB-O 3.39Å; T745-A750 WeakPolarHBondContact CG2-O 3.32Å; T745-A750 PolarHBondContact OG1-O 2.93Å; T748-A750 PolarHBondContact O-N 3.4Å; T748-A750 PolarHBondContact OG1-N 2.93Å; A750-F859 WeakPolarHBondContact CA-O 3.32Å; A750-Q864 HydrophobicContact CB-CB 4.13Å; A750-A868 HydrophobicContact CB-CB 3.7Å
751	K	87.5	Confident	81.8	Confident	153 Å²	153	69.8 Å²	69.8	67%	0.665	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.2	115.3	174.3	-177.1	-179.6	-179.9	-176.8	0	109.2	F859	K751-F859 HydrophobicContact CB-CB 4.34Å; K751-F859 PolarHBondContact N-O 3.07Å; K751-F859 PolarHBondContact O-N 3.34Å
752	I	90.6	Very high	79.7	Confident	22 Å²	22	73.3 Å²	73.3	11%	0.113	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	124.1	-178.4	-50.6	166	0	0	0	108.9	I741 I744 L858 I872	I741-I752 HydrophobicContact CD1-CB 4.05Å; I741-I752 HydrophobicContact CD1-CG2 3.77Å; I741-I752 HydrophobicContact CG1-CB 4.12Å; I741-I752 HydrophobicContact CG1-CD1 3.91Å; I741-I752 HydrophobicContact CG1-CG2 4.21Å; I744-I752 HydrophobicContact CB-CD1 4.04Å; I744-I752 HydrophobicContact CG2-CD1 3.75Å; I752-L858 HydrophobicContact CB-CD2 4.26Å; I752-L858 HydrophobicContact CG1-CD2 3.72Å; I752-L858 HydrophobicContact CG2-CD2 4.03Å; I752-I872 HydrophobicContact CD1-CD1 4.27Å
753	G	86.2	Confident	77.9	Confident	29 Å²	29	68.1 Å²	68.1	30%	0.299	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	123.8	171.1	0	0	0	0	0	111.3	A856 I857	G753-A856 CarbonylContact O-C 3.58Å; G753-A856 WeakPolarHBondContact O-CA 3.49Å; G753-I857 PolarHBondContact N-O 2.8Å; G753-I857 PolarHBondContact O-N 3.09Å
754	M	84	Confident	75.7	Confident	47 Å²	47	62.9 Å²	62.9	23%	0.232	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	129.3	167.4	-61.3	-71.4	-173.5	0	0	108.5	L725 V730 I733 I734 I741 A856	L725-M754 HydrophobicContact CD1-CE 3.93Å; L725-M754 HydrophobicContact CD1-SD 4.22Å; V730-M754 HydrophobicContact CG1-CE 4.07Å; V730-M754 HydrophobicContact CG1-SD 4.21Å; I733-M754 HydrophobicContact CG2-CE 3.91Å; I734-M754 HydrophobicContact CD1-CG 4.43Å; I734-M754 HydrophobicContact CG1-CE 4.11Å; I741-M754 HydrophobicContact CD1-CE 4.11Å; I741-M754 HydrophobicContact CD1-CG 4.33Å; M754-A856 HydrophobicContact SD-CB 3.66Å
755	K	78.6	Confident	73.1	Confident	88 Å²	88	65 Å²	65	38%	0.383	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	154.6	162.4	-79.8	-171.6	118.2	-155.5	0	109.3	D757 Q854 L855 I857	K755-D757 VanDerWaalsContact C-N 3.31Å; K755-D757 HydrophobicContact CB-CB 4.39Å; K755-D757 VanDerWaalsContact CD-OD2 3.31Å; K755-D757 WeakPolarHBondContact CD-OD2 3.25Å; K755-D757 VanDerWaalsContact CE-OD2 3.28Å; K755-D757 WeakPolarHBondContact CE-OD2 3.48Å; K755-D757 IonicContact NZ-OD2 3.49Å; K755-D757 PolarHBondContact NZ-OD2 3.05Å; K755-Q854 WeakPolarHBondContact O-CG 3.31Å; K755-Q854 PolarHBondContact O-NE2 2.97Å; K755-L855 HydrophobicContact CB-CB 4.38Å; K755-L855 HydrophobicContact CD-CD2 3.91Å; K755-L855 PolarHBondContact N-O 2.88Å; K755-I857 HydrophobicContact CD-CD1 4.17Å; K755-I857 HydrophobicContact CG-CD1 4.44Å
756	Q	66.3	Low	70.3	Confident	172 Å²	172	68.3 Å²	68.3	80%	0.804	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	4.4	172.3	-76	157.4	-77.7	0	0	112.8	I758	Q756-I758 PolarHBondContact O-N 2.76Å
757	D	66.5	Low	67.4	Low	22 Å²	22	67.8 Å²	67.8	12%	0.118	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	105.7	167.3	-54.5	-13.4	0	0	0	109	K755	K755-D757 VanDerWaalsContact C-N 3.31Å; K755-D757 HydrophobicContact CB-CB 4.39Å; K755-D757 VanDerWaalsContact CD-OD2 3.31Å; K755-D757 WeakPolarHBondContact CD-OD2 3.25Å; K755-D757 VanDerWaalsContact CE-OD2 3.28Å; K755-D757 WeakPolarHBondContact CE-OD2 3.48Å; K755-D757 IonicContact NZ-OD2 3.49Å; K755-D757 PolarHBondContact NZ-OD2 3.05Å
758	I	64.9	Low	64.3	Low	95 Å²	95	64.7 Å²	64.7	49%	0.487	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	124.4	172.7	-65.8	170.7	0	0	0	108.1	Q756 E852	Q756-I758 PolarHBondContact O-N 2.76Å; I758-E852 HydrophobicContact CG2-CB 3.63Å; I758-E852 HydrophobicContact CG2-CG 3.53Å
759	I	67.3	Low	61.3	Low	15 Å²	15	74 Å²	74	8%	0.077	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	101.8	178.8	-61.9	161.8	0	0	0	107.2	L724 F761 S853 L855 L893 L929 I931	L724-I759 HydrophobicContact CD2-CB 4.29Å; L724-I759 HydrophobicContact CD2-CD1 3.68Å; I759-F761 PolarHBondContact O-N 2.63Å; I759-F761 VanDerWaalsContact O-N 3.13Å; I759-S853 WeakPolarHBondContact CB-O 3.24Å; I759-S853 PolarHBondContact N-O 3.03Å; I759-S853 WeakPolarHBondContact O-CA 3.24Å; I759-S853 VanDerWaalsContact O-CB 3.27Å; I759-S853 WeakPolarHBondContact O-CB 3.02Å; I759-S853 PolarHBondContact O-N 2.92Å; I759-L855 HydrophobicContact CD1-CB 3.96Å; I759-L893 HydrophobicContact CD1-CD1 4.42Å; I759-L929 HydrophobicContact CG2-CD1 3.78Å; I759-I931 HydrophobicContact CD1-CD1 3.5Å; I759-I931 HydrophobicContact CD1-CG1 3.85Å; I759-I931 HydrophobicContact CD1-CG2 4.4Å; I759-I931 HydrophobicContact CG1-CD1 4.42Å; I759-I931 HydrophobicContact CG1-CG1 4.24Å
760	T	58.3	Low	58.5	Low	99 Å²	99	75.3 Å²	75.3	61%	0.607	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.8	109.4	175.6	48.9	0	0	0	0	109.9	E852	T760-E852 HydrophobicContact CG2-CG 3.97Å
761	F	59.3	Low	55.7	Low	16 Å²	16	83.8 Å²	83.8	7%	0.07	47%	0.468	C	S	.	.			trans	-137.5	94.8	-172.3	-178.3	-116	0	0	0	113.6	L724 I759 Q763 F764 D851 T925 L929 V948 V950	L724-F761 HydrophobicContact CD1-CD1 4.29Å; I759-F761 PolarHBondContact O-N 2.63Å; I759-F761 VanDerWaalsContact O-N 3.13Å; F761-Q763 HydrophobicContact CD1-CB 4.45Å; F761-Q763 HydrophobicContact CE1-CB 3.63Å; F761-Q763 HydrophobicContact CE2-CB 3.86Å; F761-Q763 HydrophobicContact CZ-CB 3.28Å; F761-Q763 HydrophobicContact CZ-CG 4.38Å; F761-Q763 PolarHBondContact O-N 2.93Å; F761-F764 AromaticContact CD1-CD2 3.63Å; F761-F764 HydrophobicContact CD1-CD2 3.63Å; F761-F764 AromaticContact CD1-CE2 3.62Å; F761-F764 HydrophobicContact CD1-CE2 3.62Å; F761-F764 HydrophobicContact CE1-CD2 4.26Å; F761-F764 HydrophobicContact CE1-CE2 4.24Å; F761-D851 PolarHBondContact N-O 3.36Å; F761-D851 VanDerWaalsContact O-CB 3.24Å; F761-D851 WeakPolarHBondContact O-CB 3.33Å; F761-T925 HydrophobicContact CD2-CG2 4.34Å; F761-T925 HydrophobicContact CE2-CG2 3.23Å; F761-T925 HydrophobicContact CZ-CG2 3.37Å; F761-L929 HydrophobicContact CD2-CD1 4.29Å; F761-V948 HydrophobicContact CD2-CG2 4.49Å; F761-V948 HydrophobicContact CE1-CB 4.23Å; F761-V948 HydrophobicContact CE1-CG1 4.14Å; F761-V948 HydrophobicContact CE1-CG2 4.36Å; F761-V948 HydrophobicContact CE2-CG2 4.35Å; F761-V948 HydrophobicContact CZ-CB 4.09Å; F761-V948 HydrophobicContact CZ-CG1 4.46Å; F761-V948 HydrophobicContact CZ-CG2 4.25Å; F761-V950 HydrophobicContact CE1-CG2 3.59Å; F761-V950 HydrophobicContact CZ-CG2 3.81Å
762	S	48	Very low	52.9	Low	99 Å²	99	85.6 Å²	85.6	69%	0.692	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	20.9	-171.1	-167.3	0	0	0	0	116.7
763	Q	53	Low	49.8	Very low	69 Å²	69	90.1 Å²	90.1	32%	0.322	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	12.7	-178.8	-140.2	-177.6	10.8	0	0	113.8	F761 R952	F761-Q763 HydrophobicContact CD1-CB 4.45Å; F761-Q763 HydrophobicContact CE1-CB 3.63Å; F761-Q763 HydrophobicContact CE2-CB 3.86Å; F761-Q763 HydrophobicContact CZ-CB 3.28Å; F761-Q763 HydrophobicContact CZ-CG 4.38Å; F761-Q763 PolarHBondContact O-N 2.93Å; Q763-R952 PolarHBondContact O-NH2 2.79Å
764	F	46.3	Very low	46.9	Very low	18 Å²	18	98.6 Å²	98.6	8%	0.079	53%	0.534	C	S	.	.	S	Bend	trans	-75.9	-44.4	165.8	-86.1	-77.1	0	0	0	111.2	L724 F761 D851 S853 C889 R952	L724-F764 HydrophobicContact CB-CE2 3.92Å; L724-F764 HydrophobicContact CB-CZ 3.71Å; L724-F764 HydrophobicContact CD1-CE2 4.18Å; F761-F764 AromaticContact CD1-CD2 3.63Å; F761-F764 HydrophobicContact CD1-CD2 3.63Å; F761-F764 AromaticContact CD1-CE2 3.62Å; F761-F764 HydrophobicContact CD1-CE2 3.62Å; F761-F764 HydrophobicContact CE1-CD2 4.26Å; F761-F764 HydrophobicContact CE1-CE2 4.24Å; F764-D851 HydrophobicContact CB-CB 4.08Å; F764-S853 WeakPolarHBondContact CD2-OG 3.32Å; F764-S853 WeakPolarHBondContact CE2-OG 3.24Å; F764-C889 VanDerWaalsContact CD1-SG 3.53Å; F764-C889 WeakPolarHBondContact CE1-O 3.13Å; F764-R952 PolarHBondContact O-NH2 2.86Å
765	S	39.3	Very low	44.3	Very low	50 Å²	50	105.2 Å²	105.2	35%	0.35	56%	0.561	S	S	.	*	S	Bend	trans	-56.6	144.9	166.5	27.3	0	0	0	0	112.8	D851 R952	S765-D851 VanDerWaalsContact CB-OD2 3.32Å; S765-D851 WeakPolarHBondContact CB-OD2 3.42Å; S765-D851 PolarHBondContact N-OD2 2.97Å; S765-D851 PolarHBondContact OG-OD2 2.75Å; S765-R952 PolarHBondContact O-NH2 2.81Å
766	L	31.9	Very low	42	Very low	115 Å²	115	103.1 Å²	103.1	60%	0.602	56%	0.558	S	S	*	*			trans	-77.2	137.4	167.2	-86.5	151.3	0	0	0	108.9	G768	L766-G768 PolarHBondContact O-N 2.87Å
767	P	29.2	Very low	40.3	Very low	112 Å²	112	99 Å²	99	73%	0.727	55%	0.548	S	S	*	.			trans	-61.1	109.8	155	27.9	-31.2	0	0	0	106.7
768	G	28	Very low	38.7	Very low	69 Å²	69	103.2 Å²	103.2	71%	0.711	57%	0.571	S	S	*	*			trans	-59	141.2	-176.5	0	0	0	0	0	110.9	L766 G770	L766-G768 PolarHBondContact O-N 2.87Å; G768-G770 PolarHBondContact O-N 2.82Å
769	K	27.1	Very low	37.2	Very low	216 Å²	216	102.8 Å²	102.8	94%	0.939	58%	0.576	S	S	*	*			trans	-71.1	60.6	176.7	-76.8	-165.2	172.2	-169.7	0	112	K771	K769-K771 PolarHBondContact O-N 2.67Å; K769-K771 VanDerWaalsContact O-N 3.14Å
770	G	28.2	Very low	35.5	Very low	75 Å²	75	109 Å²	109	77%	0.773	61%	0.609	S	S	*	*			trans	-78.1	84.7	171.9	0	0	0	0	0	111.3	G768	G768-G770 PolarHBondContact O-N 2.82Å
771	K	28.9	Very low	34.2	Very low	178 Å²	178	107.6 Å²	107.6	77%	0.774	62%	0.615	S	S	*	*			trans	-68.1	145.8	166.1	-73.7	-173	173.3	-178	0	109.6	K769	K769-K771 PolarHBondContact O-N 2.67Å; K769-K771 VanDerWaalsContact O-N 3.14Å
772	K	29	Very low	32.9	Very low	191 Å²	191	113.2 Å²	113.2	83%	0.83	64%	0.644	S	S	*	*			trans	96.8	89.3	166.9	-54.7	177.6	-177.6	-177.3	0	118.6
773	T	25.7	Very low	32.1	Very low	118 Å²	118	114.2 Å²	114.2	72%	0.724	64%	0.642	S	S	*	*				34.2	125.2	120.9	55.2	0	0	0	0	121.1
774	F	25.6	Very low	30.9	Very low	206 Å²	206	118.9 Å²	118.9	90%	0.904	66%	0.663	S	S	*	*				-164.2	-178.1	109	-108.7	-70.4	0	0	0	112.3
775	K	29.9	Very low	30.1	Very low	186 Å²	186	125.2 Å²	125.2	81%	0.809	70%	0.696	S	S	*	*			trans	-114.2	137.6	-157.3	-76.5	-172.2	177.8	-173.4	0	116.7
776	S	30.2	Very low	29.4	Very low	45 Å²	45	126.7 Å²	126.7	32%	0.315	71%	0.712	S	S	.	*				59	121.3	113.5	-137.5	0	0	0	0	122.9	G1993 S1994	S776-G1993 WeakPolarHBondContact CA-O 3.5Å; S776-G1993 PolarHBondContact N-O 3.02Å; S776-G1993 VanDerWaalsContact OG-CA 3.23Å; S776-G1993 WeakPolarHBondContact OG-CA 3.41Å; S776-S1994 CarbonylContact C-O 3.59Å; S776-S1994 WeakPolarHBondContact CA-O 3.11Å; S776-S1994 VanDerWaalsContact CA-OG 3.25Å; S776-S1994 WeakPolarHBondContact CA-OG 2.99Å; S776-S1994 PolarHBondContact N-O 2.88Å; S776-S1994 PolarHBondContact OG-OG 2.95Å
777	S	29.7	Very low	29.2	Very low	85 Å²	85	127 Å²	127	59%	0.594	72%	0.723	S	S	*	*			trans	-175.5	83.1	149.9	-77.5	0	0	0	0	114.4	S1994 S1995	S777-S1994 PolarHBondContact N-O 3.21Å; S777-S1994 PolarHBondContact N-OG 2.91Å; S777-S1995 WeakPolarHBondContact O-CB 3.5Å; S777-S1995 PolarHBondContact O-OG 3.31Å
778	D	32.8	Very low	29.2	Very low	111 Å²	111	127.2 Å²	127.2	59%	0.594	72%	0.722	S	S	*	*			trans	-53.4	158	-165.1	-66.5	-90.4	0	0	0	119	S1994 S1995	D778-S1994 VanDerWaalsContact N-CB 3.34Å; D778-S1994 PolarHBondContact N-OG 2.65Å; D778-S1994 VanDerWaalsContact OD1-CB 3.26Å; D778-S1994 WeakPolarHBondContact OD1-CB 3.12Å; D778-S1994 PolarHBondContact OD1-OG 3.25Å; D778-S1994 WeakPolarHBondContact OD2-CB 3.08Å; D778-S1994 PolarHBondContact OD2-OG 3.01Å; D778-S1995 VanDerWaalsContact CA-OG 3.31Å; D778-S1995 WeakPolarHBondContact CA-OG 3.41Å
779	S	34.6	Very low	29.1	Very low	85 Å²	85	132.2 Å²	132.2	59%	0.594	73%	0.733	S	S	*	*				161.6	142	107	53.2	0	0	0	0	116.6
780	N	30.3	Very low	29	Very low	145 Å²	145	129.8 Å²	129.8	78%	0.775	73%	0.725	S	S	*	*			trans	57.9	144.5	145.1	-57.4	-6	0	0	0	121.7
781	G	32	Very low	28.9	Very low	71 Å²	71	135.1 Å²	135.1	73%	0.732	73%	0.727	S	S	*	*			cis	160.8	176	-1.7	0	0	0	0	0	110.2
782	I	32.4	Very low	28.7	Very low	133 Å²	133	137.1 Å²	137.1	68%	0.682	73%	0.73	S	S	*	*			cis	-174.4	147.4	-5.5	-111.1	160	0	0	0	104.7
783	N	30.3	Very low	28.6	Very low	121 Å²	121	131 Å²	131	65%	0.647	72%	0.721	S	S	*	*			cis	-124.6	-166.5	0.8	-107	-18.6	0	0	0	108.8
784	H	28.9	Very low	28.6	Very low	167 Å²	167	133.4 Å²	133.4	77%	0.773	72%	0.724	S	S	*	*			cis	71.9	149.9	27.6	-68.7	-98.1	0	0	0	114.4
785	I	29.5	Very low	28.6	Very low	151 Å²	151	133.2 Å²	133.2	77%	0.774	73%	0.726	S	S	*	*			cis	-127.4	143.6	30	-64.3	166.3	0	0	0	114.5
786	A	24	Very low	28.5	Very low	81 Å²	81	131.9 Å²	131.9	67%	0.669	72%	0.723	S	S	*	*			trans	-136.8	136.6	155.7	0	0	0	0	0	108.9
787	S	27	Very low	28.2	Very low	121 Å²	121	139.5 Å²	139.5	85%	0.846	75%	0.753	S	S	*	*			trans	-83.9	125.3	-178.5	-61.3	0	0	0	0	111.9
788	T	29	Very low	28	Very low	116 Å²	116	138.9 Å²	138.9	71%	0.712	76%	0.761	S	S	*	*			trans	-127	126.7	176.3	-64.2	0	0	0	0	109.6	H790	T788-H790 HydrophobicContact CG2-CB 4.36Å
789	N	25.6	Very low	27.7	Very low	175 Å²	175	141.7 Å²	141.7	94%	0.936	77%	0.77	S	S	*	*			trans	-84	114.3	168.4	-87.2	-6.6	0	0	0	110.2
790	H	25	Very low	27.3	Very low	165 Å²	165	147.4 Å²	147.4	76%	0.764	78%	0.784	S	S	*	*			trans	-154.9	105.9	172.5	-170.5	4.1	0	0	0	112.5	T788	T788-H790 HydrophobicContact CG2-CB 4.36Å
791	F	26	Very low	27.1	Very low	187 Å²	187	147.8 Å²	147.8	82%	0.82	78%	0.782	S	S	*	*			trans	-159.6	156.4	163.1	-98.5	-94.3	0	0	0	105.6
792	R	26	Very low	26.7	Very low	219 Å²	219	153.2 Å²	153.2	83%	0.826	79%	0.788	S	S	*	*			cis	-177.3	158.5	-24.1	172.9	176.8	174.7	-145	2.6	103.3
793	G	26	Very low	26.4	Very low	64 Å²	64	151 Å²	151	66%	0.66	78%	0.78	S	S	*	*			cis	-163.8	-166.1	-7.6	0	0	0	0	0	106.2
794	E	26.2	Very low	26.1	Very low	167 Å²	167	150.8 Å²	150.8	78%	0.78	79%	0.787	S	S	*	*			trans	-116.4	150.1	177.1	-66.8	176.6	147.5	0	0	110.6
795	E	25.5	Very low	26	Very low	203 Å²	203	150.6 Å²	150.6	95%	0.949	79%	0.787	S	S	*	*			trans	-118.9	122.3	147.6	-70.1	-166.8	152.3	0	0	107.7
796	E	27.5	Very low	25.9	Very low	157 Å²	157	148.4 Å²	148.4	73%	0.734	78%	0.783	S	S	*	*			trans	-95.6	143.3	161.3	-64.4	-177.6	132.3	0	0	107.5
797	E	24.2	Very low	26	Very low	205 Å²	205	150.9 Å²	150.9	96%	0.958	79%	0.792	S	S	*	*				-158.7	160	114.9	-112.7	-176.2	-155.2	0	0	110.5
798	G	26.1	Very low	26	Very low	73 Å²	73	151.2 Å²	151.2	75%	0.753	78%	0.784	S	S	*	*			trans	121.7	4.7	179.8	0	0	0	0	0	117.1	K800	G798-K800 PolarHBondContact O-N 2.89Å; G798-K800 VanDerWaalsContact O-N 3.11Å
799	E	25.7	Very low	25.8	Very low	169 Å²	169	149.2 Å²	149.2	79%	0.79	78%	0.775	S	S	*	*			trans	-67.4	107.8	165.2	-76.5	-152.1	155.9	0	0	109.9	E801	E799-E801 PolarHBondContact O-N 2.83Å
800	K	27.6	Very low	26	Very low	205 Å²	205	146.1 Å²	146.1	89%	0.891	75%	0.753	S	S	*	*			trans	-69.5	114.6	159.8	-80.5	-173.1	175.2	179.5	0	108.7	G798 E802	G798-K800 PolarHBondContact O-N 2.89Å; G798-K800 VanDerWaalsContact O-N 3.11Å; K800-E802 PolarHBondContact O-N 3.11Å
801	E	24	Very low	26.3	Very low	154 Å²	154	144.8 Å²	144.8	72%	0.72	75%	0.751	S	S	*	*			trans	-57	121.9	169.5	-71.7	-169.8	147.7	0	0	110.8	E799 T803	E799-E801 PolarHBondContact O-N 2.83Å; E801-T803 PolarHBondContact OE2-OG1 3.07Å
802	E	25.5	Very low	26.5	Very low	184 Å²	184	142.2 Å²	142.2	86%	0.86	75%	0.751	S	S	*	*			trans	-101	76.4	152.5	-165.7	164.6	-118.3	0	0	108.6	K800 C804	K800-E802 PolarHBondContact O-N 3.11Å; E802-C804 VanDerWaalsContact C-N 3.34Å; E802-C804 PolarHBondContact O-N 2.87Å
803	T	24.7	Very low	26.5	Very low	86 Å²	86	140.1 Å²	140.1	53%	0.528	75%	0.748	S	S	.	*			trans	-75.8	81.6	179.4	-67	0	0	0	0	110.4	E801 Q805	E801-T803 PolarHBondContact OE2-OG1 3.07Å; T803-Q805 HydrophobicContact CG2-CG 3.99Å; T803-Q805 PolarHBondContact O-N 3.24Å
804	C	24.1	Very low	26.8	Very low	117 Å²	117	143.8 Å²	143.8	79%	0.791	76%	0.758	S	S	*	*			trans	-81.4	105.6	165.5	-81.2	0	0	0	0	110.3	E802	E802-C804 VanDerWaalsContact C-N 3.34Å; E802-C804 PolarHBondContact O-N 2.87Å
805	Q	27.4	Very low	26.9	Very low	163 Å²	163	142 Å²	142	76%	0.762	75%	0.754	S	S	*	*			trans	-76.5	161.6	-179.6	-63.7	179.8	-35.6	0	0	112.4	T803	T803-Q805 HydrophobicContact CG2-CG 3.99Å; T803-Q805 PolarHBondContact O-N 3.24Å
806	P	26.6	Very low	27.1	Very low	106 Å²	106	139.2 Å²	139.2	69%	0.688	75%	0.751	S	S	*	*			trans	-63	150.4	158.5	30.4	-35.7	0	0	0	110.6	D808	P806-D808 PolarHBondContact O-N 3.04Å; P806-D808 VanDerWaalsContact O-N 3.13Å
807	P	25.9	Very low	27.1	Very low	132 Å²	132	137.1 Å²	137.1	86%	0.857	74%	0.744	S	S	*	*			trans	-80.7	94.7	-177	31.8	-34.7	0	0	0	112.2
808	D	26.9	Very low	27.5	Very low	128 Å²	128	134.5 Å²	134.5	68%	0.684	74%	0.737	S	S	*	*			trans	-93.9	102.1	166	-106.6	-45.8	0	0	0	109.9	P806 H2035	P806-D808 PolarHBondContact O-N 3.04Å; P806-D808 VanDerWaalsContact O-N 3.13Å; D808-H2035 IonicContact OD1-CE1 2.88Å
809	S	26.4	Very low	27.6	Very low	75 Å²	75	137 Å²	137	52%	0.524	73%	0.733	S	S	.	*			trans	-90.4	112	-177.5	55.5	0	0	0	0	112.3	H2035	S809-H2035 PolarHBondContact O-CD2 3.21Å; S809-H2035 VanDerWaalsContact O-CD2 3.24Å; S809-H2035 PolarHBondContact O-NE2 2.72Å
810	K	29.8	Very low	28	Very low	110 Å²	110	135.2 Å²	135.2	48%	0.478	73%	0.734	S	S	.	*			trans	-140.9	79.7	177.9	-73.5	-174.5	173.7	-169.4	0	114	H2035 H2036	K810-H2035 HydrophobicContact CG-CB 4.4Å; K810-H2036 PolarHBondContact NZ-NE2 3.48Å
811	D	30.6	Very low	28	Very low	136 Å²	136	132 Å²	132	73%	0.727	72%	0.72	S	S	*	*			trans	-86.7	137.6	156.4	-79	-50.6	0	0	0	110.8
812	T	30.8	Very low	28.2	Very low	133 Å²	133	130 Å²	130	82%	0.816	72%	0.718	S	S	*	*			trans	-95.2	125.1	-178.7	-61.9	0	0	0	0	109.9
813	F	25.9	Very low	28.5	Very low	175 Å²	175	126.5 Å²	126.5	77%	0.768	71%	0.705	S	S	*	*			trans	-110.6	127.4	179.2	-90.3	-81	0	0	0	113.4
814	T	32.4	Very low	28.7	Very low	142 Å²	142	127.2 Å²	127.2	87%	0.871	70%	0.703	S	S	*	*			trans	-131	97.7	148.3	51.5	0	0	0	0	106.6
815	N	26.9	Very low	29	Very low	130 Å²	130	122.9 Å²	122.9	70%	0.695	67%	0.673	S	S	*	*			cis	107.7	90.3	37.3	178.7	22	0	0	0	110.9
816	V	30.9	Very low	28.9	Very low	144 Å²	144	120.7 Å²	120.7	87%	0.873	68%	0.676	S	S	*	*			trans	-156.2	141.8	156.6	-177.7	0	0	0	0	106.6
817	N	27.5	Very low	29	Very low	112 Å²	112	121 Å²	121	60%	0.599	67%	0.668	S	S	*	*			cis	-175.6	124.1	-35.9	167.3	70.4	0	0	0	106.8
818	D	31.9	Very low	29	Very low	151 Å²	151	118.4 Å²	118.4	81%	0.807	65%	0.65	S	S	*	*			trans	-172.1	166.5	148.7	-106.6	-28.6	0	0	0	113.5
819	N	28	Very low	28.8	Very low	125 Å²	125	116.7 Å²	116.7	67%	0.668	65%	0.647	S	S	*	*			trans	-111.5	169.7	-159.3	-60.2	-90	0	0	0	112.2
820	T	33.9	Very low	29	Very low	131 Å²	131	117.3 Å²	117.3	80%	0.804	65%	0.649	S	S	*	*			cis	-167.1	161.7	38.1	-37.4	0	0	0	0	113.5
821	K	27.5	Very low	28.7	Very low	137 Å²	137	119 Å²	119	60%	0.596	66%	0.663	S	S	*	*			trans	-27.2	152.9	165.8	-112.5	175.7	175.6	-175.1	0	116.5	D2028	K821-D2028 IonicContact NZ-OD2 3.05Å; K821-D2028 PolarHBondContact NZ-OD2 2.89Å
822	V	28.7	Very low	28.4	Very low	112 Å²	112	118.9 Å²	118.9	68%	0.679	67%	0.668	S	S	*	*			cis	-133.2	-143.7	25.6	-143.5	0	0	0	0	111.5
823	D	32.4	Very low	28.1	Very low	112 Å²	112	118.9 Å²	118.9	60%	0.599	66%	0.663	S	S	*	*			cis	-152.8	166.2	4.4	-164.1	24.3	0	0	0	114.9	R337	R337-D823 PolarHBondContact NH1-O 2.79Å
824	Q	29.4	Very low	28.1	Very low	101 Å²	101	116.1 Å²	116.1	47%	0.472	66%	0.661	S	S	.	*			trans	-98.8	176.2	-171.2	-83.5	-167.1	13.6	0	0	116	R337 T2029	R337-Q824 WeakPolarHBondContact CD-O 3.35Å; R337-Q824 PolarHBondContact NE-O 3Å; R337-Q824 VanDerWaalsContact NH1-C 3.26Å; R337-Q824 PolarHBondContact NH1-O 2.81Å; Q824-T2029 PolarHBondContact NE2-OG1 3.19Å
825	P	29	Very low	27.7	Very low	25 Å²	25	116.9 Å²	116.9	16%	0.162	65%	0.654	C	S	.	*			cis	-127.1	-166.8	3	42.4	-25.9	0	0	0	114.9	R337 I338	R337-P825 VanDerWaalsContact CZ-N 3.29Å; R337-P825 VanDerWaalsContact NE-CD 3.34Å; R337-P825 PolarHBondContact NE-O 2.85Å; R337-P825 PolarHBondContact NH2-O 3.35Å; I338-P825 HydrophobicContact CG1-CG 4.37Å
826	S	25.7	Very low	27.7	Very low	118 Å²	118	116.2 Å²	116.2	83%	0.825	66%	0.66	S	S	*	*			trans	-119	137.3	157.4	-55.7	0	0	0	0	108.8
827	E	28.6	Very low	27.5	Very low	112 Å²	112	114.9 Å²	114.9	52%	0.523	65%	0.646	S	S	.	*			trans	-171.8	160.4	173.7	-110.6	172.7	-167.9	0	0	110.1	R339	R339-E827 VanDerWaalsContact CD-OE2 3.23Å; R339-E827 WeakPolarHBondContact CD-OE2 3.21Å; R339-E827 VanDerWaalsContact CG-OE2 3.3Å; R339-E827 WeakPolarHBondContact CG-OE2 3.47Å
828	T	26.5	Very low	27.5	Very low	78 Å²	78	116.9 Å²	116.9	48%	0.479	66%	0.656	S	S	.	*			cis	-171.1	125.4	-44.2	-88.8	0	0	0	0	109.1	H340	H340-T828 PolarHBondContact CD2-N 2.92Å; H340-T828 VanDerWaalsContact CD2-N 3.27Å; H340-T828 PolarHBondContact CE1-O 3.24Å; H340-T828 PolarHBondContact ND1-O 2.78Å; H340-T828 PolarHBondContact NE2-N 3.38Å
829	C	22.7	Very low	27.1	Very low	91 Å²	91	114.6 Å²	114.6	62%	0.615	65%	0.648	S	S	*	*			trans	-153.9	141.1	153.4	-106.6	0	0	0	0	109.7	T342	T342-C829 PolarHBondContact OG1-SG 3.41Å
830	P	29.3	Very low	27	Very low	88 Å²	88	117 Å²	117	57%	0.571	66%	0.661	S	S	*	*				-124.6	164.2	-109.3	39.8	-32	0	0	0	116.3	T342	T342-P830 HydrophobicContact CG2-CG 4.48Å
831	N	23.4	Very low	26.5	Very low	146 Å²	146	119.5 Å²	119.5	78%	0.781	66%	0.661	S	S	*	*			trans	-88.1	145.1	158.5	-93	-6	0	0	0	110.6
832	T	25.4	Very low	26.3	Very low	134 Å²	134	118 Å²	118	82%	0.822	67%	0.668	S	S	*	*			trans	-134.7	85.2	153.8	50.7	0	0	0	0	110.8
833	N	24.4	Very low	26.3	Very low	132 Å²	132	121.6 Å²	121.6	71%	0.706	68%	0.677	S	S	*	*			trans	-23.2	146.4	135.6	-74.4	19.2	0	0	0	114.2
834	T	25.9	Very low	25.8	Very low	118 Å²	118	121.9 Å²	121.9	72%	0.724	69%	0.687	S	S	*	*			cis	-162.7	178.9	-9.9	-56	0	0	0	0	108.2
835	E	24.6	Very low	25.5	Very low	157 Å²	157	123.3 Å²	123.3	73%	0.734	70%	0.698	S	S	*	*			trans	95.7	79.9	154.5	-57.8	-163.5	-178.7	0	0	120.7	I837	E835-I837 HydrophobicContact CB-CD1 4.4Å; E835-I837 HydrophobicContact CG-CD1 4.19Å
836	S	25.9	Very low	25.5	Very low	116 Å²	116	130.4 Å²	130.4	81%	0.811	73%	0.734	S	S	*	*				-158.3	122.2	110.2	23	0	0	0	0	106.6
837	I	25.9	Very low	25.5	Very low	116 Å²	116	132 Å²	132	60%	0.595	73%	0.728	S	S	*	*			cis	61.4	117.2	45.3	-45.7	175.7	0	0	0	109	E835	E835-I837 HydrophobicContact CB-CD1 4.4Å; E835-I837 HydrophobicContact CG-CD1 4.19Å
838	L	28.2	Very low	25.8	Very low	154 Å²	154	132.7 Å²	132.7	81%	0.806	74%	0.74	S	S	*	*			cis	-109.5	128.6	25.4	-84.7	84.4	0	0	0	113.5
839	T	23.3	Very low	26.2	Very low	104 Å²	104	135.1 Å²	135.1	64%	0.638	75%	0.746	S	S	*	*				51.6	113.5	92.2	69.9	0	0	0	0	117.4
840	N	26.8	Very low	26.9	Very low	174 Å²	174	133.5 Å²	133.5	93%	0.93	74%	0.735	S	S	*	*				-147.9	149.2	123.9	-104.3	-27.9	0	0	0	109.6
841	K	23.5	Very low	28.2	Very low	185 Å²	185	130.7 Å²	130.7	80%	0.804	72%	0.716	S	S	*	*			trans	-134.7	153.3	-171.1	-171.3	180	178.8	-173	0	109.5
842	S	23.6	Very low	30.4	Very low	106 Å²	106	126.5 Å²	126.5	74%	0.741	69%	0.691	S	S	*	*			trans	52.7	98.4	169.6	53.6	0	0	0	0	117
843	Q	26.7	Very low	33	Very low	187 Å²	187	120.1 Å²	120.1	87%	0.874	65%	0.652	S	S	*	*				-131.5	110.6	119	-150.9	168.4	13.2	0	0	109.1	N845	Q843-N845 VanDerWaalsContact C-N 3.3Å; Q843-N845 PolarHBondContact O-N 2.79Å; Q843-N845 VanDerWaalsContact O-N 3.1Å
844	S	22.9	Very low	35.8	Very low	117 Å²	117	115.4 Å²	115.4	82%	0.818	63%	0.626	S	S	*	*			trans	-85.1	73.6	179.8	56.5	0	0	0	0	110.2
845	N	23.1	Very low	38.6	Very low	131 Å²	131	110 Å²	110	70%	0.701	59%	0.592	S	S	*	*			trans	-72.6	130.1	142.6	-85.5	-28.6	0	0	0	106.5	Q843 E847	Q843-N845 VanDerWaalsContact C-N 3.3Å; Q843-N845 PolarHBondContact O-N 2.79Å; Q843-N845 VanDerWaalsContact O-N 3.1Å; N845-E847 HydrophobicContact CB-CB 4.36Å; N845-E847 PolarHBondContact O-N 3.33Å
846	L	29.8	Very low	41.6	Very low	175 Å²	175	102.5 Å²	102.5	92%	0.916	56%	0.557	S	S	*	*			trans	-73	74.8	149.3	-164.9	81	0	0	0	105.2	V848	L846-V848 PolarHBondContact O-N 2.92Å
847	E	25.8	Very low	44.6	Very low	150 Å²	150	98.3 Å²	98.3	70%	0.701	53%	0.526	S	S	*	.			trans	-54.9	117.8	175	-173.3	162.2	-137.3	0	0	105.8	N845 Q849	N845-E847 HydrophobicContact CB-CB 4.36Å; N845-E847 PolarHBondContact O-N 3.33Å; E847-Q849 PolarHBondContact O-N 2.88Å
848	V	33.7	Very low	47.6	Very low	127 Å²	127	92.8 Å²	92.8	77%	0.77	50%	0.498	S	S	*	.			trans	-65.1	87.6	166.5	174.9	0	0	0	0	103.5	L846 S850	L846-V848 PolarHBondContact O-N 2.92Å; V848-S850 VanDerWaalsContact C-N 3.35Å; V848-S850 PolarHBondContact O-N 2.82Å
849	Q	35.3	Very low	50.4	Low	130 Å²	130	89.9 Å²	89.9	61%	0.607	48%	0.478	S	S	*	.			trans	-57.4	106	-173	-177.5	162.9	47.4	0	0	105.3	E847 D851	E847-Q849 PolarHBondContact O-N 2.88Å; Q849-D851 PolarHBondContact O-N 3.43Å
850	S	37.2	Very low	53.3	Low	56 Å²	56	85.6 Å²	85.6	39%	0.392	46%	0.455	S	S	.	.			trans	-53.2	120	-177.5	34.4	0	0	0	0	105.5	V848 E852	V848-S850 VanDerWaalsContact C-N 3.35Å; V848-S850 PolarHBondContact O-N 2.82Å; S850-E852 PolarHBondContact O-N 3.02Å; S850-E852 PolarHBondContact OG-OE1 3.29Å
851	D	57.4	Low	55.9	Low	29 Å²	29	77.9 Å²	77.9	16%	0.155	42%	0.415	C	S	.	.			trans	-72.1	63.4	176.4	-95.2	-46.9	0	0	0	108.1	F761 F764 S765 Q849 S853	F761-D851 PolarHBondContact N-O 3.36Å; F761-D851 VanDerWaalsContact O-CB 3.24Å; F761-D851 WeakPolarHBondContact O-CB 3.33Å; F764-D851 HydrophobicContact CB-CB 4.08Å; S765-D851 VanDerWaalsContact CB-OD2 3.32Å; S765-D851 WeakPolarHBondContact CB-OD2 3.42Å; S765-D851 PolarHBondContact N-OD2 2.97Å; S765-D851 PolarHBondContact OG-OD2 2.75Å; Q849-D851 PolarHBondContact O-N 3.43Å; D851-S853 PolarHBondContact O-N 3.29Å; D851-S853 VanDerWaalsContact O-N 3.07Å; D851-S853 PolarHBondContact O-OG 3.22Å
852	E	69.7	Low	58.8	Low	59 Å²	59	71 Å²	71	28%	0.276	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	108.5	174.6	-81.4	177.8	-151.1	0	0	106.5	T727 I758 T760 S850	T727-E852 WeakPolarHBondContact CB-O 3.07Å; T727-E852 HydrophobicContact CG2-CB 3.99Å; T727-E852 VanDerWaalsContact CG2-O 3.24Å; T727-E852 WeakPolarHBondContact CG2-O 3.45Å; T727-E852 PolarHBondContact N-O 3.04Å; T727-E852 PolarHBondContact OG1-O 3.38Å; T727-E852 VanDerWaalsContact OG1-O 3.07Å; I758-E852 HydrophobicContact CG2-CB 3.63Å; I758-E852 HydrophobicContact CG2-CG 3.53Å; T760-E852 HydrophobicContact CG2-CG 3.97Å; S850-E852 PolarHBondContact O-N 3.02Å; S850-E852 PolarHBondContact OG-OE1 3.29Å
853	S	78.7	Confident	61.8	Low	0 Å²	0	69.9 Å²	69.9	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	109.7	-170	-61.5	0	0	0	0	107.1	L725 I759 F764 D851	L725-S853 CarbonylContact O-C 3.55Å; L725-S853 VanDerWaalsContact O-CA 3.31Å; L725-S853 WeakPolarHBondContact O-CA 2.97Å; I759-S853 WeakPolarHBondContact CB-O 3.24Å; I759-S853 PolarHBondContact N-O 3.03Å; I759-S853 WeakPolarHBondContact O-CA 3.24Å; I759-S853 VanDerWaalsContact O-CB 3.27Å; I759-S853 WeakPolarHBondContact O-CB 3.02Å; I759-S853 PolarHBondContact O-N 2.92Å; F764-S853 WeakPolarHBondContact CD2-OG 3.32Å; F764-S853 WeakPolarHBondContact CE2-OG 3.24Å; D851-S853 PolarHBondContact O-N 3.29Å; D851-S853 VanDerWaalsContact O-N 3.07Å; D851-S853 PolarHBondContact O-OG 3.22Å
854	Q	83.6	Confident	64.9	Low	32 Å²	32	64.4 Å²	64.4	15%	0.15	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	131.2	179.7	-166.1	165.9	1.8	0	0	109.5	L725 T727 V730 K755 A856	L725-Q854 PolarHBondContact N-O 2.91Å; L725-Q854 VanDerWaalsContact N-O 3.1Å; L725-Q854 PolarHBondContact O-N 3.11Å; T727-Q854 HydrophobicContact CG2-CB 4.12Å; V730-Q854 HydrophobicContact CG2-CB 4.04Å; K755-Q854 WeakPolarHBondContact O-CG 3.31Å; K755-Q854 PolarHBondContact O-NE2 2.97Å; Q854-A856 PolarHBondContact O-N 3.41Å
855	L	85.4	Confident	68.1	Low	4 Å²	4	58.8 Å²	58.8	2%	0.021	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	119.5	176.4	178	59.7	0	0	0	110.6	R722 K755 I759 I857	R722-L855 HydrophobicContact CB-CD1 4.2Å; K755-L855 HydrophobicContact CB-CB 4.38Å; K755-L855 HydrophobicContact CD-CD2 3.91Å; K755-L855 PolarHBondContact N-O 2.88Å; I759-L855 HydrophobicContact CD1-CB 3.96Å; L855-I857 HydrophobicContact CD1-CG1 4.46Å; L855-I857 HydrophobicContact CG-CG1 4.24Å
856	A	87	Confident	71.3	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	152.4	164.1	0	0	0	0	0	110.8	L723 L725 G753 M754 Q854	L723-A856 HydrophobicContact CD1-CB 3.73Å; L723-A856 HydrophobicContact CG-CB 4.12Å; L723-A856 PolarHBondContact N-O 3.25Å; L723-A856 PolarHBondContact O-N 2.95Å; L723-A856 VanDerWaalsContact O-O 3.12Å; L725-A856 HydrophobicContact CD1-CB 4.07Å; G753-A856 CarbonylContact O-C 3.58Å; G753-A856 WeakPolarHBondContact O-CA 3.49Å; M754-A856 HydrophobicContact SD-CB 3.66Å; Q854-A856 PolarHBondContact O-N 3.41Å
857	I	88.5	Confident	74.2	Confident	29 Å²	29	47.2 Å²	47.2	15%	0.149	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	122.1	-177	-51.1	-177.6	0	0	0	108.5	P720 G753 K755 L855 F859	P720-I857 HydrophobicContact CB-CG2 3.56Å; G753-I857 PolarHBondContact N-O 2.8Å; G753-I857 PolarHBondContact O-N 3.09Å; K755-I857 HydrophobicContact CD-CD1 4.17Å; K755-I857 HydrophobicContact CG-CD1 4.44Å; L855-I857 HydrophobicContact CD1-CG1 4.46Å; L855-I857 HydrophobicContact CG-CG1 4.24Å; I857-F859 HydrophobicContact CB-CE2 3.94Å; I857-F859 HydrophobicContact CB-CZ 4.37Å; I857-F859 HydrophobicContact CG2-CD2 4.13Å; I857-F859 HydrophobicContact CG2-CE1 4.27Å; I857-F859 HydrophobicContact CG2-CE2 3.47Å; I857-F859 VanDerWaalsContact CG2-CE2 3.47Å; I857-F859 HydrophobicContact CG2-CZ 3.56Å
858	L	90.2	Very high	77.4	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	129.1	175.3	-57.4	176.5	0	0	0	109.8	P720 T721 L723 I752 C865 A868 L869 I872	P720-L858 VanDerWaalsContact CA-O 3.32Å; P720-L858 WeakPolarHBondContact CA-O 3.39Å; T721-L858 PolarHBondContact N-O 3.32Å; T721-L858 PolarHBondContact O-N 2.91Å; L723-L858 HydrophobicContact CD2-CD1 3.56Å; L723-L858 HydrophobicContact CD2-CD2 4.37Å; L723-L858 HydrophobicContact CD2-CG 3.75Å; I752-L858 HydrophobicContact CB-CD2 4.26Å; I752-L858 HydrophobicContact CG1-CD2 3.72Å; I752-L858 HydrophobicContact CG2-CD2 4.03Å; L858-C865 HydrophobicContact CB-CB 4.29Å; L858-C865 HydrophobicContact CD1-CB 4.34Å; L858-A868 HydrophobicContact CD2-CB 4.28Å; L858-L869 HydrophobicContact CD1-CB 3.99Å; L858-L869 HydrophobicContact CD1-CD1 4.35Å; L858-I872 HydrophobicContact CD2-CD1 4.22Å
859	F	85.4	Confident	80.2	Confident	92 Å²	92	34.1 Å²	34.1	40%	0.404	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	138.6	172.1	-57.6	-96.6	0	0	0	110.1	P720 A750 K751 I857	P720-F859 HydrophobicContact CB-CD1 3.93Å; P720-F859 HydrophobicContact CB-CE1 3.76Å; P720-F859 HydrophobicContact CB-CZ 4.29Å; P720-F859 HydrophobicContact CG-CE1 4.34Å; A750-F859 WeakPolarHBondContact CA-O 3.32Å; K751-F859 HydrophobicContact CB-CB 4.34Å; K751-F859 PolarHBondContact N-O 3.07Å; K751-F859 PolarHBondContact O-N 3.34Å; I857-F859 HydrophobicContact CB-CE2 3.94Å; I857-F859 HydrophobicContact CB-CZ 4.37Å; I857-F859 HydrophobicContact CG2-CD2 4.13Å; I857-F859 HydrophobicContact CG2-CE1 4.27Å; I857-F859 HydrophobicContact CG2-CE2 3.47Å; I857-F859 VanDerWaalsContact CG2-CE2 3.47Å; I857-F859 HydrophobicContact CG2-CZ 3.56Å
860	G	84.8	Confident	82.9	Confident	15 Å²	15	30 Å²	30	16%	0.155	16%	0.164	C	C	.	.	S	Bend	trans	138.2	-178.8	-176.6	0	0	0	0	0	111.7	D717 C865 R970	D717-G860 CarbonylContact O-C 3.58Å; D717-G860 VanDerWaalsContact O-O 3.11Å; G860-C865 PolarHBondContact O-SG 2.84Å; G860-R970 PolarHBondContact O-NH1 2.94Å
861	S	82.5	Confident	85.6	Confident	11 Å²	11	30 Å²	30	8%	0.077	16%	0.158	C	C	.	.			trans	-61.6	162	179.3	88.1	0	0	0	0	112.3	D717 E863 Q864 C865	D717-S861 VanDerWaalsContact CG-CA 3.46Å; D717-S861 VanDerWaalsContact CG-CB 3.41Å; D717-S861 WeakPolarHBondContact OD1-CA 3.29Å; D717-S861 WeakPolarHBondContact OD1-CB 3.29Å; S861-E863 VanDerWaalsContact C-N 3.25Å; S861-E863 VanDerWaalsContact CB-OE2 3.26Å; S861-E863 WeakPolarHBondContact CB-OE2 3.44Å; S861-E863 PolarHBondContact O-N 3.47Å; S861-E863 PolarHBondContact OG-N 3Å; S861-E863 PolarHBondContact OG-OE2 2.81Å; S861-Q864 PolarHBondContact O-N 2.84Å; S861-Q864 VanDerWaalsContact OG-CG 3.31Å; S861-Q864 WeakPolarHBondContact OG-CG 3.47Å; S861-Q864 PolarHBondContact OG-N 2.95Å; S861-C865 WeakPolarHBondContact O-CB 3.43Å; S861-C865 PolarHBondContact O-N 2.8Å; S861-C865 PolarHBondContact O-SG 3.08Å
862	R	83.8	Confident	87.3	Confident	41 Å²	41	28.7 Å²	28.7	16%	0.155	15%	0.151	C	C	.	.	H	α-helix	trans	-48.8	-50.8	175.3	-179.4	-154.7	177.6	154.8	13.5	111.1	C865 S866 A963 E967	R862-C865 PolarHBondContact O-N 3.07Å; R862-S866 PolarHBondContact O-N 3.41Å; R862-S866 PolarHBondContact O-OG 2.52Å; R862-A963 PolarHBondContact NH2-O 3.22Å; R862-E967 IonicContact CZ-OE1 2.63Å; R862-E967 IonicContact CZ-OE2 3.68Å; R862-E967 IonicContact NH1-OE1 3.2Å; R862-E967 PolarHBondContact NH1-OE1 2.79Å; R862-E967 IonicContact NH1-OE2 3.66Å; R862-E967 PolarHBondContact NH1-OE2 3.45Å; R862-E967 VanDerWaalsContact NH2-CD 3.27Å; R862-E967 IonicContact NH2-OE1 3.09Å; R862-E967 IonicContact NH2-OE2 3.43Å; R862-E967 PolarHBondContact NH2-OE2 3.03Å
863	E	87.4	Confident	88.2	Confident	83 Å²	83	26.1 Å²	26.1	39%	0.388	14%	0.139	S	C	.	.	H	α-helix	trans	-67.1	-40.3	-175.7	-48.3	83.8	173	0	0	111.3	R713 S861 A867	R713-E863 IonicContact CZ-OE1 2.74Å; R713-E863 IonicContact NE-OE1 3.72Å; R713-E863 IonicContact NH2-OE1 3.59Å; R713-E863 PolarHBondContact NH2-OE1 3.13Å; R713-E863 IonicContact NH2-OE2 3.59Å; S861-E863 VanDerWaalsContact C-N 3.25Å; S861-E863 VanDerWaalsContact CB-OE2 3.26Å; S861-E863 WeakPolarHBondContact CB-OE2 3.44Å; S861-E863 PolarHBondContact O-N 3.47Å; S861-E863 PolarHBondContact OG-N 3Å; S861-E863 PolarHBondContact OG-OE2 2.81Å; E863-A867 WeakPolarHBondContact O-CB 3.4Å; E863-A867 PolarHBondContact O-N 3.1Å
864	Q	90	Very high	88.9	Confident	71 Å²	71	28.8 Å²	28.8	33%	0.332	16%	0.155	S	C	.	.	H	α-helix	trans	-62.9	-43.2	175.5	-65.6	174	-20.2	0	0	111.5	T748 A750 S861 A868	T748-Q864 WeakPolarHBondContact O-CB 3.47Å; T748-Q864 WeakPolarHBondContact O-CG 3.48Å; A750-Q864 HydrophobicContact CB-CB 4.13Å; S861-Q864 PolarHBondContact O-N 2.84Å; S861-Q864 VanDerWaalsContact OG-CG 3.31Å; S861-Q864 WeakPolarHBondContact OG-CG 3.47Å; S861-Q864 PolarHBondContact OG-N 2.95Å; Q864-A868 WeakPolarHBondContact O-CB 3.1Å; Q864-A868 PolarHBondContact O-N 2.83Å
865	C	90.1	Very high	89.2	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-69.9	-47.8	-178.7	-66.2	0	0	0	0	112	L858 G860 S861 R862 A867 A868 L869 R970	L858-C865 HydrophobicContact CB-CB 4.29Å; L858-C865 HydrophobicContact CD1-CB 4.34Å; G860-C865 PolarHBondContact O-SG 2.84Å; S861-C865 WeakPolarHBondContact O-CB 3.43Å; S861-C865 PolarHBondContact O-N 2.8Å; S861-C865 PolarHBondContact O-SG 3.08Å; R862-C865 PolarHBondContact O-N 3.07Å; C865-A867 VanDerWaalsContact C-N 3.3Å; C865-A867 PolarHBondContact O-N 2.83Å; C865-A868 PolarHBondContact O-N 2.87Å; C865-L869 WeakPolarHBondContact O-CB 3.46Å; C865-L869 PolarHBondContact O-N 3.45Å; C865-R970 PolarHBondContact SG-NH2 2.78Å
866	S	91.2	Very high	89.3	Confident	22 Å²	22	27.9 Å²	27.9	15%	0.154	15%	0.152	C	C	.	.	H	α-helix	trans	-62.7	-36.2	175	-68.4	0	0	0	0	112	R862 C870 E962	R862-S866 PolarHBondContact O-N 3.41Å; R862-S866 PolarHBondContact O-OG 2.52Å; S866-C870 VanDerWaalsContact O-CB 3.29Å; S866-C870 WeakPolarHBondContact O-CB 3.37Å; S866-C870 PolarHBondContact O-N 2.86Å; S866-E962 WeakPolarHBondContact CA-OE2 3.35Å; S866-E962 VanDerWaalsContact CB-OE2 3.22Å; S866-E962 WeakPolarHBondContact CB-OE2 3.17Å; S866-E962 PolarHBondContact OG-OE1 3.18Å; S866-E962 PolarHBondContact OG-OE2 3.31Å
867	A	91	Very high	89.4	Confident	41 Å²	41	28.8 Å²	28.8	34%	0.339	16%	0.156	S	C	.	.	H	α-helix	trans	-66	-43.4	173.3	0	0	0	0	0	112.4	T748 E863 C865 C870 E871	T748-A867 HydrophobicContact CG2-CB 3.98Å; E863-A867 WeakPolarHBondContact O-CB 3.4Å; E863-A867 PolarHBondContact O-N 3.1Å; C865-A867 VanDerWaalsContact C-N 3.3Å; C865-A867 PolarHBondContact O-N 2.83Å; A867-C870 PolarHBondContact O-N 2.8Å; A867-E871 WeakPolarHBondContact O-CG 3.22Å; A867-E871 PolarHBondContact O-N 2.88Å
868	A	92.6	Very high	89.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-62.9	-42.7	175.7	0	0	0	0	0	112.3	I744 T748 A750 L858 Q864 C865 C870 E871 I872	I744-A868 HydrophobicContact CG2-CB 4.23Å; T748-A868 HydrophobicContact CG2-CB 4.29Å; A750-A868 HydrophobicContact CB-CB 3.7Å; L858-A868 HydrophobicContact CD2-CB 4.28Å; Q864-A868 WeakPolarHBondContact O-CB 3.1Å; Q864-A868 PolarHBondContact O-N 2.83Å; C865-A868 PolarHBondContact O-N 2.87Å; A868-C870 VanDerWaalsContact C-N 3.35Å; A868-E871 PolarHBondContact O-N 2.68Å; A868-I872 WeakPolarHBondContact O-CD1 3.39Å; A868-I872 WeakPolarHBondContact O-CG1 3.34Å; A868-I872 PolarHBondContact O-N 2.94Å
869	L	92.4	Very high	89.2	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-64.7	-38.4	176.5	-173	147.4	0	0	0	111.7	L723 L858 C865 I872 L873 L890 L892 E962	L723-L869 HydrophobicContact CD2-CD1 3.93Å; L858-L869 HydrophobicContact CD1-CB 3.99Å; L858-L869 HydrophobicContact CD1-CD1 4.35Å; C865-L869 WeakPolarHBondContact O-CB 3.46Å; C865-L869 PolarHBondContact O-N 3.45Å; L869-I872 PolarHBondContact O-N 3.12Å; L869-L873 HydrophobicContact CD2-CD1 3.58Å; L869-L873 HydrophobicContact CD2-CG 4.13Å; L869-L873 WeakPolarHBondContact O-CB 3.34Å; L869-L873 WeakPolarHBondContact O-CG 3.36Å; L869-L873 PolarHBondContact O-N 3.03Å; L869-L890 HydrophobicContact CD1-CD1 3.95Å; L869-L890 HydrophobicContact CD1-CD2 4.24Å; L869-L890 HydrophobicContact CD2-CD1 4.42Å; L869-L890 HydrophobicContact CD2-CD2 4.08Å; L869-L890 HydrophobicContact CG-CD1 4.34Å; L869-L892 HydrophobicContact CD1-CD2 4.28Å; L869-E962 HydrophobicContact CD1-CG 3.62Å; L869-E962 HydrophobicContact CD2-CB 4.17Å; L869-E962 HydrophobicContact CD2-CG 3.7Å; L869-E962 HydrophobicContact CG-CG 4.27Å
870	C	92.1	Very high	89.1	Confident	43 Å²	43	31 Å²	31	29%	0.291	16%	0.161	S	C	.	.	H	α-helix	trans	-62.1	-44.9	173.2	-172.6	0	0	0	0	112.4	S866 A867 A868 L873 T874	S866-C870 VanDerWaalsContact O-CB 3.29Å; S866-C870 WeakPolarHBondContact O-CB 3.37Å; S866-C870 PolarHBondContact O-N 2.86Å; A867-C870 PolarHBondContact O-N 2.8Å; A868-C870 VanDerWaalsContact C-N 3.35Å; C870-L873 PolarHBondContact O-N 2.92Å; C870-T874 WeakPolarHBondContact O-CB 3.29Å; C870-T874 PolarHBondContact O-N 2.56Å; C870-T874 PolarHBondContact O-OG1 3.5Å
871	E	93.4	Very high	89.1	Confident	55 Å²	55	37.9 Å²	37.9	26%	0.257	19%	0.187	S	C	.	.	H	α-helix	trans	-63.7	-43	174.8	-65	-73.2	128.8	0	0	111.9	I744 K747 T748 A867 A868 T874 I875	I744-E871 HydrophobicContact CG1-CB 4.15Å; I744-E871 HydrophobicContact CG2-CB 3.91Å; I744-E871 HydrophobicContact CG2-CG 4.4Å; K747-E871 HydrophobicContact CD-CG 4.31Å; K747-E871 WeakPolarHBondContact CD-OE2 3.33Å; K747-E871 IonicContact NZ-OE1 3.71Å; K747-E871 PolarHBondContact NZ-OE1 2.86Å; K747-E871 IonicContact NZ-OE2 3.86Å; K747-E871 PolarHBondContact NZ-OE2 3.38Å; T748-E871 HydrophobicContact CG2-CG 4.07Å; A867-E871 WeakPolarHBondContact O-CG 3.22Å; A867-E871 PolarHBondContact O-N 2.88Å; A868-E871 PolarHBondContact O-N 2.68Å; E871-T874 WeakPolarHBondContact O-CB 3.47Å; E871-T874 PolarHBondContact O-N 3.32Å; E871-I875 WeakPolarHBondContact O-CD1 3.32Å; E871-I875 WeakPolarHBondContact O-CG1 3.16Å; E871-I875 PolarHBondContact O-N 3.33Å
872	I	92.6	Very high	88.9	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.015	22%	0.216	C	C	.	.	H	α-helix	trans	-59.8	-52	176.5	-69	164	0	0	0	110.3	L725 I733 I744 I752 L858 A868 L869 T874 I875 C876	L725-I872 HydrophobicContact CD2-CG2 3.91Å; I733-I872 HydrophobicContact CD1-CG2 3.97Å; I733-I872 HydrophobicContact CG1-CG2 4.3Å; I733-I872 HydrophobicContact CG2-CG1 4.16Å; I733-I872 HydrophobicContact CG2-CG2 4.08Å; I744-I872 HydrophobicContact CD1-CG1 4Å; I752-I872 HydrophobicContact CD1-CD1 4.27Å; L858-I872 HydrophobicContact CD2-CD1 4.22Å; A868-I872 WeakPolarHBondContact O-CD1 3.39Å; A868-I872 WeakPolarHBondContact O-CG1 3.34Å; A868-I872 PolarHBondContact O-N 2.94Å; L869-I872 PolarHBondContact O-N 3.12Å; I872-T874 VanDerWaalsContact C-N 3.31Å; I872-T874 PolarHBondContact O-N 3.48Å; I872-I875 WeakPolarHBondContact O-CB 3.35Å; I872-I875 PolarHBondContact O-N 3Å; I872-I875 VanDerWaalsContact O-N 3.11Å; I872-C876 PolarHBondContact O-N 3.32Å; I872-C876 PolarHBondContact O-SG 3.14Å
873	L	90.6	Very high	88.5	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-62.6	-36.6	177.5	-73.6	-179.4	0	0	0	112.2	L869 C870 I875 C876 F877 L890 L955 I958	L869-L873 HydrophobicContact CD2-CD1 3.58Å; L869-L873 HydrophobicContact CD2-CG 4.13Å; L869-L873 WeakPolarHBondContact O-CB 3.34Å; L869-L873 WeakPolarHBondContact O-CG 3.36Å; L869-L873 PolarHBondContact O-N 3.03Å; C870-L873 PolarHBondContact O-N 2.92Å; L873-I875 VanDerWaalsContact C-N 3.26Å; L873-I875 PolarHBondContact O-N 2.9Å; L873-C876 WeakPolarHBondContact O-CB 3.34Å; L873-C876 PolarHBondContact O-N 2.66Å; L873-C876 VanDerWaalsContact O-N 3.16Å; L873-F877 WeakPolarHBondContact O-CB 3.48Å; L873-F877 WeakPolarHBondContact O-CD2 3.44Å; L873-F877 PolarHBondContact O-N 3.18Å; L873-L890 HydrophobicContact CD1-CB 4.5Å; L873-L890 HydrophobicContact CD2-CB 4.49Å; L873-L955 HydrophobicContact CB-CD1 3.56Å; L873-I958 HydrophobicContact CD1-CB 4.36Å; L873-I958 HydrophobicContact CD1-CG2 3.55Å
874	T	91.4	Very high	87.9	Confident	57 Å²	57	48.3 Å²	48.3	35%	0.35	25%	0.249	S	C	.	.	H	α-helix	trans	-59.7	-38.5	174.5	-60	0	0	0	0	111.4	C870 E871 I872 R878	C870-T874 WeakPolarHBondContact O-CB 3.29Å; C870-T874 PolarHBondContact O-N 2.56Å; C870-T874 PolarHBondContact O-OG1 3.5Å; E871-T874 WeakPolarHBondContact O-CB 3.47Å; E871-T874 PolarHBondContact O-N 3.32Å; I872-T874 VanDerWaalsContact C-N 3.31Å; I872-T874 PolarHBondContact O-N 3.48Å; T874-R878 WeakPolarHBondContact O-CB 3.31Å; T874-R878 PolarHBondContact O-N 2.89Å; T874-R878 VanDerWaalsContact O-N 3.16Å
875	I	90.1	Very high	87	Confident	13 Å²	13	48.9 Å²	48.9	7%	0.067	25%	0.251	C	S	.	.	H	α-helix	trans	-70.8	-42.8	174	-67.8	155.4	0	0	0	110.9	I733 T740 I744 E871 I872 L873 R878 E879	I733-I875 HydrophobicContact CG1-CG2 4.43Å; T740-I875 HydrophobicContact CG2-CD1 3.54Å; I744-I875 HydrophobicContact CD1-CD1 3.74Å; I744-I875 HydrophobicContact CG1-CD1 4.28Å; E871-I875 WeakPolarHBondContact O-CD1 3.32Å; E871-I875 WeakPolarHBondContact O-CG1 3.16Å; E871-I875 PolarHBondContact O-N 3.33Å; I872-I875 WeakPolarHBondContact O-CB 3.35Å; I872-I875 PolarHBondContact O-N 3Å; I872-I875 VanDerWaalsContact O-N 3.11Å; L873-I875 VanDerWaalsContact C-N 3.26Å; L873-I875 PolarHBondContact O-N 2.9Å; I875-R878 PolarHBondContact O-N 3.07Å; I875-E879 HydrophobicContact CG2-CG 4.26Å; I875-E879 WeakPolarHBondContact O-CB 2.77Å; I875-E879 WeakPolarHBondContact O-CG 3.26Å; I875-E879 PolarHBondContact O-N 3.34Å
876	C	88.3	Confident	86.2	Confident	3 Å²	3	52.3 Å²	52.3	2%	0.02	28%	0.275	C	S	.	.	H	α-helix	trans	-56.4	-51.2	174.4	-63.5	0	0	0	0	112.1	L729 I872 L873 R878 E879 S880 P888	L729-C876 HydrophobicContact CD1-CB 4.01Å; I872-C876 PolarHBondContact O-N 3.32Å; I872-C876 PolarHBondContact O-SG 3.14Å; L873-C876 WeakPolarHBondContact O-CB 3.34Å; L873-C876 PolarHBondContact O-N 2.66Å; L873-C876 VanDerWaalsContact O-N 3.16Å; C876-R878 PolarHBondContact O-N 3.39Å; C876-E879 PolarHBondContact O-N 2.79Å; C876-S880 WeakPolarHBondContact O-CB 3.25Å; C876-S880 PolarHBondContact O-N 2.89Å; C876-S880 PolarHBondContact O-OG 2.97Å; C876-P888 HydrophobicContact CB-CB 4.03Å; C876-P888 HydrophobicContact CB-CG 3.84Å
877	F	89.2	Confident	85.5	Confident	20 Å²	20	56.7 Å²	56.7	9%	0.088	30%	0.296	C	S	.	.	H	α-helix	trans	-66.5	-22.9	179.6	-90.2	-81.9	0	0	0	113.5	L873 S880 K881 D887 P888 L955 I958	L873-F877 WeakPolarHBondContact O-CB 3.48Å; L873-F877 WeakPolarHBondContact O-CD2 3.44Å; L873-F877 PolarHBondContact O-N 3.18Å; F877-S880 PolarHBondContact O-OG 3.33Å; F877-K881 WeakPolarHBondContact O-CD 3.43Å; F877-K881 VanDerWaalsContact O-CG 3.25Å; F877-K881 WeakPolarHBondContact O-CG 3.17Å; F877-D887 HydrophobicContact CE1-CB 4.08Å; F877-D887 WeakPolarHBondContact CE1-OD1 3.27Å; F877-P888 HydrophobicContact CB-CG 4.41Å; F877-P888 HydrophobicContact CD1-CG 4.05Å; F877-P888 HydrophobicContact CD2-CG 3.77Å; F877-P888 HydrophobicContact CE1-CG 4.25Å; F877-P888 HydrophobicContact CE2-CG 3.97Å; F877-P888 WeakPolarHBondContact CE2-O 3.48Å; F877-P888 HydrophobicContact CG-CG 3.81Å; F877-P888 HydrophobicContact CZ-CG 4.2Å; F877-P888 WeakPolarHBondContact CZ-O 3.31Å; F877-L955 HydrophobicContact CD2-CB 4.1Å; F877-L955 HydrophobicContact CD2-CD1 3.9Å; F877-L955 HydrophobicContact CD2-CG 4.5Å; F877-L955 HydrophobicContact CE2-CB 4.17Å; F877-L955 HydrophobicContact CE2-CD1 4.26Å; F877-I958 HydrophobicContact CE2-CD1 4.03Å; F877-I958 HydrophobicContact CZ-CD1 3.96Å
878	R	88.7	Confident	85	Confident	131 Å²	131	55.6 Å²	55.6	49%	0.494	29%	0.285	S	S	.	.	H	α-helix	trans	-79.6	-45.5	171.9	-173.3	180	66.7	-157.6	-3	111.2	T874 I875 C876 K881 H882	T874-R878 WeakPolarHBondContact O-CB 3.31Å; T874-R878 PolarHBondContact O-N 2.89Å; T874-R878 VanDerWaalsContact O-N 3.16Å; I875-R878 PolarHBondContact O-N 3.07Å; C876-R878 PolarHBondContact O-N 3.39Å; R878-K881 PolarHBondContact O-N 2.89Å; R878-H882 PolarHBondContact O-CD2 3.4Å; R878-H882 PolarHBondContact O-N 3.47Å; R878-H882 VanDerWaalsContact O-N 3.11Å
879	E	86.1	Confident	84.6	Confident	34 Å²	34	56.2 Å²	56.2	16%	0.159	29%	0.29	C	S	.	.	H	α-helix	trans	-68.2	-39.2	179.6	-73.1	-75.3	128.6	0	0	112.5	L729 S732 I875 C876 K881 H882 R883	L729-E879 HydrophobicContact CD2-CB 3.84Å; S732-E879 WeakPolarHBondContact CB-OE2 3.17Å; S732-E879 PolarHBondContact OG-OE2 2.94Å; I875-E879 HydrophobicContact CG2-CG 4.26Å; I875-E879 WeakPolarHBondContact O-CB 2.77Å; I875-E879 WeakPolarHBondContact O-CG 3.26Å; I875-E879 PolarHBondContact O-N 3.34Å; C876-E879 PolarHBondContact O-N 2.79Å; E879-K881 VanDerWaalsContact C-N 3.34Å; E879-K881 PolarHBondContact O-N 3.26Å; E879-H882 PolarHBondContact O-N 2.97Å; E879-R883 VanDerWaalsContact O-CB 3.32Å; E879-R883 WeakPolarHBondContact O-CB 3.38Å; E879-R883 VanDerWaalsContact O-CG 3.28Å; E879-R883 WeakPolarHBondContact O-CG 3.06Å; E879-R883 PolarHBondContact O-N 3.33Å; E879-R883 IonicContact OE2-CZ 3.65Å; E879-R883 IonicContact OE2-NE 2.91Å; E879-R883 PolarHBondContact OE2-NE 3.46Å; E879-R883 IonicContact OE2-NH2 3.33Å; E879-R883 PolarHBondContact OE2-NH2 3.38Å
880	S	83.8	Confident	84.4	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.007	29%	0.29	C	S	.	.	H	α-helix	trans	-59.8	-46	175.3	64	0	0	0	0	111.1	C876 F877 H882 R883 G884 F885 P888	C876-S880 WeakPolarHBondContact O-CB 3.25Å; C876-S880 PolarHBondContact O-N 2.89Å; C876-S880 PolarHBondContact O-OG 2.97Å; F877-S880 PolarHBondContact O-OG 3.33Å; S880-H882 VanDerWaalsContact C-N 3.33Å; S880-H882 PolarHBondContact O-N 3.41Å; S880-R883 PolarHBondContact O-N 3.05Å; S880-G884 PolarHBondContact O-N 3.31Å; S880-F885 PolarHBondContact O-N 3.21Å; S880-F885 VanDerWaalsContact O-N 3.09Å; S880-P888 WeakPolarHBondContact OG-CD 3.23Å
881	K	83.4	Confident	84.3	Confident	160 Å²	160	54.2 Å²	54.2	70%	0.696	28%	0.276	S	S	*	.	H	α-helix	trans	-62.4	-33.5	175.5	-72.8	-179.5	-178.8	-172.3	0	113.7	F877 R878 E879	F877-K881 WeakPolarHBondContact O-CD 3.43Å; F877-K881 VanDerWaalsContact O-CG 3.25Å; F877-K881 WeakPolarHBondContact O-CG 3.17Å; R878-K881 PolarHBondContact O-N 2.89Å; E879-K881 VanDerWaalsContact C-N 3.34Å; E879-K881 PolarHBondContact O-N 3.26Å
882	H	79.3	Confident	84.1	Confident	149 Å²	149	51.7 Å²	51.7	69%	0.69	26%	0.264	S	S	*	.	H	α-helix	trans	-80.1	-24.1	174.7	-73.6	-55.9	0	0	0	114	R878 E879 S880	R878-H882 PolarHBondContact O-CD2 3.4Å; R878-H882 PolarHBondContact O-N 3.47Å; R878-H882 VanDerWaalsContact O-N 3.11Å; E879-H882 PolarHBondContact O-N 2.97Å; S880-H882 VanDerWaalsContact C-N 3.33Å; S880-H882 PolarHBondContact O-N 3.41Å
883	R	75.5	Confident	83.8	Confident	135 Å²	135	51.9 Å²	51.9	51%	0.509	27%	0.266	S	S	.	.	H	α-helix	trans	-102.6	-8.8	-176.6	-65.5	175.2	-175.1	-112.6	2.2	114.3	S732 E879 S880 F885	S732-R883 PolarHBondContact OG-NH2 3.19Å; S732-R883 VanDerWaalsContact OG-NH2 3.07Å; E879-R883 VanDerWaalsContact O-CB 3.32Å; E879-R883 WeakPolarHBondContact O-CB 3.38Å; E879-R883 VanDerWaalsContact O-CG 3.28Å; E879-R883 WeakPolarHBondContact O-CG 3.06Å; E879-R883 PolarHBondContact O-N 3.33Å; E879-R883 IonicContact OE2-CZ 3.65Å; E879-R883 IonicContact OE2-NE 2.91Å; E879-R883 PolarHBondContact OE2-NE 3.46Å; E879-R883 IonicContact OE2-NH2 3.33Å; E879-R883 PolarHBondContact OE2-NH2 3.38Å; S880-R883 PolarHBondContact O-N 3.05Å; R883-F885 HydrophobicContact CB-CD2 3.69Å; R883-F885 HydrophobicContact CB-CE2 3.79Å; R883-F885 HydrophobicContact CB-CG 4.35Å; R883-F885 HydrophobicContact CB-CZ 4.5Å; R883-F885 HydrophobicContact CG-CE2 4.33Å
884	G	73.7	Confident	83.6	Confident	71 Å²	71	51.9 Å²	51.9	73%	0.732	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	15.9	-176.3	0	0	0	0	0	114.5	S880	S880-G884 PolarHBondContact O-N 3.31Å
885	F	71.6	Confident	83.1	Confident	83 Å²	83	51 Å²	51	36%	0.364	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-76.1	152.4	174.7	-63.3	-49.1	0	0	0	111.4	L729 S880 R883	L729-F885 HydrophobicContact CD2-CD2 4.28Å; S880-F885 PolarHBondContact O-N 3.21Å; S880-F885 VanDerWaalsContact O-N 3.09Å; R883-F885 HydrophobicContact CB-CD2 3.69Å; R883-F885 HydrophobicContact CB-CE2 3.79Å; R883-F885 HydrophobicContact CB-CG 4.35Å; R883-F885 HydrophobicContact CB-CZ 4.5Å; R883-F885 HydrophobicContact CG-CE2 4.33Å
886	S	74.2	Confident	82.6	Confident	72 Å²	72	52.5 Å²	52.5	50%	0.503	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-57.1	156.2	173.1	52.7	0	0	0	0	112.4	P888	S886-P888 WeakPolarHBondContact O-CD 3.14Å; S886-P888 VanDerWaalsContact O-N 3.13Å
887	D	76.2	Confident	82	Confident	114 Å²	114	56.7 Å²	56.7	61%	0.61	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-51.6	118.9	179	-80.8	-48.9	0	0	0	111.6	F877 C889	F877-D887 HydrophobicContact CE1-CB 4.08Å; F877-D887 WeakPolarHBondContact CE1-OD1 3.27Å; D887-C889 PolarHBondContact O-N 3.47Å
888	P	80.3	Confident	81.4	Confident	17 Å²	17	55.9 Å²	55.9	11%	0.11	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-71.1	123	-172.3	26.5	-33.5	0	0	0	110.1	L729 C876 F877 S880 S886	L729-P888 HydrophobicContact CD1-CB 4.19Å; C876-P888 HydrophobicContact CB-CB 4.03Å; C876-P888 HydrophobicContact CB-CG 3.84Å; F877-P888 HydrophobicContact CB-CG 4.41Å; F877-P888 HydrophobicContact CD1-CG 4.05Å; F877-P888 HydrophobicContact CD2-CG 3.77Å; F877-P888 HydrophobicContact CE1-CG 4.25Å; F877-P888 HydrophobicContact CE2-CG 3.97Å; F877-P888 WeakPolarHBondContact CE2-O 3.48Å; F877-P888 HydrophobicContact CG-CG 3.81Å; F877-P888 HydrophobicContact CZ-CG 4.2Å; F877-P888 WeakPolarHBondContact CZ-O 3.31Å; S880-P888 WeakPolarHBondContact OG-CD 3.23Å; S886-P888 WeakPolarHBondContact O-CD 3.14Å; S886-P888 VanDerWaalsContact O-N 3.13Å
889	C	84	Confident	81	Confident	13 Å²	13	51.4 Å²	51.4	9%	0.088	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-91.3	164.3	173	51.9	0	0	0	0	111.9	F764 D887 V950 V951 R952	F764-C889 VanDerWaalsContact CD1-SG 3.53Å; F764-C889 WeakPolarHBondContact CE1-O 3.13Å; D887-C889 PolarHBondContact O-N 3.47Å; C889-V950 HydrophobicContact CB-CG1 4.34Å; C889-V951 VanDerWaalsContact CB-O 3.29Å; C889-V951 WeakPolarHBondContact CB-O 3.32Å; C889-R952 HydrophobicContact CB-CB 4.35Å; C889-R952 HydrophobicContact CB-CG 3.64Å
890	L	88.9	Confident	80.4	Confident	3 Å²	3	51 Å²	51	2%	0.016	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	122.1	-179.8	171.4	69.9	0	0	0	109.5	L723 L869 L873 L892 V950 V951 I958 E962	L723-L890 HydrophobicContact CB-CD1 4.5Å; L869-L890 HydrophobicContact CD1-CD1 3.95Å; L869-L890 HydrophobicContact CD1-CD2 4.24Å; L869-L890 HydrophobicContact CD2-CD1 4.42Å; L869-L890 HydrophobicContact CD2-CD2 4.08Å; L869-L890 HydrophobicContact CG-CD1 4.34Å; L873-L890 HydrophobicContact CD1-CB 4.5Å; L873-L890 HydrophobicContact CD2-CB 4.49Å; L890-L892 HydrophobicContact CD1-CD2 4.2Å; L890-L892 HydrophobicContact CD2-CD1 4.19Å; L890-L892 HydrophobicContact CD2-CD2 4.03Å; L890-L892 HydrophobicContact CD2-CG 3.9Å; L890-L892 HydrophobicContact CG-CD2 4.2Å; L890-L892 HydrophobicContact CG-CG 4.05Å; L890-V950 WeakPolarHBondContact O-CA 3.39Å; L890-V951 HydrophobicContact CB-CB 4.33Å; L890-V951 PolarHBondContact N-O 3.05Å; L890-V951 PolarHBondContact O-N 2.69Å; L890-I958 HydrophobicContact CB-CG2 3.7Å; L890-I958 HydrophobicContact CD2-CG2 3.9Å; L890-I958 HydrophobicContact CG-CG2 4.47Å; L890-E962 HydrophobicContact CD2-CB 3.89Å; L890-E962 HydrophobicContact CD2-CG 3.85Å
891	G	88.6	Confident	79.7	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	115	164.8	0	0	0	0	0	110.5	L723 L724	L723-G891 CarbonylContact C-O 3.56Å; L723-G891 WeakPolarHBondContact CA-O 3.36Å; L724-G891 PolarHBondContact N-O 3.02Å
892	L	89.6	Confident	79.1	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	138	167.4	-66.2	174.7	0	0	0	109.2	T721 L723 L869 L890 V948 L949 E962 L965	T721-L892 HydrophobicContact CG2-CD2 4.05Å; L723-L892 HydrophobicContact CB-CD2 4.37Å; L869-L892 HydrophobicContact CD1-CD2 4.28Å; L890-L892 HydrophobicContact CD1-CD2 4.2Å; L890-L892 HydrophobicContact CD2-CD1 4.19Å; L890-L892 HydrophobicContact CD2-CD2 4.03Å; L890-L892 HydrophobicContact CD2-CG 3.9Å; L890-L892 HydrophobicContact CG-CD2 4.2Å; L890-L892 HydrophobicContact CG-CG 4.05Å; L892-V948 CarbonylContact O-C 3.47Å; L892-V948 WeakPolarHBondContact O-CA 3.33Å; L892-L949 HydrophobicContact CB-CB 4.35Å; L892-L949 PolarHBondContact N-O 3.29Å; L892-L949 PolarHBondContact O-N 2.58Å; L892-E962 HydrophobicContact CD1-CG 4.27Å; L892-E962 HydrophobicContact CD2-CG 4.46Å; L892-L965 HydrophobicContact CD1-CB 4.12Å; L892-L965 HydrophobicContact CD1-CD1 4.2Å
893	L	87.3	Confident	78.5	Confident	8 Å²	8	40.9 Å²	40.9	4%	0.042	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	120.8	-171.8	-151.6	130	0	0	0	111	R722 L724 I759 I931 D946 V948	R722-L893 HydrophobicContact CB-CB 4.01Å; R722-L893 PolarHBondContact O-N 3.29Å; L724-L893 HydrophobicContact CD1-CD1 3.85Å; L724-L893 HydrophobicContact CD2-CD1 3.86Å; L724-L893 HydrophobicContact CG-CD1 3.79Å; I759-L893 HydrophobicContact CD1-CD1 4.42Å; L893-I931 HydrophobicContact CD1-CD1 3.98Å; L893-I931 HydrophobicContact CD2-CD1 3.52Å; L893-I931 HydrophobicContact CG-CD1 4.4Å; L893-D946 HydrophobicContact CD2-CB 3.57Å; L893-D946 WeakPolarHBondContact CD2-OD2 3.48Å; L893-D946 HydrophobicContact CG-CB 4.23Å; L893-V948 HydrophobicContact CD1-CG2 4.1Å
894	V	85.2	Confident	77.5	Confident	4 Å²	4	41.3 Å²	41.3	2%	0.024	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	131.7	-163.4	-173.4	0	0	0	0	110.6	I898 R947 L949 I969	V894-I898 HydrophobicContact CG1-CB 3.95Å; V894-I898 HydrophobicContact CG1-CG2 3.88Å; V894-R947 PolarHBondContact N-O 2.74Å; V894-R947 PolarHBondContact O-N 2.74Å; V894-L949 HydrophobicContact CG2-CD1 3.91Å; V894-L949 HydrophobicContact CG2-CG 4.21Å; V894-I969 HydrophobicContact CG1-CG1 4.29Å; V894-I969 HydrophobicContact CG1-CG2 4.48Å; V894-I969 HydrophobicContact CG2-CD1 3.56Å; V894-I969 HydrophobicContact CG2-CG1 4.06Å
895	E	80.9	Confident	76.6	Confident	37 Å²	37	43.8 Å²	43.8	17%	0.173	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	141.6	178.9	-66.7	172.5	130.6	0	0	111.5	H897 I898 Y899 D946	E895-H897 PolarHBondContact O-N 2.77Å; E895-H897 VanDerWaalsContact O-N 3.12Å; E895-H897 IonicContact OE2-CE1 2.72Å; E895-H897 PolarHBondContact OE2-CE1 2.86Å; E895-H897 VanDerWaalsContact OE2-CE1 3.29Å; E895-I898 HydrophobicContact CB-CD1 4.25Å; E895-I898 HydrophobicContact CB-CG1 4.23Å; E895-I898 PolarHBondContact O-N 2.85Å; E895-I898 WeakPolarHBondContact OE2-CD1 3.5Å; E895-Y899 PolarHBondContact O-N 2.98Å; E895-D946 WeakPolarHBondContact CG-OD1 3.34Å
896	Q	79.7	Confident	76.1	Confident	45 Å²	45	43.8 Å²	43.8	21%	0.21	23%	0.228	C	C	.	.	H	α-helix	trans	-55.6	-32.7	-175	170.8	61.7	82.4	0	0	113.2	A900 T945 R947	Q896-A900 VanDerWaalsContact O-CB 3.28Å; Q896-A900 WeakPolarHBondContact O-CB 3.45Å; Q896-A900 PolarHBondContact O-N 2.91Å; Q896-T945 WeakPolarHBondContact CB-O 3.31Å; Q896-T945 WeakPolarHBondContact CB-OG1 3.37Å; Q896-T945 PolarHBondContact N-O 3.01Å; Q896-R947 VanDerWaalsContact OE1-CZ 3.25Å
897	H	75.3	Confident	75.8	Confident	92 Å²	92	41.7 Å²	41.7	43%	0.426	22%	0.218	S	C	.	.	H	α-helix	trans	-72	-41.9	177.3	74	-91.6	0	0	0	111.8	E895 A900 Q901 S976	E895-H897 PolarHBondContact O-N 2.77Å; E895-H897 VanDerWaalsContact O-N 3.12Å; E895-H897 IonicContact OE2-CE1 2.72Å; E895-H897 PolarHBondContact OE2-CE1 2.86Å; E895-H897 VanDerWaalsContact OE2-CE1 3.29Å; H897-A900 PolarHBondContact O-N 2.81Å; H897-Q901 WeakPolarHBondContact O-CB 3.22Å; H897-Q901 PolarHBondContact O-N 3.47Å; H897-S976 PolarHBondContact NE2-OG 3.34Å
898	I	77.7	Confident	75.5	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.015	22%	0.224	C	C	.	.	H	α-helix	trans	-65.8	-45	175.5	-55.9	-176.6	0	0	0	110.2	V894 E895 A900 Q901 L902 I969 A972 T973	V894-I898 HydrophobicContact CG1-CB 3.95Å; V894-I898 HydrophobicContact CG1-CG2 3.88Å; E895-I898 HydrophobicContact CB-CD1 4.25Å; E895-I898 HydrophobicContact CB-CG1 4.23Å; E895-I898 PolarHBondContact O-N 2.85Å; E895-I898 WeakPolarHBondContact OE2-CD1 3.5Å; I898-A900 VanDerWaalsContact C-N 3.32Å; I898-A900 PolarHBondContact O-N 3.22Å; I898-Q901 PolarHBondContact O-N 3.04Å; I898-L902 HydrophobicContact CG2-CD1 4.09Å; I898-L902 WeakPolarHBondContact O-CB 3.38Å; I898-L902 VanDerWaalsContact O-CG 3.3Å; I898-L902 WeakPolarHBondContact O-CG 3.45Å; I898-L902 PolarHBondContact O-N 3.25Å; I898-I969 HydrophobicContact CG2-CG2 4.49Å; I898-A972 HydrophobicContact CG2-CB 3.73Å; I898-T973 HydrophobicContact CD1-CG2 4.31Å; I898-T973 WeakPolarHBondContact CD1-OG1 3.36Å
899	Y	79.8	Confident	75.2	Confident	37 Å²	37	51.8 Å²	51.8	15%	0.145	26%	0.255	C	S	.	.	H	α-helix	trans	-57.2	-44.1	173	170.6	-93.3	0	0	0	112.1	E895 L902 I903 F911 V924 L949	E895-Y899 PolarHBondContact O-N 2.98Å; Y899-L902 PolarHBondContact O-N 2.64Å; Y899-I903 HydrophobicContact CD2-CD1 4.12Å; Y899-I903 HydrophobicContact CE1-CD1 3.96Å; Y899-I903 HydrophobicContact CE2-CD1 3.35Å; Y899-I903 HydrophobicContact CE2-CG1 4.39Å; Y899-I903 PolarHBondContact O-N 2.83Å; Y899-I903 VanDerWaalsContact OH-CD1 3.27Å; Y899-I903 WeakPolarHBondContact OH-CD1 3.39Å; Y899-F911 HydrophobicContact CE2-CZ 4.29Å; Y899-V924 HydrophobicContact CD2-CG1 4.24Å; Y899-V924 HydrophobicContact CE2-CB 4.23Å; Y899-V924 HydrophobicContact CE2-CG1 3.39Å; Y899-V924 HydrophobicContact CE2-CG2 3.85Å; Y899-L949 HydrophobicContact CD2-CD2 4.02Å; Y899-L949 HydrophobicContact CE2-CD2 3.99Å
900	A	73.3	Confident	75.1	Confident	26 Å²	26	52.4 Å²	52.4	22%	0.215	26%	0.256	C	S	.	.	H	α-helix	trans	-63.5	-45.4	175	0	0	0	0	0	111.1	Q896 H897 I898 L902 I903 M904	Q896-A900 VanDerWaalsContact O-CB 3.28Å; Q896-A900 WeakPolarHBondContact O-CB 3.45Å; Q896-A900 PolarHBondContact O-N 2.91Å; H897-A900 PolarHBondContact O-N 2.81Å; I898-A900 VanDerWaalsContact C-N 3.32Å; I898-A900 PolarHBondContact O-N 3.22Å; A900-L902 VanDerWaalsContact C-N 3.33Å; A900-L902 PolarHBondContact O-N 3.21Å; A900-I903 PolarHBondContact O-N 3.18Å; A900-I903 VanDerWaalsContact O-N 3.1Å; A900-M904 HydrophobicContact CB-CE 4.05Å; A900-M904 WeakPolarHBondContact O-CB 3.43Å; A900-M904 VanDerWaalsContact O-CG 3.23Å; A900-M904 WeakPolarHBondContact O-CG 3.23Å; A900-M904 PolarHBondContact O-N 3.44Å
901	Q	69.2	Low	74.9	Confident	44 Å²	44	53.2 Å²	53.2	21%	0.206	26%	0.259	C	S	.	.	H	α-helix	trans	-62.5	-37.3	179.7	-167.1	167.9	-5.1	0	0	112.6	H897 I898 I903 E975	H897-Q901 WeakPolarHBondContact O-CB 3.22Å; H897-Q901 PolarHBondContact O-N 3.47Å; I898-Q901 PolarHBondContact O-N 3.04Å; Q901-I903 VanDerWaalsContact C-N 3.34Å; Q901-I903 PolarHBondContact O-N 3.01Å; Q901-E975 PolarHBondContact NE2-OE2 2.92Å
902	L	70.3	Confident	74.6	Confident	22 Å²	22	58.1 Å²	58.1	12%	0.115	29%	0.285	C	S	.	.	H	α-helix	trans	-64.1	-33.4	173.2	-73.3	164.6	0	0	0	113.2	I898 Y899 A900 Q968 I969	I898-L902 HydrophobicContact CG2-CD1 4.09Å; I898-L902 WeakPolarHBondContact O-CB 3.38Å; I898-L902 VanDerWaalsContact O-CG 3.3Å; I898-L902 WeakPolarHBondContact O-CG 3.45Å; I898-L902 PolarHBondContact O-N 3.25Å; Y899-L902 PolarHBondContact O-N 2.64Å; A900-L902 VanDerWaalsContact C-N 3.33Å; A900-L902 PolarHBondContact O-N 3.21Å; L902-Q968 HydrophobicContact CD2-CB 3.68Å; L902-I969 HydrophobicContact CD1-CG1 3.93Å
903	I	68.1	Low	74.3	Confident	31 Å²	31	60.7 Å²	60.7	16%	0.159	31%	0.307	C	S	.	.	H	α-helix	trans	-101	-34.5	-173.8	-66.1	-172.8	0	0	0	114	Y899 A900 Q901 N905 K906 G907 F911	Y899-I903 HydrophobicContact CD2-CD1 4.12Å; Y899-I903 HydrophobicContact CE1-CD1 3.96Å; Y899-I903 HydrophobicContact CE2-CD1 3.35Å; Y899-I903 HydrophobicContact CE2-CG1 4.39Å; Y899-I903 PolarHBondContact O-N 2.83Å; Y899-I903 VanDerWaalsContact OH-CD1 3.27Å; Y899-I903 WeakPolarHBondContact OH-CD1 3.39Å; A900-I903 PolarHBondContact O-N 3.18Å; A900-I903 VanDerWaalsContact O-N 3.1Å; Q901-I903 VanDerWaalsContact C-N 3.34Å; Q901-I903 PolarHBondContact O-N 3.01Å; I903-N905 PolarHBondContact O-N 3.29Å; I903-K906 PolarHBondContact O-N 3.09Å; I903-G907 PolarHBondContact O-N 3.19Å; I903-F911 HydrophobicContact CD1-CE2 3.46Å; I903-F911 VanDerWaalsContact CD1-CE2 3.46Å; I903-F911 HydrophobicContact CD1-CZ 3.63Å; I903-F911 HydrophobicContact CG1-CE2 4.3Å; I903-F911 HydrophobicContact CG1-CZ 4.2Å
904	M	54	Low	74.3	Confident	144 Å²	144	60.9 Å²	60.9	71%	0.709	31%	0.308	S	S	*	.	H	α-helix	trans	-53.5	-32.4	-175.3	-81.7	-174.3	-63.6	0	0	112.3	A900	A900-M904 HydrophobicContact CB-CE 4.05Å; A900-M904 WeakPolarHBondContact O-CB 3.43Å; A900-M904 VanDerWaalsContact O-CG 3.23Å; A900-M904 WeakPolarHBondContact O-CG 3.23Å; A900-M904 PolarHBondContact O-N 3.44Å
905	N	54.8	Low	74.3	Confident	123 Å²	123	64.4 Å²	64.4	66%	0.658	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-12.8	179.2	-66	-27.7	0	0	0	114.8	I903	I903-N905 PolarHBondContact O-N 3.29Å
906	K	61.7	Low	74.6	Confident	82 Å²	82	67.9 Å²	67.9	36%	0.357	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.1	-12.4	-168	-64.7	-172.3	179.8	177.7	0	117.7	I903 K909 Y910	I903-K906 PolarHBondContact O-N 3.09Å; K906-K909 WeakPolarHBondContact O-CB 3.47Å; K906-Y910 HydrophobicContact CB-CD2 4.42Å; K906-Y910 HydrophobicContact CB-CG 4.45Å; K906-Y910 HydrophobicContact CD-CD2 4.01Å
907	G	66.8	Low	74.9	Confident	29 Å²	29	67.7 Å²	67.7	30%	0.299	35%	0.354	S	S	.	.			trans	60.4	-162.5	175.1	0	0	0	0	0	115.8	I903 K909 Y910	I903-G907 PolarHBondContact O-N 3.19Å; G907-K909 PolarHBondContact O-N 2.94Å; G907-Y910 WeakPolarHBondContact O-CB 3.29Å; G907-Y910 PolarHBondContact O-N 2.98Å
908	K	69.8	Low	75.6	Confident	167 Å²	167	64.1 Å²	64.1	73%	0.726	34%	0.339	S	S	*	.	H	α-helix	trans	-50.2	-30.4	172	-87.5	-172.4	175.1	-177.7	0	112.4	Y910 F911 N912	K908-Y910 PolarHBondContact O-N 2.91Å; K908-F911 PolarHBondContact O-N 2.82Å; K908-N912 PolarHBondContact O-N 3.31Å; K908-N912 PolarHBondContact O-OD1 2.93Å
909	K	74.5	Confident	76	Confident	175 Å²	175	66 Å²	66	76%	0.761	36%	0.359	S	S	*	.	H	α-helix	trans	-59.5	-26.3	179.4	-62.4	178.8	179.7	177.3	0	113	K906 G907 A913	K906-K909 WeakPolarHBondContact O-CB 3.47Å; G907-K909 PolarHBondContact O-N 2.94Å; K909-A913 WeakPolarHBondContact O-CB 3.49Å; K909-A913 PolarHBondContact O-N 3.21Å
910	Y	81.6	Confident	76.4	Confident	26 Å²	26	64.3 Å²	64.3	10%	0.102	35%	0.352	C	S	.	.	H	α-helix	trans	-62.8	-50.5	174.4	-178.9	-114.4	0	0	0	112.6	K906 G907 K908 N912 A913 I914 L965 Q968	K906-Y910 HydrophobicContact CB-CD2 4.42Å; K906-Y910 HydrophobicContact CB-CG 4.45Å; K906-Y910 HydrophobicContact CD-CD2 4.01Å; G907-Y910 WeakPolarHBondContact O-CB 3.29Å; G907-Y910 PolarHBondContact O-N 2.98Å; K908-Y910 PolarHBondContact O-N 2.91Å; Y910-N912 VanDerWaalsContact C-N 3.35Å; Y910-A913 WeakPolarHBondContact O-CB 3.2Å; Y910-A913 PolarHBondContact O-N 3.09Å; Y910-I914 HydrophobicContact CD1-CD1 4.14Å; Y910-I914 HydrophobicContact CE1-CD1 3.62Å; Y910-I914 HydrophobicContact CE2-CD1 4.18Å; Y910-I914 PolarHBondContact O-N 3.48Å; Y910-I914 VanDerWaalsContact O-N 3.09Å; Y910-L965 HydrophobicContact CE1-CD2 4.33Å; Y910-Q968 WeakPolarHBondContact OH-CG 3.37Å
911	F	85	Confident	77	Confident	21 Å²	21	71.4 Å²	71.4	9%	0.092	37%	0.374	C	S	.	.	H	α-helix	trans	-67.9	-36.4	178.6	-62.8	-45.8	0	0	0	111.9	Y899 I903 K908 A913 I914 H915 I922 V924 L949	Y899-F911 HydrophobicContact CE2-CZ 4.29Å; I903-F911 HydrophobicContact CD1-CE2 3.46Å; I903-F911 VanDerWaalsContact CD1-CE2 3.46Å; I903-F911 HydrophobicContact CD1-CZ 3.63Å; I903-F911 HydrophobicContact CG1-CE2 4.3Å; I903-F911 HydrophobicContact CG1-CZ 4.2Å; K908-F911 PolarHBondContact O-N 2.82Å; F911-A913 VanDerWaalsContact C-N 3.31Å; F911-A913 PolarHBondContact O-N 3.13Å; F911-I914 PolarHBondContact O-N 2.96Å; F911-H915 WeakPolarHBondContact O-CB 3.17Å; F911-H915 PolarHBondContact O-N 2.96Å; F911-I922 HydrophobicContact CB-CB 4.28Å; F911-I922 HydrophobicContact CD1-CB 3.97Å; F911-I922 HydrophobicContact CD1-CD1 3.94Å; F911-I922 HydrophobicContact CD1-CG2 3.61Å; F911-I922 HydrophobicContact CE1-CG2 3.78Å; F911-I922 HydrophobicContact CG-CB 4.23Å; F911-I922 HydrophobicContact CG-CG2 4.11Å; F911-I922 HydrophobicContact CZ-CG2 4.4Å; F911-V924 HydrophobicContact CD2-CG2 4.42Å; F911-V924 HydrophobicContact CE2-CG2 3.58Å; F911-V924 HydrophobicContact CZ-CG2 3.92Å; F911-L949 HydrophobicContact CE1-CD2 4.22Å; F911-L949 HydrophobicContact CZ-CD2 3.85Å
912	N	82.9	Confident	78	Confident	103 Å²	103	70.4 Å²	70.4	55%	0.551	37%	0.369	S	S	*	.	H	α-helix	trans	-62.2	-38.7	172.4	-68.5	16.3	0	0	0	111.4	K908 Y910 H915 T916	K908-N912 PolarHBondContact O-N 3.31Å; K908-N912 PolarHBondContact O-OD1 2.93Å; Y910-N912 VanDerWaalsContact C-N 3.35Å; N912-H915 WeakPolarHBondContact O-CB 3.44Å; N912-H915 PolarHBondContact O-N 3.28Å; N912-T916 PolarHBondContact O-N 2.77Å; N912-T916 PolarHBondContact O-OG1 2.66Å
913	A	83.7	Confident	78.7	Confident	55 Å²	55	71.3 Å²	71.3	46%	0.455	38%	0.377	S	S	.	.	H	α-helix	trans	-65.8	-39.4	175.8	0	0	0	0	0	112.9	K909 Y910 F911 A917	K909-A913 WeakPolarHBondContact O-CB 3.49Å; K909-A913 PolarHBondContact O-N 3.21Å; Y910-A913 WeakPolarHBondContact O-CB 3.2Å; Y910-A913 PolarHBondContact O-N 3.09Å; F911-A913 VanDerWaalsContact C-N 3.31Å; F911-A913 PolarHBondContact O-N 3.13Å; A913-A917 WeakPolarHBondContact O-CB 3.46Å; A913-A917 PolarHBondContact O-N 3.14Å
914	I	86.4	Confident	79.4	Confident	13 Å²	13	71.4 Å²	71.4	7%	0.067	38%	0.379	C	S	.	.	H	α-helix	trans	-68.8	-40.6	174.3	-60	168.1	0	0	0	110.7	Y910 F911 T916 A917 T918 I922 A961 L965	Y910-I914 HydrophobicContact CD1-CD1 4.14Å; Y910-I914 HydrophobicContact CE1-CD1 3.62Å; Y910-I914 HydrophobicContact CE2-CD1 4.18Å; Y910-I914 PolarHBondContact O-N 3.48Å; Y910-I914 VanDerWaalsContact O-N 3.09Å; F911-I914 PolarHBondContact O-N 2.96Å; I914-T916 PolarHBondContact O-N 3.29Å; I914-A917 PolarHBondContact O-N 3.27Å; I914-A917 VanDerWaalsContact O-N 3.12Å; I914-T918 HydrophobicContact CG2-CG2 4.06Å; I914-T918 WeakPolarHBondContact O-CB 3.37Å; I914-T918 PolarHBondContact O-N 3.19Å; I914-T918 PolarHBondContact O-OG1 3.03Å; I914-I922 HydrophobicContact CB-CD1 3.78Å; I914-I922 HydrophobicContact CD1-CD1 3.94Å; I914-I922 HydrophobicContact CG1-CD1 4.48Å; I914-I922 HydrophobicContact CG2-CD1 3.62Å; I914-A961 HydrophobicContact CG2-CB 4.04Å; I914-L965 HydrophobicContact CD1-CD2 3.77Å; I914-L965 HydrophobicContact CD1-CG 4.37Å
915	H	85.2	Confident	80.3	Confident	78 Å²	78	64.8 Å²	64.8	36%	0.361	35%	0.347	S	S	.	.	H	α-helix	trans	-56.1	-50.1	173.5	175.3	-105.2	0	0	0	111.1	F911 N912 A917 T918 G919 A920 R921	F911-H915 WeakPolarHBondContact O-CB 3.17Å; F911-H915 PolarHBondContact O-N 2.96Å; N912-H915 WeakPolarHBondContact O-CB 3.44Å; N912-H915 PolarHBondContact O-N 3.28Å; H915-A917 VanDerWaalsContact C-N 3.29Å; H915-A917 PolarHBondContact O-N 2.8Å; H915-T918 PolarHBondContact O-N 3.25Å; H915-G919 WeakPolarHBondContact O-CA 3.31Å; H915-G919 PolarHBondContact O-N 2.79Å; H915-A920 WeakPolarHBondContact CA-O 3.45Å; H915-A920 PolarHBondContact CD2-O 3.43Å; H915-R921 VanDerWaalsContact CD2-CG 3.47Å; H915-R921 WeakPolarHBondContact CD2-CG 3.1Å; H915-R921 WeakPolarHBondContact NE2-CG 3.36Å
916	T	86.5	Confident	80.6	Confident	109 Å²	109	62.2 Å²	62.2	67%	0.669	35%	0.35	S	S	*	.	H	α-helix	trans	-63.4	-31.1	175.7	-56.3	0	0	0	0	113	N912 I914	N912-T916 PolarHBondContact O-N 2.77Å; N912-T916 PolarHBondContact O-OG1 2.66Å; I914-T916 PolarHBondContact O-N 3.29Å
917	A	87.1	Confident	80.4	Confident	42 Å²	42	63 Å²	63	35%	0.347	36%	0.362	S	S	.	.	H	α-helix	trans	-79.9	-23.9	179.1	0	0	0	0	0	114.6	A913 I914 H915	A913-A917 WeakPolarHBondContact O-CB 3.46Å; A913-A917 PolarHBondContact O-N 3.14Å; I914-A917 PolarHBondContact O-N 3.27Å; I914-A917 VanDerWaalsContact O-N 3.12Å; H915-A917 VanDerWaalsContact C-N 3.29Å; H915-A917 PolarHBondContact O-N 2.8Å
918	T	88.5	Confident	80	Confident	17 Å²	17	64 Å²	64	10%	0.104	36%	0.363	C	S	.	.	H	α-helix	trans	-129.6	-22.3	-167.1	63.4	0	0	0	0	115.4	I914 H915 A920 S957 A960 A961 F964	I914-T918 HydrophobicContact CG2-CG2 4.06Å; I914-T918 WeakPolarHBondContact O-CB 3.37Å; I914-T918 PolarHBondContact O-N 3.19Å; I914-T918 PolarHBondContact O-OG1 3.03Å; H915-T918 PolarHBondContact O-N 3.25Å; T918-A920 VanDerWaalsContact C-N 3.33Å; T918-A920 PolarHBondContact OG1-N 3.22Å; T918-S957 WeakPolarHBondContact O-CA 3.38Å; T918-S957 WeakPolarHBondContact O-CB 3.29Å; T918-S957 PolarHBondContact O-OG 2.9Å; T918-A960 HydrophobicContact CG2-CB 3.98Å; T918-A961 HydrophobicContact CG2-CB 4.24Å; T918-F964 HydrophobicContact CG2-CD2 3.84Å; T918-F964 HydrophobicContact CG2-CE2 3.94Å
919	G	86.9	Confident	79.5	Confident	43 Å²	43	57.6 Å²	57.6	44%	0.443	34%	0.336	S	S	.	.	S	Bend	trans	78.7	6.5	-169.9	0	0	0	0	0	115.1	H915	H915-G919 WeakPolarHBondContact O-CA 3.31Å; H915-G919 PolarHBondContact O-N 2.79Å
920	A	88.6	Confident	78.5	Confident	0 Å²	0	56 Å²	56	0%	0	33%	0.332	C	S	.	.			trans	-98.4	126.3	178.2	0	0	0	0	0	112	H915 T918 V951 R952 A961	H915-A920 WeakPolarHBondContact CA-O 3.45Å; H915-A920 PolarHBondContact CD2-O 3.43Å; T918-A920 VanDerWaalsContact C-N 3.33Å; T918-A920 PolarHBondContact OG1-N 3.22Å; A920-V951 HydrophobicContact CB-CG1 3.83Å; A920-R952 CarbonylContact C-O 3.26Å; A920-R952 VanDerWaalsContact CA-O 3.29Å; A920-R952 WeakPolarHBondContact CA-O 3.22Å; A920-A961 HydrophobicContact CB-CB 3.7Å
921	R	86.2	Confident	77.3	Confident	176 Å²	176	55.8 Å²	55.8	66%	0.664	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.8	125.7	172.8	-71.3	-178.3	77	154.6	4	108.6	H915 R952	H915-R921 VanDerWaalsContact CD2-CG 3.47Å; H915-R921 WeakPolarHBondContact CD2-CG 3.1Å; H915-R921 WeakPolarHBondContact NE2-CG 3.36Å; R921-R952 PolarHBondContact N-O 2.92Å; R921-R952 PolarHBondContact O-N 2.76Å
922	I	88.7	Confident	75	Confident	23 Å²	23	65.5 Å²	65.5	12%	0.118	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	130.7	175.7	-57.6	162.1	0	0	0	108	F911 I914 V951 L965	F911-I922 HydrophobicContact CB-CB 4.28Å; F911-I922 HydrophobicContact CD1-CB 3.97Å; F911-I922 HydrophobicContact CD1-CD1 3.94Å; F911-I922 HydrophobicContact CD1-CG2 3.61Å; F911-I922 HydrophobicContact CE1-CG2 3.78Å; F911-I922 HydrophobicContact CG-CB 4.23Å; F911-I922 HydrophobicContact CG-CG2 4.11Å; F911-I922 HydrophobicContact CZ-CG2 4.4Å; I914-I922 HydrophobicContact CB-CD1 3.78Å; I914-I922 HydrophobicContact CD1-CD1 3.94Å; I914-I922 HydrophobicContact CG1-CD1 4.48Å; I914-I922 HydrophobicContact CG2-CD1 3.62Å; I922-V951 HydrophobicContact CG1-CG1 4.35Å; I922-V951 HydrophobicContact CG1-CG2 4.36Å; I922-L965 HydrophobicContact CD1-CD1 3.94Å; I922-L965 HydrophobicContact CD1-CD2 4.35Å; I922-L965 HydrophobicContact CD1-CG 4.39Å; I922-L965 HydrophobicContact CG1-CD1 4.37Å
923	S	85.3	Confident	72.8	Confident	40 Å²	40	64.7 Å²	64.7	28%	0.28	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	158.8	176.3	49.7	0	0	0	0	109.6	V950	S923-V950 PolarHBondContact N-O 3.47Å; S923-V950 PolarHBondContact O-N 2.78Å; S923-V950 PolarHBondContact OG-O 2.9Å; S923-V950 VanDerWaalsContact OG-O 3.08Å
924	V	82.8	Confident	70.3	Confident	33 Å²	33	67.1 Å²	67.1	20%	0.2	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	147.2	-173.9	-164.5	0	0	0	0	109.8	Y899 F911 R947 V948 L949	Y899-V924 HydrophobicContact CD2-CG1 4.24Å; Y899-V924 HydrophobicContact CE2-CB 4.23Å; Y899-V924 HydrophobicContact CE2-CG1 3.39Å; Y899-V924 HydrophobicContact CE2-CG2 3.85Å; F911-V924 HydrophobicContact CD2-CG2 4.42Å; F911-V924 HydrophobicContact CE2-CG2 3.58Å; F911-V924 HydrophobicContact CZ-CG2 3.92Å; V924-R947 HydrophobicContact CG1-CB 4.36Å; V924-V948 WeakPolarHBondContact CA-O 3.37Å; V924-L949 HydrophobicContact CG1-CD2 4.22Å; V924-L949 HydrophobicContact CG2-CD2 3.87Å
925	T	74.4	Confident	67.7	Low	5 Å²	5	70.7 Å²	70.7	3%	0.031	41%	0.408	C	S	.	.			trans	-60.7	133.1	167.5	63.1	0	0	0	0	111.7	F761 T927 R947 V948	F761-T925 HydrophobicContact CD2-CG2 4.34Å; F761-T925 HydrophobicContact CE2-CG2 3.23Å; F761-T925 HydrophobicContact CZ-CG2 3.37Å; T925-T927 WeakPolarHBondContact CB-O 3.19Å; T925-T927 PolarHBondContact OG1-O 2.67Å; T925-R947 PolarHBondContact O-NH1 3.42Å; T925-V948 HydrophobicContact CG2-CB 3.62Å; T925-V948 HydrophobicContact CG2-CG2 3.91Å; T925-V948 PolarHBondContact N-O 3.28Å; T925-V948 PolarHBondContact OG1-N 3.24Å
926	G	59.3	Low	64.8	Low	70 Å²	70	75.1 Å²	75.1	72%	0.722	43%	0.434	S	S	*	.	S	Bend	trans	-64.2	-46.9	174	0	0	0	0	0	111.5	R947	G926-R947 PolarHBondContact O-NH1 2.97Å
927	T	59.4	Low	62.2	Low	99 Å²	99	75.7 Å²	75.7	61%	0.607	44%	0.438	S	S	*	.	S	Bend	trans	-89	148.8	172.5	46.8	0	0	0	0	112.1	T925	T925-T927 WeakPolarHBondContact CB-O 3.19Å; T925-T927 PolarHBondContact OG1-O 2.67Å
928	P	58	Low	59.3	Low	49 Å²	49	82.9 Å²	82.9	32%	0.318	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-72	141.9	157.9	-9.1	26.4	0	0	0	110.2	T945 D946	P928-T945 HydrophobicContact CB-CG2 3.91Å; P928-T945 HydrophobicContact CG-CG2 4.36Å; P928-D946 CarbonylContact C-O 3.33Å; P928-D946 WeakPolarHBondContact CA-O 3.42Å
929	L	58.4	Low	56.4	Low	32 Å²	32	88.2 Å²	88.2	17%	0.168	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	133.6	169.3	-60.8	177.5	0	0	0	109.5	I759 F761 D946 V948	I759-L929 HydrophobicContact CG2-CD1 3.78Å; F761-L929 HydrophobicContact CD2-CD1 4.29Å; L929-D946 PolarHBondContact N-O 2.79Å; L929-D946 PolarHBondContact O-N 2.93Å; L929-D946 VanDerWaalsContact O-N 3.1Å; L929-V948 HydrophobicContact CD1-CG2 3.57Å
930	Q	54.5	Low	53.4	Low	143 Å²	143	92.7 Å²	92.7	67%	0.668	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	110.3	159.3	-75.5	-174	-12	0	0	108.5	R932 A943	Q930-R932 PolarHBondContact O-N 2.72Å; Q930-A943 HydrophobicContact CG-CB 4.28Å
931	I	55.2	Low	50.5	Low	21 Å²	21	95.2 Å²	95.2	11%	0.108	52%	0.524	C	S	.	.			trans	-84	97.6	170.7	-61.9	171.8	0	0	0	107.6	I759 L893 P933	I759-I931 HydrophobicContact CD1-CD1 3.5Å; I759-I931 HydrophobicContact CD1-CG1 3.85Å; I759-I931 HydrophobicContact CD1-CG2 4.4Å; I759-I931 HydrophobicContact CG1-CD1 4.42Å; I759-I931 HydrophobicContact CG1-CG1 4.24Å; L893-I931 HydrophobicContact CD1-CD1 3.98Å; L893-I931 HydrophobicContact CD2-CD1 3.52Å; L893-I931 HydrophobicContact CG-CD1 4.4Å; I931-P933 WeakPolarHBondContact O-CD 3.49Å
932	R	36.9	Very low	47.9	Very low	225 Å²	225	94.6 Å²	94.6	85%	0.849	53%	0.533	S	S	*	.			trans	-71.8	119.4	177	-169	170.7	-176.9	147.5	-1.4	109.6	Q930	Q930-R932 PolarHBondContact O-N 2.72Å
933	P	36.4	Very low	45.5	Very low	86 Å²	86	95.1 Å²	95.1	56%	0.558	54%	0.541	S	S	*	.			trans	-68.6	133.7	178.7	-19	32.8	0	0	0	111.5	I931 S935	I931-P933 WeakPolarHBondContact O-CD 3.49Å; P933-S935 VanDerWaalsContact C-N 3.31Å; P933-S935 PolarHBondContact O-N 3.05Å
934	S	31.2	Very low	44	Very low	105 Å²	105	95.4 Å²	95.4	73%	0.734	54%	0.542	S	S	*	.	S	Bend	trans	-82.1	70.4	179.3	-56.5	0	0	0	0	111.9
935	S	31.8	Very low	43.2	Very low	88 Å²	88	96.7 Å²	96.7	62%	0.615	55%	0.55	S	S	*	.	S	Bend	trans	-159.1	124.3	171.5	60.8	0	0	0	0	112.2	P933 V937	P933-S935 VanDerWaalsContact C-N 3.31Å; P933-S935 PolarHBondContact O-N 3.05Å; S935-V937 PolarHBondContact O-N 3.27Å; S935-V937 VanDerWaalsContact O-N 3.13Å
936	D	25.7	Very low	43.3	Very low	172 Å²	172	96.5 Å²	96.5	92%	0.92	55%	0.548	S	S	*	.			trans	-77.4	96	-170.4	-51.7	-75.3	0	0	0	114
937	V	31.6	Very low	44.3	Very low	121 Å²	121	95.1 Å²	95.1	73%	0.733	52%	0.522	S	S	*	.			trans	-141.7	122.8	150.7	-177.5	0	0	0	0	108.3	S935 Q939	S935-V937 PolarHBondContact O-N 3.27Å; S935-V937 VanDerWaalsContact O-N 3.13Å; V937-Q939 PolarHBondContact O-N 3.23Å
938	E	26.5	Very low	45.6	Very low	193 Å²	193	90.4 Å²	90.4	90%	0.902	49%	0.493	S	S	*	.			trans	-66.7	115.9	173.5	-64.6	-170	134.3	0	0	111
939	Q	27	Very low	47	Very low	129 Å²	129	88.2 Å²	88.2	60%	0.603	48%	0.478	S	S	*	.			trans	-155.4	85.4	165.7	-146.2	161.9	95	0	0	112.1	V937 N941	V937-Q939 PolarHBondContact O-N 3.23Å; Q939-N941 PolarHBondContact O-N 3.16Å; Q939-N941 PolarHBondContact O-ND2 3.47Å
940	C	23.4	Very low	48.5	Very low	137 Å²	137	86.7 Å²	86.7	93%	0.926	47%	0.47	S	S	*	.			trans	-50.7	100	176.5	-65.1	0	0	0	0	112.3
941	N	27.3	Very low	50.3	Low	52 Å²	52	79.9 Å²	79.9	28%	0.278	44%	0.438	S	S	.	.			trans	-137.1	150.2	166.8	-63.5	-96.5	0	0	0	105.5	Q939 A943	Q939-N941 PolarHBondContact O-N 3.16Å; Q939-N941 PolarHBondContact O-ND2 3.47Å; N941-A943 PolarHBondContact O-N 2.98Å; N941-A943 VanDerWaalsContact O-N 3.07Å
942	L	33.1	Very low	51.9	Low	163 Å²	163	81.4 Å²	81.4	85%	0.853	44%	0.443	S	S	*	.			trans	-65.4	113.2	-169.9	-78.6	65.9	0	0	0	110.4
943	A	38.2	Very low	54.3	Low	34 Å²	34	72.2 Å²	72.2	28%	0.281	42%	0.418	S	S	.	.			trans	-57.7	142.3	177.4	0	0	0	0	0	111	Q930 N941 T945	Q930-A943 HydrophobicContact CG-CB 4.28Å; N941-A943 PolarHBondContact O-N 2.98Å; N941-A943 VanDerWaalsContact O-N 3.07Å; A943-T945 PolarHBondContact O-N 3.13Å
944	P	53.9	Low	56.8	Low	46 Å²	46	75 Å²	75	30%	0.299	42%	0.424	S	S	.	.			trans	-69.5	124.1	-174.6	28.8	-30.5	0	0	0	108.6	D946 E1234	P944-D946 PolarHBondContact O-N 3.18Å; P944-E1234 VanDerWaalsContact CD-OE2 3.27Å; P944-E1234 WeakPolarHBondContact CD-OE2 3.28Å
945	T	64.3	Low	59.6	Low	60 Å²	60	71.8 Å²	71.8	37%	0.368	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	107.3	178.6	35.1	0	0	0	0	108.8	Q896 P928 A943	Q896-T945 WeakPolarHBondContact CB-O 3.31Å; Q896-T945 WeakPolarHBondContact CB-OG1 3.37Å; Q896-T945 PolarHBondContact N-O 3.01Å; P928-T945 HydrophobicContact CB-CG2 3.91Å; P928-T945 HydrophobicContact CG-CG2 4.36Å; A943-T945 PolarHBondContact O-N 3.13Å
946	D	77.8	Confident	62.5	Low	1 Å²	1	75 Å²	75	1%	0.005	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	148.1	176.6	-78.6	-51	0	0	0	110.8	R722 L893 E895 P928 L929 P944	R722-D946 IonicContact CZ-OD1 3.56Å; R722-D946 IonicContact CZ-OD2 4Å; R722-D946 VanDerWaalsContact CZ-OD2 3.3Å; R722-D946 VanDerWaalsContact NH1-CG 3.25Å; R722-D946 IonicContact NH1-OD1 2.76Å; R722-D946 PolarHBondContact NH1-OD1 3.01Å; R722-D946 IonicContact NH1-OD2 2.82Å; R722-D946 PolarHBondContact NH1-OD2 3.26Å; R722-D946 IonicContact NH2-OD1 3.76Å; R722-D946 IonicContact NH2-OD2 2.72Å; R722-D946 PolarHBondContact NH2-OD2 3.1Å; L893-D946 HydrophobicContact CD2-CB 3.57Å; L893-D946 WeakPolarHBondContact CD2-OD2 3.48Å; L893-D946 HydrophobicContact CG-CB 4.23Å; E895-D946 WeakPolarHBondContact CG-OD1 3.34Å; P928-D946 CarbonylContact C-O 3.33Å; P928-D946 WeakPolarHBondContact CA-O 3.42Å; L929-D946 PolarHBondContact N-O 2.79Å; L929-D946 PolarHBondContact O-N 2.93Å; L929-D946 VanDerWaalsContact O-N 3.1Å; P944-D946 PolarHBondContact O-N 3.18Å
947	R	80.9	Confident	65.6	Low	42 Å²	42	67.8 Å²	67.8	16%	0.158	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	154	164.2	-69	-159.6	-173.1	-121.4	-5.9	110.7	V894 Q896 V924 T925 G926	V894-R947 PolarHBondContact N-O 2.74Å; V894-R947 PolarHBondContact O-N 2.74Å; Q896-R947 VanDerWaalsContact OE1-CZ 3.25Å; V924-R947 HydrophobicContact CG1-CB 4.36Å; T925-R947 PolarHBondContact O-NH1 3.42Å; G926-R947 PolarHBondContact O-NH1 2.97Å
948	V	85.5	Confident	68.5	Low	0 Å²	0	62 Å²	62	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	126.9	168.3	-164.3	0	0	0	0	109.3	L724 F761 L892 L893 V924 T925 L929 V950	L724-V948 HydrophobicContact CD1-CG1 3.91Å; L724-V948 HydrophobicContact CD1-CG2 3.74Å; F761-V948 HydrophobicContact CD2-CG2 4.49Å; F761-V948 HydrophobicContact CE1-CB 4.23Å; F761-V948 HydrophobicContact CE1-CG1 4.14Å; F761-V948 HydrophobicContact CE1-CG2 4.36Å; F761-V948 HydrophobicContact CE2-CG2 4.35Å; F761-V948 HydrophobicContact CZ-CB 4.09Å; F761-V948 HydrophobicContact CZ-CG1 4.46Å; F761-V948 HydrophobicContact CZ-CG2 4.25Å; L892-V948 CarbonylContact O-C 3.47Å; L892-V948 WeakPolarHBondContact O-CA 3.33Å; L893-V948 HydrophobicContact CD1-CG2 4.1Å; V924-V948 WeakPolarHBondContact CA-O 3.37Å; T925-V948 HydrophobicContact CG2-CB 3.62Å; T925-V948 HydrophobicContact CG2-CG2 3.91Å; T925-V948 PolarHBondContact N-O 3.28Å; T925-V948 PolarHBondContact OG1-N 3.24Å; L929-V948 HydrophobicContact CD1-CG2 3.57Å; V948-V950 HydrophobicContact CB-CG2 4.43Å; V948-V950 HydrophobicContact CG1-CG2 3.93Å
949	L	88.4	Confident	71.5	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	109.2	161.7	-62.2	178.8	0	0	0	107.6	L892 V894 Y899 F911 V924 L965 I969	L892-L949 HydrophobicContact CB-CB 4.35Å; L892-L949 PolarHBondContact N-O 3.29Å; L892-L949 PolarHBondContact O-N 2.58Å; V894-L949 HydrophobicContact CG2-CD1 3.91Å; V894-L949 HydrophobicContact CG2-CG 4.21Å; Y899-L949 HydrophobicContact CD2-CD2 4.02Å; Y899-L949 HydrophobicContact CE2-CD2 3.99Å; F911-L949 HydrophobicContact CE1-CD2 4.22Å; F911-L949 HydrophobicContact CZ-CD2 3.85Å; V924-L949 HydrophobicContact CG1-CD2 4.22Å; V924-L949 HydrophobicContact CG2-CD2 3.87Å; L949-L965 HydrophobicContact CD1-CD1 4.42Å; L949-L965 HydrophobicContact CD1-CD2 4.24Å; L949-I969 HydrophobicContact CD1-CD1 4.34Å
950	V	89.4	Confident	74.6	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	110.8	178.3	-179.4	0	0	0	0	108.9	F761 C889 L890 S923 V948 R952	F761-V950 HydrophobicContact CE1-CG2 3.59Å; F761-V950 HydrophobicContact CZ-CG2 3.81Å; C889-V950 HydrophobicContact CB-CG1 4.34Å; L890-V950 WeakPolarHBondContact O-CA 3.39Å; S923-V950 PolarHBondContact N-O 3.47Å; S923-V950 PolarHBondContact O-N 2.78Å; S923-V950 PolarHBondContact OG-O 2.9Å; S923-V950 VanDerWaalsContact OG-O 3.08Å; V948-V950 HydrophobicContact CB-CG2 4.43Å; V948-V950 HydrophobicContact CG1-CG2 3.93Å; V950-R952 HydrophobicContact CG1-CG 4.16Å
951	V	91	Very high	77.8	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	119.3	-178.2	-170.1	0	0	0	0	109.4	C889 L890 A920 I922 I958 A961 L965	C889-V951 VanDerWaalsContact CB-O 3.29Å; C889-V951 WeakPolarHBondContact CB-O 3.32Å; L890-V951 HydrophobicContact CB-CB 4.33Å; L890-V951 PolarHBondContact N-O 3.05Å; L890-V951 PolarHBondContact O-N 2.69Å; A920-V951 HydrophobicContact CB-CG1 3.83Å; I922-V951 HydrophobicContact CG1-CG1 4.35Å; I922-V951 HydrophobicContact CG1-CG2 4.36Å; V951-I958 HydrophobicContact CB-CG2 4.48Å; V951-I958 HydrophobicContact CG1-CG1 4.37Å; V951-I958 HydrophobicContact CG1-CG2 4.19Å; V951-A961 HydrophobicContact CG1-CB 3.95Å; V951-L965 HydrophobicContact CG2-CD1 3.78Å
952	R	88.8	Confident	80.8	Confident	53 Å²	53	40.5 Å²	40.5	20%	0.2	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	143.9	-179.2	-53.2	-157.7	165.7	165	-5.8	111.1	Q763 F764 S765 C889 A920 R921 V950	Q763-R952 PolarHBondContact O-NH2 2.79Å; F764-R952 PolarHBondContact O-NH2 2.86Å; S765-R952 PolarHBondContact O-NH2 2.81Å; C889-R952 HydrophobicContact CB-CB 4.35Å; C889-R952 HydrophobicContact CB-CG 3.64Å; A920-R952 CarbonylContact C-O 3.26Å; A920-R952 VanDerWaalsContact CA-O 3.29Å; A920-R952 WeakPolarHBondContact CA-O 3.22Å; R921-R952 PolarHBondContact N-O 2.92Å; R921-R952 PolarHBondContact O-N 2.76Å; V950-R952 HydrophobicContact CG1-CG 4.16Å
953	G	88.8	Confident	83.4	Confident	32 Å²	32	34.1 Å²	34.1	33%	0.33	19%	0.194	S	C	.	.	S	Bend	trans	156.4	-168.2	179.1	0	0	0	0	0	111.9	I958	G953-I958 VanDerWaalsContact O-CD1 3.31Å; G953-I958 WeakPolarHBondContact O-CD1 3.39Å
954	Q	89.1	Confident	85.7	Confident	145 Å²	145	34.2 Å²	34.2	68%	0.678	19%	0.189	S	C	*	.			trans	-69.1	154.2	169.5	-61.7	-175	4.2	0	0	110.9	H956 S957 I958	Q954-H956 VanDerWaalsContact C-N 3.32Å; Q954-H956 PolarHBondContact O-N 3.03Å; Q954-S957 WeakPolarHBondContact O-CA 3.42Å; Q954-S957 WeakPolarHBondContact O-CB 3.34Å; Q954-S957 PolarHBondContact O-N 3.05Å; Q954-I958 PolarHBondContact O-N 2.75Å
955	L	90.2	Very high	87.3	Confident	37 Å²	37	32.1 Å²	32.1	19%	0.194	18%	0.175	C	C	.	.	H	α-helix	trans	-45.2	-50.8	178.9	175.6	62.2	0	0	0	113.2	L873 F877 S957 I958 C959	L873-L955 HydrophobicContact CB-CD1 3.56Å; F877-L955 HydrophobicContact CD2-CB 4.1Å; F877-L955 HydrophobicContact CD2-CD1 3.9Å; F877-L955 HydrophobicContact CD2-CG 4.5Å; F877-L955 HydrophobicContact CE2-CB 4.17Å; F877-L955 HydrophobicContact CE2-CD1 4.26Å; L955-S957 PolarHBondContact O-N 2.92Å; L955-I958 PolarHBondContact O-N 3.48Å; L955-C959 PolarHBondContact O-N 3.24Å; L955-C959 PolarHBondContact O-SG 2.81Å; L955-C959 VanDerWaalsContact O-SG 3.33Å
956	H	91.2	Very high	88.2	Confident	155 Å²	155	29.5 Å²	29.5	72%	0.718	16%	0.159	S	C	*	.	H	α-helix	trans	-62.2	-39.5	178.4	-61.9	115.1	0	0	0	113.2	Q954 A960	Q954-H956 VanDerWaalsContact C-N 3.32Å; Q954-H956 PolarHBondContact O-N 3.03Å; H956-A960 WeakPolarHBondContact O-CB 3.31Å; H956-A960 PolarHBondContact O-N 3.42Å
957	S	91.8	Very high	88.3	Confident	21 Å²	21	30.5 Å²	30.5	15%	0.147	16%	0.163	C	C	.	.	H	α-helix	trans	-67.8	-42.9	176.9	-63.8	0	0	0	0	112.1	T918 Q954 L955 A960 A961	T918-S957 WeakPolarHBondContact O-CA 3.38Å; T918-S957 WeakPolarHBondContact O-CB 3.29Å; T918-S957 PolarHBondContact O-OG 2.9Å; Q954-S957 WeakPolarHBondContact O-CA 3.42Å; Q954-S957 WeakPolarHBondContact O-CB 3.34Å; Q954-S957 PolarHBondContact O-N 3.05Å; L955-S957 PolarHBondContact O-N 2.92Å; S957-A960 PolarHBondContact O-N 3.17Å; S957-A961 WeakPolarHBondContact O-CB 3.26Å; S957-A961 PolarHBondContact O-N 3.37Å
958	I	91.7	Very high	88.3	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-63.3	-47.2	176.6	-63.7	175.2	0	0	0	110	L873 F877 L890 V951 G953 Q954 L955 A960 A961 E962	L873-I958 HydrophobicContact CD1-CB 4.36Å; L873-I958 HydrophobicContact CD1-CG2 3.55Å; F877-I958 HydrophobicContact CE2-CD1 4.03Å; F877-I958 HydrophobicContact CZ-CD1 3.96Å; L890-I958 HydrophobicContact CB-CG2 3.7Å; L890-I958 HydrophobicContact CD2-CG2 3.9Å; L890-I958 HydrophobicContact CG-CG2 4.47Å; V951-I958 HydrophobicContact CB-CG2 4.48Å; V951-I958 HydrophobicContact CG1-CG1 4.37Å; V951-I958 HydrophobicContact CG1-CG2 4.19Å; G953-I958 VanDerWaalsContact O-CD1 3.31Å; G953-I958 WeakPolarHBondContact O-CD1 3.39Å; Q954-I958 PolarHBondContact O-N 2.75Å; L955-I958 PolarHBondContact O-N 3.48Å; I958-A960 VanDerWaalsContact C-N 3.33Å; I958-A960 PolarHBondContact O-N 3.01Å; I958-A961 PolarHBondContact O-N 3.14Å; I958-E962 WeakPolarHBondContact O-CB 3.18Å; I958-E962 PolarHBondContact O-N 3.4Å
959	C	91	Very high	88.2	Confident	22 Å²	22	31.7 Å²	31.7	15%	0.149	17%	0.172	C	C	.	.	H	α-helix	trans	-64.1	-35.8	177.8	-66.8	0	0	0	0	112.8	L955 A963	L955-C959 PolarHBondContact O-N 3.24Å; L955-C959 PolarHBondContact O-SG 2.81Å; L955-C959 VanDerWaalsContact O-SG 3.33Å; C959-A963 WeakPolarHBondContact O-CB 3.15Å; C959-A963 PolarHBondContact O-N 2.83Å; C959-A963 VanDerWaalsContact O-N 3.07Å
960	A	90.1	Very high	87.8	Confident	37 Å²	37	32 Å²	32	31%	0.306	17%	0.172	S	C	.	.	H	α-helix	trans	-65.4	-47.1	173.1	0	0	0	0	0	111.8	T918 H956 S957 I958 A963 F964	T918-A960 HydrophobicContact CG2-CB 3.98Å; H956-A960 WeakPolarHBondContact O-CB 3.31Å; H956-A960 PolarHBondContact O-N 3.42Å; S957-A960 PolarHBondContact O-N 3.17Å; I958-A960 VanDerWaalsContact C-N 3.33Å; I958-A960 PolarHBondContact O-N 3.01Å; A960-A963 PolarHBondContact O-N 2.83Å; A960-F964 WeakPolarHBondContact O-CD2 3.35Å; A960-F964 PolarHBondContact O-N 2.92Å
961	A	91.6	Very high	87	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-66.1	-36.8	178.4	0	0	0	0	0	112.8	I914 T918 A920 V951 S957 I958 F964 L965	I914-A961 HydrophobicContact CG2-CB 4.04Å; T918-A961 HydrophobicContact CG2-CB 4.24Å; A920-A961 HydrophobicContact CB-CB 3.7Å; V951-A961 HydrophobicContact CG1-CB 3.95Å; S957-A961 WeakPolarHBondContact O-CB 3.26Å; S957-A961 PolarHBondContact O-N 3.37Å; I958-A961 PolarHBondContact O-N 3.14Å; A961-F964 PolarHBondContact O-N 2.71Å; A961-L965 WeakPolarHBondContact O-CB 3.5Å; A961-L965 WeakPolarHBondContact O-CG 3.5Å; A961-L965 PolarHBondContact O-N 3.13Å
962	E	90.4	Very high	86.1	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.8	-48.7	171.5	-174.3	-84.3	151.6	0	0	111.4	S866 L869 L890 L892 I958 F964 L965 S966	S866-E962 WeakPolarHBondContact CA-OE2 3.35Å; S866-E962 VanDerWaalsContact CB-OE2 3.22Å; S866-E962 WeakPolarHBondContact CB-OE2 3.17Å; S866-E962 PolarHBondContact OG-OE1 3.18Å; S866-E962 PolarHBondContact OG-OE2 3.31Å; L869-E962 HydrophobicContact CD1-CG 3.62Å; L869-E962 HydrophobicContact CD2-CB 4.17Å; L869-E962 HydrophobicContact CD2-CG 3.7Å; L869-E962 HydrophobicContact CG-CG 4.27Å; L890-E962 HydrophobicContact CD2-CB 3.89Å; L890-E962 HydrophobicContact CD2-CG 3.85Å; L892-E962 HydrophobicContact CD1-CG 4.27Å; L892-E962 HydrophobicContact CD2-CG 4.46Å; I958-E962 WeakPolarHBondContact O-CB 3.18Å; I958-E962 PolarHBondContact O-N 3.4Å; E962-F964 PolarHBondContact O-N 3.16Å; E962-L965 PolarHBondContact O-N 3.07Å; E962-L965 VanDerWaalsContact O-N 3.14Å; E962-S966 VanDerWaalsContact O-CB 3.29Å; E962-S966 WeakPolarHBondContact O-CB 3.37Å; E962-S966 PolarHBondContact O-N 3.42Å; E962-S966 PolarHBondContact O-OG 2.75Å; E962-S966 VanDerWaalsContact OE1-CB 3.23Å; E962-S966 WeakPolarHBondContact OE1-CB 3.4Å; E962-S966 PolarHBondContact OE1-OG 2.86Å
963	A	87.1	Confident	85.4	Confident	28 Å²	28	33.3 Å²	33.3	23%	0.231	18%	0.18	C	C	.	.	H	α-helix	trans	-60.5	-29.7	-179.9	0	0	0	0	0	113	R862 C959 A960	R862-A963 PolarHBondContact NH2-O 3.22Å; C959-A963 WeakPolarHBondContact O-CB 3.15Å; C959-A963 PolarHBondContact O-N 2.83Å; C959-A963 VanDerWaalsContact O-N 3.07Å; A960-A963 PolarHBondContact O-N 2.83Å
964	F	85.8	Confident	84.4	Confident	37 Å²	37	31.8 Å²	31.8	16%	0.162	17%	0.165	C	C	.	.	H	α-helix	trans	-76.3	-49.2	170.6	-78.1	-71	0	0	0	112.7	T918 A960 A961 E962 E967 Q968 W1030 V1034 L1038	T918-F964 HydrophobicContact CG2-CD2 3.84Å; T918-F964 HydrophobicContact CG2-CE2 3.94Å; A960-F964 WeakPolarHBondContact O-CD2 3.35Å; A960-F964 PolarHBondContact O-N 2.92Å; A961-F964 PolarHBondContact O-N 2.71Å; E962-F964 PolarHBondContact O-N 3.16Å; F964-E967 PolarHBondContact O-N 2.86Å; F964-Q968 WeakPolarHBondContact O-CG 3.27Å; F964-Q968 PolarHBondContact O-N 3.38Å; F964-W1030 HydrophobicContact CD1-CH2 4.16Å; F964-W1030 HydrophobicContact CD1-CZ2 4.01Å; F964-W1030 AromaticContact CE1-CH2 3.56Å; F964-W1030 HydrophobicContact CE1-CH2 3.56Å; F964-W1030 AromaticContact CE1-CZ2 3.71Å; F964-W1030 HydrophobicContact CE1-CZ2 3.71Å; F964-W1030 HydrophobicContact CE1-CZ3 4.09Å; F964-V1034 HydrophobicContact CE1-CG1 4.47Å; F964-V1034 HydrophobicContact CZ-CG1 3.83Å; F964-L1038 HydrophobicContact CE1-CD1 3.74Å; F964-L1038 HydrophobicContact CZ-CD1 3.69Å
965	L	88.5	Confident	83.3	Confident	2 Å²	2	27.2 Å²	27.2	1%	0.01	14%	0.144	C	C	.	.	H	α-helix	trans	-64.4	-48.9	-177.6	-73.6	172.8	0	0	0	111.6	L892 Y910 I914 I922 L949 V951 A961 E962 E967 Q968 I969	L892-L965 HydrophobicContact CD1-CB 4.12Å; L892-L965 HydrophobicContact CD1-CD1 4.2Å; Y910-L965 HydrophobicContact CE1-CD2 4.33Å; I914-L965 HydrophobicContact CD1-CD2 3.77Å; I914-L965 HydrophobicContact CD1-CG 4.37Å; I922-L965 HydrophobicContact CD1-CD1 3.94Å; I922-L965 HydrophobicContact CD1-CD2 4.35Å; I922-L965 HydrophobicContact CD1-CG 4.39Å; I922-L965 HydrophobicContact CG1-CD1 4.37Å; L949-L965 HydrophobicContact CD1-CD1 4.42Å; L949-L965 HydrophobicContact CD1-CD2 4.24Å; V951-L965 HydrophobicContact CG2-CD1 3.78Å; A961-L965 WeakPolarHBondContact O-CB 3.5Å; A961-L965 WeakPolarHBondContact O-CG 3.5Å; A961-L965 PolarHBondContact O-N 3.13Å; E962-L965 PolarHBondContact O-N 3.07Å; E962-L965 VanDerWaalsContact O-N 3.14Å; L965-E967 VanDerWaalsContact C-N 3.27Å; L965-E967 PolarHBondContact O-N 3.45Å; L965-Q968 PolarHBondContact O-N 2.88Å; L965-Q968 VanDerWaalsContact O-N 3.13Å; L965-I969 HydrophobicContact CB-CD1 4.33Å; L965-I969 WeakPolarHBondContact O-CB 3.39Å; L965-I969 WeakPolarHBondContact O-CD1 3.13Å; L965-I969 WeakPolarHBondContact O-CG1 3.5Å; L965-I969 PolarHBondContact O-N 3.32Å
966	S	84.1	Confident	82.1	Confident	5 Å²	5	28.1 Å²	28.1	4%	0.035	15%	0.153	C	C	.	.	H	α-helix	trans	-62.1	-31.4	-179.8	-72.5	0	0	0	0	113.1	E962 R970	E962-S966 VanDerWaalsContact O-CB 3.29Å; E962-S966 WeakPolarHBondContact O-CB 3.37Å; E962-S966 PolarHBondContact O-N 3.42Å; E962-S966 PolarHBondContact O-OG 2.75Å; E962-S966 VanDerWaalsContact OE1-CB 3.23Å; E962-S966 WeakPolarHBondContact OE1-CB 3.4Å; E962-S966 PolarHBondContact OE1-OG 2.86Å; S966-R970 WeakPolarHBondContact O-CB 3.39Å; S966-R970 WeakPolarHBondContact O-CG 3.21Å; S966-R970 PolarHBondContact O-N 3.45Å; S966-R970 VanDerWaalsContact O-N 3.09Å
967	E	79.3	Confident	80.5	Confident	21 Å²	21	22.3 Å²	22.3	10%	0.098	13%	0.13	C	C	.	.	H	α-helix	trans	-67.1	-49.8	171.1	169.1	164.1	-122	0	0	111.5	R862 F964 L965 I969 R970 W971 W1030	R862-E967 IonicContact CZ-OE1 2.63Å; R862-E967 IonicContact CZ-OE2 3.68Å; R862-E967 IonicContact NH1-OE1 3.2Å; R862-E967 PolarHBondContact NH1-OE1 2.79Å; R862-E967 IonicContact NH1-OE2 3.66Å; R862-E967 PolarHBondContact NH1-OE2 3.45Å; R862-E967 VanDerWaalsContact NH2-CD 3.27Å; R862-E967 IonicContact NH2-OE1 3.09Å; R862-E967 IonicContact NH2-OE2 3.43Å; R862-E967 PolarHBondContact NH2-OE2 3.03Å; F964-E967 PolarHBondContact O-N 2.86Å; L965-E967 VanDerWaalsContact C-N 3.27Å; L965-E967 PolarHBondContact O-N 3.45Å; E967-I969 PolarHBondContact O-N 2.77Å; E967-R970 PolarHBondContact O-N 2.66Å; E967-W971 PolarHBondContact O-N 2.76Å; E967-W1030 VanDerWaalsContact OE2-CZ2 3.29Å; E967-W1030 WeakPolarHBondContact OE2-CZ2 3.3Å; E967-W1030 PolarHBondContact OE2-NE1 3.16Å; E967-W1030 VanDerWaalsContact OE2-NE1 3.14Å
968	Q	79.5	Confident	78.6	Confident	43 Å²	43	22.5 Å²	22.5	20%	0.201	13%	0.129	C	C	.	.	H	α-helix	trans	-68.3	-35.8	-176.6	-64.9	-76.5	5.9	0	0	111.8	L902 Y910 F964 L965 A972	L902-Q968 HydrophobicContact CD2-CB 3.68Å; Y910-Q968 WeakPolarHBondContact OH-CG 3.37Å; F964-Q968 WeakPolarHBondContact O-CG 3.27Å; F964-Q968 PolarHBondContact O-N 3.38Å; L965-Q968 PolarHBondContact O-N 2.88Å; L965-Q968 VanDerWaalsContact O-N 3.13Å; Q968-A972 WeakPolarHBondContact O-CB 3.36Å; Q968-A972 PolarHBondContact O-N 2.96Å
969	I	83.8	Confident	76.1	Confident	25 Å²	25	25.8 Å²	25.8	13%	0.128	15%	0.15	C	C	.	.	H	α-helix	trans	-59.9	-53.4	169.7	-67.4	158.8	0	0	0	109.7	V894 I898 L902 L949 L965 E967 W971 A972 T973	V894-I969 HydrophobicContact CG1-CG1 4.29Å; V894-I969 HydrophobicContact CG1-CG2 4.48Å; V894-I969 HydrophobicContact CG2-CD1 3.56Å; V894-I969 HydrophobicContact CG2-CG1 4.06Å; I898-I969 HydrophobicContact CG2-CG2 4.49Å; L902-I969 HydrophobicContact CD1-CG1 3.93Å; L949-I969 HydrophobicContact CD1-CD1 4.34Å; L965-I969 HydrophobicContact CB-CD1 4.33Å; L965-I969 WeakPolarHBondContact O-CB 3.39Å; L965-I969 WeakPolarHBondContact O-CD1 3.13Å; L965-I969 WeakPolarHBondContact O-CG1 3.5Å; L965-I969 PolarHBondContact O-N 3.32Å; E967-I969 PolarHBondContact O-N 2.77Å; I969-W971 VanDerWaalsContact C-N 3.35Å; I969-W971 PolarHBondContact O-N 2.91Å; I969-A972 PolarHBondContact O-N 3.35Å; I969-T973 PolarHBondContact O-N 3.13Å; I969-T973 PolarHBondContact O-OG1 3.12Å
970	R	81.1	Confident	73.8	Confident	7 Å²	7	29 Å²	29	3%	0.026	17%	0.173	C	C	.	.	H	α-helix	trans	-60.3	-40.3	-179.4	-74.3	-180	-173.2	-142.9	4.6	112.7	L716 C719 T721 G860 C865 S966 E967 T973 I974	L716-R970 HydrophobicContact CD2-CB 3.96Å; L716-R970 PolarHBondContact O-NH1 2.88Å; C719-R970 HydrophobicContact CB-CB 4.43Å; C719-R970 HydrophobicContact CB-CG 3.81Å; C719-R970 PolarHBondContact O-NE 3.19Å; C719-R970 PolarHBondContact O-NH1 2.95Å; C719-R970 PolarHBondContact O-NH2 3.48Å; T721-R970 PolarHBondContact OG1-NH2 3.16Å; G860-R970 PolarHBondContact O-NH1 2.94Å; C865-R970 PolarHBondContact SG-NH2 2.78Å; S966-R970 WeakPolarHBondContact O-CB 3.39Å; S966-R970 WeakPolarHBondContact O-CG 3.21Å; S966-R970 PolarHBondContact O-N 3.45Å; S966-R970 VanDerWaalsContact O-N 3.09Å; E967-R970 PolarHBondContact O-N 2.66Å; R970-T973 PolarHBondContact O-N 3.12Å; R970-I974 WeakPolarHBondContact O-CG1 3.37Å; R970-I974 PolarHBondContact O-N 3.29Å
971	W	71.2	Confident	71.2	Confident	60 Å²	60	33.4 Å²	33.4	23%	0.227	19%	0.192	C	C	.	.	H	α-helix	trans	-63.2	-45.2	174.5	-80	115.9	0	0	0	112.3	L716 E967 I969 I974 E975 L1025	L716-W971 HydrophobicContact CD1-CH2 4.04Å; L716-W971 HydrophobicContact CD1-CZ2 3.9Å; L716-W971 HydrophobicContact CD2-CD2 4.25Å; E967-W971 PolarHBondContact O-N 2.76Å; I969-W971 VanDerWaalsContact C-N 3.35Å; I969-W971 PolarHBondContact O-N 2.91Å; W971-I974 PolarHBondContact O-N 3.43Å; W971-E975 WeakPolarHBondContact O-CB 3.38Å; W971-E975 PolarHBondContact O-N 3.13Å; W971-L1025 HydrophobicContact CH2-CD1 4.05Å; W971-L1025 HydrophobicContact CZ2-CD1 4.04Å
972	A	73	Confident	68.6	Low	7 Å²	7	38 Å²	38	6%	0.058	21%	0.212	C	C	.	.	H	α-helix	trans	-68.9	-33.7	177.7	0	0	0	0	0	112.8	I898 Q968 I969 I974 E975 S976	I898-A972 HydrophobicContact CG2-CB 3.73Å; Q968-A972 WeakPolarHBondContact O-CB 3.36Å; Q968-A972 PolarHBondContact O-N 2.96Å; I969-A972 PolarHBondContact O-N 3.35Å; A972-I974 VanDerWaalsContact C-N 3.33Å; A972-E975 PolarHBondContact O-N 2.77Å; A972-S976 PolarHBondContact O-N 3.27Å; A972-S976 PolarHBondContact O-OG 2.78Å; A972-S976 VanDerWaalsContact O-OG 3.11Å
973	T	75	Confident	66.3	Low	14 Å²	14	41.6 Å²	41.6	9%	0.086	23%	0.225	C	C	.	.	H	α-helix	trans	-60.6	-41.6	168.8	-49.9	0	0	0	0	111.5	I898 I969 R970 S976 S977 M1239	I898-T973 HydrophobicContact CD1-CG2 4.31Å; I898-T973 WeakPolarHBondContact CD1-OG1 3.36Å; I969-T973 PolarHBondContact O-N 3.13Å; I969-T973 PolarHBondContact O-OG1 3.12Å; R970-T973 PolarHBondContact O-N 3.12Å; T973-S976 PolarHBondContact O-OG 2.89Å; T973-S977 VanDerWaalsContact O-CB 3.22Å; T973-S977 WeakPolarHBondContact O-CB 3.39Å; T973-S977 PolarHBondContact O-N 3.02Å; T973-S977 VanDerWaalsContact O-N 3.07Å; T973-S977 PolarHBondContact O-OG 2.93Å; T973-M1239 HydrophobicContact CG2-CE 3.57Å; T973-M1239 HydrophobicContact CG2-SD 3.66Å
974	I	67.8	Low	63.7	Low	1 Å²	1	45 Å²	45	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-67.9	-47	176.8	-72.6	178.4	0	0	0	110.5	V715 L716 R970 W971 A972 S976 S977 I978	V715-I974 HydrophobicContact CB-CD1 4.25Å; V715-I974 HydrophobicContact CG1-CD1 3.64Å; V715-I974 HydrophobicContact CG1-CG1 3.86Å; L716-I974 HydrophobicContact CB-CD1 4.34Å; L716-I974 HydrophobicContact CD2-CD1 3.44Å; L716-I974 VanDerWaalsContact CD2-CD1 3.44Å; L716-I974 HydrophobicContact CG-CD1 3.55Å; R970-I974 WeakPolarHBondContact O-CG1 3.37Å; R970-I974 PolarHBondContact O-N 3.29Å; W971-I974 PolarHBondContact O-N 3.43Å; A972-I974 VanDerWaalsContact C-N 3.33Å; I974-S976 VanDerWaalsContact C-N 3.33Å; I974-S976 PolarHBondContact O-N 2.75Å; I974-S977 WeakPolarHBondContact CA-OG 3.19Å; I974-S977 PolarHBondContact O-N 3.1Å; I974-S977 PolarHBondContact O-OG 3.39Å; I974-I978 HydrophobicContact CG2-CD1 3.53Å; I974-I978 HydrophobicContact CG2-CG1 4.19Å; I974-I978 WeakPolarHBondContact O-CG1 3.43Å; I974-I978 PolarHBondContact O-N 3.22Å
975	E	65.4	Low	61.1	Low	49 Å²	49	48.8 Å²	48.8	23%	0.229	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-37.3	-179.3	-176.1	169	-136.1	0	0	112.8	Q901 W971 A972 W983 Y1013	Q901-E975 PolarHBondContact NE2-OE2 2.92Å; W971-E975 WeakPolarHBondContact O-CB 3.38Å; W971-E975 PolarHBondContact O-N 3.13Å; A972-E975 PolarHBondContact O-N 2.77Å; E975-W983 HydrophobicContact CB-CZ2 4.27Å; E975-W983 HydrophobicContact CG-CZ2 4.07Å; E975-Y1013 VanDerWaalsContact CD-OH 3.24Å; E975-Y1013 WeakPolarHBondContact OE1-CE1 3.44Å; E975-Y1013 VanDerWaalsContact OE1-CZ 3.24Å; E975-Y1013 PolarHBondContact OE1-OH 3.19Å
976	S	63.7	Low	58.9	Low	55 Å²	55	50.1 Å²	50.1	39%	0.385	27%	0.273	S	S	.	.	H	α-helix	trans	-75.4	-26.4	172.8	65.6	0	0	0	0	113.6	H897 A972 T973 I974	H897-S976 PolarHBondContact NE2-OG 3.34Å; A972-S976 PolarHBondContact O-N 3.27Å; A972-S976 PolarHBondContact O-OG 2.78Å; A972-S976 VanDerWaalsContact O-OG 3.11Å; T973-S976 PolarHBondContact O-OG 2.89Å; I974-S976 VanDerWaalsContact C-N 3.33Å; I974-S976 PolarHBondContact O-N 2.75Å
977	S	59.6	Low	56.3	Low	34 Å²	34	56.6 Å²	56.6	24%	0.238	31%	0.307	C	S	.	.	H	α-helix	trans	-82.6	-23.1	178.4	76.2	0	0	0	0	115.1	T973 I974	T973-S977 VanDerWaalsContact O-CB 3.22Å; T973-S977 WeakPolarHBondContact O-CB 3.39Å; T973-S977 PolarHBondContact O-N 3.02Å; T973-S977 VanDerWaalsContact O-N 3.07Å; T973-S977 PolarHBondContact O-OG 2.93Å; I974-S977 WeakPolarHBondContact CA-OG 3.19Å; I974-S977 PolarHBondContact O-N 3.1Å; I974-S977 PolarHBondContact O-OG 3.39Å
978	I	50.1	Low	54.3	Low	24 Å²	24	61.5 Å²	61.5	12%	0.123	33%	0.33	C	S	.	.	S	Bend	trans	-94.2	115.9	179.8	-66.5	179.3	0	0	0	109	F712 I974 S980 F982	F712-I978 HydrophobicContact CE1-CD1 4.35Å; I974-I978 HydrophobicContact CG2-CD1 3.53Å; I974-I978 HydrophobicContact CG2-CG1 4.19Å; I974-I978 WeakPolarHBondContact O-CG1 3.43Å; I974-I978 PolarHBondContact O-N 3.22Å; I978-S980 PolarHBondContact O-N 3.5Å; I978-F982 HydrophobicContact CG2-CB 3.79Å
979	P	39.5	Very low	51.8	Low	70 Å²	70	62.4 Å²	62.4	46%	0.455	34%	0.336	S	S	.	.			trans	-58.4	138.6	175.2	-21.3	31.8	0	0	0	110.9	N981 F982	P979-N981 PolarHBondContact O-N 2.78Å; P979-F982 HydrophobicContact CB-CD2 4.17Å; P979-F982 HydrophobicContact CG-CD2 4.16Å; P979-F982 HydrophobicContact CG-CE2 4.45Å; P979-F982 PolarHBondContact O-N 2.87Å
980	S	42.8	Very low	49.2	Very low	91 Å²	91	65.4 Å²	65.4	64%	0.636	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-44	-36.6	179.2	51	0	0	0	0	113.7	I978 F982 W983	I978-S980 PolarHBondContact O-N 3.5Å; S980-F982 PolarHBondContact O-N 3.01Å; S980-F982 VanDerWaalsContact O-N 3.11Å; S980-W983 PolarHBondContact O-N 2.68Å
981	N	36.6	Very low	46.6	Very low	129 Å²	129	71.2 Å²	71.2	69%	0.69	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-53	-23.9	174.9	-54.8	-21.4	0	0	0	115.7	P979	P979-N981 PolarHBondContact O-N 2.78Å
982	F	36	Very low	44.5	Very low	97 Å²	97	73.4 Å²	73.4	43%	0.425	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-95.8	-20.4	-175.9	-80.8	-87.3	0	0	0	114.4	I978 P979 S980 P984 L985	I978-F982 HydrophobicContact CG2-CB 3.79Å; P979-F982 HydrophobicContact CB-CD2 4.17Å; P979-F982 HydrophobicContact CG-CD2 4.16Å; P979-F982 HydrophobicContact CG-CE2 4.45Å; P979-F982 PolarHBondContact O-N 2.87Å; S980-F982 PolarHBondContact O-N 3.01Å; S980-F982 VanDerWaalsContact O-N 3.11Å; F982-P984 VanDerWaalsContact C-CD 3.48Å; F982-P984 VanDerWaalsContact C-N 3.32Å; F982-L985 HydrophobicContact CD1-CD1 3.69Å; F982-L985 HydrophobicContact CE1-CD1 4.08Å; F982-L985 WeakPolarHBondContact O-CB 3.25Å; F982-L985 PolarHBondContact O-N 3.29Å
983	W	41.9	Very low	42.3	Very low	74 Å²	74	78.4 Å²	78.4	28%	0.28	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-55.8	-38.4	177.2	-76.9	91.9	0	0	0	113.7	E975 S980 L985 L986 L989	E975-W983 HydrophobicContact CB-CZ2 4.27Å; E975-W983 HydrophobicContact CG-CZ2 4.07Å; S980-W983 PolarHBondContact O-N 2.68Å; W983-L985 PolarHBondContact O-N 2.91Å; W983-L986 HydrophobicContact CD2-CD1 4.42Å; W983-L986 HydrophobicContact CE3-CD1 3.95Å; W983-L986 HydrophobicContact CZ3-CD1 4.37Å; W983-L986 WeakPolarHBondContact O-CB 3.43Å; W983-L986 PolarHBondContact O-N 3.2Å; W983-L989 HydrophobicContact CE3-CD1 3.62Å; W983-L989 HydrophobicContact CZ3-CD1 3.64Å
984	P	32.9	Very low	40.1	Very low	99 Å²	99	84.1 Å²	84.1	64%	0.643	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-68.9	-8.8	175.1	-21.7	34.8	0	0	0	115.8	F982 L986	F982-P984 VanDerWaalsContact C-CD 3.48Å; F982-P984 VanDerWaalsContact C-N 3.32Å; P984-L986 VanDerWaalsContact C-N 3.31Å
985	L	31.8	Very low	38.2	Very low	118 Å²	118	90.6 Å²	90.6	62%	0.618	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-85.6	-7.8	174.5	-67.9	166.2	0	0	0	112.2	F982 W983 N987	F982-L985 HydrophobicContact CD1-CD1 3.69Å; F982-L985 HydrophobicContact CE1-CD1 4.08Å; F982-L985 WeakPolarHBondContact O-CB 3.25Å; F982-L985 PolarHBondContact O-N 3.29Å; W983-L985 PolarHBondContact O-N 2.91Å; L985-N987 PolarHBondContact O-N 2.88Å
986	L	41.2	Very low	36.3	Very low	29 Å²	29	93.1 Å²	93.1	15%	0.152	52%	0.52	C	S	.	.			trans	-91.1	70	-178.7	-52.8	179	0	0	0	110.4	F712 W983 P984 H988 L989	F712-L986 HydrophobicContact CE1-CD1 4.36Å; F712-L986 HydrophobicContact CE2-CD1 4.37Å; F712-L986 HydrophobicContact CE2-CD2 3.83Å; F712-L986 HydrophobicContact CZ-CD1 3.58Å; F712-L986 HydrophobicContact CZ-CD2 3.64Å; F712-L986 HydrophobicContact CZ-CG 4.22Å; W983-L986 HydrophobicContact CD2-CD1 4.42Å; W983-L986 HydrophobicContact CE3-CD1 3.95Å; W983-L986 HydrophobicContact CZ3-CD1 4.37Å; W983-L986 WeakPolarHBondContact O-CB 3.43Å; W983-L986 PolarHBondContact O-N 3.2Å; P984-L986 VanDerWaalsContact C-N 3.31Å; L986-H988 PolarHBondContact O-N 3.47Å; L986-L989 HydrophobicContact CB-CD1 4.04Å; L986-L989 HydrophobicContact CD1-CD1 4.17Å; L986-L989 PolarHBondContact O-N 2.82Å
987	N	29.9	Very low	34.7	Very low	141 Å²	141	97 Å²	97	75%	0.754	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	40.8	-173.8	-71.8	-33.4	0	0	0	115.3	L985	L985-N987 PolarHBondContact O-N 2.88Å
988	H	37.1	Very low	33.2	Very low	125 Å²	125	101.9 Å²	101.9	58%	0.579	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.3	-1.6	173.2	-0.5	-67.2	0	0	0	112.3	L986	L986-H988 PolarHBondContact O-N 3.47Å
989	L	27.2	Very low	32.3	Very low	61 Å²	61	108.7 Å²	108.7	32%	0.319	60%	0.597	S	S	.	*	S	Bend	trans	-86.5	141.7	170	-65.9	170.6	0	0	0	109.8	W983 L986 L1021	W983-L989 HydrophobicContact CE3-CD1 3.62Å; W983-L989 HydrophobicContact CZ3-CD1 3.64Å; L986-L989 HydrophobicContact CB-CD1 4.04Å; L986-L989 HydrophobicContact CD1-CD1 4.17Å; L986-L989 PolarHBondContact O-N 2.82Å; L989-L1021 HydrophobicContact CD2-CD1 3.62Å; L989-L1021 HydrophobicContact CD2-CD2 3.87Å; L989-L1021 HydrophobicContact CD2-CG 4.4Å
990	P	29.7	Very low	31.7	Very low	89 Å²	89	112.6 Å²	112.6	58%	0.578	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-65.2	134.2	177.6	27.1	-33.6	0	0	0	110.3	L992	P990-L992 PolarHBondContact O-N 3.21Å
991	P	27.3	Very low	31.1	Very low	128 Å²	128	115.8 Å²	115.8	83%	0.831	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-66.6	127.8	-178.5	26.9	-34.1	0	0	0	110.8
992	L	26.3	Very low	30.5	Very low	106 Å²	106	120.8 Å²	120.8	56%	0.555	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-72	139.1	176.3	-58	-174.5	0	0	0	110.7	P990 M994 S1017	P990-L992 PolarHBondContact O-N 3.21Å; L992-M994 PolarHBondContact O-N 3.07Å; L992-S1017 VanDerWaalsContact CD2-CB 3.41Å; L992-S1017 WeakPolarHBondContact CD2-OG 3.49Å
993	P	27.4	Very low	29.9	Very low	113 Å²	113	121.5 Å²	121.5	73%	0.734	65%	0.65	S	S	*	*			trans	-73.4	99.9	176.8	29.6	-33.5	0	0	0	110.7	N995	P993-N995 PolarHBondContact O-N 3.24Å
994	M	27.8	Very low	29.1	Very low	134 Å²	134	124 Å²	124	66%	0.66	68%	0.679	S	S	*	*			trans	-63.1	99	163.5	-89.6	-74	-176.9	0	0	109.4	L992 N996 V1623	L992-M994 PolarHBondContact O-N 3.07Å; M994-N996 PolarHBondContact O-N 3.47Å; M994-V1623 HydrophobicContact CG-CG1 4.34Å; M994-V1623 HydrophobicContact SD-CG1 4.11Å
995	N	27.6	Very low	28.7	Very low	136 Å²	136	128.9 Å²	128.9	73%	0.727	69%	0.69	S	S	*	*			trans	-74	118.2	175.8	-172.1	25.1	0	0	0	110.3	P993 N997	P993-N995 PolarHBondContact O-N 3.24Å; N995-N997 PolarHBondContact O-N 3.22Å
996	N	26	Very low	28.5	Very low	102 Å²	102	129 Å²	129	55%	0.545	70%	0.701	S	S	.	*			trans	-103.7	64.8	-162	-164.6	47.2	0	0	0	112.3	M994 N998	M994-N996 PolarHBondContact O-N 3.47Å; N996-N998 PolarHBondContact O-N 3.41Å
997	N	30.6	Very low	27.7	Very low	138 Å²	138	132.5 Å²	132.5	74%	0.738	73%	0.727	S	S	*	*			trans	-88.8	91.6	179.2	-84.8	9.1	0	0	0	111.8	N995 N999	N995-N997 PolarHBondContact O-N 3.22Å; N997-N999 PolarHBondContact O-N 2.95Å
998	N	27.3	Very low	27.5	Very low	135 Å²	135	133 Å²	133	72%	0.722	73%	0.73	S	S	*	*			trans	-69.3	123.8	159.2	-76.1	-20.3	0	0	0	109.6	N996	N996-N998 PolarHBondContact O-N 3.41Å
999	N	32.5	Very low	27	Very low	167 Å²	167	135 Å²	135	89%	0.893	75%	0.745	S	S	*	*			trans	-159.7	129.6	147.5	-103.1	-18.6	0	0	0	108.9	N997	N997-N999 PolarHBondContact O-N 2.95Å
1000	N	27	Very low	26.8	Very low	152 Å²	152	137.3 Å²	137.3	81%	0.813	77%	0.766	S	S	*	*			trans	-91.2	134.3	-176.3	-62.6	-43.3	0	0	0	110.5
1001	N	28.6	Very low	26.6	Very low	158 Å²	158	142 Å²	142	85%	0.845	78%	0.777	S	S	*	*				-167.8	126.1	118.5	-100.3	-25.1	0	0	0	115.3
1002	R	25.3	Very low	26.6	Very low	234 Å²	234	141.7 Å²	141.7	88%	0.883	78%	0.778	S	S	*	*			trans	25.9	137.4	152.3	-103.4	173.1	169.2	168.3	-6.9	123.1
1003	S	22.8	Very low	26.9	Very low	113 Å²	113	141.8 Å²	141.8	79%	0.79	77%	0.772	S	S	*	*			trans	85.3	117.8	148.7	78.7	0	0	0	0	119
1004	S	25.2	Very low	27.2	Very low	125 Å²	125	139.9 Å²	139.9	87%	0.874	76%	0.756	S	S	*	*			trans	-162.5	134.3	157.2	-75.9	0	0	0	0	108.5
1005	K	24.6	Very low	27.7	Very low	203 Å²	203	137.5 Å²	137.5	88%	0.883	75%	0.75	S	S	*	*			trans	-75	167.7	162.8	-70.6	-179.8	178	179.3	0	109.1	S1007	K1005-S1007 PolarHBondContact O-N 3.11Å
1006	S	27.8	Very low	28.1	Very low	120 Å²	120	135.6 Å²	135.6	84%	0.839	74%	0.737	S	S	*	*	S	Bend	trans	-55.9	126.3	-170.9	52.5	0	0	0	0	115.8
1007	S	23.7	Very low	28.9	Very low	102 Å²	102	131.9 Å²	131.9	71%	0.713	72%	0.719	S	S	*	*			trans	-171.2	156.7	139.9	50.8	0	0	0	0	112.2	K1005	K1005-S1007 PolarHBondContact O-N 3.11Å
1008	N	25.5	Very low	29.3	Very low	153 Å²	153	127.3 Å²	127.3	82%	0.818	70%	0.696	S	S	*	*			trans	42.8	93.8	156.6	-58.2	-28.9	0	0	0	119.3
1009	L	26	Very low	29.9	Very low	167 Å²	167	122.2 Å²	122.2	87%	0.874	67%	0.671	S	S	*	*			trans	-95.1	95.1	164.5	-97.9	162.8	0	0	0	111.4
1010	S	23.9	Very low	30.3	Very low	109 Å²	109	117.7 Å²	117.7	76%	0.762	65%	0.652	S	S	*	*			trans	-85.4	122.9	170.6	48.8	0	0	0	0	111.2	S1012	S1010-S1012 PolarHBondContact O-N 3.17Å
1011	F	25.7	Very low	31.2	Very low	187 Å²	187	112.9 Å²	112.9	82%	0.82	63%	0.626	S	S	*	*			trans	-78.4	109.2	171.2	-85.7	-91	0	0	0	110.3
1012	S	27.5	Very low	32	Very low	122 Å²	122	108 Å²	108	85%	0.853	60%	0.599	S	S	*	*			trans	-82.4	114.9	173.1	-168.7	0	0	0	0	110.7	S1010	S1010-S1012 PolarHBondContact O-N 3.17Å
1013	Y	32.2	Very low	32.9	Very low	108 Å²	108	100 Å²	100	42%	0.424	57%	0.572	S	S	.	*			trans	-78.1	153.5	165.8	-76.7	-112.4	0	0	0	109.9	E975 P1015 V1018	E975-Y1013 VanDerWaalsContact CD-OH 3.24Å; E975-Y1013 WeakPolarHBondContact OE1-CE1 3.44Å; E975-Y1013 VanDerWaalsContact OE1-CZ 3.24Å; E975-Y1013 PolarHBondContact OE1-OH 3.19Å; Y1013-P1015 WeakPolarHBondContact O-CD 3.37Å; Y1013-V1018 HydrophobicContact CD1-CG2 3.81Å
1014	D	32.8	Very low	33.9	Very low	73 Å²	73	97.5 Å²	97.5	39%	0.39	56%	0.555	S	S	.	*			trans	-77.5	107.3	161.2	168.9	22.4	0	0	0	109.2	Q1016 S1017 V1018	D1014-Q1016 PolarHBondContact O-N 2.79Å; D1014-Q1016 VanDerWaalsContact OD1-CB 3.25Å; D1014-Q1016 WeakPolarHBondContact OD1-CB 3.41Å; D1014-Q1016 PolarHBondContact OD1-N 2.73Å; D1014-S1017 PolarHBondContact O-N 3.01Å; D1014-S1017 PolarHBondContact O-OG 3.4Å; D1014-S1017 WeakPolarHBondContact OD2-CB 3.18Å; D1014-S1017 PolarHBondContact OD2-N 3.21Å; D1014-V1018 PolarHBondContact O-N 2.86Å
1015	P	39.5	Very low	34.8	Very low	84 Å²	84	93 Å²	93	55%	0.545	52%	0.522	S	S	.	.	H	α-helix	trans	-66.8	-21	-177	30.9	-36.9	0	0	0	112.4	Y1013 C1019	Y1013-P1015 WeakPolarHBondContact O-CD 3.37Å; P1015-C1019 WeakPolarHBondContact O-CB 3.48Å; P1015-C1019 PolarHBondContact O-N 3.36Å; P1015-C1019 PolarHBondContact O-SG 3.46Å
1016	Q	35.2	Very low	35.4	Very low	95 Å²	95	83.5 Å²	83.5	44%	0.444	48%	0.481	S	S	.	.	H	α-helix	trans	-70.9	-44.3	179	-157.1	69	19.9	0	0	110.3	D1014 S1020 F1044	D1014-Q1016 PolarHBondContact O-N 2.79Å; D1014-Q1016 VanDerWaalsContact OD1-CB 3.25Å; D1014-Q1016 WeakPolarHBondContact OD1-CB 3.41Å; D1014-Q1016 PolarHBondContact OD1-N 2.73Å; Q1016-S1020 WeakPolarHBondContact O-CB 3.44Å; Q1016-S1020 PolarHBondContact O-N 2.92Å; Q1016-F1044 PolarHBondContact NE2-O 3.4Å
1017	S	43	Very low	36	Very low	24 Å²	24	81 Å²	81	17%	0.168	46%	0.463	C	S	.	.	H	α-helix	trans	-62.9	-46.1	174	72.9	0	0	0	0	112.8	L992 D1014 S1020 L1021	L992-S1017 VanDerWaalsContact CD2-CB 3.41Å; L992-S1017 WeakPolarHBondContact CD2-OG 3.49Å; D1014-S1017 PolarHBondContact O-N 3.01Å; D1014-S1017 PolarHBondContact O-OG 3.4Å; D1014-S1017 WeakPolarHBondContact OD2-CB 3.18Å; D1014-S1017 PolarHBondContact OD2-N 3.21Å; S1017-S1020 PolarHBondContact O-N 2.84Å; S1017-L1021 WeakPolarHBondContact O-CB 3.27Å; S1017-L1021 PolarHBondContact O-N 3.42Å
1018	V	40.3	Very low	36.9	Very low	43 Å²	43	81.8 Å²	81.8	26%	0.261	46%	0.458	S	S	.	.	H	α-helix	trans	-68.7	-41.5	-179	179.6	0	0	0	0	111.1	Y1013 D1014 L1021 I1022	Y1013-V1018 HydrophobicContact CD1-CG2 3.81Å; D1014-V1018 PolarHBondContact O-N 2.86Å; V1018-L1021 PolarHBondContact O-N 2.9Å; V1018-I1022 HydrophobicContact CG1-CD1 3.84Å; V1018-I1022 HydrophobicContact CG1-CG1 4.47Å; V1018-I1022 WeakPolarHBondContact O-CB 3.08Å; V1018-I1022 VanDerWaalsContact O-CG1 3.27Å; V1018-I1022 WeakPolarHBondContact O-CG1 3.28Å; V1018-I1022 PolarHBondContact O-N 2.88Å
1019	C	39.7	Very low	37.5	Very low	28 Å²	28	78.8 Å²	78.8	19%	0.189	44%	0.438	C	S	.	.	H	α-helix	trans	-68	-36.3	174.3	-67.3	0	0	0	0	112.1	P1015 I1022 M1023	P1015-C1019 WeakPolarHBondContact O-CB 3.48Å; P1015-C1019 PolarHBondContact O-N 3.36Å; P1015-C1019 PolarHBondContact O-SG 3.46Å; C1019-I1022 PolarHBondContact O-N 2.9Å; C1019-M1023 WeakPolarHBondContact O-CB 3.49Å; C1019-M1023 WeakPolarHBondContact O-CG 3.23Å; C1019-M1023 PolarHBondContact O-N 3.32Å
1020	S	40.8	Very low	38.1	Very low	72 Å²	72	72.4 Å²	72.4	50%	0.503	40%	0.403	S	S	.	.	H	α-helix	trans	-63	-42.1	173.1	-172.5	0	0	0	0	111.7	Q1016 S1017 M1023 S1024	Q1016-S1020 WeakPolarHBondContact O-CB 3.44Å; Q1016-S1020 PolarHBondContact O-N 2.92Å; S1017-S1020 PolarHBondContact O-N 2.84Å; S1020-M1023 PolarHBondContact O-N 2.84Å; S1020-S1024 VanDerWaalsContact O-CB 3.23Å; S1020-S1024 WeakPolarHBondContact O-CB 3.11Å; S1020-S1024 PolarHBondContact O-N 3.28Å; S1020-S1024 PolarHBondContact O-OG 2.76Å
1021	L	44.9	Very low	38.8	Very low	50 Å²	50	71.2 Å²	71.2	26%	0.262	39%	0.392	S	S	.	.	H	α-helix	trans	-63.9	-48.6	174.5	179.8	62.5	0	0	0	111.8	L989 S1017 V1018 M1023 S1024 L1025	L989-L1021 HydrophobicContact CD2-CD1 3.62Å; L989-L1021 HydrophobicContact CD2-CD2 3.87Å; L989-L1021 HydrophobicContact CD2-CG 4.4Å; S1017-L1021 WeakPolarHBondContact O-CB 3.27Å; S1017-L1021 PolarHBondContact O-N 3.42Å; V1018-L1021 PolarHBondContact O-N 2.9Å; L1021-M1023 VanDerWaalsContact C-N 3.31Å; L1021-M1023 PolarHBondContact O-N 3.16Å; L1021-S1024 PolarHBondContact O-N 2.87Å; L1021-L1025 HydrophobicContact CD1-CD1 3.93Å; L1021-L1025 HydrophobicContact CD1-CG 4.11Å; L1021-L1025 HydrophobicContact CG-CD1 3.95Å; L1021-L1025 HydrophobicContact CG-CG 4.5Å; L1021-L1025 WeakPolarHBondContact O-CB 3.33Å; L1021-L1025 WeakPolarHBondContact O-CG 3.45Å; L1021-L1025 PolarHBondContact O-N 2.71Å
1022	I	44.8	Very low	39.5	Very low	56 Å²	56	69.6 Å²	69.6	29%	0.287	39%	0.387	S	S	.	.	H	α-helix	trans	-58.7	-41.8	176.7	-72.4	166.9	0	0	0	111.2	V1018 C1019 G1026	V1018-I1022 HydrophobicContact CG1-CD1 3.84Å; V1018-I1022 HydrophobicContact CG1-CG1 4.47Å; V1018-I1022 WeakPolarHBondContact O-CB 3.08Å; V1018-I1022 VanDerWaalsContact O-CG1 3.27Å; V1018-I1022 WeakPolarHBondContact O-CG1 3.28Å; V1018-I1022 PolarHBondContact O-N 2.88Å; C1019-I1022 PolarHBondContact O-N 2.9Å; I1022-G1026 PolarHBondContact O-N 2.85Å
1023	M	44.3	Very low	40.3	Very low	65 Å²	65	67.7 Å²	67.7	32%	0.32	37%	0.374	S	S	.	.	H	α-helix	trans	-72.9	-33.9	178.6	-67.5	-75.1	-78	0	0	112.4	C1019 S1020 L1021 S1027 L1038 T1042	C1019-M1023 WeakPolarHBondContact O-CB 3.49Å; C1019-M1023 WeakPolarHBondContact O-CG 3.23Å; C1019-M1023 PolarHBondContact O-N 3.32Å; S1020-M1023 PolarHBondContact O-N 2.84Å; L1021-M1023 VanDerWaalsContact C-N 3.31Å; L1021-M1023 PolarHBondContact O-N 3.16Å; M1023-S1027 PolarHBondContact O-N 3.25Å; M1023-L1038 HydrophobicContact CE-CB 4.15Å; M1023-L1038 HydrophobicContact SD-CB 4.31Å; M1023-L1038 HydrophobicContact SD-CD2 4Å; M1023-T1042 HydrophobicContact CE-CG2 3.61Å
1024	S	45.1	Very low	40.7	Very low	62 Å²	62	64.7 Å²	64.7	43%	0.434	37%	0.366	S	S	.	.	H	α-helix	trans	-73.9	-30.7	175.9	-58.6	0	0	0	0	113	S1020 L1021 S1027	S1020-S1024 VanDerWaalsContact O-CB 3.23Å; S1020-S1024 WeakPolarHBondContact O-CB 3.11Å; S1020-S1024 PolarHBondContact O-N 3.28Å; S1020-S1024 PolarHBondContact O-OG 2.76Å; L1021-S1024 PolarHBondContact O-N 2.87Å; S1024-S1027 PolarHBondContact O-OG 3.04Å
1025	L	42.5	Very low	41.4	Very low	31 Å²	31	62.4 Å²	62.4	16%	0.162	36%	0.356	C	S	.	.	H	α-helix	trans	-76.5	-42.9	169.8	-69.3	171.5	0	0	0	110.6	L709 W971 L1021 S1027 I1028 F1029	L709-L1025 HydrophobicContact CD2-CD2 4.33Å; W971-L1025 HydrophobicContact CH2-CD1 4.05Å; W971-L1025 HydrophobicContact CZ2-CD1 4.04Å; L1021-L1025 HydrophobicContact CD1-CD1 3.93Å; L1021-L1025 HydrophobicContact CD1-CG 4.11Å; L1021-L1025 HydrophobicContact CG-CD1 3.95Å; L1021-L1025 HydrophobicContact CG-CG 4.5Å; L1021-L1025 WeakPolarHBondContact O-CB 3.33Å; L1021-L1025 WeakPolarHBondContact O-CG 3.45Å; L1021-L1025 PolarHBondContact O-N 2.71Å; L1025-S1027 VanDerWaalsContact C-N 3.26Å; L1025-S1027 PolarHBondContact O-N 3.35Å; L1025-I1028 WeakPolarHBondContact O-CB 3.41Å; L1025-I1028 PolarHBondContact O-N 2.92Å; L1025-F1029 WeakPolarHBondContact O-CD2 3.49Å; L1025-F1029 PolarHBondContact O-N 3.15Å
1026	G	38.2	Very low	41.7	Very low	3 Å²	3	60.6 Å²	60.6	3%	0.031	35%	0.348	C	S	.	.	H	α-helix	trans	-57	-36.9	176.6	0	0	0	0	0	113.1	I1022 I1028 F1029 W1030	I1022-G1026 PolarHBondContact O-N 2.85Å; G1026-I1028 PolarHBondContact O-N 3.25Å; G1026-F1029 PolarHBondContact O-N 2.73Å; G1026-F1029 VanDerWaalsContact O-N 3.16Å; G1026-W1030 WeakPolarHBondContact O-CB 3.22Å; G1026-W1030 PolarHBondContact O-N 2.83Å
1027	S	39.7	Very low	42.1	Very low	67 Å²	67	63.2 Å²	63.2	47%	0.469	36%	0.358	S	S	.	.	H	α-helix	trans	-67.7	-13	175.7	69.1	0	0	0	0	115.1	M1023 S1024 L1025	M1023-S1027 PolarHBondContact O-N 3.25Å; S1024-S1027 PolarHBondContact O-OG 3.04Å; L1025-S1027 VanDerWaalsContact C-N 3.26Å; L1025-S1027 PolarHBondContact O-N 3.35Å
1028	I	43.4	Very low	42	Very low	118 Å²	118	64.4 Å²	64.4	61%	0.605	36%	0.362	S	S	*	.	H	α-helix	trans	-90.6	-25	174.5	-60.2	168.6	0	0	0	111.2	L1025 G1026	L1025-I1028 WeakPolarHBondContact O-CB 3.41Å; L1025-I1028 PolarHBondContact O-N 2.92Å; G1026-I1028 PolarHBondContact O-N 3.25Å
1029	F	37.4	Very low	42.2	Very low	91 Å²	91	64.1 Å²	64.1	40%	0.399	37%	0.368	S	S	.	.	H	α-helix	trans	-119.2	-10.3	-168.8	-68.8	-73.7	0	0	0	115.8	L1025 G1026	L1025-F1029 WeakPolarHBondContact O-CD2 3.49Å; L1025-F1029 PolarHBondContact O-N 3.15Å; G1026-F1029 PolarHBondContact O-N 2.73Å; G1026-F1029 VanDerWaalsContact O-N 3.16Å
1030	W	38.5	Very low	42.4	Very low	33 Å²	33	71.2 Å²	71.2	13%	0.125	40%	0.396	C	S	.	.	S	Bend	trans	-108.1	153.8	177.5	-63	-11.3	0	0	0	113.1	F964 E967 G1026 V1034 L1038	F964-W1030 HydrophobicContact CD1-CH2 4.16Å; F964-W1030 HydrophobicContact CD1-CZ2 4.01Å; F964-W1030 AromaticContact CE1-CH2 3.56Å; F964-W1030 HydrophobicContact CE1-CH2 3.56Å; F964-W1030 AromaticContact CE1-CZ2 3.71Å; F964-W1030 HydrophobicContact CE1-CZ2 3.71Å; F964-W1030 HydrophobicContact CE1-CZ3 4.09Å; E967-W1030 VanDerWaalsContact OE2-CZ2 3.29Å; E967-W1030 WeakPolarHBondContact OE2-CZ2 3.3Å; E967-W1030 PolarHBondContact OE2-NE1 3.16Å; E967-W1030 VanDerWaalsContact OE2-NE1 3.14Å; G1026-W1030 WeakPolarHBondContact O-CB 3.22Å; G1026-W1030 PolarHBondContact O-N 2.83Å; W1030-V1034 HydrophobicContact CB-CB 4.25Å; W1030-V1034 HydrophobicContact CD2-CG1 4.06Å; W1030-V1034 HydrophobicContact CE3-CB 4.38Å; W1030-V1034 HydrophobicContact CE3-CG1 3.74Å; W1030-V1034 HydrophobicContact CG-CG1 4.42Å; W1030-V1034 HydrophobicContact CZ3-CG1 4.36Å; W1030-L1038 HydrophobicContact CH2-CD1 4.32Å; W1030-L1038 HydrophobicContact CH2-CD2 3.84Å; W1030-L1038 HydrophobicContact CZ3-CB 4.45Å; W1030-L1038 HydrophobicContact CZ3-CD1 3.85Å; W1030-L1038 HydrophobicContact CZ3-CD2 3.78Å; W1030-L1038 HydrophobicContact CZ3-CG 4.22Å
1031	P	39.5	Very low	42.1	Very low	83 Å²	83	72.3 Å²	72.3	54%	0.539	40%	0.396	S	S	.	.			trans	-59.3	143.7	167.1	-21.6	33.2	0	0	0	111.8	S1033 V1034 C1035	P1031-S1033 PolarHBondContact O-N 2.84Å; P1031-V1034 HydrophobicContact CB-CG2 4.43Å; P1031-V1034 HydrophobicContact CG-CG2 4.43Å; P1031-V1034 PolarHBondContact O-N 2.69Å; P1031-C1035 PolarHBondContact O-N 3.3Å
1032	Q	40.7	Very low	41.5	Very low	154 Å²	154	73.1 Å²	73.1	72%	0.72	40%	0.403	S	S	*	.	H	α-helix	trans	-52.8	-29.6	-178.3	-158	73.3	-8.6	0	0	113.5	A1036	Q1032-A1036 WeakPolarHBondContact O-CB 3.06Å; Q1032-A1036 PolarHBondContact O-N 2.79Å
1033	S	44.3	Very low	40.7	Very low	82 Å²	82	78.3 Å²	78.3	57%	0.573	43%	0.432	S	S	*	.	H	α-helix	trans	-67.9	-30.1	176	52.4	0	0	0	0	114.1	P1031 K1037	P1031-S1033 PolarHBondContact O-N 2.84Å; S1033-K1037 PolarHBondContact O-N 3.1Å
1034	V	39.5	Very low	39.9	Very low	44 Å²	44	81.1 Å²	81.1	27%	0.267	44%	0.442	S	S	.	.	H	α-helix	trans	-80.9	-46.6	177.1	-174.8	0	0	0	0	109.8	F964 W1030 P1031 A1036 K1037 L1038	F964-V1034 HydrophobicContact CE1-CG1 4.47Å; F964-V1034 HydrophobicContact CZ-CG1 3.83Å; W1030-V1034 HydrophobicContact CB-CB 4.25Å; W1030-V1034 HydrophobicContact CD2-CG1 4.06Å; W1030-V1034 HydrophobicContact CE3-CB 4.38Å; W1030-V1034 HydrophobicContact CE3-CG1 3.74Å; W1030-V1034 HydrophobicContact CG-CG1 4.42Å; W1030-V1034 HydrophobicContact CZ3-CG1 4.36Å; P1031-V1034 HydrophobicContact CB-CG2 4.43Å; P1031-V1034 HydrophobicContact CG-CG2 4.43Å; P1031-V1034 PolarHBondContact O-N 2.69Å; V1034-A1036 VanDerWaalsContact C-N 3.29Å; V1034-A1036 PolarHBondContact O-N 3.02Å; V1034-K1037 PolarHBondContact O-N 3.22Å; V1034-L1038 HydrophobicContact CG1-CD1 4.48Å; V1034-L1038 PolarHBondContact O-N 3.25Å
1035	C	47.8	Very low	39	Very low	25 Å²	25	85.1 Å²	85.1	17%	0.169	45%	0.454	C	S	.	.	H	α-helix	trans	-58.4	-40.2	171.5	-69.8	0	0	0	0	112.1	P1031 K1037 L1038 G1039	P1031-C1035 PolarHBondContact O-N 3.3Å; C1035-K1037 VanDerWaalsContact C-N 3.32Å; C1035-K1037 PolarHBondContact O-N 2.86Å; C1035-L1038 PolarHBondContact O-N 2.94Å; C1035-G1039 PolarHBondContact O-N 2.78Å
1036	A	47.1	Very low	38.1	Very low	47 Å²	47	92.2 Å²	92.2	39%	0.388	48%	0.48	S	S	.	.	H	α-helix	trans	-70	-24.3	175.4	0	0	0	0	0	113.5	Q1032 V1034 K1040	Q1032-A1036 WeakPolarHBondContact O-CB 3.06Å; Q1032-A1036 PolarHBondContact O-N 2.79Å; V1034-A1036 VanDerWaalsContact C-N 3.29Å; V1034-A1036 PolarHBondContact O-N 3.02Å; A1036-K1040 WeakPolarHBondContact O-CB 3.5Å; A1036-K1040 WeakPolarHBondContact O-CD 3.25Å; A1036-K1040 WeakPolarHBondContact O-CG 3.36Å; A1036-K1040 PolarHBondContact O-N 3.37Å
1037	K	43.6	Very low	37.4	Very low	150 Å²	150	102 Å²	102	65%	0.652	52%	0.518	S	S	*	.	H	α-helix	trans	-75.5	-44.1	170.3	-85	-172.4	172.7	-170.6	0	111.7	S1033 V1034 C1035 K1040 N1041	S1033-K1037 PolarHBondContact O-N 3.1Å; V1034-K1037 PolarHBondContact O-N 3.22Å; C1035-K1037 VanDerWaalsContact C-N 3.32Å; C1035-K1037 PolarHBondContact O-N 2.86Å; K1037-K1040 PolarHBondContact O-N 2.93Å; K1037-N1041 PolarHBondContact O-N 3.07Å
1038	L	41	Very low	36.7	Very low	49 Å²	49	105.9 Å²	105.9	26%	0.257	53%	0.533	S	S	.	.	H	α-helix	trans	-66.5	-40.9	173.8	-94.8	86.1	0	0	0	112.4	F964 M1023 W1030 V1034 C1035 K1040 N1041 T1042	F964-L1038 HydrophobicContact CE1-CD1 3.74Å; F964-L1038 HydrophobicContact CZ-CD1 3.69Å; M1023-L1038 HydrophobicContact CE-CB 4.15Å; M1023-L1038 HydrophobicContact SD-CB 4.31Å; M1023-L1038 HydrophobicContact SD-CD2 4Å; W1030-L1038 HydrophobicContact CH2-CD1 4.32Å; W1030-L1038 HydrophobicContact CH2-CD2 3.84Å; W1030-L1038 HydrophobicContact CZ3-CB 4.45Å; W1030-L1038 HydrophobicContact CZ3-CD1 3.85Å; W1030-L1038 HydrophobicContact CZ3-CD2 3.78Å; W1030-L1038 HydrophobicContact CZ3-CG 4.22Å; V1034-L1038 HydrophobicContact CG1-CD1 4.48Å; V1034-L1038 PolarHBondContact O-N 3.25Å; C1035-L1038 PolarHBondContact O-N 2.94Å; L1038-K1040 PolarHBondContact O-N 3.24Å; L1038-N1041 CarbonylContact O-C 3.24Å; L1038-N1041 WeakPolarHBondContact O-CA 3.38Å; L1038-N1041 PolarHBondContact O-N 2.91Å; L1038-T1042 PolarHBondContact O-N 2.88Å
1039	G	43.9	Very low	35.8	Very low	37 Å²	37	107.4 Å²	107.4	38%	0.381	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-15.3	175.5	0	0	0	0	0	114.8	C1035 T1042	C1035-G1039 PolarHBondContact O-N 2.78Å; G1039-T1042 PolarHBondContact O-OG1 2.57Å
1040	K	43.7	Very low	35.3	Very low	176 Å²	176	110.8 Å²	110.8	77%	0.765	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-14.8	167	-76.8	172.4	-177	-172.9	0	113	A1036 K1037 L1038	A1036-K1040 WeakPolarHBondContact O-CB 3.5Å; A1036-K1040 WeakPolarHBondContact O-CD 3.25Å; A1036-K1040 WeakPolarHBondContact O-CG 3.36Å; A1036-K1040 PolarHBondContact O-N 3.37Å; K1037-K1040 PolarHBondContact O-N 2.93Å; L1038-K1040 PolarHBondContact O-N 3.24Å
1041	N	33.7	Very low	34.5	Very low	95 Å²	95	113.5 Å²	113.5	51%	0.508	57%	0.569	S	S	.	*	S	Bend	trans	-101	8.6	173.9	-68.9	0.7	0	0	0	112.7	K1037 L1038 N1043	K1037-N1041 PolarHBondContact O-N 3.07Å; L1038-N1041 CarbonylContact O-C 3.24Å; L1038-N1041 WeakPolarHBondContact O-CA 3.38Å; L1038-N1041 PolarHBondContact O-N 2.91Å; N1041-N1043 PolarHBondContact O-N 2.8Å
1042	T	32.5	Very low	33.7	Very low	68 Å²	68	117.2 Å²	117.2	42%	0.417	58%	0.584	S	S	.	*			trans	-80.4	62.9	175.7	52.1	0	0	0	0	113.4	M1023 L1038 G1039 F1044	M1023-T1042 HydrophobicContact CE-CG2 3.61Å; L1038-T1042 PolarHBondContact O-N 2.88Å; G1039-T1042 PolarHBondContact O-OG1 2.57Å; T1042-F1044 PolarHBondContact O-N 3.07Å; T1042-F1044 VanDerWaalsContact O-N 3.14Å
1043	N	28.9	Very low	33	Very low	165 Å²	165	118.1 Å²	118.1	88%	0.882	59%	0.592	S	S	*	*			trans	-79.1	55.8	142.8	-87.7	-25.2	0	0	0	108.9	N1041	N1041-N1043 PolarHBondContact O-N 2.8Å
1044	F	27.7	Very low	32	Very low	124 Å²	124	125 Å²	125	54%	0.544	61%	0.605	S	S	.	*			trans	-115.6	44.8	174.8	-85	-74.4	0	0	0	109.4	Q1016 T1042	Q1016-F1044 PolarHBondContact NE2-O 3.4Å; T1042-F1044 PolarHBondContact O-N 3.07Å; T1042-F1044 VanDerWaalsContact O-N 3.14Å
1045	Q	24.6	Very low	31.2	Very low	146 Å²	146	127.1 Å²	127.1	68%	0.682	62%	0.622	S	S	*	*	S	Bend	trans	-143.7	131.7	174.9	-155	173.7	10.9	0	0	107.9
1046	Y	24.6	Very low	30	Very low	179 Å²	179	130.7 Å²	130.7	70%	0.702	64%	0.637	S	S	*	*			trans	61.3	102.4	-169.7	-68.7	-88.4	0	0	0	116.1
1047	Y	23.3	Very low	29	Very low	210 Å²	210	133.4 Å²	133.4	82%	0.824	65%	0.649	S	S	*	*				-157	105.6	95	-114.5	-85.2	0	0	0	110.5
1048	N	24.4	Very low	28.2	Very low	147 Å²	147	128.8 Å²	128.8	79%	0.786	63%	0.634	S	S	*	*			trans	-156.3	118.9	155.7	-154.4	-32.1	0	0	0	109.6
1049	K	25.7	Very low	27.5	Very low	151 Å²	151	132.2 Å²	132.2	66%	0.657	65%	0.648	S	S	*	*			trans	-143.3	129.1	175.6	-112.8	-170.2	176.9	-177.4	0	107.1
1050	R	25.9	Very low	26.6	Very low	161 Å²	161	135.7 Å²	135.7	61%	0.608	65%	0.653	S	S	*	*			trans	56.2	100.6	-179.6	-81.7	-171	167.7	175.6	-2	116	D1828 F1830	R1050-D1828 IonicContact NH2-OD1 3.19Å; R1050-F1830 VanDerWaalsContact NH1-CZ 3.33Å
1051	S	21.9	Very low	25.8	Very low	91 Å²	91	131.9 Å²	131.9	64%	0.636	64%	0.64	S	S	*	*				-4.4	146.6	128.2	55.3	0	0	0	0	119.5
1052	L	23	Very low	25.4	Very low	160 Å²	160	131.7 Å²	131.7	84%	0.838	64%	0.639	S	S	*	*			trans	62	97.3	149.5	-71.7	161.4	0	0	0	117.2
1053	I	25.9	Very low	25.1	Very low	174 Å²	174	132.3 Å²	132.3	89%	0.892	64%	0.64	S	S	*	*				-163.9	165.5	110.2	-101.7	161.5	0	0	0	111
1054	R	23	Very low	25	Very low	226 Å²	226	128.4 Å²	128.4	85%	0.853	62%	0.622	S	S	*	*			trans	-55.1	136.3	-179.8	163.8	-174.2	-80	-157.1	-4.8	114
1055	S	23	Very low	25.1	Very low	89 Å²	89	126.7 Å²	126.7	62%	0.622	62%	0.623	S	S	*	*			trans	15.4	105.3	141.7	-175.8	0	0	0	0	118.6
1056	M	23.3	Very low	25.1	Very low	100 Å²	100	122.4 Å²	122.4	49%	0.493	61%	0.61	S	S	.	*				-127.9	175.3	106.3	-79.4	-67	-178.3	0	0	106.3	E1179	M1056-E1179 VanDerWaalsContact CB-C 3.47Å; M1056-E1179 HydrophobicContact CB-CB 3.44Å; M1056-E1179 VanDerWaalsContact CB-CB 3.44Å; M1056-E1179 WeakPolarHBondContact CB-O 3.47Å
1057	T	24.6	Very low	25.4	Very low	103 Å²	103	121.4 Å²	121.4	63%	0.632	61%	0.609	S	S	*	*			trans	-146.8	91.1	176.4	-52.2	0	0	0	0	117.2	E1179 S1180	T1057-E1179 VanDerWaalsContact C-OE1 3.3Å; T1057-E1179 VanDerWaalsContact CA-CD 3.44Å; T1057-E1179 WeakPolarHBondContact CA-OE1 3.4Å; T1057-S1180 WeakPolarHBondContact O-CB 3.43Å; T1057-S1180 PolarHBondContact O-OG 2.98Å
1058	T	27.4	Very low	25.7	Very low	53 Å²	53	116.7 Å²	116.7	33%	0.325	60%	0.598	S	S	.	*			trans	-174.2	116.6	165.9	47.4	0	0	0	0	116.5	N1178 E1179 S1180	T1058-N1178 VanDerWaalsContact O-CA 3.25Å; T1058-N1178 WeakPolarHBondContact O-CA 3.46Å; T1058-N1178 PolarHBondContact O-N 2.85Å; T1058-E1179 PolarHBondContact N-OE1 2.66Å; T1058-S1180 WeakPolarHBondContact CG2-OG 3.27Å; T1058-S1180 VanDerWaalsContact OG1-CA 3.25Å; T1058-S1180 WeakPolarHBondContact OG1-CA 3.43Å; T1058-S1180 WeakPolarHBondContact OG1-CB 3.33Å; T1058-S1180 PolarHBondContact OG1-OG 2.76Å
1059	Q	25.7	Very low	26	Very low	122 Å²	122	117.7 Å²	117.7	57%	0.57	60%	0.601	S	S	*	*			trans	77.6	150.4	133.3	-58.7	-171.8	32.1	0	0	122	K1177 N1178	Q1059-K1177 HydrophobicContact CB-CD 3.88Å; Q1059-K1177 HydrophobicContact CB-CG 3.99Å; Q1059-K1177 CarbonylContact O-C 3.46Å; Q1059-K1177 WeakPolarHBondContact O-CB 3.23Å; Q1059-K1177 VanDerWaalsContact O-CG 3.24Å; Q1059-K1177 WeakPolarHBondContact O-CG 3.47Å; Q1059-N1178 PolarHBondContact N-OD1 2.72Å; Q1059-N1178 PolarHBondContact O-N 2.95Å; Q1059-N1178 PolarHBondContact O-ND2 2.85Å; Q1059-N1178 PolarHBondContact O-OD1 3.32Å
1060	K	25.8	Very low	26	Very low	110 Å²	110	115.4 Å²	115.4	48%	0.478	61%	0.605	S	S	.	*			trans	-169.3	152.6	-138.3	140	-97.9	-179.1	-68.6	0	110.2	D1062	K1060-D1062 IonicContact NZ-OD1 3.81Å; K1060-D1062 PolarHBondContact NZ-OD1 3.28Å
1061	I	27.1	Very low	26.1	Very low	95 Å²	95	111 Å²	111	49%	0.487	61%	0.61	S	S	.	*			trans	176.1	97.7	145	-90.8	150.2	0	0	0	111.8	Q1175 D1176	I1061-Q1175 VanDerWaalsContact O-CD 3.27Å; I1061-Q1175 WeakPolarHBondContact O-CG 3.2Å; I1061-Q1175 PolarHBondContact O-OE1 2.82Å; I1061-D1176 WeakPolarHBondContact CA-OD2 3.41Å; I1061-D1176 PolarHBondContact N-OD2 3.47Å
1062	D	24.7	Very low	26.4	Very low	91 Å²	91	113.6 Å²	113.6	49%	0.487	62%	0.616	S	S	.	*			trans	66.4	-172	138.9	-70.5	61.7	0	0	0	116.4	K1060	K1060-D1062 IonicContact NZ-OD1 3.81Å; K1060-D1062 PolarHBondContact NZ-OD1 3.28Å
1063	N	25.8	Very low	26.7	Very low	81 Å²	81	111.8 Å²	111.8	43%	0.433	61%	0.606	S	S	.	*			cis	-151.8	131.2	-35.3	-110	-23	0	0	0	118.1	R1835	N1063-R1835 PolarHBondContact ND2-NH2 3.45Å; N1063-R1835 PolarHBondContact OD1-NH2 2.86Å
1064	T	26.6	Very low	26.7	Very low	84 Å²	84	110.7 Å²	110.7	52%	0.515	60%	0.597	S	S	.	*			trans	71.7	157.5	136.8	53.8	0	0	0	0	125	R1835	T1064-R1835 HydrophobicContact CG2-CG 4.48Å; T1064-R1835 VanDerWaalsContact CG2-CZ 3.41Å; T1064-R1835 VanDerWaalsContact CG2-NE 3.3Å
1065	P	30.4	Very low	27.1	Very low	88 Å²	88	106 Å²	106	57%	0.571	59%	0.589	S	S	*	*			cis	-141.1	150.4	-26.6	35.3	-16.4	0	0	0	117.6
1066	S	25.9	Very low	27.3	Very low	56 Å²	56	106.8 Å²	106.8	39%	0.392	59%	0.586	S	S	.	*			trans	29.1	144.4	148.2	75.8	0	0	0	0	122.3
1067	K	30.5	Very low	27.8	Very low	157 Å²	157	108.7 Å²	108.7	68%	0.683	60%	0.598	S	S	*	*			cis	-176.8	132.1	43.1	-151.1	163	-173.9	170.2	0	114.9
1068	N	28.2	Very low	28.1	Very low	112 Å²	112	110.3 Å²	110.3	60%	0.599	60%	0.603	S	S	*	*			trans	37.3	130.8	146.4	-52.1	19.8	0	0	0	123.8
1069	I	30.9	Very low	28.2	Very low	167 Å²	167	112.8 Å²	112.8	86%	0.856	62%	0.618	S	S	*	*				165.1	159.2	124.2	-89.3	158.9	0	0	0	109.4
1070	S	25.7	Very low	28.6	Very low	104 Å²	104	114.1 Å²	114.1	73%	0.727	63%	0.629	S	S	*	*				-166.1	131.2	-66.7	62.7	0	0	0	0	110.5
1071	G	28.8	Very low	28.7	Very low	69 Å²	69	114.9 Å²	114.9	71%	0.711	64%	0.638	S	S	*	*			trans	81.4	166.4	173.7	0	0	0	0	0	115.2
1072	N	27.8	Very low	28.7	Very low	145 Å²	145	117.5 Å²	117.5	78%	0.775	65%	0.649	S	S	*	*			cis	-163	153.1	1.9	-121	9.3	0	0	0	113.5
1073	I	29.5	Very low	29	Very low	121 Å²	121	120 Å²	120	62%	0.621	66%	0.662	S	S	*	*			trans	77.5	119.2	141.1	-72.4	170.6	0	0	0	121.1
1074	E	26.6	Very low	29.6	Very low	152 Å²	152	123.7 Å²	123.7	71%	0.71	68%	0.682	S	S	*	*			trans	50.7	117.8	141.2	-64.8	155.6	-146.7	0	0	122.5
1075	N	30	Very low	30.1	Very low	126 Å²	126	124.6 Å²	124.6	67%	0.674	69%	0.689	S	S	*	*				-152.5	137.1	104.6	-110.1	-42.3	0	0	0	110.9	R1826	N1075-R1826 PolarHBondContact O-NE 2.83Å; N1075-R1826 PolarHBondContact O-NH2 3.35Å
1076	D	27.9	Very low	30.3	Very low	107 Å²	107	126.7 Å²	126.7	57%	0.572	70%	0.695	S	S	*	*			trans	-98.6	159.9	170.9	-69.2	-41.7	0	0	0	110.4
1077	N	34	Very low	30.9	Very low	140 Å²	140	131.5 Å²	131.5	75%	0.749	71%	0.709	S	S	*	*			trans	177.2	132.1	131.9	-95.6	-61.9	0	0	0	111.4
1078	N	31.6	Very low	31.2	Very low	136 Å²	136	131 Å²	131	73%	0.727	71%	0.709	S	S	*	*			trans	36.2	114.1	151.1	-51.8	-18.6	0	0	0	119.1
1079	V	29.7	Very low	31.6	Very low	106 Å²	106	131.3 Å²	131.3	64%	0.642	71%	0.711	S	S	*	*				50	101.1	74.8	-175.6	0	0	0	0	110.3
1080	D	32.8	Very low	31.9	Very low	150 Å²	150	131.1 Å²	131.1	80%	0.802	71%	0.706	S	S	*	*				-161.3	161.8	88.3	-106.7	-41.4	0	0	0	115.7
1081	N	28.4	Very low	32.4	Very low	126 Å²	126	131.6 Å²	131.6	67%	0.674	70%	0.701	S	S	*	*			trans	-10.5	152	174.8	-87	18.1	0	0	0	126.5
1082	E	27.9	Very low	32.8	Very low	150 Å²	150	136.3 Å²	136.3	70%	0.701	70%	0.702	S	S	*	*			trans	82.7	106.7	137	-77	169.8	-118.4	0	0	123.4
1083	N	30.5	Very low	33	Very low	144 Å²	144	135.3 Å²	135.3	77%	0.77	70%	0.697	S	S	*	*				56.5	106.6	121.4	-61	-11.2	0	0	0	121.9
1084	D	37.5	Very low	33.5	Very low	158 Å²	158	136 Å²	136	85%	0.845	70%	0.7	S	S	*	*				65.2	109.9	118	-150.4	19.4	0	0	0	119.9
1085	P	36.6	Very low	33.9	Very low	102 Å²	102	134.2 Å²	134.2	66%	0.662	70%	0.695	S	S	*	*			trans	-97.7	121	-173	36.1	-32.8	0	0	0	115.8
1086	N	36.5	Very low	34.2	Very low	132 Å²	132	134.2 Å²	134.2	71%	0.706	70%	0.695	S	S	*	*			trans	91.1	136.4	146.3	-56.6	-45	0	0	0	120.3
1087	K	38.5	Very low	34.8	Very low	158 Å²	158	135.7 Å²	135.7	69%	0.687	70%	0.703	S	S	*	*			cis	-175.8	151.6	-22.4	-123.6	176.3	-170.8	-178.8	0	111.1
1088	Q	35.2	Very low	35.1	Very low	147 Å²	147	134.4 Å²	134.4	69%	0.687	70%	0.696	S	S	*	*			trans	66.3	146.7	154.6	-71.1	177.8	-109.5	0	0	117.3
1089	D	37.4	Very low	35.6	Very low	118 Å²	118	133.4 Å²	133.4	63%	0.631	69%	0.691	S	S	*	*			cis	-153.4	158	3.7	-117.5	-24.6	0	0	0	113.8
1090	Q	37	Very low	36.3	Very low	162 Å²	162	135.1 Å²	135.1	76%	0.757	70%	0.697	S	S	*	*			trans	72.1	110	154.3	-69.1	175.8	36.1	0	0	123.8
1091	D	36.4	Very low	36.6	Very low	115 Å²	115	134.9 Å²	134.9	62%	0.615	70%	0.695	S	S	*	*				74.5	106.3	125.3	-79.6	17.7	0	0	0	125.1
1092	K	37.5	Very low	36.9	Very low	167 Å²	167	135.4 Å²	135.4	73%	0.726	70%	0.698	S	S	*	*				80.5	103.5	128.7	-65.8	165.1	-177.3	144.1	0	120.8
1093	N	31.7	Very low	37.3	Very low	125 Å²	125	135.3 Å²	135.3	67%	0.668	70%	0.697	S	S	*	*				35	136.7	104.9	-75.9	-23.1	0	0	0	118.2
1094	I	39	Very low	37.3	Very low	136 Å²	136	133.2 Å²	133.2	70%	0.697	69%	0.694	S	S	*	*			cis	-164.3	160.4	31.2	-135.8	169.2	0	0	0	113.5
1095	N	35.2	Very low	37.1	Very low	114 Å²	114	132.2 Å²	132.2	61%	0.61	69%	0.689	S	S	*	*			trans	73.6	109.5	160.7	-75.1	46.7	0	0	0	122.6
1096	D	37.1	Very low	36.9	Very low	125 Å²	125	133.9 Å²	133.9	67%	0.668	69%	0.692	S	S	*	*				98.6	139.1	115	-58.6	-6.4	0	0	0	123.5
1097	D	39.9	Very low	36.5	Very low	139 Å²	139	135.1 Å²	135.1	74%	0.743	70%	0.698	S	S	*	*			trans	82.2	110.5	157	-55.3	-15	0	0	0	123.5
1098	D	40.4	Very low	36	Very low	113 Å²	113	136.4 Å²	136.4	60%	0.604	70%	0.703	S	S	*	*			trans	88.2	113.1	134.6	-58.2	-5	0	0	0	126
1099	D	42.7	Very low	35.8	Very low	114 Å²	114	134.2 Å²	134.2	61%	0.61	70%	0.7	S	S	*	*				68.6	109.3	129	-66.3	6.5	0	0	0	126.2
1100	D	43.9	Very low	35.6	Very low	143 Å²	143	135 Å²	135	77%	0.765	70%	0.703	S	S	*	*				66.9	122.8	121.9	-73.8	7.8	0	0	0	126
1101	D	40	Very low	35.3	Very low	144 Å²	144	133 Å²	133	77%	0.77	70%	0.698	S	S	*	*			trans	49.2	99.4	133.3	-75.5	5.4	0	0	0	124.6
1102	D	34.6	Very low	35.2	Very low	137 Å²	137	134.3 Å²	134.3	73%	0.733	70%	0.704	S	S	*	*				70.5	155.7	109.1	-144.5	-4	0	0	0	123.3
1103	H	36.3	Very low	34.8	Very low	149 Å²	149	131.2 Å²	131.2	69%	0.69	70%	0.704	S	S	*	*			trans	79.8	106	163.3	-72.5	16.3	0	0	0	121.3
1104	S	30.8	Very low	34.7	Very low	100 Å²	100	132.6 Å²	132.6	70%	0.699	71%	0.711	S	S	*	*			trans	41.1	136.7	134.6	59.2	0	0	0	0	121.2
1105	D	33.1	Very low	34.5	Very low	137 Å²	137	135.6 Å²	135.6	73%	0.733	72%	0.722	S	S	*	*			cis	-156	149.1	32.3	-129.7	-27.9	0	0	0	115.4
1106	N	31	Very low	34.3	Very low	137 Å²	137	138.7 Å²	138.7	73%	0.733	73%	0.73	S	S	*	*			trans	41.7	123.9	149.9	-89.6	-69	0	0	0	125.4
1107	L	28.1	Very low	34.1	Very low	157 Å²	157	140.2 Å²	140.2	82%	0.822	74%	0.738	S	S	*	*				93.9	103.1	124.7	-162.8	72.2	0	0	0	121.5
1108	K	28.9	Very low	33.5	Very low	185 Å²	185	136.7 Å²	136.7	80%	0.804	74%	0.735	S	S	*	*			trans	-161.9	152.5	135.9	-105.2	-177.2	168.5	-171.2	0	107
1109	T	31.4	Very low	32.9	Very low	101 Å²	101	138.8 Å²	138.8	62%	0.62	75%	0.745	S	S	*	*			cis	-159.5	155.4	14.7	-4.9	0	0	0	0	110.9
1110	I	33.1	Very low	32.5	Very low	136 Å²	136	141.5 Å²	141.5	70%	0.697	76%	0.759	S	S	*	*			trans	73.7	115.4	140.1	-73.1	167.7	0	0	0	120.3
1111	N	30.9	Very low	31.9	Very low	120 Å²	120	142.1 Å²	142.1	64%	0.642	76%	0.762	S	S	*	*				51.9	157.3	126.6	-55.4	45	0	0	0	121.1
1112	D	33.2	Very low	31.5	Very low	141 Å²	141	143.8 Å²	143.8	75%	0.754	77%	0.765	S	S	*	*			cis	-155.5	175.6	-18.8	-98.7	-18.3	0	0	0	108.2
1113	S	29.1	Very low	31.5	Very low	102 Å²	102	142.5 Å²	142.5	71%	0.713	76%	0.762	S	S	*	*			trans	-91.9	162.2	-169	-55.2	0	0	0	0	115.9
1114	D	30.9	Very low	31.1	Very low	154 Å²	154	144.7 Å²	144.7	82%	0.824	77%	0.769	S	S	*	*			trans	61	126.5	151.6	-52.2	-32.8	0	0	0	121
1115	E	32.9	Very low	31.2	Very low	199 Å²	199	147.4 Å²	147.4	93%	0.93	78%	0.776	S	S	*	*				-163.6	176.2	109.2	-116.7	-170.4	168.4	0	0	113.8
1116	K	32.7	Very low	31.7	Very low	179 Å²	179	145.4 Å²	145.4	78%	0.778	77%	0.771	S	S	*	*			trans	-103.6	153.9	-176.6	-58.8	168.7	-179.1	169.6	0	111.5
1117	N	32.2	Very low	31.8	Very low	157 Å²	157	146 Å²	146	84%	0.84	77%	0.773	S	S	*	*				165.1	154.4	116.8	-83.6	-27.8	0	0	0	112.5
1118	G	27.7	Very low	31.9	Very low	66 Å²	66	144.5 Å²	144.5	68%	0.68	77%	0.765	S	S	*	*			trans	-90.6	-169	152.7	0	0	0	0	0	110.2
1119	I	26.8	Very low	32	Very low	157 Å²	157	141.8 Å²	141.8	81%	0.805	76%	0.759	S	S	*	*			cis	-150.4	142.3	6.4	-55.7	167.7	0	0	0	105.3
1120	D	34	Very low	31.9	Very low	170 Å²	170	142.5 Å²	142.5	91%	0.909	76%	0.764	S	S	*	*			trans	-157	145	151.4	-112.2	-29.2	0	0	0	110.2
1121	L	31.2	Very low	31.6	Very low	157 Å²	157	143.7 Å²	143.7	82%	0.822	77%	0.771	S	S	*	*			trans	-158.2	91.5	-169.4	-156.3	176.7	0	0	0	111.4
1122	E	33.6	Very low	31.5	Very low	178 Å²	178	144.1 Å²	144.1	83%	0.832	77%	0.773	S	S	*	*			trans	-147.1	144.8	173	-117.7	-162.5	-151.6	0	0	115.5
1123	T	34.2	Very low	31.3	Very low	110 Å²	110	144.9 Å²	144.9	68%	0.675	77%	0.772	S	S	*	*			trans	57.8	86.3	146.4	-47.2	0	0	0	0	120.5
1124	K	27.8	Very low	31.3	Very low	195 Å²	195	144.8 Å²	144.8	85%	0.848	77%	0.771	S	S	*	*			trans	32.3	108.2	131.1	-62.8	179.8	179.2	178.5	0	119.6
1125	D	32.7	Very low	31.2	Very low	158 Å²	158	142.4 Å²	142.4	85%	0.845	77%	0.766	S	S	*	*				-170.1	155.7	119.7	-108.2	-5	0	0	0	109.7
1126	P	42.6	Very low	31	Very low	95 Å²	95	140.4 Å²	140.4	62%	0.617	76%	0.759	S	S	*	*				-132.9	159.5	-51.3	31.4	-13.7	0	0	0	113.5
1127	I	33.8	Very low	30.9	Very low	150 Å²	150	138.2 Å²	138.2	77%	0.769	76%	0.756	S	S	*	*			trans	36.9	106.7	143.9	-53.9	172	0	0	0	115.9
1128	D	31	Very low	30.8	Very low	125 Å²	125	137.1 Å²	137.1	67%	0.668	75%	0.749	S	S	*	*			cis	-156.4	138.9	16.7	-104.7	-24.7	0	0	0	112.6
1129	N	30.8	Very low	30.8	Very low	127 Å²	127	141.1 Å²	141.1	68%	0.679	75%	0.75	S	S	*	*			trans	55.8	137.2	138.3	-54.7	-34.8	0	0	0	121.7
1130	T	29.2	Very low	30.8	Very low	116 Å²	116	139.7 Å²	139.7	71%	0.712	74%	0.743	S	S	*	*			cis	174.4	148.7	-20.8	27.5	0	0	0	0	106.1
1131	L	26.1	Very low	30.6	Very low	162 Å²	162	137.2 Å²	137.2	85%	0.848	74%	0.739	S	S	*	*			cis	-154.8	-168.2	-13	-132.6	177.9	0	0	0	106.8
1132	N	28.7	Very low	30.6	Very low	129 Å²	129	136 Å²	136	69%	0.69	74%	0.738	S	S	*	*			trans	-129.1	146.1	-178	-121.3	-4.2	0	0	0	113.8
1133	H	29.1	Very low	30.7	Very low	156 Å²	156	135.5 Å²	135.5	72%	0.722	74%	0.741	S	S	*	*			trans	47.1	115.7	155.5	-68.6	-68.4	0	0	0	123.6
1134	S	29.4	Very low	30.7	Very low	101 Å²	101	133.7 Å²	133.7	71%	0.706	74%	0.744	S	S	*	*				65.9	123.2	128	67.5	0	0	0	0	124.2
1135	S	29.5	Very low	31	Very low	103 Å²	103	127.4 Å²	127.4	72%	0.72	74%	0.735	S	S	*	*			trans	86.2	95.6	132.4	-60.9	0	0	0	0	122.4
1136	M	28.9	Very low	31.2	Very low	157 Å²	157	127.4 Å²	127.4	77%	0.773	74%	0.735	S	S	*	*			trans	67.3	121.8	137.1	-79.6	-172.5	-77.1	0	0	122.1
1137	N	29.9	Very low	30.7	Very low	133 Å²	133	129.6 Å²	129.6	71%	0.711	74%	0.741	S	S	*	*			trans	65.5	136.1	132.9	-63.4	2.4	0	0	0	117.1
1138	I	30.7	Very low	30.6	Very low	135 Å²	135	130.7 Å²	130.7	69%	0.692	74%	0.743	S	S	*	*			cis	175.9	153.9	6.7	-118.9	166.2	0	0	0	102.4
1139	E	26.8	Very low	30.5	Very low	150 Å²	150	131.1 Å²	131.1	70%	0.701	74%	0.741	S	S	*	*			cis	-164.8	177.5	29.2	-139.7	174.4	-166.4	0	0	113.1
1140	L	26.6	Very low	30.7	Very low	127 Å²	127	133.8 Å²	133.8	67%	0.665	75%	0.749	S	S	*	*			trans	66.9	95.2	149.1	-76.9	164	0	0	0	121.6	V1142	L1140-V1142 HydrophobicContact CD2-CG2 4.16Å
1141	S	30.3	Very low	30.7	Very low	118 Å²	118	137.6 Å²	137.6	83%	0.825	76%	0.759	S	S	*	*				172.3	93.4	118.9	-71.6	0	0	0	0	108.3
1142	V	31.9	Very low	30.9	Very low	131 Å²	131	133.6 Å²	133.6	79%	0.794	75%	0.75	S	S	*	*				66.4	98.8	65.5	-174.5	0	0	0	0	113.6	L1140	L1140-V1142 HydrophobicContact CD2-CG2 4.16Å
1143	D	34	Very low	31.1	Very low	167 Å²	167	132 Å²	132	89%	0.893	74%	0.738	S	S	*	*			trans	-162.9	141.8	141.2	-155.9	-1.4	0	0	0	110.8
1144	G	35.5	Very low	31.3	Very low	72 Å²	72	131.5 Å²	131.5	74%	0.742	74%	0.741	S	S	*	*			trans	66.5	141	-172.9	0	0	0	0	0	115.4
1145	G	34.5	Very low	31.5	Very low	64 Å²	64	134.7 Å²	134.7	66%	0.66	74%	0.744	S	S	*	*			cis	115.1	127.7	12.6	0	0	0	0	0	110.2
1146	D	35.6	Very low	31.6	Very low	158 Å²	158	133.1 Å²	133.1	85%	0.845	73%	0.728	S	S	*	*			cis	-146.5	159.7	3	-61.3	-48.8	0	0	0	111.6
1147	D	32.7	Very low	31.7	Very low	141 Å²	141	127.3 Å²	127.3	75%	0.754	70%	0.699	S	S	*	*			trans	4.6	143.6	156.7	-53.5	-26.8	0	0	0	125.4
1148	E	31.2	Very low	31.6	Very low	173 Å²	173	123.4 Å²	123.4	81%	0.808	68%	0.676	S	S	*	*			trans	66.1	113.5	135.6	-68.8	178.3	-176.5	0	0	125.5
1149	E	28.6	Very low	31.6	Very low	133 Å²	133	120.5 Å²	120.5	62%	0.621	66%	0.66	S	S	*	*			trans	59.2	-178.9	130.3	-54.8	-157.1	148.2	0	0	123	V1977	E1149-V1977 WeakPolarHBondContact OE1-CG2 3.29Å
1150	E	35.8	Very low	31.8	Very low	183 Å²	183	118 Å²	118	86%	0.855	65%	0.65	S	S	*	*			trans	-102.9	132	-148.5	-55	-179.2	139.7	0	0	117.1
1151	E	29.5	Very low	32.2	Very low	196 Å²	196	120 Å²	120	92%	0.916	66%	0.656	S	S	*	*			trans	-168.2	156.9	151.9	-95.6	-157.3	147.6	0	0	107.9
1152	A	29	Very low	32.2	Very low	79 Å²	79	119.5 Å²	119.5	65%	0.653	65%	0.653	S	S	*	*			cis	-169.2	-167.8	-16.9	0	0	0	0	0	109.4
1153	E	33.1	Very low	32.3	Very low	96 Å²	96	122.3 Å²	122.3	45%	0.449	65%	0.654	S	S	.	*			trans	77.2	86.1	162	-56.2	-168.6	176.2	0	0	120.6	W1922	E1153-W1922 PolarHBondContact OE1-N 2.88Å
1154	D	34.8	Very low	32	Very low	145 Å²	145	119.7 Å²	119.7	78%	0.775	64%	0.644	S	S	*	*				64.7	97.7	118.4	-55.5	-4.5	0	0	0	125.5
1155	Q	32.1	Very low	31.7	Very low	167 Å²	167	124.4 Å²	124.4	78%	0.78	65%	0.651	S	S	*	*				54.6	114.4	116.7	-68.9	-169.9	-37.4	0	0	125.4
1156	D	31.9	Very low	31.4	Very low	71 Å²	71	125.1 Å²	125.1	38%	0.38	66%	0.658	S	S	.	*				112.1	145.5	113.4	-73	14.4	0	0	0	123.7	H661 D1929	H661-D1156 PolarHBondContact CE1-O 2.79Å; H661-D1156 PolarHBondContact NE2-O 3.39Å; H661-D1156 VanDerWaalsContact NE2-O 3.09Å; D1156-D1929 WeakPolarHBondContact CA-O 3.42Å; D1156-D1929 PolarHBondContact N-O 3.17Å; D1156-D1929 VanDerWaalsContact N-O 3.1Å
1157	Q	30.8	Very low	31	Very low	34 Å²	34	122.5 Å²	122.5	16%	0.159	65%	0.652	C	S	.	*			trans	92.2	149.8	160.8	-53.4	-133.2	-41.3	0	0	121.2	H661 D1929 T1930 I1931	H661-Q1157 PolarHBondContact CD2-O 3.29Å; H661-Q1157 WeakPolarHBondContact CE1-CB 3.12Å; H661-Q1157 VanDerWaalsContact NE2-CA 3.34Å; H661-Q1157 WeakPolarHBondContact NE2-CA 3.45Å; H661-Q1157 PolarHBondContact NE2-O 3.11Å; Q1157-D1929 WeakPolarHBondContact O-CA 3.24Å; Q1157-D1929 PolarHBondContact O-N 2.9Å; Q1157-T1930 VanDerWaalsContact N-C 3.27Å; Q1157-T1930 PolarHBondContact N-O 2.91Å; Q1157-I1931 HydrophobicContact CB-CG1 4.29Å; Q1157-I1931 HydrophobicContact CG-CG1 3.91Å; Q1157-I1931 VanDerWaalsContact NE2-CG1 3.35Å
1158	E	29	Very low	30.8	Very low	51 Å²	51	123.6 Å²	123.6	24%	0.238	66%	0.656	C	S	.	*			trans	-55.1	167.1	-149.4	-36.1	91.7	91.7	0	0	119.7	V660 H661 G662 I1931	V660-E1158 WeakPolarHBondContact CA-O 3.05Å; H661-E1158 VanDerWaalsContact C-OE1 3.31Å; H661-E1158 WeakPolarHBondContact CA-OE1 3.36Å; H661-E1158 WeakPolarHBondContact CA-OE2 3.28Å; H661-E1158 PolarHBondContact CD2-O 3.18Å; H661-E1158 PolarHBondContact N-O 3.22Å; G662-E1158 PolarHBondContact N-OE1 2.92Å; G662-E1158 VanDerWaalsContact N-OE1 3.12Å; G662-E1158 PolarHBondContact N-OE2 3.2Å; E1158-I1931 HydrophobicContact CG-CB 4.04Å; E1158-I1931 HydrophobicContact CG-CD1 3.84Å; E1158-I1931 HydrophobicContact CG-CG1 4.28Å; E1158-I1931 HydrophobicContact CG-CG2 4.08Å
1159	E	30.2	Very low	30.8	Very low	75 Å²	75	121.2 Å²	121.2	35%	0.35	65%	0.653	S	S	.	*			cis	-177	-169.3	-36.3	-151.5	-140.1	129.7	0	0	104.5	N659 V660 H1161 T1930	N659-E1159 WeakPolarHBondContact CB-O 3.45Å; V660-E1159 WeakPolarHBondContact CG2-O 3.42Å; E1159-H1161 IonicContact OE1-CD2 2.8Å; E1159-H1161 PolarHBondContact OE1-CD2 2.73Å; E1159-T1930 HydrophobicContact CG-CG2 4.24Å
1160	I	31.9	Very low	30.5	Very low	96 Å²	96	120.6 Å²	120.6	49%	0.492	66%	0.663	S	S	.	*			cis	-146.5	149.2	20.1	-55.7	175	0	0	0	108.8	N659	N659-I1160 HydrophobicContact CB-CB 4.45Å; N659-I1160 HydrophobicContact CB-CD1 4.09Å; N659-I1160 HydrophobicContact CB-CG1 3.94Å; N659-I1160 WeakPolarHBondContact ND2-CB 3.35Å; N659-I1160 PolarHBondContact ND2-N 3.4Å; N659-I1160 WeakPolarHBondContact OD1-CD1 3.32Å
1161	H	34.8	Very low	30.2	Very low	170 Å²	170	116.4 Å²	116.4	79%	0.787	66%	0.655	S	S	*	*			trans	-44.2	144.6	-177	-74.9	-102.6	0	0	0	121.1	E1159	E1159-H1161 IonicContact OE1-CD2 2.8Å; E1159-H1161 PolarHBondContact OE1-CD2 2.73Å
1162	S	29.6	Very low	30.1	Very low	108 Å²	108	113.7 Å²	113.7	76%	0.755	65%	0.646	S	S	*	*				-160.5	151.1	125	71	0	0	0	0	114.5
1163	K	33.2	Very low	30.2	Very low	190 Å²	190	120 Å²	120	83%	0.826	66%	0.655	S	S	*	*			trans	73.1	118.5	156.3	-77.3	-177.5	175.9	177.9	0	123.7
1164	T	28.5	Very low	29.9	Very low	112 Å²	112	122 Å²	122	69%	0.687	66%	0.664	S	S	*	*				90	117.1	117.8	-59.5	0	0	0	0	123.5
1165	I	28.3	Very low	29.5	Very low	171 Å²	171	119.7 Å²	119.7	88%	0.877	65%	0.648	S	S	*	*			trans	67.7	133.4	151.9	-66.9	166.5	0	0	0	120.3
1166	G	29.2	Very low	29.4	Very low	78 Å²	78	114.8 Å²	114.8	80%	0.804	63%	0.628	S	S	*	*			trans	177.1	137.5	164.4	0	0	0	0	0	115.9
1167	S	27.5	Very low	29.5	Very low	104 Å²	104	117.2 Å²	117.2	73%	0.727	64%	0.635	S	S	*	*			trans	-89.5	155.6	-164.6	-167.2	0	0	0	0	117.5
1168	I	27.3	Very low	29.6	Very low	163 Å²	163	120.1 Å²	120.1	84%	0.836	65%	0.652	S	S	*	*			trans	60.4	149.8	150.8	-73.6	166.5	0	0	0	120
1169	V	31.3	Very low	29.7	Very low	124 Å²	124	122.5 Å²	122.5	75%	0.752	66%	0.663	S	S	*	*			trans	-92.4	135.8	-175.9	172.7	0	0	0	0	113.1
1170	S	23.1	Very low	29.7	Very low	119 Å²	119	120.7 Å²	120.7	83%	0.832	66%	0.658	S	S	*	*			trans	-130	170.9	132.7	-77	0	0	0	0	108.5
1171	S	28.5	Very low	29.5	Very low	96 Å²	96	120.8 Å²	120.8	67%	0.671	66%	0.664	S	S	*	*			trans	-82.3	164.4	-153.4	61.2	0	0	0	0	116.1
1172	D	27.5	Very low	29.2	Very low	139 Å²	139	118.6 Å²	118.6	74%	0.743	66%	0.662	S	S	*	*			trans	64.5	71	153.6	-49.6	-37.3	0	0	0	118.5
1173	Y	31.8	Very low	29	Very low	212 Å²	212	119.2 Å²	119.2	83%	0.831	66%	0.661	S	S	*	*				-134.2	165.2	108.8	-129.3	-89.3	0	0	0	113.1
1174	E	27.3	Very low	28.8	Very low	137 Å²	137	116.8 Å²	116.8	64%	0.64	66%	0.656	S	S	*	*			trans	-70.2	145.1	-151.9	-102.6	-170.3	129.6	0	0	118.6
1175	Q	26.7	Very low	28.7	Very low	96 Å²	96	118.6 Å²	118.6	45%	0.449	66%	0.657	S	S	.	*				75	75.9	123.5	-154.4	161.3	102.7	0	0	119.5	I1061	I1061-Q1175 VanDerWaalsContact O-CD 3.27Å; I1061-Q1175 WeakPolarHBondContact O-CG 3.2Å; I1061-Q1175 PolarHBondContact O-OE1 2.82Å
1176	D	29.7	Very low	28.7	Very low	65 Å²	65	117.5 Å²	117.5	35%	0.348	65%	0.65	S	S	.	*				85.6	99.3	121.2	-65.9	-14.3	0	0	0	119.9	I1061	I1061-D1176 WeakPolarHBondContact CA-OD2 3.41Å; I1061-D1176 PolarHBondContact N-OD2 3.47Å
1177	K	34.4	Very low	28.8	Very low	122 Å²	122	118.6 Å²	118.6	53%	0.53	65%	0.645	S	S	.	*				86.8	173	60.5	-173.1	-172.4	-168.6	176.3	0	111.6	Q1059	Q1059-K1177 HydrophobicContact CB-CD 3.88Å; Q1059-K1177 HydrophobicContact CB-CG 3.99Å; Q1059-K1177 CarbonylContact O-C 3.46Å; Q1059-K1177 WeakPolarHBondContact O-CB 3.23Å; Q1059-K1177 VanDerWaalsContact O-CG 3.24Å; Q1059-K1177 WeakPolarHBondContact O-CG 3.47Å
1178	N	31.9	Very low	29	Very low	95 Å²	95	119 Å²	119	51%	0.508	64%	0.639	S	S	.	*			trans	88.5	110.2	-159.2	-55.5	-77.1	0	0	0	112	T1058 Q1059	T1058-N1178 VanDerWaalsContact O-CA 3.25Å; T1058-N1178 WeakPolarHBondContact O-CA 3.46Å; T1058-N1178 PolarHBondContact O-N 2.85Å; Q1059-N1178 PolarHBondContact N-OD1 2.72Å; Q1059-N1178 PolarHBondContact O-N 2.95Å; Q1059-N1178 PolarHBondContact O-ND2 2.85Å; Q1059-N1178 PolarHBondContact O-OD1 3.32Å
1179	E	32.3	Very low	29.4	Very low	101 Å²	101	117.7 Å²	117.7	47%	0.472	63%	0.629	S	S	.	*			cis	-163.5	157.1	5.5	-52.5	-162.3	101.3	0	0	107.7	M1056 T1057 T1058	M1056-E1179 VanDerWaalsContact CB-C 3.47Å; M1056-E1179 HydrophobicContact CB-CB 3.44Å; M1056-E1179 VanDerWaalsContact CB-CB 3.44Å; M1056-E1179 WeakPolarHBondContact CB-O 3.47Å; T1057-E1179 VanDerWaalsContact C-OE1 3.3Å; T1057-E1179 VanDerWaalsContact CA-CD 3.44Å; T1057-E1179 WeakPolarHBondContact CA-OE1 3.4Å; T1058-E1179 PolarHBondContact N-OE1 2.66Å
1180	S	28.7	Very low	29.4	Very low	36 Å²	36	118.7 Å²	118.7	25%	0.252	63%	0.63	S	S	.	*			cis	178.5	177	-7.2	-179.8	0	0	0	0	113	T1057 T1058	T1057-S1180 WeakPolarHBondContact O-CB 3.43Å; T1057-S1180 PolarHBondContact O-OG 2.98Å; T1058-S1180 WeakPolarHBondContact CG2-OG 3.27Å; T1058-S1180 VanDerWaalsContact OG1-CA 3.25Å; T1058-S1180 WeakPolarHBondContact OG1-CA 3.43Å; T1058-S1180 WeakPolarHBondContact OG1-CB 3.33Å; T1058-S1180 PolarHBondContact OG1-OG 2.76Å
1181	T	27.4	Very low	30	Very low	99 Å²	99	119.7 Å²	119.7	61%	0.607	62%	0.62	S	S	*	*			trans	94.8	135.5	146	-2.4	0	0	0	0	121.2
1182	V	29.2	Very low	30.1	Very low	123 Å²	123	124.4 Å²	124.4	75%	0.745	63%	0.631	S	S	*	*			trans	67.3	114	169.3	-172.5	0	0	0	0	113.6
1183	V	26.2	Very low	30.2	Very low	122 Å²	122	124 Å²	124	74%	0.739	63%	0.634	S	S	*	*			cis	73.7	86.1	29	-168.4	0	0	0	0	115
1184	L	29	Very low	30	Very low	138 Å²	138	123 Å²	123	72%	0.723	64%	0.637	S	S	*	*			trans	170.5	112	141.9	-90.7	159.8	0	0	0	104.5	M1186	L1184-M1186 HydrophobicContact CD2-CE 3.67Å; L1184-M1186 HydrophobicContact CD2-SD 4.16Å
1185	E	26.3	Very low	30.1	Very low	150 Å²	150	123.2 Å²	123.2	70%	0.701	64%	0.642	S	S	*	*			cis	60.6	101.2	41.5	-164.8	-172.3	-132.9	0	0	112.7
1186	M	28.6	Very low	30.3	Very low	149 Å²	149	127.2 Å²	127.2	73%	0.734	66%	0.66	S	S	*	*			trans	171.4	142.9	138.9	-86.5	144.9	-149.8	0	0	106	L1184	L1184-M1186 HydrophobicContact CD2-CE 3.67Å; L1184-M1186 HydrophobicContact CD2-SD 4.16Å
1187	S	31	Very low	30	Very low	101 Å²	101	131.3 Å²	131.3	71%	0.706	68%	0.681	S	S	*	*				-175.1	167.1	70.6	-97.9	0	0	0	0	108.4
1188	D	31.6	Very low	30	Very low	112 Å²	112	130.6 Å²	130.6	60%	0.599	69%	0.689	S	S	*	*			cis	-149.3	142.6	2.1	-105.8	-5.3	0	0	0	107.7
1189	E	35.2	Very low	29.6	Very low	136 Å²	136	130.6 Å²	130.6	64%	0.636	70%	0.696	S	S	*	*				62.2	132.9	82.9	-68.3	-153.7	164.4	0	0	117.8
1190	N	32.3	Very low	29.3	Very low	144 Å²	144	132.8 Å²	132.8	77%	0.77	71%	0.711	S	S	*	*				-153.8	114.5	125.2	-87.4	-59.4	0	0	0	106.1
1191	K	33.9	Very low	29.1	Very low	141 Å²	141	138.6 Å²	138.6	61%	0.613	74%	0.739	S	S	*	*				72.8	119.6	74.5	-74.8	177.7	-174.1	151.1	0	114.3
1192	E	30.5	Very low	28.9	Very low	195 Å²	195	139.4 Å²	139.4	91%	0.911	75%	0.748	S	S	*	*				-155	167.9	108.5	-112.2	173.1	-157.7	0	0	110.5
1193	T	30.6	Very low	28.7	Very low	129 Å²	129	140.6 Å²	140.6	79%	0.791	75%	0.748	S	S	*	*			trans	-133.7	146.7	-162	50.4	0	0	0	0	113.2
1194	E	28.3	Very low	28.7	Very low	191 Å²	191	141.6 Å²	141.6	89%	0.893	75%	0.75	S	S	*	*			trans	-144.6	159.7	150.4	-150.2	166.7	-146.4	0	0	110.9
1195	L	29.3	Very low	28.5	Very low	143 Å²	143	139.5 Å²	139.5	75%	0.749	75%	0.747	S	S	*	*			trans	-108.9	138.4	-162.7	-54.5	98.1	0	0	0	113.1
1196	H	29.3	Very low	28.5	Very low	180 Å²	180	141.8 Å²	141.8	83%	0.833	76%	0.757	S	S	*	*				-175.8	161.8	104.3	-111.6	-93.3	0	0	0	114.2
1197	L	25.2	Very low	28.5	Very low	150 Å²	150	140.3 Å²	140.3	79%	0.785	75%	0.751	S	S	*	*			trans	-66.9	172	171.9	-74.7	154.8	0	0	0	113.3
1198	P	32.9	Very low	28.4	Very low	108 Å²	108	144 Å²	144	70%	0.701	76%	0.757	S	S	*	*			cis	-135.9	155	3.3	22.2	3	0	0	0	118.5
1199	S	24.9	Very low	28.3	Very low	94 Å²	94	147.8 Å²	147.8	66%	0.657	77%	0.768	S	S	*	*			trans	29.1	132.7	142.3	71.6	0	0	0	0	125.2
1200	N	25.2	Very low	27.7	Very low	148 Å²	148	146 Å²	146	79%	0.791	77%	0.771	S	S	*	*			trans	63.7	106.2	131.8	-65	-13.9	0	0	0	122.8
1201	N	25.2	Very low	27.5	Very low	157 Å²	157	145.7 Å²	145.7	84%	0.84	77%	0.769	S	S	*	*			trans	64	160	142.6	-78.2	-17.7	0	0	0	120.6
1202	C	22.7	Very low	27.4	Very low	117 Å²	117	148.4 Å²	148.4	79%	0.791	78%	0.781	S	S	*	*			trans	68.7	95.2	175.1	-62.6	0	0	0	0	116.8
1203	I	25	Very low	27	Very low	147 Å²	147	146.9 Å²	146.9	75%	0.754	78%	0.778	S	S	*	*				16.2	122.9	115	-62.1	176.2	0	0	0	115.7
1204	D	25.9	Very low	26.8	Very low	143 Å²	143	147.1 Å²	147.1	77%	0.765	78%	0.775	S	S	*	*			trans	51.6	116.7	155	-51	-15.5	0	0	0	119.8
1205	S	25.5	Very low	27	Very low	94 Å²	94	145.9 Å²	145.9	66%	0.657	77%	0.769	S	S	*	*				-179.1	136.1	107.6	-75.6	0	0	0	0	112.8	I1207	S1205-I1207 VanDerWaalsContact O-CD1 3.31Å; S1205-I1207 WeakPolarHBondContact O-CD1 3.48Å; S1205-I1207 WeakPolarHBondContact O-CG1 3.08Å
1206	E	26.2	Very low	26.9	Very low	199 Å²	199	146.2 Å²	146.2	93%	0.93	77%	0.771	S	S	*	*			trans	-111.4	102.5	130.2	-79.3	-161.3	127.1	0	0	106.4
1207	I	28.7	Very low	26.8	Very low	118 Å²	118	146.7 Å²	146.7	61%	0.605	77%	0.771	S	S	*	*				95.9	93.2	55.1	-72	165	0	0	0	111.5	S1205	S1205-I1207 VanDerWaalsContact O-CD1 3.31Å; S1205-I1207 WeakPolarHBondContact O-CD1 3.48Å; S1205-I1207 WeakPolarHBondContact O-CG1 3.08Å
1208	Q	29.1	Very low	27.1	Very low	177 Å²	177	144.3 Å²	144.3	83%	0.827	76%	0.764	S	S	*	*				179.4	136.8	127.6	-97.5	158.3	79.1	0	0	109.4
1209	K	28	Very low	26.6	Very low	192 Å²	192	146.2 Å²	146.2	84%	0.835	77%	0.768	S	S	*	*			cis	-129.3	162.5	8.3	-67.6	-176.7	176	178.6	0	112.6
1210	S	23.5	Very low	26.7	Very low	98 Å²	98	150.9 Å²	150.9	69%	0.685	78%	0.78	S	S	*	*			trans	-73.8	159	163.3	56.6	0	0	0	0	112
1211	D	28.8	Very low	26.7	Very low	139 Å²	139	148.9 Å²	148.9	74%	0.743	78%	0.776	S	S	*	*				-167.5	138.3	103.1	-100.8	7.4	0	0	0	115.7
1212	K	30.7	Very low	26.7	Very low	197 Å²	197	146.2 Å²	146.2	86%	0.857	78%	0.776	S	S	*	*			trans	51.3	126.9	158.3	-64.7	-166.1	174.5	-173.6	0	123.4
1213	L	23.1	Very low	26.8	Very low	163 Å²	163	150.4 Å²	150.4	85%	0.853	78%	0.781	S	S	*	*			trans	-73	143.5	159.2	176.9	79.4	0	0	0	111.6
1214	D	26.5	Very low	26.8	Very low	135 Å²	135	151.3 Å²	151.3	72%	0.722	78%	0.782	S	S	*	*			trans	-166.2	157	132.1	-125.8	-36.2	0	0	0	114.6
1215	Q	30.9	Very low	26.7	Very low	165 Å²	165	156.2 Å²	156.2	77%	0.771	79%	0.79	S	S	*	*			trans	64	118.6	175.5	-61.6	171.7	69.5	0	0	116.4
1216	L	27.5	Very low	26.6	Very low	150 Å²	150	160.2 Å²	160.2	79%	0.785	80%	0.803	S	S	*	*				64.3	123.1	61.5	-58.6	167	0	0	0	112.1
1217	K	26.6	Very low	26.5	Very low	190 Å²	190	156.3 Å²	156.3	83%	0.826	79%	0.793	S	S	*	*			cis	-148.4	174.6	6.5	-114.6	-171	176.1	-179.4	0	110.6
1218	P	31.5	Very low	26.3	Very low	99 Å²	99	162.1 Å²	162.1	64%	0.643	81%	0.807	S	S	*	*			trans	-99.1	-175.3	-159	41.2	-41.2	0	0	0	117.1
1219	D	23.3	Very low	26	Very low	148 Å²	148	158.8 Å²	158.8	79%	0.791	80%	0.804	S	S	*	*			trans	75.3	99.2	155.5	-56	-38.9	0	0	0	120.5
1220	Q	27.6	Very low	25.9	Very low	193 Å²	193	155.9 Å²	155.9	90%	0.902	80%	0.802	S	S	*	*				-154.9	155.6	110.2	-116	179.1	11	0	0	115.5
1221	C	24.9	Very low	25.9	Very low	105 Å²	105	157.9 Å²	157.9	71%	0.709	81%	0.805	S	S	*	*			trans	-34.2	137.4	-175.7	-58.2	0	0	0	0	117.1	F1223	C1221-F1223 PolarHBondContact O-N 2.77Å
1222	A	25.4	Very low	25.8	Very low	102 Å²	102	157.1 Å²	157.1	84%	0.843	81%	0.808	S	S	*	*				61.4	37.7	58.6	0	0	0	0	0	115.3
1223	F	23.9	Very low	25.6	Very low	204 Å²	204	153.3 Å²	153.3	90%	0.895	79%	0.791	S	S	*	*			trans	-130	22.3	167.8	-137.6	-91.8	0	0	0	116	C1221	C1221-F1223 PolarHBondContact O-N 2.77Å
1224	E	24.4	Very low	26	Very low	166 Å²	166	150.8 Å²	150.8	78%	0.776	78%	0.775	S	S	*	*	S	Bend	trans	-134.2	32	-177.6	-144.1	-178.5	-160.7	0	0	115.9
1225	R	24.6	Very low	26.3	Very low	246 Å²	246	148.8 Å²	148.8	93%	0.928	77%	0.768	S	S	*	*	S	Bend	trans	-114	6.7	174.1	-79.4	-171.8	176	176.8	0.5	116.2
1226	L	24.5	Very low	26.6	Very low	178 Å²	178	145 Å²	145	93%	0.932	75%	0.753	S	S	*	*	S	Bend	trans	-101.5	6.6	174.7	-145.6	74.9	0	0	0	114.5
1227	T	23.7	Very low	27.1	Very low	117 Å²	117	142.3 Å²	142.3	72%	0.718	75%	0.745	S	S	*	*	S	Bend	trans	-114.7	8.4	-174.7	44.5	0	0	0	0	114.1
1228	R	24	Very low	27.6	Very low	240 Å²	240	138.2 Å²	138.2	91%	0.906	74%	0.736	S	S	*	*	S	Bend	trans	-134.6	34.8	-176.2	-138.9	179.9	-160.1	-164.9	7.2	115
1229	S	23	Very low	27.7	Very low	108 Å²	108	135.1 Å²	135.1	76%	0.755	71%	0.713	S	S	*	*			trans	-135	62.2	179.6	-175.7	0	0	0	0	113.4
1230	T	24.8	Very low	28.5	Very low	131 Å²	131	130.8 Å²	130.8	80%	0.804	69%	0.692	S	S	*	*			trans	-137.3	59.6	172	44.5	0	0	0	0	111.9	P1232	T1230-P1232 VanDerWaalsContact O-CD 3.29Å; T1230-P1232 WeakPolarHBondContact O-CD 3.33Å
1231	N	24.3	Very low	29.1	Very low	140 Å²	140	124.6 Å²	124.6	75%	0.749	67%	0.667	S	S	*	*			trans	-89.7	109	165.7	-91.2	-17.5	0	0	0	109.7	K1233	N1231-K1233 PolarHBondContact O-N 3.21Å
1232	P	27.3	Very low	29.7	Very low	123 Å²	123	120.9 Å²	120.9	80%	0.799	64%	0.644	S	S	*	*			trans	-83.1	78.7	178.4	33.9	-34.9	0	0	0	111.1	T1230	T1230-P1232 VanDerWaalsContact O-CD 3.29Å; T1230-P1232 WeakPolarHBondContact O-CD 3.33Å
1233	K	26.9	Very low	30.3	Very low	117 Å²	117	116.8 Å²	116.8	51%	0.509	61%	0.608	S	S	.	*			trans	-142.2	138.9	165.2	-65.6	-173.3	-175.9	-177.1	0	108	N1231	N1231-K1233 PolarHBondContact O-N 3.21Å
1234	E	30.7	Very low	30.9	Very low	109 Å²	109	112.4 Å²	112.4	51%	0.509	59%	0.591	S	S	.	*			cis	-118.5	135.2	5.4	-62.6	-172.2	154.7	0	0	112	P944	P944-E1234 VanDerWaalsContact CD-OE2 3.27Å; P944-E1234 WeakPolarHBondContact CD-OE2 3.28Å
1235	T	31.8	Very low	31.6	Very low	94 Å²	94	109.3 Å²	109.3	58%	0.577	58%	0.576	S	S	*	*	S	Bend	trans	-134.6	139.6	150	39.1	0	0	0	0	105.7	P1237 V1240	T1235-P1237 VanDerWaalsContact O-CD 3.29Å; T1235-P1237 WeakPolarHBondContact O-CD 3.06Å; T1235-V1240 HydrophobicContact CG2-CG2 4.35Å; T1235-V1240 WeakPolarHBondContact OG1-CG2 3.39Å
1236	N	38.7	Very low	32.2	Very low	84 Å²	84	98.2 Å²	98.2	45%	0.449	54%	0.536	S	S	.	.			trans	-52.1	113.1	-176	-105.8	-77.9	0	0	0	109.4	T1238 M1239 V1240	N1236-T1238 PolarHBondContact O-N 3.02Å; N1236-M1239 HydrophobicContact CB-CB 3.6Å; N1236-M1239 CarbonylContact O-C 3.57Å; N1236-M1239 WeakPolarHBondContact O-CA 3.37Å; N1236-M1239 PolarHBondContact O-N 3.09Å; N1236-V1240 PolarHBondContact O-N 3.22Å
1237	P	37.7	Very low	32.6	Very low	95 Å²	95	92.9 Å²	92.9	62%	0.617	51%	0.508	S	S	*	.	H	α-helix	trans	-67.6	-28	-168.8	24.5	-33.4	0	0	0	111.4	T1235 T1241	T1235-P1237 VanDerWaalsContact O-CD 3.29Å; T1235-P1237 WeakPolarHBondContact O-CD 3.06Å; P1237-T1241 WeakPolarHBondContact O-CA 3.39Å; P1237-T1241 WeakPolarHBondContact O-CB 3.14Å; P1237-T1241 PolarHBondContact O-N 3.01Å; P1237-T1241 PolarHBondContact O-OG1 2.69Å
1238	T	36.1	Very low	33.1	Very low	104 Å²	104	89.1 Å²	89.1	64%	0.638	48%	0.483	S	S	*	.	H	α-helix	trans	-68.4	-34.9	167.3	38.7	0	0	0	0	113.1	N1236 A1242	N1236-T1238 PolarHBondContact O-N 3.02Å; T1238-A1242 WeakPolarHBondContact O-CA 3.43Å; T1238-A1242 WeakPolarHBondContact O-CB 3.29Å; T1238-A1242 PolarHBondContact O-N 3.04Å
1239	M	35.1	Very low	33.6	Very low	34 Å²	34	79.8 Å²	79.8	17%	0.167	46%	0.458	C	S	.	.	H	α-helix	trans	-77.6	-42.6	176.9	-169.1	172.3	75.8	0	0	111.7	T973 N1236 T1241 A1242 V1243	T973-M1239 HydrophobicContact CG2-CE 3.57Å; T973-M1239 HydrophobicContact CG2-SD 3.66Å; N1236-M1239 HydrophobicContact CB-CB 3.6Å; N1236-M1239 CarbonylContact O-C 3.57Å; N1236-M1239 WeakPolarHBondContact O-CA 3.37Å; N1236-M1239 PolarHBondContact O-N 3.09Å; M1239-T1241 VanDerWaalsContact C-N 3.33Å; M1239-A1242 CarbonylContact O-C 3.46Å; M1239-A1242 PolarHBondContact O-N 3.5Å; M1239-V1243 HydrophobicContact CG-CG2 4.32Å; M1239-V1243 WeakPolarHBondContact O-CB 3.25Å; M1239-V1243 VanDerWaalsContact O-CG2 3.25Å; M1239-V1243 WeakPolarHBondContact O-CG2 3.25Å; M1239-V1243 PolarHBondContact O-N 3.09Å
1240	V	38.4	Very low	34.2	Very low	57 Å²	57	76.6 Å²	76.6	35%	0.345	44%	0.438	S	S	.	.	H	α-helix	trans	-65.8	-38	171.3	170.1	0	0	0	0	110.6	T1235 N1236 Q1244	T1235-V1240 HydrophobicContact CG2-CG2 4.35Å; T1235-V1240 WeakPolarHBondContact OG1-CG2 3.39Å; N1236-V1240 PolarHBondContact O-N 3.22Å; V1240-Q1244 WeakPolarHBondContact O-CA 3.24Å; V1240-Q1244 WeakPolarHBondContact O-CB 3.36Å; V1240-Q1244 PolarHBondContact O-N 3.49Å
1241	T	40.8	Very low	34.7	Very low	63 Å²	63	73.6 Å²	73.6	39%	0.387	42%	0.419	S	S	.	.	H	α-helix	trans	-67.5	-33.7	171.4	-58.9	0	0	0	0	111.9	P1237 M1239 Q1245	P1237-T1241 WeakPolarHBondContact O-CA 3.39Å; P1237-T1241 WeakPolarHBondContact O-CB 3.14Å; P1237-T1241 PolarHBondContact O-N 3.01Å; P1237-T1241 PolarHBondContact O-OG1 2.69Å; M1239-T1241 VanDerWaalsContact C-N 3.33Å; T1241-Q1245 HydrophobicContact CG2-CG 4.17Å; T1241-Q1245 WeakPolarHBondContact O-CA 3.01Å; T1241-Q1245 WeakPolarHBondContact O-CB 3.47Å; T1241-Q1245 WeakPolarHBondContact O-CG 3.36Å; T1241-Q1245 PolarHBondContact O-N 3.28Å
1242	A	38.5	Very low	34.9	Very low	26 Å²	26	67.6 Å²	67.6	22%	0.215	39%	0.391	C	S	.	.	H	α-helix	trans	-77.6	-33.8	177.3	0	0	0	0	0	113.1	T1238 M1239 S1246	T1238-A1242 WeakPolarHBondContact O-CA 3.43Å; T1238-A1242 WeakPolarHBondContact O-CB 3.29Å; T1238-A1242 PolarHBondContact O-N 3.04Å; M1239-A1242 CarbonylContact O-C 3.46Å; M1239-A1242 PolarHBondContact O-N 3.5Å; A1242-S1246 WeakPolarHBondContact O-CA 3.39Å; A1242-S1246 WeakPolarHBondContact O-CB 3.48Å; A1242-S1246 PolarHBondContact O-N 3Å; A1242-S1246 PolarHBondContact O-OG 2.89Å
1243	V	37.1	Very low	35.2	Very low	17 Å²	17	62.9 Å²	62.9	10%	0.103	36%	0.36	C	S	.	.	H	α-helix	trans	-70.4	-41.4	169.7	172.9	0	0	0	0	109.2	V715 M1239 S1246 L1247	V715-V1243 HydrophobicContact CG1-CG1 4.39Å; V715-V1243 HydrophobicContact CG1-CG2 4.18Å; M1239-V1243 HydrophobicContact CG-CG2 4.32Å; M1239-V1243 WeakPolarHBondContact O-CB 3.25Å; M1239-V1243 VanDerWaalsContact O-CG2 3.25Å; M1239-V1243 WeakPolarHBondContact O-CG2 3.25Å; M1239-V1243 PolarHBondContact O-N 3.09Å; V1243-S1246 CarbonylContact O-C 3.55Å; V1243-S1246 PolarHBondContact O-N 2.88Å; V1243-L1247 WeakPolarHBondContact O-CB 3.17Å; V1243-L1247 PolarHBondContact O-N 2.04Å
1244	Q	37.4	Very low	35.4	Very low	111 Å²	111	63.8 Å²	63.8	52%	0.519	37%	0.369	S	S	.	.	H	α-helix	trans	-66.3	-42.2	173.9	-173.9	178.3	4.7	0	0	111.6	V1240 L1247 I1248	V1240-Q1244 WeakPolarHBondContact O-CA 3.24Å; V1240-Q1244 WeakPolarHBondContact O-CB 3.36Å; V1240-Q1244 PolarHBondContact O-N 3.49Å; Q1244-L1247 PolarHBondContact O-N 3.42Å; Q1244-I1248 HydrophobicContact CG-CD1 4.02Å; Q1244-I1248 WeakPolarHBondContact O-CB 3.19Å; Q1244-I1248 WeakPolarHBondContact O-CD1 3.5Å; Q1244-I1248 WeakPolarHBondContact O-CG1 3.05Å; Q1244-I1248 PolarHBondContact O-N 3.02Å
1245	Q	39.3	Very low	35.4	Very low	102 Å²	102	62 Å²	62	48%	0.477	37%	0.373	S	S	.	.	H	α-helix	trans	-68.3	-37.7	174.1	-78.9	178.4	7.7	0	0	111.9	T1241 I1248 A1249	T1241-Q1245 HydrophobicContact CG2-CG 4.17Å; T1241-Q1245 WeakPolarHBondContact O-CA 3.01Å; T1241-Q1245 WeakPolarHBondContact O-CB 3.47Å; T1241-Q1245 WeakPolarHBondContact O-CG 3.36Å; T1241-Q1245 PolarHBondContact O-N 3.28Å; Q1245-I1248 CarbonylContact O-C 3.44Å; Q1245-I1248 WeakPolarHBondContact O-CA 3.44Å; Q1245-I1248 WeakPolarHBondContact O-CB 3.15Å; Q1245-I1248 PolarHBondContact O-N 3.39Å; Q1245-A1249 WeakPolarHBondContact O-CB 3.19Å; Q1245-A1249 PolarHBondContact O-N 2.79Å
1246	S	35.3	Very low	35.5	Very low	13 Å²	13	59.4 Å²	59.4	9%	0.091	35%	0.352	C	S	.	.	H	α-helix	trans	-76.7	-25.3	176	-64.8	0	0	0	0	112.5	S718 A1242 V1243 A1249 A1250	S718-S1246 PolarHBondContact OG-OG 3.29Å; S718-S1246 VanDerWaalsContact OG-OG 3.13Å; A1242-S1246 WeakPolarHBondContact O-CA 3.39Å; A1242-S1246 WeakPolarHBondContact O-CB 3.48Å; A1242-S1246 PolarHBondContact O-N 3Å; A1242-S1246 PolarHBondContact O-OG 2.89Å; V1243-S1246 CarbonylContact O-C 3.55Å; V1243-S1246 PolarHBondContact O-N 2.88Å; S1246-A1249 CarbonylContact O-C 3.6Å; S1246-A1249 PolarHBondContact O-N 3.06Å; S1246-A1250 WeakPolarHBondContact O-CB 3.35Å; S1246-A1250 PolarHBondContact O-N 3.19Å
1247	L	33.3	Very low	35.5	Very low	66 Å²	66	58.1 Å²	58.1	35%	0.346	35%	0.345	S	S	.	.	H	α-helix	trans	-73.4	-35.3	165.5	-157.8	77.7	0	0	0	110.3	V1243 Q1244 A1249 V1251	V1243-L1247 WeakPolarHBondContact O-CB 3.17Å; V1243-L1247 PolarHBondContact O-N 2.04Å; Q1244-L1247 PolarHBondContact O-N 3.42Å; L1247-A1249 PolarHBondContact O-N 3.09Å; L1247-V1251 HydrophobicContact CD1-CG2 3.92Å; L1247-V1251 HydrophobicContact CG-CG2 4.06Å; L1247-V1251 CarbonylContact O-C 3.1Å; L1247-V1251 VanDerWaalsContact O-CA 3.3Å; L1247-V1251 WeakPolarHBondContact O-CA 3.25Å; L1247-V1251 WeakPolarHBondContact O-CB 3.18Å; L1247-V1251 PolarHBondContact O-N 3.18Å
1248	I	35.3	Very low	35.3	Very low	37 Å²	37	58.2 Å²	58.2	19%	0.19	35%	0.354	C	S	.	.	H	α-helix	trans	-71.9	-4.4	167.8	-73.9	167.8	0	0	0	112.5	Q1244 Q1245 G1252 P1253 I1254 Q1555	Q1244-I1248 HydrophobicContact CG-CD1 4.02Å; Q1244-I1248 WeakPolarHBondContact O-CB 3.19Å; Q1244-I1248 WeakPolarHBondContact O-CD1 3.5Å; Q1244-I1248 WeakPolarHBondContact O-CG1 3.05Å; Q1244-I1248 PolarHBondContact O-N 3.02Å; Q1245-I1248 CarbonylContact O-C 3.44Å; Q1245-I1248 WeakPolarHBondContact O-CA 3.44Å; Q1245-I1248 WeakPolarHBondContact O-CB 3.15Å; Q1245-I1248 PolarHBondContact O-N 3.39Å; I1248-G1252 WeakPolarHBondContact O-CA 3.16Å; I1248-P1253 HydrophobicContact CG2-CG 3.92Å; I1248-P1253 WeakPolarHBondContact O-CD 3.48Å; I1248-I1254 WeakPolarHBondContact O-CD1 3.17Å; I1248-I1254 WeakPolarHBondContact O-CG1 3.44Å; I1248-Q1555 HydrophobicContact CD1-CG 4.32Å
1249	A	34.1	Very low	35.4	Very low	44 Å²	44	57.8 Å²	57.8	36%	0.364	35%	0.351	S	S	.	.	H	α-helix	trans	-105.8	-40.4	169.2	0	0	0	0	0	112.4	L714 Q1245 S1246 L1247 I1254	L714-A1249 HydrophobicContact CD1-CB 4.31Å; Q1245-A1249 WeakPolarHBondContact O-CB 3.19Å; Q1245-A1249 PolarHBondContact O-N 2.79Å; S1246-A1249 CarbonylContact O-C 3.6Å; S1246-A1249 PolarHBondContact O-N 3.06Å; L1247-A1249 PolarHBondContact O-N 3.09Å; A1249-I1254 HydrophobicContact CB-CD1 4.35Å
1250	A	34.9	Very low	35.9	Very low	41 Å²	41	59.1 Å²	59.1	34%	0.339	37%	0.374	S	S	.	.	H	α-helix	trans	-70.9	-52.3	177.5	0	0	0	0	0	112.5	S1246 G1252	S1246-A1250 WeakPolarHBondContact O-CB 3.35Å; S1246-A1250 PolarHBondContact O-N 3.19Å; A1250-G1252 VanDerWaalsContact C-N 3.28Å
1251	V	35.1	Very low	37	Very low	69 Å²	69	57.2 Å²	57.2	42%	0.418	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	45.5	177.1	-163.6	0	0	0	0	107.8	L1247 P1253	L1247-V1251 HydrophobicContact CD1-CG2 3.92Å; L1247-V1251 HydrophobicContact CG-CG2 4.06Å; L1247-V1251 CarbonylContact O-C 3.1Å; L1247-V1251 VanDerWaalsContact O-CA 3.3Å; L1247-V1251 WeakPolarHBondContact O-CA 3.25Å; L1247-V1251 WeakPolarHBondContact O-CB 3.18Å; L1247-V1251 PolarHBondContact O-N 3.18Å; V1251-P1253 WeakPolarHBondContact O-CD 3.49Å
1252	G	28.7	Very low	38.5	Very low	14 Å²	14	57.7 Å²	57.7	14%	0.144	37%	0.365	C	S	.	.			trans	-70.9	127.3	-154.6	0	0	0	0	0	114.8	I1248 A1250 I1254 A1255	I1248-G1252 WeakPolarHBondContact O-CA 3.16Å; A1250-G1252 VanDerWaalsContact C-N 3.28Å; G1252-I1254 PolarHBondContact O-N 3.32Å; G1252-A1255 PolarHBondContact O-N 3.07Å
1253	P	34.1	Very low	40.6	Very low	24 Å²	24	57.1 Å²	57.1	16%	0.156	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-60.1	-6.9	157.3	27	-35.7	0	0	0	113	I1248 V1251 A1255 W1256 V1554	I1248-P1253 HydrophobicContact CG2-CG 3.92Å; I1248-P1253 WeakPolarHBondContact O-CD 3.48Å; V1251-P1253 WeakPolarHBondContact O-CD 3.49Å; P1253-A1255 PolarHBondContact O-N 3.12Å; P1253-A1255 VanDerWaalsContact O-N 3.09Å; P1253-W1256 PolarHBondContact O-N 3.03Å; P1253-W1256 VanDerWaalsContact O-N 3.09Å; P1253-V1554 HydrophobicContact CB-CB 3.91Å; P1253-V1554 HydrophobicContact CB-CG1 3.58Å
1254	I	30.6	Very low	42.9	Very low	136 Å²	136	57.7 Å²	57.7	70%	0.697	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-54.8	-18.6	174.6	-60.2	-177.2	0	0	0	113.2	I1248 A1249 G1252	I1248-I1254 WeakPolarHBondContact O-CD1 3.17Å; I1248-I1254 WeakPolarHBondContact O-CG1 3.44Å; A1249-I1254 HydrophobicContact CB-CD1 4.35Å; G1252-I1254 PolarHBondContact O-N 3.32Å
1255	A	31.2	Very low	45.3	Very low	72 Å²	72	52.4 Å²	52.4	60%	0.595	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-98.8	-10.4	176.4	0	0	0	0	0	115.4	G1252 P1253	G1252-A1255 PolarHBondContact O-N 3.07Å; P1253-A1255 PolarHBondContact O-N 3.12Å; P1253-A1255 VanDerWaalsContact O-N 3.09Å
1256	W	34	Very low	47.5	Very low	38 Å²	38	47.7 Å²	47.7	14%	0.144	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-15.1	-156.1	-139.6	57.5	0	0	0	118	P1253 L1599 L1757 H1758 L1761	P1253-W1256 PolarHBondContact O-N 3.03Å; P1253-W1256 VanDerWaalsContact O-N 3.09Å; W1256-L1599 HydrophobicContact CH2-CD2 4.14Å; W1256-L1757 HydrophobicContact CH2-CB 4.22Å; W1256-L1757 HydrophobicContact CZ2-CB 4.44Å; W1256-L1757 WeakPolarHBondContact CZ2-O 3.46Å; W1256-H1758 WeakPolarHBondContact CB-NE2 3.12Å; W1256-H1758 AromaticContact CD1-CD2 3.23Å; W1256-H1758 AromaticContact CD1-CG 3.69Å; W1256-H1758 AromaticContact CD1-NE2 3.46Å; W1256-H1758 HydrophobicContact CD2-CB 4.38Å; W1256-H1758 AromaticContact CD2-CD2 3.57Å; W1256-H1758 VanDerWaalsContact CE2-CA 3.46Å; W1256-H1758 AromaticContact CG-CD2 3.13Å; W1256-H1758 AromaticContact CG-CG 3.97Å; W1256-H1758 AromaticContact CG-NE2 3.51Å; W1256-H1758 HydrophobicContact CZ2-CB 4.41Å; W1256-H1758 AromaticContact NE1-CD2 3.75Å; W1256-H1758 AromaticContact NE1-CG 3.81Å; W1256-H1758 PolarHBondContact NE1-O 2.67Å; W1256-H1758 VanDerWaalsContact NE1-O 3.11Å; W1256-L1761 HydrophobicContact CD2-CD2 4.43Å; W1256-L1761 HydrophobicContact CZ2-CB 3.69Å; W1256-L1761 HydrophobicContact CZ2-CD2 3.6Å; W1256-L1761 HydrophobicContact CZ2-CG 4.26Å
1257	L	39	Very low	50	Low	57 Å²	57	47 Å²	47	30%	0.298	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	36.8	178.3	-68.3	-176	0	0	0	113.4	T1259 G1261 V1554	L1257-T1259 CarbonylContact O-C 3.54Å; L1257-T1259 PolarHBondContact O-N 2.92Å; L1257-G1261 WeakPolarHBondContact CD1-O 3.38Å; L1257-G1261 WeakPolarHBondContact CD2-O 3.15Å; L1257-V1554 HydrophobicContact CD1-CG2 3.74Å; L1257-V1554 HydrophobicContact CG-CG2 3.98Å
1258	A	32.6	Very low	52.4	Low	98 Å²	98	44.5 Å²	44.5	81%	0.81	30%	0.295	S	S	*	.	S	Bend	trans	-54.8	-15.3	166.1	0	0	0	0	0	113.4
1259	T	38.4	Very low	54.7	Low	94 Å²	94	48.9 Å²	48.9	58%	0.577	31%	0.31	S	S	*	.	S	Bend	trans	-127.7	118.1	153	60.1	0	0	0	0	109.1	L1257 G1261 R1738	L1257-T1259 CarbonylContact O-C 3.54Å; L1257-T1259 PolarHBondContact O-N 2.92Å; T1259-G1261 PolarHBondContact O-N 2.85Å; T1259-R1738 PolarHBondContact O-NH2 3.42Å; T1259-R1738 PolarHBondContact OG1-NH2 3.37Å; T1259-R1738 VanDerWaalsContact OG1-NH2 3.09Å
1260	G	46.2	Very low	57	Low	62 Å²	62	52.5 Å²	52.5	64%	0.639	32%	0.323	S	S	*	.			trans	-56.5	132.1	-168.3	0	0	0	0	0	115	R1738	G1260-R1738 VanDerWaalsContact O-CZ 3.25Å; G1260-R1738 PolarHBondContact O-NH2 2.93Å
1261	G	61.3	Low	59.4	Low	17 Å²	17	51.4 Å²	51.4	18%	0.175	31%	0.311	C	S	.	.			trans	-148.7	108.7	179.1	0	0	0	0	0	109.7	L1257 T1259	L1257-G1261 WeakPolarHBondContact CD1-O 3.38Å; L1257-G1261 WeakPolarHBondContact CD2-O 3.15Å; T1259-G1261 PolarHBondContact O-N 2.85Å
1262	M	71.7	Confident	61.8	Low	74 Å²	74	48.1 Å²	48.1	37%	0.365	29%	0.291	S	S	.	.			trans	-73.5	149.5	-180	-63	179.9	-58.7	0	0	110.6	Y1264 C1549 L1550	M1262-Y1264 HydrophobicContact CB-CE2 4.08Å; M1262-Y1264 HydrophobicContact CE-CE1 4.31Å; M1262-Y1264 VanDerWaalsContact CE-OH 3.29Å; M1262-Y1264 WeakPolarHBondContact CE-OH 3.46Å; M1262-Y1264 VanDerWaalsContact O-CD2 3.28Å; M1262-Y1264 WeakPolarHBondContact O-CD2 3.33Å; M1262-Y1264 WeakPolarHBondContact O-CE2 3.3Å; M1262-C1549 VanDerWaalsContact SD-SG 3.65Å; M1262-L1550 WeakPolarHBondContact CB-O 3.41Å
1263	L	82.4	Confident	64.4	Low	13 Å²	13	49.4 Å²	49.4	7%	0.068	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	141.2	169.1	-164.2	67.2	0	0	0	109.6	L1550 Q1561 T1595 I1597	L1263-L1550 HydrophobicContact CB-CB 4.39Å; L1263-L1550 HydrophobicContact CB-CD1 4.46Å; L1263-L1550 HydrophobicContact CD2-CD1 4.29Å; L1263-L1550 PolarHBondContact N-O 2.82Å; L1263-L1550 PolarHBondContact O-N 3.04Å; L1263-Q1561 HydrophobicContact CD2-CB 4.08Å; L1263-Q1561 HydrophobicContact CD2-CG 4.04Å; L1263-T1595 HydrophobicContact CD1-CG2 3.59Å; L1263-T1595 HydrophobicContact CD2-CG2 4.15Å; L1263-T1595 HydrophobicContact CG-CG2 3.92Å; L1263-I1597 HydrophobicContact CD1-CG1 3.73Å
1264	Y	85.1	Confident	66.7	Low	30 Å²	30	50.1 Å²	50.1	12%	0.118	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	160.5	176.9	-50.6	-101.1	0	0	0	111.2	M1262 L1547 V1548 C1549 T1595 L1596 L1732	M1262-Y1264 HydrophobicContact CB-CE2 4.08Å; M1262-Y1264 HydrophobicContact CE-CE1 4.31Å; M1262-Y1264 VanDerWaalsContact CE-OH 3.29Å; M1262-Y1264 WeakPolarHBondContact CE-OH 3.46Å; M1262-Y1264 VanDerWaalsContact O-CD2 3.28Å; M1262-Y1264 WeakPolarHBondContact O-CD2 3.33Å; M1262-Y1264 WeakPolarHBondContact O-CE2 3.3Å; Y1264-L1547 HydrophobicContact CD1-CD2 3.97Å; Y1264-L1547 HydrophobicContact CD1-CG 4.21Å; Y1264-L1547 HydrophobicContact CE1-CD2 4.49Å; Y1264-V1548 CarbonylContact C-O 3.47Å; Y1264-V1548 WeakPolarHBondContact CA-O 3.4Å; Y1264-V1548 WeakPolarHBondContact CB-O 3.48Å; Y1264-C1549 HydrophobicContact CD1-CB 3.67Å; Y1264-C1549 HydrophobicContact CE1-CB 3.84Å; Y1264-C1549 WeakPolarHBondContact CE1-SG 3.29Å; Y1264-T1595 CarbonylContact O-C 3.4Å; Y1264-T1595 WeakPolarHBondContact O-CA 3.37Å; Y1264-L1596 PolarHBondContact N-O 2.93Å; Y1264-L1596 PolarHBondContact O-N 3.25Å; Y1264-L1732 HydrophobicContact CD1-CD2 3.72Å; Y1264-L1732 HydrophobicContact CD2-CD2 3.71Å; Y1264-L1732 HydrophobicContact CE1-CD2 3.45Å; Y1264-L1732 VanDerWaalsContact CE1-CD2 3.45Å; Y1264-L1732 HydrophobicContact CE2-CD2 3.46Å; Y1264-L1732 VanDerWaalsContact CE2-CD2 3.46Å; Y1264-L1732 HydrophobicContact CG-CD2 3.83Å
1265	M	87.7	Confident	69.3	Low	0 Å²	0	44 Å²	44	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	146	173.6	-66.1	168.9	-68.1	0	0	110.9	V1267 V1548 L1550 Q1561 I1564 L1593 A1594	M1265-V1267 HydrophobicContact CB-CG2 4.18Å; M1265-V1548 HydrophobicContact CB-CB 4.5Å; M1265-V1548 HydrophobicContact CE-CB 4.29Å; M1265-V1548 HydrophobicContact CE-CG1 4.08Å; M1265-V1548 PolarHBondContact N-O 3.24Å; M1265-V1548 PolarHBondContact O-N 2.97Å; M1265-L1550 HydrophobicContact CE-CD1 3.72Å; M1265-L1550 HydrophobicContact CE-CD2 4.17Å; M1265-L1550 HydrophobicContact CE-CG 4.06Å; M1265-Q1561 HydrophobicContact SD-CG 3.85Å; M1265-I1564 HydrophobicContact CE-CB 4.29Å; M1265-I1564 HydrophobicContact CE-CD1 3.57Å; M1265-I1564 HydrophobicContact CE-CG2 4.01Å; M1265-I1564 HydrophobicContact SD-CG2 4.15Å; M1265-L1593 HydrophobicContact CG-CD2 4.43Å; M1265-L1593 HydrophobicContact SD-CD2 3.78Å; M1265-A1594 CarbonylContact C-O 3.2Å; M1265-A1594 WeakPolarHBondContact CA-O 3.25Å
1266	R	86.4	Confident	71.9	Confident	2 Å²	2	43 Å²	43	1%	0.008	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	130.4	161.5	-44.6	-168.7	-172.8	-136.5	8.6	108.6	I1301 S1302 P1303 Y1545 L1593 A1594 L1596 E1742	R1266-I1301 HydrophobicContact CB-CD1 3.87Å; R1266-I1301 HydrophobicContact CG-CD1 3.69Å; R1266-S1302 PolarHBondContact NH1-O 3.14Å; R1266-S1302 PolarHBondContact NH1-OG 3.35Å; R1266-P1303 PolarHBondContact NH1-O 3.43Å; R1266-Y1545 HydrophobicContact CB-CD1 4.16Å; R1266-L1593 WeakPolarHBondContact O-CD1 3.38Å; R1266-A1594 HydrophobicContact CB-CB 4Å; R1266-A1594 HydrophobicContact CG-CB 4Å; R1266-A1594 PolarHBondContact N-O 2.85Å; R1266-L1596 HydrophobicContact CG-CD1 3.73Å; R1266-E1742 IonicContact CZ-OE2 2.66Å; R1266-E1742 IonicContact NE-OE1 2.67Å; R1266-E1742 IonicContact NE-OE2 3.64Å; R1266-E1742 PolarHBondContact NE-OE2 3.35Å; R1266-E1742 IonicContact NH2-OE1 3.79Å; R1266-E1742 IonicContact NH2-OE2 3.03Å; R1266-E1742 PolarHBondContact NH2-OE2 3.46Å
1267	V	86.9	Confident	74.3	Confident	0 Å²	0	42 Å²	42	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	137.8	-177.3	175	0	0	0	0	107.3	M1265 E1271 A1272 L1275 Y1545 R1546 V1548 L1568	M1265-V1267 HydrophobicContact CB-CG2 4.18Å; V1267-E1271 HydrophobicContact CG1-CB 3.37Å; V1267-E1271 HydrophobicContact CG1-CG 4.44Å; V1267-E1271 WeakPolarHBondContact CG1-OE2 3Å; V1267-A1272 HydrophobicContact CG1-CB 4.04Å; V1267-L1275 HydrophobicContact CG1-CD1 3.99Å; V1267-Y1545 CarbonylContact O-C 3.46Å; V1267-Y1545 WeakPolarHBondContact O-CA 3.49Å; V1267-R1546 PolarHBondContact N-O 3.09Å; V1267-R1546 PolarHBondContact O-N 2.8Å; V1267-V1548 HydrophobicContact CB-CG2 4.01Å; V1267-V1548 HydrophobicContact CG2-CB 4.46Å; V1267-V1548 HydrophobicContact CG2-CG2 3.63Å; V1267-L1568 HydrophobicContact CG1-CD1 4.12Å; V1267-L1568 HydrophobicContact CG2-CD1 4.24Å
1268	S	84.6	Confident	76.3	Confident	12 Å²	12	43.8 Å²	43.8	8%	0.084	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	159.6	-179.6	77.3	0	0	0	0	111.7	N1270 E1271 A1272	S1268-N1270 PolarHBondContact O-N 3.18Å; S1268-E1271 WeakPolarHBondContact CB-OE1 2.97Å; S1268-E1271 PolarHBondContact N-OE2 2.88Å; S1268-E1271 VanDerWaalsContact N-OE2 3.13Å; S1268-E1271 PolarHBondContact O-N 3Å; S1268-E1271 VanDerWaalsContact OG-CG 3.31Å; S1268-E1271 WeakPolarHBondContact OG-CG 3.3Å; S1268-E1271 PolarHBondContact OG-N 3.36Å; S1268-E1271 PolarHBondContact OG-OE1 3.32Å; S1268-A1272 VanDerWaalsContact O-CB 3.32Å; S1268-A1272 WeakPolarHBondContact O-CB 3.44Å; S1268-A1272 PolarHBondContact O-N 3.49Å
1269	Y	83.2	Confident	78.5	Confident	130 Å²	130	48.6 Å²	48.6	51%	0.51	29%	0.287	S	S	.	.	H	α-helix	trans	-51.8	-41.8	178	-171.4	-75	0	0	0	112.5	A1272 G1273 S1544	Y1269-A1272 PolarHBondContact O-N 2.9Å; Y1269-G1273 PolarHBondContact O-N 3.43Å; Y1269-S1544 WeakPolarHBondContact CB-O 3.1Å; Y1269-S1544 PolarHBondContact N-O 2.69Å
1270	N	83.1	Confident	80.6	Confident	120 Å²	120	44.6 Å²	44.6	64%	0.642	27%	0.265	S	S	*	.	H	α-helix	trans	-71.7	-44.3	-175.9	-64	-8	0	0	0	111.6	S1268 G1273 S1274	S1268-N1270 PolarHBondContact O-N 3.18Å; N1270-G1273 PolarHBondContact O-N 3.21Å; N1270-S1274 PolarHBondContact O-N 2.83Å; N1270-S1274 VanDerWaalsContact O-N 3.16Å
1271	E	85.5	Confident	82.4	Confident	18 Å²	18	44.3 Å²	44.3	8%	0.084	25%	0.253	C	S	.	.	H	α-helix	trans	-59.2	-46.5	172.3	-71.4	155.3	-128.4	0	0	111.3	V1267 S1268 G1273 S1274 L1275 L1568 L1571 H1572	V1267-E1271 HydrophobicContact CG1-CB 3.37Å; V1267-E1271 HydrophobicContact CG1-CG 4.44Å; V1267-E1271 WeakPolarHBondContact CG1-OE2 3Å; S1268-E1271 WeakPolarHBondContact CB-OE1 2.97Å; S1268-E1271 PolarHBondContact N-OE2 2.88Å; S1268-E1271 VanDerWaalsContact N-OE2 3.13Å; S1268-E1271 PolarHBondContact O-N 3Å; S1268-E1271 VanDerWaalsContact OG-CG 3.31Å; S1268-E1271 WeakPolarHBondContact OG-CG 3.3Å; S1268-E1271 PolarHBondContact OG-N 3.36Å; S1268-E1271 PolarHBondContact OG-OE1 3.32Å; E1271-G1273 VanDerWaalsContact C-N 3.34Å; E1271-G1273 PolarHBondContact O-N 3.28Å; E1271-S1274 WeakPolarHBondContact O-CA 3.06Å; E1271-S1274 WeakPolarHBondContact O-CB 3.39Å; E1271-S1274 PolarHBondContact O-N 3.36Å; E1271-L1275 WeakPolarHBondContact O-CG 2.99Å; E1271-L1275 PolarHBondContact O-N 3.06Å; E1271-L1568 HydrophobicContact CB-CD1 4.48Å; E1271-L1568 HydrophobicContact CB-CD2 3.67Å; E1271-L1568 HydrophobicContact CG-CD2 3.92Å; E1271-L1571 HydrophobicContact CG-CD2 4.38Å; E1271-H1572 IonicContact OE1-CE1 3.17Å
1272	A	84.2	Confident	83.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.2	-39.8	-179.9	0	0	0	0	0	112.1	V1267 S1268 Y1269 S1274 L1275 I1276 V1296 R1546	V1267-A1272 HydrophobicContact CG1-CB 4.04Å; S1268-A1272 VanDerWaalsContact O-CB 3.32Å; S1268-A1272 WeakPolarHBondContact O-CB 3.44Å; S1268-A1272 PolarHBondContact O-N 3.49Å; Y1269-A1272 PolarHBondContact O-N 2.9Å; A1272-S1274 VanDerWaalsContact C-N 3.32Å; A1272-S1274 PolarHBondContact O-N 3.17Å; A1272-L1275 PolarHBondContact O-N 2.92Å; A1272-I1276 VanDerWaalsContact O-CG1 3.26Å; A1272-I1276 WeakPolarHBondContact O-CG1 3.34Å; A1272-I1276 PolarHBondContact O-N 3.47Å; A1272-V1296 HydrophobicContact CB-CG1 4.18Å; A1272-R1546 HydrophobicContact CB-CB 4.34Å
1273	G	83.7	Confident	84.3	Confident	41 Å²	41	46.7 Å²	46.7	42%	0.423	25%	0.254	S	S	.	.	H	α-helix	trans	-59.1	-42.5	171	0	0	0	0	0	112.5	Y1269 N1270 E1271 I1276 G1277	Y1269-G1273 PolarHBondContact O-N 3.43Å; N1270-G1273 PolarHBondContact O-N 3.21Å; E1271-G1273 VanDerWaalsContact C-N 3.34Å; E1271-G1273 PolarHBondContact O-N 3.28Å; G1273-I1276 PolarHBondContact O-N 3.19Å; G1273-G1277 PolarHBondContact O-N 2.73Å
1274	S	82.8	Confident	84.5	Confident	39 Å²	39	51.2 Å²	51.2	27%	0.273	28%	0.275	S	S	.	.	H	α-helix	trans	-68.9	-32.7	177.9	-167.3	0	0	0	0	113.9	N1270 E1271 A1272 R1282 L1571	N1270-S1274 PolarHBondContact O-N 2.83Å; N1270-S1274 VanDerWaalsContact O-N 3.16Å; E1271-S1274 WeakPolarHBondContact O-CA 3.06Å; E1271-S1274 WeakPolarHBondContact O-CB 3.39Å; E1271-S1274 PolarHBondContact O-N 3.36Å; A1272-S1274 VanDerWaalsContact C-N 3.32Å; A1272-S1274 PolarHBondContact O-N 3.17Å; S1274-R1282 VanDerWaalsContact O-CD 3.28Å; S1274-R1282 WeakPolarHBondContact O-CD 3.4Å; S1274-R1282 PolarHBondContact O-NH1 2.84Å; S1274-R1282 VanDerWaalsContact O-NH1 3.15Å; S1274-R1282 PolarHBondContact OG-NH1 3.37Å; S1274-L1571 VanDerWaalsContact CB-CD1 3.46Å; S1274-L1571 WeakPolarHBondContact OG-CD1 3.39Å
1275	L	84.4	Confident	84.6	Confident	6 Å²	6	55.1 Å²	55.1	3%	0.031	29%	0.294	C	S	.	.	H	α-helix	trans	-69.5	-41.5	173.8	-70.3	178.5	0	0	0	112.5	V1267 E1271 A1272 R1282 I1283 I1564 R1567 L1568	V1267-L1275 HydrophobicContact CG1-CD1 3.99Å; E1271-L1275 WeakPolarHBondContact O-CG 2.99Å; E1271-L1275 PolarHBondContact O-N 3.06Å; A1272-L1275 PolarHBondContact O-N 2.92Å; L1275-R1282 CarbonylContact O-C 3.2Å; L1275-R1282 WeakPolarHBondContact O-CB 3.26Å; L1275-I1283 PolarHBondContact O-N 3.44Å; L1275-I1564 HydrophobicContact CD1-CG1 4.49Å; L1275-I1564 HydrophobicContact CD1-CG2 3.85Å; L1275-I1564 HydrophobicContact CD2-CG1 4.26Å; L1275-I1564 HydrophobicContact CD2-CG2 4.23Å; L1275-R1567 HydrophobicContact CD2-CB 4.2Å; L1275-L1568 HydrophobicContact CD1-CD1 4.48Å; L1275-L1568 HydrophobicContact CD1-CD2 4.13Å; L1275-L1568 HydrophobicContact CD2-CD2 3.88Å; L1275-L1568 HydrophobicContact CD2-CG 4.38Å; L1275-L1568 HydrophobicContact CG-CD2 3.89Å
1276	I	85.7	Confident	84.6	Confident	52 Å²	52	55.2 Å²	55.2	27%	0.267	29%	0.294	S	S	.	.	H	α-helix	trans	-67.7	-48	176.4	-63.9	164.4	0	0	0	109.8	A1272 G1273 G1280 R1282 I1283 V1296	A1272-I1276 VanDerWaalsContact O-CG1 3.26Å; A1272-I1276 WeakPolarHBondContact O-CG1 3.34Å; A1272-I1276 PolarHBondContact O-N 3.47Å; G1273-I1276 PolarHBondContact O-N 3.19Å; I1276-G1280 CarbonylContact O-C 3.59Å; I1276-G1280 VanDerWaalsContact O-C 3.23Å; I1276-G1280 VanDerWaalsContact O-CA 3.25Å; I1276-G1280 WeakPolarHBondContact O-CA 3.36Å; I1276-R1282 PolarHBondContact O-N 2.82Å; I1276-I1283 HydrophobicContact CB-CG2 4.43Å; I1276-I1283 HydrophobicContact CG2-CG2 4.23Å; I1276-I1283 PolarHBondContact O-N 2.9Å; I1276-V1296 HydrophobicContact CD1-CB 4.15Å; I1276-V1296 HydrophobicContact CD1-CG1 4.07Å; I1276-V1296 HydrophobicContact CD1-CG2 4.33Å; I1276-V1296 HydrophobicContact CG1-CB 4.4Å; I1276-V1296 HydrophobicContact CG1-CG2 4.05Å
1277	G	84.4	Confident	84.7	Confident	18 Å²	18	58.1 Å²	58.1	19%	0.186	31%	0.309	C	S	.	.			trans	72.4	179.1	-172.6	0	0	0	0	0	113.2	G1273 E1279 G1280	G1273-G1277 PolarHBondContact O-N 2.73Å; G1277-E1279 PolarHBondContact O-N 2.9Å; G1277-G1280 PolarHBondContact O-N 2.9Å
1278	S	82.3	Confident	84.7	Confident	94 Å²	94	65.6 Å²	65.6	66%	0.657	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-56.8	130.7	170.4	39.7	0	0	0	0	110.1	G1280 S1281	S1278-G1280 PolarHBondContact O-N 2.94Å; S1278-S1281 WeakPolarHBondContact O-CB 3.39Å; S1278-S1281 PolarHBondContact O-N 2.56Å; S1278-S1281 PolarHBondContact O-OG 3.11Å
1279	E	78.5	Confident	84.8	Confident	199 Å²	199	67.9 Å²	67.9	93%	0.93	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	56.8	11.3	177.3	-52.5	-174.1	144.4	0	0	115.9	G1277 S1281	G1277-E1279 PolarHBondContact O-N 2.9Å; E1279-S1281 VanDerWaalsContact C-N 3.33Å
1280	G	82.4	Confident	84.9	Confident	10 Å²	10	62.2 Å²	62.2	10%	0.103	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	81.2	7.7	-172.9	0	0	0	0	0	114.7	I1276 G1277 S1278 R1282 I1283 Q1284	I1276-G1280 CarbonylContact O-C 3.59Å; I1276-G1280 VanDerWaalsContact O-C 3.23Å; I1276-G1280 VanDerWaalsContact O-CA 3.25Å; I1276-G1280 WeakPolarHBondContact O-CA 3.36Å; G1277-G1280 PolarHBondContact O-N 2.9Å; S1278-G1280 PolarHBondContact O-N 2.94Å; G1280-R1282 VanDerWaalsContact C-N 3.32Å; G1280-R1282 PolarHBondContact O-N 3.46Å; G1280-I1283 WeakPolarHBondContact O-CG2 3.32Å; G1280-I1283 PolarHBondContact O-N 2.97Å; G1280-Q1284 WeakPolarHBondContact O-CG 3.22Å; G1280-Q1284 PolarHBondContact O-N 3.34Å
1281	S	84	Confident	84.9	Confident	56 Å²	56	59.3 Å²	59.3	39%	0.392	34%	0.341	S	S	.	.	H	α-helix	trans	-52.6	-43.9	-179.1	54.7	0	0	0	0	113.8	S1278 E1279 Q1285	S1278-S1281 WeakPolarHBondContact O-CB 3.39Å; S1278-S1281 PolarHBondContact O-N 2.56Å; S1278-S1281 PolarHBondContact O-OG 3.11Å; E1279-S1281 VanDerWaalsContact C-N 3.33Å; S1281-Q1285 WeakPolarHBondContact O-CB 3.33Å; S1281-Q1285 PolarHBondContact O-N 3.49Å
1282	R	83.8	Confident	84.8	Confident	123 Å²	123	58.7 Å²	58.7	46%	0.464	34%	0.338	S	S	.	.	H	α-helix	trans	-74.2	-28.9	-176.3	-67.5	-177.5	178.4	177.2	0.5	113.7	S1274 L1275 I1276 G1280 L1286 R1567	S1274-R1282 VanDerWaalsContact O-CD 3.28Å; S1274-R1282 WeakPolarHBondContact O-CD 3.4Å; S1274-R1282 PolarHBondContact O-NH1 2.84Å; S1274-R1282 VanDerWaalsContact O-NH1 3.15Å; S1274-R1282 PolarHBondContact OG-NH1 3.37Å; L1275-R1282 CarbonylContact O-C 3.2Å; L1275-R1282 WeakPolarHBondContact O-CB 3.26Å; I1276-R1282 PolarHBondContact O-N 2.82Å; G1280-R1282 VanDerWaalsContact C-N 3.32Å; G1280-R1282 PolarHBondContact O-N 3.46Å; R1282-L1286 WeakPolarHBondContact O-CB 3.26Å; R1282-L1286 PolarHBondContact O-N 3.42Å; R1282-R1567 PolarHBondContact O-NH1 2.98Å
1283	I	88.9	Confident	84.9	Confident	18 Å²	18	63.2 Å²	63.2	9%	0.092	36%	0.36	C	S	.	.	H	α-helix	trans	-82.4	-35.4	174.8	-173.6	162.1	0	0	0	111.5	L1275 I1276 G1280 L1286 M1287 I1294 V1296	L1275-I1283 PolarHBondContact O-N 3.44Å; I1276-I1283 HydrophobicContact CB-CG2 4.43Å; I1276-I1283 HydrophobicContact CG2-CG2 4.23Å; I1276-I1283 PolarHBondContact O-N 2.9Å; G1280-I1283 WeakPolarHBondContact O-CG2 3.32Å; G1280-I1283 PolarHBondContact O-N 2.97Å; I1283-L1286 WeakPolarHBondContact O-CB 3.43Å; I1283-L1286 PolarHBondContact O-N 3.27Å; I1283-M1287 HydrophobicContact CG1-SD 4.25Å; I1283-M1287 VanDerWaalsContact O-CG 3.28Å; I1283-M1287 WeakPolarHBondContact O-CG 3.31Å; I1283-M1287 PolarHBondContact O-N 3.3Å; I1283-I1294 HydrophobicContact CD1-CB 4.12Å; I1283-I1294 HydrophobicContact CD1-CG2 3.69Å; I1283-I1294 HydrophobicContact CG1-CB 4.16Å; I1283-I1294 HydrophobicContact CG1-CG2 4.1Å; I1283-V1296 HydrophobicContact CD1-CG2 3.62Å
1284	Q	87.2	Confident	85.1	Confident	108 Å²	108	61.6 Å²	61.6	51%	0.505	34%	0.341	S	S	.	.	H	α-helix	trans	-60.6	-47.3	169.6	-70.9	177.5	29	0	0	111.5	G1280 L1286 M1287 Q1288	G1280-Q1284 WeakPolarHBondContact O-CG 3.22Å; G1280-Q1284 PolarHBondContact O-N 3.34Å; Q1284-L1286 VanDerWaalsContact C-N 3.27Å; Q1284-L1286 PolarHBondContact O-N 3.5Å; Q1284-M1287 PolarHBondContact O-N 2.92Å; Q1284-Q1288 WeakPolarHBondContact O-CG 3.05Å; Q1284-Q1288 PolarHBondContact O-N 3.31Å
1285	Q	87.2	Confident	85.3	Confident	111 Å²	111	64.7 Å²	64.7	52%	0.519	35%	0.351	S	S	.	.	H	α-helix	trans	-59.3	-38	174.2	-169.9	-162.9	46	0	0	112.2	S1281 A1289	S1281-Q1285 WeakPolarHBondContact O-CB 3.33Å; S1281-Q1285 PolarHBondContact O-N 3.49Å; Q1285-A1289 VanDerWaalsContact O-CB 3.22Å; Q1285-A1289 WeakPolarHBondContact O-CB 3.34Å; Q1285-A1289 PolarHBondContact O-N 2.94Å
1286	L	87.6	Confident	85.3	Confident	2 Å²	2	65.9 Å²	65.9	1%	0.01	36%	0.359	C	S	.	.	H	α-helix	trans	-67.8	-42.7	177.4	-178.9	68.7	0	0	0	111.9	R1282 I1283 Q1284 A1289 T1290 I1294 Q1563 I1564	R1282-L1286 WeakPolarHBondContact O-CB 3.26Å; R1282-L1286 PolarHBondContact O-N 3.42Å; I1283-L1286 WeakPolarHBondContact O-CB 3.43Å; I1283-L1286 PolarHBondContact O-N 3.27Å; Q1284-L1286 VanDerWaalsContact C-N 3.27Å; Q1284-L1286 PolarHBondContact O-N 3.5Å; L1286-A1289 PolarHBondContact O-N 3.32Å; L1286-T1290 HydrophobicContact CD1-CG2 4.13Å; L1286-T1290 WeakPolarHBondContact O-CB 3.49Å; L1286-T1290 VanDerWaalsContact O-CG2 3.26Å; L1286-T1290 WeakPolarHBondContact O-CG2 3.45Å; L1286-T1290 PolarHBondContact O-N 2.95Å; L1286-T1290 VanDerWaalsContact O-N 3.14Å; L1286-T1290 PolarHBondContact O-OG1 2.91Å; L1286-I1294 HydrophobicContact CB-CD1 4.33Å; L1286-I1294 HydrophobicContact CD2-CD1 3.5Å; L1286-I1294 VanDerWaalsContact CD2-CD1 3.5Å; L1286-I1294 HydrophobicContact CG-CD1 3.54Å; L1286-Q1563 HydrophobicContact CD1-CB 3.52Å; L1286-Q1563 HydrophobicContact CD1-CG 4.3Å; L1286-I1564 HydrophobicContact CD2-CD1 3.91Å; L1286-I1564 HydrophobicContact CD2-CG1 3.62Å
1287	M	88.6	Confident	85	Confident	64 Å²	64	64.6 Å²	64.6	32%	0.315	36%	0.358	S	S	.	.	H	α-helix	trans	-61.4	-47.5	174.6	-69.8	164.4	65.5	0	0	110.7	I1283 Q1284 A1289 T1290 G1291 A1292 E1293 I1294	I1283-M1287 HydrophobicContact CG1-SD 4.25Å; I1283-M1287 VanDerWaalsContact O-CG 3.28Å; I1283-M1287 WeakPolarHBondContact O-CG 3.31Å; I1283-M1287 PolarHBondContact O-N 3.3Å; Q1284-M1287 PolarHBondContact O-N 2.92Å; M1287-A1289 PolarHBondContact O-N 3.09Å; M1287-T1290 PolarHBondContact O-N 2.66Å; M1287-T1290 PolarHBondContact O-OG1 3.16Å; M1287-G1291 WeakPolarHBondContact O-CA 3.46Å; M1287-G1291 PolarHBondContact O-N 3.25Å; M1287-A1292 WeakPolarHBondContact CA-O 3.47Å; M1287-A1292 VanDerWaalsContact CB-O 3.31Å; M1287-A1292 WeakPolarHBondContact CB-O 3.27Å; M1287-A1292 WeakPolarHBondContact CG-O 3.35Å; M1287-E1293 HydrophobicContact CE-CG 4.45Å; M1287-I1294 HydrophobicContact CG-CB 3.82Å; M1287-I1294 HydrophobicContact CG-CD1 4Å; M1287-I1294 HydrophobicContact CG-CG1 3.76Å; M1287-I1294 HydrophobicContact SD-CB 4.35Å
1288	Q	87	Confident	84.7	Confident	156 Å²	156	73 Å²	73	73%	0.729	39%	0.39	S	S	*	.	H	α-helix	trans	-59.2	-44.7	175.9	-71.8	170.6	-2.9	0	0	112.6	Q1284 T1290	Q1284-Q1288 WeakPolarHBondContact O-CG 3.05Å; Q1284-Q1288 PolarHBondContact O-N 3.31Å; Q1288-T1290 VanDerWaalsContact C-N 3.31Å; Q1288-T1290 PolarHBondContact O-N 3.34Å
1289	A	85.3	Confident	84.5	Confident	61 Å²	61	72.4 Å²	72.4	50%	0.504	38%	0.382	S	S	.	.	H	α-helix	trans	-76.1	-12.5	-177.1	0	0	0	0	0	114.7	Q1285 L1286 M1287	Q1285-A1289 VanDerWaalsContact O-CB 3.22Å; Q1285-A1289 WeakPolarHBondContact O-CB 3.34Å; Q1285-A1289 PolarHBondContact O-N 2.94Å; L1286-A1289 PolarHBondContact O-N 3.32Å; M1287-A1289 PolarHBondContact O-N 3.09Å
1290	T	85.9	Confident	84.3	Confident	11 Å²	11	66 Å²	66	7%	0.067	36%	0.357	C	S	.	.	H	α-helix	trans	-118	-19.3	-176.6	59.7	0	0	0	0	113.8	L1286 M1287 Q1288 A1292 S1556 M1559 A1560 Q1563	L1286-T1290 HydrophobicContact CD1-CG2 4.13Å; L1286-T1290 WeakPolarHBondContact O-CB 3.49Å; L1286-T1290 VanDerWaalsContact O-CG2 3.26Å; L1286-T1290 WeakPolarHBondContact O-CG2 3.45Å; L1286-T1290 PolarHBondContact O-N 2.95Å; L1286-T1290 VanDerWaalsContact O-N 3.14Å; L1286-T1290 PolarHBondContact O-OG1 2.91Å; M1287-T1290 PolarHBondContact O-N 2.66Å; M1287-T1290 PolarHBondContact O-OG1 3.16Å; Q1288-T1290 VanDerWaalsContact C-N 3.31Å; Q1288-T1290 PolarHBondContact O-N 3.34Å; T1290-A1292 PolarHBondContact O-N 3.43Å; T1290-A1292 PolarHBondContact OG1-N 3.36Å; T1290-S1556 WeakPolarHBondContact O-CA 3.37Å; T1290-S1556 WeakPolarHBondContact O-CB 3.11Å; T1290-M1559 HydrophobicContact CG2-CG 4.23Å; T1290-A1560 HydrophobicContact CG2-CB 4.14Å; T1290-Q1563 HydrophobicContact CG2-CB 4.37Å; T1290-Q1563 HydrophobicContact CG2-CG 3.99Å
1291	G	82.7	Confident	84.2	Confident	59 Å²	59	65.9 Å²	65.9	61%	0.608	35%	0.354	S	S	*	.			trans	69.4	7.7	-169.4	0	0	0	0	0	114	M1287	M1287-G1291 WeakPolarHBondContact O-CA 3.46Å; M1287-G1291 PolarHBondContact O-N 3.25Å
1292	A	84.2	Confident	83.9	Confident	4 Å²	4	64.3 Å²	64.3	3%	0.033	34%	0.344	C	S	.	.			trans	-90.2	146.8	176.4	0	0	0	0	0	110.7	M1287 T1290 I1294 S1551 A1560	M1287-A1292 WeakPolarHBondContact CA-O 3.47Å; M1287-A1292 VanDerWaalsContact CB-O 3.31Å; M1287-A1292 WeakPolarHBondContact CB-O 3.27Å; M1287-A1292 WeakPolarHBondContact CG-O 3.35Å; T1290-A1292 PolarHBondContact O-N 3.43Å; T1290-A1292 PolarHBondContact OG1-N 3.36Å; A1292-I1294 HydrophobicContact CB-CD1 4.41Å; A1292-I1294 HydrophobicContact CB-CG1 4.09Å; A1292-S1551 WeakPolarHBondContact CA-O 3.42Å; A1292-A1560 HydrophobicContact CB-CB 3.69Å
1293	E	85.8	Confident	83.5	Confident	95 Å²	95	60.5 Å²	60.5	44%	0.444	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	128.3	166.1	177.3	-172.7	-128.8	0	0	108	M1287 H1295 S1551	M1287-E1293 HydrophobicContact CE-CG 4.45Å; E1293-H1295 VanDerWaalsContact CD-CE1 3.44Å; E1293-H1295 IonicContact OE1-CE1 3.61Å; E1293-H1295 PolarHBondContact OE1-CE1 3.11Å; E1293-H1295 IonicContact OE2-CE1 3.71Å; E1293-S1551 WeakPolarHBondContact CB-OG 3.37Å; E1293-S1551 WeakPolarHBondContact CG-OG 3.48Å; E1293-S1551 PolarHBondContact N-O 3.46Å; E1293-S1551 PolarHBondContact O-N 3.49Å; E1293-S1551 PolarHBondContact O-OG 3.2Å; E1293-S1551 VanDerWaalsContact OE2-CB 3.31Å; E1293-S1551 WeakPolarHBondContact OE2-CB 3.31Å; E1293-S1551 PolarHBondContact OE2-OG 3.32Å
1294	I	89.1	Confident	83	Confident	8 Å²	8	59.8 Å²	59.8	4%	0.041	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	113.7	-167.2	-53.2	179.5	0	0	0	109.4	I1283 L1286 M1287 A1292 V1548 L1550 A1560 I1564	I1283-I1294 HydrophobicContact CD1-CB 4.12Å; I1283-I1294 HydrophobicContact CD1-CG2 3.69Å; I1283-I1294 HydrophobicContact CG1-CB 4.16Å; I1283-I1294 HydrophobicContact CG1-CG2 4.1Å; L1286-I1294 HydrophobicContact CB-CD1 4.33Å; L1286-I1294 HydrophobicContact CD2-CD1 3.5Å; L1286-I1294 VanDerWaalsContact CD2-CD1 3.5Å; L1286-I1294 HydrophobicContact CG-CD1 3.54Å; M1287-I1294 HydrophobicContact CG-CB 3.82Å; M1287-I1294 HydrophobicContact CG-CD1 4Å; M1287-I1294 HydrophobicContact CG-CG1 3.76Å; M1287-I1294 HydrophobicContact SD-CB 4.35Å; A1292-I1294 HydrophobicContact CB-CD1 4.41Å; A1292-I1294 HydrophobicContact CB-CG1 4.09Å; I1294-V1548 HydrophobicContact CG2-CG1 3.94Å; I1294-L1550 HydrophobicContact CB-CD2 4.28Å; I1294-L1550 HydrophobicContact CD1-CD2 4.3Å; I1294-L1550 HydrophobicContact CG1-CD2 3.84Å; I1294-L1550 HydrophobicContact CG2-CD2 3.82Å; I1294-A1560 HydrophobicContact CD1-CB 3.93Å; I1294-I1564 HydrophobicContact CG2-CD1 4.39Å
1295	H	85.3	Confident	82.2	Confident	104 Å²	104	58.2 Å²	58.2	48%	0.481	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	120.8	-176	-77.7	106.7	0	0	0	110.9	E1293 V1548 C1549	E1293-H1295 VanDerWaalsContact CD-CE1 3.44Å; E1293-H1295 IonicContact OE1-CE1 3.61Å; E1293-H1295 PolarHBondContact OE1-CE1 3.11Å; E1293-H1295 IonicContact OE2-CE1 3.71Å; H1295-V1548 WeakPolarHBondContact O-CA 3.46Å; H1295-C1549 HydrophobicContact CB-CB 4.22Å; H1295-C1549 PolarHBondContact N-O 2.99Å; H1295-C1549 PolarHBondContact O-N 3.28Å
1296	V	85.6	Confident	81.2	Confident	30 Å²	30	53.6 Å²	53.6	18%	0.182	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	123.9	175.7	-174.4	0	0	0	0	110.5	A1272 I1276 I1283 R1546 V1548	A1272-V1296 HydrophobicContact CB-CG1 4.18Å; I1276-V1296 HydrophobicContact CD1-CB 4.15Å; I1276-V1296 HydrophobicContact CD1-CG1 4.07Å; I1276-V1296 HydrophobicContact CD1-CG2 4.33Å; I1276-V1296 HydrophobicContact CG1-CB 4.4Å; I1276-V1296 HydrophobicContact CG1-CG2 4.05Å; I1283-V1296 HydrophobicContact CD1-CG2 3.62Å; V1296-R1546 HydrophobicContact CG1-CB 4.42Å; V1296-V1548 HydrophobicContact CG1-CG2 4.43Å; V1296-V1548 HydrophobicContact CG2-CG1 4.46Å; V1296-V1548 HydrophobicContact CG2-CG2 4.24Å
1297	G	80.2	Confident	80.1	Confident	25 Å²	25	57.1 Å²	57.1	26%	0.258	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	136.4	178.4	0	0	0	0	0	113.2	R1546 L1547	G1297-R1546 PolarHBondContact O-NH1 2.97Å; G1297-L1547 PolarHBondContact N-O 3.18Å
1298	K	77.9	Confident	78.5	Confident	196 Å²	196	58 Å²	58	85%	0.852	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	-23.8	169.7	-64.6	-173.6	-179.6	-177.2	0	112.8
1299	V	77.6	Confident	76.3	Confident	81 Å²	81	55.9 Å²	55.9	49%	0.491	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	133.9	177.6	-166.9	0	0	0	0	108.9
1300	P	74.4	Confident	73.9	Confident	64 Å²	64	58.8 Å²	58.8	42%	0.416	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	158.9	170.5	30.1	-35.7	0	0	0	111	Y1545 G1728	P1300-Y1545 CarbonylContact C-O 3.59Å; P1300-Y1545 WeakPolarHBondContact CA-O 3.46Å; P1300-G1728 PolarHBondContact O-N 2.99Å; P1300-G1728 VanDerWaalsContact O-N 3.13Å
1301	I	79.4	Confident	71.2	Confident	7 Å²	7	64.3 Å²	64.3	4%	0.036	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	155.2	176.4	61.4	158.5	0	0	0	110.2	R1266 Y1545 L1547 L1729	R1266-I1301 HydrophobicContact CB-CD1 3.87Å; R1266-I1301 HydrophobicContact CG-CD1 3.69Å; I1301-Y1545 WeakPolarHBondContact CG1-O 3.18Å; I1301-Y1545 PolarHBondContact N-O 3.36Å; I1301-Y1545 WeakPolarHBondContact O-CB 3.44Å; I1301-Y1545 PolarHBondContact O-N 3Å; I1301-L1547 HydrophobicContact CD1-CB 4.14Å; I1301-L1547 HydrophobicContact CD1-CD1 4.29Å; I1301-L1547 HydrophobicContact CG2-CB 4.34Å; I1301-L1729 HydrophobicContact CB-CD1 3.49Å; I1301-L1729 VanDerWaalsContact CB-CD1 3.49Å; I1301-L1729 HydrophobicContact CD1-CD1 3.62Å; I1301-L1729 HydrophobicContact CG1-CD1 4.13Å; I1301-L1729 HydrophobicContact CG2-CD1 3.54Å
1302	S	78.1	Confident	68.7	Low	24 Å²	24	70.2 Å²	70.2	17%	0.168	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-54.4	155.1	171.5	45	0	0	0	0	113.7	R1266 D1727	R1266-S1302 PolarHBondContact NH1-O 3.14Å; R1266-S1302 PolarHBondContact NH1-OG 3.35Å; S1302-D1727 WeakPolarHBondContact CB-OD2 3.2Å; S1302-D1727 PolarHBondContact N-OD1 2.96Å; S1302-D1727 PolarHBondContact OG-OD2 2.93Å
1303	P	75.6	Confident	66	Low	43 Å²	43	80.6 Å²	80.6	28%	0.279	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-63.2	161.6	171	27.8	-36	0	0	0	112.3	R1266 Y1545	R1266-P1303 PolarHBondContact NH1-O 3.43Å; P1303-Y1545 HydrophobicContact CB-CD2 3.99Å; P1303-Y1545 HydrophobicContact CB-CE2 3.76Å
1304	P	78.1	Confident	63.3	Low	3 Å²	3	81.1 Å²	81.1	2%	0.019	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-49.7	140.4	173.4	-27.8	34.6	0	0	0	113.6	A1306 L1307 Y1545 A1594 E1742 Y1744	P1304-A1306 PolarHBondContact O-N 3.25Å; P1304-L1307 HydrophobicContact CB-CB 4.49Å; P1304-L1307 HydrophobicContact CB-CD1 4.3Å; P1304-L1307 HydrophobicContact CB-CG 4.24Å; P1304-L1307 HydrophobicContact CG-CD1 4.03Å; P1304-L1307 PolarHBondContact O-N 2.87Å; P1304-Y1545 HydrophobicContact CG-CE1 4.26Å; P1304-A1594 HydrophobicContact CB-CB 3.9Å; P1304-A1594 HydrophobicContact CG-CB 3.72Å; P1304-E1742 WeakPolarHBondContact CA-OE1 3.3Å; P1304-Y1744 HydrophobicContact CB-CD2 4.12Å; P1304-Y1744 HydrophobicContact CB-CE2 4.4Å; P1304-Y1744 HydrophobicContact CG-CD2 4.44Å; P1304-Y1744 HydrophobicContact CG-CE2 4.39Å
1305	Y	70	Confident	60.4	Low	74 Å²	74	87.1 Å²	87.1	29%	0.29	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-64.2	-26.4	-178.9	-83	-72.9	0	0	0	113.1	L1307 L1677 P1678 E1742	Y1305-L1307 VanDerWaalsContact C-N 3.26Å; Y1305-L1307 PolarHBondContact O-N 3.21Å; Y1305-L1677 HydrophobicContact CD2-CD1 4.48Å; Y1305-L1677 HydrophobicContact CD2-CG 4.18Å; Y1305-L1677 HydrophobicContact CE2-CD2 4.19Å; Y1305-L1677 HydrophobicContact CE2-CG 3.79Å; Y1305-P1678 HydrophobicContact CE1-CG 4.45Å; Y1305-E1742 PolarHBondContact N-OE1 3Å
1306	A	66.7	Low	57.8	Low	15 Å²	15	86.6 Å²	86.6	12%	0.124	47%	0.471	C	S	.	.	G	3₁₀ helix	trans	-70.6	-16.4	173.3	0	0	0	0	0	114.4	P1304 V1670 H1675 Y1744	P1304-A1306 PolarHBondContact O-N 3.25Å; A1306-V1670 HydrophobicContact CB-CG1 4.24Å; A1306-H1675 WeakPolarHBondContact CA-NE2 3.28Å; A1306-H1675 WeakPolarHBondContact CB-NE2 3.36Å; A1306-Y1744 HydrophobicContact CB-CD1 3.52Å; A1306-Y1744 HydrophobicContact CB-CE1 4.35Å; A1306-Y1744 HydrophobicContact CB-CG 3.68Å
1307	L	64.3	Low	55.3	Low	75 Å²	75	92.9 Å²	92.9	39%	0.393	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-100.6	0.2	-179.9	-66.3	-178.1	0	0	0	113.8	P1304 Y1305 P1309 Y1744	P1304-L1307 HydrophobicContact CB-CB 4.49Å; P1304-L1307 HydrophobicContact CB-CD1 4.3Å; P1304-L1307 HydrophobicContact CB-CG 4.24Å; P1304-L1307 HydrophobicContact CG-CD1 4.03Å; P1304-L1307 PolarHBondContact O-N 2.87Å; Y1305-L1307 VanDerWaalsContact C-N 3.26Å; Y1305-L1307 PolarHBondContact O-N 3.21Å; L1307-P1309 WeakPolarHBondContact O-CD 3.35Å; L1307-Y1744 HydrophobicContact CD1-CE2 4.37Å; L1307-Y1744 HydrophobicContact CD2-CE1 4.13Å; L1307-Y1744 HydrophobicContact CG-CE1 4.45Å; L1307-Y1744 HydrophobicContact CG-CE2 4.46Å
1308	N	55.5	Low	52.8	Low	82 Å²	82	98.4 Å²	98.4	44%	0.439	53%	0.527	S	S	.	.			trans	-86	104.5	173.6	-73.6	-50.3	0	0	0	110	T1310	N1308-T1310 PolarHBondContact O-N 3.18Å
1309	P	40.6	Very low	50.7	Low	112 Å²	112	96.9 Å²	96.9	73%	0.727	53%	0.529	S	S	*	.			trans	-61.5	135.7	164	28.2	-34.1	0	0	0	108.5	L1307 P1311	L1307-P1309 WeakPolarHBondContact O-CD 3.35Å; P1309-P1311 WeakPolarHBondContact O-CD 3.43Å
1310	T	34.2	Very low	48.4	Very low	123 Å²	123	99.7 Å²	99.7	76%	0.755	54%	0.541	S	S	*	.			trans	-56.4	124.7	165.5	46.6	0	0	0	0	107.9	N1308 K1312	N1308-T1310 PolarHBondContact O-N 3.18Å; T1310-K1312 PolarHBondContact O-N 3.31Å
1311	P	30.4	Very low	46.5	Very low	126 Å²	126	103.4 Å²	103.4	82%	0.818	56%	0.557	S	S	*	*			trans	-64.8	104.2	-178.4	25.4	-33.3	0	0	0	108.8	P1309 R1313	P1309-P1311 WeakPolarHBondContact O-CD 3.43Å; P1311-R1313 PolarHBondContact O-N 2.97Å; P1311-R1313 VanDerWaalsContact O-N 3.17Å
1312	K	29.1	Very low	44.3	Very low	183 Å²	183	109.6 Å²	109.6	80%	0.796	59%	0.591	S	S	*	*			trans	-58.3	119.4	158.8	-75.2	-173.8	174.9	-176.9	0	105.5	T1310 T1314	T1310-K1312 PolarHBondContact O-N 3.31Å; K1312-T1314 PolarHBondContact O-N 3.35Å
1313	R	27.3	Very low	42.2	Very low	222 Å²	222	114.6 Å²	114.6	84%	0.838	62%	0.615	S	S	*	*			trans	-63.5	96.7	159.4	-97	-171.5	170.5	-175.6	-6.2	106.4	P1311	P1311-R1313 PolarHBondContact O-N 2.97Å; P1311-R1313 VanDerWaalsContact O-N 3.17Å
1314	T	29.1	Very low	40.1	Very low	106 Å²	106	118.4 Å²	118.4	65%	0.65	63%	0.634	S	S	*	*			trans	-90.6	96.4	163.7	-45.4	0	0	0	0	105.1	K1312 S1316	K1312-T1314 PolarHBondContact O-N 3.35Å; T1314-S1316 PolarHBondContact O-N 2.94Å
1315	D	29.8	Very low	37.9	Very low	134 Å²	134	122.1 Å²	122.1	72%	0.717	65%	0.653	S	S	*	*			trans	-74.1	79.8	175.4	-66.2	-42.8	0	0	0	108	N1317	D1315-N1317 VanDerWaalsContact C-N 3.32Å; D1315-N1317 PolarHBondContact O-N 3.41Å
1316	S	30.5	Very low	36.1	Very low	93 Å²	93	122 Å²	122	65%	0.65	66%	0.657	S	S	*	*			trans	-73.6	77.8	-175.3	-64.8	0	0	0	0	112.3	T1314	T1314-S1316 PolarHBondContact O-N 2.94Å
1317	N	31.6	Very low	34.4	Very low	163 Å²	163	125.5 Å²	125.5	87%	0.872	67%	0.674	S	S	*	*			trans	-81.4	110.7	156.7	-92.4	3.7	0	0	0	109.1	D1315	D1315-N1317 VanDerWaalsContact C-N 3.32Å; D1315-N1317 PolarHBondContact O-N 3.41Å
1318	N	29.3	Very low	32.7	Very low	140 Å²	140	127 Å²	127	75%	0.749	68%	0.683	S	S	*	*			trans	-67.9	139.7	164.9	-72	-13.5	0	0	0	110
1319	N	33.5	Very low	31.4	Very low	165 Å²	165	129.3 Å²	129.3	88%	0.882	70%	0.695	S	S	*	*			trans	-162.4	146.1	135.3	-103	-18.5	0	0	0	110
1320	N	30	Very low	30.8	Very low	140 Å²	140	130.3 Å²	130.3	75%	0.749	69%	0.694	S	S	*	*			trans	-95.4	163.1	-169.5	-62.8	-22.6	0	0	0	113
1321	N	34.4	Very low	30.4	Very low	141 Å²	141	131 Å²	131	75%	0.754	69%	0.693	S	S	*	*			trans	125.1	115.3	144.9	-62.5	-15.7	0	0	0	116
1322	N	32	Very low	30.4	Very low	137 Å²	137	132.7 Å²	132.7	73%	0.733	70%	0.696	S	S	*	*				39.5	132.5	117.1	-57.8	5.9	0	0	0	118.1
1323	N	33.4	Very low	30.2	Very low	129 Å²	129	132.1 Å²	132.1	69%	0.69	70%	0.701	S	S	*	*			cis	-159.3	167.5	13.1	-90	-24.7	0	0	0	111.3
1324	N	33.2	Very low	30.1	Very low	124 Å²	124	127.5 Å²	127.5	66%	0.663	69%	0.693	S	S	*	*			trans	30	146.1	141	-58.8	-3.2	0	0	0	121.6
1325	N	31.8	Very low	30	Very low	80 Å²	80	129.3 Å²	129.3	43%	0.428	70%	0.704	S	S	.	*			cis	-170.9	149.2	1.5	-98.5	-1	0	0	0	110.4	H563	H563-N1325 PolarHBondContact CD2-ND2 3.48Å; H563-N1325 VanDerWaalsContact NE2-CG 3.31Å; H563-N1325 PolarHBondContact NE2-ND2 3.05Å; H563-N1325 PolarHBondContact NE2-OD1 2.9Å
1326	N	31.4	Very low	29.9	Very low	71 Å²	71	130.9 Å²	130.9	38%	0.38	71%	0.707	S	S	.	*			trans	65.7	145.7	146	-60	29.1	0	0	0	119.2	S560 S561 S562	S560-N1326 PolarHBondContact OG-N 2.88Å; S561-N1326 WeakPolarHBondContact O-CA 3.38Å; S561-N1326 PolarHBondContact O-N 3.13Å; S561-N1326 PolarHBondContact O-OD1 2.92Å; S562-N1326 PolarHBondContact N-OD1 3Å; S562-N1326 PolarHBondContact O-ND2 3.31Å; S562-N1326 VanDerWaalsContact O-ND2 3.09Å; S562-N1326 PolarHBondContact O-OD1 2.84Å; S562-N1326 PolarHBondContact OG-OD1 3.39Å
1327	N	30.8	Very low	29.8	Very low	90 Å²	90	130.7 Å²	130.7	48%	0.481	71%	0.705	S	S	.	*			cis	-160.6	149.3	-3	-115.9	5.1	0	0	0	113.2	L559 S560	L559-N1327 CarbonylContact O-C 3.34Å; S560-N1327 CarbonylContact O-C 3.38Å; S560-N1327 WeakPolarHBondContact O-CA 3.25Å
1328	N	29.4	Very low	29.6	Very low	106 Å²	106	130.4 Å²	130.4	57%	0.567	70%	0.704	S	S	*	*			trans	71.9	125.3	145.8	-70.7	-4.3	0	0	0	124.9	L559 S560	L559-N1328 PolarHBondContact O-N 3.41Å; S560-N1328 PolarHBondContact O-N 2.97Å
1329	N	27.9	Very low	29.5	Very low	131 Å²	131	131 Å²	131	70%	0.701	70%	0.702	S	S	*	*			trans	83.7	133.5	132.4	-69.8	2	0	0	0	125.9
1330	N	27.8	Very low	29.2	Very low	133 Å²	133	131.6 Å²	131.6	71%	0.711	70%	0.697	S	S	*	*			trans	79.7	120.5	150.3	-68.1	2.5	0	0	0	122.9
1331	N	26.4	Very low	28.9	Very low	136 Å²	136	129 Å²	129	73%	0.727	69%	0.69	S	S	*	*			trans	60.4	92.1	141.9	-59.7	-7.7	0	0	0	119.7
1332	N	30.2	Very low	28.6	Very low	163 Å²	163	128.5 Å²	128.5	87%	0.872	69%	0.694	S	S	*	*				-162.2	146.7	103.1	-105.5	-57.3	0	0	0	113.4	N1334	N1332-N1334 PolarHBondContact O-N 3.48Å
1333	N	24.8	Very low	28.3	Very low	171 Å²	171	127.2 Å²	127.2	91%	0.914	69%	0.691	S	S	*	*			trans	-78.4	84	-175.1	-70.2	-28.9	0	0	0	112.1
1334	N	25.7	Very low	27.9	Very low	124 Å²	124	127.2 Å²	127.2	66%	0.663	70%	0.7	S	S	*	*			trans	-150.9	74.4	164.9	-159.1	-4.8	0	0	0	114.7	N1332 Q1336	N1332-N1334 PolarHBondContact O-N 3.48Å; N1334-Q1336 WeakPolarHBondContact OD1-CB 3.43Å; N1334-Q1336 PolarHBondContact OD1-N 2.98Å
1335	V	26.3	Very low	27.6	Very low	145 Å²	145	128.8 Å²	128.8	88%	0.879	71%	0.706	S	S	*	*			trans	-108.5	66.6	150.3	-173.4	0	0	0	0	107.7	S1337	V1335-S1337 VanDerWaalsContact C-N 3.32Å; V1335-S1337 PolarHBondContact O-N 2.71Å
1336	Q	28.1	Very low	27.3	Very low	167 Å²	167	129.1 Å²	129.1	78%	0.78	72%	0.715	S	S	*	*			trans	-69.2	95.1	167.2	-169.9	167.8	32.9	0	0	108.4	N1334 N1338	N1334-Q1336 WeakPolarHBondContact OD1-CB 3.43Å; N1334-Q1336 PolarHBondContact OD1-N 2.98Å; Q1336-N1338 PolarHBondContact O-N 2.93Å
1337	S	28	Very low	27	Very low	88 Å²	88	131.6 Å²	131.6	62%	0.615	73%	0.728	S	S	*	*			trans	-55.5	122.3	177.4	50.7	0	0	0	0	109.9	V1335 E1339	V1335-S1337 VanDerWaalsContact C-N 3.32Å; V1335-S1337 PolarHBondContact O-N 2.71Å; S1337-E1339 PolarHBondContact O-N 2.84Å
1338	N	26.2	Very low	26.8	Very low	157 Å²	157	131.1 Å²	131.1	84%	0.84	73%	0.728	S	S	*	*			trans	-75.9	43	175.2	-106.4	-54.5	0	0	0	111.6	Q1336 K1340	Q1336-N1338 PolarHBondContact O-N 2.93Å; N1338-K1340 VanDerWaalsContact C-N 3.25Å; N1338-K1340 PolarHBondContact O-N 2.86Å
1339	E	28.7	Very low	26.5	Very low	152 Å²	152	132.2 Å²	132.2	71%	0.71	73%	0.734	S	S	*	*			trans	-70	88	162.5	-70.2	-137.7	158.5	0	0	108.3	S1337 S1341	S1337-E1339 PolarHBondContact O-N 2.84Å; E1339-S1341 VanDerWaalsContact C-N 3.32Å; E1339-S1341 PolarHBondContact O-N 3.32Å
1340	K	26.4	Very low	26.5	Very low	179 Å²	179	132 Å²	132	78%	0.778	74%	0.743	S	S	*	*			trans	-60.3	100.9	161.1	-85.6	-175.1	175.5	176.5	0	108.2	N1338	N1338-K1340 VanDerWaalsContact C-N 3.25Å; N1338-K1340 PolarHBondContact O-N 2.86Å
1341	S	23.2	Very low	26.3	Very low	85 Å²	85	133 Å²	133	59%	0.594	74%	0.741	S	S	*	*			trans	-50.7	131.3	169	48.2	0	0	0	0	109.8	E1339 T1343	E1339-S1341 VanDerWaalsContact C-N 3.32Å; E1339-S1341 PolarHBondContact O-N 3.32Å; S1341-T1343 PolarHBondContact O-N 3.16Å
1342	P	28.6	Very low	26.3	Very low	131 Å²	131	135.7 Å²	135.7	85%	0.851	75%	0.746	S	S	*	*			trans	-71	90.3	168.2	28.9	-31.8	0	0	0	107.5
1343	T	27	Very low	26.1	Very low	110 Å²	110	136.1 Å²	136.1	68%	0.675	75%	0.749	S	S	*	*			trans	-57.9	153.9	-179.7	37.9	0	0	0	0	112	S1341 I1345	S1341-T1343 PolarHBondContact O-N 3.16Å; T1343-I1345 PolarHBondContact O-N 3.45Å; T1343-I1345 VanDerWaalsContact O-N 3.07Å
1344	C	23.7	Very low	26.1	Very low	128 Å²	128	132.5 Å²	132.5	87%	0.865	73%	0.729	S	S	*	*			trans	-54.2	111.1	-177.4	-51.3	0	0	0	0	111.7	S1346	C1344-S1346 PolarHBondContact O-N 3.27Å
1345	I	27.5	Very low	26.1	Very low	157 Å²	157	132.6 Å²	132.6	81%	0.805	73%	0.73	S	S	*	*			trans	-83.7	98.8	168.7	-59.5	-179.2	0	0	0	108.5	T1343	T1343-I1345 PolarHBondContact O-N 3.45Å; T1343-I1345 VanDerWaalsContact O-N 3.07Å
1346	S	25.5	Very low	26.1	Very low	88 Å²	88	131.8 Å²	131.8	62%	0.615	73%	0.726	S	S	*	*			trans	-68.5	121.8	166.8	51.3	0	0	0	0	110.7	C1344 V1348	C1344-S1346 PolarHBondContact O-N 3.27Å; S1346-V1348 VanDerWaalsContact C-N 3.3Å; S1346-V1348 PolarHBondContact O-N 2.96Å; S1346-V1348 VanDerWaalsContact O-N 3.12Å
1347	L	25.7	Very low	26.1	Very low	122 Å²	122	129.8 Å²	129.8	64%	0.639	73%	0.725	S	S	*	*			trans	-86.1	70.3	171.7	-89.8	167.1	0	0	0	111.4	W1605	L1347-W1605 PolarHBondContact O-NE1 2.98Å
1348	V	25.5	Very low	26	Very low	80 Å²	80	131.8 Å²	131.8	49%	0.485	73%	0.733	S	S	.	*	S	Bend	trans	-131.3	120.8	162	-178.6	0	0	0	0	108.2	S1346 T1609	S1346-V1348 VanDerWaalsContact C-N 3.3Å; S1346-V1348 PolarHBondContact O-N 2.96Å; S1346-V1348 VanDerWaalsContact O-N 3.12Å; V1348-T1609 HydrophobicContact CG2-CG2 4.31Å
1349	D	23.5	Very low	25.9	Very low	129 Å²	129	128.4 Å²	128.4	69%	0.69	73%	0.727	S	S	*	*			trans	29.5	103.7	165	-57.8	-45.4	0	0	0	119.8
1350	S	27.3	Very low	25.9	Very low	127 Å²	127	128 Å²	128	89%	0.888	73%	0.728	S	S	*	*			trans	-144	61.1	152.8	-70.5	0	0	0	0	109.7
1351	F	24.5	Very low	25.9	Very low	155 Å²	155	126 Å²	126	68%	0.68	73%	0.726	S	S	*	*			trans	-81.7	160.3	158.4	-81.2	-89.8	0	0	0	109.7
1352	F	26.1	Very low	26	Very low	191 Å²	191	127.1 Å²	127.1	84%	0.838	73%	0.732	S	S	*	*			trans	69.3	83.1	-179.2	-56.6	-79.5	0	0	0	116.4
1353	N	26	Very low	25.9	Very low	173 Å²	173	127.8 Å²	127.8	93%	0.925	73%	0.729	S	S	*	*				-145.8	130.1	109	-85.9	-42.1	0	0	0	107.7
1354	D	25.6	Very low	25.8	Very low	94 Å²	94	126.7 Å²	126.7	50%	0.503	73%	0.726	S	S	.	*			trans	-145.5	140.3	-169.9	-153.2	44.2	0	0	0	108.2	K1692	D1354-K1692 VanDerWaalsContact OD2-CE 3.29Å; D1354-K1692 WeakPolarHBondContact OD2-CE 3.24Å; D1354-K1692 IonicContact OD2-NZ 2.72Å; D1354-K1692 PolarHBondContact OD2-NZ 3.29Å
1355	D	25.9	Very low	25.7	Very low	127 Å²	127	125.7 Å²	125.7	68%	0.679	72%	0.72	S	S	*	*			trans	64.4	142.5	177.3	-50.2	-38.5	0	0	0	114.7	K1692	D1355-K1692 IonicContact OD1-NZ 3.7Å; D1355-K1692 IonicContact OD2-NZ 3.96Å; D1355-K1692 PolarHBondContact OD2-NZ 3.47Å
1356	T	25.3	Very low	25.7	Very low	128 Å²	128	123.2 Å²	123.2	79%	0.785	72%	0.717	S	S	*	*			cis	-137.1	164.6	7.1	48.3	0	0	0	0	108.5
1357	V	27.9	Very low	25.7	Very low	125 Å²	125	126.6 Å²	126.6	76%	0.758	73%	0.728	S	S	*	*				-159	133.2	63	160.9	0	0	0	0	112.3
1358	T	26.3	Very low	25.8	Very low	130 Å²	130	127.4 Å²	127.4	80%	0.798	74%	0.738	S	S	*	*			trans	-46.9	164.9	160.8	45	0	0	0	0	116.4
1359	A	22.9	Very low	25.8	Very low	85 Å²	85	130.2 Å²	130.2	70%	0.702	75%	0.75	S	S	*	*			cis	-162.1	-176.9	-9.9	0	0	0	0	0	107.3
1360	I	29.5	Very low	25.8	Very low	145 Å²	145	130.1 Å²	130.1	74%	0.744	75%	0.749	S	S	*	*				-177.7	137.4	93.4	-90.2	163.7	0	0	0	108.9
1361	N	27.3	Very low	25.9	Very low	136 Å²	136	133 Å²	133	73%	0.727	75%	0.746	S	S	*	*			trans	52.1	137.3	161	-61	6	0	0	0	119.3
1362	C	24.4	Very low	26.2	Very low	108 Å²	108	132.9 Å²	132.9	73%	0.73	75%	0.751	S	S	*	*			cis	73.1	135.5	47.9	-54.5	0	0	0	0	112.2
1363	D	26.3	Very low	26.6	Very low	145 Å²	145	129.4 Å²	129.4	78%	0.775	74%	0.741	S	S	*	*			cis	-148.3	175.8	24.1	-126.5	-49.5	0	0	0	117.7
1364	S	24.5	Very low	26.7	Very low	88 Å²	88	129.1 Å²	129.1	62%	0.615	73%	0.734	S	S	*	*			trans	-52.8	146.2	-179.7	-51.5	0	0	0	0	120.4
1365	S	23	Very low	26.7	Very low	106 Å²	106	128.8 Å²	128.8	74%	0.741	74%	0.739	S	S	*	*				88.9	149.6	122.7	71.8	0	0	0	0	124.9
1366	S	27	Very low	26.6	Very low	106 Å²	106	130.1 Å²	130.1	74%	0.741	75%	0.746	S	S	*	*			trans	93.4	141	140	75.6	0	0	0	0	121
1367	N	25.1	Very low	26.6	Very low	158 Å²	158	127.8 Å²	127.8	85%	0.845	73%	0.734	S	S	*	*			trans	-88.9	143.8	168.5	-68.7	-7.1	0	0	0	110.1
1368	V	28.3	Very low	26.5	Very low	139 Å²	139	130 Å²	130	84%	0.842	73%	0.734	S	S	*	*			trans	-136.8	140.8	148.9	-178.5	0	0	0	0	107.9
1369	N	24.5	Very low	26.5	Very low	139 Å²	139	130.6 Å²	130.6	74%	0.743	73%	0.731	S	S	*	*			trans	-110.6	147.9	-179.4	-105.2	-6.2	0	0	0	111.5
1370	N	25.3	Very low	26.8	Very low	127 Å²	127	132 Å²	132	68%	0.679	73%	0.727	S	S	*	*			trans	67.6	117.6	149.6	-71.7	-28.7	0	0	0	122
1371	K	28.5	Very low	26.6	Very low	188 Å²	188	130.7 Å²	130.7	82%	0.817	72%	0.721	S	S	*	*			trans	69.9	177.4	135.2	-62.6	-175.3	177.6	-176.2	0	116.7
1372	I	31.3	Very low	26.8	Very low	153 Å²	153	130.5 Å²	130.5	79%	0.785	72%	0.72	S	S	*	*			trans	69.2	111.1	-151	-52	175.2	0	0	0	108.8
1373	D	33	Very low	26.9	Very low	117 Å²	117	132.1 Å²	132.1	63%	0.626	72%	0.722	S	S	*	*			cis	-139.2	158.7	-1.2	-108.8	-26.5	0	0	0	109.1
1374	Q	29.3	Very low	27.2	Very low	167 Å²	167	131.8 Å²	131.8	78%	0.78	72%	0.718	S	S	*	*				39.4	132.3	83.6	-63.3	-177.2	96.4	0	0	114.1
1375	S	25.9	Very low	27.3	Very low	88 Å²	88	134.2 Å²	134.2	62%	0.615	72%	0.724	S	S	*	*			cis	-162.2	174.5	-10.8	57.4	0	0	0	0	109.2
1376	L	24.2	Very low	27.7	Very low	154 Å²	154	135.5 Å²	135.5	81%	0.806	72%	0.723	S	S	*	*			trans	25.5	126.6	131.4	-60.5	169.9	0	0	0	117
1377	S	24.7	Very low	27.9	Very low	79 Å²	79	136.8 Å²	136.8	55%	0.552	72%	0.721	S	S	*	*			cis	177.5	-166.2	14.2	44.6	0	0	0	0	109.9
1378	K	25.2	Very low	28.1	Very low	171 Å²	171	134.9 Å²	134.9	74%	0.743	72%	0.716	S	S	*	*			trans	46.1	105.6	136.8	-76.1	168.6	-172.7	178.4	0	114.7
1379	I	26.3	Very low	28.2	Very low	144 Å²	144	133.7 Å²	133.7	74%	0.738	71%	0.709	S	S	*	*				179.8	147.2	68.3	-97.9	140.1	0	0	0	106
1380	N	29.1	Very low	28.5	Very low	114 Å²	114	132.9 Å²	132.9	61%	0.61	71%	0.705	S	S	*	*			cis	-163.2	-154.1	-11.3	-106.5	4.3	0	0	0	105.5
1381	N	25.6	Very low	28.8	Very low	117 Å²	117	132.2 Å²	132.2	63%	0.626	70%	0.701	S	S	*	*				-19.4	148	115.8	3	-27	0	0	0	113.5
1382	D	32.4	Very low	29	Very low	132 Å²	132	129.7 Å²	129.7	71%	0.706	70%	0.696	S	S	*	*			cis	-133.1	164.1	24.1	-77.3	-68.1	0	0	0	109.6
1383	N	25.3	Very low	29	Very low	143 Å²	143	129.5 Å²	129.5	77%	0.765	69%	0.692	S	S	*	*				41.2	126.9	82.2	-114.9	-3.2	0	0	0	114.7
1384	I	32	Very low	29	Very low	137 Å²	137	130 Å²	130	70%	0.703	69%	0.693	S	S	*	*			trans	84.9	85.8	157.6	-51.5	165.2	0	0	0	118.3
1385	N	27.9	Very low	29.1	Very low	139 Å²	139	128 Å²	128	74%	0.743	69%	0.688	S	S	*	*				63.9	173	111.6	-55.1	-0.9	0	0	0	124
1386	D	31.8	Very low	29.5	Very low	134 Å²	134	129.3 Å²	129.3	72%	0.717	69%	0.693	S	S	*	*			trans	76	125.7	161.4	-70	12.9	0	0	0	118
1387	N	29.7	Very low	29.7	Very low	132 Å²	132	129.2 Å²	129.2	71%	0.706	69%	0.693	S	S	*	*			cis	-147.5	155.1	-5.9	-98.3	-62	0	0	0	106.8
1388	T	30.6	Very low	30.1	Very low	118 Å²	118	134.4 Å²	134.4	72%	0.724	71%	0.708	S	S	*	*			cis	-157.5	143.4	49.1	50	0	0	0	0	113.2
1389	T	30.7	Very low	30.3	Very low	114 Å²	114	131.6 Å²	131.6	70%	0.699	71%	0.71	S	S	*	*			trans	56.3	120.2	131.2	-52	0	0	0	0	119.1
1390	D	30.2	Very low	30.5	Very low	123 Å²	123	132.2 Å²	132.2	66%	0.658	71%	0.713	S	S	*	*			cis	-167.5	157	8.2	-119.6	20.2	0	0	0	113.3
1391	N	31.4	Very low	30.4	Very low	112 Å²	112	133.9 Å²	133.9	60%	0.599	72%	0.722	S	S	*	*			trans	67	118	143.7	-65.5	-34.3	0	0	0	124.4
1392	N	33.4	Very low	30.5	Very low	135 Å²	135	135.5 Å²	135.5	72%	0.722	73%	0.729	S	S	*	*				77.7	144.1	120.6	-64.6	-10.4	0	0	0	121.5
1393	H	31	Very low	30.6	Very low	149 Å²	149	136 Å²	136	69%	0.69	73%	0.731	S	S	*	*			cis	-175.1	154.3	-15.5	-151.9	-41.1	0	0	0	109
1394	I	32.2	Very low	31.1	Very low	128 Å²	128	135 Å²	135	66%	0.656	73%	0.725	S	S	*	*			trans	69	142.7	151.8	-93.9	157.1	0	0	0	116.6
1395	D	32.4	Very low	31	Very low	124 Å²	124	135 Å²	135	66%	0.663	73%	0.726	S	S	*	*			cis	-154.4	165.2	-2.7	-112.5	-26.3	0	0	0	111.7
1396	T	32.6	Very low	31.2	Very low	117 Å²	117	136.3 Å²	136.3	72%	0.718	73%	0.728	S	S	*	*			trans	36.1	137.2	154.3	61.6	0	0	0	0	121.3
1397	N	29.7	Very low	31.1	Very low	152 Å²	152	137 Å²	137	81%	0.813	73%	0.731	S	S	*	*			cis	-147.2	167.2	31.7	-115.6	-22.3	0	0	0	114.2
1398	Q	32.6	Very low	30.9	Very low	188 Å²	188	135.6 Å²	135.6	88%	0.879	73%	0.732	S	S	*	*			trans	-82.5	172.5	-171	-74.4	174.4	-13.8	0	0	114.4
1399	S	30.2	Very low	30.9	Very low	112 Å²	112	135 Å²	135	78%	0.783	73%	0.732	S	S	*	*			cis	-141.1	-157.3	20	67.5	0	0	0	0	114.9
1400	I	28.9	Very low	30.9	Very low	157 Å²	157	137 Å²	137	81%	0.805	74%	0.736	S	S	*	*			trans	-139.9	166.1	-165.8	-69.3	176.4	0	0	0	110.5
1401	N	27.2	Very low	30.8	Very low	149 Å²	149	137.5 Å²	137.5	80%	0.797	74%	0.738	S	S	*	*			trans	-56.8	169.3	172.1	-52.2	-63.7	0	0	0	114.3
1402	I	29.1	Very low	30.9	Very low	151 Å²	151	138.8 Å²	138.8	77%	0.774	74%	0.744	S	S	*	*			trans	-46.5	155.6	160.3	49.8	165	0	0	0	113.4
1403	I	34	Very low	30.8	Very low	143 Å²	143	138.1 Å²	138.1	73%	0.733	74%	0.74	S	S	*	*				-157.7	151.1	71.2	-80.7	171	0	0	0	112.9
1404	N	35	Very low	30.8	Very low	120 Å²	120	138.7 Å²	138.7	64%	0.642	74%	0.743	S	S	*	*			trans	-8.4	152.7	153.3	-56.1	66.4	0	0	0	118.9
1405	D	31.5	Very low	31	Very low	137 Å²	137	137.8 Å²	137.8	73%	0.733	74%	0.744	S	S	*	*			cis	-166.7	171.9	-0.5	-117.9	-31.5	0	0	0	113.5
1406	Q	30.9	Very low	31	Very low	167 Å²	167	138 Å²	138	78%	0.78	75%	0.745	S	S	*	*			trans	71.6	102.1	163.4	-65.8	-159.2	8.2	0	0	121.9
1407	L	29.1	Very low	31.2	Very low	148 Å²	148	138.3 Å²	138.3	78%	0.775	74%	0.742	S	S	*	*				62.9	110	120	-72.3	164.6	0	0	0	122.8
1408	S	26.1	Very low	31.5	Very low	103 Å²	103	137.1 Å²	137.1	72%	0.72	74%	0.736	S	S	*	*				99.5	150.4	120.3	79.2	0	0	0	0	121.1
1409	S	31.8	Very low	31.8	Very low	106 Å²	106	133.9 Å²	133.9	74%	0.741	73%	0.725	S	S	*	*			trans	68.9	135.6	178.4	75	0	0	0	0	117.1
1410	M	29	Very low	32.4	Very low	157 Å²	157	136.3 Å²	136.3	77%	0.773	73%	0.729	S	S	*	*			cis	-161.3	161.4	-24.7	-148.5	91.1	100.3	0	0	109.6
1411	D	28.1	Very low	32.8	Very low	132 Å²	132	132 Å²	132	71%	0.706	72%	0.724	S	S	*	*			trans	70.5	122.6	142.6	-76.3	-10.1	0	0	0	123.2
1412	I	33.3	Very low	33.4	Very low	140 Å²	140	132.2 Å²	132.2	72%	0.718	72%	0.724	S	S	*	*				105.8	114	129.9	-73.4	166.1	0	0	0	119.7
1413	N	32	Very low	34	Very low	120 Å²	120	131.6 Å²	131.6	64%	0.642	72%	0.723	S	S	*	*			trans	72.7	114.2	160.1	-66.9	21.7	0	0	0	118.6
1414	E	32.1	Very low	34.3	Very low	162 Å²	162	131.3 Å²	131.3	76%	0.757	72%	0.723	S	S	*	*				75.5	138.4	64.3	-68.7	174.2	179.1	0	0	111.8
1415	T	34.7	Very low	34.5	Very low	108 Å²	108	132 Å²	132	66%	0.663	73%	0.727	S	S	*	*			cis	-149.3	141.9	34.2	48.6	0	0	0	0	114.6
1416	N	33.3	Very low	34.8	Very low	130 Å²	130	132 Å²	132	70%	0.695	73%	0.726	S	S	*	*			trans	70.4	143.4	132	-66.8	52.7	0	0	0	120.8
1417	D	35.7	Very low	35.1	Very low	123 Å²	123	130.4 Å²	130.4	66%	0.658	72%	0.723	S	S	*	*			cis	-151	148.2	6.2	-90.4	-33.6	0	0	0	112.3
1418	N	37.5	Very low	35.4	Very low	126 Å²	126	130.2 Å²	130.2	67%	0.674	72%	0.723	S	S	*	*			trans	64.6	142.1	143.9	-70.5	45.4	0	0	0	121.9
1419	D	37.9	Very low	35.6	Very low	121 Å²	121	132.8 Å²	132.8	65%	0.647	72%	0.724	S	S	*	*			cis	-153.5	154.3	-2.7	-82.6	-36.1	0	0	0	111
1420	D	42.1	Very low	35.6	Very low	162 Å²	162	135.6 Å²	135.6	87%	0.866	73%	0.725	S	S	*	*			trans	37.5	141.4	155.6	-46.7	-20.6	0	0	0	123
1421	G	38.9	Very low	35.8	Very low	68 Å²	68	135.9 Å²	135.9	70%	0.701	72%	0.724	S	S	*	*			cis	172.5	154.1	-5.2	0	0	0	0	0	115
1422	D	39.6	Very low	36.2	Very low	152 Å²	152	134.9 Å²	134.9	81%	0.813	72%	0.723	S	S	*	*			trans	73.2	104.7	150.9	-48	-3.2	0	0	0	124.7
1423	D	41.7	Very low	35.9	Very low	139 Å²	139	137.6 Å²	137.6	74%	0.743	73%	0.733	S	S	*	*				77.9	99.9	120.9	-55.6	3.2	0	0	0	126.3
1424	D	39.2	Very low	35.8	Very low	136 Å²	136	135.9 Å²	135.9	73%	0.727	74%	0.743	S	S	*	*				64.3	110.3	107.7	-58.5	10.9	0	0	0	126.1
1425	D	39.9	Very low	35.6	Very low	136 Å²	136	135.4 Å²	135.4	73%	0.727	75%	0.746	S	S	*	*				65.3	128.2	107.2	-58.2	0.3	0	0	0	127.4
1426	D	38.5	Very low	35.2	Very low	136 Å²	136	134 Å²	134	73%	0.727	74%	0.74	S	S	*	*				79.1	133.6	127.1	-62	-1	0	0	0	129
1427	D	37.7	Very low	34.9	Very low	134 Å²	134	133.6 Å²	133.6	72%	0.717	74%	0.743	S	S	*	*			trans	70	109.2	135.2	-67.6	6.8	0	0	0	127.4
1428	D	34.3	Very low	34.7	Very low	143 Å²	143	135.9 Å²	135.9	77%	0.765	75%	0.747	S	S	*	*				69.1	136.5	116.6	-80.2	6.4	0	0	0	128
1429	E	31.4	Very low	34.4	Very low	158 Å²	158	137.4 Å²	137.4	74%	0.738	75%	0.75	S	S	*	*			trans	74.5	123.5	144.3	-63.6	-81.6	91.6	0	0	125.2
1430	E	31.7	Very low	33.8	Very low	164 Å²	164	140 Å²	140	77%	0.766	76%	0.758	S	S	*	*			trans	72.5	149.4	143.3	-67.9	-151.6	135.7	0	0	127.3
1431	E	31.7	Very low	33.4	Very low	163 Å²	163	136.4 Å²	136.4	76%	0.762	74%	0.744	S	S	*	*			trans	72	106.5	156.7	-67.9	-104	112.2	0	0	124.2
1432	V	36.4	Very low	32.9	Very low	112 Å²	112	139.2 Å²	139.2	68%	0.679	74%	0.743	S	S	*	*				73.4	119.5	126.4	-178.3	0	0	0	0	122.8
1433	E	28.6	Very low	32.4	Very low	197 Å²	197	139.3 Å²	139.3	92%	0.921	74%	0.738	S	S	*	*			trans	20.9	121.7	152.9	-59.4	-168.3	172.2	0	0	122.5
1434	G	29.9	Very low	31.7	Very low	83 Å²	83	139.8 Å²	139.8	86%	0.856	74%	0.74	S	S	*	*			trans	-159.7	118.7	160.1	0	0	0	0	0	112.3
1435	D	27.1	Very low	31.3	Very low	152 Å²	152	140.1 Å²	140.1	81%	0.813	74%	0.74	S	S	*	*			trans	-101.2	151.9	-162.9	-174.7	33.3	0	0	0	116
1436	S	26.5	Very low	30.9	Very low	78 Å²	78	139.8 Å²	139.8	55%	0.545	74%	0.739	S	S	.	*			trans	75	124.2	147.9	74.2	0	0	0	0	122.8
1437	T	27.3	Very low	30.5	Very low	123 Å²	123	140.7 Å²	140.7	76%	0.755	74%	0.743	S	S	*	*			trans	69.8	129.4	143.7	66.2	0	0	0	0	119.3
1438	K	31.7	Very low	30.4	Very low	171 Å²	171	137.5 Å²	137.5	74%	0.743	74%	0.742	S	S	*	*				-159.2	142.7	62.8	-87.4	169.4	-176.8	157.7	0	115.4
1439	Q	30.3	Very low	30.3	Very low	157 Å²	157	137.9 Å²	137.9	73%	0.734	74%	0.743	S	S	*	*			trans	64.3	127.9	143	-63.1	165.4	-55.3	0	0	118.4
1440	Q	25.1	Very low	30.5	Very low	175 Å²	175	136.5 Å²	136.5	82%	0.818	74%	0.74	S	S	*	*			cis	71.8	154.7	48.2	-79.3	-160	-18.6	0	0	114.9
1441	P	34.6	Very low	30.5	Very low	87 Å²	87	135.8 Å²	135.8	57%	0.565	74%	0.737	S	S	*	*			cis	-139.7	-158	-23.5	36.1	-15.2	0	0	0	112.2
1442	N	28.2	Very low	30.5	Very low	128 Å²	128	136.1 Å²	136.1	68%	0.684	74%	0.739	S	S	*	*			trans	68.6	162.1	154.9	-66.4	11.7	0	0	0	115.9
1443	E	29.7	Very low	30.3	Very low	153 Å²	153	135.8 Å²	135.8	72%	0.715	74%	0.737	S	S	*	*			cis	-148.3	168.2	-6.2	-132	158.5	-122.2	0	0	112.3
1444	L	25.3	Very low	30.5	Very low	149 Å²	149	133.4 Å²	133.4	78%	0.78	73%	0.729	S	S	*	*			trans	-35.5	148.5	162.6	-68.9	138.5	0	0	0	116.3
1445	I	30.9	Very low	30.3	Very low	144 Å²	144	134.9 Å²	134.9	74%	0.738	73%	0.725	S	S	*	*				165.9	137.6	119	-86.4	157.3	0	0	0	113.1
1446	N	31.9	Very low	30.5	Very low	129 Å²	129	134.7 Å²	134.7	69%	0.69	73%	0.73	S	S	*	*			trans	64.8	120.8	168.5	-68.1	-27.4	0	0	0	118.6
1447	N	31.1	Very low	30.4	Very low	154 Å²	154	137.6 Å²	137.6	82%	0.824	74%	0.739	S	S	*	*				79.5	123.6	55.1	-67.2	-37	0	0	0	112.8
1448	G	33.9	Very low	30.6	Very low	68 Å²	68	141.4 Å²	141.4	70%	0.701	75%	0.745	S	S	*	*			cis	-145.1	-150	0	0	0	0	0	0	111.6
1449	I	33.5	Very low	30.4	Very low	151 Å²	151	139.2 Å²	139.2	77%	0.774	74%	0.74	S	S	*	*			cis	-147.8	121.5	12.8	-71	177.4	0	0	0	109.8
1450	N	34.8	Very low	30.1	Very low	128 Å²	128	136.3 Å²	136.3	68%	0.684	74%	0.737	S	S	*	*			trans	54.5	158.1	142.4	-51.4	15.6	0	0	0	120.7
1451	E	33	Very low	30.3	Very low	149 Å²	149	135.5 Å²	135.5	70%	0.696	74%	0.738	S	S	*	*			cis	-155.5	144.6	8.2	-138.4	144.6	-110.8	0	0	111.3
1452	E	30.3	Very low	30.1	Very low	171 Å²	171	136.5 Å²	136.5	80%	0.799	74%	0.742	S	S	*	*			trans	44.8	151.8	144.6	-68.6	-170.7	-172.5	0	0	123.6
1453	T	33.3	Very low	30.2	Very low	105 Å²	105	136.6 Å²	136.6	64%	0.644	74%	0.743	S	S	*	*			cis	-155.6	161.3	3.6	3.7	0	0	0	0	112.5
1454	I	32.4	Very low	30.1	Very low	146 Å²	146	136.3 Å²	136.3	75%	0.749	75%	0.746	S	S	*	*			trans	51.4	110.3	150.7	-61.4	158.3	0	0	0	118.3
1455	C	26	Very low	30.1	Very low	114 Å²	114	137.7 Å²	137.7	77%	0.77	75%	0.748	S	S	*	*				72.2	101.2	55.5	-64.5	0	0	0	0	118.1
1456	T	30.4	Very low	29.7	Very low	149 Å²	149	136.3 Å²	136.3	91%	0.914	75%	0.75	S	S	*	*				-163.3	138.7	125.3	7.2	0	0	0	0	112
1457	N	25.6	Very low	29.8	Very low	138 Å²	138	135.5 Å²	135.5	74%	0.738	75%	0.75	S	S	*	*			trans	-123.3	139.5	-179.4	-119.5	-20.8	0	0	0	110.4	I1459	N1457-I1459 HydrophobicContact CB-CD1 4.29Å
1458	K	30.5	Very low	29.6	Very low	203 Å²	203	135.9 Å²	135.9	88%	0.883	75%	0.747	S	S	*	*			trans	-171.2	102.7	155.1	-108.8	164.9	-177.2	-179.7	0	107.9
1459	I	27.1	Very low	29.3	Very low	125 Å²	125	138.8 Å²	138.8	64%	0.641	74%	0.744	S	S	*	*			cis	73	100.4	44.8	-56.5	-177.9	0	0	0	113	N1457	N1457-I1459 HydrophobicContact CB-CD1 4.29Å
1460	S	24.7	Very low	29	Very low	96 Å²	96	138.3 Å²	138.3	67%	0.671	74%	0.742	S	S	*	*			trans	25.1	137.3	147.9	66.7	0	0	0	0	122.6
1461	L	28.4	Very low	28.4	Very low	158 Å²	158	137.7 Å²	137.7	83%	0.827	75%	0.747	S	S	*	*			trans	-168.3	150.3	131.2	-123.8	66.2	0	0	0	105.6
1462	V	31.8	Very low	28.1	Very low	109 Å²	109	133.7 Å²	133.7	66%	0.661	74%	0.735	S	S	*	*			cis	-149.4	137.9	23.5	-180	0	0	0	0	110.5
1463	D	29.2	Very low	28	Very low	130 Å²	130	133.1 Å²	133.1	70%	0.695	74%	0.735	S	S	*	*			trans	40	156.7	150.1	-45.2	-13.9	0	0	0	125.7
1464	N	28.9	Very low	27.9	Very low	147 Å²	147	134.7 Å²	134.7	79%	0.786	74%	0.739	S	S	*	*			trans	67	119.1	164.8	-51.7	-39.6	0	0	0	116.4
1465	E	25	Very low	27.9	Very low	177 Å²	177	135 Å²	135	83%	0.827	74%	0.742	S	S	*	*			cis	74.6	117	27.9	-151.9	-174	-112.5	0	0	116
1466	C	21.1	Very low	27.9	Very low	116 Å²	116	137.1 Å²	137.1	78%	0.784	75%	0.746	S	S	*	*			trans	61.2	-178.6	164.8	-121.8	0	0	0	0	119.2
1467	T	35.2	Very low	27.9	Very low	112 Å²	112	135.1 Å²	135.1	69%	0.687	73%	0.734	S	S	*	*			trans	73.1	101.5	177.2	-33.6	0	0	0	0	112.7
1468	Q	27.2	Very low	28.2	Very low	161 Å²	161	136.1 Å²	136.1	75%	0.752	73%	0.734	S	S	*	*				60.2	147.2	75.9	-61.7	-178.1	6.4	0	0	112.8
1469	M	27.9	Very low	28.2	Very low	129 Å²	129	133.1 Å²	133.1	64%	0.635	73%	0.726	S	S	*	*			cis	-148.5	168.4	22	-135.6	175	-76.7	0	0	107
1470	I	25.3	Very low	28.3	Very low	142 Å²	142	133 Å²	133	73%	0.728	73%	0.727	S	S	*	*	S	Bend	cis	-133.2	120.8	21.3	-61.3	174.1	0	0	0	112.7
1471	S	22.3	Very low	28.5	Very low	114 Å²	114	135.6 Å²	135.6	80%	0.797	73%	0.728	S	S	*	*			trans	-129.7	63.6	146	67	0	0	0	0	108.9
1472	S	28.3	Very low	28.7	Very low	65 Å²	65	133 Å²	133	46%	0.455	71%	0.714	S	S	.	*			trans	-132.9	84.9	173.6	31.6	0	0	0	0	106.7
1473	M	28.5	Very low	28.7	Very low	160 Å²	160	130.4 Å²	130.4	79%	0.788	70%	0.704	S	S	*	*				72.2	123.7	76.4	-68.7	-177.1	66.1	0	0	113.5
1474	N	30.3	Very low	28.8	Very low	137 Å²	137	127.8 Å²	127.8	73%	0.733	70%	0.701	S	S	*	*	S	Bend	trans	30.3	124.1	148.8	-60	-9.9	0	0	0	119.6	D1476	N1474-D1476 PolarHBondContact O-N 3.2Å
1475	N	31.9	Very low	28.9	Very low	152 Å²	152	127 Å²	127	81%	0.813	70%	0.696	S	S	*	*			trans	30.1	89.7	133.5	-61	-6.4	0	0	0	116.3
1476	D	26.7	Very low	29.2	Very low	159 Å²	159	125.6 Å²	125.6	85%	0.85	69%	0.69	S	S	*	*				-119.3	163	115	-127.8	-40	0	0	0	110.1	N1474	N1474-D1476 PolarHBondContact O-N 3.2Å
1477	T	31.1	Very low	29.5	Very low	108 Å²	108	126.3 Å²	126.3	66%	0.663	69%	0.69	S	S	*	*			trans	-96.9	158.7	-148.5	55.5	0	0	0	0	116.4
1478	H	30.6	Very low	29.2	Very low	159 Å²	159	127 Å²	127	74%	0.736	70%	0.7	S	S	*	*			trans	81.9	115.2	162.6	-72.3	-77.6	0	0	0	121.1
1479	I	30	Very low	29.1	Very low	139 Å²	139	125.9 Å²	125.9	71%	0.713	70%	0.699	S	S	*	*				89.8	121.6	128	-69	171.5	0	0	0	119.1
1480	N	30.5	Very low	29.1	Very low	123 Å²	123	125.8 Å²	125.8	66%	0.658	70%	0.699	S	S	*	*			trans	76.9	116.4	156.2	-76.7	26.1	0	0	0	122.5
1481	E	29.3	Very low	29	Very low	150 Å²	150	126.3 Å²	126.3	70%	0.701	70%	0.702	S	S	*	*				84.3	120.2	123	-71.3	178.2	125.2	0	0	122
1482	I	32	Very low	29.2	Very low	105 Å²	105	126.6 Å²	126.6	54%	0.538	70%	0.704	S	S	.	*				93.6	144.3	127.9	-73.3	174.2	0	0	0	118	S97 S98	S97-I1482 CarbonylContact O-C 3.58Å; S97-I1482 VanDerWaalsContact O-CA 3.3Å; S97-I1482 WeakPolarHBondContact O-CA 3.35Å; S98-I1482 WeakPolarHBondContact O-CG2 3.31Å
1483	A	30.5	Very low	29.2	Very low	53 Å²	53	130 Å²	130	44%	0.438	72%	0.717	S	S	.	*			trans	-149.2	-160	-144.1	0	0	0	0	0	117.5	S97 S98	S97-A1483 VanDerWaalsContact C-N 3.27Å; S97-A1483 CarbonylContact C-O 3.54Å; S97-A1483 PolarHBondContact O-N 3.35Å; S98-A1483 CarbonylContact C-O 3.41Å; S98-A1483 WeakPolarHBondContact CA-O 3.4Å; S98-A1483 PolarHBondContact N-O 2.88Å; S98-A1483 VanDerWaalsContact O-O 3.12Å
1484	A	32.1	Very low	28.9	Very low	76 Å²	76	127.3 Å²	127.3	63%	0.628	71%	0.713	S	S	*	*			trans	87.3	158.4	178.7	0	0	0	0	0	116
1485	D	31.9	Very low	28.5	Very low	131 Å²	131	131.4 Å²	131.4	70%	0.701	72%	0.72	S	S	*	*			cis	-157.2	169.4	2.2	-142.3	-24.3	0	0	0	114.4
1486	Q	31.5	Very low	28.3	Very low	146 Å²	146	131.6 Å²	131.6	68%	0.682	72%	0.721	S	S	*	*			trans	26.4	114.7	152.4	-81.5	159.1	81	0	0	122.4
1487	T	27.5	Very low	28.4	Very low	131 Å²	131	131.3 Å²	131.3	80%	0.804	71%	0.714	S	S	*	*				67.1	133.8	85.8	64	0	0	0	0	119
1488	S	27.9	Very low	28.4	Very low	126 Å²	126	133.4 Å²	133.4	88%	0.881	72%	0.716	S	S	*	*			trans	-125	147	160.1	61.9	0	0	0	0	111.2
1489	D	26	Very low	28.1	Very low	138 Å²	138	133 Å²	133	74%	0.738	72%	0.719	S	S	*	*			trans	-143.2	168.3	-175.4	-162.8	1.3	0	0	0	111
1490	M	26.3	Very low	28	Very low	128 Å²	128	132.3 Å²	132.3	63%	0.631	72%	0.72	S	S	*	*			trans	74.7	123.3	163.1	-66.1	-87.9	83.2	0	0	121
1491	L	23.7	Very low	27.7	Very low	153 Å²	153	134.7 Å²	134.7	80%	0.801	73%	0.725	S	S	*	*			trans	65.8	115.3	138.3	-60.9	168	0	0	0	121.1
1492	S	25.6	Very low	27.6	Very low	119 Å²	119	133.8 Å²	133.8	83%	0.832	74%	0.735	S	S	*	*				-161.2	179.4	107.2	-156.8	0	0	0	0	113
1493	N	28.7	Very low	27.3	Very low	138 Å²	138	133.5 Å²	133.5	74%	0.738	74%	0.743	S	S	*	*			trans	-82.3	142.5	-164.1	-73	-62.4	0	0	0	116.3
1494	C	21.8	Very low	27.1	Very low	103 Å²	103	135.9 Å²	135.9	70%	0.696	76%	0.756	S	S	*	*			trans	53.9	143.7	130	-58.5	0	0	0	0	123.5
1495	Y	22.3	Very low	26.9	Very low	222 Å²	222	140 Å²	140	87%	0.871	77%	0.766	S	S	*	*			trans	67.5	80.7	158.9	-72.2	-66.9	0	0	0	119.2
1496	N	28.7	Very low	26.6	Very low	156 Å²	156	138.6 Å²	138.6	83%	0.834	76%	0.755	S	S	*	*			trans	-166.2	159.6	137.5	-95.8	-31.9	0	0	0	108.8
1497	H	29.4	Very low	26.4	Very low	153 Å²	153	137.6 Å²	137.6	71%	0.708	76%	0.764	S	S	*	*			cis	-155	162.9	-34.8	-159.8	-114.2	0	0	0	107.5
1498	H	30.6	Very low	26.2	Very low	153 Å²	153	136.7 Å²	136.7	71%	0.708	75%	0.754	S	S	*	*			trans	56.8	135	161.9	-126.8	-104.5	0	0	0	121.4
1499	L	23.8	Very low	26.1	Very low	151 Å²	151	137.1 Å²	137.1	79%	0.791	76%	0.756	S	S	*	*			trans	-103.3	122.5	168.3	-178.1	82.8	0	0	0	109
1500	V	27.1	Very low	26.1	Very low	124 Å²	124	136.7 Å²	136.7	75%	0.752	76%	0.758	S	S	*	*			trans	-132.1	146.5	165.1	-174.2	0	0	0	0	109.6
1501	K	24.7	Very low	26.2	Very low	173 Å²	173	136.5 Å²	136.5	75%	0.752	76%	0.764	S	S	*	*			trans	-85.2	151.9	-170.6	-56.7	160.2	-177.2	166.7	0	111.7
1502	S	26.8	Very low	26.4	Very low	131 Å²	131	135.4 Å²	135.4	92%	0.916	76%	0.763	S	S	*	*			trans	-154.2	145.4	134.3	-80.6	0	0	0	0	108.9
1503	S	26.2	Very low	26.4	Very low	99 Å²	99	136.2 Å²	136.2	69%	0.692	75%	0.754	S	S	*	*			trans	-114.6	145.2	-178.3	53.1	0	0	0	0	110.9
1504	S	25.5	Very low	26.5	Very low	103 Å²	103	137.6 Å²	137.6	72%	0.72	75%	0.753	S	S	*	*			trans	-61.3	148.3	-176.5	54.8	0	0	0	0	115.2
1505	I	28.3	Very low	26.6	Very low	163 Å²	163	139.5 Å²	139.5	84%	0.836	75%	0.754	S	S	*	*			trans	-109.7	148.5	153.1	-71	178.2	0	0	0	108.3
1506	H	25.8	Very low	27.2	Very low	101 Å²	101	134.2 Å²	134.2	47%	0.468	75%	0.746	S	S	.	*			trans	-86.7	161.7	178.4	-97.5	-118.1	0	0	0	112	D1508 K1527	H1506-D1508 IonicContact CE1-OD1 3.83Å; H1506-D1508 IonicContact CG-OD1 2.88Å; H1506-D1508 IonicContact ND1-OD1 2.63Å; H1506-D1508 PolarHBondContact ND1-OD1 3.5Å; H1506-D1508 IonicContact ND1-OD2 2.77Å; H1506-K1527 PolarHBondContact CD2-NZ 2.79Å; H1506-K1527 PolarHBondContact CE1-NZ 3.37Å; H1506-K1527 VanDerWaalsContact CE1-NZ 3.27Å; H1506-K1527 PolarHBondContact NE2-NZ 3.43Å
1507	S	27.5	Very low	27.2	Very low	125 Å²	125	131.7 Å²	131.7	87%	0.874	73%	0.733	S	S	*	*			trans	-147.9	134.7	142.8	-72.3	0	0	0	0	107.9
1508	D	24.1	Very low	27.2	Very low	112 Å²	112	131.9 Å²	131.9	60%	0.599	73%	0.734	S	S	*	*			trans	-116.8	166.8	-165.6	-51.2	-71	0	0	0	111.4	H1506	H1506-D1508 IonicContact CE1-OD1 3.83Å; H1506-D1508 IonicContact CG-OD1 2.88Å; H1506-D1508 IonicContact ND1-OD1 2.63Å; H1506-D1508 PolarHBondContact ND1-OD1 3.5Å; H1506-D1508 IonicContact ND1-OD2 2.77Å
1509	C	26.1	Very low	27	Very low	135 Å²	135	132.3 Å²	132.3	91%	0.912	74%	0.736	S	S	*	*			trans	-146.2	150.6	158.3	-96.7	0	0	0	0	110.3
1510	T	25	Very low	27.3	Very low	129 Å²	129	131.9 Å²	131.9	79%	0.791	73%	0.733	S	S	*	*			trans	-133.4	-147.1	-162.6	57.5	0	0	0	0	111.8
1511	V	29.2	Very low	27.3	Very low	124 Å²	124	130 Å²	130	75%	0.752	73%	0.726	S	S	*	*			trans	87.2	96.5	178.7	-174.1	0	0	0	0	113.5
1512	V	27.1	Very low	27.4	Very low	129 Å²	129	129.2 Å²	129.2	78%	0.782	73%	0.725	S	S	*	*				83	130.9	74.1	157.3	0	0	0	0	111.7
1513	E	26.6	Very low	27.4	Very low	137 Å²	137	127.7 Å²	127.7	64%	0.64	71%	0.714	S	S	*	*			cis	-136.7	-150.9	2.6	-136.8	-158.1	118.4	0	0	109.9
1514	K	29	Very low	27.5	Very low	166 Å²	166	129 Å²	129	72%	0.722	72%	0.717	S	S	*	*			cis	-149.7	168	9.4	-164.3	129.7	-166.1	76.1	0	111.2
1515	M	25.5	Very low	27.5	Very low	143 Å²	143	132.8 Å²	132.8	70%	0.704	72%	0.724	S	S	*	*			trans	-115.6	164	178.8	-130.8	165.3	-179.9	0	0	111.9
1516	P	34.1	Very low	27.4	Very low	111 Å²	111	133 Å²	133	72%	0.721	72%	0.722	S	S	*	*				-139.6	132.5	86.4	27.5	-6.9	0	0	0	113.9
1517	D	27.9	Very low	27.4	Very low	104 Å²	104	134 Å²	134	56%	0.556	72%	0.724	S	S	*	*				87.1	140	85.6	-63.9	-31.4	0	0	0	113.4
1518	H	30.1	Very low	27.3	Very low	156 Å²	156	133.6 Å²	133.6	72%	0.722	72%	0.717	S	S	*	*			cis	-151.4	171.9	-6.8	-91.6	-22	0	0	0	106
1519	Q	27.5	Very low	27.3	Very low	162 Å²	162	132.4 Å²	132.4	76%	0.757	72%	0.717	S	S	*	*			cis	-140.8	138.5	21.5	-74	-179.1	-20.2	0	0	111.6
1520	I	29.5	Very low	27.2	Very low	142 Å²	142	132.7 Å²	132.7	73%	0.728	71%	0.71	S	S	*	*				48.8	121.4	125.2	-53.1	166.1	0	0	0	116.6
1521	S	27.4	Very low	27.5	Very low	86 Å²	86	133.1 Å²	133.1	60%	0.601	71%	0.713	S	S	*	*			cis	-175.6	178.4	3.9	-100	0	0	0	0	107.5
1522	E	26.4	Very low	27.2	Very low	156 Å²	156	133.7 Å²	133.7	73%	0.729	72%	0.716	S	S	*	*			cis	-158.2	149.7	-4.3	-108.4	137.8	-132	0	0	104.4
1523	S	25.7	Very low	27.3	Very low	98 Å²	98	133.4 Å²	133.4	69%	0.685	72%	0.715	S	S	*	*			cis	63	92.8	44.7	65.1	0	0	0	0	114.5
1524	V	28.3	Very low	27.1	Very low	126 Å²	126	133.4 Å²	133.4	76%	0.764	72%	0.724	S	S	*	*			cis	80.3	119.2	28	-176.6	0	0	0	0	115.9
1525	E	26.3	Very low	27.1	Very low	183 Å²	183	131 Å²	131	86%	0.855	72%	0.724	S	S	*	*			trans	172.2	144.2	146.4	-94.5	158.2	-167.1	0	0	107.5
1526	Q	26.4	Very low	27.1	Very low	169 Å²	169	131.2 Å²	131.2	79%	0.79	73%	0.733	S	S	*	*			cis	70.8	140.5	39.3	-61.3	-159.2	6.9	0	0	113.4
1527	K	25.4	Very low	26.9	Very low	120 Å²	120	131.3 Å²	131.3	52%	0.522	73%	0.732	S	S	.	*			cis	-167.1	147.5	36.2	-150.3	173.2	179.3	-178.7	0	110.8	H1506	H1506-K1527 PolarHBondContact CD2-NZ 2.79Å; H1506-K1527 PolarHBondContact CE1-NZ 3.37Å; H1506-K1527 VanDerWaalsContact CE1-NZ 3.27Å; H1506-K1527 PolarHBondContact NE2-NZ 3.43Å
1528	T	25.3	Very low	26.8	Very low	118 Å²	118	133.1 Å²	133.1	72%	0.724	75%	0.747	S	S	*	*			trans	51.4	151.4	151.3	47.8	0	0	0	0	122.1
1529	S	24.1	Very low	26.6	Very low	87 Å²	87	130.7 Å²	130.7	61%	0.608	75%	0.747	S	S	*	*			cis	-166.9	154.7	-8.2	-93.9	0	0	0	0	112.3
1530	N	24.1	Very low	26.7	Very low	141 Å²	141	129.3 Å²	129.3	75%	0.754	75%	0.75	S	S	*	*			trans	45.6	120	154.6	-60.5	-7.9	0	0	0	122.8
1531	T	30.9	Very low	27	Very low	138 Å²	138	126.6 Å²	126.6	85%	0.847	74%	0.744	S	S	*	*			trans	-156.4	151.1	132.3	-77.7	0	0	0	0	108.9
1532	T	22.7	Very low	27.6	Very low	136 Å²	136	130.1 Å²	130.1	83%	0.834	76%	0.756	S	S	*	*			trans	-96.2	122.3	-173.1	-52.7	0	0	0	0	112.3
1533	T	30	Very low	29	Very low	122 Å²	122	128 Å²	128	75%	0.748	75%	0.746	S	S	*	*			trans	-146.9	134	159.7	-26	0	0	0	0	110.9
1534	T	22.2	Very low	31.1	Very low	137 Å²	137	126 Å²	126	84%	0.84	73%	0.732	S	S	*	*			trans	-78.1	120.2	175.8	37	0	0	0	0	111.6
1535	T	29.1	Very low	33.8	Very low	117 Å²	117	121.1 Å²	121.1	72%	0.718	70%	0.7	S	S	*	*			trans	-148.1	131.5	160.4	-36.7	0	0	0	0	110.3	V1537	T1535-V1537 PolarHBondContact O-N 2.85Å
1536	T	24.6	Very low	36.6	Very low	146 Å²	146	114.5 Å²	114.5	90%	0.896	67%	0.667	S	S	*	*			trans	-75.8	104.6	-178.8	47.2	0	0	0	0	111.1
1537	V	30.4	Very low	39.4	Very low	113 Å²	113	107.2 Å²	107.2	69%	0.685	63%	0.634	S	S	*	*			trans	-117.1	123.9	174.8	-174.1	0	0	0	0	110.5	T1535 S1539	T1535-V1537 PolarHBondContact O-N 2.85Å; V1537-S1539 PolarHBondContact O-N 3.43Å
1538	T	25.6	Very low	42.3	Very low	143 Å²	143	101.5 Å²	101.5	88%	0.877	61%	0.609	S	S	*	*			trans	-69	83.8	-179.6	37	0	0	0	0	112.2	T1540	T1538-T1540 PolarHBondContact O-N 3.3Å
1539	S	26.9	Very low	45.2	Very low	105 Å²	105	96.7 Å²	96.7	73%	0.734	58%	0.58	S	S	*	*			trans	-88	95.1	-179.7	44.1	0	0	0	0	112.3	V1537 S1541	V1537-S1539 PolarHBondContact O-N 3.43Å; S1539-S1541 PolarHBondContact O-N 2.99Å
1540	T	28.4	Very low	48.2	Very low	132 Å²	132	92.6 Å²	92.6	81%	0.81	55%	0.551	S	S	*	*			trans	-69.8	78.2	167	52.5	0	0	0	0	110.3	T1538 N1542	T1538-T1540 PolarHBondContact O-N 3.3Å; T1540-N1542 PolarHBondContact O-N 3.33Å
1541	S	36	Very low	51	Low	86 Å²	86	86.4 Å²	86.4	60%	0.601	52%	0.519	S	S	*	.			trans	-62.7	126.8	176.1	62.8	0	0	0	0	110.6	S1539 Q1543	S1539-S1541 PolarHBondContact O-N 2.99Å; S1541-Q1543 PolarHBondContact O-N 3.42Å
1542	N	41.8	Very low	53.4	Low	160 Å²	160	82.1 Å²	82.1	86%	0.856	50%	0.502	S	S	*	.			trans	-73.3	74.7	179.1	-81.4	-44.1	0	0	0	110.8	T1540 S1544	T1540-N1542 PolarHBondContact O-N 3.33Å; N1542-S1544 PolarHBondContact O-N 3.45Å
1543	Q	54.7	Low	55.9	Low	112 Å²	112	79 Å²	79	52%	0.523	49%	0.486	S	S	.	.			trans	-62.2	95.1	171.5	-67.6	-173.2	-1.3	0	0	109.6	S1541 Y1545	S1541-Q1543 PolarHBondContact O-N 3.42Å; Q1543-Y1545 HydrophobicContact CB-CD2 4.44Å; Q1543-Y1545 HydrophobicContact CB-CE2 3.84Å; Q1543-Y1545 WeakPolarHBondContact O-CD2 3.38Å; Q1543-Y1545 PolarHBondContact O-N 2.93Å; Q1543-Y1545 PolarHBondContact OE1-OH 2.91Å
1544	S	70.2	Confident	57.7	Low	56 Å²	56	74.7 Å²	74.7	39%	0.392	46%	0.459	S	S	.	.			trans	-68.2	121.8	168.3	-68.5	0	0	0	0	108.8	Y1269 N1542	Y1269-S1544 WeakPolarHBondContact CB-O 3.1Å; Y1269-S1544 PolarHBondContact N-O 2.69Å; N1542-S1544 PolarHBondContact O-N 3.45Å
1545	Y	84.3	Confident	60	Low	23 Å²	23	71.8 Å²	71.8	9%	0.09	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	163.8	171.1	-74.3	-107.2	0	0	0	109.4	R1266 V1267 P1300 I1301 P1303 P1304 Q1543	R1266-Y1545 HydrophobicContact CB-CD1 4.16Å; V1267-Y1545 CarbonylContact O-C 3.46Å; V1267-Y1545 WeakPolarHBondContact O-CA 3.49Å; P1300-Y1545 CarbonylContact C-O 3.59Å; P1300-Y1545 WeakPolarHBondContact CA-O 3.46Å; I1301-Y1545 WeakPolarHBondContact CG1-O 3.18Å; I1301-Y1545 PolarHBondContact N-O 3.36Å; I1301-Y1545 WeakPolarHBondContact O-CB 3.44Å; I1301-Y1545 PolarHBondContact O-N 3Å; P1303-Y1545 HydrophobicContact CB-CD2 3.99Å; P1303-Y1545 HydrophobicContact CB-CE2 3.76Å; P1304-Y1545 HydrophobicContact CG-CE1 4.26Å; Q1543-Y1545 HydrophobicContact CB-CD2 4.44Å; Q1543-Y1545 HydrophobicContact CB-CE2 3.84Å; Q1543-Y1545 WeakPolarHBondContact O-CD2 3.38Å; Q1543-Y1545 PolarHBondContact O-N 2.93Å; Q1543-Y1545 PolarHBondContact OE1-OH 2.91Å
1546	R	85.1	Confident	62.5	Low	43 Å²	43	66.5 Å²	66.5	16%	0.162	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	145.4	171.7	-70	172.2	178.5	-109.4	14.3	109	V1267 A1272 V1296 G1297	V1267-R1546 PolarHBondContact N-O 3.09Å; V1267-R1546 PolarHBondContact O-N 2.8Å; A1272-R1546 HydrophobicContact CB-CB 4.34Å; V1296-R1546 HydrophobicContact CG1-CB 4.42Å; G1297-R1546 PolarHBondContact O-NH1 2.97Å
1547	L	85.8	Confident	65.4	Low	16 Å²	16	60.1 Å²	60.1	8%	0.084	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	123.3	173.3	-166.7	69.8	0	0	0	109.4	Y1264 G1297 I1301 L1732	Y1264-L1547 HydrophobicContact CD1-CD2 3.97Å; Y1264-L1547 HydrophobicContact CD1-CG 4.21Å; Y1264-L1547 HydrophobicContact CE1-CD2 4.49Å; G1297-L1547 PolarHBondContact N-O 3.18Å; I1301-L1547 HydrophobicContact CD1-CB 4.14Å; I1301-L1547 HydrophobicContact CD1-CD1 4.29Å; I1301-L1547 HydrophobicContact CG2-CB 4.34Å; L1547-L1732 HydrophobicContact CD2-CD1 4.5Å; L1547-L1732 HydrophobicContact CD2-CD2 4.15Å; L1547-L1732 HydrophobicContact CD2-CG 4.31Å
1548	V	86.7	Confident	67.7	Low	1 Å²	1	57.3 Å²	57.3	1%	0.006	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	132.6	166.2	-175.7	0	0	0	0	108	Y1264 M1265 V1267 I1294 H1295 V1296 L1550 I1564	Y1264-V1548 CarbonylContact C-O 3.47Å; Y1264-V1548 WeakPolarHBondContact CA-O 3.4Å; Y1264-V1548 WeakPolarHBondContact CB-O 3.48Å; M1265-V1548 HydrophobicContact CB-CB 4.5Å; M1265-V1548 HydrophobicContact CE-CB 4.29Å; M1265-V1548 HydrophobicContact CE-CG1 4.08Å; M1265-V1548 PolarHBondContact N-O 3.24Å; M1265-V1548 PolarHBondContact O-N 2.97Å; V1267-V1548 HydrophobicContact CB-CG2 4.01Å; V1267-V1548 HydrophobicContact CG2-CB 4.46Å; V1267-V1548 HydrophobicContact CG2-CG2 3.63Å; I1294-V1548 HydrophobicContact CG2-CG1 3.94Å; H1295-V1548 WeakPolarHBondContact O-CA 3.46Å; V1296-V1548 HydrophobicContact CG1-CG2 4.43Å; V1296-V1548 HydrophobicContact CG2-CG1 4.46Å; V1296-V1548 HydrophobicContact CG2-CG2 4.24Å; V1548-L1550 HydrophobicContact CG1-CD2 4.29Å; V1548-I1564 HydrophobicContact CG1-CD1 4.4Å
1549	C	86.1	Confident	70.3	Confident	17 Å²	17	54.4 Å²	54.4	12%	0.115	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	137	176.6	-179.4	0	0	0	0	109.6	M1262 Y1264 H1295	M1262-C1549 VanDerWaalsContact SD-SG 3.65Å; Y1264-C1549 HydrophobicContact CD1-CB 3.67Å; Y1264-C1549 HydrophobicContact CE1-CB 3.84Å; Y1264-C1549 WeakPolarHBondContact CE1-SG 3.29Å; H1295-C1549 HydrophobicContact CB-CB 4.22Å; H1295-C1549 PolarHBondContact N-O 2.99Å; H1295-C1549 PolarHBondContact O-N 3.28Å
1550	L	87.3	Confident	73.1	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	117.9	178.2	-54.5	179.5	0	0	0	110.1	M1262 L1263 M1265 I1294 V1548 Q1557 A1560 Q1561 I1564	M1262-L1550 WeakPolarHBondContact CB-O 3.41Å; L1263-L1550 HydrophobicContact CB-CB 4.39Å; L1263-L1550 HydrophobicContact CB-CD1 4.46Å; L1263-L1550 HydrophobicContact CD2-CD1 4.29Å; L1263-L1550 PolarHBondContact N-O 2.82Å; L1263-L1550 PolarHBondContact O-N 3.04Å; M1265-L1550 HydrophobicContact CE-CD1 3.72Å; M1265-L1550 HydrophobicContact CE-CD2 4.17Å; M1265-L1550 HydrophobicContact CE-CG 4.06Å; I1294-L1550 HydrophobicContact CB-CD2 4.28Å; I1294-L1550 HydrophobicContact CD1-CD2 4.3Å; I1294-L1550 HydrophobicContact CG1-CD2 3.84Å; I1294-L1550 HydrophobicContact CG2-CD2 3.82Å; V1548-L1550 HydrophobicContact CG1-CD2 4.29Å; L1550-Q1557 HydrophobicContact CB-CB 4.28Å; L1550-Q1557 HydrophobicContact CB-CG 4Å; L1550-Q1557 WeakPolarHBondContact CD1-O 3.33Å; L1550-Q1557 VanDerWaalsContact O-CD 3.23Å; L1550-Q1557 PolarHBondContact O-OE1 3.16Å; L1550-A1560 HydrophobicContact CD1-CB 4.26Å; L1550-A1560 HydrophobicContact CD2-CB 4.09Å; L1550-Q1561 HydrophobicContact CD1-CB 4.09Å; L1550-I1564 HydrophobicContact CD2-CD1 4.05Å
1551	S	82.7	Confident	75.9	Confident	11 Å²	11	43.3 Å²	43.3	8%	0.077	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	168.9	172.8	29.5	0	0	0	0	111.1	A1292 E1293	A1292-S1551 WeakPolarHBondContact CA-O 3.42Å; E1293-S1551 WeakPolarHBondContact CB-OG 3.37Å; E1293-S1551 WeakPolarHBondContact CG-OG 3.48Å; E1293-S1551 PolarHBondContact N-O 3.46Å; E1293-S1551 PolarHBondContact O-N 3.49Å; E1293-S1551 PolarHBondContact O-OG 3.2Å; E1293-S1551 VanDerWaalsContact OE2-CB 3.31Å; E1293-S1551 WeakPolarHBondContact OE2-CB 3.31Å; E1293-S1551 PolarHBondContact OE2-OG 3.32Å
1552	G	81.7	Confident	78.2	Confident	48 Å²	48	44.3 Å²	44.3	50%	0.495	24%	0.24	S	C	.	.	S	Bend	trans	108.5	-162.6	-171.9	0	0	0	0	0	112.8	Q1557	G1552-Q1557 PolarHBondContact O-NE2 2.86Å
1553	S	75.1	Confident	80.3	Confident	72 Å²	72	39.2 Å²	39.2	50%	0.503	21%	0.211	S	C	.	.			trans	-66.9	157.4	178.7	79	0	0	0	0	111.6	Q1555 S1556 Q1557	S1553-Q1555 PolarHBondContact O-N 2.71Å; S1553-S1556 PolarHBondContact N-OG 2.93Å; S1553-S1556 PolarHBondContact O-N 3.38Å; S1553-S1556 PolarHBondContact O-OG 3.02Å; S1553-S1556 WeakPolarHBondContact OG-CB 3.28Å; S1553-S1556 PolarHBondContact OG-N 3.36Å; S1553-S1556 PolarHBondContact OG-OG 3.12Å; S1553-Q1557 WeakPolarHBondContact O-CG 3.33Å; S1553-Q1557 PolarHBondContact O-N 3.45Å
1554	V	66.8	Low	82	Confident	30 Å²	30	33.9 Å²	33.9	18%	0.182	19%	0.187	C	C	.	.	H	α-helix	trans	-61.5	-37.4	178.2	-179.9	0	0	0	0	111.1	P1253 L1257 Q1557 I1558	P1253-V1554 HydrophobicContact CB-CB 3.91Å; P1253-V1554 HydrophobicContact CB-CG1 3.58Å; L1257-V1554 HydrophobicContact CD1-CG2 3.74Å; L1257-V1554 HydrophobicContact CG-CG2 3.98Å; V1554-Q1557 PolarHBondContact O-N 3.31Å; V1554-I1558 HydrophobicContact CG1-CD1 3.86Å; V1554-I1558 HydrophobicContact CG1-CG1 4.47Å; V1554-I1558 WeakPolarHBondContact O-CG1 3.32Å; V1554-I1558 PolarHBondContact O-N 2.88Å
1555	Q	71.2	Confident	82.8	Confident	76 Å²	76	31.8 Å²	31.8	36%	0.355	17%	0.17	S	C	.	.	H	α-helix	trans	-63.3	-44	174.6	-175.6	175.7	2.1	0	0	111.7	I1248 S1553 I1558 M1559	I1248-Q1555 HydrophobicContact CD1-CG 4.32Å; S1553-Q1555 PolarHBondContact O-N 2.71Å; Q1555-I1558 PolarHBondContact O-N 3.01Å; Q1555-M1559 VanDerWaalsContact O-CB 3.26Å; Q1555-M1559 WeakPolarHBondContact O-CB 3.25Å; Q1555-M1559 PolarHBondContact O-N 3.38Å
1556	S	81.9	Confident	82.8	Confident	7 Å²	7	33.2 Å²	33.2	5%	0.049	18%	0.178	C	C	.	.	H	α-helix	trans	-66.9	-40.3	177.5	66.9	0	0	0	0	111.9	T1290 S1553 M1559 A1560	T1290-S1556 WeakPolarHBondContact O-CA 3.37Å; T1290-S1556 WeakPolarHBondContact O-CB 3.11Å; S1553-S1556 PolarHBondContact N-OG 2.93Å; S1553-S1556 PolarHBondContact O-N 3.38Å; S1553-S1556 PolarHBondContact O-OG 3.02Å; S1553-S1556 WeakPolarHBondContact OG-CB 3.28Å; S1553-S1556 PolarHBondContact OG-N 3.36Å; S1553-S1556 PolarHBondContact OG-OG 3.12Å; S1556-M1559 PolarHBondContact O-N 2.92Å; S1556-A1560 VanDerWaalsContact O-CB 3.27Å; S1556-A1560 WeakPolarHBondContact O-CB 3.45Å; S1556-A1560 PolarHBondContact O-N 3.39Å
1557	Q	84.1	Confident	82.8	Confident	12 Å²	12	34.5 Å²	34.5	6%	0.056	18%	0.183	C	C	.	.	H	α-helix	trans	-61.5	-45.2	175.4	-69.9	-180	47.8	0	0	112	L1550 G1552 S1553 V1554 A1560 Q1561	L1550-Q1557 HydrophobicContact CB-CB 4.28Å; L1550-Q1557 HydrophobicContact CB-CG 4Å; L1550-Q1557 WeakPolarHBondContact CD1-O 3.33Å; L1550-Q1557 VanDerWaalsContact O-CD 3.23Å; L1550-Q1557 PolarHBondContact O-OE1 3.16Å; G1552-Q1557 PolarHBondContact O-NE2 2.86Å; S1553-Q1557 WeakPolarHBondContact O-CG 3.33Å; S1553-Q1557 PolarHBondContact O-N 3.45Å; V1554-Q1557 PolarHBondContact O-N 3.31Å; Q1557-A1560 PolarHBondContact O-N 3.35Å; Q1557-Q1561 WeakPolarHBondContact O-CB 3.3Å; Q1557-Q1561 PolarHBondContact O-N 2.87Å
1558	I	79.2	Confident	82.8	Confident	54 Å²	54	33.8 Å²	33.8	28%	0.277	18%	0.179	S	C	.	.	H	α-helix	trans	-66	-41.6	176.5	-68.9	170	0	0	0	111.1	V1554 Q1555 A1560 Q1561 W1562	V1554-I1558 HydrophobicContact CG1-CD1 3.86Å; V1554-I1558 HydrophobicContact CG1-CG1 4.47Å; V1554-I1558 WeakPolarHBondContact O-CG1 3.32Å; V1554-I1558 PolarHBondContact O-N 2.88Å; Q1555-I1558 PolarHBondContact O-N 3.01Å; I1558-A1560 VanDerWaalsContact C-N 3.35Å; I1558-A1560 PolarHBondContact O-N 3.5Å; I1558-Q1561 WeakPolarHBondContact O-CB 3.4Å; I1558-Q1561 PolarHBondContact O-N 3.46Å; I1558-W1562 PolarHBondContact O-N 3.48Å
1559	M	79.9	Confident	82.7	Confident	82 Å²	82	38.7 Å²	38.7	40%	0.404	20%	0.2	S	C	.	.	H	α-helix	trans	-64.6	-38.4	177.2	-169.4	177.1	177.2	0	0	112	T1290 Q1555 S1556 W1562 Q1563	T1290-M1559 HydrophobicContact CG2-CG 4.23Å; Q1555-M1559 VanDerWaalsContact O-CB 3.26Å; Q1555-M1559 WeakPolarHBondContact O-CB 3.25Å; Q1555-M1559 PolarHBondContact O-N 3.38Å; S1556-M1559 PolarHBondContact O-N 2.92Å; M1559-W1562 PolarHBondContact O-N 2.87Å; M1559-Q1563 WeakPolarHBondContact O-CB 3.35Å; M1559-Q1563 VanDerWaalsContact O-CG 3.3Å; M1559-Q1563 WeakPolarHBondContact O-CG 3.48Å; M1559-Q1563 PolarHBondContact O-N 2.88Å
1560	A	86.7	Confident	82.5	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68.4	-41.5	173.1	0	0	0	0	0	112.5	T1290 A1292 I1294 L1550 S1556 Q1557 I1558 W1562 Q1563 I1564	T1290-A1560 HydrophobicContact CG2-CB 4.14Å; A1292-A1560 HydrophobicContact CB-CB 3.69Å; I1294-A1560 HydrophobicContact CD1-CB 3.93Å; L1550-A1560 HydrophobicContact CD1-CB 4.26Å; L1550-A1560 HydrophobicContact CD2-CB 4.09Å; S1556-A1560 VanDerWaalsContact O-CB 3.27Å; S1556-A1560 WeakPolarHBondContact O-CB 3.45Å; S1556-A1560 PolarHBondContact O-N 3.39Å; Q1557-A1560 PolarHBondContact O-N 3.35Å; I1558-A1560 VanDerWaalsContact C-N 3.35Å; I1558-A1560 PolarHBondContact O-N 3.5Å; A1560-W1562 VanDerWaalsContact C-N 3.33Å; A1560-W1562 PolarHBondContact O-N 3.04Å; A1560-Q1563 PolarHBondContact O-N 3.36Å; A1560-I1564 VanDerWaalsContact O-CB 3.32Å; A1560-I1564 WeakPolarHBondContact O-CB 3.42Å; A1560-I1564 VanDerWaalsContact O-CG1 3.25Å; A1560-I1564 WeakPolarHBondContact O-CG1 3.42Å; A1560-I1564 PolarHBondContact O-N 3.27Å
1561	Q	87.4	Confident	82.1	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.019	22%	0.224	C	C	.	.	H	α-helix	trans	-57.8	-45.9	172.7	-169.2	-160.1	11.3	0	0	111	L1263 M1265 L1550 Q1557 I1558 I1564 F1565 T1595	L1263-Q1561 HydrophobicContact CD2-CB 4.08Å; L1263-Q1561 HydrophobicContact CD2-CG 4.04Å; M1265-Q1561 HydrophobicContact SD-CG 3.85Å; L1550-Q1561 HydrophobicContact CD1-CB 4.09Å; Q1557-Q1561 WeakPolarHBondContact O-CB 3.3Å; Q1557-Q1561 PolarHBondContact O-N 2.87Å; I1558-Q1561 WeakPolarHBondContact O-CB 3.4Å; I1558-Q1561 PolarHBondContact O-N 3.46Å; Q1561-I1564 PolarHBondContact O-N 2.93Å; Q1561-F1565 VanDerWaalsContact O-CB 3.3Å; Q1561-F1565 WeakPolarHBondContact O-CB 3.37Å; Q1561-F1565 PolarHBondContact O-N 3.46Å; Q1561-T1595 PolarHBondContact NE2-OG1 2.92Å
1562	W	84.2	Confident	81.8	Confident	107 Å²	107	45.6 Å²	45.6	41%	0.405	23%	0.233	S	C	.	.	H	α-helix	trans	-63.7	-50.3	176.7	-177.8	73.2	0	0	0	112.3	I1558 M1559 A1560 I1564 F1565 Q1566 F1747	I1558-W1562 PolarHBondContact O-N 3.48Å; M1559-W1562 PolarHBondContact O-N 2.87Å; A1560-W1562 VanDerWaalsContact C-N 3.33Å; A1560-W1562 PolarHBondContact O-N 3.04Å; W1562-I1564 VanDerWaalsContact C-N 3.29Å; W1562-I1564 PolarHBondContact O-N 3.32Å; W1562-F1565 PolarHBondContact O-N 3.49Å; W1562-F1565 VanDerWaalsContact O-N 3.16Å; W1562-Q1566 HydrophobicContact CD2-CG 4.11Å; W1562-Q1566 HydrophobicContact CG-CG 4.41Å; W1562-Q1566 HydrophobicContact CZ2-CG 4.05Å; W1562-Q1566 VanDerWaalsContact NE1-NE2 3.13Å; W1562-Q1566 WeakPolarHBondContact O-CG 3.39Å; W1562-Q1566 PolarHBondContact O-N 2.82Å; W1562-F1747 HydrophobicContact CB-CD2 4.33Å; W1562-F1747 HydrophobicContact CB-CE2 3.54Å; W1562-F1747 HydrophobicContact CB-CZ 3.74Å; W1562-F1747 AromaticContact CD1-CD1 3.76Å; W1562-F1747 AromaticContact CD1-CD2 3.92Å; W1562-F1747 AromaticContact CD1-CE1 3.44Å; W1562-F1747 VanDerWaalsContact CD1-CE1 3.44Å; W1562-F1747 AromaticContact CD1-CE2 3.61Å; W1562-F1747 AromaticContact CD1-CG 3.99Å; W1562-F1747 AromaticContact CD1-CZ 3.36Å; W1562-F1747 HydrophobicContact CG-CE1 4.33Å; W1562-F1747 AromaticContact CG-CE2 3.98Å; W1562-F1747 HydrophobicContact CG-CE2 3.98Å; W1562-F1747 AromaticContact CG-CZ 3.86Å; W1562-F1747 HydrophobicContact CG-CZ 3.86Å
1563	Q	86.3	Confident	81.4	Confident	52 Å²	52	50.5 Å²	50.5	24%	0.243	24%	0.241	C	C	.	.	H	α-helix	trans	-59.1	-39.9	178.3	-76.8	-73.9	-10.5	0	0	112.1	L1286 T1290 M1559 A1560 R1567	L1286-Q1563 HydrophobicContact CD1-CB 3.52Å; L1286-Q1563 HydrophobicContact CD1-CG 4.3Å; T1290-Q1563 HydrophobicContact CG2-CB 4.37Å; T1290-Q1563 HydrophobicContact CG2-CG 3.99Å; M1559-Q1563 WeakPolarHBondContact O-CB 3.35Å; M1559-Q1563 VanDerWaalsContact O-CG 3.3Å; M1559-Q1563 WeakPolarHBondContact O-CG 3.48Å; M1559-Q1563 PolarHBondContact O-N 2.88Å; A1560-Q1563 PolarHBondContact O-N 3.36Å; Q1563-R1567 WeakPolarHBondContact O-CB 3.29Å; Q1563-R1567 WeakPolarHBondContact O-CG 3.28Å; Q1563-R1567 PolarHBondContact O-N 2.91Å
1564	I	89.2	Confident	80.6	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-64.1	-51.9	173.3	-72.9	166.9	0	0	0	110	M1265 L1275 L1286 I1294 V1548 L1550 A1560 Q1561 W1562 Q1566 R1567 L1568	M1265-I1564 HydrophobicContact CE-CB 4.29Å; M1265-I1564 HydrophobicContact CE-CD1 3.57Å; M1265-I1564 HydrophobicContact CE-CG2 4.01Å; M1265-I1564 HydrophobicContact SD-CG2 4.15Å; L1275-I1564 HydrophobicContact CD1-CG1 4.49Å; L1275-I1564 HydrophobicContact CD1-CG2 3.85Å; L1275-I1564 HydrophobicContact CD2-CG1 4.26Å; L1275-I1564 HydrophobicContact CD2-CG2 4.23Å; L1286-I1564 HydrophobicContact CD2-CD1 3.91Å; L1286-I1564 HydrophobicContact CD2-CG1 3.62Å; I1294-I1564 HydrophobicContact CG2-CD1 4.39Å; V1548-I1564 HydrophobicContact CG1-CD1 4.4Å; L1550-I1564 HydrophobicContact CD2-CD1 4.05Å; A1560-I1564 VanDerWaalsContact O-CB 3.32Å; A1560-I1564 WeakPolarHBondContact O-CB 3.42Å; A1560-I1564 VanDerWaalsContact O-CG1 3.25Å; A1560-I1564 WeakPolarHBondContact O-CG1 3.42Å; A1560-I1564 PolarHBondContact O-N 3.27Å; Q1561-I1564 PolarHBondContact O-N 2.93Å; W1562-I1564 VanDerWaalsContact C-N 3.29Å; W1562-I1564 PolarHBondContact O-N 3.32Å; I1564-Q1566 VanDerWaalsContact C-N 3.33Å; I1564-Q1566 PolarHBondContact O-N 2.86Å; I1564-R1567 PolarHBondContact O-N 3.39Å; I1564-R1567 VanDerWaalsContact O-N 3.12Å; I1564-L1568 HydrophobicContact CG2-CD1 3.94Å; I1564-L1568 HydrophobicContact CG2-CG 4.19Å; I1564-L1568 WeakPolarHBondContact O-CG 3.36Å; I1564-L1568 PolarHBondContact O-N 2.87Å
1565	F	87.4	Confident	80.2	Confident	11 Å²	11	59.4 Å²	59.4	5%	0.048	26%	0.264	C	S	.	.	H	α-helix	trans	-55.8	-44.3	179.5	-172.8	-83.5	0	0	0	112.3	Q1561 W1562 L1568 K1569 F1591 L1593 D1746 F1747	Q1561-F1565 VanDerWaalsContact O-CB 3.3Å; Q1561-F1565 WeakPolarHBondContact O-CB 3.37Å; Q1561-F1565 PolarHBondContact O-N 3.46Å; W1562-F1565 PolarHBondContact O-N 3.49Å; W1562-F1565 VanDerWaalsContact O-N 3.16Å; F1565-L1568 PolarHBondContact O-N 2.89Å; F1565-K1569 HydrophobicContact CE1-CD 4.17Å; F1565-K1569 VanDerWaalsContact O-CB 3.27Å; F1565-K1569 WeakPolarHBondContact O-CB 3.39Å; F1565-K1569 PolarHBondContact O-N 2.95Å; F1565-F1591 HydrophobicContact CD1-CD1 4.47Å; F1565-F1591 HydrophobicContact CD2-CD1 4.3Å; F1565-F1591 HydrophobicContact CD2-CE1 4.02Å; F1565-F1591 HydrophobicContact CE1-CD1 4.01Å; F1565-F1591 AromaticContact CE2-CD1 3.81Å; F1565-F1591 HydrophobicContact CE2-CD1 3.81Å; F1565-F1591 AromaticContact CE2-CE1 3.94Å; F1565-F1591 HydrophobicContact CE2-CE1 3.94Å; F1565-F1591 HydrophobicContact CG-CE1 4.38Å; F1565-F1591 AromaticContact CZ-CD1 3.66Å; F1565-F1591 HydrophobicContact CZ-CD1 3.66Å; F1565-F1591 HydrophobicContact CZ-CE1 4.22Å; F1565-F1591 VanDerWaalsContact CZ-O 3.27Å; F1565-F1591 WeakPolarHBondContact CZ-O 3.35Å; F1565-L1593 HydrophobicContact CB-CD2 4.48Å; F1565-L1593 HydrophobicContact CD2-CB 3.76Å; F1565-L1593 HydrophobicContact CD2-CD2 3.96Å; F1565-L1593 HydrophobicContact CE2-CB 3.89Å; F1565-D1746 HydrophobicContact CZ-CB 4.4Å; F1565-F1747 HydrophobicContact CD1-CB 3.74Å; F1565-F1747 HydrophobicContact CD2-CB 4.23Å; F1565-F1747 HydrophobicContact CE1-CB 3.65Å; F1565-F1747 HydrophobicContact CE2-CB 4.16Å; F1565-F1747 HydrophobicContact CG-CB 4.03Å; F1565-F1747 HydrophobicContact CZ-CB 3.87Å; F1565-F1747 VanDerWaalsContact CZ-N 3.29Å
1566	Q	84.5	Confident	79.2	Confident	53 Å²	53	63.3 Å²	63.3	25%	0.248	28%	0.284	C	S	.	.	H	α-helix	trans	-67.5	-40.7	176.6	-62	-57.4	-16.6	0	0	112.4	W1562 I1564 L1568 N1570	W1562-Q1566 HydrophobicContact CD2-CG 4.11Å; W1562-Q1566 HydrophobicContact CG-CG 4.41Å; W1562-Q1566 HydrophobicContact CZ2-CG 4.05Å; W1562-Q1566 VanDerWaalsContact NE1-NE2 3.13Å; W1562-Q1566 WeakPolarHBondContact O-CG 3.39Å; W1562-Q1566 PolarHBondContact O-N 2.82Å; I1564-Q1566 VanDerWaalsContact C-N 3.33Å; I1564-Q1566 PolarHBondContact O-N 2.86Å; Q1566-L1568 VanDerWaalsContact C-N 3.33Å; Q1566-L1568 PolarHBondContact O-N 2.78Å; Q1566-N1570 VanDerWaalsContact O-CB 3.32Å; Q1566-N1570 WeakPolarHBondContact O-CB 3.33Å; Q1566-N1570 PolarHBondContact O-N 2.81Å; Q1566-N1570 PolarHBondContact O-ND2 2.88Å
1567	R	84.3	Confident	77.7	Confident	71 Å²	71	68 Å²	68	27%	0.268	31%	0.313	S	S	.	.	H	α-helix	trans	-60.5	-42	174.1	-75.8	173.1	177.8	-149.3	-3.6	111.3	L1275 R1282 Q1563 I1564 L1571	L1275-R1567 HydrophobicContact CD2-CB 4.2Å; R1282-R1567 PolarHBondContact O-NH1 2.98Å; Q1563-R1567 WeakPolarHBondContact O-CB 3.29Å; Q1563-R1567 WeakPolarHBondContact O-CG 3.28Å; Q1563-R1567 PolarHBondContact O-N 2.91Å; I1564-R1567 PolarHBondContact O-N 3.39Å; I1564-R1567 VanDerWaalsContact O-N 3.12Å; R1567-L1571 WeakPolarHBondContact O-CB 3.14Å; R1567-L1571 PolarHBondContact O-N 3.17Å
1568	L	86.9	Confident	75.7	Confident	1 Å²	1	72.1 Å²	72.1	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-73.1	-40.7	178.7	-61.8	-171.7	0	0	0	113	V1267 E1271 L1275 I1564 F1565 Q1566 N1570 L1571 H1572 F1591 L1593	V1267-L1568 HydrophobicContact CG1-CD1 4.12Å; V1267-L1568 HydrophobicContact CG2-CD1 4.24Å; E1271-L1568 HydrophobicContact CB-CD1 4.48Å; E1271-L1568 HydrophobicContact CB-CD2 3.67Å; E1271-L1568 HydrophobicContact CG-CD2 3.92Å; L1275-L1568 HydrophobicContact CD1-CD1 4.48Å; L1275-L1568 HydrophobicContact CD1-CD2 4.13Å; L1275-L1568 HydrophobicContact CD2-CD2 3.88Å; L1275-L1568 HydrophobicContact CD2-CG 4.38Å; L1275-L1568 HydrophobicContact CG-CD2 3.89Å; I1564-L1568 HydrophobicContact CG2-CD1 3.94Å; I1564-L1568 HydrophobicContact CG2-CG 4.19Å; I1564-L1568 WeakPolarHBondContact O-CG 3.36Å; I1564-L1568 PolarHBondContact O-N 2.87Å; F1565-L1568 PolarHBondContact O-N 2.89Å; Q1566-L1568 VanDerWaalsContact C-N 3.33Å; Q1566-L1568 PolarHBondContact O-N 2.78Å; L1568-N1570 VanDerWaalsContact C-N 3.34Å; L1568-N1570 PolarHBondContact O-N 3Å; L1568-L1571 WeakPolarHBondContact O-CB 3.41Å; L1568-L1571 PolarHBondContact O-N 2.98Å; L1568-H1572 PolarHBondContact O-N 2.84Å; L1568-H1572 PolarHBondContact O-ND1 2.82Å; L1568-F1591 HydrophobicContact CB-CE1 3.97Å; L1568-F1591 HydrophobicContact CB-CZ 3.66Å; L1568-L1593 HydrophobicContact CD1-CD1 4.08Å; L1568-L1593 HydrophobicContact CD1-CD2 4.37Å
1569	K	84.6	Confident	73.7	Confident	104 Å²	104	72.4 Å²	72.4	45%	0.452	36%	0.355	S	S	.	.	H	α-helix	trans	-59.6	-43.9	173.7	-175.7	175	179.8	176.8	0	111.3	F1565 H1572 K1573 F1591	F1565-K1569 HydrophobicContact CE1-CD 4.17Å; F1565-K1569 VanDerWaalsContact O-CB 3.27Å; F1565-K1569 WeakPolarHBondContact O-CB 3.39Å; F1565-K1569 PolarHBondContact O-N 2.95Å; K1569-H1572 PolarHBondContact O-N 3.07Å; K1569-K1573 PolarHBondContact O-N 2.91Å; K1569-F1591 HydrophobicContact CB-CD1 3.77Å; K1569-F1591 HydrophobicContact CB-CE1 4.28Å; K1569-F1591 HydrophobicContact CB-CG 4.28Å; K1569-F1591 HydrophobicContact CG-CB 4.25Å; K1569-F1591 HydrophobicContact CG-CD1 4.28Å; K1569-F1591 HydrophobicContact CG-CG 4.45Å
1570	N	80.9	Confident	71.4	Confident	87 Å²	87	73.9 Å²	73.9	47%	0.465	37%	0.374	S	S	.	.	H	α-helix	trans	-69	-31.8	176.1	-74.7	-37.8	0	0	0	113	Q1566 L1568 R1574	Q1566-N1570 VanDerWaalsContact O-CB 3.32Å; Q1566-N1570 WeakPolarHBondContact O-CB 3.33Å; Q1566-N1570 PolarHBondContact O-N 2.81Å; Q1566-N1570 PolarHBondContact O-ND2 2.88Å; L1568-N1570 VanDerWaalsContact C-N 3.34Å; L1568-N1570 PolarHBondContact O-N 3Å; N1570-R1574 WeakPolarHBondContact O-CG 3.45Å; N1570-R1574 PolarHBondContact O-N 3.18Å; N1570-R1574 VanDerWaalsContact O-N 3.1Å
1571	L	79.6	Confident	68.7	Low	30 Å²	30	79.7 Å²	79.7	16%	0.157	42%	0.415	C	S	.	.	H	α-helix	trans	-66.5	-46.1	173.7	-179.4	136	0	0	0	111.7	E1271 S1274 R1567 L1568 K1573 R1574 Q1575	E1271-L1571 HydrophobicContact CG-CD2 4.38Å; S1274-L1571 VanDerWaalsContact CB-CD1 3.46Å; S1274-L1571 WeakPolarHBondContact OG-CD1 3.39Å; R1567-L1571 WeakPolarHBondContact O-CB 3.14Å; R1567-L1571 PolarHBondContact O-N 3.17Å; L1568-L1571 WeakPolarHBondContact O-CB 3.41Å; L1568-L1571 PolarHBondContact O-N 2.98Å; L1571-K1573 PolarHBondContact O-N 3.39Å; L1571-R1574 PolarHBondContact O-N 3.28Å; L1571-R1574 VanDerWaalsContact O-N 3.17Å; L1571-Q1575 PolarHBondContact O-N 3.37Å
1572	H	75.3	Confident	66	Low	56 Å²	56	84 Å²	84	26%	0.259	45%	0.445	S	S	.	.	H	α-helix	trans	-62.1	-42.1	174.6	-74.9	80.9	0	0	0	111.7	E1271 L1568 K1569 R1574 Q1575 M1576 F1591	E1271-H1572 IonicContact OE1-CE1 3.17Å; L1568-H1572 PolarHBondContact O-N 2.84Å; L1568-H1572 PolarHBondContact O-ND1 2.82Å; K1569-H1572 PolarHBondContact O-N 3.07Å; H1572-R1574 VanDerWaalsContact C-N 3.25Å; H1572-R1574 PolarHBondContact O-N 2.93Å; H1572-Q1575 PolarHBondContact O-N 3.38Å; H1572-Q1575 VanDerWaalsContact O-N 3.16Å; H1572-M1576 WeakPolarHBondContact O-CG 3.26Å; H1572-M1576 PolarHBondContact O-N 2.88Å; H1572-M1576 VanDerWaalsContact O-N 3.09Å; H1572-F1591 AromaticContact CE1-CE2 3.45Å; H1572-F1591 VanDerWaalsContact CE1-CE2 3.45Å; H1572-F1591 WeakPolarHBondContact CE1-CE2 3.36Å; H1572-F1591 AromaticContact CG-CE2 3.93Å; H1572-F1591 AromaticContact ND1-CD2 3.94Å; H1572-F1591 AromaticContact ND1-CE2 3.39Å; H1572-F1591 WeakPolarHBondContact ND1-CE2 3.21Å; H1572-F1591 AromaticContact NE2-CE2 4Å
1573	K	74.9	Confident	63.4	Low	151 Å²	151	87.1 Å²	87.1	66%	0.657	47%	0.47	S	S	*	.	H	α-helix	trans	-60	-33.7	175.2	-167.6	172.3	-177.4	178.6	0	112.7	K1569 L1571 T1577	K1569-K1573 PolarHBondContact O-N 2.91Å; L1571-K1573 PolarHBondContact O-N 3.39Å; K1573-T1577 PolarHBondContact O-OG1 3.33Å
1574	R	58.5	Low	60.9	Low	189 Å²	189	90.7 Å²	90.7	71%	0.713	49%	0.49	S	S	*	.	H	α-helix	trans	-75.9	-33.4	174.9	-73.1	176.5	-177.6	-161	-0.3	113.6	N1570 L1571 H1572 T1577 T1578	N1570-R1574 WeakPolarHBondContact O-CG 3.45Å; N1570-R1574 PolarHBondContact O-N 3.18Å; N1570-R1574 VanDerWaalsContact O-N 3.1Å; L1571-R1574 PolarHBondContact O-N 3.28Å; L1571-R1574 VanDerWaalsContact O-N 3.17Å; H1572-R1574 VanDerWaalsContact C-N 3.25Å; H1572-R1574 PolarHBondContact O-N 2.93Å; R1574-T1577 WeakPolarHBondContact CA-OG1 3.49Å; R1574-T1577 PolarHBondContact O-N 2.91Å; R1574-T1577 PolarHBondContact O-OG1 3.36Å; R1574-T1578 PolarHBondContact O-OG1 3.09Å
1575	Q	57.7	Low	58	Low	99 Å²	99	99.4 Å²	99.4	46%	0.463	54%	0.537	S	S	.	.	H	α-helix	trans	-65.3	-43.6	175.4	-74.6	173.2	-26.6	0	0	111	L1571 H1572 T1577 T1578	L1571-Q1575 PolarHBondContact O-N 3.37Å; H1572-Q1575 PolarHBondContact O-N 3.38Å; H1572-Q1575 VanDerWaalsContact O-N 3.16Å; Q1575-T1577 PolarHBondContact O-N 2.89Å; Q1575-T1578 PolarHBondContact O-N 3.26Å; Q1575-T1578 PolarHBondContact O-OG1 2.9Å
1576	M	50.1	Low	55.4	Low	158 Å²	158	103.4 Å²	103.4	78%	0.778	57%	0.566	S	S	*	*	H	α-helix	trans	-55.3	-34.6	173.9	-66.9	-66.6	-175.3	0	0	113	H1572 T1578	H1572-M1576 WeakPolarHBondContact O-CG 3.26Å; H1572-M1576 PolarHBondContact O-N 2.88Å; H1572-M1576 VanDerWaalsContact O-N 3.09Å; M1576-T1578 VanDerWaalsContact C-N 3.3Å; M1576-T1578 PolarHBondContact O-N 3Å
1577	T	50.6	Low	53.2	Low	106 Å²	106	104.7 Å²	104.7	65%	0.65	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	11.9	179	53.3	0	0	0	0	114.9	K1573 R1574 Q1575	K1573-T1577 PolarHBondContact O-OG1 3.33Å; R1574-T1577 WeakPolarHBondContact CA-OG1 3.49Å; R1574-T1577 PolarHBondContact O-N 2.91Å; R1574-T1577 PolarHBondContact O-OG1 3.36Å; Q1575-T1577 PolarHBondContact O-N 2.89Å
1578	T	42.2	Very low	51.4	Low	98 Å²	98	110.5 Å²	110.5	60%	0.601	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.9	4.5	-177.3	53.7	0	0	0	0	115.1	R1574 Q1575 M1576	R1574-T1578 PolarHBondContact O-OG1 3.09Å; Q1575-T1578 PolarHBondContact O-N 3.26Å; Q1575-T1578 PolarHBondContact O-OG1 2.9Å; M1576-T1578 VanDerWaalsContact C-N 3.3Å; M1576-T1578 PolarHBondContact O-N 3Å
1579	G	37.1	Very low	49.9	Very low	60 Å²	60	117.3 Å²	117.3	62%	0.619	64%	0.641	S	S	*	*	S	Bend	trans	-85	158.7	163.1	0	0	0	0	0	111.8
1580	S	30.6	Very low	49	Very low	113 Å²	113	114.7 Å²	114.7	79%	0.79	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-67.1	160.5	178.5	-60.4	0	0	0	0	112.9	S1582	S1580-S1582 PolarHBondContact O-N 3.31Å
1581	S	30.2	Very low	49	Very low	123 Å²	123	112.2 Å²	112.2	86%	0.86	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-61.2	123.8	-179.9	52.4	0	0	0	0	114.2
1582	S	31.7	Very low	49.2	Very low	93 Å²	93	111.6 Å²	111.6	65%	0.65	62%	0.615	S	S	*	*			trans	-143.8	126.8	156	55.8	0	0	0	0	108.9	S1580 D1584	S1580-S1582 PolarHBondContact O-N 3.31Å; S1582-D1584 PolarHBondContact O-N 3.29Å
1583	N	28.7	Very low	49.8	Very low	174 Å²	174	109.2 Å²	109.2	93%	0.93	60%	0.604	S	S	*	*			trans	-75.8	85.3	-177.8	-80	-10.9	0	0	0	111.3
1584	D	33.3	Very low	50.3	Low	127 Å²	127	102.1 Å²	102.1	68%	0.679	57%	0.573	S	S	*	*			trans	-116.6	106.6	166.4	-88.8	-52.8	0	0	0	110.2	S1582 S1586	S1582-D1584 PolarHBondContact O-N 3.29Å; D1584-S1586 PolarHBondContact O-N 3.22Å
1585	N	29.4	Very low	51.6	Low	183 Å²	183	93.1 Å²	93.1	98%	0.979	54%	0.539	S	S	*	.			trans	-71.6	56.3	166.6	-82.9	-29.9	0	0	0	110.7
1586	S	31.9	Very low	52.9	Low	96 Å²	96	88.4 Å²	88.4	67%	0.671	52%	0.517	S	S	*	.			trans	-80.3	139.7	175.8	60.7	0	0	0	0	110.4	D1584	D1584-S1586 PolarHBondContact O-N 3.22Å
1587	S	38.8	Very low	54.5	Low	80 Å²	80	81.5 Å²	81.5	56%	0.559	48%	0.484	S	S	*	.			trans	-60.1	148.8	-171.6	44.5	0	0	0	0	112.8	K1589	S1587-K1589 VanDerWaalsContact C-N 3.34Å; S1587-K1589 PolarHBondContact O-N 3.1Å
1588	Q	45.7	Very low	55.9	Low	192 Å²	192	77 Å²	77	90%	0.897	46%	0.456	S	S	*	.			trans	-60.1	90.3	-178.7	-66.9	-172.5	14	0	0	111.5	L1590	Q1588-L1590 PolarHBondContact O-N 3.06Å; Q1588-L1590 VanDerWaalsContact O-N 3.17Å
1589	K	55.3	Low	57.6	Low	145 Å²	145	72.5 Å²	72.5	63%	0.63	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-65.1	116.3	-173.3	-165.9	160.4	-175.6	134.6	0	110.4	S1587 F1591 D1668	S1587-K1589 VanDerWaalsContact C-N 3.34Å; S1587-K1589 PolarHBondContact O-N 3.1Å; K1589-F1591 PolarHBondContact O-N 3.43Å; K1589-D1668 WeakPolarHBondContact CE-OD2 3.45Å; K1589-D1668 IonicContact NZ-OD1 3.3Å; K1589-D1668 PolarHBondContact NZ-OD1 2.96Å; K1589-D1668 IonicContact NZ-OD2 2.69Å; K1589-D1668 PolarHBondContact NZ-OD2 3.15Å
1590	L	67.2	Low	59.5	Low	48 Å²	48	71.2 Å²	71.2	25%	0.251	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-59.3	129	-179.9	-101.6	72	0	0	0	110.6	Q1588 C1592 L1660 N1663 L1664 D1746	Q1588-L1590 PolarHBondContact O-N 3.06Å; Q1588-L1590 VanDerWaalsContact O-N 3.17Å; L1590-C1592 PolarHBondContact O-N 2.94Å; L1590-L1660 HydrophobicContact CD2-CD2 4.44Å; L1590-N1663 HydrophobicContact CD1-CB 3.96Å; L1590-N1663 WeakPolarHBondContact CD1-O 3.28Å; L1590-N1663 HydrophobicContact CD2-CB 3.77Å; L1590-L1664 HydrophobicContact CB-CD1 4.07Å; L1590-L1664 HydrophobicContact CD1-CD1 4.36Å; L1590-L1664 HydrophobicContact CD2-CD1 3.9Å; L1590-L1664 HydrophobicContact CG-CD1 4.32Å; L1590-D1746 HydrophobicContact CD2-CB 4.34Å
1591	F	81.2	Confident	61.4	Low	35 Å²	35	72.2 Å²	72.2	15%	0.154	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-75.2	116.1	171.7	179.2	-106.1	0	0	0	109.6	F1565 L1568 K1569 H1572 K1589 L1593	F1565-F1591 HydrophobicContact CD1-CD1 4.47Å; F1565-F1591 HydrophobicContact CD2-CD1 4.3Å; F1565-F1591 HydrophobicContact CD2-CE1 4.02Å; F1565-F1591 HydrophobicContact CE1-CD1 4.01Å; F1565-F1591 AromaticContact CE2-CD1 3.81Å; F1565-F1591 HydrophobicContact CE2-CD1 3.81Å; F1565-F1591 AromaticContact CE2-CE1 3.94Å; F1565-F1591 HydrophobicContact CE2-CE1 3.94Å; F1565-F1591 HydrophobicContact CG-CE1 4.38Å; F1565-F1591 AromaticContact CZ-CD1 3.66Å; F1565-F1591 HydrophobicContact CZ-CD1 3.66Å; F1565-F1591 HydrophobicContact CZ-CE1 4.22Å; F1565-F1591 VanDerWaalsContact CZ-O 3.27Å; F1565-F1591 WeakPolarHBondContact CZ-O 3.35Å; L1568-F1591 HydrophobicContact CB-CE1 3.97Å; L1568-F1591 HydrophobicContact CB-CZ 3.66Å; K1569-F1591 HydrophobicContact CB-CD1 3.77Å; K1569-F1591 HydrophobicContact CB-CE1 4.28Å; K1569-F1591 HydrophobicContact CB-CG 4.28Å; K1569-F1591 HydrophobicContact CG-CB 4.25Å; K1569-F1591 HydrophobicContact CG-CD1 4.28Å; K1569-F1591 HydrophobicContact CG-CG 4.45Å; H1572-F1591 AromaticContact CE1-CE2 3.45Å; H1572-F1591 VanDerWaalsContact CE1-CE2 3.45Å; H1572-F1591 WeakPolarHBondContact CE1-CE2 3.36Å; H1572-F1591 AromaticContact CG-CE2 3.93Å; H1572-F1591 AromaticContact ND1-CD2 3.94Å; H1572-F1591 AromaticContact ND1-CE2 3.39Å; H1572-F1591 WeakPolarHBondContact ND1-CE2 3.21Å; H1572-F1591 AromaticContact NE2-CE2 4Å; K1589-F1591 PolarHBondContact O-N 3.43Å; F1591-L1593 HydrophobicContact CE1-CB 4.48Å
1592	C	83.6	Confident	63.5	Low	17 Å²	17	74.6 Å²	74.6	12%	0.115	39%	0.387	C	S	.	.			trans	-112.8	148.1	177.3	-68.1	0	0	0	0	110.5	L1590 Y1744 A1745	L1590-C1592 PolarHBondContact O-N 2.94Å; C1592-Y1744 HydrophobicContact CB-CD1 4.16Å; C1592-Y1744 HydrophobicContact CB-CD2 4.44Å; C1592-Y1744 HydrophobicContact CB-CE1 3.7Å; C1592-Y1744 HydrophobicContact CB-CE2 4Å; C1592-A1745 CarbonylContact C-O 3.57Å; C1592-A1745 VanDerWaalsContact CA-O 3.26Å; C1592-A1745 WeakPolarHBondContact CA-O 3.38Å; C1592-A1745 VanDerWaalsContact SG-C 3.59Å
1593	L	86.2	Confident	65.8	Low	7 Å²	7	70.2 Å²	70.2	4%	0.037	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	137.4	-179.3	-173.7	63.9	0	0	0	110.9	M1265 R1266 F1565 L1568 F1591 T1595 A1745	M1265-L1593 HydrophobicContact CG-CD2 4.43Å; M1265-L1593 HydrophobicContact SD-CD2 3.78Å; R1266-L1593 WeakPolarHBondContact O-CD1 3.38Å; F1565-L1593 HydrophobicContact CB-CD2 4.48Å; F1565-L1593 HydrophobicContact CD2-CB 3.76Å; F1565-L1593 HydrophobicContact CD2-CD2 3.96Å; F1565-L1593 HydrophobicContact CE2-CB 3.89Å; L1568-L1593 HydrophobicContact CD1-CD1 4.08Å; L1568-L1593 HydrophobicContact CD1-CD2 4.37Å; F1591-L1593 HydrophobicContact CE1-CB 4.48Å; L1593-T1595 PolarHBondContact O-N 3.19Å; L1593-A1745 PolarHBondContact N-O 3.25Å
1594	A	86.6	Confident	68.3	Low	1 Å²	1	62.2 Å²	62.2	1%	0.008	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	107.4	178.6	0	0	0	0	0	111.1	M1265 R1266 P1304 E1742 I1743 Y1744	M1265-A1594 CarbonylContact C-O 3.2Å; M1265-A1594 WeakPolarHBondContact CA-O 3.25Å; R1266-A1594 HydrophobicContact CB-CB 4Å; R1266-A1594 HydrophobicContact CG-CB 4Å; R1266-A1594 PolarHBondContact N-O 2.85Å; P1304-A1594 HydrophobicContact CB-CB 3.9Å; P1304-A1594 HydrophobicContact CG-CB 3.72Å; A1594-E1742 HydrophobicContact CB-CG 4.42Å; A1594-I1743 CarbonylContact C-O 3.59Å; A1594-I1743 WeakPolarHBondContact CA-O 3.45Å; A1594-Y1744 HydrophobicContact CB-CD2 4.02Å
1595	T	85.8	Confident	70.3	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.006	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	135.3	175.3	-56.6	0	0	0	0	110.1	L1263 Y1264 Q1561 L1593 E1742 I1743 T1750	L1263-T1595 HydrophobicContact CD1-CG2 3.59Å; L1263-T1595 HydrophobicContact CD2-CG2 4.15Å; L1263-T1595 HydrophobicContact CG-CG2 3.92Å; Y1264-T1595 CarbonylContact O-C 3.4Å; Y1264-T1595 WeakPolarHBondContact O-CA 3.37Å; Q1561-T1595 PolarHBondContact NE2-OG1 2.92Å; L1593-T1595 PolarHBondContact O-N 3.19Å; T1595-E1742 CarbonylContact O-C 3.13Å; T1595-E1742 WeakPolarHBondContact O-CA 3.41Å; T1595-I1743 PolarHBondContact N-O 2.85Å; T1595-I1743 PolarHBondContact O-N 2.72Å; T1595-T1750 HydrophobicContact CG2-CG2 4.44Å
1596	L	84.6	Confident	72.9	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	137.2	-178.7	-73.4	85.1	0	0	0	112.4	Y1264 R1266 L1677 L1729 L1732 L1741 E1742	Y1264-L1596 PolarHBondContact N-O 2.93Å; Y1264-L1596 PolarHBondContact O-N 3.25Å; R1266-L1596 HydrophobicContact CG-CD1 3.73Å; L1596-L1677 HydrophobicContact CD2-CD1 4.11Å; L1596-L1677 HydrophobicContact CD2-CD2 3.92Å; L1596-L1729 HydrophobicContact CD2-CD2 3.76Å; L1596-L1732 HydrophobicContact CD2-CD1 3.76Å; L1596-L1741 CarbonylContact C-O 3.22Å; L1596-L1741 VanDerWaalsContact CA-O 3.27Å; L1596-L1741 WeakPolarHBondContact CA-O 3.38Å; L1596-E1742 HydrophobicContact CD1-CB 4.39Å; L1596-E1742 HydrophobicContact CD1-CG 3.98Å; L1596-E1742 HydrophobicContact CD2-CB 4.44Å; L1596-E1742 HydrophobicContact CG-CB 3.93Å; L1596-E1742 HydrophobicContact CG-CG 4.08Å
1597	I	83.9	Confident	75.3	Confident	13 Å²	13	51.5 Å²	51.5	7%	0.067	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	131.3	-174.9	-53.7	159.6	0	0	0	110	L1263 L1599 P1740 L1741 I1743 L1754 L1757	L1263-I1597 HydrophobicContact CD1-CG1 3.73Å; I1597-L1599 HydrophobicContact CG2-CD2 3.87Å; I1597-L1599 HydrophobicContact CG2-CG 4.19Å; I1597-L1599 PolarHBondContact O-N 3.4Å; I1597-P1740 CarbonylContact O-C 3.59Å; I1597-P1740 WeakPolarHBondContact O-CA 3.33Å; I1597-L1741 PolarHBondContact N-O 2.91Å; I1597-L1741 PolarHBondContact O-N 2.98Å; I1597-I1743 HydrophobicContact CD1-CD1 3.54Å; I1597-L1754 HydrophobicContact CD1-CD2 3.47Å; I1597-L1754 VanDerWaalsContact CD1-CD2 3.47Å; I1597-L1754 HydrophobicContact CD1-CG 4.32Å; I1597-L1754 HydrophobicContact CG1-CD2 4.15Å; I1597-L1757 HydrophobicContact CD1-CD1 4.26Å
1598	C	79.4	Confident	77.1	Confident	11 Å²	11	49.2 Å²	49.2	7%	0.074	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	86.3	179.9	-64.6	0	0	0	0	113.2	R1738	C1598-R1738 HydrophobicContact CB-CB 4.25Å; C1598-R1738 PolarHBondContact O-NH1 3.42Å
1599	L	78.7	Confident	78.5	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.021	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	150.2	-178.6	-64.3	-179.9	0	0	0	113.2	W1256 I1597 F1603 L1604 L1607 R1738 I1739 L1741	W1256-L1599 HydrophobicContact CH2-CD2 4.14Å; I1597-L1599 HydrophobicContact CG2-CD2 3.87Å; I1597-L1599 HydrophobicContact CG2-CG 4.19Å; I1597-L1599 PolarHBondContact O-N 3.4Å; L1599-F1603 HydrophobicContact CD1-CD1 4.36Å; L1599-F1603 HydrophobicContact CD1-CE1 4.28Å; L1599-F1603 HydrophobicContact CD2-CD1 4.28Å; L1599-F1603 HydrophobicContact CD2-CE1 4.22Å; L1599-L1604 HydrophobicContact CD1-CD1 4.39Å; L1599-L1607 HydrophobicContact CD1-CD1 4.23Å; L1599-R1738 CarbonylContact O-C 3.56Å; L1599-R1738 VanDerWaalsContact O-CA 3.26Å; L1599-R1738 WeakPolarHBondContact O-CA 3.24Å; L1599-I1739 PolarHBondContact N-O 2.94Å; L1599-I1739 PolarHBondContact O-N 2.77Å; L1599-L1741 HydrophobicContact CD1-CB 4.35Å; L1599-L1741 HydrophobicContact CD1-CD2 3.81Å
1600	P	77	Confident	79	Confident	33 Å²	33	40.1 Å²	40.1	21%	0.214	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	139.3	173.1	-19.4	32.4	0	0	0	112.7	R1602 F1603 L1604 N1737	P1600-R1602 PolarHBondContact O-N 3.36Å; P1600-F1603 HydrophobicContact CB-CB 4.39Å; P1600-F1603 PolarHBondContact O-N 3.06Å; P1600-F1603 VanDerWaalsContact O-N 3.09Å; P1600-L1604 PolarHBondContact O-N 3.5Å; P1600-N1737 WeakPolarHBondContact CA-O 3.3Å
1601	Y	70.9	Confident	78.8	Confident	133 Å²	133	39.2 Å²	39.2	52%	0.522	17%	0.174	S	C	.	.	H	α-helix	trans	-50.4	-50.7	-177.3	-175.6	-79.4	0	0	0	113.3	F1603 L1604 W1605 N1737 I1739	Y1601-F1603 VanDerWaalsContact C-N 3.3Å; Y1601-F1603 PolarHBondContact O-N 2.79Å; Y1601-L1604 PolarHBondContact O-N 3.21Å; Y1601-W1605 WeakPolarHBondContact O-CB 3.26Å; Y1601-W1605 PolarHBondContact O-N 3.37Å; Y1601-N1737 PolarHBondContact N-O 3.24Å; Y1601-I1739 HydrophobicContact CD2-CD1 3.51Å; Y1601-I1739 HydrophobicContact CD2-CG1 4.29Å; Y1601-I1739 HydrophobicContact CE2-CD1 3.92Å; Y1601-I1739 HydrophobicContact CG-CD1 4.39Å
1602	R	73.2	Confident	77.4	Confident	174 Å²	174	43 Å²	43	66%	0.657	20%	0.202	S	C	*	.	H	α-helix	trans	-64.1	-33.4	-177.5	-67.6	-173.9	175.1	-171.2	-1.3	113.1	P1600 W1606 W1764	P1600-R1602 PolarHBondContact O-N 3.36Å; R1602-W1606 PolarHBondContact O-N 3.47Å; R1602-W1606 VanDerWaalsContact O-N 3.1Å; R1602-W1764 HydrophobicContact CB-CH2 3.8Å; R1602-W1764 HydrophobicContact CB-CZ2 3.63Å
1603	F	80.7	Confident	75.8	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-74.5	-43.8	177.1	174.3	-117.1	0	0	0	111.2	L1599 P1600 Y1601 W1605 W1606 L1607 M1760 L1761 W1764	L1599-F1603 HydrophobicContact CD1-CD1 4.36Å; L1599-F1603 HydrophobicContact CD1-CE1 4.28Å; L1599-F1603 HydrophobicContact CD2-CD1 4.28Å; L1599-F1603 HydrophobicContact CD2-CE1 4.22Å; P1600-F1603 HydrophobicContact CB-CB 4.39Å; P1600-F1603 PolarHBondContact O-N 3.06Å; P1600-F1603 VanDerWaalsContact O-N 3.09Å; Y1601-F1603 VanDerWaalsContact C-N 3.3Å; Y1601-F1603 PolarHBondContact O-N 2.79Å; F1603-W1605 VanDerWaalsContact C-N 3.3Å; F1603-W1605 PolarHBondContact O-N 3.15Å; F1603-W1606 AromaticContact CD2-CE3 3.92Å; F1603-W1606 HydrophobicContact CD2-CE3 3.92Å; F1603-W1606 HydrophobicContact CD2-CZ3 4.42Å; F1603-W1606 AromaticContact CE2-CE3 3.72Å; F1603-W1606 HydrophobicContact CE2-CE3 3.72Å; F1603-W1606 AromaticContact CE2-CZ3 3.78Å; F1603-W1606 HydrophobicContact CE2-CZ3 3.78Å; F1603-W1606 PolarHBondContact O-N 2.84Å; F1603-L1607 HydrophobicContact CD1-CD1 4.01Å; F1603-L1607 HydrophobicContact CD1-CG 4.48Å; F1603-L1607 HydrophobicContact CD2-CG 4.41Å; F1603-L1607 HydrophobicContact CE1-CD1 3.47Å; F1603-L1607 VanDerWaalsContact CE1-CD1 3.47Å; F1603-L1607 HydrophobicContact CE1-CG 4.06Å; F1603-L1607 HydrophobicContact CE2-CD1 4.3Å; F1603-L1607 HydrophobicContact CE2-CD2 4.07Å; F1603-L1607 HydrophobicContact CE2-CG 3.96Å; F1603-L1607 HydrophobicContact CZ-CD1 3.63Å; F1603-L1607 HydrophobicContact CZ-CD2 3.85Å; F1603-L1607 HydrophobicContact CZ-CG 3.77Å; F1603-L1607 WeakPolarHBondContact O-CG 3.26Å; F1603-L1607 PolarHBondContact O-N 2.9Å; F1603-M1760 HydrophobicContact CE2-CB 4.24Å; F1603-M1760 HydrophobicContact CZ-CB 4.02Å; F1603-L1761 HydrophobicContact CB-CD1 3.93Å; F1603-L1761 HydrophobicContact CD1-CB 4.26Å; F1603-L1761 HydrophobicContact CD1-CD1 3.76Å; F1603-L1761 HydrophobicContact CD1-CG 4.43Å; F1603-L1761 HydrophobicContact CD2-CB 4.34Å; F1603-L1761 HydrophobicContact CD2-CD1 3.7Å; F1603-L1761 HydrophobicContact CE1-CB 3.76Å; F1603-L1761 HydrophobicContact CE1-CD1 4.16Å; F1603-L1761 HydrophobicContact CE1-CG 4.4Å; F1603-L1761 VanDerWaalsContact CE2-CA 3.45Å; F1603-L1761 HydrophobicContact CE2-CB 3.87Å; F1603-L1761 HydrophobicContact CE2-CD1 4.12Å; F1603-L1761 HydrophobicContact CG-CD1 3.5Å; F1603-L1761 HydrophobicContact CZ-CB 3.55Å; F1603-L1761 HydrophobicContact CZ-CD1 4.34Å; F1603-W1764 HydrophobicContact CB-CD2 4.17Å; F1603-W1764 HydrophobicContact CB-CE3 4.07Å; F1603-W1764 HydrophobicContact CB-CH2 4.39Å; F1603-W1764 HydrophobicContact CB-CZ2 4.48Å; F1603-W1764 HydrophobicContact CB-CZ3 4.17Å; F1603-W1764 HydrophobicContact CD2-CB 3.83Å; F1603-W1764 AromaticContact CD2-CD2 3.85Å; F1603-W1764 HydrophobicContact CD2-CD2 3.85Å; F1603-W1764 HydrophobicContact CD2-CE3 4.18Å; F1603-W1764 AromaticContact CD2-CG 3.69Å; F1603-W1764 HydrophobicContact CD2-CG 3.69Å; F1603-W1764 HydrophobicContact CE2-CB 3.99Å; F1603-W1764 HydrophobicContact CE2-CG 4.32Å; F1603-W1764 HydrophobicContact CG-CD2 4.47Å; F1603-W1764 HydrophobicContact CG-CE3 4.48Å
1604	L	80.3	Confident	74.3	Confident	6 Å²	6	47.8 Å²	47.8	3%	0.031	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-39.5	175	-177.3	60.7	0	0	0	111.5	L1599 P1600 Y1601 L1607 T1608 V1676 I1739 L1741	L1599-L1604 HydrophobicContact CD1-CD1 4.39Å; P1600-L1604 PolarHBondContact O-N 3.5Å; Y1601-L1604 PolarHBondContact O-N 3.21Å; L1604-L1607 HydrophobicContact CD1-CD1 4.46Å; L1604-L1607 PolarHBondContact O-N 3.34Å; L1604-T1608 HydrophobicContact CD1-CG2 4.41Å; L1604-T1608 WeakPolarHBondContact O-CG2 3.48Å; L1604-T1608 PolarHBondContact O-N 3.16Å; L1604-T1608 PolarHBondContact O-OG1 3.42Å; L1604-V1676 HydrophobicContact CD1-CG2 4.13Å; L1604-V1676 HydrophobicContact CD2-CG1 3.91Å; L1604-V1676 HydrophobicContact CD2-CG2 4.16Å; L1604-I1739 HydrophobicContact CD2-CB 3.74Å; L1604-I1739 HydrophobicContact CD2-CD1 3.95Å; L1604-I1739 HydrophobicContact CD2-CG1 4.44Å; L1604-I1739 HydrophobicContact CD2-CG2 3.52Å; L1604-L1741 HydrophobicContact CD1-CD1 4.44Å
1605	W	77	Confident	72.6	Confident	120 Å²	120	54.2 Å²	54.2	46%	0.455	27%	0.274	S	S	.	.	H	α-helix	trans	-57.8	-51.7	172.7	-173.6	61.7	0	0	0	111	L1347 Y1601 F1603 L1607 T1608 T1609	L1347-W1605 PolarHBondContact O-NE1 2.98Å; Y1601-W1605 WeakPolarHBondContact O-CB 3.26Å; Y1601-W1605 PolarHBondContact O-N 3.37Å; F1603-W1605 VanDerWaalsContact C-N 3.3Å; F1603-W1605 PolarHBondContact O-N 3.15Å; W1605-L1607 VanDerWaalsContact C-N 3.31Å; W1605-L1607 PolarHBondContact O-N 3.06Å; W1605-T1608 WeakPolarHBondContact CA-OG1 3.48Å; W1605-T1608 CarbonylContact O-C 3.52Å; W1605-T1608 PolarHBondContact O-N 3.47Å; W1605-T1608 PolarHBondContact O-OG1 3.39Å; W1605-T1609 HydrophobicContact CD2-CG2 4Å; W1605-T1609 HydrophobicContact CG-CG2 4.31Å; W1605-T1609 HydrophobicContact CZ2-CG2 3.98Å; W1605-T1609 WeakPolarHBondContact O-CG2 3.43Å; W1605-T1609 PolarHBondContact O-N 3.03Å; W1605-T1609 PolarHBondContact O-OG1 3.2Å
1606	W	82.1	Confident	70.7	Confident	62 Å²	62	57 Å²	57	24%	0.235	29%	0.287	C	S	.	.	H	α-helix	trans	-57.1	-38.7	176.4	176.9	79.1	0	0	0	113.8	R1602 F1603 T1608 T1609 N1611 P1648 M1760 W1764	R1602-W1606 PolarHBondContact O-N 3.47Å; R1602-W1606 VanDerWaalsContact O-N 3.1Å; F1603-W1606 AromaticContact CD2-CE3 3.92Å; F1603-W1606 HydrophobicContact CD2-CE3 3.92Å; F1603-W1606 HydrophobicContact CD2-CZ3 4.42Å; F1603-W1606 AromaticContact CE2-CE3 3.72Å; F1603-W1606 HydrophobicContact CE2-CE3 3.72Å; F1603-W1606 AromaticContact CE2-CZ3 3.78Å; F1603-W1606 HydrophobicContact CE2-CZ3 3.78Å; F1603-W1606 PolarHBondContact O-N 2.84Å; W1606-T1608 VanDerWaalsContact C-N 3.35Å; W1606-T1609 WeakPolarHBondContact CA-OG1 3.46Å; W1606-T1609 PolarHBondContact O-OG1 3.47Å; W1606-N1611 PolarHBondContact NE1-OD1 3.35Å; W1606-N1611 PolarHBondContact O-ND2 2.84Å; W1606-P1648 HydrophobicContact CH2-CG 4.36Å; W1606-M1760 HydrophobicContact CZ3-CB 4.17Å; W1606-W1764 AromaticContact CD2-CD1 3.5Å; W1606-W1764 HydrophobicContact CD2-CG 4.42Å; W1606-W1764 HydrophobicContact CE3-CB 4.46Å; W1606-W1764 AromaticContact CE3-CD1 3.84Å; W1606-W1764 HydrophobicContact CE3-CG 4.36Å; W1606-W1764 AromaticContact CG-CD1 3.53Å; W1606-W1764 AromaticContact CG-NE1 3.69Å
1607	L	82.4	Confident	68.4	Low	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-64.6	-35.9	173	-73.7	176.3	0	0	0	112.8	L1599 F1603 L1604 W1605 P1648 L1649 L1757 M1760	L1599-L1607 HydrophobicContact CD1-CD1 4.23Å; F1603-L1607 HydrophobicContact CD1-CD1 4.01Å; F1603-L1607 HydrophobicContact CD1-CG 4.48Å; F1603-L1607 HydrophobicContact CD2-CG 4.41Å; F1603-L1607 HydrophobicContact CE1-CD1 3.47Å; F1603-L1607 VanDerWaalsContact CE1-CD1 3.47Å; F1603-L1607 HydrophobicContact CE1-CG 4.06Å; F1603-L1607 HydrophobicContact CE2-CD1 4.3Å; F1603-L1607 HydrophobicContact CE2-CD2 4.07Å; F1603-L1607 HydrophobicContact CE2-CG 3.96Å; F1603-L1607 HydrophobicContact CZ-CD1 3.63Å; F1603-L1607 HydrophobicContact CZ-CD2 3.85Å; F1603-L1607 HydrophobicContact CZ-CG 3.77Å; F1603-L1607 WeakPolarHBondContact O-CG 3.26Å; F1603-L1607 PolarHBondContact O-N 2.9Å; L1604-L1607 HydrophobicContact CD1-CD1 4.46Å; L1604-L1607 PolarHBondContact O-N 3.34Å; W1605-L1607 VanDerWaalsContact C-N 3.31Å; W1605-L1607 PolarHBondContact O-N 3.06Å; L1607-P1648 HydrophobicContact CD2-CB 3.87Å; L1607-P1648 WeakPolarHBondContact O-CD 3.38Å; L1607-L1649 HydrophobicContact CB-CB 4.33Å; L1607-L1649 VanDerWaalsContact O-CB 3.3Å; L1607-L1649 WeakPolarHBondContact O-CB 3.31Å; L1607-L1649 PolarHBondContact O-N 3.41Å; L1607-L1757 HydrophobicContact CD1-CD2 3.6Å; L1607-L1757 HydrophobicContact CD2-CD2 4.5Å; L1607-M1760 HydrophobicContact CD2-CB 4.33Å; L1607-M1760 HydrophobicContact CD2-SD 3.65Å
1608	T	78.2	Confident	65.9	Low	32 Å²	32	63 Å²	63	20%	0.196	33%	0.326	C	S	.	.	H	α-helix	trans	-81.1	-29.6	179.9	57.2	0	0	0	0	113.7	L1604 W1605 W1606 S1647 L1649	L1604-T1608 HydrophobicContact CD1-CG2 4.41Å; L1604-T1608 WeakPolarHBondContact O-CG2 3.48Å; L1604-T1608 PolarHBondContact O-N 3.16Å; L1604-T1608 PolarHBondContact O-OG1 3.42Å; W1605-T1608 WeakPolarHBondContact CA-OG1 3.48Å; W1605-T1608 CarbonylContact O-C 3.52Å; W1605-T1608 PolarHBondContact O-N 3.47Å; W1605-T1608 PolarHBondContact O-OG1 3.39Å; W1606-T1608 VanDerWaalsContact C-N 3.35Å; T1608-S1647 WeakPolarHBondContact O-CB 3.46Å; T1608-S1647 PolarHBondContact O-OG 3.49Å; T1608-L1649 HydrophobicContact CG2-CD2 3.75Å
1609	T	74.5	Confident	63.6	Low	21 Å²	21	73.2 Å²	73.2	13%	0.129	36%	0.363	C	S	.	.	S	Bend	trans	-71.2	146	179.8	47.8	0	0	0	0	112.6	V1348 W1605 W1606 N1611 S1647	V1348-T1609 HydrophobicContact CG2-CG2 4.31Å; W1605-T1609 HydrophobicContact CD2-CG2 4Å; W1605-T1609 HydrophobicContact CG-CG2 4.31Å; W1605-T1609 HydrophobicContact CZ2-CG2 3.98Å; W1605-T1609 WeakPolarHBondContact O-CG2 3.43Å; W1605-T1609 PolarHBondContact O-N 3.03Å; W1605-T1609 PolarHBondContact O-OG1 3.2Å; W1606-T1609 WeakPolarHBondContact CA-OG1 3.46Å; W1606-T1609 PolarHBondContact O-OG1 3.47Å; T1609-N1611 PolarHBondContact O-N 2.7Å; T1609-N1611 PolarHBondContact O-ND2 3.02Å; T1609-N1611 VanDerWaalsContact O-ND2 3.15Å; T1609-S1647 VanDerWaalsContact O-CB 3.24Å; T1609-S1647 WeakPolarHBondContact O-CB 3.39Å
1610	H	65.7	Low	61.1	Low	124 Å²	124	78.3 Å²	78.3	57%	0.574	40%	0.399	S	S	*	.			trans	-72.5	108.8	170.3	-66.9	-96.7	0	0	0	109.3	G1645	H1610-G1645 PolarHBondContact ND1-O 2.82Å
1611	N	64.1	Low	58.7	Low	29 Å²	29	81 Å²	81	16%	0.155	42%	0.418	C	S	.	.			trans	-95.7	114	177.8	-73.6	-82.8	0	0	0	108.7	W1606 T1609 G1613 F1614	W1606-N1611 PolarHBondContact NE1-OD1 3.35Å; W1606-N1611 PolarHBondContact O-ND2 2.84Å; T1609-N1611 PolarHBondContact O-N 2.7Å; T1609-N1611 PolarHBondContact O-ND2 3.02Å; T1609-N1611 VanDerWaalsContact O-ND2 3.15Å; N1611-G1613 PolarHBondContact O-N 3.47Å; N1611-F1614 HydrophobicContact CB-CB 3.98Å; N1611-F1614 WeakPolarHBondContact O-CB 3.46Å; N1611-F1614 PolarHBondContact O-N 2.9Å
1612	P	50.2	Low	56.5	Low	116 Å²	116	79.5 Å²	79.5	75%	0.753	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-19.9	-175.9	25.6	-34.1	0	0	0	113.8	F1614	P1612-F1614 VanDerWaalsContact C-N 3.34Å
1613	G	51.5	Low	54.3	Low	72 Å²	72	74.5 Å²	74.5	74%	0.742	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-8.3	170	0	0	0	0	0	114.7	N1611 I1615	N1611-G1613 PolarHBondContact O-N 3.47Å; G1613-I1615 VanDerWaalsContact C-N 3.27Å; G1613-I1615 PolarHBondContact O-N 2.95Å
1614	F	53.7	Low	51.9	Low	52 Å²	52	81.1 Å²	81.1	23%	0.228	45%	0.45	C	S	.	.			trans	-85.1	71.9	174.8	-166.3	-96	0	0	0	109.6	N1611 P1612 E1616 P1648 W1651 M1760	N1611-F1614 HydrophobicContact CB-CB 3.98Å; N1611-F1614 WeakPolarHBondContact O-CB 3.46Å; N1611-F1614 PolarHBondContact O-N 2.9Å; P1612-F1614 VanDerWaalsContact C-N 3.34Å; F1614-E1616 PolarHBondContact O-N 3.32Å; F1614-P1648 HydrophobicContact CD1-CG 4.44Å; F1614-P1648 HydrophobicContact CD2-CG 4.07Å; F1614-P1648 HydrophobicContact CE2-CB 4.36Å; F1614-P1648 HydrophobicContact CE2-CG 4.29Å; F1614-P1648 HydrophobicContact CG-CG 4.16Å; F1614-P1648 HydrophobicContact CZ-CB 4.38Å; F1614-W1651 HydrophobicContact CE1-CB 3.73Å; F1614-W1651 HydrophobicContact CE1-CD2 4.36Å; F1614-W1651 AromaticContact CE1-CG 3.86Å; F1614-W1651 HydrophobicContact CE1-CG 3.86Å; F1614-W1651 HydrophobicContact CZ-CB 4.15Å; F1614-W1651 HydrophobicContact CZ-CD2 4.02Å; F1614-W1651 HydrophobicContact CZ-CE3 4.17Å; F1614-W1651 HydrophobicContact CZ-CG 4.02Å; F1614-M1760 HydrophobicContact CE2-CE 4.1Å; F1614-M1760 HydrophobicContact CZ-CE 4.1Å
1615	I	50.3	Low	49.3	Very low	136 Å²	136	87.2 Å²	87.2	70%	0.697	49%	0.488	S	S	*	.			trans	-78.7	114.3	176.3	-60	176.6	0	0	0	108.4	G1613 T1617	G1613-I1615 VanDerWaalsContact C-N 3.27Å; G1613-I1615 PolarHBondContact O-N 2.95Å; I1615-T1617 PolarHBondContact O-N 2.67Å
1616	E	45.7	Very low	46.9	Very low	58 Å²	58	85.8 Å²	85.8	27%	0.271	50%	0.496	S	S	.	.			trans	-65.3	114.4	169.6	-168.5	-168.8	-130.9	0	0	109.1	F1614 S1618	F1614-E1616 PolarHBondContact O-N 3.32Å; E1616-S1618 PolarHBondContact O-N 3.25Å; E1616-S1618 PolarHBondContact O-OG 2.93Å; E1616-S1618 WeakPolarHBondContact OE2-CB 3.15Å; E1616-S1618 PolarHBondContact OE2-OG 2.79Å
1617	T	37.4	Very low	44.2	Very low	109 Å²	109	89.1 Å²	89.1	67%	0.669	52%	0.524	S	S	*	.			trans	-72.5	33.4	176.1	43.5	0	0	0	0	113.1	I1615 R1619 S1620	I1615-T1617 PolarHBondContact O-N 2.67Å; T1617-R1619 PolarHBondContact O-N 2.99Å; T1617-S1620 PolarHBondContact O-N 2.88Å
1618	S	32.3	Very low	41.4	Very low	31 Å²	31	95.1 Å²	95.1	22%	0.217	56%	0.56	C	S	.	*	T	Hydrogen-bonded Turn	trans	-71.9	40.6	174.4	57.5	0	0	0	0	113.7	E1616 K1643	E1616-S1618 PolarHBondContact O-N 3.25Å; E1616-S1618 PolarHBondContact O-OG 2.93Å; E1616-S1618 WeakPolarHBondContact OE2-CB 3.15Å; E1616-S1618 PolarHBondContact OE2-OG 2.79Å; S1618-K1643 PolarHBondContact O-NZ 3.47Å; S1618-K1643 VanDerWaalsContact O-NZ 3.13Å; S1618-K1643 PolarHBondContact OG-NZ 2.86Å
1619	R	29.1	Very low	39	Very low	226 Å²	226	103 Å²	103	85%	0.853	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.6	6.3	158.7	-98.9	-172.9	176.2	175.4	-1.6	112.5	T1617	T1617-R1619 PolarHBondContact O-N 2.99Å
1620	S	26.5	Very low	36.5	Very low	111 Å²	111	107.1 Å²	107.1	78%	0.776	62%	0.622	S	S	*	*	S	Bend	trans	-114.1	11.4	172.2	-52.4	0	0	0	0	112.3	T1617	T1617-S1620 PolarHBondContact O-N 2.88Å
1621	S	26.7	Very low	34.5	Very low	88 Å²	88	110.4 Å²	110.4	62%	0.615	63%	0.634	S	S	*	*			trans	-126.3	62.8	-173.2	66.6	0	0	0	0	111.2
1622	S	24.8	Very low	32.9	Very low	102 Å²	102	118.8 Å²	118.8	71%	0.713	67%	0.67	S	S	*	*			trans	-139.1	45	179.2	63.9	0	0	0	0	112.1
1623	V	27.9	Very low	31.5	Very low	70 Å²	70	123 Å²	123	42%	0.424	68%	0.677	S	S	.	*	S	Bend	trans	-134.9	127.1	169.3	174.9	0	0	0	0	107.4	M994	M994-V1623 HydrophobicContact CG-CG1 4.34Å; M994-V1623 HydrophobicContact SD-CG1 4.11Å
1624	L	30	Very low	30.5	Very low	138 Å²	138	127 Å²	127	72%	0.723	68%	0.681	S	S	*	*			trans	60.9	76.8	171.5	-63	170.5	0	0	0	118.2
1625	T	25.5	Very low	29.1	Very low	134 Å²	134	130.1 Å²	130.1	82%	0.822	71%	0.709	S	S	*	*	S	Bend		-124.6	125.7	124.3	51.9	0	0	0	0	109.1
1626	S	26.1	Very low	28.1	Very low	90 Å²	90	127.3 Å²	127.3	63%	0.629	71%	0.714	S	S	*	*			trans	61.3	136.8	174.9	75.3	0	0	0	0	119.6
1627	T	25.2	Very low	27.1	Very low	132 Å²	132	131.2 Å²	131.2	81%	0.81	74%	0.737	S	S	*	*	S	Bend	trans	-142.1	59.5	150.9	52.7	0	0	0	0	110.7
1628	V	24.8	Very low	26.7	Very low	126 Å²	126	131.6 Å²	131.6	76%	0.764	74%	0.739	S	S	*	*			trans	-151.7	93	138	-176.3	0	0	0	0	107.6
1629	F	28	Very low	26.4	Very low	198 Å²	198	136.2 Å²	136.2	87%	0.868	76%	0.761	S	S	*	*			trans	-152.8	80.5	155.1	-100.4	-69	0	0	0	106.7
1630	S	22.3	Very low	26.5	Very low	108 Å²	108	132.3 Å²	132.3	76%	0.755	76%	0.758	S	S	*	*			trans	-87.4	148.3	172.4	-60.2	0	0	0	0	109.5
1631	K	23.5	Very low	26.4	Very low	192 Å²	192	134.5 Å²	134.5	84%	0.835	76%	0.761	S	S	*	*			trans	60	76.5	-177.2	-61.3	-174.8	177.9	-178.1	0	115
1632	F	28.7	Very low	26.7	Very low	206 Å²	206	136.5 Å²	136.5	90%	0.904	76%	0.764	S	S	*	*				-132.4	97	122.3	-102.9	-78	0	0	0	108.5
1633	F	22.6	Very low	27.3	Very low	204 Å²	204	138.7 Å²	138.7	90%	0.895	76%	0.761	S	S	*	*			trans	-79	123.7	153.7	-84.7	-90.1	0	0	0	106.5
1634	D	29.7	Very low	27.7	Very low	155 Å²	155	139.9 Å²	139.9	83%	0.829	77%	0.772	S	S	*	*			trans	-144.8	140.3	145.7	-148	-19.6	0	0	0	108.8
1635	S	23.6	Very low	28.5	Very low	118 Å²	118	135.3 Å²	135.3	83%	0.825	76%	0.758	S	S	*	*			trans	-97.3	125.8	-163.2	79	0	0	0	0	112.1
1636	G	29.6	Very low	30.2	Very low	77 Å²	77	131.1 Å²	131.1	79%	0.794	73%	0.733	S	S	*	*			trans	-153.9	52	-171.3	0	0	0	0	0	114	T1638	G1636-T1638 PolarHBondContact O-N 3.04Å
1637	N	25.6	Very low	32.6	Very low	140 Å²	140	127 Å²	127	75%	0.749	70%	0.704	S	S	*	*			trans	-76	118.7	178.7	-179.6	10.4	0	0	0	111.8
1638	T	28.7	Very low	35.2	Very low	118 Å²	118	120.7 Å²	120.7	72%	0.724	67%	0.665	S	S	*	*			trans	-160.9	106.9	141.2	3.2	0	0	0	0	113.8	G1636	G1636-T1638 PolarHBondContact O-N 3.04Å
1639	N	26.2	Very low	38	Very low	127 Å²	127	115.7 Å²	115.7	68%	0.679	63%	0.634	S	S	*	*			trans	27.2	96.7	140.3	-64.7	-28.9	0	0	0	118.9
1640	N	30	Very low	40.4	Very low	145 Å²	145	109.6 Å²	109.6	78%	0.775	61%	0.611	S	S	*	*			trans	-133.6	59.5	156.9	-97.7	-64.6	0	0	0	111.9	N1642	N1640-N1642 PolarHBondContact O-N 2.91Å
1641	N	25.7	Very low	43.3	Very low	157 Å²	157	107.5 Å²	107.5	84%	0.84	59%	0.586	S	S	*	*			trans	-73.9	64	171.1	-85	-34.6	0	0	0	111.8
1642	N	33.3	Very low	46.2	Very low	129 Å²	129	98.5 Å²	98.5	69%	0.69	55%	0.547	S	S	*	.			trans	-124.6	76.2	172.5	-87.5	-44.3	0	0	0	110	N1640 S1644	N1640-N1642 PolarHBondContact O-N 2.91Å; N1642-S1644 PolarHBondContact O-N 2.84Å
1643	K	36.6	Very low	48.7	Very low	149 Å²	149	90.1 Å²	90.1	65%	0.648	51%	0.511	S	S	*	.			trans	-75.2	66.4	166	-75.5	-152.4	176.1	-156.4	0	110.5	S1618	S1618-K1643 PolarHBondContact O-NZ 3.47Å; S1618-K1643 VanDerWaalsContact O-NZ 3.13Å; S1618-K1643 PolarHBondContact OG-NZ 2.86Å
1644	S	36.4	Very low	51.4	Low	95 Å²	95	82.4 Å²	82.4	66%	0.664	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-85.3	136.7	165.2	50.8	0	0	0	0	109.7	N1642 T1646	N1642-S1644 PolarHBondContact O-N 2.84Å; S1644-T1646 PolarHBondContact O-N 2.93Å
1645	G	46.8	Very low	53.7	Low	41 Å²	41	77.2 Å²	77.2	42%	0.423	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-58.5	129.1	-164.4	0	0	0	0	0	113.8	H1610	H1610-G1645 PolarHBondContact ND1-O 2.82Å
1646	T	61.3	Low	56.3	Low	47 Å²	47	71.7 Å²	71.7	29%	0.288	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-75.7	143.1	175.4	46.8	0	0	0	0	110.7	S1644	S1644-T1646 PolarHBondContact O-N 2.93Å
1647	S	76	Confident	58.5	Low	3 Å²	3	69.2 Å²	69.2	2%	0.021	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-71.4	148.3	167.9	59.1	0	0	0	0	110.1	T1608 T1609 L1649 N1650 W1651	T1608-S1647 WeakPolarHBondContact O-CB 3.46Å; T1608-S1647 PolarHBondContact O-OG 3.49Å; T1609-S1647 VanDerWaalsContact O-CB 3.24Å; T1609-S1647 WeakPolarHBondContact O-CB 3.39Å; S1647-L1649 PolarHBondContact O-N 3.34Å; S1647-L1649 VanDerWaalsContact O-N 3.14Å; S1647-N1650 WeakPolarHBondContact O-CB 3.49Å; S1647-N1650 PolarHBondContact O-N 2.88Å; S1647-N1650 VanDerWaalsContact OG-CG 3.31Å; S1647-N1650 PolarHBondContact OG-ND2 3.2Å; S1647-W1651 PolarHBondContact O-N 3.4Å
1648	P	80.8	Confident	60.9	Low	0 Å²	0	70.1 Å²	70.1	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-53.6	-36.3	-179	-28.6	34.4	0	0	0	113.8	W1606 L1607 F1614 W1651 I1652 M1760	W1606-P1648 HydrophobicContact CH2-CG 4.36Å; L1607-P1648 HydrophobicContact CD2-CB 3.87Å; L1607-P1648 WeakPolarHBondContact O-CD 3.38Å; F1614-P1648 HydrophobicContact CD1-CG 4.44Å; F1614-P1648 HydrophobicContact CD2-CG 4.07Å; F1614-P1648 HydrophobicContact CE2-CB 4.36Å; F1614-P1648 HydrophobicContact CE2-CG 4.29Å; F1614-P1648 HydrophobicContact CG-CG 4.16Å; F1614-P1648 HydrophobicContact CZ-CB 4.38Å; P1648-W1651 PolarHBondContact O-N 2.55Å; P1648-I1652 WeakPolarHBondContact O-CG1 3.41Å; P1648-I1652 PolarHBondContact O-N 3.13Å; P1648-M1760 HydrophobicContact CB-CE 4.2Å; P1648-M1760 HydrophobicContact CB-SD 3.81Å
1649	L	82.6	Confident	62.8	Low	21 Å²	21	72 Å²	72	11%	0.11	37%	0.373	C	S	.	.	H	α-helix	trans	-65.7	-40	175.6	-171.8	65	0	0	0	112.7	L1607 T1608 S1647 W1651 I1652 Q1653 I1674 V1676	L1607-L1649 HydrophobicContact CB-CB 4.33Å; L1607-L1649 VanDerWaalsContact O-CB 3.3Å; L1607-L1649 WeakPolarHBondContact O-CB 3.31Å; L1607-L1649 PolarHBondContact O-N 3.41Å; T1608-L1649 HydrophobicContact CG2-CD2 3.75Å; S1647-L1649 PolarHBondContact O-N 3.34Å; S1647-L1649 VanDerWaalsContact O-N 3.14Å; L1649-W1651 VanDerWaalsContact C-N 3.3Å; L1649-W1651 PolarHBondContact O-N 3.44Å; L1649-I1652 PolarHBondContact O-N 2.81Å; L1649-Q1653 WeakPolarHBondContact O-CB 3.42Å; L1649-Q1653 PolarHBondContact O-N 2.88Å; L1649-I1674 HydrophobicContact CD1-CG2 4.19Å; L1649-V1676 HydrophobicContact CD2-CG2 4.46Å
1650	N	78.5	Confident	64.9	Low	70 Å²	70	66 Å²	66	37%	0.374	34%	0.341	S	S	.	.	H	α-helix	trans	-67.3	-33.3	175.6	-75	-13.1	0	0	0	111.5	S1647 Q1653 S1654	S1647-N1650 WeakPolarHBondContact O-CB 3.49Å; S1647-N1650 PolarHBondContact O-N 2.88Å; S1647-N1650 VanDerWaalsContact OG-CG 3.31Å; S1647-N1650 PolarHBondContact OG-ND2 3.2Å; N1650-Q1653 PolarHBondContact O-N 3.48Å; N1650-S1654 WeakPolarHBondContact O-CB 3.46Å; N1650-S1654 PolarHBondContact O-N 3.39Å
1651	W	82.9	Confident	66.5	Low	64 Å²	64	64.2 Å²	64.2	24%	0.242	33%	0.331	C	S	.	.	H	α-helix	trans	-67.9	-45.5	172.5	178.3	85	0	0	0	112.2	F1614 S1647 P1648 L1649 Q1653 S1654 L1655 N1756 M1760	F1614-W1651 HydrophobicContact CE1-CB 3.73Å; F1614-W1651 HydrophobicContact CE1-CD2 4.36Å; F1614-W1651 AromaticContact CE1-CG 3.86Å; F1614-W1651 HydrophobicContact CE1-CG 3.86Å; F1614-W1651 HydrophobicContact CZ-CB 4.15Å; F1614-W1651 HydrophobicContact CZ-CD2 4.02Å; F1614-W1651 HydrophobicContact CZ-CE3 4.17Å; F1614-W1651 HydrophobicContact CZ-CG 4.02Å; S1647-W1651 PolarHBondContact O-N 3.4Å; P1648-W1651 PolarHBondContact O-N 2.55Å; L1649-W1651 VanDerWaalsContact C-N 3.3Å; L1649-W1651 PolarHBondContact O-N 3.44Å; W1651-Q1653 VanDerWaalsContact C-N 3.3Å; W1651-Q1653 PolarHBondContact O-N 2.84Å; W1651-S1654 WeakPolarHBondContact O-CB 3.49Å; W1651-S1654 PolarHBondContact O-N 2.83Å; W1651-L1655 HydrophobicContact CH2-CD2 3.94Å; W1651-L1655 HydrophobicContact CZ2-CD2 4.42Å; W1651-L1655 HydrophobicContact CZ3-CD2 4.18Å; W1651-L1655 WeakPolarHBondContact O-CB 3.37Å; W1651-L1655 PolarHBondContact O-N 2.93Å; W1651-N1756 WeakPolarHBondContact CZ3-OD1 3.39Å; W1651-M1760 HydrophobicContact CE3-CE 3.65Å; W1651-M1760 HydrophobicContact CZ3-CE 3.63Å
1652	I	84.4	Confident	67.8	Low	2 Å²	2	60.4 Å²	60.4	1%	0.01	32%	0.322	C	S	.	.	H	α-helix	trans	-59.5	-41.8	172.8	-65.7	175.1	0	0	0	110.5	P1648 L1649 L1655 A1656 I1674 I1753 N1756 L1757 M1760	P1648-I1652 WeakPolarHBondContact O-CG1 3.41Å; P1648-I1652 PolarHBondContact O-N 3.13Å; L1649-I1652 PolarHBondContact O-N 2.81Å; I1652-L1655 PolarHBondContact O-N 3.49Å; I1652-A1656 WeakPolarHBondContact O-CB 3.21Å; I1652-A1656 PolarHBondContact O-N 2.95Å; I1652-I1674 HydrophobicContact CG2-CD1 3.64Å; I1652-I1753 HydrophobicContact CG2-CB 4.43Å; I1652-I1753 HydrophobicContact CG2-CG1 4.06Å; I1652-I1753 HydrophobicContact CG2-CG2 3.95Å; I1652-N1756 HydrophobicContact CD1-CB 4.43Å; I1652-N1756 HydrophobicContact CG1-CB 4.46Å; I1652-L1757 HydrophobicContact CD1-CD2 3.7Å; I1652-L1757 HydrophobicContact CD1-CG 4.12Å; I1652-M1760 HydrophobicContact CD1-CE 4.09Å; I1652-M1760 HydrophobicContact CD1-SD 3.78Å; I1652-M1760 HydrophobicContact CG1-CE 4.07Å; I1652-M1760 HydrophobicContact CG1-SD 4.4Å
1653	Q	81.5	Confident	68.7	Low	31 Å²	31	58.9 Å²	58.9	15%	0.145	31%	0.313	C	S	.	.	H	α-helix	trans	-63.6	-41.8	177.3	-157.8	-162.4	-62.8	0	0	111.5	L1649 N1650 W1651 A1656 S1657	L1649-Q1653 WeakPolarHBondContact O-CB 3.42Å; L1649-Q1653 PolarHBondContact O-N 2.88Å; N1650-Q1653 PolarHBondContact O-N 3.48Å; W1651-Q1653 VanDerWaalsContact C-N 3.3Å; W1651-Q1653 PolarHBondContact O-N 2.84Å; Q1653-A1656 PolarHBondContact O-N 3.4Å; Q1653-S1657 WeakPolarHBondContact O-CB 3.26Å; Q1653-S1657 PolarHBondContact O-N 3.21Å; Q1653-S1657 PolarHBondContact O-OG 2.91Å
1654	S	78.7	Confident	69.4	Low	41 Å²	41	54.3 Å²	54.3	29%	0.287	30%	0.295	S	S	.	.	H	α-helix	trans	-60.9	-45.7	173.9	-178.3	0	0	0	0	111.9	N1650 W1651 A1656 S1657 R1658	N1650-S1654 WeakPolarHBondContact O-CB 3.46Å; N1650-S1654 PolarHBondContact O-N 3.39Å; W1651-S1654 WeakPolarHBondContact O-CB 3.49Å; W1651-S1654 PolarHBondContact O-N 2.83Å; S1654-A1656 PolarHBondContact O-N 2.93Å; S1654-S1657 PolarHBondContact O-N 3.19Å; S1654-R1658 WeakPolarHBondContact O-CG 3.34Å; S1654-R1658 PolarHBondContact O-N 3.24Å
1655	L	78	Confident	69.6	Low	47 Å²	47	53.4 Å²	53.4	25%	0.246	29%	0.289	C	S	.	.	H	α-helix	trans	-60.7	-44.5	176.6	-179.4	64.1	0	0	0	111.9	W1651 I1652 R1658 R1659 L1752	W1651-L1655 HydrophobicContact CH2-CD2 3.94Å; W1651-L1655 HydrophobicContact CZ2-CD2 4.42Å; W1651-L1655 HydrophobicContact CZ3-CD2 4.18Å; W1651-L1655 WeakPolarHBondContact O-CB 3.37Å; W1651-L1655 PolarHBondContact O-N 2.93Å; I1652-L1655 PolarHBondContact O-N 3.49Å; L1655-R1658 PolarHBondContact O-N 3.3Å; L1655-R1659 PolarHBondContact O-N 3.04Å; L1655-L1752 HydrophobicContact CD2-CD2 4.15Å; L1655-L1752 HydrophobicContact CD2-CG 4.31Å; L1655-L1752 HydrophobicContact CG-CD2 4.08Å
1656	A	78.4	Confident	69.2	Low	1 Å²	1	56.7 Å²	56.7	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-64.3	-46.3	176	0	0	0	0	0	112.1	I1652 Q1653 S1654 R1658 R1659 L1660 T1749 I1753	I1652-A1656 WeakPolarHBondContact O-CB 3.21Å; I1652-A1656 PolarHBondContact O-N 2.95Å; Q1653-A1656 PolarHBondContact O-N 3.4Å; S1654-A1656 PolarHBondContact O-N 2.93Å; A1656-R1658 VanDerWaalsContact C-N 3.35Å; A1656-R1658 PolarHBondContact O-N 3.43Å; A1656-R1659 PolarHBondContact O-N 3.04Å; A1656-L1660 PolarHBondContact O-N 2.75Å; A1656-T1749 HydrophobicContact CB-CG2 3.76Å; A1656-I1753 HydrophobicContact CB-CD1 3.87Å; A1656-I1753 HydrophobicContact CB-CG1 4.21Å
1657	S	77	Confident	67.9	Low	26 Å²	26	61.1 Å²	61.1	18%	0.182	33%	0.328	C	S	.	.	H	α-helix	trans	-61.6	-39	176.5	-68.9	0	0	0	0	112.6	Q1653 S1654 R1659 N1661 F1673	Q1653-S1657 WeakPolarHBondContact O-CB 3.26Å; Q1653-S1657 PolarHBondContact O-N 3.21Å; Q1653-S1657 PolarHBondContact O-OG 2.91Å; S1654-S1657 PolarHBondContact O-N 3.19Å; S1657-R1659 VanDerWaalsContact C-N 3.3Å; S1657-R1659 PolarHBondContact O-N 2.79Å; S1657-N1661 WeakPolarHBondContact O-CB 3.46Å; S1657-N1661 PolarHBondContact O-N 2.99Å; S1657-N1661 PolarHBondContact O-OD1 3.14Å; S1657-F1673 WeakPolarHBondContact OG-CD2 3.5Å; S1657-F1673 WeakPolarHBondContact OG-CE2 3.11Å
1658	R	74.1	Confident	66.4	Low	159 Å²	159	64.9 Å²	64.9	60%	0.6	35%	0.347	S	S	*	.	H	α-helix	trans	-64.1	-33.2	175.5	-71.2	178.8	-159.9	-157.7	7.6	112.9	S1654 L1655 A1656	S1654-R1658 WeakPolarHBondContact O-CG 3.34Å; S1654-R1658 PolarHBondContact O-N 3.24Å; L1655-R1658 PolarHBondContact O-N 3.3Å; A1656-R1658 VanDerWaalsContact C-N 3.35Å; A1656-R1658 PolarHBondContact O-N 3.43Å
1659	R	70	Confident	64.6	Low	158 Å²	158	69.3 Å²	69.3	60%	0.596	38%	0.384	S	S	*	.	H	α-helix	trans	-77.2	-44.1	177.5	-76	-71.9	-178.4	164.7	-2.2	112.5	L1655 A1656 S1657 L1752	L1655-R1659 PolarHBondContact O-N 3.04Å; A1656-R1659 PolarHBondContact O-N 3.04Å; S1657-R1659 VanDerWaalsContact C-N 3.3Å; S1657-R1659 PolarHBondContact O-N 2.79Å; R1659-L1752 HydrophobicContact CG-CD2 4.06Å
1660	L	69.8	Low	63.1	Low	1 Å²	1	70.1 Å²	70.1	1%	0.005	39%	0.39	C	S	.	.	H	α-helix	trans	-73.6	-41.5	-179.4	-68.2	167.5	0	0	0	112.2	L1590 A1656 A1662 N1663 L1664 F1673 A1745 D1746 T1749	L1590-L1660 HydrophobicContact CD2-CD2 4.44Å; A1656-L1660 PolarHBondContact O-N 2.75Å; L1660-A1662 PolarHBondContact O-N 3.24Å; L1660-N1663 PolarHBondContact O-N 3.22Å; L1660-L1664 HydrophobicContact CB-CD1 4.46Å; L1660-L1664 WeakPolarHBondContact O-CD1 3.5Å; L1660-L1664 PolarHBondContact O-N 2.97Å; L1660-F1673 HydrophobicContact CB-CE1 4.42Å; L1660-F1673 HydrophobicContact CB-CE2 4.22Å; L1660-F1673 HydrophobicContact CB-CZ 4.01Å; L1660-F1673 HydrophobicContact CD1-CB 4.24Å; L1660-F1673 HydrophobicContact CD1-CD1 3.48Å; L1660-F1673 VanDerWaalsContact CD1-CD1 3.48Å; L1660-F1673 HydrophobicContact CD1-CD2 3.79Å; L1660-F1673 HydrophobicContact CD1-CE1 3.66Å; L1660-F1673 HydrophobicContact CD1-CE2 3.96Å; L1660-F1673 HydrophobicContact CD1-CG 3.55Å; L1660-F1673 HydrophobicContact CD1-CZ 3.9Å; L1660-A1745 HydrophobicContact CD1-CB 3.92Å; L1660-D1746 HydrophobicContact CD2-CB 4.41Å; L1660-T1749 HydrophobicContact CD1-CG2 4.14Å; L1660-T1749 HydrophobicContact CG-CG2 4.12Å
1661	N	63.7	Low	62	Low	106 Å²	106	75 Å²	75	57%	0.567	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-15.9	179.5	-65.2	15.2	0	0	0	113.3	S1657 N1663	S1657-N1661 WeakPolarHBondContact O-CB 3.46Å; S1657-N1661 PolarHBondContact O-N 2.99Å; S1657-N1661 PolarHBondContact O-OD1 3.14Å; N1661-N1663 PolarHBondContact O-N 2.88Å
1662	A	53.5	Low	61	Low	78 Å²	78	76.9 Å²	76.9	65%	0.645	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-17.7	169.5	0	0	0	0	0	112.8	L1660	L1660-A1662 PolarHBondContact O-N 3.24Å
1663	N	51.4	Low	60.5	Low	96 Å²	96	77.4 Å²	77.4	51%	0.513	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.3	-7.6	-173.3	-67	-15.4	0	0	0	113.8	L1590 L1660 N1661	L1590-N1663 HydrophobicContact CD1-CB 3.96Å; L1590-N1663 WeakPolarHBondContact CD1-O 3.28Å; L1590-N1663 HydrophobicContact CD2-CB 3.77Å; L1660-N1663 PolarHBondContact O-N 3.22Å; N1661-N1663 PolarHBondContact O-N 2.88Å
1664	L	51	Low	60.3	Low	53 Å²	53	76.3 Å²	76.3	28%	0.277	42%	0.415	S	S	.	.	S	Bend	trans	-115.4	131.3	179.6	-81	85.9	0	0	0	111.8	L1590 L1660	L1590-L1664 HydrophobicContact CB-CD1 4.07Å; L1590-L1664 HydrophobicContact CD1-CD1 4.36Å; L1590-L1664 HydrophobicContact CD2-CD1 3.9Å; L1590-L1664 HydrophobicContact CG-CD1 4.32Å; L1660-L1664 HydrophobicContact CB-CD1 4.46Å; L1660-L1664 WeakPolarHBondContact O-CD1 3.5Å; L1660-L1664 PolarHBondContact O-N 2.97Å
1665	S	41.9	Very low	60.2	Low	76 Å²	76	77 Å²	77	53%	0.531	41%	0.414	S	S	.	.			trans	-65.1	152.6	166.7	-174.4	0	0	0	0	111.1	N1667	S1665-N1667 PolarHBondContact O-N 3.24Å
1666	S	37.3	Very low	59.9	Low	110 Å²	110	77.4 Å²	77.4	77%	0.769	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	3.4	-153.3	54.4	0	0	0	0	118.7
1667	N	35.2	Very low	59.6	Low	141 Å²	141	77.8 Å²	77.8	75%	0.754	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	-9.4	-157.3	-64.7	-6	0	0	0	116.2	S1665	S1665-N1667 PolarHBondContact O-N 3.24Å
1668	D	43.3	Very low	58.9	Low	81 Å²	81	80.5 Å²	80.5	43%	0.433	44%	0.437	S	S	.	.			trans	-90.3	111.8	173.9	-89.4	-51.4	0	0	0	111.8	K1589 V1670	K1589-D1668 WeakPolarHBondContact CE-OD2 3.45Å; K1589-D1668 IonicContact NZ-OD1 3.3Å; K1589-D1668 PolarHBondContact NZ-OD1 2.96Å; K1589-D1668 IonicContact NZ-OD2 2.69Å; K1589-D1668 PolarHBondContact NZ-OD2 3.15Å; D1668-V1670 VanDerWaalsContact C-N 3.27Å; D1668-V1670 PolarHBondContact O-N 2.74Å
1669	A	43.3	Very low	58.3	Low	94 Å²	94	76.5 Å²	76.5	78%	0.777	43%	0.425	S	S	*	.			trans	-78.6	42.2	-165.9	0	0	0	0	0	116.6	K1671	A1669-K1671 VanDerWaalsContact C-N 3.31Å; A1669-K1671 PolarHBondContact O-N 2.81Å
1670	V	51.8	Low	57.8	Low	38 Å²	38	70 Å²	70	23%	0.23	40%	0.404	C	S	.	.			trans	-76.8	76.4	179	-172.1	0	0	0	0	111.2	A1306 D1668 K1672 F1673	A1306-V1670 HydrophobicContact CB-CG1 4.24Å; D1668-V1670 VanDerWaalsContact C-N 3.27Å; D1668-V1670 PolarHBondContact O-N 2.74Å; V1670-K1672 WeakPolarHBondContact CG1-O 3.26Å; V1670-K1672 PolarHBondContact O-N 3.29Å; V1670-K1672 VanDerWaalsContact O-N 3.07Å; V1670-F1673 HydrophobicContact CB-CD1 4.42Å; V1670-F1673 HydrophobicContact CB-CE1 3.82Å; V1670-F1673 HydrophobicContact CB-CZ 4.35Å; V1670-F1673 HydrophobicContact CG1-CD1 3.63Å; V1670-F1673 HydrophobicContact CG1-CE1 3.54Å; V1670-F1673 HydrophobicContact CG1-CZ 4.35Å
1671	K	53.9	Low	57	Low	172 Å²	172	80.9 Å²	80.9	75%	0.748	44%	0.444	S	S	*	.			trans	-63.2	-12.3	-177.8	-77.3	-175.5	175.3	177.5	0	114.9	A1669	A1669-K1671 VanDerWaalsContact C-N 3.31Å; A1669-K1671 PolarHBondContact O-N 2.81Å
1672	K	62.3	Low	56.4	Low	103 Å²	103	81.9 Å²	81.9	45%	0.448	44%	0.44	S	S	.	.			trans	-147.3	131.6	171.2	-63.3	-159.1	176	-155.4	0	112.2	V1670 H1675	V1670-K1672 WeakPolarHBondContact CG1-O 3.26Å; V1670-K1672 PolarHBondContact O-N 3.29Å; V1670-K1672 VanDerWaalsContact O-N 3.07Å; K1672-H1675 PolarHBondContact O-NE2 2.88Å
1673	F	73.3	Confident	56.6	Low	13 Å²	13	80.6 Å²	80.6	6%	0.057	42%	0.419	C	S	.	.	S	Bend	trans	-96	-13.7	176.4	-58.7	-69.6	0	0	0	114.2	S1657 L1660 V1670 Y1744	S1657-F1673 WeakPolarHBondContact OG-CD2 3.5Å; S1657-F1673 WeakPolarHBondContact OG-CE2 3.11Å; L1660-F1673 HydrophobicContact CB-CE1 4.42Å; L1660-F1673 HydrophobicContact CB-CE2 4.22Å; L1660-F1673 HydrophobicContact CB-CZ 4.01Å; L1660-F1673 HydrophobicContact CD1-CB 4.24Å; L1660-F1673 HydrophobicContact CD1-CD1 3.48Å; L1660-F1673 VanDerWaalsContact CD1-CD1 3.48Å; L1660-F1673 HydrophobicContact CD1-CD2 3.79Å; L1660-F1673 HydrophobicContact CD1-CE1 3.66Å; L1660-F1673 HydrophobicContact CD1-CE2 3.96Å; L1660-F1673 HydrophobicContact CD1-CG 3.55Å; L1660-F1673 HydrophobicContact CD1-CZ 3.9Å; V1670-F1673 HydrophobicContact CB-CD1 4.42Å; V1670-F1673 HydrophobicContact CB-CE1 3.82Å; V1670-F1673 HydrophobicContact CB-CZ 4.35Å; V1670-F1673 HydrophobicContact CG1-CD1 3.63Å; V1670-F1673 HydrophobicContact CG1-CE1 3.54Å; V1670-F1673 HydrophobicContact CG1-CZ 4.35Å; F1673-Y1744 PolarHBondContact O-N 2.9Å
1674	I	78.8	Confident	56.9	Low	9 Å²	9	81 Å²	81	5%	0.046	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	127.7	-178.8	-55.2	176	0	0	0	108.6	L1649 I1652 L1741 E1742 I1753	L1649-I1674 HydrophobicContact CD1-CG2 4.19Å; I1652-I1674 HydrophobicContact CG2-CD1 3.64Å; I1674-L1741 HydrophobicContact CG2-CD1 3.75Å; I1674-L1741 HydrophobicContact CG2-CD2 4.17Å; I1674-L1741 HydrophobicContact CG2-CG 4.06Å; I1674-E1742 CarbonylContact C-O 3.43Å; I1674-E1742 WeakPolarHBondContact CA-O 3.32Å; I1674-I1753 HydrophobicContact CD1-CD1 3.88Å; I1674-I1753 HydrophobicContact CD1-CG1 4.19Å; I1674-I1753 HydrophobicContact CD1-CG2 4.05Å; I1674-I1753 HydrophobicContact CG1-CD1 4.14Å
1675	H	75.5	Confident	56.9	Low	55 Å²	55	87 Å²	87	26%	0.255	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	122.1	-174.6	-65.6	-95.9	0	0	0	110.5	A1306 K1672 E1742	A1306-H1675 WeakPolarHBondContact CA-NE2 3.28Å; A1306-H1675 WeakPolarHBondContact CB-NE2 3.36Å; K1672-H1675 PolarHBondContact O-NE2 2.88Å; H1675-E1742 HydrophobicContact CB-CB 4.46Å; H1675-E1742 PolarHBondContact N-O 3.24Å; H1675-E1742 PolarHBondContact O-N 2.71Å
1676	V	71.9	Confident	57.6	Low	56 Å²	56	87.1 Å²	87.1	34%	0.339	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	129.2	164.6	179.1	0	0	0	0	107.6	L1604 L1649 I1739 L1741	L1604-V1676 HydrophobicContact CD1-CG2 4.13Å; L1604-V1676 HydrophobicContact CD2-CG1 3.91Å; L1604-V1676 HydrophobicContact CD2-CG2 4.16Å; L1649-V1676 HydrophobicContact CD2-CG2 4.46Å; V1676-I1739 HydrophobicContact CG1-CG2 3.79Å; V1676-L1741 HydrophobicContact CB-CD1 4.47Å; V1676-L1741 HydrophobicContact CG2-CD1 3.66Å
1677	L	73.6	Confident	58.6	Low	9 Å²	9	84.8 Å²	84.8	5%	0.047	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-70.7	142.2	-178.4	-87.5	73.2	0	0	0	111.9	Y1305 L1596 L1729 W1733 P1740 E1742	Y1305-L1677 HydrophobicContact CD2-CD1 4.48Å; Y1305-L1677 HydrophobicContact CD2-CG 4.18Å; Y1305-L1677 HydrophobicContact CE2-CD2 4.19Å; Y1305-L1677 HydrophobicContact CE2-CG 3.79Å; L1596-L1677 HydrophobicContact CD2-CD1 4.11Å; L1596-L1677 HydrophobicContact CD2-CD2 3.92Å; L1677-L1729 HydrophobicContact CD2-CD2 3.29Å; L1677-W1733 HydrophobicContact CB-CZ2 3.92Å; L1677-W1733 WeakPolarHBondContact O-CZ2 3.5Å; L1677-P1740 HydrophobicContact CB-CG 4.06Å; L1677-P1740 HydrophobicContact CD1-CB 4.45Å; L1677-P1740 WeakPolarHBondContact CD1-O 3.19Å; L1677-P1740 HydrophobicContact CD2-CB 4.22Å; L1677-P1740 HydrophobicContact CD2-CG 4.03Å; L1677-P1740 HydrophobicContact CG-CG 4.5Å; L1677-P1740 PolarHBondContact N-O 3.33Å; L1677-E1742 HydrophobicContact CD1-CB 3.58Å
1678	P	60.2	Low	59.8	Low	82 Å²	82	81.8 Å²	81.8	53%	0.532	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-62.6	136.9	169.3	-20.1	32.5	0	0	0	111.6	Y1305 W1733	Y1305-P1678 HydrophobicContact CE1-CG 4.45Å; P1678-W1733 WeakPolarHBondContact O-CZ2 3.3Å
1679	E	62.2	Low	60.4	Low	75 Å²	75	83 Å²	83	35%	0.35	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-65.7	131	172.1	-174.6	-179.5	-139.8	0	0	110.2	R1681 R1683 W1733	E1679-R1681 PolarHBondContact O-N 2.86Å; E1679-R1683 HydrophobicContact CG-CB 4.3Å; E1679-R1683 HydrophobicContact CG-CG 4.35Å; E1679-R1683 WeakPolarHBondContact OE1-CD 3.32Å; E1679-R1683 IonicContact OE1-CZ 2.77Å; E1679-R1683 IonicContact OE1-NE 3.5Å; E1679-R1683 PolarHBondContact OE1-NE 3.41Å; E1679-R1683 IonicContact OE1-NH2 2.64Å; E1679-W1733 HydrophobicContact CB-CH2 3.91Å; E1679-W1733 HydrophobicContact CB-CZ2 4.45Å; E1679-W1733 HydrophobicContact CB-CZ3 3.95Å; E1679-W1733 HydrophobicContact CG-CE3 4.15Å; E1679-W1733 HydrophobicContact CG-CH2 4.42Å; E1679-W1733 HydrophobicContact CG-CZ3 3.97Å
1680	P	60	Low	61	Low	23 Å²	23	83.1 Å²	83.1	15%	0.149	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-55.4	126.3	178.2	-28.3	35.1	0	0	0	111.9	R1682 R1683 K1684 D1730 W1733	P1680-R1682 PolarHBondContact O-N 3.27Å; P1680-R1683 HydrophobicContact CB-CB 4.45Å; P1680-R1683 WeakPolarHBondContact O-CB 3.41Å; P1680-R1683 PolarHBondContact O-N 2.88Å; P1680-K1684 PolarHBondContact O-N 2.93Å; P1680-D1730 VanDerWaalsContact CB-OD1 3.3Å; P1680-D1730 WeakPolarHBondContact CB-OD1 3.42Å; P1680-D1730 WeakPolarHBondContact CG-OD1 3.4Å; P1680-W1733 HydrophobicContact CG-CB 4.38Å; P1680-W1733 HydrophobicContact CG-CD2 4.38Å; P1680-W1733 HydrophobicContact CG-CG 3.89Å
1681	R	53	Low	61.1	Low	229 Å²	229	85.9 Å²	85.9	86%	0.864	39%	0.392	S	S	*	.	H	α-helix	trans	-49.6	-29.8	-177.8	-72.1	179	172.6	169.4	-3	113.4	E1679 R1685	E1679-R1681 PolarHBondContact O-N 2.86Å; R1681-R1685 PolarHBondContact O-N 3.22Å
1682	R	51.5	Low	61	Low	126 Å²	126	82.6 Å²	82.6	48%	0.475	38%	0.378	S	S	.	.	H	α-helix	trans	-80	-29.6	179.6	-160.4	160.9	174.2	-165.6	-11.7	113.6	P1680 L1686 G1723 L1724	P1680-R1682 PolarHBondContact O-N 3.27Å; R1682-L1686 WeakPolarHBondContact O-CB 3.49Å; R1682-L1686 PolarHBondContact O-N 3.05Å; R1682-G1723 VanDerWaalsContact CZ-O 3.23Å; R1682-G1723 PolarHBondContact NH1-O 3.24Å; R1682-G1723 PolarHBondContact NH2-O 3.37Å; R1682-L1724 HydrophobicContact CG-CD2 4.36Å
1683	R	57.5	Low	60.3	Low	51 Å²	51	86.1 Å²	86.1	19%	0.192	39%	0.388	C	S	.	.	H	α-helix	trans	-67	-46.5	169.2	179.4	174.3	143	145.2	-0.2	110.4	E1679 P1680 R1685 L1686 V1687 W1733 H1735 P1736	E1679-R1683 HydrophobicContact CG-CB 4.3Å; E1679-R1683 HydrophobicContact CG-CG 4.35Å; E1679-R1683 WeakPolarHBondContact OE1-CD 3.32Å; E1679-R1683 IonicContact OE1-CZ 2.77Å; E1679-R1683 IonicContact OE1-NE 3.5Å; E1679-R1683 PolarHBondContact OE1-NE 3.41Å; E1679-R1683 IonicContact OE1-NH2 2.64Å; P1680-R1683 HydrophobicContact CB-CB 4.45Å; P1680-R1683 WeakPolarHBondContact O-CB 3.41Å; P1680-R1683 PolarHBondContact O-N 2.88Å; R1683-R1685 VanDerWaalsContact C-N 3.34Å; R1683-R1685 PolarHBondContact O-N 3.39Å; R1683-L1686 PolarHBondContact O-N 2.89Å; R1683-V1687 HydrophobicContact CG-CG2 4.38Å; R1683-V1687 WeakPolarHBondContact O-CG2 3.44Å; R1683-V1687 PolarHBondContact O-N 3.22Å; R1683-W1733 PolarHBondContact NH1-O 2.74Å; R1683-H1735 PolarHBondContact NH1-O 2.84Å; R1683-P1736 PolarHBondContact NH2-O 2.86Å
1684	K	56.4	Low	59.3	Low	106 Å²	106	90.2 Å²	90.2	46%	0.461	41%	0.41	S	S	.	.	H	α-helix	trans	-55.9	-45.9	174.2	-171.4	167.3	-177.3	172	0	112	P1680 Q1688	P1680-K1684 PolarHBondContact O-N 2.93Å; K1684-Q1688 WeakPolarHBondContact O-CB 3.27Å; K1684-Q1688 VanDerWaalsContact O-CG 3.29Å; K1684-Q1688 WeakPolarHBondContact O-CG 3.41Å; K1684-Q1688 PolarHBondContact O-N 3.32Å; K1684-Q1688 PolarHBondContact O-OE1 2.89Å
1685	R	53.1	Low	57.8	Low	179 Å²	179	94.6 Å²	94.6	68%	0.675	43%	0.433	S	S	*	.	H	α-helix	trans	-63.1	-39.7	172.9	-79.6	-176.3	171.3	177.8	-2.8	113.6	R1681 R1683 Q1689	R1681-R1685 PolarHBondContact O-N 3.22Å; R1683-R1685 VanDerWaalsContact C-N 3.34Å; R1683-R1685 PolarHBondContact O-N 3.39Å; R1685-Q1689 VanDerWaalsContact O-CB 3.31Å; R1685-Q1689 WeakPolarHBondContact O-CB 3.02Å; R1685-Q1689 VanDerWaalsContact O-CG 3.25Å; R1685-Q1689 WeakPolarHBondContact O-CG 3.47Å; R1685-Q1689 PolarHBondContact O-N 3.34Å
1686	L	56.2	Low	56.2	Low	77 Å²	77	95.3 Å²	95.3	40%	0.403	45%	0.448	S	S	.	.	H	α-helix	trans	-66.1	-44.2	177.5	-99.6	160.4	0	0	0	112.4	R1682 R1683 Q1689 Q1690	R1682-L1686 WeakPolarHBondContact O-CB 3.49Å; R1682-L1686 PolarHBondContact O-N 3.05Å; R1683-L1686 PolarHBondContact O-N 2.89Å; L1686-Q1689 PolarHBondContact O-N 3.18Å; L1686-Q1690 WeakPolarHBondContact O-CG 3.32Å; L1686-Q1690 PolarHBondContact O-N 3.33Å
1687	V	58.3	Low	55.1	Low	62 Å²	62	98.3 Å²	98.3	38%	0.376	47%	0.467	S	S	.	.	H	α-helix	trans	-65.6	-43.9	175.6	175.5	0	0	0	0	110.5	R1683 Q1689 Q1690 L1691	R1683-V1687 HydrophobicContact CG-CG2 4.38Å; R1683-V1687 WeakPolarHBondContact O-CG2 3.44Å; R1683-V1687 PolarHBondContact O-N 3.22Å; V1687-Q1689 VanDerWaalsContact C-N 3.32Å; V1687-Q1689 PolarHBondContact O-N 2.97Å; V1687-Q1690 PolarHBondContact O-N 3.48Å; V1687-L1691 HydrophobicContact CG1-CD1 4.11Å; V1687-L1691 WeakPolarHBondContact O-CD1 3.45Å; V1687-L1691 PolarHBondContact O-N 3.39Å
1688	Q	59.1	Low	53.5	Low	78 Å²	78	104.5 Å²	104.5	36%	0.364	50%	0.5	S	S	.	.	H	α-helix	trans	-62.4	-35.3	173	-75.1	178.3	-55.5	0	0	112.6	K1684 K1692	K1684-Q1688 WeakPolarHBondContact O-CB 3.27Å; K1684-Q1688 VanDerWaalsContact O-CG 3.29Å; K1684-Q1688 WeakPolarHBondContact O-CG 3.41Å; K1684-Q1688 PolarHBondContact O-N 3.32Å; K1684-Q1688 PolarHBondContact O-OE1 2.89Å; Q1688-K1692 WeakPolarHBondContact O-CB 3.27Å; Q1688-K1692 PolarHBondContact O-N 3.09Å
1689	Q	56	Low	52.1	Low	105 Å²	105	112.1 Å²	112.1	49%	0.491	52%	0.518	S	S	.	.	H	α-helix	trans	-71.5	-35.3	174	-79.1	178	-3	0	0	112.5	R1685 L1686 V1687 R1693	R1685-Q1689 VanDerWaalsContact O-CB 3.31Å; R1685-Q1689 WeakPolarHBondContact O-CB 3.02Å; R1685-Q1689 VanDerWaalsContact O-CG 3.25Å; R1685-Q1689 WeakPolarHBondContact O-CG 3.47Å; R1685-Q1689 PolarHBondContact O-N 3.34Å; L1686-Q1689 PolarHBondContact O-N 3.18Å; V1687-Q1689 VanDerWaalsContact C-N 3.32Å; V1687-Q1689 PolarHBondContact O-N 2.97Å; Q1689-R1693 WeakPolarHBondContact O-CB 3.45Å; Q1689-R1693 VanDerWaalsContact O-CG 3.27Å; Q1689-R1693 WeakPolarHBondContact O-CG 3.23Å; Q1689-R1693 PolarHBondContact O-N 3.44Å
1690	Q	55.5	Low	50.7	Low	98 Å²	98	111.5 Å²	111.5	46%	0.458	53%	0.531	S	S	.	.	H	α-helix	trans	-66	-44.6	172.2	-75.9	175.6	-28.3	0	0	110.9	L1686 V1687 R1693 I1694	L1686-Q1690 WeakPolarHBondContact O-CG 3.32Å; L1686-Q1690 PolarHBondContact O-N 3.33Å; V1687-Q1690 PolarHBondContact O-N 3.48Å; Q1690-R1693 PolarHBondContact O-N 2.98Å; Q1690-I1694 WeakPolarHBondContact O-CB 3.21Å; Q1690-I1694 WeakPolarHBondContact O-CD1 3.42Å; Q1690-I1694 VanDerWaalsContact O-CG1 3.26Å; Q1690-I1694 WeakPolarHBondContact O-CG1 3.4Å; Q1690-I1694 PolarHBondContact O-N 3Å
1691	L	55.6	Low	49.5	Very low	95 Å²	95	119.2 Å²	119.2	50%	0.497	57%	0.565	S	S	.	*	H	α-helix	trans	-66.5	-44.2	174.8	-92.6	69.3	0	0	0	112.8	V1687 R1693 I1694 N1695	V1687-L1691 HydrophobicContact CG1-CD1 4.11Å; V1687-L1691 WeakPolarHBondContact O-CD1 3.45Å; V1687-L1691 PolarHBondContact O-N 3.39Å; L1691-R1693 VanDerWaalsContact C-N 3.28Å; L1691-R1693 PolarHBondContact O-N 3.48Å; L1691-I1694 PolarHBondContact O-N 2.87Å; L1691-N1695 WeakPolarHBondContact O-CB 3.45Å; L1691-N1695 PolarHBondContact O-N 3.1Å
1692	K	52.1	Low	48.3	Very low	103 Å²	103	117.5 Å²	117.5	45%	0.448	57%	0.567	S	S	.	*	H	α-helix	trans	-65	-29.4	175.2	-73.8	-164.4	179.5	-175.3	0	111.4	D1354 D1355 Q1688 A1696	D1354-K1692 VanDerWaalsContact OD2-CE 3.29Å; D1354-K1692 WeakPolarHBondContact OD2-CE 3.24Å; D1354-K1692 IonicContact OD2-NZ 2.72Å; D1354-K1692 PolarHBondContact OD2-NZ 3.29Å; D1355-K1692 IonicContact OD1-NZ 3.7Å; D1355-K1692 IonicContact OD2-NZ 3.96Å; D1355-K1692 PolarHBondContact OD2-NZ 3.47Å; Q1688-K1692 WeakPolarHBondContact O-CB 3.27Å; Q1688-K1692 PolarHBondContact O-N 3.09Å; K1692-A1696 WeakPolarHBondContact O-CB 3.26Å; K1692-A1696 PolarHBondContact O-N 3.17Å
1693	R	47.5	Very low	47.5	Very low	177 Å²	177	119.5 Å²	119.5	67%	0.668	58%	0.582	S	S	*	*	H	α-helix	trans	-68.1	-53.5	167.8	-76.1	-178.2	-152.4	-168.4	7	112.5	Q1689 Q1690 L1691 N1695 A1696 T1697	Q1689-R1693 WeakPolarHBondContact O-CB 3.45Å; Q1689-R1693 VanDerWaalsContact O-CG 3.27Å; Q1689-R1693 WeakPolarHBondContact O-CG 3.23Å; Q1689-R1693 PolarHBondContact O-N 3.44Å; Q1690-R1693 PolarHBondContact O-N 2.98Å; L1691-R1693 VanDerWaalsContact C-N 3.28Å; L1691-R1693 PolarHBondContact O-N 3.48Å; R1693-N1695 VanDerWaalsContact C-N 3.29Å; R1693-N1695 PolarHBondContact O-N 3.41Å; R1693-A1696 PolarHBondContact O-N 3.37Å; R1693-A1696 VanDerWaalsContact O-N 3.09Å; R1693-T1697 PolarHBondContact O-N 2.95Å; R1693-T1697 PolarHBondContact O-OG1 3.47Å
1694	I	52	Low	46.2	Very low	99 Å²	99	125.3 Å²	125.3	51%	0.508	61%	0.611	S	S	.	*	H	α-helix	trans	-57.7	-43.1	-178.1	-69.7	163.1	0	0	0	110.8	Q1690 L1691 T1697	Q1690-I1694 WeakPolarHBondContact O-CB 3.21Å; Q1690-I1694 WeakPolarHBondContact O-CD1 3.42Å; Q1690-I1694 VanDerWaalsContact O-CG1 3.26Å; Q1690-I1694 WeakPolarHBondContact O-CG1 3.4Å; Q1690-I1694 PolarHBondContact O-N 3Å; L1691-I1694 PolarHBondContact O-N 2.87Å; I1694-T1697 PolarHBondContact O-N 3.3Å
1695	N	45.8	Very low	45	Very low	102 Å²	102	127.3 Å²	127.3	55%	0.545	63%	0.626	S	S	.	*	H	α-helix	trans	-73.8	-30.6	177.4	-70	-13.4	0	0	0	113.2	L1691 R1693 T1697 L1698 R1699	L1691-N1695 WeakPolarHBondContact O-CB 3.45Å; L1691-N1695 PolarHBondContact O-N 3.1Å; R1693-N1695 VanDerWaalsContact C-N 3.29Å; R1693-N1695 PolarHBondContact O-N 3.41Å; N1695-T1697 VanDerWaalsContact C-N 3.33Å; N1695-L1698 PolarHBondContact O-N 2.91Å; N1695-R1699 PolarHBondContact O-N 3.41Å
1696	A	43.7	Very low	43.7	Very low	69 Å²	69	124.9 Å²	124.9	57%	0.57	63%	0.626	S	S	*	*	H	α-helix	trans	-67.2	-33.5	172.1	0	0	0	0	0	112.1	K1692 R1693 L1698 R1699	K1692-A1696 WeakPolarHBondContact O-CB 3.26Å; K1692-A1696 PolarHBondContact O-N 3.17Å; R1693-A1696 PolarHBondContact O-N 3.37Å; R1693-A1696 VanDerWaalsContact O-N 3.09Å; A1696-L1698 PolarHBondContact O-N 3.18Å; A1696-R1699 PolarHBondContact O-N 3.23Å
1697	T	47.8	Very low	42.4	Very low	120 Å²	120	130.8 Å²	130.8	74%	0.736	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-5.1	173.1	-42.3	0	0	0	0	113.2	R1693 I1694 N1695	R1693-T1697 PolarHBondContact O-N 2.95Å; R1693-T1697 PolarHBondContact O-OG1 3.47Å; I1694-T1697 PolarHBondContact O-N 3.3Å; N1695-T1697 VanDerWaalsContact C-N 3.33Å
1698	L	40.7	Very low	40.9	Very low	139 Å²	139	133.9 Å²	133.9	73%	0.728	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.2	7.8	-179.6	-90.4	156.7	0	0	0	114.3	N1695 A1696	N1695-L1698 PolarHBondContact O-N 2.91Å; A1696-L1698 PolarHBondContact O-N 3.18Å
1699	R	31	Very low	39.3	Very low	242 Å²	242	134.1 Å²	134.1	91%	0.913	69%	0.687	S	S	*	*	S	Bend	trans	-131.5	52.3	169.2	-74.3	-166.3	174.4	-165	-0.1	112	N1695 A1696	N1695-R1699 PolarHBondContact O-N 3.41Å; A1696-R1699 PolarHBondContact O-N 3.23Å
1700	G	32.7	Very low	37.8	Very low	61 Å²	61	132.6 Å²	132.6	63%	0.629	70%	0.7	S	S	*	*	S	Bend	trans	-147.2	115.2	172.8	0	0	0	0	0	111.5
1701	Q	34.2	Very low	36.4	Very low	185 Å²	185	135.8 Å²	135.8	86%	0.864	72%	0.72	S	S	*	*			trans	57.1	96.5	170.4	-63	-174.3	-16.4	0	0	118.2	Q1703	Q1701-Q1703 PolarHBondContact O-N 3.19Å
1702	Q	28	Very low	35	Very low	193 Å²	193	134.2 Å²	134.2	90%	0.902	72%	0.716	S	S	*	*				-64.2	110.5	128.7	-77.9	-179.1	-43.1	0	0	108
1703	Q	34.6	Very low	33.8	Very low	168 Å²	168	135.4 Å²	135.4	79%	0.785	73%	0.727	S	S	*	*			trans	174	122.8	134.1	-94.6	163	23.4	0	0	111.9	Q1701	Q1701-Q1703 PolarHBondContact O-N 3.19Å
1704	Q	29.1	Very low	33	Very low	173 Å²	173	130.1 Å²	130.1	81%	0.808	72%	0.717	S	S	*	*			trans	41	103	148.2	-56.4	-176.2	-4.9	0	0	120
1705	L	31.6	Very low	32	Very low	149 Å²	149	133.8 Å²	133.8	78%	0.78	73%	0.729	S	S	*	*				170.1	114	104	-90.4	164.3	0	0	0	114.8
1706	N	26.8	Very low	31	Very low	127 Å²	127	133.6 Å²	133.6	68%	0.679	74%	0.736	S	S	*	*			trans	35	146.2	133.2	-62.7	-9.5	0	0	0	125.4
1707	Y	28.2	Very low	30.4	Very low	201 Å²	201	137.2 Å²	137.2	79%	0.788	75%	0.745	S	S	*	*			trans	82.5	92.9	150.7	-73.3	-60.7	0	0	0	122.7
1708	T	26.4	Very low	29.5	Very low	128 Å²	128	138.1 Å²	138.1	79%	0.785	74%	0.744	S	S	*	*				53.1	118.2	125.8	54	0	0	0	0	123.4
1709	G	25.7	Very low	29	Very low	82 Å²	82	137 Å²	137	85%	0.845	74%	0.738	S	S	*	*				121.3	122.6	116.5	0	0	0	0	0	120.5
1710	G	25.1	Very low	28.9	Very low	74 Å²	74	130.4 Å²	130.4	76%	0.763	73%	0.726	S	S	*	*			trans	107	112.3	142.5	0	0	0	0	0	120.8
1711	N	25.1	Very low	28.9	Very low	165 Å²	165	133.1 Å²	133.1	88%	0.882	73%	0.733	S	S	*	*			trans	20.6	126.1	147.9	-61.8	-5.1	0	0	0	122.8
1712	C	25.9	Very low	28.6	Very low	61 Å²	61	135.6 Å²	135.6	41%	0.412	73%	0.734	S	S	.	*			trans	-158.3	-170.2	144.5	29.5	0	0	0	0	109.7	A394 P396	A394-C1712 PolarHBondContact N-SG 2.95Å; A394-C1712 WeakPolarHBondContact O-CB 3.42Å; P396-C1712 WeakPolarHBondContact CD-O 3.41Å; P396-C1712 WeakPolarHBondContact CG-O 3.47Å
1713	L	27.6	Very low	28.7	Very low	129 Å²	129	128.9 Å²	128.9	68%	0.675	72%	0.717	S	S	*	*			trans	-117.5	125.7	-153.1	-71.7	149.6	0	0	0	116.5	A394 K1715	A394-L1713 PolarHBondContact O-N 3.13Å; A394-L1713 VanDerWaalsContact O-N 3.16Å; L1713-K1715 PolarHBondContact O-N 2.96Å
1714	S	32	Very low	28.6	Very low	65 Å²	65	125.2 Å²	125.2	46%	0.455	70%	0.702	S	S	.	*			trans	-78.8	79.9	175.7	-92.8	0	0	0	0	111.8	T395 P396	T395-S1714 WeakPolarHBondContact CB-OG 3.11Å; P396-S1714 WeakPolarHBondContact CD-OG 3.27Å; P396-S1714 PolarHBondContact O-OG 2.57Å
1715	K	29.3	Very low	29.2	Very low	176 Å²	176	121 Å²	121	77%	0.765	69%	0.689	S	S	*	*			trans	-60.9	148.8	173	-68.9	172.7	178.5	174.9	0	111.2	L1713 L1717	L1713-K1715 PolarHBondContact O-N 2.96Å; K1715-L1717 PolarHBondContact O-N 3.18Å
1716	S	25.5	Very low	29.8	Very low	98 Å²	98	120.9 Å²	120.9	69%	0.685	69%	0.689	S	S	*	*			trans	-45	138.4	164.4	178.8	0	0	0	0	111.1	I1718	S1716-I1718 PolarHBondContact O-N 3.43Å
1717	L	31.2	Very low	31.2	Very low	145 Å²	145	117.6 Å²	117.6	76%	0.759	67%	0.671	S	S	*	*			trans	-74.7	73	172.1	-123.3	169.8	0	0	0	109	K1715 L1719	K1715-L1717 PolarHBondContact O-N 3.18Å; L1717-L1719 PolarHBondContact O-N 3.41Å
1718	I	27.8	Very low	32.6	Very low	140 Å²	140	108.7 Å²	108.7	72%	0.718	64%	0.641	S	S	*	*			trans	-65.3	90.5	169.3	-59	175	0	0	0	106.8	S1716	S1716-I1718 PolarHBondContact O-N 3.43Å
1719	L	32.2	Very low	34.6	Very low	115 Å²	115	103 Å²	103	60%	0.602	61%	0.606	S	S	*	*			trans	-56.4	129.5	165.3	-78.8	160.7	0	0	0	107.8	L1717	L1717-L1719 PolarHBondContact O-N 3.41Å
1720	P	28.7	Very low	36.4	Very low	103 Å²	103	101 Å²	101	67%	0.669	58%	0.575	S	S	*	*			trans	-62.2	134.6	-176.1	24.7	-33.6	0	0	0	109.9	R1722	P1720-R1722 PolarHBondContact O-N 2.93Å
1721	P	32.5	Very low	38.3	Very low	119 Å²	119	104.9 Å²	104.9	77%	0.773	57%	0.574	S	S	*	*	S	Bend	trans	-79.4	60	-172.3	32.9	-37.2	0	0	0	112.4
1722	R	26.9	Very low	40.3	Very low	236 Å²	236	97.2 Å²	97.2	89%	0.891	53%	0.533	S	S	*	.	S	Bend	trans	-163.1	134.2	168.7	-98.7	126.9	-174.5	174.8	2	111.6	P1720	P1720-R1722 PolarHBondContact O-N 2.93Å
1723	G	30.7	Very low	42.1	Very low	52 Å²	52	95.3 Å²	95.3	54%	0.536	52%	0.517	S	S	.	.			trans	82.8	51.6	158.3	0	0	0	0	0	117.3	R1682	R1682-G1723 VanDerWaalsContact CZ-O 3.23Å; R1682-G1723 PolarHBondContact NH1-O 3.24Å; R1682-G1723 PolarHBondContact NH2-O 3.37Å
1724	L	33.3	Very low	43.6	Very low	91 Å²	91	92.7 Å²	92.7	48%	0.476	51%	0.514	S	S	.	.	S	Bend	trans	-103.5	173.9	148.6	-70.2	173.9	0	0	0	109.3	R1682	R1682-L1724 HydrophobicContact CG-CD2 4.36Å
1725	T	40	Very low	44.8	Very low	85 Å²	85	95.3 Å²	95.3	52%	0.521	52%	0.519	S	S	.	.			trans	-67.8	154	-163.1	4.2	0	0	0	0	113.4	D1727 D1730	T1725-D1727 PolarHBondContact O-N 2.85Å; T1725-D1730 PolarHBondContact N-OD2 2.9Å; T1725-D1730 PolarHBondContact OG1-OD2 2.92Å
1726	N	45	Very low	46	Very low	147 Å²	147	91.1 Å²	91.1	79%	0.786	51%	0.51	S	S	*	.	S	Bend	trans	-63.4	-7.4	-166.9	-66.5	0.7	0	0	0	116.1
1727	D	55.3	Low	47.8	Very low	57 Å²	57	92.4 Å²	92.4	31%	0.305	51%	0.509	S	S	.	.			trans	-88.4	115.5	173.2	-92.4	-3.8	0	0	0	110.7	S1302 T1725 L1729 D1730	S1302-D1727 WeakPolarHBondContact CB-OD2 3.2Å; S1302-D1727 PolarHBondContact N-OD1 2.96Å; S1302-D1727 PolarHBondContact OG-OD2 2.93Å; T1725-D1727 PolarHBondContact O-N 2.85Å; D1727-L1729 PolarHBondContact O-N 2.77Å; D1727-D1730 PolarHBondContact O-N 2.88Å
1728	G	59	Low	49.5	Very low	15 Å²	15	87.1 Å²	87.1	16%	0.155	48%	0.479	C	S	.	.	G	3₁₀ helix	trans	-57.5	-2.3	171.5	0	0	0	0	0	116.3	P1300 D1730	P1300-G1728 PolarHBondContact O-N 2.99Å; P1300-G1728 VanDerWaalsContact O-N 3.13Å; G1728-D1730 VanDerWaalsContact C-N 3.32Å
1729	L	68.8	Low	51.7	Low	9 Å²	9	81.5 Å²	81.5	5%	0.047	45%	0.45	C	S	.	.	G	3₁₀ helix	trans	-73.1	-16.2	172.2	-92.3	87.2	0	0	0	114.3	I1301 L1596 L1677 D1727 Q1731 L1732	I1301-L1729 HydrophobicContact CB-CD1 3.49Å; I1301-L1729 VanDerWaalsContact CB-CD1 3.49Å; I1301-L1729 HydrophobicContact CD1-CD1 3.62Å; I1301-L1729 HydrophobicContact CG1-CD1 4.13Å; I1301-L1729 HydrophobicContact CG2-CD1 3.54Å; L1596-L1729 HydrophobicContact CD2-CD2 3.76Å; L1677-L1729 HydrophobicContact CD2-CD2 3.29Å; D1727-L1729 PolarHBondContact O-N 2.77Å; L1729-Q1731 PolarHBondContact O-N 3.13Å; L1729-L1732 HydrophobicContact CD2-CD1 4.05Å; L1729-L1732 HydrophobicContact CG-CD1 3.95Å; L1729-L1732 WeakPolarHBondContact O-CB 3.4Å; L1729-L1732 PolarHBondContact O-N 3.24Å
1730	D	63.3	Low	53.9	Low	39 Å²	39	76 Å²	76	21%	0.209	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-55.1	-26	175.7	-88.1	-16.7	0	0	0	111.7	P1680 T1725 D1727 G1728 L1732 W1733	P1680-D1730 VanDerWaalsContact CB-OD1 3.3Å; P1680-D1730 WeakPolarHBondContact CB-OD1 3.42Å; P1680-D1730 WeakPolarHBondContact CG-OD1 3.4Å; T1725-D1730 PolarHBondContact N-OD2 2.9Å; T1725-D1730 PolarHBondContact OG1-OD2 2.92Å; D1727-D1730 PolarHBondContact O-N 2.88Å; G1728-D1730 VanDerWaalsContact C-N 3.32Å; D1730-L1732 VanDerWaalsContact C-N 3.35Å; D1730-L1732 PolarHBondContact O-N 2.91Å; D1730-W1733 PolarHBondContact O-N 3.18Å
1731	Q	64	Low	56.5	Low	155 Å²	155	71.2 Å²	71.2	72%	0.724	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-65	-30.5	175.1	-168.5	173.2	11.9	0	0	113.8	L1729 W1733 A1734	L1729-Q1731 PolarHBondContact O-N 3.13Å; Q1731-W1733 PolarHBondContact O-N 2.72Å; Q1731-A1734 WeakPolarHBondContact O-CB 3.38Å; Q1731-A1734 PolarHBondContact O-N 2.82Å
1732	L	66.5	Low	59	Low	4 Å²	4	65.5 Å²	65.5	2%	0.021	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-67.1	-22.4	177.1	-61	-179.1	0	0	0	112.4	Y1264 L1547 L1596 L1729 D1730 P1740	Y1264-L1732 HydrophobicContact CD1-CD2 3.72Å; Y1264-L1732 HydrophobicContact CD2-CD2 3.71Å; Y1264-L1732 HydrophobicContact CE1-CD2 3.45Å; Y1264-L1732 VanDerWaalsContact CE1-CD2 3.45Å; Y1264-L1732 HydrophobicContact CE2-CD2 3.46Å; Y1264-L1732 VanDerWaalsContact CE2-CD2 3.46Å; Y1264-L1732 HydrophobicContact CG-CD2 3.83Å; L1547-L1732 HydrophobicContact CD2-CD1 4.5Å; L1547-L1732 HydrophobicContact CD2-CD2 4.15Å; L1547-L1732 HydrophobicContact CD2-CG 4.31Å; L1596-L1732 HydrophobicContact CD2-CD1 3.76Å; L1729-L1732 HydrophobicContact CD2-CD1 4.05Å; L1729-L1732 HydrophobicContact CG-CD1 3.95Å; L1729-L1732 WeakPolarHBondContact O-CB 3.4Å; L1729-L1732 PolarHBondContact O-N 3.24Å; D1730-L1732 VanDerWaalsContact C-N 3.35Å; D1730-L1732 PolarHBondContact O-N 2.91Å; L1732-P1740 HydrophobicContact CB-CB 4.26Å; L1732-P1740 HydrophobicContact CB-CG 4.07Å; L1732-P1740 HydrophobicContact CD1-CB 4.15Å
1733	W	64.4	Low	61.8	Low	21 Å²	21	54.3 Å²	54.3	8%	0.08	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-91.6	7.7	177.7	-66.9	93.7	0	0	0	113.6	L1677 P1678 E1679 P1680 R1683 D1730 Q1731 H1735 I1739 P1740	L1677-W1733 HydrophobicContact CB-CZ2 3.92Å; L1677-W1733 WeakPolarHBondContact O-CZ2 3.5Å; P1678-W1733 WeakPolarHBondContact O-CZ2 3.3Å; E1679-W1733 HydrophobicContact CB-CH2 3.91Å; E1679-W1733 HydrophobicContact CB-CZ2 4.45Å; E1679-W1733 HydrophobicContact CB-CZ3 3.95Å; E1679-W1733 HydrophobicContact CG-CE3 4.15Å; E1679-W1733 HydrophobicContact CG-CH2 4.42Å; E1679-W1733 HydrophobicContact CG-CZ3 3.97Å; P1680-W1733 HydrophobicContact CG-CB 4.38Å; P1680-W1733 HydrophobicContact CG-CD2 4.38Å; P1680-W1733 HydrophobicContact CG-CG 3.89Å; R1683-W1733 PolarHBondContact NH1-O 2.74Å; D1730-W1733 PolarHBondContact O-N 3.18Å; Q1731-W1733 PolarHBondContact O-N 2.72Å; W1733-H1735 VanDerWaalsContact C-N 3.29Å; W1733-H1735 PolarHBondContact O-N 2.8Å; W1733-I1739 HydrophobicContact CH2-CB 4.46Å; W1733-I1739 HydrophobicContact CH2-CG1 4.23Å; W1733-I1739 HydrophobicContact CH2-CG2 3.91Å; W1733-I1739 HydrophobicContact CZ3-CG1 3.99Å; W1733-I1739 HydrophobicContact CZ3-CG2 4.45Å; W1733-P1740 HydrophobicContact CD2-CG 4.23Å; W1733-P1740 HydrophobicContact CZ2-CG 3.84Å
1734	A	58.6	Low	64.4	Low	75 Å²	75	53.6 Å²	53.6	62%	0.62	29%	0.292	S	S	*	.			trans	-65.5	-27.9	179.4	0	0	0	0	0	113.6	Q1731	Q1731-A1734 WeakPolarHBondContact O-CB 3.38Å; Q1731-A1734 PolarHBondContact O-N 2.82Å
1735	H	57.3	Low	66.9	Low	119 Å²	119	49.3 Å²	49.3	55%	0.551	27%	0.27	S	S	*	.	S	Bend	trans	-86.3	129.6	173.4	-69.4	-66.9	0	0	0	111	R1683 W1733 N1737 R1738	R1683-H1735 PolarHBondContact NH1-O 2.84Å; W1733-H1735 VanDerWaalsContact C-N 3.29Å; W1733-H1735 PolarHBondContact O-N 2.8Å; H1735-N1737 VanDerWaalsContact C-N 3.34Å; H1735-N1737 PolarHBondContact O-N 2.93Å; H1735-R1738 HydrophobicContact CB-CB 4.32Å; H1735-R1738 HydrophobicContact CB-CG 4.37Å
1736	P	54.8	Low	68.9	Low	89 Å²	89	46 Å²	46	58%	0.578	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-37.8	-176	23.7	-33	0	0	0	112.6	R1683	R1683-P1736 PolarHBondContact NH2-O 2.86Å
1737	N	63	Low	70.6	Confident	124 Å²	124	40.7 Å²	40.7	66%	0.663	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97	6.8	-168.6	-62.3	-8.7	0	0	0	114.8	P1600 Y1601 H1735	P1600-N1737 WeakPolarHBondContact CA-O 3.3Å; Y1601-N1737 PolarHBondContact N-O 3.24Å; H1735-N1737 VanDerWaalsContact C-N 3.34Å; H1735-N1737 PolarHBondContact O-N 2.93Å
1738	R	67	Low	71.7	Confident	34 Å²	34	45.2 Å²	45.2	13%	0.128	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	147.1	178.1	-65.9	-174.1	-175.6	-86.2	-2.4	111.3	T1259 G1260 C1598 L1599 H1735	T1259-R1738 PolarHBondContact O-NH2 3.42Å; T1259-R1738 PolarHBondContact OG1-NH2 3.37Å; T1259-R1738 VanDerWaalsContact OG1-NH2 3.09Å; G1260-R1738 VanDerWaalsContact O-CZ 3.25Å; G1260-R1738 PolarHBondContact O-NH2 2.93Å; C1598-R1738 HydrophobicContact CB-CB 4.25Å; C1598-R1738 PolarHBondContact O-NH1 3.42Å; L1599-R1738 CarbonylContact O-C 3.56Å; L1599-R1738 VanDerWaalsContact O-CA 3.26Å; L1599-R1738 WeakPolarHBondContact O-CA 3.24Å; H1735-R1738 HydrophobicContact CB-CB 4.32Å; H1735-R1738 HydrophobicContact CB-CG 4.37Å
1739	I	75	Confident	72.8	Confident	23 Å²	23	44.7 Å²	44.7	12%	0.118	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	130.8	171.7	-67.8	171.9	0	0	0	108.4	L1599 Y1601 L1604 V1676 W1733	L1599-I1739 PolarHBondContact N-O 2.94Å; L1599-I1739 PolarHBondContact O-N 2.77Å; Y1601-I1739 HydrophobicContact CD2-CD1 3.51Å; Y1601-I1739 HydrophobicContact CD2-CG1 4.29Å; Y1601-I1739 HydrophobicContact CE2-CD1 3.92Å; Y1601-I1739 HydrophobicContact CG-CD1 4.39Å; L1604-I1739 HydrophobicContact CD2-CB 3.74Å; L1604-I1739 HydrophobicContact CD2-CD1 3.95Å; L1604-I1739 HydrophobicContact CD2-CG1 4.44Å; L1604-I1739 HydrophobicContact CD2-CG2 3.52Å; V1676-I1739 HydrophobicContact CG1-CG2 3.79Å; W1733-I1739 HydrophobicContact CH2-CB 4.46Å; W1733-I1739 HydrophobicContact CH2-CG1 4.23Å; W1733-I1739 HydrophobicContact CH2-CG2 3.91Å; W1733-I1739 HydrophobicContact CZ3-CG1 3.99Å; W1733-I1739 HydrophobicContact CZ3-CG2 4.45Å
1740	P	78.4	Confident	73.4	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	128.6	169.2	24.3	-26	0	0	0	112	I1597 L1677 L1732 W1733	I1597-P1740 CarbonylContact O-C 3.59Å; I1597-P1740 WeakPolarHBondContact O-CA 3.33Å; L1677-P1740 HydrophobicContact CB-CG 4.06Å; L1677-P1740 HydrophobicContact CD1-CB 4.45Å; L1677-P1740 WeakPolarHBondContact CD1-O 3.19Å; L1677-P1740 HydrophobicContact CD2-CB 4.22Å; L1677-P1740 HydrophobicContact CD2-CG 4.03Å; L1677-P1740 HydrophobicContact CG-CG 4.5Å; L1677-P1740 PolarHBondContact N-O 3.33Å; L1732-P1740 HydrophobicContact CB-CB 4.26Å; L1732-P1740 HydrophobicContact CB-CG 4.07Å; L1732-P1740 HydrophobicContact CD1-CB 4.15Å; W1733-P1740 HydrophobicContact CD2-CG 4.23Å; W1733-P1740 HydrophobicContact CZ2-CG 3.84Å
1741	L	82.8	Confident	74.2	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.9	170.3	-176.5	76	0	0	0	108.4	L1596 I1597 L1599 L1604 I1674 V1676 L1757	L1596-L1741 CarbonylContact C-O 3.22Å; L1596-L1741 VanDerWaalsContact CA-O 3.27Å; L1596-L1741 WeakPolarHBondContact CA-O 3.38Å; I1597-L1741 PolarHBondContact N-O 2.91Å; I1597-L1741 PolarHBondContact O-N 2.98Å; L1599-L1741 HydrophobicContact CD1-CB 4.35Å; L1599-L1741 HydrophobicContact CD1-CD2 3.81Å; L1604-L1741 HydrophobicContact CD1-CD1 4.44Å; I1674-L1741 HydrophobicContact CG2-CD1 3.75Å; I1674-L1741 HydrophobicContact CG2-CD2 4.17Å; I1674-L1741 HydrophobicContact CG2-CG 4.06Å; V1676-L1741 HydrophobicContact CB-CD1 4.47Å; V1676-L1741 HydrophobicContact CG2-CD1 3.66Å; L1741-L1757 HydrophobicContact CD2-CD1 4.02Å
1742	E	84.4	Confident	74.9	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	135.6	176.9	-178.4	170.1	129.8	0	0	111.2	R1266 P1304 Y1305 A1594 T1595 L1596 I1674 H1675 L1677	R1266-E1742 IonicContact CZ-OE2 2.66Å; R1266-E1742 IonicContact NE-OE1 2.67Å; R1266-E1742 IonicContact NE-OE2 3.64Å; R1266-E1742 PolarHBondContact NE-OE2 3.35Å; R1266-E1742 IonicContact NH2-OE1 3.79Å; R1266-E1742 IonicContact NH2-OE2 3.03Å; R1266-E1742 PolarHBondContact NH2-OE2 3.46Å; P1304-E1742 WeakPolarHBondContact CA-OE1 3.3Å; Y1305-E1742 PolarHBondContact N-OE1 3Å; A1594-E1742 HydrophobicContact CB-CG 4.42Å; T1595-E1742 CarbonylContact O-C 3.13Å; T1595-E1742 WeakPolarHBondContact O-CA 3.41Å; L1596-E1742 HydrophobicContact CD1-CB 4.39Å; L1596-E1742 HydrophobicContact CD1-CG 3.98Å; L1596-E1742 HydrophobicContact CD2-CB 4.44Å; L1596-E1742 HydrophobicContact CG-CB 3.93Å; L1596-E1742 HydrophobicContact CG-CG 4.08Å; I1674-E1742 CarbonylContact C-O 3.43Å; I1674-E1742 WeakPolarHBondContact CA-O 3.32Å; H1675-E1742 HydrophobicContact CB-CB 4.46Å; H1675-E1742 PolarHBondContact N-O 3.24Å; H1675-E1742 PolarHBondContact O-N 2.71Å; L1677-E1742 HydrophobicContact CD1-CB 3.58Å
1743	I	86.4	Confident	75.7	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	122.1	175.3	-60.7	163.7	0	0	0	106.6	A1594 T1595 I1597 A1745 T1750 I1753	A1594-I1743 CarbonylContact C-O 3.59Å; A1594-I1743 WeakPolarHBondContact CA-O 3.45Å; T1595-I1743 PolarHBondContact N-O 2.85Å; T1595-I1743 PolarHBondContact O-N 2.72Å; I1597-I1743 HydrophobicContact CD1-CD1 3.54Å; I1743-A1745 HydrophobicContact CG2-CB 4.14Å; I1743-T1750 HydrophobicContact CG2-CG2 4.3Å; I1743-I1753 HydrophobicContact CD1-CB 4.18Å; I1743-I1753 HydrophobicContact CD1-CG2 3.46Å; I1743-I1753 VanDerWaalsContact CD1-CG2 3.46Å; I1743-I1753 HydrophobicContact CG1-CG2 4.09Å; I1743-I1753 HydrophobicContact CG2-CD1 3.61Å
1744	Y	85.7	Confident	76.5	Confident	38 Å²	38	39.3 Å²	39.3	15%	0.149	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	98.2	173.9	-175.3	-103	0	0	0	109	P1304 A1306 L1307 C1592 A1594 F1673	P1304-Y1744 HydrophobicContact CB-CD2 4.12Å; P1304-Y1744 HydrophobicContact CB-CE2 4.4Å; P1304-Y1744 HydrophobicContact CG-CD2 4.44Å; P1304-Y1744 HydrophobicContact CG-CE2 4.39Å; A1306-Y1744 HydrophobicContact CB-CD1 3.52Å; A1306-Y1744 HydrophobicContact CB-CE1 4.35Å; A1306-Y1744 HydrophobicContact CB-CG 3.68Å; L1307-Y1744 HydrophobicContact CD1-CE2 4.37Å; L1307-Y1744 HydrophobicContact CD2-CE1 4.13Å; L1307-Y1744 HydrophobicContact CG-CE1 4.45Å; L1307-Y1744 HydrophobicContact CG-CE2 4.46Å; C1592-Y1744 HydrophobicContact CB-CD1 4.16Å; C1592-Y1744 HydrophobicContact CB-CD2 4.44Å; C1592-Y1744 HydrophobicContact CB-CE1 3.7Å; C1592-Y1744 HydrophobicContact CB-CE2 4Å; A1594-Y1744 HydrophobicContact CB-CD2 4.02Å; F1673-Y1744 PolarHBondContact O-N 2.9Å
1745	A	84.5	Confident	77.4	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	178.2	-174.5	0	0	0	0	0	110.8	C1592 L1593 L1660 I1743 T1749	C1592-A1745 CarbonylContact C-O 3.57Å; C1592-A1745 VanDerWaalsContact CA-O 3.26Å; C1592-A1745 WeakPolarHBondContact CA-O 3.38Å; C1592-A1745 VanDerWaalsContact SG-C 3.59Å; L1593-A1745 PolarHBondContact N-O 3.25Å; L1660-A1745 HydrophobicContact CD1-CB 3.92Å; I1743-A1745 HydrophobicContact CG2-CB 4.14Å; A1745-T1749 HydrophobicContact CB-CG2 4.33Å
1746	D	83.3	Confident	78.5	Confident	16 Å²	16	34.8 Å²	34.8	9%	0.086	18%	0.18	C	C	.	.			trans	-70.6	172.4	165.9	68.3	1	0	0	0	111.7	F1565 L1590 L1660 E1748 T1749 T1750	F1565-D1746 HydrophobicContact CZ-CB 4.4Å; L1590-D1746 HydrophobicContact CD2-CB 4.34Å; L1660-D1746 HydrophobicContact CD2-CB 4.41Å; D1746-E1748 PolarHBondContact O-N 3.36Å; D1746-T1749 WeakPolarHBondContact OD1-CA 3.46Å; D1746-T1749 WeakPolarHBondContact OD1-CB 3.45Å; D1746-T1749 PolarHBondContact OD1-N 3.12Å; D1746-T1749 PolarHBondContact OD1-OG1 2.92Å; D1746-T1750 VanDerWaalsContact O-CB 3.24Å; D1746-T1750 WeakPolarHBondContact O-CB 3.45Å; D1746-T1750 PolarHBondContact O-N 2.83Å; D1746-T1750 PolarHBondContact O-OG1 3Å
1747	F	80.2	Confident	79.9	Confident	36 Å²	36	30.6 Å²	30.6	16%	0.158	15%	0.153	C	C	.	.	H	α-helix	trans	-62.2	-43.7	-178.4	178	-97	0	0	0	112.4	W1562 F1565 T1750 Q1751	W1562-F1747 HydrophobicContact CB-CD2 4.33Å; W1562-F1747 HydrophobicContact CB-CE2 3.54Å; W1562-F1747 HydrophobicContact CB-CZ 3.74Å; W1562-F1747 AromaticContact CD1-CD1 3.76Å; W1562-F1747 AromaticContact CD1-CD2 3.92Å; W1562-F1747 AromaticContact CD1-CE1 3.44Å; W1562-F1747 VanDerWaalsContact CD1-CE1 3.44Å; W1562-F1747 AromaticContact CD1-CE2 3.61Å; W1562-F1747 AromaticContact CD1-CG 3.99Å; W1562-F1747 AromaticContact CD1-CZ 3.36Å; W1562-F1747 HydrophobicContact CG-CE1 4.33Å; W1562-F1747 AromaticContact CG-CE2 3.98Å; W1562-F1747 HydrophobicContact CG-CE2 3.98Å; W1562-F1747 AromaticContact CG-CZ 3.86Å; W1562-F1747 HydrophobicContact CG-CZ 3.86Å; F1565-F1747 HydrophobicContact CD1-CB 3.74Å; F1565-F1747 HydrophobicContact CD2-CB 4.23Å; F1565-F1747 HydrophobicContact CE1-CB 3.65Å; F1565-F1747 HydrophobicContact CE2-CB 4.16Å; F1565-F1747 HydrophobicContact CG-CB 4.03Å; F1565-F1747 HydrophobicContact CZ-CB 3.87Å; F1565-F1747 VanDerWaalsContact CZ-N 3.29Å; F1747-T1750 PolarHBondContact O-N 3.06Å; F1747-Q1751 HydrophobicContact CD1-CG 4.09Å; F1747-Q1751 HydrophobicContact CD2-CG 4.38Å; F1747-Q1751 HydrophobicContact CE1-CG 3.51Å; F1747-Q1751 HydrophobicContact CE2-CG 3.85Å; F1747-Q1751 HydrophobicContact CG-CG 4.49Å; F1747-Q1751 HydrophobicContact CZ-CG 3.36Å; F1747-Q1751 WeakPolarHBondContact O-CG 3.43Å; F1747-Q1751 PolarHBondContact O-N 3.34Å
1748	E	78.2	Confident	80.2	Confident	151 Å²	151	26.1 Å²	26.1	71%	0.706	13%	0.128	S	C	*	.	H	α-helix	trans	-68.1	-44.7	-174.3	-68	177.9	-148.7	0	0	111.9	D1746 T1750 Q1751 L1752	D1746-E1748 PolarHBondContact O-N 3.36Å; E1748-T1750 VanDerWaalsContact C-N 3.32Å; E1748-T1750 PolarHBondContact O-N 3.48Å; E1748-Q1751 PolarHBondContact O-N 2.86Å; E1748-L1752 WeakPolarHBondContact O-CB 3.27Å; E1748-L1752 PolarHBondContact O-N 2.85Å
1749	T	81.8	Confident	80.5	Confident	5 Å²	5	28.5 Å²	28.5	3%	0.031	14%	0.14	C	C	.	.	H	α-helix	trans	-67.9	-34.5	174.1	-49	0	0	0	0	111	A1656 L1660 A1745 D1746 L1752 I1753	A1656-T1749 HydrophobicContact CB-CG2 3.76Å; L1660-T1749 HydrophobicContact CD1-CG2 4.14Å; L1660-T1749 HydrophobicContact CG-CG2 4.12Å; A1745-T1749 HydrophobicContact CB-CG2 4.33Å; D1746-T1749 WeakPolarHBondContact OD1-CA 3.46Å; D1746-T1749 WeakPolarHBondContact OD1-CB 3.45Å; D1746-T1749 PolarHBondContact OD1-N 3.12Å; D1746-T1749 PolarHBondContact OD1-OG1 2.92Å; T1749-L1752 PolarHBondContact O-N 3.46Å; T1749-I1753 HydrophobicContact CG2-CD1 3.98Å; T1749-I1753 HydrophobicContact CG2-CG1 4.41Å; T1749-I1753 WeakPolarHBondContact O-CD1 3.41Å; T1749-I1753 VanDerWaalsContact O-CG1 3.23Å; T1749-I1753 WeakPolarHBondContact O-CG1 3.49Å; T1749-I1753 PolarHBondContact O-N 2.92Å
1750	T	81.9	Confident	80.8	Confident	2 Å²	2	28.2 Å²	28.2	1%	0.012	14%	0.139	C	C	.	.	H	α-helix	trans	-63.9	-43.1	174.3	-58.1	0	0	0	0	111.9	T1595 I1743 D1746 F1747 E1748 I1753 L1754	T1595-T1750 HydrophobicContact CG2-CG2 4.44Å; I1743-T1750 HydrophobicContact CG2-CG2 4.3Å; D1746-T1750 VanDerWaalsContact O-CB 3.24Å; D1746-T1750 WeakPolarHBondContact O-CB 3.45Å; D1746-T1750 PolarHBondContact O-N 2.83Å; D1746-T1750 PolarHBondContact O-OG1 3Å; F1747-T1750 PolarHBondContact O-N 3.06Å; E1748-T1750 VanDerWaalsContact C-N 3.32Å; E1748-T1750 PolarHBondContact O-N 3.48Å; T1750-I1753 PolarHBondContact O-N 2.8Å; T1750-L1754 HydrophobicContact CG2-CD1 4.09Å; T1750-L1754 WeakPolarHBondContact O-CB 3.49Å; T1750-L1754 WeakPolarHBondContact O-CG 3.45Å; T1750-L1754 PolarHBondContact O-N 3.38Å
1751	Q	79.7	Confident	80.7	Confident	33 Å²	33	28.9 Å²	28.9	15%	0.154	14%	0.142	C	C	.	.	H	α-helix	trans	-65.4	-38.7	173.5	-68.3	-50.6	-44.6	0	0	112.2	F1747 E1748 L1754 T1755	F1747-Q1751 HydrophobicContact CD1-CG 4.09Å; F1747-Q1751 HydrophobicContact CD2-CG 4.38Å; F1747-Q1751 HydrophobicContact CE1-CG 3.51Å; F1747-Q1751 HydrophobicContact CE2-CG 3.85Å; F1747-Q1751 HydrophobicContact CG-CG 4.49Å; F1747-Q1751 HydrophobicContact CZ-CG 3.36Å; F1747-Q1751 WeakPolarHBondContact O-CG 3.43Å; F1747-Q1751 PolarHBondContact O-N 3.34Å; E1748-Q1751 PolarHBondContact O-N 2.86Å; Q1751-L1754 PolarHBondContact O-N 2.68Å; Q1751-T1755 VanDerWaalsContact O-CB 3.26Å; Q1751-T1755 WeakPolarHBondContact O-CB 3.44Å; Q1751-T1755 PolarHBondContact O-N 3.48Å; Q1751-T1755 PolarHBondContact O-OG1 3.17Å
1752	L	79.5	Confident	80.1	Confident	55 Å²	55	30.9 Å²	30.9	29%	0.288	16%	0.159	S	C	.	.	H	α-helix	trans	-61.8	-44.5	174.6	-176.7	64.9	0	0	0	111.4	L1655 R1659 E1748 T1749 T1755 N1756	L1655-L1752 HydrophobicContact CD2-CD2 4.15Å; L1655-L1752 HydrophobicContact CD2-CG 4.31Å; L1655-L1752 HydrophobicContact CG-CD2 4.08Å; R1659-L1752 HydrophobicContact CG-CD2 4.06Å; E1748-L1752 WeakPolarHBondContact O-CB 3.27Å; E1748-L1752 PolarHBondContact O-N 2.85Å; T1749-L1752 PolarHBondContact O-N 3.46Å; L1752-T1755 PolarHBondContact O-N 3.32Å; L1752-N1756 WeakPolarHBondContact CD1-ND2 3.12Å; L1752-N1756 WeakPolarHBondContact O-CB 3.38Å; L1752-N1756 PolarHBondContact O-N 2.74Å; L1752-N1756 PolarHBondContact O-ND2 3.03Å
1753	I	83.5	Confident	79.5	Confident	4 Å²	4	36.7 Å²	36.7	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-65	-48.4	177	-66.4	160.4	0	0	0	110.6	I1652 A1656 I1674 I1743 T1749 T1750 T1755 N1756 L1757	I1652-I1753 HydrophobicContact CG2-CB 4.43Å; I1652-I1753 HydrophobicContact CG2-CG1 4.06Å; I1652-I1753 HydrophobicContact CG2-CG2 3.95Å; A1656-I1753 HydrophobicContact CB-CD1 3.87Å; A1656-I1753 HydrophobicContact CB-CG1 4.21Å; I1674-I1753 HydrophobicContact CD1-CD1 3.88Å; I1674-I1753 HydrophobicContact CD1-CG1 4.19Å; I1674-I1753 HydrophobicContact CD1-CG2 4.05Å; I1674-I1753 HydrophobicContact CG1-CD1 4.14Å; I1743-I1753 HydrophobicContact CD1-CB 4.18Å; I1743-I1753 HydrophobicContact CD1-CG2 3.46Å; I1743-I1753 VanDerWaalsContact CD1-CG2 3.46Å; I1743-I1753 HydrophobicContact CG1-CG2 4.09Å; I1743-I1753 HydrophobicContact CG2-CD1 3.61Å; T1749-I1753 HydrophobicContact CG2-CD1 3.98Å; T1749-I1753 HydrophobicContact CG2-CG1 4.41Å; T1749-I1753 WeakPolarHBondContact O-CD1 3.41Å; T1749-I1753 VanDerWaalsContact O-CG1 3.23Å; T1749-I1753 WeakPolarHBondContact O-CG1 3.49Å; T1749-I1753 PolarHBondContact O-N 2.92Å; T1750-I1753 PolarHBondContact O-N 2.8Å; I1753-T1755 VanDerWaalsContact C-N 3.29Å; I1753-T1755 PolarHBondContact O-N 3.09Å; I1753-N1756 PolarHBondContact O-N 3.02Å; I1753-L1757 HydrophobicContact CG2-CD1 3.78Å; I1753-L1757 HydrophobicContact CG2-CG 4.26Å; I1753-L1757 WeakPolarHBondContact O-CB 3.36Å; I1753-L1757 VanDerWaalsContact O-CG 3.31Å; I1753-L1757 WeakPolarHBondContact O-CG 3.37Å; I1753-L1757 PolarHBondContact O-N 3.25Å
1754	L	81.4	Confident	79	Confident	21 Å²	21	38.5 Å²	38.5	11%	0.11	20%	0.196	C	C	.	.	H	α-helix	trans	-54.4	-45.6	175.2	-82.5	164.7	0	0	0	111.5	I1597 T1750 Q1751 L1757 H1758	I1597-L1754 HydrophobicContact CD1-CD2 3.47Å; I1597-L1754 VanDerWaalsContact CD1-CD2 3.47Å; I1597-L1754 HydrophobicContact CD1-CG 4.32Å; I1597-L1754 HydrophobicContact CG1-CD2 4.15Å; T1750-L1754 HydrophobicContact CG2-CD1 4.09Å; T1750-L1754 WeakPolarHBondContact O-CB 3.49Å; T1750-L1754 WeakPolarHBondContact O-CG 3.45Å; T1750-L1754 PolarHBondContact O-N 3.38Å; Q1751-L1754 PolarHBondContact O-N 2.68Å; L1754-L1757 PolarHBondContact O-N 3.05Å; L1754-H1758 WeakPolarHBondContact O-CB 3.19Å; L1754-H1758 PolarHBondContact O-N 3.21Å
1755	T	76.7	Confident	78.3	Confident	65 Å²	65	40.9 Å²	40.9	40%	0.399	21%	0.211	S	C	.	.	H	α-helix	trans	-69.3	-36.9	-179	-55.2	0	0	0	0	112.5	Q1751 L1752 I1753 H1758 H1759	Q1751-T1755 VanDerWaalsContact O-CB 3.26Å; Q1751-T1755 WeakPolarHBondContact O-CB 3.44Å; Q1751-T1755 PolarHBondContact O-N 3.48Å; Q1751-T1755 PolarHBondContact O-OG1 3.17Å; L1752-T1755 PolarHBondContact O-N 3.32Å; I1753-T1755 VanDerWaalsContact C-N 3.29Å; I1753-T1755 PolarHBondContact O-N 3.09Å; T1755-H1758 WeakPolarHBondContact O-CB 3.34Å; T1755-H1758 PolarHBondContact O-N 3Å; T1755-H1759 PolarHBondContact O-N 3.16Å; T1755-H1759 PolarHBondContact O-ND1 3.32Å
1756	N	80	Confident	77.3	Confident	34 Å²	34	47.6 Å²	47.6	18%	0.182	24%	0.237	C	C	.	.	H	α-helix	trans	-70.7	-43.8	175.1	-82.5	-87.6	0	0	0	111.8	W1651 I1652 L1752 I1753 H1758 H1759 M1760	W1651-N1756 WeakPolarHBondContact CZ3-OD1 3.39Å; I1652-N1756 HydrophobicContact CD1-CB 4.43Å; I1652-N1756 HydrophobicContact CG1-CB 4.46Å; L1752-N1756 WeakPolarHBondContact CD1-ND2 3.12Å; L1752-N1756 WeakPolarHBondContact O-CB 3.38Å; L1752-N1756 PolarHBondContact O-N 2.74Å; L1752-N1756 PolarHBondContact O-ND2 3.03Å; I1753-N1756 PolarHBondContact O-N 3.02Å; N1756-H1758 PolarHBondContact O-N 2.97Å; N1756-H1759 PolarHBondContact O-N 3.07Å; N1756-M1760 WeakPolarHBondContact O-CB 3.31Å; N1756-M1760 WeakPolarHBondContact O-CG 3.45Å; N1756-M1760 PolarHBondContact O-N 2.87Å
1757	L	83.7	Confident	76.6	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-57.9	-36.7	170.6	-70.2	171.5	0	0	0	111.3	W1256 I1597 L1607 I1652 L1741 I1753 L1754 M1760 L1761	W1256-L1757 HydrophobicContact CH2-CB 4.22Å; W1256-L1757 HydrophobicContact CZ2-CB 4.44Å; W1256-L1757 WeakPolarHBondContact CZ2-O 3.46Å; I1597-L1757 HydrophobicContact CD1-CD1 4.26Å; L1607-L1757 HydrophobicContact CD1-CD2 3.6Å; L1607-L1757 HydrophobicContact CD2-CD2 4.5Å; I1652-L1757 HydrophobicContact CD1-CD2 3.7Å; I1652-L1757 HydrophobicContact CD1-CG 4.12Å; L1741-L1757 HydrophobicContact CD2-CD1 4.02Å; I1753-L1757 HydrophobicContact CG2-CD1 3.78Å; I1753-L1757 HydrophobicContact CG2-CG 4.26Å; I1753-L1757 WeakPolarHBondContact O-CB 3.36Å; I1753-L1757 VanDerWaalsContact O-CG 3.31Å; I1753-L1757 WeakPolarHBondContact O-CG 3.37Å; I1753-L1757 PolarHBondContact O-N 3.25Å; L1754-L1757 PolarHBondContact O-N 3.05Å; L1757-M1760 PolarHBondContact O-N 3.35Å; L1757-L1761 PolarHBondContact O-N 3.19Å
1758	H	70.4	Confident	75.9	Confident	30 Å²	30	50.6 Å²	50.6	14%	0.139	26%	0.261	C	S	.	.	H	α-helix	trans	-58	-58.2	177.4	-177	-78.4	0	0	0	112.4	W1256 L1754 T1755 N1756 M1760 L1761 A1762	W1256-H1758 WeakPolarHBondContact CB-NE2 3.12Å; W1256-H1758 AromaticContact CD1-CD2 3.23Å; W1256-H1758 AromaticContact CD1-CG 3.69Å; W1256-H1758 AromaticContact CD1-NE2 3.46Å; W1256-H1758 HydrophobicContact CD2-CB 4.38Å; W1256-H1758 AromaticContact CD2-CD2 3.57Å; W1256-H1758 VanDerWaalsContact CE2-CA 3.46Å; W1256-H1758 AromaticContact CG-CD2 3.13Å; W1256-H1758 AromaticContact CG-CG 3.97Å; W1256-H1758 AromaticContact CG-NE2 3.51Å; W1256-H1758 HydrophobicContact CZ2-CB 4.41Å; W1256-H1758 AromaticContact NE1-CD2 3.75Å; W1256-H1758 AromaticContact NE1-CG 3.81Å; W1256-H1758 PolarHBondContact NE1-O 2.67Å; W1256-H1758 VanDerWaalsContact NE1-O 3.11Å; L1754-H1758 WeakPolarHBondContact O-CB 3.19Å; L1754-H1758 PolarHBondContact O-N 3.21Å; T1755-H1758 WeakPolarHBondContact O-CB 3.34Å; T1755-H1758 PolarHBondContact O-N 3Å; N1756-H1758 PolarHBondContact O-N 2.97Å; H1758-M1760 VanDerWaalsContact C-N 3.32Å; H1758-M1760 PolarHBondContact O-N 3.21Å; H1758-L1761 PolarHBondContact O-N 3.42Å; H1758-A1762 PolarHBondContact O-N 2Å
1759	H	72.6	Confident	74.5	Confident	84 Å²	84	46.7 Å²	46.7	39%	0.389	25%	0.25	S	S	.	.	H	α-helix	trans	-62.2	-39.1	179.3	-69.1	84	0	0	0	111.8	T1755 N1756 A1762 L1763	T1755-H1759 PolarHBondContact O-N 3.16Å; T1755-H1759 PolarHBondContact O-ND1 3.32Å; N1756-H1759 PolarHBondContact O-N 3.07Å; H1759-A1762 PolarHBondContact O-N 2.6Å; H1759-L1763 WeakPolarHBondContact O-CB 3.16Å; H1759-L1763 VanDerWaalsContact O-CG 3.3Å; H1759-L1763 WeakPolarHBondContact O-CG 3.33Å; H1759-L1763 PolarHBondContact O-N 2.83Å
1760	M	81.3	Confident	72.9	Confident	17 Å²	17	51.3 Å²	51.3	8%	0.084	27%	0.274	C	S	.	.	H	α-helix	trans	-64.6	-41.6	176.3	-74.5	-169.6	-172.1	0	0	113.3	F1603 W1606 L1607 F1614 P1648 W1651 I1652 N1756 L1757 H1758 W1764	F1603-M1760 HydrophobicContact CE2-CB 4.24Å; F1603-M1760 HydrophobicContact CZ-CB 4.02Å; W1606-M1760 HydrophobicContact CZ3-CB 4.17Å; L1607-M1760 HydrophobicContact CD2-CB 4.33Å; L1607-M1760 HydrophobicContact CD2-SD 3.65Å; F1614-M1760 HydrophobicContact CE2-CE 4.1Å; F1614-M1760 HydrophobicContact CZ-CE 4.1Å; P1648-M1760 HydrophobicContact CB-CE 4.2Å; P1648-M1760 HydrophobicContact CB-SD 3.81Å; W1651-M1760 HydrophobicContact CE3-CE 3.65Å; W1651-M1760 HydrophobicContact CZ3-CE 3.63Å; I1652-M1760 HydrophobicContact CD1-CE 4.09Å; I1652-M1760 HydrophobicContact CD1-SD 3.78Å; I1652-M1760 HydrophobicContact CG1-CE 4.07Å; I1652-M1760 HydrophobicContact CG1-SD 4.4Å; N1756-M1760 WeakPolarHBondContact O-CB 3.31Å; N1756-M1760 WeakPolarHBondContact O-CG 3.45Å; N1756-M1760 PolarHBondContact O-N 2.87Å; L1757-M1760 PolarHBondContact O-N 3.35Å; H1758-M1760 VanDerWaalsContact C-N 3.32Å; H1758-M1760 PolarHBondContact O-N 3.21Å; M1760-W1764 VanDerWaalsContact O-CB 3.26Å; M1760-W1764 WeakPolarHBondContact O-CB 3.36Å; M1760-W1764 PolarHBondContact O-N 3.27Å
1761	L	77.2	Confident	71.3	Confident	13 Å²	13	54.7 Å²	54.7	7%	0.068	30%	0.303	C	S	.	.	H	α-helix	trans	-70.1	-35.6	175.7	178.8	62.8	0	0	0	111.6	W1256 F1603 L1757 H1758 W1764 L1765	W1256-L1761 HydrophobicContact CD2-CD2 4.43Å; W1256-L1761 HydrophobicContact CZ2-CB 3.69Å; W1256-L1761 HydrophobicContact CZ2-CD2 3.6Å; W1256-L1761 HydrophobicContact CZ2-CG 4.26Å; F1603-L1761 HydrophobicContact CB-CD1 3.93Å; F1603-L1761 HydrophobicContact CD1-CB 4.26Å; F1603-L1761 HydrophobicContact CD1-CD1 3.76Å; F1603-L1761 HydrophobicContact CD1-CG 4.43Å; F1603-L1761 HydrophobicContact CD2-CB 4.34Å; F1603-L1761 HydrophobicContact CD2-CD1 3.7Å; F1603-L1761 HydrophobicContact CE1-CB 3.76Å; F1603-L1761 HydrophobicContact CE1-CD1 4.16Å; F1603-L1761 HydrophobicContact CE1-CG 4.4Å; F1603-L1761 VanDerWaalsContact CE2-CA 3.45Å; F1603-L1761 HydrophobicContact CE2-CB 3.87Å; F1603-L1761 HydrophobicContact CE2-CD1 4.12Å; F1603-L1761 HydrophobicContact CG-CD1 3.5Å; F1603-L1761 HydrophobicContact CZ-CB 3.55Å; F1603-L1761 HydrophobicContact CZ-CD1 4.34Å; L1757-L1761 PolarHBondContact O-N 3.19Å; H1758-L1761 PolarHBondContact O-N 3.42Å; L1761-W1764 HydrophobicContact CD1-CE3 3.73Å; L1761-W1764 HydrophobicContact CD1-CZ3 4.29Å; L1761-W1764 PolarHBondContact O-N 2.87Å; L1761-L1765 HydrophobicContact CD1-CD1 4.14Å; L1761-L1765 HydrophobicContact CD1-CG 3.98Å; L1761-L1765 HydrophobicContact CG-CD1 3.95Å; L1761-L1765 HydrophobicContact CG-CG 4.25Å; L1761-L1765 WeakPolarHBondContact O-CB 3.37Å; L1761-L1765 VanDerWaalsContact O-CG 3.28Å; L1761-L1765 WeakPolarHBondContact O-CG 3.49Å; L1761-L1765 PolarHBondContact O-N 3.07Å
1762	A	70.9	Confident	69.4	Low	44 Å²	44	56 Å²	56	36%	0.364	32%	0.324	S	S	.	.	H	α-helix	trans	-62.9	-47.1	175.1	0	0	0	0	0	111.6	H1758 H1759 W1764 L1765 Y1766	H1758-A1762 PolarHBondContact O-N 2Å; H1759-A1762 PolarHBondContact O-N 2.6Å; A1762-W1764 PolarHBondContact O-N 2.76Å; A1762-L1765 PolarHBondContact O-N 3.26Å; A1762-Y1766 WeakPolarHBondContact O-CB 3.42Å; A1762-Y1766 PolarHBondContact O-N 3.26Å
1763	L	70.7	Confident	67.2	Low	121 Å²	121	59.5 Å²	59.5	63%	0.634	35%	0.348	S	S	*	.	H	α-helix	trans	-62.1	-41	173.9	-71.3	168.7	0	0	0	112.2	H1759 Y1766 G1767	H1759-L1763 WeakPolarHBondContact O-CB 3.16Å; H1759-L1763 VanDerWaalsContact O-CG 3.3Å; H1759-L1763 WeakPolarHBondContact O-CG 3.33Å; H1759-L1763 PolarHBondContact O-N 2.83Å; L1763-Y1766 PolarHBondContact O-N 3.02Å; L1763-G1767 PolarHBondContact O-N 3.18Å
1764	W	76.5	Confident	64.8	Low	39 Å²	39	64.3 Å²	64.3	15%	0.148	38%	0.382	C	S	.	.	H	α-helix	trans	-64.4	-45.6	176.9	-176.6	84.3	0	0	0	112.1	R1602 F1603 W1606 M1760 L1761 A1762 G1767 Q1768	R1602-W1764 HydrophobicContact CB-CH2 3.8Å; R1602-W1764 HydrophobicContact CB-CZ2 3.63Å; F1603-W1764 HydrophobicContact CB-CD2 4.17Å; F1603-W1764 HydrophobicContact CB-CE3 4.07Å; F1603-W1764 HydrophobicContact CB-CH2 4.39Å; F1603-W1764 HydrophobicContact CB-CZ2 4.48Å; F1603-W1764 HydrophobicContact CB-CZ3 4.17Å; F1603-W1764 HydrophobicContact CD2-CB 3.83Å; F1603-W1764 AromaticContact CD2-CD2 3.85Å; F1603-W1764 HydrophobicContact CD2-CD2 3.85Å; F1603-W1764 HydrophobicContact CD2-CE3 4.18Å; F1603-W1764 AromaticContact CD2-CG 3.69Å; F1603-W1764 HydrophobicContact CD2-CG 3.69Å; F1603-W1764 HydrophobicContact CE2-CB 3.99Å; F1603-W1764 HydrophobicContact CE2-CG 4.32Å; F1603-W1764 HydrophobicContact CG-CD2 4.47Å; F1603-W1764 HydrophobicContact CG-CE3 4.48Å; W1606-W1764 AromaticContact CD2-CD1 3.5Å; W1606-W1764 HydrophobicContact CD2-CG 4.42Å; W1606-W1764 HydrophobicContact CE3-CB 4.46Å; W1606-W1764 AromaticContact CE3-CD1 3.84Å; W1606-W1764 HydrophobicContact CE3-CG 4.36Å; W1606-W1764 AromaticContact CG-CD1 3.53Å; W1606-W1764 AromaticContact CG-NE1 3.69Å; M1760-W1764 VanDerWaalsContact O-CB 3.26Å; M1760-W1764 WeakPolarHBondContact O-CB 3.36Å; M1760-W1764 PolarHBondContact O-N 3.27Å; L1761-W1764 HydrophobicContact CD1-CE3 3.73Å; L1761-W1764 HydrophobicContact CD1-CZ3 4.29Å; L1761-W1764 PolarHBondContact O-N 2.87Å; A1762-W1764 PolarHBondContact O-N 2.76Å; W1764-G1767 PolarHBondContact O-N 3.27Å; W1764-Q1768 HydrophobicContact CD2-CG 4.14Å; W1764-Q1768 HydrophobicContact CE3-CG 4.19Å; W1764-Q1768 HydrophobicContact CH2-CG 4.04Å; W1764-Q1768 HydrophobicContact CZ2-CG 3.97Å; W1764-Q1768 HydrophobicContact CZ3-CG 4.16Å; W1764-Q1768 WeakPolarHBondContact O-CG 3.48Å; W1764-Q1768 PolarHBondContact O-N 3.21Å
1765	L	69.4	Low	62.2	Low	87 Å²	87	69.3 Å²	69.3	46%	0.455	41%	0.413	S	S	.	.	H	α-helix	trans	-64.6	-39.5	175.6	-73.1	172.5	0	0	0	112	L1761 A1762 Q1768 S1769	L1761-L1765 HydrophobicContact CD1-CD1 4.14Å; L1761-L1765 HydrophobicContact CD1-CG 3.98Å; L1761-L1765 HydrophobicContact CG-CD1 3.95Å; L1761-L1765 HydrophobicContact CG-CG 4.25Å; L1761-L1765 WeakPolarHBondContact O-CB 3.37Å; L1761-L1765 VanDerWaalsContact O-CG 3.28Å; L1761-L1765 WeakPolarHBondContact O-CG 3.49Å; L1761-L1765 PolarHBondContact O-N 3.07Å; A1762-L1765 PolarHBondContact O-N 3.26Å; L1765-Q1768 PolarHBondContact O-N 2.72Å; L1765-S1769 PolarHBondContact O-N 2.78Å
1766	Y	63.6	Low	59.8	Low	141 Å²	141	74.5 Å²	74.5	55%	0.553	43%	0.433	S	S	*	.	H	α-helix	trans	-60	-47.2	173.1	-179.6	-112.9	0	0	0	111.2	A1762 L1763 Q1768 S1769 L1770	A1762-Y1766 WeakPolarHBondContact O-CB 3.42Å; A1762-Y1766 PolarHBondContact O-N 3.26Å; L1763-Y1766 PolarHBondContact O-N 3.02Å; Y1766-Q1768 PolarHBondContact O-N 2.77Å; Y1766-S1769 PolarHBondContact O-N 2.63Å; Y1766-S1769 PolarHBondContact O-OG 2.83Å; Y1766-L1770 HydrophobicContact CD1-CD1 4.09Å; Y1766-L1770 HydrophobicContact CE1-CD1 3.58Å; Y1766-L1770 HydrophobicContact CE1-CG 4.35Å; Y1766-L1770 HydrophobicContact CE2-CD1 4.44Å; Y1766-L1770 HydrophobicContact CE2-CD2 4.48Å; Y1766-L1770 HydrophobicContact CE2-CG 4.38Å; Y1766-L1770 PolarHBondContact O-N 2.81Å
1767	G	69.9	Low	57.2	Low	35 Å²	35	78.1 Å²	78.1	36%	0.361	46%	0.461	S	S	.	.	H	α-helix	trans	-60.5	-39	173.7	0	0	0	0	0	113.8	L1763 W1764 S1769 A1771	L1763-G1767 PolarHBondContact O-N 3.18Å; W1764-G1767 PolarHBondContact O-N 3.27Å; G1767-S1769 VanDerWaalsContact C-N 3.32Å; G1767-S1769 PolarHBondContact O-N 2.88Å; G1767-A1771 PolarHBondContact O-N 2.97Å
1768	Q	64.4	Low	54.6	Low	81 Å²	81	86.6 Å²	86.6	38%	0.379	50%	0.498	S	S	.	.	H	α-helix	trans	-65.5	-32.9	172.1	-67	-66	-84.1	0	0	112.3	W1764 L1765 Y1766	W1764-Q1768 HydrophobicContact CD2-CG 4.14Å; W1764-Q1768 HydrophobicContact CE3-CG 4.19Å; W1764-Q1768 HydrophobicContact CH2-CG 4.04Å; W1764-Q1768 HydrophobicContact CZ2-CG 3.97Å; W1764-Q1768 HydrophobicContact CZ3-CG 4.16Å; W1764-Q1768 WeakPolarHBondContact O-CG 3.48Å; W1764-Q1768 PolarHBondContact O-N 3.21Å; L1765-Q1768 PolarHBondContact O-N 2.72Å; Y1766-Q1768 PolarHBondContact O-N 2.77Å
1769	S	48.9	Very low	52.5	Low	69 Å²	69	93.6 Å²	93.6	48%	0.483	54%	0.535	S	S	.	.	H	α-helix	trans	-73	-39.5	178.9	76	0	0	0	0	112.9	L1765 Y1766 G1767 A1771 G1772	L1765-S1769 PolarHBondContact O-N 2.78Å; Y1766-S1769 PolarHBondContact O-N 2.63Å; Y1766-S1769 PolarHBondContact O-OG 2.83Å; G1767-S1769 VanDerWaalsContact C-N 3.32Å; G1767-S1769 PolarHBondContact O-N 2.88Å; S1769-A1771 VanDerWaalsContact C-N 3.26Å; S1769-A1771 PolarHBondContact O-N 2.88Å; S1769-G1772 PolarHBondContact O-N 3.36Å
1770	L	49.7	Very low	50.3	Low	101 Å²	101	97.2 Å²	97.2	53%	0.529	55%	0.552	S	S	.	*	H	α-helix	trans	-64.9	-30.2	174.3	-69.6	175.7	0	0	0	112.4	Y1766 G1772	Y1766-L1770 HydrophobicContact CD1-CD1 4.09Å; Y1766-L1770 HydrophobicContact CE1-CD1 3.58Å; Y1766-L1770 HydrophobicContact CE1-CG 4.35Å; Y1766-L1770 HydrophobicContact CE2-CD1 4.44Å; Y1766-L1770 HydrophobicContact CE2-CD2 4.48Å; Y1766-L1770 HydrophobicContact CE2-CG 4.38Å; Y1766-L1770 PolarHBondContact O-N 2.81Å; L1770-G1772 PolarHBondContact O-N 2.89Å
1771	A	48.3	Very low	47.7	Very low	74 Å²	74	100.1 Å²	100.1	61%	0.612	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-1.8	172.7	0	0	0	0	0	114	G1767 S1769	G1767-A1771 PolarHBondContact O-N 2.97Å; S1769-A1771 VanDerWaalsContact C-N 3.26Å; S1769-A1771 PolarHBondContact O-N 2.88Å
1772	G	38.4	Very low	45.3	Very low	59 Å²	59	104.8 Å²	104.8	61%	0.608	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-9.9	-177	0	0	0	0	0	115.9	S1769 L1770	S1769-G1772 PolarHBondContact O-N 3.36Å; L1770-G1772 PolarHBondContact O-N 2.89Å
1773	T	32.8	Very low	43.3	Very low	129 Å²	129	108.7 Å²	108.7	79%	0.791	62%	0.623	S	S	*	*	S	Bend	trans	-102.9	29.9	-167.9	60.4	0	0	0	0	115.5
1774	S	32.9	Very low	41.3	Very low	105 Å²	105	109 Å²	109	73%	0.734	63%	0.63	S	S	*	*	S	Bend	trans	-156.5	158.7	158.4	60.3	0	0	0	0	110.7
1775	V	28.3	Very low	39	Very low	126 Å²	126	115.3 Å²	115.3	76%	0.764	66%	0.655	S	S	*	*			trans	-96.2	133.5	-171.4	177.9	0	0	0	0	111.5
1776	Q	26.4	Very low	36.9	Very low	175 Å²	175	117.8 Å²	117.8	82%	0.818	67%	0.673	S	S	*	*	S	Bend	trans	72.8	149	166.6	-77.1	161.9	-42.6	0	0	118.9
1777	S	25.1	Very low	35.2	Very low	109 Å²	109	116.9 Å²	116.9	76%	0.762	68%	0.677	S	S	*	*			trans	53.5	102.9	179.5	56.3	0	0	0	0	118.1
1778	F	28.7	Very low	33.1	Very low	180 Å²	180	120.7 Å²	120.7	79%	0.789	70%	0.696	S	S	*	*			trans	-160.2	113.4	131.2	-107.6	-68.6	0	0	0	110.7	Q1780	F1778-Q1780 HydrophobicContact CD1-CB 4.27Å
1779	I	25.4	Very low	31.4	Very low	177 Å²	177	125.5 Å²	125.5	91%	0.908	72%	0.724	S	S	*	*			trans	-106.3	69.3	165.2	-55	179.8	0	0	0	107.3
1780	Q	28	Very low	30.5	Very low	159 Å²	159	125.5 Å²	125.5	74%	0.743	74%	0.735	S	S	*	*	S	Bend	trans	-160.5	155.2	170.7	-113.1	165	-1.8	0	0	109.1	F1778	F1778-Q1780 HydrophobicContact CD1-CB 4.27Å
1781	A	25.2	Very low	29.5	Very low	79 Å²	79	131.8 Å²	131.8	65%	0.653	75%	0.752	S	S	*	*			trans	-69.5	138.6	-177.2	0	0	0	0	0	111.2	I1783	A1781-I1783 PolarHBondContact O-N 3.42Å
1782	P	28	Very low	28.4	Very low	111 Å²	111	134.4 Å²	134.4	72%	0.721	76%	0.762	S	S	*	*			trans	-71.1	103.4	-179.3	28.2	-34	0	0	0	110.9	V1784	P1782-V1784 PolarHBondContact O-N 2.87Å
1783	I	27.9	Very low	28	Very low	125 Å²	125	138 Å²	138	64%	0.641	77%	0.773	S	S	*	*			trans	-77.1	103.2	169.6	-53.6	175	0	0	0	107.9	A1781 Y1785	A1781-I1783 PolarHBondContact O-N 3.42Å; I1783-Y1785 VanDerWaalsContact C-N 3.28Å; I1783-Y1785 HydrophobicContact CB-CD2 4.38Å; I1783-Y1785 HydrophobicContact CG2-CD2 3.5Å; I1783-Y1785 HydrophobicContact CG2-CE2 3.66Å; I1783-Y1785 HydrophobicContact CG2-CG 4.27Å; I1783-Y1785 PolarHBondContact O-N 2.87Å
1784	V	30	Very low	27.6	Very low	128 Å²	128	139.3 Å²	139.3	78%	0.776	78%	0.775	S	S	*	*			trans	-77.3	82.9	172.5	-176	0	0	0	0	109	P1782 V1786	P1782-V1784 PolarHBondContact O-N 2.87Å; V1784-V1786 PolarHBondContact O-N 2.81Å
1785	Y	27	Very low	27.4	Very low	172 Å²	172	142 Å²	142	68%	0.675	78%	0.779	S	S	*	*			trans	-72.5	109	166.1	-94.1	-71.7	0	0	0	109.9	I1783 L1787	I1783-Y1785 VanDerWaalsContact C-N 3.28Å; I1783-Y1785 HydrophobicContact CB-CD2 4.38Å; I1783-Y1785 HydrophobicContact CG2-CD2 3.5Å; I1783-Y1785 HydrophobicContact CG2-CE2 3.66Å; I1783-Y1785 HydrophobicContact CG2-CG 4.27Å; I1783-Y1785 PolarHBondContact O-N 2.87Å; Y1785-L1787 HydrophobicContact CD1-CD1 4.24Å; Y1785-L1787 HydrophobicContact CD1-CD2 4.38Å; Y1785-L1787 HydrophobicContact CD1-CG 3.94Å; Y1785-L1787 HydrophobicContact CG-CD1 4.18Å; Y1785-L1787 HydrophobicContact CG-CG 4.28Å; Y1785-L1787 PolarHBondContact O-N 2.88Å
1786	V	26.1	Very low	27.4	Very low	138 Å²	138	140.2 Å²	140.2	84%	0.836	77%	0.773	S	S	*	*			trans	-84.2	89.7	155.1	-178.2	0	0	0	0	106.8	V1784	V1784-V1786 PolarHBondContact O-N 2.81Å
1787	L	27	Very low	27.3	Very low	123 Å²	123	138.3 Å²	138.3	64%	0.644	77%	0.773	S	S	*	*			trans	-85.5	135.4	177.1	-87.8	156.9	0	0	0	110.6	Y1785	Y1785-L1787 HydrophobicContact CD1-CD1 4.24Å; Y1785-L1787 HydrophobicContact CD1-CD2 4.38Å; Y1785-L1787 HydrophobicContact CD1-CG 3.94Å; Y1785-L1787 HydrophobicContact CG-CD1 4.18Å; Y1785-L1787 HydrophobicContact CG-CG 4.28Å; Y1785-L1787 PolarHBondContact O-N 2.88Å
1788	P	27.1	Very low	27.3	Very low	115 Å²	115	137.8 Å²	137.8	75%	0.747	77%	0.769	S	S	*	*			trans	-70.5	145.8	169.6	30.6	-34	0	0	0	110.6	G1790	P1788-G1790 PolarHBondContact O-N 3.05Å; P1788-G1790 VanDerWaalsContact O-N 3.09Å
1789	N	29.1	Very low	27.3	Very low	181 Å²	181	136.4 Å²	136.4	97%	0.968	77%	0.77	S	S	*	*	S	Bend	trans	-71.5	104.8	-178.1	-85.2	-28.5	0	0	0	112
1790	G	29.8	Very low	27.5	Very low	69 Å²	69	132.7 Å²	132.7	71%	0.711	76%	0.76	S	S	*	*			trans	-164	61.2	-179.2	0	0	0	0	0	114.2	P1788	P1788-G1790 PolarHBondContact O-N 3.05Å; P1788-G1790 VanDerWaalsContact O-N 3.09Å
1791	R	27.8	Very low	27.6	Very low	234 Å²	234	126.9 Å²	126.9	88%	0.883	74%	0.739	S	S	*	*			trans	26.4	105.4	169.1	-76.3	-173.7	172	-173.7	-1.9	118
1792	P	25.7	Very low	27.9	Very low	129 Å²	129	127.2 Å²	127.2	84%	0.838	73%	0.73	S	S	*	*			trans	-79.7	125.3	157.7	32.2	-30.6	0	0	0	111
1793	T	29.5	Very low	28	Very low	134 Å²	134	124.1 Å²	124.1	82%	0.822	72%	0.718	S	S	*	*			trans	-109.6	127	159.6	45.6	0	0	0	0	108.7
1794	N	25.7	Very low	28	Very low	157 Å²	157	129.8 Å²	129.8	84%	0.84	73%	0.732	S	S	*	*			trans	-70.2	165.1	-171.1	-88.9	-38.2	0	0	0	114.7
1795	I	28.4	Very low	28.1	Very low	160 Å²	160	129.1 Å²	129.1	82%	0.821	73%	0.73	S	S	*	*			trans	122.5	118.2	164.1	-68.6	158.3	0	0	0	110.1
1796	S	26.7	Very low	28.1	Very low	90 Å²	90	131.4 Å²	131.4	63%	0.629	74%	0.739	S	S	*	*			cis	155	117.5	-26.4	52.8	0	0	0	0	106.9
1797	T	25.5	Very low	28.3	Very low	134 Å²	134	130.2 Å²	130.2	82%	0.822	74%	0.737	S	S	*	*			trans	41.6	141.4	143.7	55.8	0	0	0	0	121.3
1798	S	25.3	Very low	28.3	Very low	98 Å²	98	133.7 Å²	133.7	69%	0.685	75%	0.746	S	S	*	*			cis	-163.1	170.5	-0.8	45	0	0	0	0	108.6
1799	D	29.4	Very low	28.1	Very low	152 Å²	152	133.3 Å²	133.3	81%	0.813	75%	0.746	S	S	*	*				173.4	-177.9	94.6	-100.5	7.9	0	0	0	112
1800	S	29	Very low	28	Very low	98 Å²	98	131.1 Å²	131.1	69%	0.685	74%	0.735	S	S	*	*			trans	-100	168.7	176.2	-63.7	0	0	0	0	113.2
1801	A	29.5	Very low	27.9	Very low	38 Å²	38	137.5 Å²	137.5	31%	0.314	74%	0.738	S	S	.	*			cis	-172.2	-135.7	-35.8	0	0	0	0	0	111.1	G504 S505 N506	G504-A1801 VanDerWaalsContact C-C 3.43Å; G504-A1801 CarbonylContact C-O 3.14Å; G504-A1801 PolarHBondContact N-O 2.93Å; G504-A1801 CarbonylContact O-C 3.56Å; G504-A1801 PolarHBondContact O-N 2.85Å; S505-A1801 VanDerWaalsContact C-CB 3.45Å; S505-A1801 WeakPolarHBondContact O-CB 3.45Å; N506-A1801 HydrophobicContact CB-CB 3.45Å; N506-A1801 VanDerWaalsContact CB-CB 3.45Å; N506-A1801 WeakPolarHBondContact ND2-CB 3.39Å
1802	N	30.6	Very low	27.9	Very low	86 Å²	86	133.6 Å²	133.6	46%	0.46	73%	0.729	S	S	.	*	B	Isolated β-bridge	trans	-55.7	128.4	-157.3	-60.3	-30.4	0	0	0	119.7	G504 S505	G504-N1802 CarbonylContact C-O 3.57Å; G504-N1802 WeakPolarHBondContact CA-O 3.36Å; G504-N1802 PolarHBondContact N-O 3.44Å; S505-N1802 PolarHBondContact N-O 3.24Å; S505-N1802 WeakPolarHBondContact O-CB 3.37Å; S505-N1802 PolarHBondContact O-N 3.22Å; S505-N1802 PolarHBondContact O-ND2 2.97Å
1803	G	30.4	Very low	27.9	Very low	46 Å²	46	133.4 Å²	133.4	47%	0.474	72%	0.721	S	S	.	*			trans	-60.7	-137.9	163.8	0	0	0	0	0	117.5
1804	R	28.5	Very low	27.9	Very low	244 Å²	244	132.6 Å²	132.6	92%	0.921	72%	0.716	S	S	*	*			trans	-149.3	155.2	165.8	-102.3	-166.9	179	-161	0.1	112.7
1805	P	33.2	Very low	27.9	Very low	113 Å²	113	131.1 Å²	131.1	73%	0.734	71%	0.708	S	S	*	*			trans	-105.3	178.2	-170.4	41.6	-36.7	0	0	0	113.9
1806	Y	27	Very low	27.6	Very low	220 Å²	220	132.2 Å²	132.2	86%	0.863	71%	0.709	S	S	*	*			trans	-136.9	144.2	159.3	-102.7	-80.4	0	0	0	113.8
1807	S	29.2	Very low	28	Very low	114 Å²	114	132.4 Å²	132.4	80%	0.797	71%	0.709	S	S	*	*			trans	68.5	139	155.2	-63.3	0	0	0	0	121.4
1808	K	26.3	Very low	27.9	Very low	195 Å²	195	132 Å²	132	85%	0.848	70%	0.702	S	S	*	*			trans	-96.9	175.2	-172.3	-61.4	170.4	172.9	176.6	0	112.4
1809	S	22.7	Very low	27.8	Very low	107 Å²	107	136.4 Å²	136.4	75%	0.748	71%	0.705	S	S	*	*			trans	69.9	132.5	152.3	52.2	0	0	0	0	116.5
1810	N	27.4	Very low	27.5	Very low	135 Å²	135	138.6 Å²	138.6	72%	0.722	70%	0.701	S	S	*	*				-153.5	155.1	56.4	-121.1	-22.4	0	0	0	116.1
1811	R	28.9	Very low	27.4	Very low	204 Å²	204	140.5 Å²	140.5	77%	0.77	71%	0.709	S	S	*	*			trans	65	119.7	144.2	-70	-174	176.7	-173.4	-3.6	122.6
1812	H	27.3	Very low	27.2	Very low	152 Å²	152	146 Å²	146	70%	0.704	73%	0.733	S	S	*	*				52.2	131.5	118.4	-73.2	-62.4	0	0	0	122.3
1813	N	25.3	Very low	27	Very low	125 Å²	125	149.9 Å²	149.9	67%	0.668	75%	0.75	S	S	*	*			trans	63.7	153.5	130.1	-56.4	24.1	0	0	0	118
1814	T	30.1	Very low	27	Very low	116 Å²	116	152.7 Å²	152.7	71%	0.712	76%	0.76	S	S	*	*			cis	-141.5	135.3	7.5	-22	0	0	0	0	110.5
1815	D	26.2	Very low	26.9	Very low	127 Å²	127	143.5 Å²	143.5	68%	0.679	74%	0.741	S	S	*	*			trans	4.6	148.1	147.3	-53.3	-71.3	0	0	0	123.2
1816	Q	22.2	Very low	26.6	Very low	182 Å²	182	147.3 Å²	147.3	85%	0.85	74%	0.741	S	S	*	*			trans	84	156.5	138.1	-83.9	-164.9	-43.5	0	0	121
1817	P	33.4	Very low	26.5	Very low	95 Å²	95	144.3 Å²	144.3	62%	0.617	73%	0.734	S	S	*	*			trans	-135.3	-128.1	-138.6	39.9	-15.4	0	0	0	111.6
1818	D	24.3	Very low	26.3	Very low	125 Å²	125	144.4 Å²	144.4	67%	0.668	73%	0.726	S	S	*	*			trans	69.3	150.2	169.9	-56.6	-32.4	0	0	0	114.9
1819	Y	23.7	Very low	26.4	Very low	191 Å²	191	138.4 Å²	138.4	75%	0.749	71%	0.713	S	S	*	*			cis	-147.3	-163.5	-4.7	-136.2	-142.7	0	0	0	110.1
1820	W	21.8	Very low	26.4	Very low	197 Å²	197	139.5 Å²	139.5	75%	0.746	71%	0.705	S	S	*	*			trans	-45.6	153.8	170	-56.9	52.8	0	0	0	112.6
1821	T	28	Very low	26.2	Very low	138 Å²	138	137.3 Å²	137.3	85%	0.847	69%	0.692	S	S	*	*				-160.3	-175.8	69.5	36	0	0	0	0	114.7
1822	L	24.1	Very low	26	Very low	155 Å²	155	133.5 Å²	133.5	81%	0.812	69%	0.687	S	S	*	*			trans	-84.4	156.8	-177.4	-85.5	68.2	0	0	0	114.6
1823	M	28.3	Very low	26.1	Very low	166 Å²	166	129 Å²	129	82%	0.818	67%	0.673	S	S	*	*			trans	-32.8	151.8	152	-59.9	-164.3	74.7	0	0	115.2
1824	P	29	Very low	26.1	Very low	106 Å²	106	128 Å²	128	69%	0.688	67%	0.667	S	S	*	*				-137.9	175.4	60.8	38	-20.3	0	0	0	115.4
1825	G	26.9	Very low	25.8	Very low	50 Å²	50	128.9 Å²	128.9	52%	0.515	66%	0.657	S	S	.	*			cis	142.7	138.3	-10.4	0	0	0	0	0	114.2
1826	R	26.9	Very low	25.9	Very low	194 Å²	194	131.4 Å²	131.4	73%	0.732	67%	0.665	S	S	*	*			trans	-125.6	121.8	155.2	-89.5	-169.5	-178.3	-118.5	7	109.4	N1075	N1075-R1826 PolarHBondContact O-NE 2.83Å; N1075-R1826 PolarHBondContact O-NH2 3.35Å
1827	Q	24.8	Very low	26.3	Very low	156 Å²	156	127.8 Å²	127.8	73%	0.729	66%	0.657	S	S	*	*			trans	-112.2	168	177.4	-62.7	159.5	-112.7	0	0	109.1
1828	D	25.2	Very low	25.9	Very low	116 Å²	116	131.8 Å²	131.8	62%	0.62	67%	0.665	S	S	*	*			trans	66.8	152.1	150.4	-72.8	-49.2	0	0	0	117.7	R1050	R1050-D1828 IonicContact NH2-OD1 3.19Å
1829	A	27.2	Very low	26	Very low	70 Å²	70	135 Å²	135	58%	0.579	68%	0.676	S	S	*	*			cis	-162.7	153.9	-15	0	0	0	0	0	112.7
1830	F	23	Very low	26.3	Very low	130 Å²	130	132.2 Å²	132.2	57%	0.57	67%	0.672	S	S	*	*				60.7	154.9	129.4	-76.2	-135.7	0	0	0	120.1	R1050	R1050-F1830 VanDerWaalsContact NH1-CZ 3.33Å
1831	L	24.8	Very low	26.7	Very low	89 Å²	89	127.7 Å²	127.7	47%	0.466	67%	0.668	S	S	.	*			cis	-158.6	-166.4	-24.7	-118.1	-167.9	0	0	0	109.3
1832	N	23.6	Very low	26.6	Very low	124 Å²	124	124.3 Å²	124.3	66%	0.663	65%	0.645	S	S	*	*			trans	78.1	151.9	167.1	-57.6	-23.2	0	0	0	116.1
1833	S	29.1	Very low	27.3	Very low	58 Å²	58	122.6 Å²	122.6	41%	0.406	63%	0.631	S	S	.	*			cis	-143.2	173.9	3	-145.1	0	0	0	0	114.2
1834	L	25.5	Very low	27.4	Very low	102 Å²	102	119 Å²	119	53%	0.534	62%	0.62	S	S	.	*			trans	-93.5	-178.5	-174	-89.8	164.5	0	0	0	114.4
1835	R	24.1	Very low	27.5	Very low	136 Å²	136	115.4 Å²	115.4	51%	0.513	60%	0.603	S	S	.	*			trans	83.9	153.9	173.5	-49.9	-165.8	179.1	-166.8	-3.8	115.1	N1063 T1064	N1063-R1835 PolarHBondContact ND2-NH2 3.45Å; N1063-R1835 PolarHBondContact OD1-NH2 2.86Å; T1064-R1835 HydrophobicContact CG2-CG 4.48Å; T1064-R1835 VanDerWaalsContact CG2-CZ 3.41Å; T1064-R1835 VanDerWaalsContact CG2-NE 3.3Å
1836	Q	28.5	Very low	27.8	Very low	180 Å²	180	114 Å²	114	84%	0.841	59%	0.588	S	S	*	*			cis	-133.5	179.8	11.7	-99.8	-142.5	48.9	0	0	113.4
1837	P	31.4	Very low	28.3	Very low	105 Å²	105	110.4 Å²	110.4	68%	0.682	58%	0.582	S	S	*	*			trans	-113	-160.9	-156.8	44.2	-36.5	0	0	0	118.5
1838	F	23.6	Very low	28.8	Very low	179 Å²	179	106.9 Å²	106.9	79%	0.785	57%	0.573	S	S	*	*			trans	-57.2	154.7	-168.6	-56.5	-95.2	0	0	0	119.8
1839	H	27.6	Very low	29.1	Very low	194 Å²	194	107 Å²	107	90%	0.898	57%	0.574	S	S	*	*				-169.6	160.3	123.2	-113.6	-97.9	0	0	0	111.2
1840	I	28.9	Very low	29.1	Very low	132 Å²	132	113 Å²	113	68%	0.677	59%	0.587	S	S	*	*			trans	-145	125.5	-161.1	-51.8	175.2	0	0	0	116.5
1841	P	30.4	Very low	29.4	Very low	102 Å²	102	109.8 Å²	109.8	66%	0.662	59%	0.59	S	S	*	*			trans	-114.9	164.9	143.9	0.4	21.9	0	0	0	112.3
1842	L	26	Very low	29.6	Very low	66 Å²	66	111.3 Å²	111.3	35%	0.346	61%	0.608	S	S	.	*			cis	121.2	177.4	2	-61.8	162.5	0	0	0	114.1	R1882 P1884	L1842-R1882 HydrophobicContact CB-CB 4.49Å; L1842-R1882 HydrophobicContact CD2-CB 4.27Å; L1842-R1882 HydrophobicContact CD2-CG 4.39Å; L1842-P1884 VanDerWaalsContact CD1-CD 3.42Å
1843	F	39.8	Very low	29.9	Very low	120 Å²	120	110.4 Å²	110.4	53%	0.526	61%	0.612	S	S	.	*			trans	-145	172.1	179.1	-43.8	-56.9	0	0	0	110	R1882	F1843-R1882 HydrophobicContact CB-CB 3.87Å; F1843-R1882 HydrophobicContact CB-CG 4.22Å; F1843-R1882 HydrophobicContact CD2-CB 4.23Å; F1843-R1882 HydrophobicContact CD2-CG 3.64Å; F1843-R1882 HydrophobicContact CE2-CG 4.42Å; F1843-R1882 HydrophobicContact CG-CB 4.33Å; F1843-R1882 HydrophobicContact CG-CG 4.14Å; F1843-R1882 VanDerWaalsContact CZ-CZ 3.46Å; F1843-R1882 VanDerWaalsContact CZ-NH1 3.3Å; F1843-R1882 VanDerWaalsContact N-CB 3.33Å; F1843-R1882 CarbonylContact O-C 3.6Å; F1843-R1882 WeakPolarHBondContact O-CB 3.4Å
1844	P	30.2	Very low	29.8	Very low	89 Å²	89	113.8 Å²	113.8	58%	0.578	63%	0.63	S	S	*	*				-137.4	169.7	85.1	38.9	-25.6	0	0	0	115.7	P1881	P1844-P1881 WeakPolarHBondContact CA-O 3.5Å
1845	G	30.6	Very low	30.1	Very low	32 Å²	32	113.9 Å²	113.9	33%	0.33	65%	0.646	S	S	.	*			trans	-95.9	-148.9	172.9	0	0	0	0	0	114.5	F1879 Y1880	G1845-F1879 WeakPolarHBondContact O-CD1 3.25Å; G1845-F1879 WeakPolarHBondContact O-CE1 3.31Å; G1845-Y1880 VanDerWaalsContact C-CB 3.4Å; G1845-Y1880 VanDerWaalsContact C-CG 3.43Å; G1845-Y1880 VanDerWaalsContact N-CB 3.33Å; G1845-Y1880 WeakPolarHBondContact O-CB 3.35Å
1846	G	32.9	Very low	30.4	Very low	21 Å²	21	110.5 Å²	110.5	22%	0.216	65%	0.654	C	S	.	*			trans	-154.2	-110.8	-167.8	0	0	0	0	0	117.7	Y1880	G1846-Y1880 WeakPolarHBondContact O-CD2 3.41Å; G1846-Y1880 WeakPolarHBondContact O-CE2 3.26Å
1847	I	38.5	Very low	30.3	Very low	118 Å²	118	106.4 Å²	106.4	61%	0.605	65%	0.651	S	S	*	*			trans	64.6	130.3	-174.5	-53.9	-178.5	0	0	0	113.9	F1878 Y1880	I1847-F1878 VanDerWaalsContact C-CD1 3.49Å; I1847-F1878 VanDerWaalsContact C-CE1 3.45Å; I1847-F1878 WeakPolarHBondContact O-CD1 3.29Å; I1847-F1878 VanDerWaalsContact O-CG 3.25Å; I1847-F1878 WeakPolarHBondContact O-CG 3.3Å; I1847-Y1880 HydrophobicContact CB-CE2 4.48Å; I1847-Y1880 HydrophobicContact CD1-CE2 4.42Å; I1847-Y1880 VanDerWaalsContact CD1-OH 3.24Å; I1847-Y1880 WeakPolarHBondContact CD1-OH 3.12Å; I1847-Y1880 HydrophobicContact CG1-CE2 4.32Å
1848	P	35.1	Very low	30.9	Very low	81 Å²	81	106.9 Å²	106.9	53%	0.526	65%	0.654	S	S	.	*			cis	-126.2	-154.9	23.1	20	6.9	0	0	0	113.8	F1878	P1848-F1878 VanDerWaalsContact CD-CZ 3.43Å; P1848-F1878 WeakPolarHBondContact O-CZ 3.33Å
1849	N	30.6	Very low	31.2	Very low	120 Å²	120	104 Å²	104	64%	0.642	65%	0.646	S	S	*	*				-168.8	149.8	-62.8	-163.1	5.1	0	0	0	110
1850	F	27.3	Very low	31.4	Very low	194 Å²	194	104.4 Å²	104.4	85%	0.851	64%	0.641	S	S	*	*			trans	62.6	151.2	176.9	-62	-74	0	0	0	119.3
1851	G	28.6	Very low	31.5	Very low	63 Å²	63	102.7 Å²	102.7	65%	0.649	64%	0.641	S	S	*	*			cis	173.7	-168.6	-3.7	0	0	0	0	0	114.3
1852	S	29.2	Very low	31.5	Very low	121 Å²	121	103.6 Å²	103.6	85%	0.846	65%	0.645	S	S	*	*			trans	72.2	142.5	-175.3	-111	0	0	0	0	115.4
1853	S	29.4	Very low	31.9	Very low	106 Å²	106	105.4 Å²	105.4	74%	0.741	66%	0.661	S	S	*	*			cis	-169.7	171.8	3.3	34.6	0	0	0	0	110
1854	T	27.3	Very low	31.5	Very low	128 Å²	128	107.7 Å²	107.7	79%	0.785	68%	0.675	S	S	*	*			cis	-172.7	156.6	-28	-78.5	0	0	0	0	108.7
1855	A	32.7	Very low	31.4	Very low	105 Å²	105	110.4 Å²	110.4	87%	0.868	68%	0.684	S	S	*	*			trans	79.5	143.5	171.3	0	0	0	0	0	118
1856	G	29.5	Very low	31.8	Very low	65 Å²	65	114.6 Å²	114.6	67%	0.67	71%	0.705	S	S	*	*			cis	-154.2	149.6	-5.8	0	0	0	0	0	110.1
1857	A	27.6	Very low	31.7	Very low	94 Å²	94	119.7 Å²	119.7	78%	0.777	73%	0.728	S	S	*	*				65.3	148.6	77.6	0	0	0	0	0	112.7
1858	P	42.5	Very low	31.1	Very low	115 Å²	115	124.7 Å²	124.7	75%	0.747	74%	0.739	S	S	*	*			cis	-78.7	-175.4	13.4	-7.7	27.3	0	0	0	113
1859	N	30.9	Very low	30.8	Very low	118 Å²	118	125.8 Å²	125.8	63%	0.631	75%	0.748	S	S	*	*			cis	-167.8	170.7	-22.7	-105.7	-3.6	0	0	0	105.8
1860	Y	30.7	Very low	30.7	Very low	202 Å²	202	127.3 Å²	127.3	79%	0.792	76%	0.756	S	S	*	*			cis	-151	172.5	0.1	-112	-31.4	0	0	0	105.6
1861	S	31	Very low	30.8	Very low	96 Å²	96	122.7 Å²	122.7	67%	0.671	75%	0.747	S	S	*	*			cis	-144.4	-161.1	6.6	-157.9	0	0	0	0	110.5
1862	T	30.4	Very low	30.8	Very low	121 Å²	121	125 Å²	125	74%	0.742	75%	0.749	S	S	*	*			trans	-143.2	-170.2	-174	65.1	0	0	0	0	109.9
1863	P	35	Very low	30.7	Very low	105 Å²	105	125.6 Å²	125.6	68%	0.682	74%	0.743	S	S	*	*			cis	-135.1	175.3	-9.8	39.7	-23	0	0	0	115.6
1864	M	31.9	Very low	30.8	Very low	168 Å²	168	127.7 Å²	127.7	83%	0.828	75%	0.745	S	S	*	*				176.4	167.8	127.4	-87.5	-91.7	75.3	0	0	111.8
1865	L	28.5	Very low	30.8	Very low	145 Å²	145	125.5 Å²	125.5	76%	0.759	74%	0.739	S	S	*	*			trans	-116.5	178.1	-164.7	-79.3	154.5	0	0	0	111.5
1866	P	39.1	Very low	30.5	Very low	121 Å²	121	129.4 Å²	129.4	79%	0.786	74%	0.74	S	S	*	*			cis	-144.7	-169	20.2	44.9	-23.6	0	0	0	119.4
1867	D	29.4	Very low	30.5	Very low	128 Å²	128	131.6 Å²	131.6	68%	0.684	74%	0.742	S	S	*	*			trans	-41.2	149.4	-172.8	-75.1	-88	0	0	0	127.1
1868	R	27.3	Very low	30.4	Very low	223 Å²	223	131.8 Å²	131.8	84%	0.842	73%	0.726	S	S	*	*			trans	45.7	125.4	133	-63.2	173	164.6	-159.8	-4.7	123.1
1869	S	28.7	Very low	29.5	Very low	103 Å²	103	134 Å²	134	72%	0.72	72%	0.724	S	S	*	*				162.6	149.1	91.4	54.1	0	0	0	0	115.4
1870	N	28.7	Very low	29.3	Very low	152 Å²	152	134.2 Å²	134.2	81%	0.813	72%	0.717	S	S	*	*			trans	56.8	148.9	156.2	-65.7	-13.6	0	0	0	120.6
1871	C	27.8	Very low	29.5	Very low	97 Å²	97	128.6 Å²	128.6	66%	0.655	71%	0.705	S	S	*	*			cis	-159	151.8	-5.5	-120.1	0	0	0	0	111.9
1872	T	28.4	Very low	29.2	Very low	113 Å²	113	130.7 Å²	130.7	69%	0.693	70%	0.698	S	S	*	*			trans	30.2	136.1	147.4	63.1	0	0	0	0	120.8
1873	N	29.1	Very low	29	Very low	133 Å²	133	134 Å²	134	71%	0.711	70%	0.699	S	S	*	*				173	159.6	54.3	-127.3	-18.8	0	0	0	113.6
1874	L	29.6	Very low	29.1	Very low	150 Å²	150	133.3 Å²	133.3	79%	0.785	69%	0.694	S	S	*	*			trans	56.8	111.7	145.9	-69.8	161.4	0	0	0	124.9
1875	A	29	Very low	28.8	Very low	81 Å²	81	132.9 Å²	132.9	67%	0.669	69%	0.694	S	S	*	*				75.2	111.3	121.1	0	0	0	0	0	124.5
1876	Q	25.5	Very low	28.7	Very low	187 Å²	187	132.8 Å²	132.8	87%	0.874	69%	0.693	S	S	*	*				56	155.3	127.9	-69.3	-169.5	2.1	0	0	123
1877	P	30.1	Very low	28.2	Very low	111 Å²	111	133.5 Å²	133.5	72%	0.721	69%	0.69	S	S	*	*			cis	-132.7	-175.9	-24.3	36	-16.9	0	0	0	114.2
1878	F	24.5	Very low	28	Very low	98 Å²	98	137.2 Å²	137.2	43%	0.43	70%	0.695	S	S	.	*			trans	-89.1	166.6	-180	-35	-178.2	0	0	0	112.1	I1847 P1848	I1847-F1878 VanDerWaalsContact C-CD1 3.49Å; I1847-F1878 VanDerWaalsContact C-CE1 3.45Å; I1847-F1878 WeakPolarHBondContact O-CD1 3.29Å; I1847-F1878 VanDerWaalsContact O-CG 3.25Å; I1847-F1878 WeakPolarHBondContact O-CG 3.3Å; P1848-F1878 VanDerWaalsContact CD-CZ 3.43Å; P1848-F1878 WeakPolarHBondContact O-CZ 3.33Å
1879	F	24.9	Very low	27.9	Very low	163 Å²	163	134.3 Å²	134.3	72%	0.715	69%	0.69	S	S	*	*				178	-177	102.3	-103.6	-73.2	0	0	0	114.1	G1845	G1845-F1879 WeakPolarHBondContact O-CD1 3.25Å; G1845-F1879 WeakPolarHBondContact O-CE1 3.31Å
1880	Y	24.9	Very low	27.8	Very low	122 Å²	122	132.4 Å²	132.4	48%	0.478	69%	0.687	S	S	.	*			trans	-123.6	179.5	-158.8	-112.3	-124.7	0	0	0	112.8	G1845 G1846 I1847	G1845-Y1880 VanDerWaalsContact C-CB 3.4Å; G1845-Y1880 VanDerWaalsContact C-CG 3.43Å; G1845-Y1880 VanDerWaalsContact N-CB 3.33Å; G1845-Y1880 WeakPolarHBondContact O-CB 3.35Å; G1846-Y1880 WeakPolarHBondContact O-CD2 3.41Å; G1846-Y1880 WeakPolarHBondContact O-CE2 3.26Å; I1847-Y1880 HydrophobicContact CB-CE2 4.48Å; I1847-Y1880 HydrophobicContact CD1-CE2 4.42Å; I1847-Y1880 VanDerWaalsContact CD1-OH 3.24Å; I1847-Y1880 WeakPolarHBondContact CD1-OH 3.12Å; I1847-Y1880 HydrophobicContact CG1-CE2 4.32Å
1881	P	35.8	Very low	27.7	Very low	84 Å²	84	133.6 Å²	133.6	55%	0.545	69%	0.691	S	S	.	*			trans	-101.9	161.2	-168.1	38.2	-34.8	0	0	0	117.7	P1844	P1844-P1881 WeakPolarHBondContact CA-O 3.5Å
1882	R	24.2	Very low	27.8	Very low	140 Å²	140	133 Å²	133	53%	0.528	69%	0.693	S	S	.	*			trans	105.6	165.9	179.5	-71.1	-163.8	-175.2	166.3	-6.9	115.1	L1842 F1843	L1842-R1882 HydrophobicContact CB-CB 4.49Å; L1842-R1882 HydrophobicContact CD2-CB 4.27Å; L1842-R1882 HydrophobicContact CD2-CG 4.39Å; F1843-R1882 HydrophobicContact CB-CB 3.87Å; F1843-R1882 HydrophobicContact CB-CG 4.22Å; F1843-R1882 HydrophobicContact CD2-CB 4.23Å; F1843-R1882 HydrophobicContact CD2-CG 3.64Å; F1843-R1882 HydrophobicContact CE2-CG 4.42Å; F1843-R1882 HydrophobicContact CG-CB 4.33Å; F1843-R1882 HydrophobicContact CG-CG 4.14Å; F1843-R1882 VanDerWaalsContact CZ-CZ 3.46Å; F1843-R1882 VanDerWaalsContact CZ-NH1 3.3Å; F1843-R1882 VanDerWaalsContact N-CB 3.33Å; F1843-R1882 CarbonylContact O-C 3.6Å; F1843-R1882 WeakPolarHBondContact O-CB 3.4Å
1883	Y	26.8	Very low	27.8	Very low	191 Å²	191	135.1 Å²	135.1	75%	0.749	70%	0.7	S	S	*	*			trans	-105.6	-154.6	-165.7	-56.1	-138.1	0	0	0	112.9
1884	P	37.4	Very low	27.7	Very low	89 Å²	89	133.4 Å²	133.4	58%	0.578	70%	0.698	S	S	*	*				-129.4	177.5	-112.7	42.5	-22.4	0	0	0	115.4	L1842	L1842-P1884 VanDerWaalsContact CD1-CD 3.42Å
1885	L	24.8	Very low	27.7	Very low	159 Å²	159	135.2 Å²	135.2	83%	0.832	70%	0.7	S	S	*	*			trans	-169.7	167.4	136.5	-104.7	164.3	0	0	0	108.7
1886	I	27.3	Very low	27.7	Very low	144 Å²	144	141.8 Å²	141.8	74%	0.738	71%	0.709	S	S	*	*			trans	-128.1	148.4	-178.8	-78	178.5	0	0	0	110.3
1887	N	27.3	Very low	27.9	Very low	135 Å²	135	138 Å²	138	72%	0.722	70%	0.703	S	S	*	*			trans	71.1	144.5	-176.4	-64.6	-18.5	0	0	0	115.3
1888	W	25.8	Very low	28	Very low	207 Å²	207	136.2 Å²	136.2	78%	0.784	71%	0.705	S	S	*	*			cis	-132.8	178	10.8	-118.8	-36.9	0	0	0	113.9
1889	H	25.9	Very low	28.3	Very low	161 Å²	161	140.2 Å²	140.2	75%	0.745	73%	0.725	S	S	*	*			trans	-10.8	141.8	175.3	-45.9	114.9	0	0	0	119.4
1890	G	26.4	Very low	28.6	Very low	63 Å²	63	137.5 Å²	137.5	65%	0.649	72%	0.722	S	S	*	*			cis	138.3	165.3	1	0	0	0	0	0	112.4
1891	I	26.8	Very low	28.8	Very low	178 Å²	178	139.2 Å²	139.2	91%	0.913	74%	0.736	S	S	*	*			trans	70.5	143.6	167.6	-58.6	167.8	0	0	0	113.8
1892	A	30.3	Very low	28.4	Very low	83 Å²	83	141 Å²	141	69%	0.686	75%	0.746	S	S	*	*			cis	-132.2	171.4	0.4	0	0	0	0	0	111.4
1893	N	28	Very low	28.7	Very low	158 Å²	158	139.3 Å²	139.3	85%	0.845	76%	0.756	S	S	*	*			trans	-115.9	83.9	154.4	-142.6	-11.4	0	0	0	110.8
1894	S	27.4	Very low	28.8	Very low	97 Å²	97	137.7 Å²	137.7	68%	0.678	76%	0.76	S	S	*	*			trans	40.2	113.5	140.4	-51.4	0	0	0	0	120.4
1895	K	28.4	Very low	29	Very low	189 Å²	189	138.2 Å²	138.2	82%	0.822	76%	0.763	S	S	*	*			trans	-157.7	130.2	142.4	-119.7	171	-173.5	178.2	0	112.3
1896	Y	30.3	Very low	29.2	Very low	219 Å²	219	136.8 Å²	136.8	86%	0.859	76%	0.761	S	S	*	*			trans	64.8	153.8	179.7	-61.3	-91.3	0	0	0	117.1
1897	S	29.8	Very low	29.3	Very low	106 Å²	106	135 Å²	135	74%	0.741	76%	0.757	S	S	*	*			cis	-172.3	98.2	-30.4	172.8	0	0	0	0	111.9
1898	G	32.1	Very low	29.5	Very low	75 Å²	75	134.2 Å²	134.2	77%	0.773	76%	0.758	S	S	*	*			trans	67	-179.4	171.4	0	0	0	0	0	115.5
1899	Q	31	Very low	29.6	Very low	182 Å²	182	135 Å²	135	85%	0.85	76%	0.761	S	S	*	*			cis	-157.7	133.2	-15.6	-146.5	-176.1	77.5	0	0	110.4
1900	T	29.1	Very low	30.3	Very low	106 Å²	106	132.6 Å²	132.6	65%	0.65	76%	0.759	S	S	*	*			trans	59.4	136.6	149.9	33.7	0	0	0	0	124.5
1901	M	29.5	Very low	30.3	Very low	157 Å²	157	135.1 Å²	135.1	77%	0.773	76%	0.761	S	S	*	*			trans	83.3	114.6	139.5	-68.2	-66.7	179.2	0	0	122.6
1902	T	28.2	Very low	30.7	Very low	121 Å²	121	137.7 Å²	137.7	74%	0.742	76%	0.76	S	S	*	*				39.3	147.6	124.5	58.6	0	0	0	0	121.9
1903	S	30.7	Very low	30.6	Very low	105 Å²	105	140.9 Å²	140.9	73%	0.734	76%	0.764	S	S	*	*			cis	-173	149.1	9.1	41.4	0	0	0	0	112.9
1904	D	29.2	Very low	30.6	Very low	158 Å²	158	136.9 Å²	136.9	85%	0.845	76%	0.76	S	S	*	*			trans	38.6	164.4	131.3	-99.4	20.6	0	0	0	124.3
1905	P	41.7	Very low	31.2	Very low	99 Å²	99	137.7 Å²	137.7	64%	0.643	76%	0.763	S	S	*	*				-133.9	-153.8	-125.7	40.1	-18.3	0	0	0	116.8
1906	T	29.2	Very low	31.7	Very low	129 Å²	129	133.4 Å²	133.4	79%	0.791	75%	0.754	S	S	*	*			trans	90.4	152.5	168.6	74.5	0	0	0	0	118.8
1907	T	29.5	Very low	31.5	Very low	107 Å²	107	128.5 Å²	128.5	66%	0.656	75%	0.747	S	S	*	*			cis	-171.9	140.3	-22.9	-88.6	0	0	0	0	112.2
1908	T	29.8	Very low	31.2	Very low	119 Å²	119	130 Å²	130	73%	0.73	75%	0.746	S	S	*	*			trans	63.9	161.2	163.8	61.3	0	0	0	0	119.4
1909	R	28.5	Very low	31	Very low	224 Å²	224	137 Å²	137	85%	0.845	75%	0.751	S	S	*	*			cis	-173.4	-175.3	-13.9	-104.7	178.3	-178.1	-157.3	3.2	107.6
1910	P	39.9	Very low	30.9	Very low	110 Å²	110	131.4 Å²	131.4	71%	0.714	74%	0.743	S	S	*	*				-134.2	-153.7	-53.8	39	-18.1	0	0	0	113.2
1911	V	27.9	Very low	31.1	Very low	115 Å²	115	132.2 Å²	132.2	70%	0.697	75%	0.751	S	S	*	*			trans	91.7	101.1	161.3	-163.2	0	0	0	0	120.7	I1913	V1911-I1913 HydrophobicContact CG1-CD1 4.07Å
1912	R	34.7	Very low	30.7	Very low	232 Å²	232	134.4 Å²	134.4	88%	0.875	75%	0.751	S	S	*	*				-175.9	133.4	113.6	-90.8	-168.9	-175.1	-147.6	-0.7	107.1
1913	I	28.2	Very low	30.9	Very low	150 Å²	150	133.4 Å²	133.4	77%	0.769	75%	0.747	S	S	*	*				74.8	108.7	55	-59.8	168.2	0	0	0	112.5	V1911	V1911-I1913 HydrophobicContact CG1-CD1 4.07Å
1914	G	27.8	Very low	30.7	Very low	74 Å²	74	139.4 Å²	139.4	76%	0.763	75%	0.753	S	S	*	*			trans	160.8	61.6	165.5	0	0	0	0	0	117.7
1915	P	40.1	Very low	30.5	Very low	115 Å²	115	135 Å²	135	75%	0.747	75%	0.745	S	S	*	*			trans	-107.7	-144.3	170.6	38.2	-18	0	0	0	108.9
1916	P	38.7	Very low	29.7	Very low	98 Å²	98	141 Å²	141	64%	0.636	76%	0.755	S	S	*	*			cis	-138.3	-154	-11.3	23.1	6.4	0	0	0	113.7
1917	T	25.3	Very low	29.5	Very low	117 Å²	117	143.5 Å²	143.5	72%	0.718	76%	0.755	S	S	*	*			trans	81.7	150.6	147.8	62.6	0	0	0	0	121.5
1918	L	25	Very low	29.3	Very low	136 Å²	136	142.1 Å²	142.1	71%	0.712	75%	0.75	S	S	*	*			cis	-168.8	172.4	-11.4	-111	168.4	0	0	0	112.5
1919	Y	27.4	Very low	29.1	Very low	222 Å²	222	140.3 Å²	140.3	87%	0.871	74%	0.735	S	S	*	*			trans	104.8	145.4	157	-71	-80.1	0	0	0	120.4
1920	G	29.8	Very low	29	Very low	66 Å²	66	133.3 Å²	133.3	68%	0.68	72%	0.718	S	S	*	*			trans	96.7	114.9	-172.2	0	0	0	0	0	112
1921	C	32.4	Very low	28.5	Very low	123 Å²	123	131.5 Å²	131.5	83%	0.831	70%	0.701	S	S	*	*				73	126.7	64.6	-71	0	0	0	0	112.8
1922	W	21.9	Very low	28.6	Very low	203 Å²	203	132.3 Å²	132.3	77%	0.769	70%	0.701	S	S	*	*			cis	61.4	129.9	1.1	-85.7	45.7	0	0	0	117	E1153	E1153-W1922 PolarHBondContact OE1-N 2.88Å
1923	P	31.8	Very low	28.3	Very low	100 Å²	100	127.7 Å²	127.7	65%	0.649	69%	0.694	S	S	*	*				-146.4	162.7	52	42.7	-25.8	0	0	0	118.9
1924	R	25.6	Very low	28.4	Very low	230 Å²	230	129.2 Å²	129.2	87%	0.868	70%	0.695	S	S	*	*			trans	70.5	84.8	161.4	-61.9	167	169.9	166.5	-3.8	117.3
1925	G	25.6	Very low	28.7	Very low	65 Å²	65	133.2 Å²	133.2	67%	0.67	69%	0.694	S	S	*	*			trans	-71.5	176.6	158.9	0	0	0	0	0	114.8
1926	R	24.2	Very low	28.2	Very low	227 Å²	227	134 Å²	134	86%	0.857	69%	0.691	S	S	*	*			trans	-149.7	129.5	163	-91.6	-160	178.7	-158.8	4	110.4
1927	F	25.9	Very low	27.9	Very low	181 Å²	181	136.5 Å²	136.5	79%	0.794	70%	0.698	S	S	*	*			trans	41.5	106.4	147.2	-65.3	-94.3	0	0	0	120.9
1928	S	24.8	Very low	28.1	Very low	78 Å²	78	139.1 Å²	139.1	55%	0.545	70%	0.702	S	S	.	*			trans	71.8	156.7	131.9	-55.7	0	0	0	0	122	H661	H661-S1928 WeakPolarHBondContact NE2-CA 3.24Å; H661-S1928 WeakPolarHBondContact NE2-CB 3.07Å
1929	D	25.4	Very low	28.4	Very low	81 Å²	81	138.8 Å²	138.8	43%	0.433	70%	0.7	S	S	.	*			trans	81.1	134.2	-177.7	-103.1	120.8	0	0	0	117.3	H661 D1156 Q1157	H661-D1929 PolarHBondContact NE2-N 3.02Å; D1156-D1929 WeakPolarHBondContact CA-O 3.42Å; D1156-D1929 PolarHBondContact N-O 3.17Å; D1156-D1929 VanDerWaalsContact N-O 3.1Å; Q1157-D1929 WeakPolarHBondContact O-CA 3.24Å; Q1157-D1929 PolarHBondContact O-N 2.9Å
1930	T	27.3	Very low	28.3	Very low	77 Å²	77	134 Å²	134	47%	0.472	69%	0.689	S	S	.	*			cis	-139.6	-175.7	1	-46.8	0	0	0	0	111	Q1157 E1159	Q1157-T1930 VanDerWaalsContact N-C 3.27Å; Q1157-T1930 PolarHBondContact N-O 2.91Å; E1159-T1930 HydrophobicContact CG-CG2 4.24Å
1931	I	30	Very low	28.1	Very low	71 Å²	71	136.9 Å²	136.9	36%	0.364	69%	0.685	S	S	.	*			trans	-117.1	163.7	-166.8	-130.5	-164.3	0	0	0	117.4	Q1157 E1158	Q1157-I1931 HydrophobicContact CB-CG1 4.29Å; Q1157-I1931 HydrophobicContact CG-CG1 3.91Å; Q1157-I1931 VanDerWaalsContact NE2-CG1 3.35Å; E1158-I1931 HydrophobicContact CG-CB 4.04Å; E1158-I1931 HydrophobicContact CG-CD1 3.84Å; E1158-I1931 HydrophobicContact CG-CG1 4.28Å; E1158-I1931 HydrophobicContact CG-CG2 4.08Å
1932	D	28.2	Very low	27.7	Very low	132 Å²	132	133.1 Å²	133.1	71%	0.706	66%	0.66	S	S	*	*			trans	64.3	107	160.6	-81.7	8.3	0	0	0	124.5
1933	D	28.5	Very low	27.8	Very low	135 Å²	135	128.9 Å²	128.9	72%	0.722	66%	0.66	S	S	*	*				61.7	72.3	109.2	-131.1	42	0	0	0	120.6
1934	K	31.1	Very low	27.4	Very low	182 Å²	182	129 Å²	129	79%	0.791	66%	0.663	S	S	*	*				-166.4	126.7	107.7	-109.5	161.2	-168.7	148.6	0	118
1935	H	33.5	Very low	27.5	Very low	158 Å²	158	126.9 Å²	126.9	73%	0.731	66%	0.663	S	S	*	*			trans	17.3	97.2	152.6	-77.4	-50.1	0	0	0	120
1936	N	30.2	Very low	27.5	Very low	131 Å²	131	128.5 Å²	128.5	70%	0.701	67%	0.665	S	S	*	*				57.3	83.2	105.8	-56.8	21.8	0	0	0	117.1
1937	I	31.3	Very low	27.5	Very low	152 Å²	152	123 Å²	123	78%	0.779	66%	0.656	S	S	*	*				-5	129.8	104.5	-59	165.7	0	0	0	114.5
1938	E	30.4	Very low	27.4	Very low	171 Å²	171	123.4 Å²	123.4	80%	0.799	65%	0.653	S	S	*	*			trans	-137.9	120.3	147.5	-102.6	-166.3	145.8	0	0	109.7
1939	I	31.2	Very low	27.8	Very low	129 Å²	129	126.8 Å²	126.8	66%	0.662	66%	0.658	S	S	*	*			trans	70.5	92	142.8	-51.4	168.8	0	0	0	118.4
1940	D	24.9	Very low	28.2	Very low	122 Å²	122	127.7 Å²	127.7	65%	0.652	67%	0.668	S	S	*	*				41	126.2	115.2	-69.8	-72.6	0	0	0	124.5
1941	Q	25.7	Very low	28.4	Very low	126 Å²	126	127.6 Å²	127.6	59%	0.589	67%	0.671	S	S	*	*				51.6	142.3	119.8	-58.1	-172	59.8	0	0	124.6
1942	S	24.7	Very low	28.5	Very low	45 Å²	45	129.2 Å²	129.2	32%	0.315	69%	0.694	S	S	.	*			trans	89.1	99	135.5	71.6	0	0	0	0	122.8	S1973 L1974	S1942-S1973 WeakPolarHBondContact OG-CA 3.49Å; S1942-S1973 VanDerWaalsContact OG-CB 3.27Å; S1942-S1973 WeakPolarHBondContact OG-CB 3.17Å; S1942-L1974 PolarHBondContact OG-N 3.23Å
1943	C	23.2	Very low	28.7	Very low	113 Å²	113	126.3 Å²	126.3	76%	0.764	70%	0.696	S	S	*	*				62.8	152.6	116.4	-109.1	0	0	0	0	125.9
1944	S	24.7	Very low	29.3	Very low	102 Å²	102	126.4 Å²	126.4	71%	0.713	70%	0.704	S	S	*	*			trans	80.5	102.2	144.7	-63.7	0	0	0	0	124.4
1945	Q	26.4	Very low	29.5	Very low	187 Å²	187	121.3 Å²	121.3	87%	0.874	70%	0.703	S	S	*	*				36.3	119.5	128.3	-60	-165.9	21.9	0	0	124.9
1946	S	25.3	Very low	29.5	Very low	99 Å²	99	124.1 Å²	124.1	69%	0.692	71%	0.709	S	S	*	*				78.6	147.8	121.1	-150.5	0	0	0	0	124.2
1947	T	25.1	Very low	29.6	Very low	112 Å²	112	122.3 Å²	122.3	69%	0.687	70%	0.702	S	S	*	*			trans	66.7	151.6	165.9	48.7	0	0	0	0	119.6	V1968	T1947-V1968 CarbonylContact C-O 3.23Å
1948	R	23.9	Very low	29.6	Very low	189 Å²	189	123.9 Å²	123.9	71%	0.713	70%	0.704	S	S	*	*			cis	178.6	112.5	-13.3	169.2	-130	-159.2	156.8	7.3	115.6	V1968	R1948-V1968 VanDerWaalsContact C-CB 3.41Å; R1948-V1968 VanDerWaalsContact C-CG1 3.48Å; R1948-V1968 PolarHBondContact N-O 2.93Å; R1948-V1968 WeakPolarHBondContact O-CB 3.47Å; R1948-V1968 WeakPolarHBondContact O-CG1 3.2Å
1949	F	32.9	Very low	29.6	Very low	148 Å²	148	122.6 Å²	122.6	65%	0.649	70%	0.701	S	S	*	*			trans	26.5	126.5	158.9	-60	-89.6	0	0	0	123.1	P1966 P1967	F1949-P1966 WeakPolarHBondContact CD1-O 3.47Å; F1949-P1966 WeakPolarHBondContact CE1-O 3.2Å; F1949-P1967 CarbonylContact C-O 3.45Å; F1949-P1967 VanDerWaalsContact C-O 3.26Å; F1949-P1967 WeakPolarHBondContact CA-O 3.43Å
1950	P	33.3	Very low	29.6	Very low	101 Å²	101	120.8 Å²	120.8	66%	0.656	71%	0.705	S	S	*	*				-152.7	178.1	71.3	42.1	-20.7	0	0	0	119.8	P1967	P1950-P1967 CarbonylContact C-O 3.56Å; P1950-P1967 WeakPolarHBondContact CA-O 3.32Å; P1950-P1967 WeakPolarHBondContact O-CD 3.39Å; P1950-P1967 WeakPolarHBondContact O-CG 3.21Å; P1950-P1967 VanDerWaalsContact O-O 3.11Å
1951	S	32.3	Very low	29.7	Very low	75 Å²	75	122.3 Å²	122.3	52%	0.524	71%	0.714	S	S	.	*			trans	-120.8	-170	-143.5	-157.4	0	0	0	0	121.2	P1967	S1951-P1967 VanDerWaalsContact CA-CD 3.43Å
1952	A	31.1	Very low	29.9	Very low	104 Å²	104	123.6 Å²	123.6	86%	0.86	72%	0.724	S	S	*	*			trans	82.8	153.9	174.8	0	0	0	0	0	118.7
1953	G	32.8	Very low	30.3	Very low	72 Å²	72	126 Å²	126	74%	0.742	74%	0.738	S	S	*	*			cis	152.6	166.2	-3	0	0	0	0	0	110.6
1954	P	41.3	Very low	31.2	Very low	137 Å²	137	129.5 Å²	129.5	89%	0.89	74%	0.741	S	S	*	*			cis	-126.8	172.2	-4.1	42.8	-27.6	0	0	0	115.4
1955	G	35.4	Very low	31.6	Very low	75 Å²	75	129.9 Å²	129.9	77%	0.773	74%	0.741	S	S	*	*			trans	-178.9	114.4	171.9	0	0	0	0	0	114.3
1956	Y	33.3	Very low	32.5	Very low	217 Å²	217	124.2 Å²	124.2	85%	0.851	72%	0.72	S	S	*	*			trans	-60.6	126.3	-166.1	-93.5	-100.5	0	0	0	117.4
1957	T	32.3	Very low	32.8	Very low	92 Å²	92	121.3 Å²	121.3	56%	0.564	70%	0.699	S	S	*	*				45.7	142.9	129	63.5	0	0	0	0	121
1958	F	31.8	Very low	33	Very low	186 Å²	186	118.8 Å²	118.8	82%	0.816	68%	0.683	S	S	*	*			cis	-172.2	179.6	0.9	-106	-28.4	0	0	0	107.4
1959	I	31.1	Very low	33.2	Very low	143 Å²	143	119.1 Å²	119.1	73%	0.733	69%	0.685	S	S	*	*			cis	-141.5	164.1	4.1	-8	154.9	0	0	0	109.8	N1961	I1959-N1961 PolarHBondContact O-N 2.83Å
1960	A	30.2	Very low	33.1	Very low	91 Å²	91	117.5 Å²	117.5	75%	0.752	69%	0.689	S	S	*	*			trans	50	56.1	145.5	0	0	0	0	0	119.1
1961	N	26.8	Very low	33	Very low	155 Å²	155	117.5 Å²	117.5	83%	0.829	69%	0.689	S	S	*	*				-141.9	163	125.5	-128.3	-34.2	0	0	0	110.9	I1959	I1959-N1961 PolarHBondContact O-N 2.83Å
1962	L	29.6	Very low	32.6	Very low	153 Å²	153	119.2 Å²	119.2	80%	0.801	70%	0.696	S	S	*	*			trans	-61.9	163.6	-172.8	-74.2	160.4	0	0	0	114.2
1963	P	33.8	Very low	32.9	Very low	94 Å²	94	116.9 Å²	116.9	61%	0.61	67%	0.673	S	S	*	*			cis	-141.2	176.6	-18.8	36	-16.5	0	0	0	116.1
1964	F	41.5	Very low	32.5	Very low	187 Å²	187	119.5 Å²	119.5	82%	0.82	67%	0.67	S	S	*	*			trans	62	146.6	162.2	-67.8	-68.6	0	0	0	120.5
1965	P	33.9	Very low	31.8	Very low	110 Å²	110	116.9 Å²	116.9	71%	0.714	65%	0.648	S	S	*	*				-129.9	159.6	129.2	33.7	-21.8	0	0	0	113.2
1966	P	45.5	Very low	31.4	Very low	69 Å²	69	119.3 Å²	119.3	45%	0.448	64%	0.639	S	S	.	*				-129.2	-109	-125.3	26.5	-1.4	0	0	0	111.6	F1949	F1949-P1966 WeakPolarHBondContact CD1-O 3.47Å; F1949-P1966 WeakPolarHBondContact CE1-O 3.2Å
1967	P	30.6	Very low	31	Very low	37 Å²	37	112.8 Å²	112.8	24%	0.24	62%	0.622	C	S	.	*			cis	-140	149.5	-45.1	31.4	-12.7	0	0	0	115.7	F1949 P1950 S1951	F1949-P1967 CarbonylContact C-O 3.45Å; F1949-P1967 VanDerWaalsContact C-O 3.26Å; F1949-P1967 WeakPolarHBondContact CA-O 3.43Å; P1950-P1967 CarbonylContact C-O 3.56Å; P1950-P1967 WeakPolarHBondContact CA-O 3.32Å; P1950-P1967 WeakPolarHBondContact O-CD 3.39Å; P1950-P1967 WeakPolarHBondContact O-CG 3.21Å; P1950-P1967 VanDerWaalsContact O-O 3.11Å; S1951-P1967 VanDerWaalsContact CA-CD 3.43Å
1968	V	30.7	Very low	30.5	Very low	59 Å²	59	116.4 Å²	116.4	36%	0.358	63%	0.632	S	S	.	*			trans	-165.2	122.6	136.5	134.7	0	0	0	0	103.1	T1947 R1948	T1947-V1968 CarbonylContact C-O 3.23Å; R1948-V1968 VanDerWaalsContact C-CB 3.41Å; R1948-V1968 VanDerWaalsContact C-CG1 3.48Å; R1948-V1968 PolarHBondContact N-O 2.93Å; R1948-V1968 WeakPolarHBondContact O-CB 3.47Å; R1948-V1968 WeakPolarHBondContact O-CG1 3.2Å
1969	R	28	Very low	30.1	Very low	197 Å²	197	113.3 Å²	113.3	74%	0.743	63%	0.628	S	S	*	*				74.2	147.6	55.2	-69.7	-167.4	-171.6	-138.2	8.7	111.1
1970	P	30.2	Very low	29.8	Very low	113 Å²	113	111.1 Å²	111.1	73%	0.734	63%	0.626	S	S	*	*				-135.9	-146.1	-66.9	33.5	-10.4	0	0	0	108.5
1971	P	31.1	Very low	29.8	Very low	101 Å²	101	112.7 Å²	112.7	66%	0.656	63%	0.626	S	S	*	*				-120.3	-153	-71.8	33.6	-14.4	0	0	0	110.9
1972	T	24.6	Very low	30	Very low	112 Å²	112	113.7 Å²	113.7	69%	0.687	63%	0.626	S	S	*	*			trans	67.4	99.5	150.7	45.3	0	0	0	0	118.9
1973	S	35.7	Very low	30.3	Very low	54 Å²	54	110.5 Å²	110.5	38%	0.378	62%	0.616	S	S	.	*				45.7	158.2	98.2	68.9	0	0	0	0	120.7	S1942	S1942-S1973 WeakPolarHBondContact OG-CA 3.49Å; S1942-S1973 VanDerWaalsContact OG-CB 3.27Å; S1942-S1973 WeakPolarHBondContact OG-CB 3.17Å
1974	L	25.9	Very low	30.1	Very low	127 Å²	127	114.4 Å²	114.4	67%	0.665	63%	0.626	S	S	*	*			trans	92	121.4	-179.8	-90.1	74.7	0	0	0	117.8	S1942	S1942-L1974 PolarHBondContact OG-N 3.23Å
1975	N	26.2	Very low	29.5	Very low	82 Å²	82	111.4 Å²	111.4	44%	0.439	62%	0.623	S	S	.	*				74.3	132.4	121.5	-67	17.6	0	0	0	124.6
1976	H	26.7	Very low	29.1	Very low	126 Å²	126	112.2 Å²	112.2	58%	0.583	63%	0.625	S	S	*	*				65.7	122.8	129.6	-71.2	-64.2	0	0	0	123.5
1977	V	24.5	Very low	28.7	Very low	81 Å²	81	114.9 Å²	114.9	49%	0.491	64%	0.643	S	S	.	*				83.3	115	115.4	170.7	0	0	0	0	121.1	E1149	E1149-V1977 WeakPolarHBondContact OE1-CG2 3.29Å
1978	H	23.1	Very low	28.4	Very low	167 Å²	167	116.4 Å²	116.4	77%	0.773	67%	0.665	S	S	*	*			trans	75.5	165.3	138.2	-80.4	-159.4	0	0	0	123.7
1979	T	23	Very low	28.3	Very low	121 Å²	121	120 Å²	120	74%	0.742	69%	0.693	S	S	*	*			trans	62.8	79.4	158.3	42.9	0	0	0	0	119
1980	S	23.9	Very low	28	Very low	98 Å²	98	114 Å²	114	69%	0.685	69%	0.692	S	S	*	*				102.2	136.7	103	74	0	0	0	0	120.4
1981	T	29.6	Very low	27.9	Very low	123 Å²	123	119.1 Å²	119.1	76%	0.755	70%	0.699	S	S	*	*			trans	47.5	87.4	145.4	54.7	0	0	0	0	118.9
1982	H	32.8	Very low	27.7	Very low	177 Å²	177	125.5 Å²	125.5	82%	0.819	71%	0.709	S	S	*	*	S	Bend		-155.3	134.7	93.8	-124.5	-79.7	0	0	0	114.4
1983	S	35.1	Very low	27.7	Very low	86 Å²	86	121.3 Å²	121.3	60%	0.601	69%	0.689	S	S	*	*			trans	57.2	72.2	154.1	-60.8	0	0	0	0	120.5
1984	Q	29.2	Very low	27.4	Very low	176 Å²	176	120.1 Å²	120.1	82%	0.822	68%	0.68	S	S	*	*				62.3	116.6	120.1	-68.4	171.3	-35.2	0	0	122.6
1985	V	28.9	Very low	27.3	Very low	124 Å²	124	116.8 Å²	116.8	75%	0.752	67%	0.668	S	S	*	*				70.8	95.2	122.9	-180	0	0	0	0	119.9
1986	V	26.9	Very low	27.2	Very low	126 Å²	126	119 Å²	119	76%	0.764	68%	0.678	S	S	*	*				36.1	145.1	98.4	-179	0	0	0	0	118.1
1987	P	36.2	Very low	27	Very low	125 Å²	125	117.9 Å²	117.9	81%	0.812	69%	0.685	S	S	*	*			cis	-126	-148	-23.1	39.3	-20.9	0	0	0	110.3
1988	G	25.2	Very low	27	Very low	69 Å²	69	118.4 Å²	118.4	71%	0.711	69%	0.692	S	S	*	*			trans	150.7	99.9	135.9	0	0	0	0	0	118.6
1989	S	26.9	Very low	27.9	Very low	135 Å²	135	119.4 Å²	119.4	94%	0.944	70%	0.697	S	S	*	*			trans	-65.8	141.1	147.4	178.8	0	0	0	0	109.5
1990	G	23.3	Very low	28.4	Very low	70 Å²	70	118 Å²	118	72%	0.722	69%	0.69	S	S	*	*			trans	-173.1	101.1	-176.7	0	0	0	0	0	115.4
1991	Y	26.5	Very low	29.3	Very low	222 Å²	222	121.4 Å²	121.4	87%	0.871	70%	0.7	S	S	*	*			trans	-67.8	159.9	160.3	-102.8	-105.8	0	0	0	111.1
1992	R	27.3	Very low	29.2	Very low	234 Å²	234	124.3 Å²	124.3	88%	0.883	70%	0.702	S	S	*	*			trans	38.1	129.4	156.8	-80	-174.1	174.8	-143.3	2.5	118
1993	G	25.7	Very low	28.9	Very low	25 Å²	25	124.9 Å²	124.9	26%	0.258	70%	0.703	S	S	.	*				-115	166.8	74.7	0	0	0	0	0	118.6	S776	S776-G1993 WeakPolarHBondContact CA-O 3.5Å; S776-G1993 PolarHBondContact N-O 3.02Å; S776-G1993 VanDerWaalsContact OG-CA 3.23Å; S776-G1993 WeakPolarHBondContact OG-CA 3.41Å
1994	S	27.7	Very low	28.6	Very low	28 Å²	28	130.6 Å²	130.6	20%	0.196	71%	0.711	C	S	.	*			trans	46.8	138.6	132.5	41.1	0	0	0	0	126.4	S776 S777 D778	S776-S1994 CarbonylContact C-O 3.59Å; S776-S1994 WeakPolarHBondContact CA-O 3.11Å; S776-S1994 VanDerWaalsContact CA-OG 3.25Å; S776-S1994 WeakPolarHBondContact CA-OG 2.99Å; S776-S1994 PolarHBondContact N-O 2.88Å; S776-S1994 PolarHBondContact OG-OG 2.95Å; S777-S1994 PolarHBondContact N-O 3.21Å; S777-S1994 PolarHBondContact N-OG 2.91Å; D778-S1994 VanDerWaalsContact N-CB 3.34Å; D778-S1994 PolarHBondContact N-OG 2.65Å; D778-S1994 VanDerWaalsContact OD1-CB 3.26Å; D778-S1994 WeakPolarHBondContact OD1-CB 3.12Å; D778-S1994 PolarHBondContact OD1-OG 3.25Å; D778-S1994 WeakPolarHBondContact OD2-CB 3.08Å; D778-S1994 PolarHBondContact OD2-OG 3.01Å
1995	S	24.7	Very low	28.4	Very low	58 Å²	58	130.4 Å²	130.4	41%	0.406	71%	0.708	S	S	.	*				66.7	139	124.2	-65.7	0	0	0	0	127.5	S777 D778	S777-S1995 WeakPolarHBondContact O-CB 3.5Å; S777-S1995 PolarHBondContact O-OG 3.31Å; D778-S1995 VanDerWaalsContact CA-OG 3.31Å; D778-S1995 WeakPolarHBondContact CA-OG 3.41Å
1996	I	23.1	Very low	28.4	Very low	127 Å²	127	135.7 Å²	135.7	65%	0.651	71%	0.714	S	S	*	*				48.2	82.2	119.5	-43.3	172.4	0	0	0	118
1997	S	23.6	Very low	28.2	Very low	104 Å²	104	137 Å²	137	73%	0.727	72%	0.718	S	S	*	*				77.3	169.1	128.7	93.8	0	0	0	0	117.7
1998	S	24.7	Very low	28.3	Very low	92 Å²	92	136.2 Å²	136.2	64%	0.643	71%	0.712	S	S	*	*			cis	-146.3	157.5	5.9	44.7	0	0	0	0	112.1
1999	H	42.7	Very low	28.4	Very low	188 Å²	188	138.7 Å²	138.7	87%	0.87	72%	0.717	S	S	*	*			trans	-54.4	146.2	148.6	-52	-83	0	0	0	108.7
2000	P	32.4	Very low	28.2	Very low	92 Å²	92	139.2 Å²	139.2	60%	0.597	71%	0.709	S	S	*	*				-144.8	143.5	114.5	32.2	-17.6	0	0	0	114.5	K2002	P2000-K2002 PolarHBondContact O-N 2.91Å
2001	N	42.1	Very low	28.4	Very low	169 Å²	169	142.2 Å²	142.2	90%	0.904	71%	0.714	S	S	*	*			trans	-61.6	103.2	151.6	-77.6	-19.8	0	0	0	108.1	F2003	N2001-F2003 PolarHBondContact O-N 3.21Å
2002	K	28.9	Very low	28.4	Very low	183 Å²	183	135.1 Å²	135.1	80%	0.796	71%	0.708	S	S	*	*			trans	-69.1	92.4	171.7	-80.3	-175.5	175.9	175.9	0	109.7	P2000	P2000-K2002 PolarHBondContact O-N 2.91Å
2003	F	25.1	Very low	28.4	Very low	190 Å²	190	130.4 Å²	130.4	83%	0.833	70%	0.701	S	S	*	*			trans	-160.6	90.6	131.6	-96.9	-61.3	0	0	0	113.2	N2001	N2001-F2003 PolarHBondContact O-N 3.21Å
2004	R	28.7	Very low	28.5	Very low	205 Å²	205	137.5 Å²	137.5	77%	0.774	73%	0.727	S	S	*	*			trans	56.1	121.2	143.5	-77.7	-176.2	168.7	177.8	-2.6	121.7
2005	F	26.6	Very low	28.5	Very low	173 Å²	173	140.8 Å²	140.8	76%	0.759	75%	0.749	S	S	*	*			trans	60.9	108.5	138.5	-67.9	-54.5	0	0	0	117.9
2006	R	27.5	Very low	28.5	Very low	234 Å²	234	144.6 Å²	144.6	88%	0.883	77%	0.77	S	S	*	*				177.6	169.5	58.6	-103.8	159.1	-178.7	-164.6	-0.4	111.5
2007	N	24.5	Very low	28.9	Very low	155 Å²	155	146.4 Å²	146.4	83%	0.829	78%	0.776	S	S	*	*			trans	-61.6	169.7	158.6	-87.9	4.2	0	0	0	113
2008	P	37.8	Very low	29.9	Very low	107 Å²	107	145 Å²	145	70%	0.695	76%	0.764	S	S	*	*			cis	-139.5	-176.7	-23.6	37.9	-18.8	0	0	0	115.3
2009	C	26	Very low	30	Very low	121 Å²	121	149 Å²	149	82%	0.818	77%	0.77	S	S	*	*			trans	75	154.9	155.5	-62.9	0	0	0	0	122.4
2010	N	24.3	Very low	29.4	Very low	146 Å²	146	146.1 Å²	146.1	78%	0.781	76%	0.76	S	S	*	*			trans	82.3	119.8	160.6	-91.6	3.5	0	0	0	124.2
2011	T	26.4	Very low	29.2	Very low	133 Å²	133	148.2 Å²	148.2	82%	0.816	77%	0.765	S	S	*	*			trans	46.8	130.3	136.9	59.7	0	0	0	0	124.6
2012	G	27.2	Very low	28.4	Very low	73 Å²	73	146.7 Å²	146.7	75%	0.753	76%	0.757	S	S	*	*				131	103	125.9	0	0	0	0	0	122.7
2013	N	27.6	Very low	28.4	Very low	136 Å²	136	143 Å²	143	73%	0.727	76%	0.755	S	S	*	*			trans	31.2	144.1	137.8	-72.2	22.4	0	0	0	127.2
2014	H	27.3	Very low	28.4	Very low	174 Å²	174	142.4 Å²	142.4	81%	0.806	76%	0.756	S	S	*	*			trans	72	157.5	145.9	-64.6	-34.4	0	0	0	120.4
2015	S	26.9	Very low	29	Very low	96 Å²	96	137.5 Å²	137.5	67%	0.671	75%	0.751	S	S	*	*			cis	-176	140	-19.8	177.9	0	0	0	0	114.4
2016	V	26	Very low	29.3	Very low	139 Å²	139	136.6 Å²	136.6	84%	0.842	75%	0.754	S	S	*	*			trans	71.3	154.6	149.5	167.1	0	0	0	0	123.3
2017	E	30.4	Very low	29.5	Very low	165 Å²	165	132.3 Å²	132.3	77%	0.771	75%	0.748	S	S	*	*			trans	-106.9	-139.3	-177.6	-140.7	-159.4	-83.3	0	0	110.7
2018	P	44.8	Very low	29.8	Very low	73 Å²	73	130.5 Å²	130.5	47%	0.474	74%	0.738	S	S	.	*			cis	-135.8	-160.3	-19.7	24.4	3.9	0	0	0	114.8
2019	F	26.1	Very low	29.3	Very low	176 Å²	176	128.7 Å²	128.7	77%	0.772	73%	0.725	S	S	*	*			trans	87.7	153.8	150.8	-62.7	-37.3	0	0	0	123.1
2020	I	30.5	Very low	29.8	Very low	128 Å²	128	125.8 Å²	125.8	66%	0.656	70%	0.704	S	S	*	*			cis	-174.5	174.4	-27.1	-154.1	173.1	0	0	0	112.3
2021	L	27.7	Very low	30	Very low	136 Å²	136	125.6 Å²	125.6	71%	0.712	70%	0.703	S	S	*	*			trans	72.7	151.8	161.4	-96.1	162.6	0	0	0	119.6
2022	N	27.2	Very low	30	Very low	137 Å²	137	126.6 Å²	126.6	73%	0.733	70%	0.699	S	S	*	*			cis	-166.5	168.1	-17.1	-138.6	3.4	0	0	0	116
2023	S	27.6	Very low	29.9	Very low	107 Å²	107	129.5 Å²	129.5	75%	0.748	70%	0.696	S	S	*	*			trans	88.2	156.8	147.1	-61.2	0	0	0	0	124.8
2024	M	26.1	Very low	29.7	Very low	176 Å²	176	126.8 Å²	126.8	87%	0.867	68%	0.681	S	S	*	*			trans	-115.2	-161.5	-164.5	-57.5	156.1	49.9	0	0	113.1
2025	P	40.6	Very low	29.7	Very low	103 Å²	103	122.8 Å²	122.8	67%	0.669	66%	0.663	S	S	*	*			cis	-130.7	-179.2	-38	30.8	-11.1	0	0	0	114.5
2026	L	31.9	Very low	29.5	Very low	154 Å²	154	124.5 Å²	124.5	81%	0.806	66%	0.66	S	S	*	*				168.8	148.1	127.5	-92.4	158.9	0	0	0	117
2027	L	32.6	Very low	29.4	Very low	144 Å²	144	121.5 Å²	121.5	75%	0.754	65%	0.645	S	S	*	*			trans	71.9	126.8	151.2	-75.3	160.8	0	0	0	125.2
2028	D	30	Very low	29	Very low	116 Å²	116	119.6 Å²	119.6	62%	0.62	64%	0.64	S	S	*	*			trans	68.8	148.1	147.8	-88	35.3	0	0	0	125	K821	K821-D2028 IonicContact NZ-OD2 3.05Å; K821-D2028 PolarHBondContact NZ-OD2 2.89Å
2029	T	27.6	Very low	28.1	Very low	70 Å²	70	125.5 Å²	125.5	43%	0.429	66%	0.659	S	S	.	*			trans	-136.8	173.1	-161.9	45.9	0	0	0	0	111.8	Q824	Q824-T2029 PolarHBondContact NE2-OG1 3.19Å
2030	P	38	Very low	28	Very low	59 Å²	59	122.7 Å²	122.7	38%	0.383	65%	0.651	S	S	.	*			cis	-137.9	178.8	-25.5	34.9	-16.2	0	0	0	115
2031	N	27	Very low	27.9	Very low	142 Å²	142	123.8 Å²	123.8	76%	0.759	65%	0.653	S	S	*	*			trans	67.1	146.3	161.2	-61.3	-17.3	0	0	0	117.2
2032	Q	27	Very low	28	Very low	155 Å²	155	123.3 Å²	123.3	72%	0.724	65%	0.651	S	S	*	*			cis	-154.1	160	0.2	-134	-176	48.5	0	0	110.7
2033	I	25.1	Very low	28	Very low	133 Å²	133	120.6 Å²	120.6	68%	0.682	64%	0.643	S	S	*	*			trans	75.5	145.1	156.4	-68	170.9	0	0	0	119.4
2034	N	24.1	Very low	28	Very low	80 Å²	80	123.8 Å²	123.8	43%	0.428	64%	0.643	S	S	.	*			trans	67.8	121.6	165.2	-75.1	-0.4	0	0	0	123.6
2035	H	25.9	Very low	28.1	Very low	89 Å²	89	122.2 Å²	122.2	41%	0.412	63%	0.633	S	S	.	*			trans	-19.1	135.4	149.3	-42.9	-105.5	0	0	0	117.2	D808 S809 K810	D808-H2035 IonicContact OD1-CE1 2.88Å; S809-H2035 PolarHBondContact O-CD2 3.21Å; S809-H2035 VanDerWaalsContact O-CD2 3.24Å; S809-H2035 PolarHBondContact O-NE2 2.72Å; K810-H2035 HydrophobicContact CG-CB 4.4Å
2036	H	23.4	Very low	27.5	Very low	132 Å²	132	122.2 Å²	122.2	61%	0.611	63%	0.632	S	S	*	*				-169.3	156.1	106.6	-123.7	-103.6	0	0	0	116.6	K810	K810-H2036 PolarHBondContact NZ-NE2 3.48Å
2037	S	23.3	Very low	27.4	Very low	77 Å²	77	121.6 Å²	121.6	54%	0.538	63%	0.628	S	S	.	*			trans	11.6	141.1	153.6	57.4	0	0	0	0	124.4
2038	N	23.3	Very low	27.2	Very low	124 Å²	124	122.1 Å²	122.1	66%	0.663	63%	0.626	S	S	*	*				47.6	109.6	129.1	-53.1	-11.6	0	0	0	120.9
2039	F	25.9	Very low	27.1	Very low	197 Å²	197	120.9 Å²	120.9	86%	0.864	63%	0.626	S	S	*	*				-152.1	128.3	119.6	-91.1	-74.7	0	0	0	105.3
2040	I	23.6	Very low	27.4	Very low	118 Å²	118	124.2 Å²	124.2	61%	0.605	65%	0.647	S	S	*	*			cis	66	129.8	26.1	-50.4	-176.3	0	0	0	112.5
2041	H	28.2	Very low	27	Very low	151 Å²	151	126.7 Å²	126.7	70%	0.699	66%	0.661	S	S	*	*			trans	68.1	138.4	-166.6	-60.6	-69.8	0	0	0	114.5
2042	N	30.1	Very low	27.4	Very low	126 Å²	126	127.8 Å²	127.8	67%	0.674	67%	0.666	S	S	*	*			cis	-137	139.7	-15.2	-90.5	-39.5	0	0	0	106.4
2043	S	26.3	Very low	27.8	Very low	80 Å²	80	123.5 Å²	123.5	56%	0.559	66%	0.664	S	S	*	*			cis	71.3	128.5	48.2	104.7	0	0	0	0	114
2044	K	27.9	Very low	28.2	Very low	174 Å²	174	123.5 Å²	123.5	76%	0.757	67%	0.666	S	S	*	*			trans	75.1	146.5	162.4	-60.6	176.1	163.3	-170.6	0	116.9
2045	Q	29	Very low	28.5	Very low	142 Å²	142	127.7 Å²	127.7	66%	0.664	68%	0.68	S	S	*	*			cis	-161.6	124.6	-4.4	-120.7	170.9	-55.1	0	0	115
2046	T	27.9	Very low	28.6	Very low	104 Å²	104	130.7 Å²	130.7	64%	0.638	70%	0.699	S	S	*	*				54.7	172.7	125.7	61.7	0	0	0	0	124.4
2047	I	29.8	Very low	28.8	Very low	141 Å²	141	133.7 Å²	133.7	72%	0.723	71%	0.713	S	S	*	*			trans	83.1	130.9	155.7	-66.1	153.4	0	0	0	116.3
2048	H	28.6	Very low	28.9	Very low	155 Å²	155	133.1 Å²	133.1	72%	0.718	72%	0.719	S	S	*	*			cis	-159.6	141.8	-22.1	-112.6	-48.2	0	0	0	113.3
2049	S	28.2	Very low	29	Very low	89 Å²	89	133.9 Å²	133.9	62%	0.622	73%	0.728	S	S	*	*				20.8	141.6	129.9	-48.3	0	0	0	0	123.8
2050	T	33.6	Very low	29.1	Very low	141 Å²	141	135.4 Å²	135.4	87%	0.865	73%	0.728	S	S	*	*				177.2	170.3	123.7	27.4	0	0	0	0	110.7
2051	V	29.6	Very low	29.7	Very low	111 Å²	111	135.3 Å²	135.3	67%	0.673	73%	0.733	S	S	*	*				-172.7	164.2	-62.4	134.8	0	0	0	0	110.1
2052	N	34.2	Very low	30.1	Very low	164 Å²	164	137 Å²	137	88%	0.877	74%	0.739	S	S	*	*			trans	96.1	137.5	175.6	-53.6	-50.8	0	0	0	116.5
2053	G	35.8	Very low	30.8	Very low	66 Å²	66	140.1 Å²	140.1	68%	0.68	75%	0.749	S	S	*	*			cis	165.8	157	-11.4	0	0	0	0	0	114.6
2054	D	33	Very low	30.9	Very low	132 Å²	132	143.6 Å²	143.6	71%	0.706	76%	0.762	S	S	*	*			trans	52.1	156	145.5	-77.8	16.7	0	0	0	123.2
2055	K	31.2	Very low	30.9	Very low	169 Å²	169	140.2 Å²	140.2	74%	0.735	76%	0.76	S	S	*	*			cis	-164.1	175	-24.4	-114.6	-177.6	-167.8	78.6	0	108.9
2056	N	26.9	Very low	30.8	Very low	151 Å²	151	141.6 Å²	141.6	81%	0.807	77%	0.766	S	S	*	*			trans	-73.5	152.8	-178	-58.4	-46.2	0	0	0	115.3
2057	Q	28.4	Very low	30.7	Very low	196 Å²	196	141.8 Å²	141.8	92%	0.916	76%	0.76	S	S	*	*				150.2	134	124.2	-82.1	-172	29.4	0	0	115.4
2058	G	25.1	Very low	30.6	Very low	64 Å²	64	139.3 Å²	139.3	66%	0.66	76%	0.755	S	S	*	*				101.9	89.7	104.7	0	0	0	0	0	122.9
2059	V	26.7	Very low	30.4	Very low	140 Å²	140	140.7 Å²	140.7	85%	0.848	75%	0.754	S	S	*	*			trans	67.9	149.1	138.2	-153.4	0	0	0	0	120.3
2060	R	27.3	Very low	30.3	Very low	229 Å²	229	147 Å²	147	86%	0.864	76%	0.764	S	S	*	*			trans	76.4	114.7	173.1	-53.5	-178.6	169.4	172.8	-3.5	114
2061	T	36.5	Very low	29.9	Very low	117 Å²	117	145.9 Å²	145.9	72%	0.718	75%	0.753	S	S	*	*				-158.3	155.2	57.2	33.7	0	0	0	0	115.1
2062	K	35.7	Very low	30.1	Very low	187 Å²	187	148.2 Å²	148.2	81%	0.813	75%	0.754	S	S	*	*			trans	39.2	87.1	140.4	-57.5	170.4	-180	178.9	0	118
2063	Q	44.8	Very low	29.8	Very low	190 Å²	190	145.8 Å²	145.8	89%	0.888	74%	0.737	S	S	*	*				177.5	75.7	118	-96.9	172.1	-32	0	0	111.1
2064	N	29	Very low	29.7	Very low	154 Å²	154	148.6 Å²	148.6	82%	0.824	74%	0.736	S	S	*	*			trans	-74.8	162.9	144.2	-52	-1.2	0	0	0	106.6
2065	S	27	Very low	29.7	Very low	102 Å²	102	148.2 Å²	148.2	71%	0.713	73%	0.734	S	S	*	*			cis	-151.7	170.2	15.8	-43.3	0	0	0	0	109.4
2066	Q	26.9	Very low	29.7	Very low	172 Å²	172	146.3 Å²	146.3	80%	0.804	74%	0.736	S	S	*	*			trans	69.9	131	172.3	-63.4	-173	-86.6	0	0	115.4
2067	E	26.3	Very low	30	Very low	108 Å²	108	145.7 Å²	145.7	51%	0.505	74%	0.738	S	S	.	*			cis	93.7	108.6	40.8	-98.7	90.5	-159.3	0	0	114.6	R2069	E2067-R2069 HydrophobicContact CB-CB 4.09Å; E2067-R2069 VanDerWaalsContact CD-CZ 3.43Å; E2067-R2069 HydrophobicContact CG-CB 3.47Å; E2067-R2069 VanDerWaalsContact CG-CB 3.47Å; E2067-R2069 HydrophobicContact CG-CG 3.4Å; E2067-R2069 VanDerWaalsContact CG-CG 3.4Å; E2067-R2069 VanDerWaalsContact CG-NE 3.26Å; E2067-R2069 IonicContact OE1-CZ 2.84Å; E2067-R2069 IonicContact OE1-NE 3.89Å; E2067-R2069 PolarHBondContact OE1-NE 2.78Å; E2067-R2069 IonicContact OE1-NH2 2.76Å; E2067-R2069 PolarHBondContact OE1-NH2 2.92Å; E2067-R2069 IonicContact OE2-CZ 2.76Å; E2067-R2069 IonicContact OE2-NE 3.29Å; E2067-R2069 IonicContact OE2-NH2 2.68Å; E2067-R2069 PolarHBondContact OE2-NH2 3.09Å; E2067-R2069 VanDerWaalsContact OE2-NH2 3.09Å
2068	S	26.9	Very low	30.2	Very low	88 Å²	88	139.8 Å²	139.8	62%	0.615	73%	0.729	S	S	*	*				-116.8	131.1	102.9	163.5	0	0	0	0	105.4	R2070	S2068-R2070 WeakPolarHBondContact OG-CG 3.05Å; S2068-R2070 PolarHBondContact OG-N 3.46Å
2069	R	24.4	Very low	30.5	Very low	185 Å²	185	140 Å²	140	70%	0.698	73%	0.732	S	S	*	*			cis	41	81.9	14.2	-76.3	-167.8	-127.1	169.9	12.3	115.7	E2067 N2071	E2067-R2069 HydrophobicContact CB-CB 4.09Å; E2067-R2069 VanDerWaalsContact CD-CZ 3.43Å; E2067-R2069 HydrophobicContact CG-CB 3.47Å; E2067-R2069 VanDerWaalsContact CG-CB 3.47Å; E2067-R2069 HydrophobicContact CG-CG 3.4Å; E2067-R2069 VanDerWaalsContact CG-CG 3.4Å; E2067-R2069 VanDerWaalsContact CG-NE 3.26Å; E2067-R2069 IonicContact OE1-CZ 2.84Å; E2067-R2069 IonicContact OE1-NE 3.89Å; E2067-R2069 PolarHBondContact OE1-NE 2.78Å; E2067-R2069 IonicContact OE1-NH2 2.76Å; E2067-R2069 PolarHBondContact OE1-NH2 2.92Å; E2067-R2069 IonicContact OE2-CZ 2.76Å; E2067-R2069 IonicContact OE2-NE 3.29Å; E2067-R2069 IonicContact OE2-NH2 2.68Å; E2067-R2069 PolarHBondContact OE2-NH2 3.09Å; E2067-R2069 VanDerWaalsContact OE2-NH2 3.09Å; R2069-N2071 CarbonylContact C-O 3.52Å
2070	R	27.4	Very low	31.4	Very low	221 Å²	221	141.6 Å²	141.6	83%	0.834	74%	0.735	S	S	*	*			trans	-139.9	112.7	147.8	-73.9	174.7	-162	-161.5	1.4	105.6	S2068	S2068-R2070 WeakPolarHBondContact OG-CG 3.05Å; S2068-R2070 PolarHBondContact OG-N 3.46Å
2071	N	24.3	Very low	31.7	Very low	117 Å²	117	140 Å²	140	63%	0.626	76%	0.759	S	S	*	*			cis	-23.7	129.7	-6.1	-61.2	52.5	0	0	0	115.7	R2069 E2073	R2069-N2071 CarbonylContact C-O 3.52Å; N2071-E2073 WeakPolarHBondContact CB-O 3.33Å; N2071-E2073 PolarHBondContact ND2-O 3.43Å
2072	K	33.7	Very low	31.5	Very low	160 Å²	160	141.2 Å²	141.2	70%	0.696	76%	0.761	S	S	*	*			cis	47.7	75.3	20	-162.9	-162.2	173.6	-168.1	0	113
2073	E	29.2	Very low	31.3	Very low	114 Å²	114	138.7 Å²	138.7	53%	0.533	76%	0.759	S	S	.	*			trans	57.6	159.8	164.8	-60.6	96	-104.3	0	0	117	N2071	N2071-E2073 WeakPolarHBondContact CB-O 3.33Å; N2071-E2073 PolarHBondContact ND2-O 3.43Å
2074	D	32.3	Very low	30.5	Very low	124 Å²	124	135.9 Å²	135.9	66%	0.663	75%	0.751	S	S	*	*			cis	-163.5	155.8	-31	-101	-20.4	0	0	0	108.7
2075	L	34.8	Very low	30.6	Very low	125 Å²	125	134.8 Å²	134.8	65%	0.654	75%	0.747	S	S	*	*			trans	65.4	127	174.4	-80.2	73.7	0	0	0	116
2076	V	31.3	Very low	30.8	Very low	128 Å²	128	136.9 Å²	136.9	78%	0.776	75%	0.749	S	S	*	*				88.9	146.9	55.9	169.1	0	0	0	0	113
2077	V	33.1	Very low	31.1	Very low	139 Å²	139	134.5 Å²	134.5	84%	0.842	75%	0.746	S	S	*	*			trans	90.4	148.7	-178	-163.7	0	0	0	0	116.2
2078	G	31.8	Very low	31.4	Very low	72 Å²	72	136.4 Å²	136.4	74%	0.742	76%	0.763	S	S	*	*			trans	-86.7	-139.1	167.3	0	0	0	0	0	112.2
2079	G	31.7	Very low	31.8	Very low	69 Å²	69	140.2 Å²	140.2	71%	0.711	77%	0.774	S	S	*	*			cis	-99.2	-153.8	-0.4	0	0	0	0	0	114.1
2080	D	44.6	Very low	32.4	Very low	173 Å²	173	136.4 Å²	136.4	93%	0.925	78%	0.781	S	S	*	*			cis	62.1	85.8	20.4	-70.4	-31.2	0	0	0	115.1
2081	S	34.5	Very low	32.8	Very low	195 Å²	195	128.7 Å²	128.7	100%	1.364	78%	0.776	S	S	*	*			trans	-162.7	0	157.3	66.6	0	0	0	0	110.1

Retrieved 2,081 of 2,081 residues in 1955.6 ms (Link to these results)

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