A0A3Q0KRA5_SCHMA Loading...

Myb1-related transcription factor AlphaSync Fragmented

AlphaFold DB , UniProt , Accession A0A3Q0KRA5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,950 aa.

						>A0A3Q0KRA5_SCHMA|A0A3Q0KRA5
MIITSTTTTTTTTTTTTTTTTTTTTTGAVLSILPSSSCNTIQSSISNLTLNNDNSTISSSDLSLLPKSEQKRFSDLCVNNLNNENDDNNPIISAPNSPISSNLIWNTTHTISGKNKNHNNERAAISSVKKQHTMNNNNNNASSNYSAIKLNSNETPTSLVKQPVHPRTTLKCPFCDKVFSNSSAIAKHKLTHSEERKYICIVCHKAFKRQDHLNGHKYTHESRKPHACHFCDKSYSDSRSLRRHYENAHPEENERWMLLCQATNGDTSALSIAAAAAAALLSSSAAAAAAAAAAATTGLDAESSLSRDGGGGNADGNLNNDNNASSLAILNALSNSTSASSAGSTIVDSSASVNKLIELGNQTGLSPAALVALVASTGSASGLSSSLQQLDRSNSSTCVSNNAKSSKQSISATSQNAGEKSLRSNRSSSSSPSRIVCHSPNSLSKPISPNNNNNDNMMDINMESENTINVITDELSDTTTTTISSASGTLTPTITNTIFNETLFANDASINHKNTVTINNFALNPIEVANAAKVALLMAHPLEEPKRVACAICAKRFKNQSALNGHMRLHGGYGPAGLIGMNNTPTTTTTTTVTTTSQSNQTYTTTIDSDINDNQESNKPIHFNLFHASSDHVKKNNNVLDSKKKGCSTSTDIDSLKSFSLKSHSKAFTASKNSYDSVLSSIVGANTRPTTFVMTTAASSNPSNSTDLSTTRATNTTITSNNSITNVNSPSSTLFDLVNASPNTLDLKIQSSNSHDHRHHPMNSNINNDNNTWSYPLNKQILESSYNTSLIDHCCNSPNMLSQQQKSQLTFDHQTESLSNIVVSCHQCQHHQPILTSACSTSIHDNSWLSQNDDHTSGQQQQLFRINSSEFDHIVDIIKKDTHTTNNTITDNVNNKSRHHVSVDESSVLKFGSAFSSTSLVKTTTPTSTTISNGSCSLLSRNEKFPLTINTSFPSETTMLITDQGTTPPIKHTSLPSSIHCLSNSIITTCSNKFLNSSTQRSELFGLMNNDDWWHPISNPTNSNHDNDVQCPIDMHIFDQKWSSIEHIQSSNHNNNNNLKVLANFQLKNPTNTTAFFDEKHMIHTTNINNDNNIMPPNIHLTSLLKLNNNEPPHVSSSVILNSSLLSSSSSSSSSPPLSSSSWSTQQRKQAHKSSFHRPIPQPLQLINEPNYQTQLGISSQYSPITPAPMNMSMHTLSTECGGPSNTTISSSSVNITTITNCINVDSNLFIAEHQHLPVNNSAECDNSNKSSSSICCFDANRLGLGNFSDSLLFPSMYNNNGNNLIIADNTNTNNNNIKPSDISMIPSMNHDRLLNITTQKRNLSKYQQQQQQQHYQQQTNNQQNQRHHHQYQQLHDQLNNSNCYESKGNCNVCYSQHHLYHQIEQQQQHSESRQLLDHIEQHQNQLNICLLPSSSSSVQSLQLNIPPSSSSYYPNRHQYHEQGNGDDHFNNNNNNNTICRRNTEPSSHTCSQYSYYQPVVNSLGSMDFTRQFTHEFMNTTTVHNNNNNNNNNNNNSIFIPSTCTSLLNPNCCSVMNMTLSSCCNSTAKTLATTTSPLSVVTSSNFIHTISTTKTTHACNSNQYSLSVNVNNCFNLSRNRLQYKQPLLGPSISSTLDLEQEHLYSFPPQLPSPHHHHHYQHHQQQQQQPTKYPIMSSTSSSSNHGIYPSLDKIDNCRFFNGTELLLQNQLNHMNGSIRNHNNISNNNTKNIVDNKDHNYKHLFLRNEQPDSFIKHTTRSHCCLTCLELERKRHISAPAINNISTQSSWSSLSLSSSSFSLSVPLSSSSHNSSISPLTCPGNSQSHLKPSALTSHKNEFLNKSYFCLPEYHSHHYRLHHHYHHLRGHYCKGTSSSGVVGDQPSSDVVAELLMQSHITDPDGLSSLTCDMHNSCPTTPELSLTPIPSPALAQPAPLPSQHQTSLLVARSTVETVDQSFSILEDECLYRPINIMNNMSSIFPTNKMTCIPSSSFLVTSLSPTTSPPVLPFSLPSALSSISQEETTSFFSCADSHLMTNSFRSMDIEDLSIEQHQQQHFSKVPTHHHHEQQHQKLPISLHLPITSSCSVSNLNQSELLDLTVPPSITQNNNIINCDDQGEITKKTINQTTPNNNNNKYLCDSGNDSVAAKFSKSLAEDNLFRNPTALPPPKKMKSKPAPISIPPQTGANLSRLRSPRVWSSKRSSLNSSPPPYTPPPMLSPVRQGSGLFSSLSRWVPTPISISGGGTSVMTSTGARSVGSGTLMNRRFSNYYPSITHHNDSETTTMCATGSGVNLGGQLKRRHASSSGARSNTSEISTSNQSISTVDSSNNISTGPTNADAYNNSYDNNANTGSITDLYMRDLNRPIAYTRRRRQQLTPKSAPVLILDCNTTKDSANQSKDLQDNELPLQSQQQQQQFSNTDTVFGYDDETMRRFAEADEAYRLSKQKQHQDNRFMRRRRDTEINASNDQINHHIITTSPTDDDNNNSNDSILNKTDHSFTFADEQLLNFDFEMKTKATNYSETTMQFNSDVELDSEHEMEDEEVDDDEGVPTSIIPHINVGHAYQAEIPDFCQEVTSTETNKESPSKWEMLLWYPAYLDEYDPKNIESLNLLTKIACSPAVRNCGLNMEYTFHLLCKYKGDVEMTLHALLRDTLVVYDYVYAETTAWTTEEIVRFQQGLAMHGRDFHQVSKDLQAAGMNKTVKACVEFYYVWKRMNTPSDVKWYRERARRQRSLPRMEPIITEESLSEQFEAFEQCNAYTTDMNSTQTLDNNNNNNNSFNVPYNLRHKQQQQTTISVQPPLSLSTNMKSDHQLTTKVTTNDIVVNNDNSNSLENSYDDFMDIVFNETTSSGSLPKYNTTTTTTTVVIATTSTAAISSHSSSFHSSLSSSLSTIQISANSVVSTSCLSTVITTTMSTPTISSTLTSSVSLSDTKHSIYTCHICNKSFHKIKSRNAHMKTHSDKNTNNHSRRQYI
					

Structure and PAE viewers are unavailable as this is a multi-fragment structure.

Download 9 Fragment Structures AlphaSync Parameters PDBs Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.1	Very low	32.7	Very low	187 Å²	187	123.9 Å²	123.9	92%	0.921	72%	0.721	S	S	*	*				0	142.9	0	-90.1	173.1	172.6	0	0	108.7	T4	M1-T4 PolarHBondContact N-OG1 3.48Å
2	I	35.1	Very low	33.1	Very low	166 Å²	166	123.6 Å²	123.6	85%	0.851	72%	0.722	S	S	*	*			cis	-119	95.7	0.4	-58.7	178	0	0	0	107.5
3	I	35.7	Very low	33.2	Very low	120 Å²	120	123.2 Å²	123.2	62%	0.615	72%	0.722	S	S	*	*	S	Bend	cis	-148.9	104.8	0.7	-56.8	170.9	0	0	0	105.5
4	T	31	Very low	33.6	Very low	91 Å²	91	122.1 Å²	122.1	56%	0.558	72%	0.718	S	S	*	*				29.5	147.3	96.2	60.9	0	0	0	0	115.9	M1	M1-T4 PolarHBondContact N-OG1 3.48Å
5	S	28.3	Very low	33.9	Very low	91 Å²	91	121.6 Å²	121.6	64%	0.636	72%	0.717	S	S	*	*			cis	-161.8	140	32.6	-41.2	0	0	0	0	112.7
6	T	29.7	Very low	34.1	Very low	114 Å²	114	120.7 Å²	120.7	70%	0.699	71%	0.713	S	S	*	*				56.7	124	124.6	64.2	0	0	0	0	124.2
7	T	29.9	Very low	34.3	Very low	126 Å²	126	120.2 Å²	120.2	77%	0.773	71%	0.712	S	S	*	*			trans	65	152.8	133	62.5	0	0	0	0	119
8	T	34	Very low	34.4	Very low	118 Å²	118	119.4 Å²	119.4	72%	0.724	71%	0.709	S	S	*	*			cis	-150.6	138.7	36.9	40.5	0	0	0	0	115.1
9	T	31.3	Very low	34.4	Very low	114 Å²	114	119.3 Å²	119.3	70%	0.699	71%	0.709	S	S	*	*			trans	11.5	139.2	135.6	54	0	0	0	0	119.8
10	T	36.3	Very low	34.5	Very low	122 Å²	122	119.2 Å²	119.2	75%	0.748	71%	0.709	S	S	*	*				-153	123.2	78.1	23.6	0	0	0	0	113.9
11	T	34	Very low	34.6	Very low	114 Å²	114	118.5 Å²	118.5	70%	0.699	71%	0.706	S	S	*	*				52.1	124	107.2	66.2	0	0	0	0	115.6
12	T	38.1	Very low	34.6	Very low	120 Å²	120	115.7 Å²	115.7	74%	0.736	70%	0.7	S	S	*	*				-155.9	134.3	52.5	29.3	0	0	0	0	111.5
13	T	34.6	Very low	34.7	Very low	118 Å²	118	113.1 Å²	113.1	72%	0.724	69%	0.692	S	S	*	*				48.7	139.6	106.8	70.2	0	0	0	0	116.3
14	T	38.8	Very low	34.5	Very low	109 Å²	109	112.8 Å²	112.8	67%	0.669	70%	0.696	S	S	*	*			cis	-165.2	139.7	32.4	-14.7	0	0	0	0	111.9
15	T	37	Very low	34.5	Very low	114 Å²	114	114.1 Å²	114.1	70%	0.699	70%	0.704	S	S	*	*			trans	47.3	144.2	136.2	60.1	0	0	0	0	122.2
16	T	37.3	Very low	34.6	Very low	107 Å²	107	115.9 Å²	115.9	66%	0.656	71%	0.711	S	S	*	*			cis	-174.3	164.2	2.4	23.4	0	0	0	0	111.3
17	T	37.3	Very low	34.6	Very low	113 Å²	113	114.2 Å²	114.2	69%	0.693	72%	0.717	S	S	*	*			trans	64.4	141.9	140.7	54.2	0	0	0	0	120.9
18	T	36.7	Very low	34.8	Very low	106 Å²	106	112.7 Å²	112.7	65%	0.65	72%	0.716	S	S	*	*			cis	-173.2	155.8	-11.1	21.4	0	0	0	0	109
19	T	35.1	Very low	34.5	Very low	117 Å²	117	114.2 Å²	114.2	72%	0.718	73%	0.725	S	S	*	*			trans	59.6	149.4	144.3	58.4	0	0	0	0	118.9
20	T	35.1	Very low	34.6	Very low	117 Å²	117	116.5 Å²	116.5	72%	0.718	73%	0.733	S	S	*	*			cis	-171.1	178.1	-2.1	24	0	0	0	0	106.3
21	T	37.1	Very low	34.2	Very low	105 Å²	105	115.3 Å²	115.3	64%	0.644	73%	0.729	S	S	*	*			cis	-165.2	145.8	11.3	-1.2	0	0	0	0	108
22	T	34.5	Very low	34.1	Very low	127 Å²	127	117.1 Å²	117.1	78%	0.779	73%	0.733	S	S	*	*			trans	54.9	157.8	148.5	60.7	0	0	0	0	119.5
23	T	37.1	Very low	33.7	Very low	112 Å²	112	118.2 Å²	118.2	69%	0.687	73%	0.733	S	S	*	*			cis	-140.1	135.5	11.4	31.2	0	0	0	0	107.7
24	T	30.7	Very low	33.6	Very low	113 Å²	113	117.9 Å²	117.9	69%	0.693	73%	0.734	S	S	*	*				48.1	133.6	85.4	65.9	0	0	0	0	114.5
25	T	32.5	Very low	33.1	Very low	119 Å²	119	117.5 Å²	117.5	73%	0.73	74%	0.735	S	S	*	*			cis	-163	147.1	13.1	-3.8	0	0	0	0	113.8
26	T	29	Very low	33	Very low	129 Å²	129	117.8 Å²	117.8	79%	0.791	74%	0.742	S	S	*	*			trans	13.1	125.2	146.8	56.4	0	0	0	0	121.9
27	G	29.9	Very low	32.6	Very low	79 Å²	79	118.4 Å²	118.4	81%	0.814	75%	0.751	S	S	*	*				104.5	117.5	99.8	0	0	0	0	0	120.1
28	A	34.5	Very low	32.1	Very low	93 Å²	93	118.7 Å²	118.7	77%	0.769	76%	0.756	S	S	*	*			trans	-162.9	101.1	146.8	0	0	0	0	0	110
29	V	28.6	Very low	31.8	Very low	151 Å²	151	121.5 Å²	121.5	92%	0.915	77%	0.767	S	S	*	*			trans	-91.9	117.4	169.7	176.6	0	0	0	0	107.8
30	L	32	Very low	31.4	Very low	162 Å²	162	122.3 Å²	122.3	85%	0.848	77%	0.772	S	S	*	*			trans	-120.7	122	179.2	-113.1	161.7	0	0	0	109.7
31	S	29	Very low	30.9	Very low	97 Å²	97	123.9 Å²	123.9	68%	0.678	77%	0.774	S	S	*	*			trans	-103.8	133.4	-171	42.1	0	0	0	0	111.9
32	I	31.1	Very low	30.4	Very low	151 Å²	151	128 Å²	128	77%	0.774	79%	0.786	S	S	*	*			trans	-129.2	119.5	169.8	-60.1	-179.5	0	0	0	107.8
33	L	29.3	Very low	30	Very low	143 Å²	143	127 Å²	127	75%	0.749	78%	0.784	S	S	*	*			trans	-92.3	155.3	169.2	-83.5	82.9	0	0	0	110
34	P	32.2	Very low	29.5	Very low	112 Å²	112	126.8 Å²	126.8	73%	0.727	79%	0.788	S	S	*	*				-118.4	130.2	107.8	35	-33.8	0	0	0	110
35	S	29.9	Very low	29.4	Very low	100 Å²	100	128.7 Å²	128.7	70%	0.699	79%	0.792	S	S	*	*				49.5	124.9	71.1	75.9	0	0	0	0	113
36	S	34.1	Very low	29	Very low	120 Å²	120	128.2 Å²	128.2	84%	0.839	79%	0.794	S	S	*	*			cis	-147.6	148	22.5	55.5	0	0	0	0	113.1
37	S	29.1	Very low	28.9	Very low	121 Å²	121	129.3 Å²	129.3	85%	0.846	80%	0.795	S	S	*	*			trans	-108	145	173.3	50.8	0	0	0	0	111.8
38	C	26.7	Very low	28.9	Very low	119 Å²	119	133.4 Å²	133.4	80%	0.804	80%	0.797	S	S	*	*			trans	-167	111.7	155.8	-148.4	0	0	0	0	111.6
39	N	30.6	Very low	28.6	Very low	164 Å²	164	135 Å²	135	88%	0.877	80%	0.797	S	S	*	*			trans	159.8	63.2	150.8	-83.5	-21.3	0	0	0	111.8
40	T	25.7	Very low	28.5	Very low	134 Å²	134	135.1 Å²	135.1	82%	0.822	79%	0.792	S	S	*	*			trans	-121.3	156.4	158.7	-51.4	0	0	0	0	106.8
41	I	25.8	Very low	28.4	Very low	151 Å²	151	135.1 Å²	135.1	77%	0.774	79%	0.793	S	S	*	*			trans	85.9	93.6	-173.5	-49.1	162.9	0	0	0	113.9
42	Q	26.6	Very low	28.3	Very low	191 Å²	191	136.7 Å²	136.7	89%	0.893	79%	0.794	S	S	*	*	S	Bend	trans	-155	44.8	141.6	-167.5	65.4	12.6	0	0	109.1
43	S	25.5	Very low	28.5	Very low	106 Å²	106	137 Å²	137	74%	0.741	80%	0.797	S	S	*	*	S	Bend	trans	-152.8	56.7	-173.2	63	0	0	0	0	112.3
44	S	26.1	Very low	28.4	Very low	108 Å²	108	137.5 Å²	137.5	76%	0.755	80%	0.8	S	S	*	*			trans	-157.4	160.8	170.7	-77.5	0	0	0	0	109.5
45	I	28.4	Very low	28.4	Very low	153 Å²	153	137.9 Å²	137.9	79%	0.785	81%	0.806	S	S	*	*			trans	64.6	57.6	-177	-34.5	-179.3	0	0	0	113.8
46	S	25.6	Very low	28.2	Very low	109 Å²	109	138.6 Å²	138.6	76%	0.762	81%	0.806	S	S	*	*				-76	143.7	126.2	-70.7	0	0	0	0	107.6
47	N	26.4	Very low	27.9	Very low	152 Å²	152	140.5 Å²	140.5	81%	0.813	81%	0.805	S	S	*	*			trans	66.5	102.3	-177.4	-47.9	-26.4	0	0	0	115.1
48	L	29.7	Very low	27.8	Very low	164 Å²	164	138.6 Å²	138.6	86%	0.859	79%	0.792	S	S	*	*				-154.5	152.8	114.7	-106.7	166.1	0	0	0	110.1
49	T	29	Very low	27.8	Very low	128 Å²	128	138.5 Å²	138.5	79%	0.785	79%	0.793	S	S	*	*			trans	-74.7	155.7	-164	41.1	0	0	0	0	114.4
50	L	25.2	Very low	28	Very low	153 Å²	153	134.3 Å²	134.3	80%	0.801	78%	0.776	S	S	*	*			trans	-46	142.1	160.3	-66.6	160.8	0	0	0	111.6
51	N	31.3	Very low	28.3	Very low	161 Å²	161	134.8 Å²	134.8	86%	0.861	77%	0.773	S	S	*	*				-148.7	144.6	127	-97.2	-25.2	0	0	0	108.8
52	N	27.1	Very low	28.7	Very low	131 Å²	131	134.6 Å²	134.6	70%	0.701	77%	0.773	S	S	*	*			trans	-72.6	157.1	166.1	-59.6	-36.3	0	0	0	108.6
53	D	35.1	Very low	29.2	Very low	156 Å²	156	130 Å²	130	83%	0.834	76%	0.763	S	S	*	*				-162.6	153.9	101.2	-98	-25.9	0	0	0	112.8
54	N	26.9	Very low	29.8	Very low	154 Å²	154	132.7 Å²	132.7	82%	0.824	77%	0.767	S	S	*	*			trans	-81.7	130	-173.8	-62.5	-74.6	0	0	0	111.4
55	S	31.7	Very low	30.2	Very low	121 Å²	121	132.3 Å²	132.3	85%	0.846	76%	0.756	S	S	*	*			trans	-145.1	144.9	151.6	44.1	0	0	0	0	109.9
56	T	26	Very low	30.6	Very low	115 Å²	115	128.9 Å²	128.9	71%	0.706	74%	0.744	S	S	*	*			trans	-134.1	173.1	-167.8	54.7	0	0	0	0	109.7
57	I	26.7	Very low	31.4	Very low	159 Å²	159	132.2 Å²	132.2	82%	0.815	75%	0.745	S	S	*	*			trans	75.3	142.1	171.9	-52.5	148.7	0	0	0	112
58	S	27.5	Very low	32	Very low	82 Å²	82	129.3 Å²	129.3	57%	0.573	74%	0.736	S	S	*	*			cis	-131.2	156.3	2.9	34.6	0	0	0	0	109
59	S	26.6	Very low	32.6	Very low	117 Å²	117	126.4 Å²	126.4	82%	0.818	72%	0.719	S	S	*	*			cis	76.7	26.6	42.7	-44.1	0	0	0	0	115.9
60	S	34.6	Very low	33.2	Very low	76 Å²	76	125.3 Å²	125.3	53%	0.531	71%	0.705	S	S	.	*			trans	-116	-52.1	-178.9	-56.1	0	0	0	0	114.7	L62	S60-L62 PolarHBondContact O-N 3.03Å
61	D	32.1	Very low	33.8	Very low	143 Å²	143	125.1 Å²	125.1	77%	0.765	70%	0.697	S	S	*	*			trans	-95.6	24.9	-157.4	-50.9	-56.2	0	0	0	115.6	S63	D61-S63 PolarHBondContact O-N 3.1Å; D61-S63 VanDerWaalsContact O-N 3.07Å
62	L	35.4	Very low	34	Very low	148 Å²	148	126.9 Å²	126.9	78%	0.775	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	8.3	-178.1	-107.5	80.1	0	0	0	115	S60	S60-L62 PolarHBondContact O-N 3.03Å
63	S	36.9	Very low	34.3	Very low	95 Å²	95	129 Å²	129	66%	0.664	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-7.3	-161.5	53.5	0	0	0	0	116.1	D61	D61-S63 PolarHBondContact O-N 3.1Å; D61-S63 VanDerWaalsContact O-N 3.07Å
64	L	37.8	Very low	34.3	Very low	161 Å²	161	124.3 Å²	124.3	84%	0.843	68%	0.675	S	S	*	*	S	Bend	trans	-113.2	0.5	-169.3	-65.8	174.3	0	0	0	115.7
65	L	34.5	Very low	34.6	Very low	100 Å²	100	123.1 Å²	123.1	52%	0.524	67%	0.668	S	S	.	*	S	Bend	trans	-88.7	136.1	-177.6	-82	153.3	0	0	0	113.2
66	P	37	Very low	34.7	Very low	81 Å²	81	124.3 Å²	124.3	53%	0.526	66%	0.664	S	S	.	*			trans	-60	151	180	-26.6	35.8	0	0	0	115.2	S68 E69 Q70	P66-S68 PolarHBondContact O-N 2.98Å; P66-E69 PolarHBondContact O-N 3.17Å; P66-Q70 PolarHBondContact O-N 3.08Å
67	K	42.4	Very low	34.8	Very low	179 Å²	179	124.2 Å²	124.2	78%	0.778	67%	0.667	S	S	*	*	H	α-helix	trans	-59.2	-19.7	-178.4	-69.4	180	177.2	176.8	0	114.8
68	S	38.5	Very low	35.1	Very low	91 Å²	91	122 Å²	122	64%	0.636	66%	0.661	S	S	*	*	H	α-helix	trans	-65.6	-35.7	173.7	39.7	0	0	0	0	112.7	P66	P66-S68 PolarHBondContact O-N 2.98Å
69	E	42.2	Very low	35.2	Very low	104 Å²	104	125.5 Å²	125.5	49%	0.486	67%	0.673	S	S	.	*	H	α-helix	trans	-91	-32.9	-177.9	-60.8	-143.4	113.2	0	0	112.8	P66 K71 R72 F73	P66-E69 PolarHBondContact O-N 3.17Å; E69-K71 PolarHBondContact O-N 3.39Å; E69-K71 VanDerWaalsContact O-N 3.08Å; E69-R72 PolarHBondContact O-N 3.01Å; E69-F73 PolarHBondContact O-N 3.04Å
70	Q	41.1	Very low	35.1	Very low	105 Å²	105	127.6 Å²	127.6	49%	0.491	68%	0.675	S	S	.	*	H	α-helix	trans	-51.4	-34.2	171.3	-68.4	-177.1	-21.5	0	0	112.2	P66	P66-Q70 PolarHBondContact O-N 3.08Å
71	K	37.7	Very low	35	Very low	149 Å²	149	131.4 Å²	131.4	65%	0.648	69%	0.688	S	S	*	*	H	α-helix	trans	-76.9	-18.9	179.2	-157.9	177	-178.4	-174.2	0	114.5	E69 S74	E69-K71 PolarHBondContact O-N 3.39Å; E69-K71 VanDerWaalsContact O-N 3.08Å; K71-S74 PolarHBondContact O-OG 2.93Å
72	R	35.7	Very low	35	Very low	197 Å²	197	132 Å²	132	74%	0.743	69%	0.692	S	S	*	*	H	α-helix	trans	-83.7	-23.2	175.2	-89.1	-176.4	166.3	175	-1.4	113.4	E69	E69-R72 PolarHBondContact O-N 3.01Å
73	F	34	Very low	34.6	Very low	177 Å²	177	132.4 Å²	132.4	78%	0.776	70%	0.695	S	S	*	*	H	α-helix	trans	-84.4	-22.9	175.1	-99.5	-89	0	0	0	113.6	E69	E69-F73 PolarHBondContact O-N 3.04Å
74	S	35.2	Very low	34.5	Very low	57 Å²	57	136.8 Å²	136.8	40%	0.399	71%	0.705	S	S	.	*	H	α-helix	trans	-70.7	-35.1	175.4	51.4	0	0	0	0	113.5	K71 L76	K71-S74 PolarHBondContact O-OG 2.93Å; S74-L76 PolarHBondContact O-N 3.47Å; S74-L76 VanDerWaalsContact O-N 3.17Å
75	D	33.5	Very low	34.2	Very low	129 Å²	129	135.9 Å²	135.9	69%	0.69	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	3.8	-172.5	-64.3	-0.9	0	0	0	113.4
76	L	33.8	Very low	34.2	Very low	145 Å²	145	138.5 Å²	138.5	76%	0.759	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.1	-0.6	-180	-91.6	161.6	0	0	0	114.4	S74	S74-L76 PolarHBondContact O-N 3.47Å; S74-L76 VanDerWaalsContact O-N 3.17Å
77	C	27.9	Very low	34	Very low	113 Å²	113	141.4 Å²	141.4	76%	0.764	73%	0.727	S	S	*	*	S	Bend	trans	-139.8	45.1	-172.5	-79.1	0	0	0	0	114.1
78	V	32	Very low	33.6	Very low	114 Å²	114	141 Å²	141	69%	0.691	73%	0.732	S	S	*	*			trans	-136.7	149.2	172.4	-169.8	0	0	0	0	110.1
79	N	29.3	Very low	33.2	Very low	154 Å²	154	142.6 Å²	142.6	82%	0.824	73%	0.734	S	S	*	*			trans	73.9	46	178.1	-56.2	-31.2	0	0	0	117.4
80	N	25.8	Very low	32.8	Very low	161 Å²	161	143.3 Å²	143.3	86%	0.861	75%	0.748	S	S	*	*			trans	-100.2	153.1	130.5	-106.1	-34.4	0	0	0	107.6
81	L	31.3	Very low	32.1	Very low	156 Å²	156	144.5 Å²	144.5	82%	0.817	76%	0.756	S	S	*	*			trans	87.8	91.5	-172.8	-56.4	167	0	0	0	116.1
82	N	33	Very low	31.7	Very low	155 Å²	155	145.4 Å²	145.4	83%	0.829	77%	0.766	S	S	*	*				172.2	140.1	102.9	-84.3	-18.2	0	0	0	111.5
83	N	26.2	Very low	31.3	Very low	157 Å²	157	140.3 Å²	140.3	84%	0.84	76%	0.761	S	S	*	*			trans	-78.7	151.8	162.7	-60.7	-37.8	0	0	0	109
84	E	35.5	Very low	31.2	Very low	188 Å²	188	136.4 Å²	136.4	88%	0.879	76%	0.762	S	S	*	*				-170.3	171.4	113.6	-103	168.7	-178	0	0	110.7
85	N	30.7	Very low	31.1	Very low	141 Å²	141	138.8 Å²	138.8	75%	0.754	78%	0.775	S	S	*	*			trans	-94	162	-168.5	-41.9	-72.9	0	0	0	111.9
86	D	36.2	Very low	30.9	Very low	156 Å²	156	139.7 Å²	139.7	83%	0.834	78%	0.781	S	S	*	*				172.8	158.4	111.6	-89.5	-14.2	0	0	0	112.7
87	D	32.3	Very low	30.9	Very low	142 Å²	142	138 Å²	138	76%	0.759	78%	0.78	S	S	*	*			trans	-78.1	154.8	-176.8	-64.5	-70	0	0	0	114.1
88	N	34.2	Very low	31	Very low	169 Å²	169	138.6 Å²	138.6	90%	0.904	78%	0.783	S	S	*	*				165.4	156.2	112.5	-89.2	-75.9	0	0	0	113.7
89	N	30.4	Very low	31.1	Very low	125 Å²	125	141.3 Å²	141.3	67%	0.668	79%	0.792	S	S	*	*			trans	-114	146.8	-173.5	-176.5	2.5	0	0	0	110.4	I91	N89-I91 PolarHBondContact OD1-N 3.07Å
90	P	32.8	Very low	31	Very low	120 Å²	120	139 Å²	139	78%	0.779	79%	0.788	S	S	*	*				-151.3	121.1	116.2	34.5	-15.4	0	0	0	117.5
91	I	26.5	Very low	31.1	Very low	129 Å²	129	136.3 Å²	136.3	66%	0.662	78%	0.782	S	S	*	*				23.4	118.9	124.8	-54.1	171.6	0	0	0	118.7	N89	N89-I91 PolarHBondContact OD1-N 3.07Å
92	I	28.9	Very low	31	Very low	168 Å²	168	136 Å²	136	86%	0.862	78%	0.781	S	S	*	*			trans	-179.1	154.7	139.3	-102.3	156.6	0	0	0	111
93	S	27.3	Very low	30.9	Very low	90 Å²	90	135 Å²	135	63%	0.629	78%	0.775	S	S	*	*			cis	-172.9	137.6	-45.5	-101.9	0	0	0	0	112.5
94	A	32	Very low	31.1	Very low	96 Å²	96	134.3 Å²	134.3	79%	0.793	77%	0.77	S	S	*	*			trans	67.7	167.8	157	0	0	0	0	0	119.6
95	P	34.7	Very low	30.8	Very low	106 Å²	106	135.2 Å²	135.2	69%	0.688	77%	0.765	S	S	*	*				-143.9	168.2	-57.4	42.8	-28	0	0	0	117.8
96	N	28.8	Very low	30.9	Very low	149 Å²	149	136.1 Å²	136.1	80%	0.797	77%	0.77	S	S	*	*			trans	81.4	136.2	141.2	-71	-15.3	0	0	0	125.9
97	S	32.9	Very low	31	Very low	108 Å²	108	133.6 Å²	133.6	76%	0.755	76%	0.761	S	S	*	*			trans	88.2	117.5	143.6	71.6	0	0	0	0	121.6
98	P	30.7	Very low	31	Very low	126 Å²	126	130.7 Å²	130.7	82%	0.818	75%	0.748	S	S	*	*			trans	-107.7	148.7	163	37.7	-29.5	0	0	0	113
99	I	33.5	Very low	31	Very low	171 Å²	171	130.7 Å²	130.7	88%	0.877	74%	0.742	S	S	*	*			trans	-135.8	147.6	171.1	-64	-177.6	0	0	0	109.9
100	S	27.6	Very low	30.8	Very low	107 Å²	107	129.6 Å²	129.6	75%	0.748	74%	0.74	S	S	*	*			trans	-85.2	153.5	-165.7	-45.6	0	0	0	0	115.9
101	S	26.8	Very low	30.6	Very low	104 Å²	104	130.9 Å²	130.9	73%	0.727	74%	0.739	S	S	*	*			trans	39.4	103.2	142.5	-51.7	0	0	0	0	119.7
102	N	30.6	Very low	30.7	Very low	148 Å²	148	130.2 Å²	130.2	79%	0.791	75%	0.746	S	S	*	*				172.2	150.3	118.3	-95.2	-51.6	0	0	0	113.9
103	L	31.4	Very low	30.8	Very low	136 Å²	136	125.5 Å²	125.5	71%	0.712	74%	0.738	S	S	*	*			trans	50.9	145.8	152.4	-86.4	82.7	0	0	0	122
104	I	30.3	Very low	31.2	Very low	142 Å²	142	131.4 Å²	131.4	73%	0.728	75%	0.753	S	S	*	*			trans	56.9	110.3	153	-58	157.9	0	0	0	116.8
105	W	28.1	Very low	31.1	Very low	207 Å²	207	132.8 Å²	132.8	78%	0.784	75%	0.747	S	S	*	*			trans	-125.3	99.9	152	-105.3	64.8	0	0	0	110.3	T107	W105-T107 HydrophobicContact CE3-CG2 4.47Å; W105-T107 HydrophobicContact CZ3-CG2 3.96Å
106	N	33	Very low	31.3	Very low	159 Å²	159	137.1 Å²	137.1	85%	0.85	76%	0.755	S	S	*	*			trans	-103	133.1	144.4	-102.3	-5.6	0	0	0	106.1
107	T	37.4	Very low	31.4	Very low	104 Å²	104	134.8 Å²	134.8	64%	0.638	74%	0.742	S	S	*	*			trans	-77.2	139	-160.9	-56.8	0	0	0	0	113.5	W105	W105-T107 HydrophobicContact CE3-CG2 4.47Å; W105-T107 HydrophobicContact CZ3-CG2 3.96Å
108	T	33.2	Very low	31.5	Very low	81 Å²	81	138.1 Å²	138.1	50%	0.497	75%	0.746	S	S	.	*			trans	-25.9	152.8	172.2	52.2	0	0	0	0	119.3
109	H	33.4	Very low	31.5	Very low	168 Å²	168	137.1 Å²	137.1	78%	0.778	73%	0.733	S	S	*	*				161.1	141.1	123.1	-85.6	-60.5	0	0	0	111.7
110	T	27.5	Very low	31.3	Very low	102 Å²	102	135.3 Å²	135.3	63%	0.626	73%	0.726	S	S	*	*			cis	-162.5	163.8	-30.8	-6.6	0	0	0	0	110.5
111	I	29	Very low	31.5	Very low	148 Å²	148	139.2 Å²	139.2	76%	0.759	73%	0.732	S	S	*	*			trans	74.4	136.9	152.2	-67.8	158.2	0	0	0	119.1
112	S	28.2	Very low	31.6	Very low	114 Å²	114	145.7 Å²	145.7	80%	0.797	74%	0.741	S	S	*	*			trans	50.5	113.3	162.2	-65.1	0	0	0	0	119.3
113	G	30	Very low	31.5	Very low	69 Å²	69	143 Å²	143	71%	0.711	74%	0.738	S	S	*	*			cis	104.1	138	1.6	0	0	0	0	0	114.5
114	K	37.1	Very low	31.6	Very low	214 Å²	214	141 Å²	141	93%	0.93	74%	0.742	S	S	*	*			trans	-160.9	111.2	155.8	-110.8	149.1	-168.9	166.4	0	111.1
115	N	29.7	Very low	31.7	Very low	126 Å²	126	141.5 Å²	141.5	67%	0.674	74%	0.744	S	S	*	*			trans	-77.2	148.4	177.8	-170.6	9.2	0	0	0	111.5	N117	N115-N117 PolarHBondContact OD1-OD1 3.26Å
116	K	37.9	Very low	31.9	Very low	196 Å²	196	136.9 Å²	136.9	85%	0.852	74%	0.744	S	S	*	*			trans	-176.1	95.7	157.2	-102.7	162.7	-173.6	-170.6	0	106.7
117	N	30.2	Very low	32	Very low	100 Å²	100	133.6 Å²	133.6	54%	0.535	73%	0.734	S	S	.	*				43	109.4	77.6	-68.9	1	0	0	0	113.3	N115	N115-N117 PolarHBondContact OD1-OD1 3.26Å
118	H	37	Very low	31.9	Very low	178 Å²	178	134.2 Å²	134.2	82%	0.824	74%	0.737	S	S	*	*				-164.8	111.5	114.3	-94.1	-81.2	0	0	0	105.8
119	N	29.2	Very low	32.2	Very low	105 Å²	105	138.2 Å²	138.2	56%	0.561	75%	0.747	S	S	*	*				77.4	122.1	61.1	-72.9	8	0	0	0	114
120	N	29	Very low	32.5	Very low	134 Å²	134	138.2 Å²	138.2	72%	0.717	75%	0.745	S	S	*	*			trans	60.4	115.2	146.6	-52.5	-14.2	0	0	0	119.3
121	E	33.1	Very low	32.8	Very low	189 Å²	189	139.5 Å²	139.5	88%	0.883	74%	0.744	S	S	*	*				-178.8	125.4	101	-93.4	162.1	-172	0	0	107.6
122	R	28.6	Very low	32.9	Very low	240 Å²	240	139.8 Å²	139.8	91%	0.906	74%	0.742	S	S	*	*			cis	83.7	126.4	29	-160	179.5	-171.3	170.9	4.5	114.1
123	A	29.5	Very low	33	Very low	90 Å²	90	139.7 Å²	139.7	74%	0.744	74%	0.736	S	S	*	*			trans	75.9	102.6	166.1	0	0	0	0	0	119.2
124	A	33	Very low	33.2	Very low	96 Å²	96	144.2 Å²	144.2	79%	0.793	74%	0.741	S	S	*	*				-176.6	154.9	129.7	0	0	0	0	0	110.2
125	I	32.3	Very low	32.8	Very low	151 Å²	151	140.9 Å²	140.9	77%	0.774	73%	0.734	S	S	*	*			cis	-172.6	144.7	-47.7	-106.4	158	0	0	0	106.4
126	S	30.9	Very low	32.7	Very low	110 Å²	110	141.1 Å²	141.1	77%	0.769	74%	0.735	S	S	*	*			trans	67.3	151.1	171.8	-112.2	0	0	0	0	116.6
127	S	36.8	Very low	32.3	Very low	91 Å²	91	138.1 Å²	138.1	64%	0.636	73%	0.728	S	S	*	*			cis	-167.3	159.3	-7.9	-124.3	0	0	0	0	112.4
128	V	35.1	Very low	32.2	Very low	116 Å²	116	139.2 Å²	139.2	70%	0.703	73%	0.734	S	S	*	*			trans	64.1	129.7	142.5	165.3	0	0	0	0	118.2
129	K	38.2	Very low	31.8	Very low	166 Å²	166	136.6 Å²	136.6	72%	0.722	73%	0.726	S	S	*	*			cis	-162.7	144.2	2.5	-118.5	173.8	-159.4	161.6	0	110.1
130	K	39.5	Very low	31.7	Very low	167 Å²	167	138.6 Å²	138.6	73%	0.726	74%	0.737	S	S	*	*			trans	65.6	153	145.6	-72.1	-178.6	165.3	-159.4	0	117.6
131	Q	34.1	Very low	31.7	Very low	129 Å²	129	137 Å²	137	60%	0.603	74%	0.742	S	S	*	*			cis	-153.4	145.5	5.6	-130.5	159.5	-39.7	0	0	111.8
132	H	32	Very low	31.5	Very low	154 Å²	154	132.9 Å²	132.9	71%	0.713	73%	0.734	S	S	*	*			trans	41.5	142.4	149.8	-62.4	-30.5	0	0	0	121.7
133	T	30	Very low	31.5	Very low	112 Å²	112	125.5 Å²	125.5	69%	0.687	72%	0.72	S	S	*	*			cis	-158.1	161.3	8.9	-3	0	0	0	0	112
134	M	35.1	Very low	31.5	Very low	165 Å²	165	127.2 Å²	127.2	81%	0.813	72%	0.716	S	S	*	*			trans	27.2	110.5	158	-55	-41	-171.3	0	0	119
135	N	28.1	Very low	31.2	Very low	144 Å²	144	132 Å²	132	77%	0.77	72%	0.715	S	S	*	*				92.8	134.7	60.5	-177.9	50.5	0	0	0	113
136	N	27.9	Very low	31.3	Very low	131 Å²	131	130.2 Å²	130.2	70%	0.701	72%	0.716	S	S	*	*			trans	-57.7	138	173	-95.2	-14.9	0	0	0	111.8
137	N	29.5	Very low	31.3	Very low	133 Å²	133	129.2 Å²	129.2	71%	0.711	72%	0.715	S	S	*	*				-172.3	151.4	104.5	-96.3	-17.4	0	0	0	113.1
138	N	28.2	Very low	31.2	Very low	122 Å²	122	133.1 Å²	133.1	65%	0.652	73%	0.726	S	S	*	*			trans	57.3	111.5	145.5	-68.3	3.6	0	0	0	121
139	N	28.8	Very low	31	Very low	123 Å²	123	136.4 Å²	136.4	66%	0.658	73%	0.731	S	S	*	*				86.6	128.3	116.2	-63.1	-3.4	0	0	0	120.7
140	N	26.7	Very low	30.5	Very low	147 Å²	147	135.5 Å²	135.5	79%	0.786	73%	0.733	S	S	*	*			trans	71	149.7	140.8	-60.8	-5.9	0	0	0	119
141	A	28	Very low	30.1	Very low	100 Å²	100	133.9 Å²	133.9	83%	0.826	73%	0.733	S	S	*	*			trans	64.9	136.6	162.1	0	0	0	0	0	116.2
142	S	29.3	Very low	29.9	Very low	103 Å²	103	131.7 Å²	131.7	72%	0.72	73%	0.732	S	S	*	*			cis	-155.5	-171.6	-14	-164.3	0	0	0	0	108.8
143	S	27.4	Very low	29.7	Very low	86 Å²	86	131.1 Å²	131.1	60%	0.601	73%	0.734	S	S	*	*			trans	-31.8	145.1	144.1	58.3	0	0	0	0	113.5
144	N	29.8	Very low	30	Very low	126 Å²	126	135.1 Å²	135.1	67%	0.674	75%	0.745	S	S	*	*				-174.9	140.9	111.5	-89.3	-7	0	0	0	114.3
145	Y	27.6	Very low	29.9	Very low	196 Å²	196	133.5 Å²	133.5	77%	0.769	75%	0.745	S	S	*	*			trans	14.1	129	152.2	-49	-72.7	0	0	0	121
146	S	34.4	Very low	30.2	Very low	113 Å²	113	131.7 Å²	131.7	79%	0.79	74%	0.74	S	S	*	*				177.8	116.3	91.9	-69.3	0	0	0	0	109.1
147	A	30.1	Very low	30.3	Very low	90 Å²	90	131.7 Å²	131.7	74%	0.744	75%	0.746	S	S	*	*				68.8	92.3	52.7	0	0	0	0	0	114.1
148	I	36.5	Very low	30.4	Very low	173 Å²	173	130.7 Å²	130.7	89%	0.887	75%	0.749	S	S	*	*			trans	-132.7	106.9	154.7	-86.7	139.9	0	0	0	108.7
149	K	30.4	Very low	30.7	Very low	184 Å²	184	133 Å²	133	80%	0.8	76%	0.76	S	S	*	*			trans	-51.1	159.5	155.4	-81.6	175.2	176.4	-179.2	0	110.8
150	L	28	Very low	31.4	Very low	147 Å²	147	132.8 Å²	132.8	77%	0.77	76%	0.763	S	S	*	*			cis	-154.1	-172.1	6.4	-103	153.2	0	0	0	105.1
151	N	31.1	Very low	32	Very low	133 Å²	133	135.4 Å²	135.4	71%	0.711	77%	0.768	S	S	*	*			cis	-148.8	173.5	19.8	-161.5	18.1	0	0	0	111.5
152	S	28.5	Very low	32.3	Very low	83 Å²	83	138.9 Å²	138.9	58%	0.58	77%	0.767	S	S	*	*			trans	-91.9	179.5	-178.9	62.5	0	0	0	0	114.4
153	N	29.2	Very low	32.9	Very low	143 Å²	143	139.8 Å²	139.8	77%	0.765	77%	0.77	S	S	*	*			trans	90.2	81.7	166.2	-49.4	-2.8	0	0	0	116.5
154	E	36.4	Very low	33.5	Very low	195 Å²	195	141 Å²	141	91%	0.911	77%	0.773	S	S	*	*				-163.9	137.5	130	-112.1	168.7	-141.1	0	0	111.7
155	T	31.6	Very low	34.3	Very low	132 Å²	132	142.8 Å²	142.8	81%	0.81	78%	0.778	S	S	*	*			trans	-127.6	164.5	170	65.9	0	0	0	0	106.5
156	P	34.5	Very low	35.2	Very low	105 Å²	105	139.1 Å²	139.1	68%	0.682	78%	0.778	S	S	*	*			cis	-143.5	-168.2	15.3	32.9	-8.2	0	0	0	115.8
157	T	29.9	Very low	36	Very low	132 Å²	132	143.7 Å²	143.7	81%	0.81	78%	0.778	S	S	*	*			trans	81.3	148.1	151.1	1.5	0	0	0	0	121.1
158	S	31.8	Very low	37.7	Very low	111 Å²	111	144.8 Å²	144.8	78%	0.776	78%	0.775	S	S	*	*			trans	69.9	76.7	163.5	-156.4	0	0	0	0	118.5
159	L	35.4	Very low	39.9	Very low	170 Å²	170	141.1 Å²	141.1	89%	0.89	76%	0.761	S	S	*	*			trans	-121.7	97.1	158.8	-82.3	174.7	0	0	0	112.6
160	V	42.2	Very low	42.6	Very low	120 Å²	120	135.1 Å²	135.1	73%	0.727	74%	0.738	S	S	*	*			trans	38.5	113.4	144.5	-170.8	0	0	0	0	118.4	Q162	V160-Q162 PolarHBondContact O-N 3.22Å; V160-Q162 VanDerWaalsContact O-N 3.08Å
161	K	40.3	Very low	45.5	Very low	202 Å²	202	134 Å²	134	88%	0.878	73%	0.726	S	S	*	*			trans	-60.4	106.6	162.7	-71.8	171.8	178	167.4	0	110.9
162	Q	34.8	Very low	48.4	Very low	173 Å²	173	127.8 Å²	127.8	81%	0.808	69%	0.694	S	S	*	*			trans	-68.1	133	167.8	-69.6	-169.6	-6.9	0	0	110.8	V160 V164	V160-Q162 PolarHBondContact O-N 3.22Å; V160-Q162 VanDerWaalsContact O-N 3.08Å; Q162-V164 PolarHBondContact O-N 3.04Å
163	P	40.2	Very low	51.2	Low	121 Å²	121	128 Å²	128	79%	0.786	69%	0.693	S	S	*	*			trans	-69.8	122.1	178	-20.9	33.6	0	0	0	112.6	H165	P163-H165 PolarHBondContact O-N 3.46Å
164	V	41.2	Very low	54	Low	111 Å²	111	127.5 Å²	127.5	67%	0.673	68%	0.684	S	S	*	*	S	Bend	trans	-70.1	97.3	176.4	179.4	0	0	0	0	110.4	Q162 L569	Q162-V164 PolarHBondContact O-N 3.04Å; V164-L569 HydrophobicContact CG2-CD2 4.15Å
165	H	46.9	Very low	56.7	Low	165 Å²	165	119.9 Å²	119.9	76%	0.764	65%	0.652	S	S	*	*			trans	54.1	118.6	179.3	-58.1	-70.1	0	0	0	116.1	P163 R167	P163-H165 PolarHBondContact O-N 3.46Å; H165-R167 PolarHBondContact O-N 3.49Å; H165-R167 VanDerWaalsContact O-N 3.13Å
166	P	45.5	Very low	59.4	Low	119 Å²	119	119.5 Å²	119.5	77%	0.773	65%	0.645	S	S	*	*			trans	-64.9	118.3	170.7	28	-33	0	0	0	109.8	T168	P166-T168 PolarHBondContact O-N 2.75Å
167	R	52.2	Low	61.9	Low	208 Å²	208	120.8 Å²	120.8	79%	0.785	64%	0.64	S	S	*	*			trans	-63.4	118.4	160.5	-79.3	-172.3	-179.8	166.1	3.6	107.5	H165 T169	H165-R167 PolarHBondContact O-N 3.49Å; H165-R167 VanDerWaalsContact O-N 3.13Å; R167-T169 PolarHBondContact O-N 2.77Å
168	T	65.8	Low	64.8	Low	113 Å²	113	118.5 Å²	118.5	69%	0.693	63%	0.626	S	S	*	*			trans	-62.9	97.4	173.5	42.8	0	0	0	0	109.9	P166	P166-T168 PolarHBondContact O-N 2.75Å
169	T	82.1	Confident	67.7	Low	97 Å²	97	115.4 Å²	115.4	60%	0.595	60%	0.598	S	S	*	*			trans	-78.7	128.2	174.8	41.6	0	0	0	0	109.5	R167 V178 F179	R167-T169 PolarHBondContact O-N 2.77Å; T169-V178 HydrophobicContact CG2-CG1 4.09Å; T169-F179 WeakPolarHBondContact CA-O 3.2Å
170	L	86.6	Confident	70.2	Confident	58 Å²	58	111.2 Å²	111.2	30%	0.304	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.8	106.2	-173.9	-58.2	179.3	0	0	0	109.6	F179 I185	L170-F179 PolarHBondContact N-O 3.37Å; L170-F179 PolarHBondContact O-N 2.79Å; L170-I185 HydrophobicContact CB-CB 4.4Å; L170-I185 HydrophobicContact CB-CD1 4.01Å; L170-I185 HydrophobicContact CB-CG2 3.99Å; L170-I185 HydrophobicContact CD1-CG2 3.78Å
171	K	88.6	Confident	72.4	Confident	122 Å²	122	109.2 Å²	109.2	53%	0.53	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-72.5	138.2	172.6	-168.3	-176.2	-178.2	-175.5	0	109.9	D176 V178 I185	K171-D176 WeakPolarHBondContact CE-OD1 3.46Å; K171-D176 IonicContact NZ-OD1 2.82Å; K171-D176 PolarHBondContact NZ-OD1 3.22Å; K171-V178 HydrophobicContact CB-CG2 4.32Å; K171-V178 HydrophobicContact CG-CG2 4.23Å; K171-I185 WeakPolarHBondContact O-CD1 3.45Å
172	C	92.2	Very high	74.8	Confident	4 Å²	4	103.6 Å²	103.6	3%	0.027	55%	0.554	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-68.5	136.4	172.1	-170.6	0	0	0	0	110.7	F174 C175 K177 F179 H188	C172-F174 PolarHBondContact O-N 2.82Å; C172-C175 WeakPolarHBondContact CB-O 3.24Å; C172-K177 PolarHBondContact N-O 3.14Å; C172-F179 HydrophobicContact CB-CE2 4.32Å; C172-H188 PolarHBondContact SG-CD2 3.05Å; C172-H188 PolarHBondContact SG-NE2 3.44Å
173	P	88.6	Confident	77.4	Confident	87 Å²	87	99.1 Å²	99.1	57%	0.565	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-13	176.4	28.1	-35.9	0	0	0	113.7
174	F	87.4	Confident	79.7	Confident	133 Å²	133	94.9 Å²	94.9	58%	0.583	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	-6.3	-175.2	-53.1	-62.6	0	0	0	114.4	C172 K189 H192	C172-F174 PolarHBondContact O-N 2.82Å; F174-K189 HydrophobicContact CE2-CG 4.5Å; F174-H192 HydrophobicContact CB-CB 4.17Å; F174-H192 WeakPolarHBondContact CB-ND1 3.4Å; F174-H192 HydrophobicContact CD2-CB 3.78Å; F174-H192 AromaticContact CD2-CD2 3.99Å; F174-H192 AromaticContact CD2-CG 3.9Å; F174-H192 HydrophobicContact CE2-CB 4.45Å; F174-H192 HydrophobicContact CG-CB 4.15Å
175	C	92.1	Very high	82.1	Confident	34 Å²	34	90.4 Å²	90.4	23%	0.23	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.6	163.1	170.2	65.9	0	0	0	0	111.5	C172 K177 H188 H192	C172-C175 WeakPolarHBondContact CB-O 3.24Å; C175-K177 PolarHBondContact O-N 2.85Å; C175-H188 PolarHBondContact SG-NE2 3.02Å; C175-H192 PolarHBondContact SG-NE2 2.76Å
176	D	88.3	Confident	84.1	Confident	124 Å²	124	85 Å²	85	66%	0.663	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	15.8	-174.3	-55.1	-79.8	0	0	0	117	K171	K171-D176 WeakPolarHBondContact CE-OD1 3.46Å; K171-D176 IonicContact NZ-OD1 2.82Å; K171-D176 PolarHBondContact NZ-OD1 3.22Å
177	K	88.8	Confident	86.1	Confident	133 Å²	133	85.1 Å²	85.1	58%	0.578	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	129.3	176	-65.3	-177.3	-178.6	179.8	0	110.4	C172 C175 F179	C172-K177 PolarHBondContact N-O 3.14Å; C175-K177 PolarHBondContact O-N 2.85Å; K177-F179 HydrophobicContact CB-CE2 3.57Å; K177-F179 HydrophobicContact CB-CZ 3.76Å; K177-F179 WeakPolarHBondContact O-CE2 3.27Å
178	V	90.8	Very high	87.9	Confident	84 Å²	84	76.1 Å²	76.1	51%	0.509	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	131.4	-174.7	179.3	0	0	0	0	110	T169 K171	T169-V178 HydrophobicContact CG2-CG1 4.09Å; K171-V178 HydrophobicContact CB-CG2 4.32Å; K171-V178 HydrophobicContact CG-CG2 4.23Å
179	F	91.2	Very high	88.9	Confident	46 Å²	46	75.3 Å²	75.3	20%	0.202	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	154.2	-172.3	-62.2	-87.9	0	0	0	112.3	T169 L170 C172 K177 A184 I185 H188	T169-F179 WeakPolarHBondContact CA-O 3.2Å; L170-F179 PolarHBondContact N-O 3.37Å; L170-F179 PolarHBondContact O-N 2.79Å; C172-F179 HydrophobicContact CB-CE2 4.32Å; K177-F179 HydrophobicContact CB-CE2 3.57Å; K177-F179 HydrophobicContact CB-CZ 3.76Å; K177-F179 WeakPolarHBondContact O-CE2 3.27Å; F179-A184 HydrophobicContact CB-CB 4.15Å; F179-A184 HydrophobicContact CD1-CB 3.86Å; F179-A184 HydrophobicContact CG-CB 4.35Å; F179-I185 HydrophobicContact CB-CB 4.13Å; F179-I185 HydrophobicContact CD2-CB 4.04Å; F179-I185 HydrophobicContact CD2-CG1 4.4Å; F179-I185 HydrophobicContact CG-CB 4.19Å; F179-H188 HydrophobicContact CE1-CB 3.97Å; F179-H188 HydrophobicContact CE2-CB 4.06Å; F179-H188 AromaticContact CE2-CD2 3.13Å; F179-H188 WeakPolarHBondContact CE2-CD2 3.32Å; F179-H188 AromaticContact CE2-CG 3.71Å; F179-H188 AromaticContact CE2-NE2 3.9Å; F179-H188 HydrophobicContact CZ-CB 3.59Å; F179-H188 AromaticContact CZ-CD2 3.26Å; F179-H188 WeakPolarHBondContact CZ-CD2 3.3Å; F179-H188 AromaticContact CZ-CG 3.34Å; F179-H188 AromaticContact CZ-NE2 4Å
180	S	88.8	Confident	89.1	Confident	82 Å²	82	74.1 Å²	74.1	57%	0.573	41%	0.405	S	S	*	.	S	Bend	trans	-93.9	-2.2	-173.6	56.3	0	0	0	0	115.2
181	N	88.9	Confident	89.1	Confident	78 Å²	78	75.1 Å²	75.1	42%	0.417	41%	0.413	S	S	.	.	S	Bend	trans	-161.1	164.2	174.1	60.8	54	0	0	0	111.6	S183 A184 I185	N181-S183 VanDerWaalsContact C-N 3.35Å; N181-S183 PolarHBondContact O-N 3.46Å; N181-S183 PolarHBondContact OD1-N 3.35Å; N181-A184 PolarHBondContact O-N 2.86Å; N181-A184 VanDerWaalsContact OD1-CB 3.3Å; N181-A184 WeakPolarHBondContact OD1-CB 3.48Å; N181-A184 PolarHBondContact OD1-N 2.96Å; N181-I185 PolarHBondContact O-N 3.27Å
182	S	90.1	Very high	89	Confident	83 Å²	83	72.6 Å²	72.6	58%	0.58	40%	0.403	S	S	*	.	H	α-helix	trans	-60.5	-39.8	-179.4	-170.1	0	0	0	0	112.8	A184 I185 A186	S182-A184 VanDerWaalsContact C-N 3.32Å; S182-A184 PolarHBondContact O-N 3.08Å; S182-I185 WeakPolarHBondContact O-CG2 3.38Å; S182-I185 PolarHBondContact O-N 3.25Å; S182-A186 WeakPolarHBondContact O-CB 3.34Å; S182-A186 PolarHBondContact O-N 2.88Å
183	S	88.5	Confident	88.6	Confident	80 Å²	80	74.3 Å²	74.3	56%	0.559	42%	0.416	S	S	*	.	H	α-helix	trans	-64	-34	-178	-43.8	0	0	0	0	113.2	N181 K187	N181-S183 VanDerWaalsContact C-N 3.35Å; N181-S183 PolarHBondContact O-N 3.46Å; N181-S183 PolarHBondContact OD1-N 3.35Å; S183-K187 WeakPolarHBondContact O-CB 3.41Å; S183-K187 WeakPolarHBondContact O-CG 2.92Å; S183-K187 PolarHBondContact O-N 2.83Å
184	A	89.2	Confident	88.2	Confident	32 Å²	32	77.9 Å²	77.9	26%	0.264	43%	0.425	S	S	.	.	H	α-helix	trans	-74.6	-43.5	178.2	0	0	0	0	0	112	F179 N181 S182 A186 K187 H188	F179-A184 HydrophobicContact CB-CB 4.15Å; F179-A184 HydrophobicContact CD1-CB 3.86Å; F179-A184 HydrophobicContact CG-CB 4.35Å; N181-A184 PolarHBondContact O-N 2.86Å; N181-A184 VanDerWaalsContact OD1-CB 3.3Å; N181-A184 WeakPolarHBondContact OD1-CB 3.48Å; N181-A184 PolarHBondContact OD1-N 2.96Å; S182-A184 VanDerWaalsContact C-N 3.32Å; S182-A184 PolarHBondContact O-N 3.08Å; A184-A186 VanDerWaalsContact C-N 3.34Å; A184-K187 PolarHBondContact O-N 3.48Å; A184-H188 WeakPolarHBondContact O-CB 3.38Å; A184-H188 PolarHBondContact O-N 3.4Å
185	I	92.3	Very high	88	Confident	16 Å²	16	76.7 Å²	76.7	8%	0.082	42%	0.421	C	S	.	.	H	α-helix	trans	-65.6	-36	172.4	-178.3	174.5	0	0	0	111.4	L170 K171 F179 N181 S182 H188 K189	L170-I185 HydrophobicContact CB-CB 4.4Å; L170-I185 HydrophobicContact CB-CD1 4.01Å; L170-I185 HydrophobicContact CB-CG2 3.99Å; L170-I185 HydrophobicContact CD1-CG2 3.78Å; K171-I185 WeakPolarHBondContact O-CD1 3.45Å; F179-I185 HydrophobicContact CB-CB 4.13Å; F179-I185 HydrophobicContact CD2-CB 4.04Å; F179-I185 HydrophobicContact CD2-CG1 4.4Å; F179-I185 HydrophobicContact CG-CB 4.19Å; N181-I185 PolarHBondContact O-N 3.27Å; S182-I185 WeakPolarHBondContact O-CG2 3.38Å; S182-I185 PolarHBondContact O-N 3.25Å; I185-H188 CarbonylContact O-C 3.6Å; I185-H188 PolarHBondContact O-N 2.87Å; I185-K189 HydrophobicContact CG1-CG 4.39Å; I185-K189 WeakPolarHBondContact O-CG 3.43Å; I185-K189 PolarHBondContact O-N 3.47Å
186	A	88.4	Confident	87.8	Confident	51 Å²	51	81.7 Å²	81.7	42%	0.421	44%	0.435	S	S	.	.	H	α-helix	trans	-62.3	-50.9	173.8	0	0	0	0	0	111.9	S182 A184 H188 K189 L190	S182-A186 WeakPolarHBondContact O-CB 3.34Å; S182-A186 PolarHBondContact O-N 2.88Å; A184-A186 VanDerWaalsContact C-N 3.34Å; A186-H188 PolarHBondContact O-N 3.15Å; A186-K189 PolarHBondContact O-N 3.33Å; A186-L190 PolarHBondContact O-N 3Å
187	K	87.3	Confident	87.8	Confident	122 Å²	122	82.2 Å²	82.2	53%	0.53	43%	0.431	S	S	.	.	H	α-helix	trans	-60.7	-26.8	174.5	-73.7	179.7	-178.6	-173.7	0	113	S183 A184	S183-K187 WeakPolarHBondContact O-CB 3.41Å; S183-K187 WeakPolarHBondContact O-CG 2.92Å; S183-K187 PolarHBondContact O-N 2.83Å; A184-K187 PolarHBondContact O-N 3.48Å
188	H	89.6	Confident	87.9	Confident	19 Å²	19	80.2 Å²	80.2	9%	0.088	42%	0.421	C	S	.	.	H	α-helix	trans	-83.7	-33.1	174.2	171.9	49.6	0	0	0	113.9	C172 C175 F179 A184 I185 A186 L190 T191 H192	C172-H188 PolarHBondContact SG-CD2 3.05Å; C172-H188 PolarHBondContact SG-NE2 3.44Å; C175-H188 PolarHBondContact SG-NE2 3.02Å; F179-H188 HydrophobicContact CE1-CB 3.97Å; F179-H188 HydrophobicContact CE2-CB 4.06Å; F179-H188 AromaticContact CE2-CD2 3.13Å; F179-H188 WeakPolarHBondContact CE2-CD2 3.32Å; F179-H188 AromaticContact CE2-CG 3.71Å; F179-H188 AromaticContact CE2-NE2 3.9Å; F179-H188 HydrophobicContact CZ-CB 3.59Å; F179-H188 AromaticContact CZ-CD2 3.26Å; F179-H188 WeakPolarHBondContact CZ-CD2 3.3Å; F179-H188 AromaticContact CZ-CG 3.34Å; F179-H188 AromaticContact CZ-NE2 4Å; A184-H188 WeakPolarHBondContact O-CB 3.38Å; A184-H188 PolarHBondContact O-N 3.4Å; I185-H188 CarbonylContact O-C 3.6Å; I185-H188 PolarHBondContact O-N 2.87Å; A186-H188 PolarHBondContact O-N 3.15Å; H188-L190 PolarHBondContact O-N 3.14Å; H188-T191 PolarHBondContact CE1-OG1 3.48Å; H188-T191 PolarHBondContact ND1-OG1 3.09Å; H188-T191 WeakPolarHBondContact O-CB 3.43Å; H188-T191 PolarHBondContact O-N 3Å; H188-T191 PolarHBondContact O-OG1 3.31Å; H188-H192 AromaticContact CE1-CD2 3.61Å; H188-H192 AromaticContact CE1-NE2 3.16Å; H188-H192 PolarHBondContact CE1-NE2 3.38Å; H188-H192 AromaticContact NE2-CD2 3.68Å; H188-H192 AromaticContact NE2-NE2 3.16Å; H188-H192 PolarHBondContact NE2-NE2 2.94Å; H188-H192 VanDerWaalsContact NE2-NE2 3.16Å
189	K	87.9	Confident	87.8	Confident	97 Å²	97	80.8 Å²	80.8	42%	0.422	42%	0.42	S	S	.	.	H	α-helix	trans	-56.8	-33.8	172.6	-79	177.3	176.9	-174.8	0	111.3	F174 I185 A186 T191 H192 S193	F174-K189 HydrophobicContact CE2-CG 4.5Å; I185-K189 HydrophobicContact CG1-CG 4.39Å; I185-K189 WeakPolarHBondContact O-CG 3.43Å; I185-K189 PolarHBondContact O-N 3.47Å; A186-K189 PolarHBondContact O-N 3.33Å; K189-T191 PolarHBondContact O-N 2.92Å; K189-H192 PolarHBondContact O-N 2.82Å; K189-S193 PolarHBondContact O-N 2.8Å
190	L	86.5	Confident	87.9	Confident	71 Å²	71	78.6 Å²	78.6	37%	0.372	41%	0.411	S	S	.	.	H	α-helix	trans	-59.2	-23.8	170.8	-61.9	176.8	0	0	0	114.1	A186 H188 H192 K208 R209	A186-L190 PolarHBondContact O-N 3Å; H188-L190 PolarHBondContact O-N 3.14Å; L190-H192 VanDerWaalsContact C-N 3.3Å; L190-K208 WeakPolarHBondContact O-CD 3.46Å; L190-R209 HydrophobicContact CD1-CG 4.13Å
191	T	85.3	Confident	87.9	Confident	79 Å²	79	81.1 Å²	81.1	49%	0.485	42%	0.416	S	S	.	.	H	α-helix	trans	-73	-27	175.5	68.1	0	0	0	0	112.3	H188 K189 K208	H188-T191 PolarHBondContact CE1-OG1 3.48Å; H188-T191 PolarHBondContact ND1-OG1 3.09Å; H188-T191 WeakPolarHBondContact O-CB 3.43Å; H188-T191 PolarHBondContact O-N 3Å; H188-T191 PolarHBondContact O-OG1 3.31Å; K189-T191 PolarHBondContact O-N 2.92Å; T191-K208 PolarHBondContact O-NZ 3.37Å
192	H	87.7	Confident	87.9	Confident	69 Å²	69	82 Å²	82	32%	0.319	42%	0.424	S	S	.	.	H	α-helix	trans	-84.7	-34.1	178.8	-68.2	-76.9	0	0	0	113.5	F174 C175 H188 K189 L190	F174-H192 HydrophobicContact CB-CB 4.17Å; F174-H192 WeakPolarHBondContact CB-ND1 3.4Å; F174-H192 HydrophobicContact CD2-CB 3.78Å; F174-H192 AromaticContact CD2-CD2 3.99Å; F174-H192 AromaticContact CD2-CG 3.9Å; F174-H192 HydrophobicContact CE2-CB 4.45Å; F174-H192 HydrophobicContact CG-CB 4.15Å; C175-H192 PolarHBondContact SG-NE2 2.76Å; H188-H192 AromaticContact CE1-CD2 3.61Å; H188-H192 AromaticContact CE1-NE2 3.16Å; H188-H192 PolarHBondContact CE1-NE2 3.38Å; H188-H192 AromaticContact NE2-CD2 3.68Å; H188-H192 AromaticContact NE2-NE2 3.16Å; H188-H192 PolarHBondContact NE2-NE2 2.94Å; H188-H192 VanDerWaalsContact NE2-NE2 3.16Å; K189-H192 PolarHBondContact O-N 2.82Å; L190-H192 VanDerWaalsContact C-N 3.3Å
193	S	82.7	Confident	88	Confident	41 Å²	41	80.2 Å²	80.2	29%	0.287	41%	0.411	S	S	.	.	S	Bend	trans	-66.2	138.4	169.4	-179.3	0	0	0	0	110.6	K189 E195 K208	K189-S193 PolarHBondContact O-N 2.8Å; S193-E195 VanDerWaalsContact C-N 3.28Å; S193-E195 WeakPolarHBondContact OG-CB 3.34Å; S193-E195 VanDerWaalsContact OG-CG 3.32Å; S193-E195 WeakPolarHBondContact OG-CG 3.49Å; S193-E195 PolarHBondContact OG-N 3.49Å; S193-E195 PolarHBondContact OG-OE2 3.28Å; S193-K208 WeakPolarHBondContact O-CD 3.4Å; S193-K208 WeakPolarHBondContact O-CE 3.37Å; S193-K208 PolarHBondContact O-NZ 3.3Å
194	E	79.7	Confident	88	Confident	162 Å²	162	83.1 Å²	83.1	76%	0.757	42%	0.416	S	S	*	.			trans	-78.1	-15.2	175.3	-59.1	-162	141.1	0	0	113.2	R196	E194-R196 PolarHBondContact O-N 2.93Å
195	E	83.4	Confident	88.1	Confident	107 Å²	107	87.9 Å²	87.9	50%	0.5	43%	0.431	S	S	.	.			trans	-57.1	117.8	-179.7	-62.6	175.8	130.9	0	0	112.4	S193 K197	S193-E195 VanDerWaalsContact C-N 3.28Å; S193-E195 WeakPolarHBondContact OG-CB 3.34Å; S193-E195 VanDerWaalsContact OG-CG 3.32Å; S193-E195 WeakPolarHBondContact OG-CG 3.49Å; S193-E195 PolarHBondContact OG-N 3.49Å; S193-E195 PolarHBondContact OG-OE2 3.28Å; E195-K197 HydrophobicContact CB-CG 4.23Å; E195-K197 WeakPolarHBondContact OE1-CE 3.42Å; E195-K197 IonicContact OE1-NZ 2.96Å; E195-K197 PolarHBondContact OE1-NZ 3Å; E195-K197 WeakPolarHBondContact OE2-CE 3.48Å; E195-K197 IonicContact OE2-NZ 2.86Å; E195-K197 PolarHBondContact OE2-NZ 3.31Å
196	R	87.6	Confident	88	Confident	139 Å²	139	88.8 Å²	88.8	53%	0.525	44%	0.44	S	S	.	.			trans	-109.3	73.1	176.2	-71.8	166.3	166.8	96.7	-15.5	110.2	E194 Y198 A206 F207 K208	E194-R196 PolarHBondContact O-N 2.93Å; R196-Y198 PolarHBondContact O-N 3.46Å; R196-Y198 VanDerWaalsContact O-N 3.11Å; R196-A206 HydrophobicContact CB-CB 3.52Å; R196-A206 VanDerWaalsContact CD-O 3.3Å; R196-A206 WeakPolarHBondContact CD-O 3.44Å; R196-A206 HydrophobicContact CG-CB 4.36Å; R196-F207 CarbonylContact C-O 3.33Å; R196-F207 WeakPolarHBondContact CA-O 3.46Å; R196-K208 HydrophobicContact CG-CG 3.85Å
197	K	88.6	Confident	88.1	Confident	135 Å²	135	88.5 Å²	88.5	59%	0.587	43%	0.43	S	S	*	.			trans	-66.3	-12.6	-168.7	-53.3	-164.2	-178.7	-166.6	0	115.3	E195 F207	E195-K197 HydrophobicContact CB-CG 4.23Å; E195-K197 WeakPolarHBondContact OE1-CE 3.42Å; E195-K197 IonicContact OE1-NZ 2.96Å; E195-K197 PolarHBondContact OE1-NZ 3Å; E195-K197 WeakPolarHBondContact OE2-CE 3.48Å; E195-K197 IonicContact OE2-NZ 2.86Å; E195-K197 PolarHBondContact OE2-NZ 3.31Å; K197-F207 PolarHBondContact N-O 3.44Å
198	Y	90.9	Very high	88.2	Confident	91 Å²	91	85.5 Å²	85.5	36%	0.357	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	95	-172.5	-55.1	-79.3	0	0	0	110	R196 F207 R209 Q210	R196-Y198 PolarHBondContact O-N 3.46Å; R196-Y198 VanDerWaalsContact O-N 3.11Å; Y198-F207 PolarHBondContact N-O 3.28Å; Y198-F207 VanDerWaalsContact N-O 3.12Å; Y198-F207 WeakPolarHBondContact O-CD2 3.34Å; Y198-F207 PolarHBondContact O-N 2.97Å; Y198-R209 VanDerWaalsContact CD2-CA 3.46Å; Y198-Q210 HydrophobicContact CD1-CB 3.79Å; Y198-Q210 HydrophobicContact CD1-CG 4.39Å; Y198-Q210 HydrophobicContact CE1-CB 3.68Å; Y198-Q210 HydrophobicContact CE1-CG 4.42Å; Y198-Q210 HydrophobicContact CG-CB 4.27Å
199	I	89.7	Confident	88.2	Confident	96 Å²	96	88.1 Å²	88.1	49%	0.492	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	136.7	-175	-54.9	179.5	0	0	0	110.4	H204 A206 L213	I199-H204 HydrophobicContact CG2-CB 4.43Å; I199-A206 HydrophobicContact CG1-CB 3.93Å; I199-L213 WeakPolarHBondContact O-CD2 3.37Å
200	C	93	Very high	88.3	Confident	1 Å²	1	87.6 Å²	87.6	1%	0.007	43%	0.425	C	S	.	.			trans	-78.3	122.7	170.2	-169.4	0	0	0	0	111	V202 H204 K205 L213 H220	C200-V202 PolarHBondContact O-N 3.2Å; C200-H204 WeakPolarHBondContact O-CA 3.46Å; C200-H204 PolarHBondContact O-N 3.39Å; C200-K205 PolarHBondContact N-O 3.44Å; C200-L213 HydrophobicContact CB-CD1 3.61Å; C200-H220 PolarHBondContact SG-CD2 3.36Å; C200-H220 PolarHBondContact SG-NE2 2.95Å
201	I	88.7	Confident	88.2	Confident	135 Å²	135	88.1 Å²	88.1	69%	0.692	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-21.3	179.8	62.5	177.4	0	0	0	113.9	H204	I201-H204 PolarHBondContact O-CE1 3.38Å
202	V	88.2	Confident	88.4	Confident	95 Å²	95	88.7 Å²	88.7	58%	0.576	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-25.6	-173.3	-169.5	0	0	0	0	113.4	C200 H220	C200-V202 PolarHBondContact O-N 3.2Å; V202-H220 HydrophobicContact CB-CB 4.27Å; V202-H220 HydrophobicContact CG1-CB 3.96Å; V202-H220 HydrophobicContact CG2-CB 4.37Å
203	C	92.3	Very high	88.6	Confident	47 Å²	47	86 Å²	86	32%	0.318	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.6	13.1	178.3	74.5	0	0	0	0	114.7	K205 H216 H220	C203-K205 PolarHBondContact O-N 2.94Å; C203-K205 VanDerWaalsContact SG-CG 3.59Å; C203-H216 PolarHBondContact SG-NE2 3.47Å; C203-H220 PolarHBondContact SG-CE1 3.47Å; C203-H220 PolarHBondContact SG-NE2 2.91Å
204	H	89.3	Confident	88.9	Confident	141 Å²	141	87.2 Å²	87.2	65%	0.653	42%	0.416	S	S	*	.			trans	55	11.6	178.2	-50.3	-63.7	0	0	0	116.4	I199 C200 I201 A206	I199-H204 HydrophobicContact CG2-CB 4.43Å; C200-H204 WeakPolarHBondContact O-CA 3.46Å; C200-H204 PolarHBondContact O-N 3.39Å; I201-H204 PolarHBondContact O-CE1 3.38Å; H204-A206 PolarHBondContact O-N 3Å
205	K	90.4	Very high	89.1	Confident	132 Å²	132	81 Å²	81	57%	0.574	40%	0.396	S	S	*	.			trans	-62.9	125	171.8	-73.9	-178.8	-177.5	178.4	0	110.1	C200 C203 F207	C200-K205 PolarHBondContact N-O 3.44Å; C203-K205 PolarHBondContact O-N 2.94Å; C203-K205 VanDerWaalsContact SG-CG 3.59Å; K205-F207 HydrophobicContact CB-CE2 3.86Å; K205-F207 HydrophobicContact CB-CZ 4.14Å; K205-F207 WeakPolarHBondContact O-CD2 3.43Å; K205-F207 WeakPolarHBondContact O-CE2 3.5Å
206	A	91.7	Very high	89.3	Confident	34 Å²	34	77 Å²	77	28%	0.281	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	131.9	-173.3	0	0	0	0	0	111.6	R196 I199 H204	R196-A206 HydrophobicContact CB-CB 3.52Å; R196-A206 VanDerWaalsContact CD-O 3.3Å; R196-A206 WeakPolarHBondContact CD-O 3.44Å; R196-A206 HydrophobicContact CG-CB 4.36Å; I199-A206 HydrophobicContact CG1-CB 3.93Å; H204-A206 PolarHBondContact O-N 3Å
207	F	90.6	Very high	89.2	Confident	46 Å²	46	74.4 Å²	74.4	20%	0.202	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	147.3	-173.7	-61.9	-93.2	0	0	0	111.4	R196 K197 Y198 K205 R209 H212 L213 H216	R196-F207 CarbonylContact C-O 3.33Å; R196-F207 WeakPolarHBondContact CA-O 3.46Å; K197-F207 PolarHBondContact N-O 3.44Å; Y198-F207 PolarHBondContact N-O 3.28Å; Y198-F207 VanDerWaalsContact N-O 3.12Å; Y198-F207 WeakPolarHBondContact O-CD2 3.34Å; Y198-F207 PolarHBondContact O-N 2.97Å; K205-F207 HydrophobicContact CB-CE2 3.86Å; K205-F207 HydrophobicContact CB-CZ 4.14Å; K205-F207 WeakPolarHBondContact O-CD2 3.43Å; K205-F207 WeakPolarHBondContact O-CE2 3.5Å; F207-R209 VanDerWaalsContact C-N 3.28Å; F207-R209 PolarHBondContact O-N 2.82Å; F207-H212 HydrophobicContact CB-CB 4.32Å; F207-H212 HydrophobicContact CD1-CB 3.77Å; F207-H212 HydrophobicContact CG-CB 4.33Å; F207-L213 HydrophobicContact CB-CB 4.42Å; F207-L213 HydrophobicContact CD2-CB 4.1Å; F207-L213 HydrophobicContact CD2-CD1 4.08Å; F207-L213 HydrophobicContact CE2-CD1 4.25Å; F207-L213 HydrophobicContact CG-CB 4.38Å; F207-H216 HydrophobicContact CE1-CB 4.16Å; F207-H216 HydrophobicContact CE2-CB 4.09Å; F207-H216 AromaticContact CE2-CD2 3.24Å; F207-H216 WeakPolarHBondContact CE2-CD2 3.5Å; F207-H216 AromaticContact CE2-CG 3.78Å; F207-H216 AromaticContact CE2-NE2 3.98Å; F207-H216 HydrophobicContact CZ-CB 3.61Å; F207-H216 AromaticContact CZ-CD2 3.33Å; F207-H216 WeakPolarHBondContact CZ-CD2 3.27Å; F207-H216 AromaticContact CZ-CG 3.39Å
208	K	89.2	Confident	88.9	Confident	59 Å²	59	71.7 Å²	71.7	26%	0.257	36%	0.356	S	S	.	.	S	Bend	trans	-78.8	-7.6	177.2	-53.1	-160.2	-171.7	-171.3	0	113.7	L190 T191 S193 R196	L190-K208 WeakPolarHBondContact O-CD 3.46Å; T191-K208 PolarHBondContact O-NZ 3.37Å; S193-K208 WeakPolarHBondContact O-CD 3.4Å; S193-K208 WeakPolarHBondContact O-CE 3.37Å; S193-K208 PolarHBondContact O-NZ 3.3Å; R196-K208 HydrophobicContact CG-CG 3.85Å
209	R	89.8	Confident	88.5	Confident	73 Å²	73	71.5 Å²	71.5	28%	0.275	37%	0.365	S	S	.	.	S	Bend	trans	-147.9	143.8	-179.3	-69.3	163.7	51	172.8	-4.9	112	L190 Y198 F207 D211 H212 L213	L190-R209 HydrophobicContact CD1-CG 4.13Å; Y198-R209 VanDerWaalsContact CD2-CA 3.46Å; F207-R209 VanDerWaalsContact C-N 3.28Å; F207-R209 PolarHBondContact O-N 2.82Å; R209-D211 WeakPolarHBondContact CB-OD1 3.49Å; R209-D211 IonicContact CZ-OD1 3.16Å; R209-D211 IonicContact CZ-OD2 3.62Å; R209-D211 IonicContact NE-OD1 2.82Å; R209-D211 PolarHBondContact NE-OD1 3.43Å; R209-D211 IonicContact NE-OD2 3.71Å; R209-D211 IonicContact NH2-OD1 2.7Å; R209-D211 PolarHBondContact NH2-OD1 3.33Å; R209-D211 VanDerWaalsContact NH2-OD1 3.08Å; R209-D211 IonicContact NH2-OD2 2.78Å; R209-D211 PolarHBondContact NH2-OD2 3.37Å; R209-D211 PolarHBondContact O-N 3.46Å; R209-H212 PolarHBondContact O-N 2.93Å; R209-L213 PolarHBondContact O-N 3.11Å
210	Q	89.6	Confident	88.1	Confident	86 Å²	86	70.1 Å²	70.1	40%	0.402	36%	0.356	S	S	.	.	H	α-helix	trans	-61.5	-36.5	179.2	-176.8	65.3	-19.4	0	0	113.8	Y198 H212 L213 N214	Y198-Q210 HydrophobicContact CD1-CB 3.79Å; Y198-Q210 HydrophobicContact CD1-CG 4.39Å; Y198-Q210 HydrophobicContact CE1-CB 3.68Å; Y198-Q210 HydrophobicContact CE1-CG 4.42Å; Y198-Q210 HydrophobicContact CG-CB 4.27Å; Q210-H212 VanDerWaalsContact C-N 3.26Å; Q210-H212 PolarHBondContact O-N 2.86Å; Q210-L213 PolarHBondContact O-N 2.93Å; Q210-L213 VanDerWaalsContact O-N 3.14Å; Q210-N214 PolarHBondContact O-N 3.32Å
211	D	84.6	Confident	87.1	Confident	82 Å²	82	74.6 Å²	74.6	44%	0.439	38%	0.377	S	S	.	.	H	α-helix	trans	-68	-27	-179	65.2	-69.6	0	0	0	112.9	R209 G215	R209-D211 WeakPolarHBondContact CB-OD1 3.49Å; R209-D211 IonicContact CZ-OD1 3.16Å; R209-D211 IonicContact CZ-OD2 3.62Å; R209-D211 IonicContact NE-OD1 2.82Å; R209-D211 PolarHBondContact NE-OD1 3.43Å; R209-D211 IonicContact NE-OD2 3.71Å; R209-D211 IonicContact NH2-OD1 2.7Å; R209-D211 PolarHBondContact NH2-OD1 3.33Å; R209-D211 VanDerWaalsContact NH2-OD1 3.08Å; R209-D211 IonicContact NH2-OD2 2.78Å; R209-D211 PolarHBondContact NH2-OD2 3.37Å; R209-D211 PolarHBondContact O-N 3.46Å; D211-G215 PolarHBondContact O-N 2.86Å; D211-G215 VanDerWaalsContact O-N 3.15Å
212	H	88.7	Confident	86.1	Confident	92 Å²	92	73 Å²	73	43%	0.426	38%	0.377	S	S	.	.	H	α-helix	trans	-76	-34.6	171.4	-61.1	-34.9	0	0	0	112.4	F207 R209 Q210 H216	F207-H212 HydrophobicContact CB-CB 4.32Å; F207-H212 HydrophobicContact CD1-CB 3.77Å; F207-H212 HydrophobicContact CG-CB 4.33Å; R209-H212 PolarHBondContact O-N 2.93Å; Q210-H212 VanDerWaalsContact C-N 3.26Å; Q210-H212 PolarHBondContact O-N 2.86Å; H212-H216 VanDerWaalsContact O-CB 3.31Å; H212-H216 WeakPolarHBondContact O-CB 3.48Å; H212-H216 PolarHBondContact O-N 3.26Å; H212-H216 VanDerWaalsContact O-N 3.15Å
213	L	92.6	Very high	85	Confident	11 Å²	11	77.5 Å²	77.5	6%	0.058	38%	0.384	C	S	.	.	H	α-helix	trans	-64.9	-47.3	171.4	172.4	57.9	0	0	0	111.1	I199 C200 F207 R209 Q210 G215 H216 K217	I199-L213 WeakPolarHBondContact O-CD2 3.37Å; C200-L213 HydrophobicContact CB-CD1 3.61Å; F207-L213 HydrophobicContact CB-CB 4.42Å; F207-L213 HydrophobicContact CD2-CB 4.1Å; F207-L213 HydrophobicContact CD2-CD1 4.08Å; F207-L213 HydrophobicContact CE2-CD1 4.25Å; F207-L213 HydrophobicContact CG-CB 4.38Å; R209-L213 PolarHBondContact O-N 3.11Å; Q210-L213 PolarHBondContact O-N 2.93Å; Q210-L213 VanDerWaalsContact O-N 3.14Å; L213-G215 PolarHBondContact O-N 3.44Å; L213-H216 CarbonylContact O-C 3.2Å; L213-H216 WeakPolarHBondContact O-CA 3.46Å; L213-H216 WeakPolarHBondContact O-CB 3.33Å; L213-H216 PolarHBondContact O-N 3.04Å; L213-K217 HydrophobicContact CD1-CG 4.46Å; L213-K217 PolarHBondContact O-N 3.15Å
214	N	88.1	Confident	84.2	Confident	68 Å²	68	81 Å²	81	36%	0.364	39%	0.394	S	S	.	.	H	α-helix	trans	-60.6	-45.7	179.7	-73.4	0	0	0	0	111.8	Q210 H216 K217	Q210-N214 PolarHBondContact O-N 3.32Å; N214-H216 PolarHBondContact O-N 3.19Å; N214-K217 PolarHBondContact O-N 3.11Å
215	G	83.7	Confident	83.7	Confident	32 Å²	32	77.5 Å²	77.5	33%	0.33	38%	0.383	S	S	.	.	H	α-helix	trans	-63.7	-23.2	174.3	0	0	0	0	0	114.2	D211 L213	D211-G215 PolarHBondContact O-N 2.86Å; D211-G215 VanDerWaalsContact O-N 3.15Å; L213-G215 PolarHBondContact O-N 3.44Å
216	H	87.6	Confident	83.3	Confident	23 Å²	23	73.8 Å²	73.8	11%	0.106	37%	0.368	C	S	.	.	H	α-helix	trans	-83.9	-29	175.5	168.9	56.6	0	0	0	113.6	C203 F207 H212 L213 N214 Y218 T219 H220	C203-H216 PolarHBondContact SG-NE2 3.47Å; F207-H216 HydrophobicContact CE1-CB 4.16Å; F207-H216 HydrophobicContact CE2-CB 4.09Å; F207-H216 AromaticContact CE2-CD2 3.24Å; F207-H216 WeakPolarHBondContact CE2-CD2 3.5Å; F207-H216 AromaticContact CE2-CG 3.78Å; F207-H216 AromaticContact CE2-NE2 3.98Å; F207-H216 HydrophobicContact CZ-CB 3.61Å; F207-H216 AromaticContact CZ-CD2 3.33Å; F207-H216 WeakPolarHBondContact CZ-CD2 3.27Å; F207-H216 AromaticContact CZ-CG 3.39Å; H212-H216 VanDerWaalsContact O-CB 3.31Å; H212-H216 WeakPolarHBondContact O-CB 3.48Å; H212-H216 PolarHBondContact O-N 3.26Å; H212-H216 VanDerWaalsContact O-N 3.15Å; L213-H216 CarbonylContact O-C 3.2Å; L213-H216 WeakPolarHBondContact O-CA 3.46Å; L213-H216 WeakPolarHBondContact O-CB 3.33Å; L213-H216 PolarHBondContact O-N 3.04Å; N214-H216 PolarHBondContact O-N 3.19Å; H216-Y218 PolarHBondContact O-N 2.96Å; H216-T219 PolarHBondContact CE1-OG1 3.24Å; H216-T219 VanDerWaalsContact CE1-OG1 3.31Å; H216-T219 PolarHBondContact ND1-OG1 3.1Å; H216-T219 WeakPolarHBondContact O-CB 3.35Å; H216-T219 PolarHBondContact O-N 3.24Å; H216-T219 PolarHBondContact O-OG1 3.4Å; H216-H220 AromaticContact CD2-NE2 3.98Å; H216-H220 AromaticContact CE1-CE1 3.82Å; H216-H220 AromaticContact CE1-NE2 3.17Å; H216-H220 PolarHBondContact CE1-NE2 2.95Å; H216-H220 AromaticContact NE2-CD2 3.95Å; H216-H220 AromaticContact NE2-CE1 3.97Å; H216-H220 AromaticContact NE2-NE2 3.06Å; H216-H220 PolarHBondContact NE2-NE2 3.31Å
217	K	86.8	Confident	82.9	Confident	83 Å²	83	74.4 Å²	74.4	36%	0.361	37%	0.374	S	S	.	.	H	α-helix	trans	-54.5	-41.6	177.5	-74.2	-169.5	174.1	-167.7	0	112.5	L213 N214 T219 H220 E221	L213-K217 HydrophobicContact CD1-CG 4.46Å; L213-K217 PolarHBondContact O-N 3.15Å; N214-K217 PolarHBondContact O-N 3.11Å; K217-T219 PolarHBondContact O-N 3.3Å; K217-H220 PolarHBondContact O-N 2.81Å; K217-E221 PolarHBondContact O-N 3.38Å
218	Y	81.7	Confident	82.8	Confident	78 Å²	78	72.9 Å²	72.9	31%	0.306	37%	0.368	S	S	.	.	H	α-helix	trans	-58.2	-17.3	173.9	-56	-49	0	0	0	115.1	H216 H220 S222 R223 P225	H216-Y218 PolarHBondContact O-N 2.96Å; Y218-H220 VanDerWaalsContact C-N 3.33Å; Y218-S222 PolarHBondContact O-N 2.99Å; Y218-R223 WeakPolarHBondContact CB-O 3.49Å; Y218-P225 HydrophobicContact CD1-CG 4.16Å; Y218-P225 HydrophobicContact CD2-CG 4.27Å; Y218-P225 HydrophobicContact CE1-CG 3.87Å; Y218-P225 HydrophobicContact CE2-CG 3.97Å; Y218-P225 HydrophobicContact CG-CG 4.36Å
219	T	81.8	Confident	82.4	Confident	88 Å²	88	75.7 Å²	75.7	54%	0.54	38%	0.382	S	S	.	.	H	α-helix	trans	-79.2	-15.1	173.8	67.3	0	0	0	0	113.5	H216 K217	H216-T219 PolarHBondContact CE1-OG1 3.24Å; H216-T219 VanDerWaalsContact CE1-OG1 3.31Å; H216-T219 PolarHBondContact ND1-OG1 3.1Å; H216-T219 WeakPolarHBondContact O-CB 3.35Å; H216-T219 PolarHBondContact O-N 3.24Å; H216-T219 PolarHBondContact O-OG1 3.4Å; K217-T219 PolarHBondContact O-N 3.3Å
220	H	82.8	Confident	82	Confident	67 Å²	67	76.4 Å²	76.4	31%	0.31	39%	0.387	S	S	.	.	H	α-helix	trans	-93.7	-45.8	171.5	-61.4	-62	0	0	0	111.9	C200 V202 C203 H216 K217 Y218 S222	C200-H220 PolarHBondContact SG-CD2 3.36Å; C200-H220 PolarHBondContact SG-NE2 2.95Å; V202-H220 HydrophobicContact CB-CB 4.27Å; V202-H220 HydrophobicContact CG1-CB 3.96Å; V202-H220 HydrophobicContact CG2-CB 4.37Å; C203-H220 PolarHBondContact SG-CE1 3.47Å; C203-H220 PolarHBondContact SG-NE2 2.91Å; H216-H220 AromaticContact CD2-NE2 3.98Å; H216-H220 AromaticContact CE1-CE1 3.82Å; H216-H220 AromaticContact CE1-NE2 3.17Å; H216-H220 PolarHBondContact CE1-NE2 2.95Å; H216-H220 AromaticContact NE2-CD2 3.95Å; H216-H220 AromaticContact NE2-CE1 3.97Å; H216-H220 AromaticContact NE2-NE2 3.06Å; H216-H220 PolarHBondContact NE2-NE2 3.31Å; K217-H220 PolarHBondContact O-N 2.81Å; Y218-H220 VanDerWaalsContact C-N 3.33Å; H220-S222 PolarHBondContact O-N 3.34Å; H220-S222 VanDerWaalsContact O-N 3.13Å
221	E	72	Confident	81.9	Confident	95 Å²	95	74 Å²	74	44%	0.444	38%	0.38	S	S	.	.	H	α-helix	trans	-67.4	-13.3	-177.8	-66.4	164.2	-144.9	0	0	112.6	K217 R223	K217-E221 PolarHBondContact O-N 3.38Å; E221-R223 HydrophobicContact CB-CB 4.23Å; E221-R223 PolarHBondContact O-N 3.4Å
222	S	66.5	Low	81.9	Confident	100 Å²	100	78 Å²	78	70%	0.699	40%	0.401	S	S	*	.			trans	57.7	-19.1	-169.2	75.9	0	0	0	0	115.9	Y218 H220 K224	Y218-S222 PolarHBondContact O-N 2.99Å; H220-S222 PolarHBondContact O-N 3.34Å; H220-S222 VanDerWaalsContact O-N 3.13Å; S222-K224 PolarHBondContact O-N 3.12Å
223	R	65.9	Low	81.7	Confident	191 Å²	191	79.3 Å²	79.3	72%	0.721	41%	0.405	S	S	*	.			trans	-58.3	116.4	169.8	-70.3	-179.9	174.7	-123.9	-5.2	110.4	Y218 E221 P225	Y218-R223 WeakPolarHBondContact CB-O 3.49Å; E221-R223 HydrophobicContact CB-CB 4.23Å; E221-R223 PolarHBondContact O-N 3.4Å; R223-P225 WeakPolarHBondContact O-CD 3.45Å
224	K	75.7	Confident	81.3	Confident	119 Å²	119	80.7 Å²	80.7	52%	0.517	42%	0.416	S	S	.	.			trans	-104.5	98.5	172.9	-65.7	-176.9	-162.2	166.6	0	108.1	S222 H226 S234 Y235	S222-K224 PolarHBondContact O-N 3.12Å; K224-H226 PolarHBondContact O-N 3.31Å; K224-S234 WeakPolarHBondContact CD-O 3.41Å; K224-Y235 CarbonylContact C-O 3.56Å; K224-Y235 WeakPolarHBondContact CB-O 3.43Å
225	P	78.7	Confident	81.1	Confident	68 Å²	68	80 Å²	80	44%	0.442	41%	0.409	S	S	.	.	S	Bend	trans	-70.3	-4.1	-166.2	29	-37.9	0	0	0	115	Y218 R223	Y218-P225 HydrophobicContact CD1-CG 4.16Å; Y218-P225 HydrophobicContact CD2-CG 4.27Å; Y218-P225 HydrophobicContact CE1-CG 3.87Å; Y218-P225 HydrophobicContact CE2-CG 3.97Å; Y218-P225 HydrophobicContact CG-CG 4.36Å; R223-P225 WeakPolarHBondContact O-CD 3.45Å
226	H	81.7	Confident	80.9	Confident	54 Å²	54	80.8 Å²	80.8	25%	0.25	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	77	179	-57.6	-64.2	0	0	0	110.3	K224 Y235 D237 S238 L241	K224-H226 PolarHBondContact O-N 3.31Å; H226-Y235 WeakPolarHBondContact CB-O 3.38Å; H226-Y235 PolarHBondContact N-O 2.7Å; H226-Y235 VanDerWaalsContact N-O 3.09Å; H226-Y235 PolarHBondContact O-N 2.89Å; H226-D237 VanDerWaalsContact CD2-CA 3.5Å; H226-D237 WeakPolarHBondContact CD2-CA 3.38Å; H226-S238 PolarHBondContact CD2-N 3.22Å; H226-S238 PolarHBondContact NE2-N 3.37Å; H226-L241 HydrophobicContact CB-CB 3.9Å; H226-L241 HydrophobicContact CB-CD2 3.74Å; H226-L241 HydrophobicContact CB-CG 4.44Å
227	A	83.5	Confident	80.6	Confident	48 Å²	48	81.5 Å²	81.5	40%	0.397	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	142.9	170.1	0	0	0	0	0	111.5	S234 L241	A227-S234 WeakPolarHBondContact CA-OG 3.28Å; A227-S234 WeakPolarHBondContact CB-OG 3.43Å; A227-L241 WeakPolarHBondContact O-CD2 3.36Å
228	C	88.1	Confident	80.4	Confident	14 Å²	14	79.8 Å²	79.8	10%	0.095	41%	0.412	C	S	.	.			trans	-75.1	148.2	158.8	-167.2	0	0	0	0	109.4	C231 K233 L241 H244 H249	C228-C231 WeakPolarHBondContact CB-O 3.42Å; C228-K233 WeakPolarHBondContact CB-O 3.4Å; C228-K233 PolarHBondContact N-O 2.86Å; C228-L241 HydrophobicContact CB-CD1 3.78Å; C228-H244 VanDerWaalsContact CB-NE2 3.35Å; C228-H244 WeakPolarHBondContact CB-NE2 3.38Å; C228-H244 PolarHBondContact SG-NE2 2.87Å; C228-H244 VanDerWaalsContact SG-NE2 3.41Å; C228-H249 VanDerWaalsContact SG-CD2 3.58Å
229	H	81.5	Confident	80.5	Confident	118 Å²	118	85.1 Å²	85.1	55%	0.546	43%	0.432	S	S	.	.	S	Bend	trans	-90.9	-14.9	175.6	-169.5	45.7	0	0	0	112.6
230	F	81	Confident	80.8	Confident	88 Å²	88	82.5 Å²	82.5	39%	0.386	42%	0.417	S	S	.	.	S	Bend	trans	-105.1	-5.9	-175.3	-62.3	-87.9	0	0	0	113.5	Y245 H249 E252 W256	F230-Y245 HydrophobicContact CD2-CD2 4.45Å; F230-Y245 AromaticContact CD2-CE2 3.66Å; F230-Y245 HydrophobicContact CD2-CE2 3.66Å; F230-Y245 AromaticContact CE2-CE2 3.77Å; F230-Y245 HydrophobicContact CE2-CE2 3.77Å; F230-H249 WeakPolarHBondContact CB-CE1 3.45Å; F230-H249 VanDerWaalsContact CB-ND1 3.26Å; F230-H249 WeakPolarHBondContact CB-ND1 3.47Å; F230-H249 PolarHBondContact O-CE1 2.72Å; F230-E252 HydrophobicContact CD1-CB 4.45Å; F230-E252 HydrophobicContact CD1-CG 3.78Å; F230-E252 HydrophobicContact CE1-CB 4.15Å; F230-E252 HydrophobicContact CE1-CG 3.74Å; F230-E252 HydrophobicContact CE2-CB 4.43Å; F230-E252 HydrophobicContact CG-CG 4.32Å; F230-E252 HydrophobicContact CZ-CB 4.14Å; F230-E252 HydrophobicContact CZ-CG 4.25Å; F230-W256 AromaticContact CZ-NE1 3.89Å
231	C	87.2	Confident	81.1	Confident	36 Å²	36	79.5 Å²	79.5	24%	0.243	40%	0.403	C	S	.	.	S	Bend	trans	-161.5	165.3	162.1	67.8	0	0	0	0	110.7	C228 K233 H244 H249	C228-C231 WeakPolarHBondContact CB-O 3.42Å; C231-K233 PolarHBondContact O-N 3.09Å; C231-H244 PolarHBondContact SG-CE1 3.19Å; C231-H244 PolarHBondContact SG-NE2 3.46Å; C231-H244 VanDerWaalsContact SG-NE2 3.42Å; C231-H249 PolarHBondContact SG-NE2 2.95Å; C231-H249 VanDerWaalsContact SG-NE2 3.36Å
232	D	83.6	Confident	81.8	Confident	166 Å²	166	80.4 Å²	80.4	89%	0.888	40%	0.403	S	S	*	.	S	Bend	trans	-68.6	7.7	-172.3	-45.7	-69.7	0	0	0	115.3	S234	D232-S234 PolarHBondContact O-N 3.12Å
233	K	84.3	Confident	82.8	Confident	118 Å²	118	83.2 Å²	83.2	51%	0.513	40%	0.398	S	S	.	.			trans	-77.5	108.2	-177.3	-67.1	175	-173.3	159.7	0	110.4	C228 C231 Y235	C228-K233 WeakPolarHBondContact CB-O 3.4Å; C228-K233 PolarHBondContact N-O 2.86Å; C231-K233 PolarHBondContact O-N 3.09Å; K233-Y235 HydrophobicContact CB-CE2 3.8Å; K233-Y235 VanDerWaalsContact O-CE2 3.27Å; K233-Y235 WeakPolarHBondContact O-CE2 3.34Å
234	S	84.5	Confident	83.9	Confident	40 Å²	40	74.8 Å²	74.8	28%	0.28	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	150.9	174.7	-58.6	0	0	0	0	113	K224 A227 D232	K224-S234 WeakPolarHBondContact CD-O 3.41Å; A227-S234 WeakPolarHBondContact CA-OG 3.28Å; A227-S234 WeakPolarHBondContact CB-OG 3.43Å; D232-S234 PolarHBondContact O-N 3.12Å
235	Y	84.6	Confident	84.3	Confident	55 Å²	55	69.9 Å²	69.9	22%	0.216	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	152.9	-172.2	-63.3	-86.7	0	0	0	113.4	K224 H226 K233 L241 H244	K224-Y235 CarbonylContact C-O 3.56Å; K224-Y235 WeakPolarHBondContact CB-O 3.43Å; H226-Y235 WeakPolarHBondContact CB-O 3.38Å; H226-Y235 PolarHBondContact N-O 2.7Å; H226-Y235 VanDerWaalsContact N-O 3.09Å; H226-Y235 PolarHBondContact O-N 2.89Å; K233-Y235 HydrophobicContact CB-CE2 3.8Å; K233-Y235 VanDerWaalsContact O-CE2 3.27Å; K233-Y235 WeakPolarHBondContact O-CE2 3.34Å; Y235-L241 HydrophobicContact CD2-CB 4.01Å; Y235-L241 HydrophobicContact CD2-CD1 4.08Å; Y235-L241 HydrophobicContact CE2-CD1 4.49Å; Y235-L241 HydrophobicContact CG-CB 4.3Å; Y235-H244 HydrophobicContact CE1-CB 4.26Å; Y235-H244 HydrophobicContact CE2-CB 3.72Å; Y235-H244 AromaticContact CE2-CD2 3.29Å; Y235-H244 WeakPolarHBondContact CE2-CD2 3.31Å; Y235-H244 AromaticContact CE2-CG 3.6Å; Y235-H244 AromaticContact CZ-CD2 3.83Å; Y235-H244 AromaticContact CZ-CG 3.65Å; Y235-H244 WeakPolarHBondContact OH-CB 3.21Å; Y235-H244 VanDerWaalsContact OH-CG 3.24Å
236	S	78.6	Confident	84.7	Confident	48 Å²	48	70.1 Å²	70.1	34%	0.336	34%	0.34	S	S	.	.	S	Bend	trans	-87.6	-12.2	179.5	52.1	0	0	0	0	114.4
237	D	82	Confident	84.9	Confident	37 Å²	37	73.6 Å²	73.6	20%	0.198	36%	0.361	C	S	.	.	S	Bend	trans	-139.8	148.6	169.1	97.6	-38.6	0	0	0	112.5	H226 R239 S240 L241	H226-D237 VanDerWaalsContact CD2-CA 3.5Å; H226-D237 WeakPolarHBondContact CD2-CA 3.38Å; D237-R239 PolarHBondContact O-N 2.86Å; D237-R239 IonicContact OD2-CZ 2.65Å; D237-R239 VanDerWaalsContact OD2-CZ 3.23Å; D237-R239 IonicContact OD2-NE 2.67Å; D237-R239 PolarHBondContact OD2-NE 3.2Å; D237-R239 IonicContact OD2-NH2 3.51Å; D237-R239 PolarHBondContact OD2-NH2 3.42Å; D237-S240 PolarHBondContact O-N 3.22Å; D237-S240 VanDerWaalsContact O-N 3.11Å; D237-S240 WeakPolarHBondContact OD1-CB 3.37Å; D237-S240 PolarHBondContact OD1-N 3.31Å; D237-S240 PolarHBondContact OD1-OG 3.18Å; D237-L241 PolarHBondContact O-N 3.13Å
238	S	82.5	Confident	85.1	Confident	48 Å²	48	73.6 Å²	73.6	34%	0.336	36%	0.361	S	S	.	.	H	α-helix	trans	-59.1	-29.1	-177.4	161.1	0	0	0	0	113.2	H226 L241 R242	H226-S238 PolarHBondContact CD2-N 3.22Å; H226-S238 PolarHBondContact NE2-N 3.37Å; S238-L241 PolarHBondContact O-N 2.94Å; S238-R242 WeakPolarHBondContact O-CB 3.43Å; S238-R242 PolarHBondContact O-N 3.07Å
239	R	85	Confident	85.1	Confident	190 Å²	190	73.6 Å²	73.6	72%	0.717	36%	0.359	S	S	*	.	H	α-helix	trans	-71.7	-34.3	177.6	-64.1	171.7	-61.5	-179.8	2.5	112.4	D237 R243	D237-R239 PolarHBondContact O-N 2.86Å; D237-R239 IonicContact OD2-CZ 2.65Å; D237-R239 VanDerWaalsContact OD2-CZ 3.23Å; D237-R239 IonicContact OD2-NE 2.67Å; D237-R239 PolarHBondContact OD2-NE 3.2Å; D237-R239 IonicContact OD2-NH2 3.51Å; D237-R239 PolarHBondContact OD2-NH2 3.42Å; R239-R243 WeakPolarHBondContact O-CB 3.33Å; R239-R243 PolarHBondContact O-N 2.83Å
240	S	88	Confident	85.1	Confident	32 Å²	32	71.3 Å²	71.3	22%	0.224	36%	0.355	C	S	.	.	H	α-helix	trans	-70.3	-39.7	174.7	-60.1	0	0	0	0	111.5	D237 H244	D237-S240 PolarHBondContact O-N 3.22Å; D237-S240 VanDerWaalsContact O-N 3.11Å; D237-S240 WeakPolarHBondContact OD1-CB 3.37Å; D237-S240 PolarHBondContact OD1-N 3.31Å; D237-S240 PolarHBondContact OD1-OG 3.18Å; S240-H244 WeakPolarHBondContact O-CB 3.41Å; S240-H244 PolarHBondContact O-N 2.78Å
241	L	89.3	Confident	84.9	Confident	4 Å²	4	74.8 Å²	74.8	2%	0.021	37%	0.372	C	S	.	.	H	α-helix	trans	-60.2	-50.9	169.6	172	58.5	0	0	0	111	H226 A227 C228 Y235 D237 S238 R243 H244 Y245 M538	H226-L241 HydrophobicContact CB-CB 3.9Å; H226-L241 HydrophobicContact CB-CD2 3.74Å; H226-L241 HydrophobicContact CB-CG 4.44Å; A227-L241 WeakPolarHBondContact O-CD2 3.36Å; C228-L241 HydrophobicContact CB-CD1 3.78Å; Y235-L241 HydrophobicContact CD2-CB 4.01Å; Y235-L241 HydrophobicContact CD2-CD1 4.08Å; Y235-L241 HydrophobicContact CE2-CD1 4.49Å; Y235-L241 HydrophobicContact CG-CB 4.3Å; D237-L241 PolarHBondContact O-N 3.13Å; S238-L241 PolarHBondContact O-N 2.94Å; L241-R243 PolarHBondContact O-N 3.01Å; L241-H244 WeakPolarHBondContact O-CB 3.2Å; L241-H244 PolarHBondContact O-N 3.23Å; L241-H244 VanDerWaalsContact O-N 3.12Å; L241-Y245 WeakPolarHBondContact O-CB 3.39Å; L241-Y245 PolarHBondContact O-N 3.31Å; L241-M538 HydrophobicContact CD2-CE 3.54Å; L241-M538 HydrophobicContact CD2-SD 4Å; L241-M538 HydrophobicContact CG-CE 4.19Å; L241-M538 HydrophobicContact CG-SD 4.05Å
242	R	85.2	Confident	84.5	Confident	115 Å²	115	75.3 Å²	75.3	43%	0.434	37%	0.371	S	S	.	.	H	α-helix	trans	-56.6	-47.8	178.4	177.5	-178.8	167.8	135.6	14.1	112.3	S238 H244 Y245 E246	S238-R242 WeakPolarHBondContact O-CB 3.43Å; S238-R242 PolarHBondContact O-N 3.07Å; R242-H244 VanDerWaalsContact C-N 3.29Å; R242-H244 PolarHBondContact O-N 3.28Å; R242-Y245 WeakPolarHBondContact O-CB 3.39Å; R242-Y245 PolarHBondContact O-N 3.32Å; R242-Y245 VanDerWaalsContact O-N 3.15Å; R242-E246 HydrophobicContact CG-CG 4.28Å; R242-E246 IonicContact CZ-OE1 2.76Å; R242-E246 IonicContact NE-OE1 3.93Å; R242-E246 PolarHBondContact NE-OE1 3.2Å; R242-E246 IonicContact NE-OE2 3.85Å; R242-E246 IonicContact NH2-OE1 3.5Å; R242-E246 PolarHBondContact NH2-OE1 3.04Å; R242-E246 WeakPolarHBondContact O-CB 3.33Å; R242-E246 WeakPolarHBondContact O-CG 3.09Å; R242-E246 PolarHBondContact O-N 3.41Å
243	R	87.3	Confident	84	Confident	158 Å²	158	69.7 Å²	69.7	60%	0.596	34%	0.341	S	S	*	.	H	α-helix	trans	-65.1	-33.3	178	-179.1	-177.5	60.8	159.6	-2	112.3	R239 L241 N247	R239-R243 WeakPolarHBondContact O-CB 3.33Å; R239-R243 PolarHBondContact O-N 2.83Å; L241-R243 PolarHBondContact O-N 3.01Å; R243-N247 VanDerWaalsContact O-CB 3.27Å; R243-N247 WeakPolarHBondContact O-CB 3.49Å; R243-N247 PolarHBondContact O-N 3.32Å
244	H	89.4	Confident	83.6	Confident	15 Å²	15	69.8 Å²	69.8	7%	0.069	34%	0.343	C	S	.	.	H	α-helix	trans	-65.7	-45.7	171.2	156.9	49.7	0	0	0	110.8	C228 C231 Y235 S240 L241 R242 N247 A248 H249	C228-H244 VanDerWaalsContact CB-NE2 3.35Å; C228-H244 WeakPolarHBondContact CB-NE2 3.38Å; C228-H244 PolarHBondContact SG-NE2 2.87Å; C228-H244 VanDerWaalsContact SG-NE2 3.41Å; C231-H244 PolarHBondContact SG-CE1 3.19Å; C231-H244 PolarHBondContact SG-NE2 3.46Å; C231-H244 VanDerWaalsContact SG-NE2 3.42Å; Y235-H244 HydrophobicContact CE1-CB 4.26Å; Y235-H244 HydrophobicContact CE2-CB 3.72Å; Y235-H244 AromaticContact CE2-CD2 3.29Å; Y235-H244 WeakPolarHBondContact CE2-CD2 3.31Å; Y235-H244 AromaticContact CE2-CG 3.6Å; Y235-H244 AromaticContact CZ-CD2 3.83Å; Y235-H244 AromaticContact CZ-CG 3.65Å; Y235-H244 WeakPolarHBondContact OH-CB 3.21Å; Y235-H244 VanDerWaalsContact OH-CG 3.24Å; S240-H244 WeakPolarHBondContact O-CB 3.41Å; S240-H244 PolarHBondContact O-N 2.78Å; L241-H244 WeakPolarHBondContact O-CB 3.2Å; L241-H244 PolarHBondContact O-N 3.23Å; L241-H244 VanDerWaalsContact O-N 3.12Å; R242-H244 VanDerWaalsContact C-N 3.29Å; R242-H244 PolarHBondContact O-N 3.28Å; H244-N247 PolarHBondContact O-N 3.05Å; H244-A248 WeakPolarHBondContact ND1-CB 3.45Å; H244-A248 VanDerWaalsContact O-CB 3.24Å; H244-A248 WeakPolarHBondContact O-CB 3.4Å; H244-A248 PolarHBondContact O-N 2.91Å; H244-H249 AromaticContact CE1-CD2 3.51Å; H244-H249 AromaticContact CE1-NE2 3.33Å; H244-H249 PolarHBondContact CE1-NE2 3.46Å; H244-H249 VanDerWaalsContact CE1-NE2 3.33Å; H244-H249 AromaticContact NE2-CD2 3.66Å; H244-H249 AromaticContact NE2-NE2 3.5Å; H244-H249 PolarHBondContact NE2-NE2 2.89Å
245	Y	84.1	Confident	83	Confident	15 Å²	15	73.9 Å²	73.9	6%	0.059	35%	0.353	C	S	.	.	H	α-helix	trans	-59.5	-51.9	178.1	-168.5	-108.6	0	0	0	111.9	F230 L241 R242 N247 H249 E252 N253	F230-Y245 HydrophobicContact CD2-CD2 4.45Å; F230-Y245 AromaticContact CD2-CE2 3.66Å; F230-Y245 HydrophobicContact CD2-CE2 3.66Å; F230-Y245 AromaticContact CE2-CE2 3.77Å; F230-Y245 HydrophobicContact CE2-CE2 3.77Å; L241-Y245 WeakPolarHBondContact O-CB 3.39Å; L241-Y245 PolarHBondContact O-N 3.31Å; R242-Y245 WeakPolarHBondContact O-CB 3.39Å; R242-Y245 PolarHBondContact O-N 3.32Å; R242-Y245 VanDerWaalsContact O-N 3.15Å; Y245-N247 PolarHBondContact O-N 3.48Å; Y245-N247 VanDerWaalsContact O-N 3.13Å; Y245-H249 HydrophobicContact CD2-CB 3.72Å; Y245-H249 HydrophobicContact CE2-CB 3.74Å; Y245-H249 HydrophobicContact CG-CB 4.46Å; Y245-H249 CarbonylContact O-C 3.35Å; Y245-H249 WeakPolarHBondContact O-CA 3.47Å; Y245-H249 PolarHBondContact O-N 3.22Å; Y245-E252 HydrophobicContact CE2-CB 4.47Å; Y245-N253 HydrophobicContact CD1-CB 4.1Å; Y245-N253 HydrophobicContact CE1-CB 3.68Å
246	E	86.7	Confident	82.4	Confident	73 Å²	73	75 Å²	75	34%	0.341	36%	0.357	S	S	.	.	H	α-helix	trans	-58.4	-25	176.7	-71.5	171.4	152	0	0	113.8	R242	R242-E246 HydrophobicContact CG-CG 4.28Å; R242-E246 IonicContact CZ-OE1 2.76Å; R242-E246 IonicContact NE-OE1 3.93Å; R242-E246 PolarHBondContact NE-OE1 3.2Å; R242-E246 IonicContact NE-OE2 3.85Å; R242-E246 IonicContact NH2-OE1 3.5Å; R242-E246 PolarHBondContact NH2-OE1 3.04Å; R242-E246 WeakPolarHBondContact O-CB 3.33Å; R242-E246 WeakPolarHBondContact O-CG 3.09Å; R242-E246 PolarHBondContact O-N 3.41Å
247	N	86.8	Confident	82	Confident	128 Å²	128	77.1 Å²	77.1	68%	0.684	36%	0.362	S	S	*	.	H	α-helix	trans	-107.5	-22.4	-174.9	-71.1	6.7	0	0	0	115.1	R243 H244 Y245	R243-N247 VanDerWaalsContact O-CB 3.27Å; R243-N247 WeakPolarHBondContact O-CB 3.49Å; R243-N247 PolarHBondContact O-N 3.32Å; H244-N247 PolarHBondContact O-N 3.05Å; Y245-N247 PolarHBondContact O-N 3.48Å; Y245-N247 VanDerWaalsContact O-N 3.13Å
248	A	87	Confident	81.6	Confident	48 Å²	48	80 Å²	80	40%	0.397	38%	0.377	S	S	.	.	H	α-helix	trans	-121.6	-13.4	-172.8	0	0	0	0	0	113.7	H244	H244-A248 WeakPolarHBondContact ND1-CB 3.45Å; H244-A248 VanDerWaalsContact O-CB 3.24Å; H244-A248 WeakPolarHBondContact O-CB 3.4Å; H244-A248 PolarHBondContact O-N 2.91Å
249	H	88.1	Confident	81.1	Confident	14 Å²	14	79.2 Å²	79.2	7%	0.065	37%	0.369	C	S	.	.			trans	-126.8	55.7	177.2	-64.8	-68.9	0	0	0	110.4	C228 F230 C231 H244 Y245 E252 N253	C228-H249 VanDerWaalsContact SG-CD2 3.58Å; F230-H249 WeakPolarHBondContact CB-CE1 3.45Å; F230-H249 VanDerWaalsContact CB-ND1 3.26Å; F230-H249 WeakPolarHBondContact CB-ND1 3.47Å; F230-H249 PolarHBondContact O-CE1 2.72Å; C231-H249 PolarHBondContact SG-NE2 2.95Å; C231-H249 VanDerWaalsContact SG-NE2 3.36Å; H244-H249 AromaticContact CE1-CD2 3.51Å; H244-H249 AromaticContact CE1-NE2 3.33Å; H244-H249 PolarHBondContact CE1-NE2 3.46Å; H244-H249 VanDerWaalsContact CE1-NE2 3.33Å; H244-H249 AromaticContact NE2-CD2 3.66Å; H244-H249 AromaticContact NE2-NE2 3.5Å; H244-H249 PolarHBondContact NE2-NE2 2.89Å; Y245-H249 HydrophobicContact CD2-CB 3.72Å; Y245-H249 HydrophobicContact CE2-CB 3.74Å; Y245-H249 HydrophobicContact CG-CB 4.46Å; Y245-H249 CarbonylContact O-C 3.35Å; Y245-H249 WeakPolarHBondContact O-CA 3.47Å; Y245-H249 PolarHBondContact O-N 3.22Å; H249-E252 WeakPolarHBondContact CA-OE2 3.36Å; H249-E252 HydrophobicContact CB-CB 4.44Å; H249-E252 WeakPolarHBondContact CB-OE2 3.45Å; H249-E252 IonicContact CE1-OE1 3.36Å; H249-E252 IonicContact CG-OE1 2.76Å; H249-E252 IonicContact ND1-OE1 3.23Å; H249-E252 PolarHBondContact ND1-OE1 3.25Å; H249-E252 IonicContact ND1-OE2 3.08Å; H249-N253 WeakPolarHBondContact O-CB 3.34Å; H249-N253 PolarHBondContact O-N 2.86Å
250	P	82.1	Confident	80.4	Confident	69 Å²	69	71.8 Å²	71.8	45%	0.448	35%	0.346	S	S	.	.	H	α-helix	trans	-68.2	-41.2	-171	28.6	-35	0	0	0	112.6	N253 E254	P250-N253 PolarHBondContact O-N 2.94Å; P250-E254 WeakPolarHBondContact O-CG 3.42Å; P250-E254 PolarHBondContact O-N 2.89Å
251	E	77.2	Confident	79.6	Confident	161 Å²	161	76 Å²	76	75%	0.752	36%	0.362	S	S	*	.	H	α-helix	trans	-66.9	-41	-179.6	-62.3	-173	176.3	0	0	111	E254 R255	E251-E254 PolarHBondContact O-N 2.92Å; E251-R255 PolarHBondContact O-N 3.34Å
252	E	77.1	Confident	78.5	Confident	48 Å²	48	77.7 Å²	77.7	22%	0.224	38%	0.377	C	S	.	.	H	α-helix	trans	-67.9	-42.9	175.8	-48.5	99.4	120.6	0	0	110.4	F230 Y245 H249 E254 R255 W256	F230-E252 HydrophobicContact CD1-CB 4.45Å; F230-E252 HydrophobicContact CD1-CG 3.78Å; F230-E252 HydrophobicContact CE1-CB 4.15Å; F230-E252 HydrophobicContact CE1-CG 3.74Å; F230-E252 HydrophobicContact CE2-CB 4.43Å; F230-E252 HydrophobicContact CG-CG 4.32Å; F230-E252 HydrophobicContact CZ-CB 4.14Å; F230-E252 HydrophobicContact CZ-CG 4.25Å; Y245-E252 HydrophobicContact CE2-CB 4.47Å; H249-E252 WeakPolarHBondContact CA-OE2 3.36Å; H249-E252 HydrophobicContact CB-CB 4.44Å; H249-E252 WeakPolarHBondContact CB-OE2 3.45Å; H249-E252 IonicContact CE1-OE1 3.36Å; H249-E252 IonicContact CG-OE1 2.76Å; H249-E252 IonicContact ND1-OE1 3.23Å; H249-E252 PolarHBondContact ND1-OE1 3.25Å; H249-E252 IonicContact ND1-OE2 3.08Å; E252-E254 VanDerWaalsContact C-N 3.32Å; E252-E254 PolarHBondContact O-N 2.92Å; E252-R255 PolarHBondContact O-N 2.89Å; E252-R255 VanDerWaalsContact O-N 3.15Å; E252-W256 PolarHBondContact O-N 3.36Å
253	N	74.4	Confident	77.6	Confident	47 Å²	47	72.5 Å²	72.5	25%	0.251	36%	0.358	S	S	.	.	H	α-helix	trans	-60.6	-38.5	175.8	-177.8	50.8	0	0	0	112.2	Y245 H249 P250 M257	Y245-N253 HydrophobicContact CD1-CB 4.1Å; Y245-N253 HydrophobicContact CE1-CB 3.68Å; H249-N253 WeakPolarHBondContact O-CB 3.34Å; H249-N253 PolarHBondContact O-N 2.86Å; P250-N253 PolarHBondContact O-N 2.94Å; N253-M257 WeakPolarHBondContact O-CB 3.48Å; N253-M257 PolarHBondContact O-N 3.39Å
254	E	75.8	Confident	76.6	Confident	120 Å²	120	72 Å²	72	56%	0.561	37%	0.367	S	S	*	.	H	α-helix	trans	-64.8	-45.5	170.9	-75.9	-172	-177.1	0	0	112.1	P250 E251 E252 W256 M257 L258	P250-E254 WeakPolarHBondContact O-CG 3.42Å; P250-E254 PolarHBondContact O-N 2.89Å; E251-E254 PolarHBondContact O-N 2.92Å; E252-E254 VanDerWaalsContact C-N 3.32Å; E252-E254 PolarHBondContact O-N 2.92Å; E254-W256 PolarHBondContact O-N 3.38Å; E254-M257 HydrophobicContact CG-CE 4.19Å; E254-M257 PolarHBondContact O-N 2.96Å; E254-L258 WeakPolarHBondContact O-CG 3.42Å; E254-L258 PolarHBondContact O-N 3.23Å
255	R	72.3	Confident	75.3	Confident	127 Å²	127	71.6 Å²	71.6	48%	0.479	37%	0.366	S	S	.	.	H	α-helix	trans	-59.5	-43.4	177	-171.8	177.5	177.7	-159	-2.8	112.3	E251 E252 L259 A375 S376	E251-R255 PolarHBondContact O-N 3.34Å; E252-R255 PolarHBondContact O-N 2.89Å; E252-R255 VanDerWaalsContact O-N 3.15Å; R255-L259 WeakPolarHBondContact O-CB 3.45Å; R255-L259 PolarHBondContact O-N 2.99Å; R255-A375 PolarHBondContact NH2-O 3.24Å; R255-S376 PolarHBondContact NH2-O 2.83Å
256	W	70.6	Confident	74.4	Confident	79 Å²	79	74.3 Å²	74.3	30%	0.299	38%	0.382	S	S	.	.	H	α-helix	trans	-72.3	-31.9	175.8	-76.6	99.7	0	0	0	112.9	F230 E252 E254 L259 C260 A535	F230-W256 AromaticContact CZ-NE1 3.89Å; E252-W256 PolarHBondContact O-N 3.36Å; E254-W256 PolarHBondContact O-N 3.38Å; W256-L259 HydrophobicContact CE3-CD2 3.9Å; W256-L259 HydrophobicContact CZ3-CD2 3.82Å; W256-L259 PolarHBondContact O-N 3.42Å; W256-C260 VanDerWaalsContact O-CB 3.31Å; W256-C260 WeakPolarHBondContact O-CB 3.41Å; W256-C260 PolarHBondContact O-N 3.29Å; W256-A535 HydrophobicContact CH2-CB 3.7Å; W256-A535 HydrophobicContact CZ2-CB 4.11Å; W256-A535 HydrophobicContact CZ3-CB 4Å
257	M	71	Confident	73.3	Confident	92 Å²	92	74.5 Å²	74.5	45%	0.453	39%	0.388	S	S	.	.	H	α-helix	trans	-66.2	-41.9	172.5	175.1	166	52.2	0	0	111.9	N253 E254 C260 Q261	N253-M257 WeakPolarHBondContact O-CB 3.48Å; N253-M257 PolarHBondContact O-N 3.39Å; E254-M257 HydrophobicContact CG-CE 4.19Å; E254-M257 PolarHBondContact O-N 2.96Å; M257-C260 WeakPolarHBondContact O-CB 3.3Å; M257-C260 PolarHBondContact O-N 3.43Å; M257-Q261 WeakPolarHBondContact O-CG 3.46Å; M257-Q261 PolarHBondContact O-N 2.93Å
258	L	73.5	Confident	72	Confident	98 Å²	98	71.1 Å²	71.1	51%	0.513	38%	0.375	S	S	.	.	H	α-helix	trans	-63.7	-41.6	173.4	-71.8	169.5	0	0	0	111.6	E254 C260 Q261 A262	E254-L258 WeakPolarHBondContact O-CG 3.42Å; E254-L258 PolarHBondContact O-N 3.23Å; L258-C260 VanDerWaalsContact C-N 3.33Å; L258-C260 PolarHBondContact O-N 3.37Å; L258-Q261 WeakPolarHBondContact O-CB 3.46Å; L258-Q261 PolarHBondContact O-N 3.31Å; L258-Q261 VanDerWaalsContact O-N 3.15Å; L258-A262 PolarHBondContact O-N 2.95Å
259	L	71.3	Confident	70.5	Confident	31 Å²	31	69.6 Å²	69.6	16%	0.162	36%	0.362	C	S	.	.	H	α-helix	trans	-64.8	-36.5	175.6	-168.8	62.5	0	0	0	112.3	R255 W256 T263 L270 A372 A375	R255-L259 WeakPolarHBondContact O-CB 3.45Å; R255-L259 PolarHBondContact O-N 2.99Å; W256-L259 HydrophobicContact CE3-CD2 3.9Å; W256-L259 HydrophobicContact CZ3-CD2 3.82Å; W256-L259 PolarHBondContact O-N 3.42Å; L259-T263 WeakPolarHBondContact O-CG2 3.46Å; L259-T263 PolarHBondContact O-N 3.29Å; L259-T263 VanDerWaalsContact O-N 3.1Å; L259-T263 PolarHBondContact O-OG1 3.35Å; L259-L270 HydrophobicContact CD2-CD1 3.62Å; L259-L270 HydrophobicContact CG-CD1 3.63Å; L259-A372 HydrophobicContact CD1-CB 3.65Å; L259-A375 HydrophobicContact CD1-CB 4.47Å
260	C	70.8	Confident	69.3	Low	34 Å²	34	69.3 Å²	69.3	23%	0.23	36%	0.361	C	S	.	.	H	α-helix	trans	-66.3	-35.9	171.8	-173.5	0	0	0	0	112.1	W256 M257 L258 T263 N264 G265	W256-C260 VanDerWaalsContact O-CB 3.31Å; W256-C260 WeakPolarHBondContact O-CB 3.41Å; W256-C260 PolarHBondContact O-N 3.29Å; M257-C260 WeakPolarHBondContact O-CB 3.3Å; M257-C260 PolarHBondContact O-N 3.43Å; L258-C260 VanDerWaalsContact C-N 3.33Å; L258-C260 PolarHBondContact O-N 3.37Å; C260-T263 WeakPolarHBondContact CA-OG1 3.36Å; C260-T263 PolarHBondContact O-OG1 3.46Å; C260-N264 PolarHBondContact O-N 3.32Å; C260-G265 PolarHBondContact O-N 2.97Å
261	Q	71.3	Confident	68.3	Low	119 Å²	119	68.4 Å²	68.4	56%	0.556	36%	0.356	S	S	*	.	H	α-helix	trans	-67.4	-49.1	172.8	-70.4	171.1	25.5	0	0	111.6	M257 L258 T263 N264	M257-Q261 WeakPolarHBondContact O-CG 3.46Å; M257-Q261 PolarHBondContact O-N 2.93Å; L258-Q261 WeakPolarHBondContact O-CB 3.46Å; L258-Q261 PolarHBondContact O-N 3.31Å; L258-Q261 VanDerWaalsContact O-N 3.15Å; Q261-T263 PolarHBondContact O-N 3.17Å; Q261-N264 PolarHBondContact O-N 2.9Å
262	A	65.9	Low	67.6	Low	41 Å²	41	65 Å²	65	34%	0.339	34%	0.342	S	S	.	.	H	α-helix	trans	-60	-30.5	179.5	0	0	0	0	0	113.6	L258	L258-A262 PolarHBondContact O-N 2.95Å
263	T	67.2	Low	66.5	Low	6 Å²	6	63.2 Å²	63.2	4%	0.037	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	3.5	175.2	51.9	0	0	0	0	113.9	L259 C260 Q261 G265 D266 A269 L270	L259-T263 WeakPolarHBondContact O-CG2 3.46Å; L259-T263 PolarHBondContact O-N 3.29Å; L259-T263 VanDerWaalsContact O-N 3.1Å; L259-T263 PolarHBondContact O-OG1 3.35Å; C260-T263 WeakPolarHBondContact CA-OG1 3.36Å; C260-T263 PolarHBondContact O-OG1 3.46Å; Q261-T263 PolarHBondContact O-N 3.17Å; T263-G265 PolarHBondContact O-N 3.32Å; T263-G265 VanDerWaalsContact O-N 3.08Å; T263-D266 VanDerWaalsContact O-CB 3.23Å; T263-D266 WeakPolarHBondContact O-CB 3.45Å; T263-D266 PolarHBondContact O-N 3.39Å; T263-A269 HydrophobicContact CG2-CB 4.29Å; T263-L270 HydrophobicContact CG2-CD1 4.23Å
264	N	66.1	Low	65.8	Low	148 Å²	148	63 Å²	63	79%	0.791	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	21.8	-168.9	-69.2	-78.8	0	0	0	114	C260 Q261 D266	C260-N264 PolarHBondContact O-N 3.32Å; Q261-N264 PolarHBondContact O-N 2.9Å; N264-D266 VanDerWaalsContact C-N 3.28Å; N264-D266 PolarHBondContact O-N 3.11Å
265	G	62.9	Low	65	Low	5 Å²	5	60.1 Å²	60.1	5%	0.052	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	29.6	-170.7	0	0	0	0	0	113.7	C260 T263 T267 K546	C260-G265 PolarHBondContact O-N 2.97Å; T263-G265 PolarHBondContact O-N 3.32Å; T263-G265 VanDerWaalsContact O-N 3.08Å; G265-T267 PolarHBondContact O-N 3.37Å; G265-K546 PolarHBondContact O-NZ 2.9Å
266	D	64.8	Low	64	Low	72 Å²	72	55.3 Å²	55.3	39%	0.385	33%	0.325	S	S	.	.			trans	-76.9	107.9	171	-171.6	-18	0	0	0	110.1	T263 N264 S268 A269 L270	T263-D266 VanDerWaalsContact O-CB 3.23Å; T263-D266 WeakPolarHBondContact O-CB 3.45Å; T263-D266 PolarHBondContact O-N 3.39Å; N264-D266 VanDerWaalsContact C-N 3.28Å; N264-D266 PolarHBondContact O-N 3.11Å; D266-S268 VanDerWaalsContact CG-OG 3.26Å; D266-S268 PolarHBondContact O-N 3.49Å; D266-S268 WeakPolarHBondContact OD1-CA 3.11Å; D266-S268 VanDerWaalsContact OD1-CB 3.32Å; D266-S268 WeakPolarHBondContact OD1-CB 3.44Å; D266-S268 PolarHBondContact OD1-N 3.43Å; D266-S268 PolarHBondContact OD1-OG 3.04Å; D266-S268 PolarHBondContact OD2-OG 3.49Å; D266-A269 HydrophobicContact CB-CB 4.06Å; D266-A269 PolarHBondContact O-N 3.33Å; D266-L270 PolarHBondContact O-N 2.96Å
267	T	63.8	Low	63.4	Low	77 Å²	77	52.5 Å²	52.5	47%	0.472	32%	0.319	S	S	.	.	H	α-helix	trans	-54.3	-33.5	175.4	43.8	0	0	0	0	112.8	G265 S271 H540	G265-T267 PolarHBondContact O-N 3.37Å; T267-S271 VanDerWaalsContact O-CB 3.31Å; T267-S271 WeakPolarHBondContact O-CB 3.49Å; T267-S271 PolarHBondContact O-N 2.92Å; T267-S271 PolarHBondContact O-OG 2.97Å; T267-H540 HydrophobicContact CG2-CB 3.88Å; T267-H540 WeakPolarHBondContact CG2-CD2 3.32Å
268	S	57.9	Low	62.8	Low	57 Å²	57	49.6 Å²	49.6	40%	0.399	31%	0.309	S	S	.	.	H	α-helix	trans	-72.5	-51.2	-178.3	72.8	0	0	0	0	110.5	D266 L270 S271 I272	D266-S268 VanDerWaalsContact CG-OG 3.26Å; D266-S268 PolarHBondContact O-N 3.49Å; D266-S268 WeakPolarHBondContact OD1-CA 3.11Å; D266-S268 VanDerWaalsContact OD1-CB 3.32Å; D266-S268 WeakPolarHBondContact OD1-CB 3.44Å; D266-S268 PolarHBondContact OD1-N 3.43Å; D266-S268 PolarHBondContact OD1-OG 3.04Å; D266-S268 PolarHBondContact OD2-OG 3.49Å; S268-L270 VanDerWaalsContact C-N 3.29Å; S268-L270 PolarHBondContact O-N 2.88Å; S268-S271 PolarHBondContact O-N 2.96Å; S268-S271 VanDerWaalsContact O-N 3.1Å; S268-S271 PolarHBondContact O-OG 3.25Å; S268-I272 VanDerWaalsContact O-CG1 3.29Å; S268-I272 WeakPolarHBondContact O-CG1 3.37Å; S268-I272 PolarHBondContact O-N 3.15Å
269	A	56.8	Low	62.1	Low	16 Å²	16	47.5 Å²	47.5	13%	0.132	31%	0.306	C	S	.	.	H	α-helix	trans	-57.4	-41.3	175.1	0	0	0	0	0	112.2	T263 D266 I272 A273	T263-A269 HydrophobicContact CG2-CB 4.29Å; D266-A269 HydrophobicContact CB-CB 4.06Å; D266-A269 PolarHBondContact O-N 3.33Å; A269-I272 PolarHBondContact O-N 2.95Å; A269-A273 WeakPolarHBondContact O-CB 3.22Å; A269-A273 PolarHBondContact O-N 3.49Å
270	L	63.6	Low	61.3	Low	8 Å²	8	48.4 Å²	48.4	4%	0.042	31%	0.311	C	S	.	.	H	α-helix	trans	-65.6	-41.3	176.2	-164.9	69.2	0	0	0	112.1	L259 T263 D266 S268 A274 L536 A539 H540	L259-L270 HydrophobicContact CD2-CD1 3.62Å; L259-L270 HydrophobicContact CG-CD1 3.63Å; T263-L270 HydrophobicContact CG2-CD1 4.23Å; D266-L270 PolarHBondContact O-N 2.96Å; S268-L270 VanDerWaalsContact C-N 3.29Å; S268-L270 PolarHBondContact O-N 2.88Å; L270-A274 WeakPolarHBondContact O-CB 3.34Å; L270-A274 PolarHBondContact O-N 2.98Å; L270-L536 HydrophobicContact CD2-CD2 4.25Å; L270-A539 HydrophobicContact CD2-CB 3.97Å; L270-H540 WeakPolarHBondContact CD2-NE2 3.35Å
271	S	59.8	Low	60.8	Low	50 Å²	50	52.7 Å²	52.7	35%	0.35	33%	0.33	S	S	.	.	H	α-helix	trans	-67.9	-36.1	176.1	71.9	0	0	0	0	113.2	T267 S268 A274 A275	T267-S271 VanDerWaalsContact O-CB 3.31Å; T267-S271 WeakPolarHBondContact O-CB 3.49Å; T267-S271 PolarHBondContact O-N 2.92Å; T267-S271 PolarHBondContact O-OG 2.97Å; S268-S271 PolarHBondContact O-N 2.96Å; S268-S271 VanDerWaalsContact O-N 3.1Å; S268-S271 PolarHBondContact O-OG 3.25Å; S271-A274 PolarHBondContact O-N 3.14Å; S271-A275 VanDerWaalsContact O-CB 3.29Å; S271-A275 WeakPolarHBondContact O-CB 3.37Å; S271-A275 PolarHBondContact O-N 3.28Å
272	I	62.8	Low	60.3	Low	89 Å²	89	50.6 Å²	50.6	46%	0.456	33%	0.329	S	S	.	.	H	α-helix	trans	-69.1	-42.7	176.6	-68.6	163.1	0	0	0	110.2	S268 A269 A274 A275 A276 L365	S268-I272 VanDerWaalsContact O-CG1 3.29Å; S268-I272 WeakPolarHBondContact O-CG1 3.37Å; S268-I272 PolarHBondContact O-N 3.15Å; A269-I272 PolarHBondContact O-N 2.95Å; I272-A274 PolarHBondContact O-N 3.47Å; I272-A275 PolarHBondContact O-N 3.03Å; I272-A276 VanDerWaalsContact O-CB 3.28Å; I272-A276 WeakPolarHBondContact O-CB 3.3Å; I272-A276 PolarHBondContact O-N 3.02Å; I272-L365 HydrophobicContact CG2-CD2 4.47Å
273	A	53.4	Low	59.9	Low	11 Å²	11	51 Å²	51	9%	0.091	33%	0.329	C	S	.	.	H	α-helix	trans	-62.5	-41.7	174.6	0	0	0	0	0	112	A269 A276 A277 A372	A269-A273 WeakPolarHBondContact O-CB 3.22Å; A269-A273 PolarHBondContact O-N 3.49Å; A273-A276 PolarHBondContact O-N 3.26Å; A273-A277 WeakPolarHBondContact O-CB 3.09Å; A273-A277 PolarHBondContact O-N 3.48Å; A273-A372 HydrophobicContact CB-CB 3.69Å
274	A	60.2	Low	58.7	Low	42 Å²	42	53.2 Å²	53.2	35%	0.347	35%	0.345	S	S	.	.	H	α-helix	trans	-65.4	-42.3	175	0	0	0	0	0	112.5	L270 S271 I272 A277 A278	L270-A274 WeakPolarHBondContact O-CB 3.34Å; L270-A274 PolarHBondContact O-N 2.98Å; S271-A274 PolarHBondContact O-N 3.14Å; I272-A274 PolarHBondContact O-N 3.47Å; A274-A277 PolarHBondContact O-N 3.2Å; A274-A278 WeakPolarHBondContact O-CB 3.48Å; A274-A278 PolarHBondContact O-N 3.34Å
275	A	58.4	Low	57.9	Low	61 Å²	61	49 Å²	49	50%	0.504	33%	0.331	S	S	.	.	H	α-helix	trans	-66.2	-40	176.4	0	0	0	0	0	112.2	S271 I272 A278 A279	S271-A275 VanDerWaalsContact O-CB 3.29Å; S271-A275 WeakPolarHBondContact O-CB 3.37Å; S271-A275 PolarHBondContact O-N 3.28Å; I272-A275 PolarHBondContact O-N 3.03Å; A275-A278 PolarHBondContact O-N 3.29Å; A275-A279 WeakPolarHBondContact O-CB 3.4Å; A275-A279 PolarHBondContact O-N 3.25Å
276	A	52.7	Low	57.1	Low	25 Å²	25	51.6 Å²	51.6	21%	0.207	35%	0.352	C	S	.	.	H	α-helix	trans	-64.9	-44.1	175	0	0	0	0	0	111.7	I272 A273 A279 L280 L373	I272-A276 VanDerWaalsContact O-CB 3.28Å; I272-A276 WeakPolarHBondContact O-CB 3.3Å; I272-A276 PolarHBondContact O-N 3.02Å; A273-A276 PolarHBondContact O-N 3.26Å; A276-A279 PolarHBondContact O-N 3.41Å; A276-L280 WeakPolarHBondContact O-CB 3.3Å; A276-L280 VanDerWaalsContact O-CG 3.25Å; A276-L280 WeakPolarHBondContact O-CG 3.34Å; A276-L280 PolarHBondContact O-N 3.44Å; A276-L373 HydrophobicContact CB-CD1 3.97Å
277	A	56.5	Low	56.3	Low	21 Å²	21	50.6 Å²	50.6	17%	0.174	35%	0.354	C	S	.	.	H	α-helix	trans	-61.5	-43.6	174.4	0	0	0	0	0	111.9	A273 A274 L280 L281 L373	A273-A277 WeakPolarHBondContact O-CB 3.09Å; A273-A277 PolarHBondContact O-N 3.48Å; A274-A277 PolarHBondContact O-N 3.2Å; A277-L280 PolarHBondContact O-N 2.94Å; A277-L281 WeakPolarHBondContact O-CB 3.49Å; A277-L281 VanDerWaalsContact O-CG 3.32Å; A277-L281 WeakPolarHBondContact O-CG 3.33Å; A277-L281 PolarHBondContact O-N 2.98Å; A277-L373 HydrophobicContact CB-CD1 4.49Å
278	A	58.8	Low	55.5	Low	31 Å²	31	49.9 Å²	49.9	26%	0.256	36%	0.355	S	S	.	.	H	α-helix	trans	-63.6	-42.1	175.4	0	0	0	0	0	112.6	A274 A275 L281 S282 V528	A274-A278 WeakPolarHBondContact O-CB 3.48Å; A274-A278 PolarHBondContact O-N 3.34Å; A275-A278 PolarHBondContact O-N 3.29Å; A278-L281 PolarHBondContact O-N 3.05Å; A278-S282 WeakPolarHBondContact O-CB 3.44Å; A278-S282 PolarHBondContact O-N 2.97Å; A278-S282 PolarHBondContact O-OG 3.2Å; A278-V528 HydrophobicContact CB-CG1 3.97Å
279	A	58.2	Low	55.1	Low	53 Å²	53	50 Å²	50	44%	0.438	36%	0.36	S	S	.	.	H	α-helix	trans	-61.2	-45.6	175.6	0	0	0	0	0	111.4	A275 A276 S282 S283	A275-A279 WeakPolarHBondContact O-CB 3.4Å; A275-A279 PolarHBondContact O-N 3.25Å; A276-A279 PolarHBondContact O-N 3.41Å; A279-S282 PolarHBondContact O-N 3.02Å; A279-S282 PolarHBondContact O-OG 2.95Å; A279-S283 PolarHBondContact O-N 3.29Å; A279-S283 PolarHBondContact O-OG 3.01Å
280	L	56.5	Low	54.9	Low	51 Å²	51	52.1 Å²	52.1	27%	0.267	38%	0.377	S	S	.	.	H	α-helix	trans	-63.5	-42.2	177.8	-70.4	167.9	0	0	0	112.4	A276 A277 S282 S283 S284 L330 L373	A276-L280 WeakPolarHBondContact O-CB 3.3Å; A276-L280 VanDerWaalsContact O-CG 3.25Å; A276-L280 WeakPolarHBondContact O-CG 3.34Å; A276-L280 PolarHBondContact O-N 3.44Å; A277-L280 PolarHBondContact O-N 2.94Å; L280-S282 VanDerWaalsContact C-N 3.34Å; L280-S282 PolarHBondContact O-N 3.02Å; L280-S283 WeakPolarHBondContact CA-OG 3.49Å; L280-S283 PolarHBondContact O-N 3.09Å; L280-S283 PolarHBondContact O-OG 2.7Å; L280-S284 PolarHBondContact O-N 2.99Å; L280-S284 PolarHBondContact O-OG 2.82Å; L280-L330 HydrophobicContact CD1-CD1 3.63Å; L280-L330 HydrophobicContact CD2-CD1 3.48Å; L280-L330 VanDerWaalsContact CD2-CD1 3.48Å; L280-L330 HydrophobicContact CG-CD1 4.12Å; L280-L373 HydrophobicContact CD1-CD1 4.05Å; L280-L373 HydrophobicContact CD1-CD2 3.94Å; L280-L373 HydrophobicContact CD1-CG 4.39Å
281	L	59.9	Low	54	Low	123 Å²	123	54.6 Å²	54.6	64%	0.644	40%	0.399	S	S	*	.	H	α-helix	trans	-63.7	-36.8	173	-71.2	167.3	0	0	0	112.6	A277 A278 S284 A285	A277-L281 WeakPolarHBondContact O-CB 3.49Å; A277-L281 VanDerWaalsContact O-CG 3.32Å; A277-L281 WeakPolarHBondContact O-CG 3.33Å; A277-L281 PolarHBondContact O-N 2.98Å; A278-L281 PolarHBondContact O-N 3.05Å; L281-S284 PolarHBondContact O-OG 3.35Å; L281-S284 VanDerWaalsContact O-OG 3.11Å; L281-A285 WeakPolarHBondContact O-CB 3.34Å; L281-A285 PolarHBondContact O-N 2.96Å; L281-A285 VanDerWaalsContact O-N 3.11Å
282	S	61.2	Low	53.6	Low	76 Å²	76	55 Å²	55	53%	0.531	41%	0.405	S	S	.	.	H	α-helix	trans	-69.6	-36.1	175.1	73.9	0	0	0	0	112.5	A278 A279 L280 A286	A278-S282 WeakPolarHBondContact O-CB 3.44Å; A278-S282 PolarHBondContact O-N 2.97Å; A278-S282 PolarHBondContact O-OG 3.2Å; A279-S282 PolarHBondContact O-N 3.02Å; A279-S282 PolarHBondContact O-OG 2.95Å; L280-S282 VanDerWaalsContact C-N 3.34Å; L280-S282 PolarHBondContact O-N 3.02Å; S282-A286 WeakPolarHBondContact O-CB 3.26Å; S282-A286 PolarHBondContact O-N 3.17Å
283	S	56.9	Low	53	Low	48 Å²	48	53.1 Å²	53.1	34%	0.336	40%	0.403	S	S	.	.	H	α-helix	trans	-73.3	-36	178	70.5	0	0	0	0	112.9	A279 L280 A286 A287	A279-S283 PolarHBondContact O-N 3.29Å; A279-S283 PolarHBondContact O-OG 3.01Å; L280-S283 WeakPolarHBondContact CA-OG 3.49Å; L280-S283 PolarHBondContact O-N 3.09Å; L280-S283 PolarHBondContact O-OG 2.7Å; S283-A286 PolarHBondContact O-N 2.82Å; S283-A287 WeakPolarHBondContact O-CB 3.13Å; S283-A287 PolarHBondContact O-N 3.47Å
284	S	42.6	Very low	52.7	Low	53 Å²	53	55.5 Å²	55.5	37%	0.371	42%	0.423	S	S	.	.	H	α-helix	trans	-70.2	-37	173.3	64.3	0	0	0	0	112	L280 L281 A287 A288	L280-S284 PolarHBondContact O-N 2.99Å; L280-S284 PolarHBondContact O-OG 2.82Å; L281-S284 PolarHBondContact O-OG 3.35Å; L281-S284 VanDerWaalsContact O-OG 3.11Å; S284-A287 PolarHBondContact O-N 3.24Å; S284-A288 VanDerWaalsContact O-CB 3.32Å; S284-A288 WeakPolarHBondContact O-CB 3.37Å; S284-A288 PolarHBondContact O-N 3.11Å
285	A	48.3	Very low	51.9	Low	59 Å²	59	56.6 Å²	56.6	49%	0.488	43%	0.432	S	S	.	.	H	α-helix	trans	-63	-43.5	171	0	0	0	0	0	112.2	L281 A288 A289	L281-A285 WeakPolarHBondContact O-CB 3.34Å; L281-A285 PolarHBondContact O-N 2.96Å; L281-A285 VanDerWaalsContact O-N 3.11Å; A285-A288 PolarHBondContact O-N 2.92Å; A285-A289 WeakPolarHBondContact O-CB 3.37Å; A285-A289 PolarHBondContact O-N 3.3Å
286	A	46.9	Very low	51.3	Low	60 Å²	60	58.4 Å²	58.4	50%	0.496	44%	0.437	S	S	.	.	H	α-helix	trans	-64.3	-42.5	175.7	0	0	0	0	0	112.4	S282 S283 A289 A290	S282-A286 WeakPolarHBondContact O-CB 3.26Å; S282-A286 PolarHBondContact O-N 3.17Å; S283-A286 PolarHBondContact O-N 2.82Å; A286-A289 PolarHBondContact O-N 2.88Å; A286-A290 WeakPolarHBondContact O-CB 3.03Å; A286-A290 PolarHBondContact O-N 3.28Å
287	A	47	Very low	51	Low	52 Å²	52	62.7 Å²	62.7	43%	0.43	46%	0.46	S	S	.	.	H	α-helix	trans	-65.1	-40	175.9	0	0	0	0	0	112.3	S283 S284 A290 A291	S283-A287 WeakPolarHBondContact O-CB 3.13Å; S283-A287 PolarHBondContact O-N 3.47Å; S284-A287 PolarHBondContact O-N 3.24Å; A287-A290 PolarHBondContact O-N 2.86Å; A287-A291 WeakPolarHBondContact O-CB 3.45Å; A287-A291 PolarHBondContact O-N 3.16Å
288	A	47.7	Very low	50.2	Low	61 Å²	61	63.9 Å²	63.9	50%	0.504	48%	0.475	S	S	.	.	H	α-helix	trans	-65.4	-40.3	174.6	0	0	0	0	0	112.2	S284 A285 A291 A292	S284-A288 VanDerWaalsContact O-CB 3.32Å; S284-A288 WeakPolarHBondContact O-CB 3.37Å; S284-A288 PolarHBondContact O-N 3.11Å; A285-A288 PolarHBondContact O-N 2.92Å; A288-A291 PolarHBondContact O-N 2.83Å; A288-A292 WeakPolarHBondContact O-CB 3.24Å; A288-A292 PolarHBondContact O-N 3.03Å
289	A	49.3	Very low	49.1	Very low	60 Å²	60	69 Å²	69	50%	0.496	50%	0.497	S	S	.	.	H	α-helix	trans	-64.9	-42.1	174.3	0	0	0	0	0	112.1	A285 A286 A292 A293	A285-A289 WeakPolarHBondContact O-CB 3.37Å; A285-A289 PolarHBondContact O-N 3.3Å; A286-A289 PolarHBondContact O-N 2.88Å; A289-A292 PolarHBondContact O-N 2.89Å; A289-A293 WeakPolarHBondContact O-CB 3.49Å; A289-A293 PolarHBondContact O-N 3.32Å
290	A	51.7	Low	47.9	Very low	60 Å²	60	74.2 Å²	74.2	50%	0.496	52%	0.518	S	S	.	.	H	α-helix	trans	-64.2	-40.3	175.4	0	0	0	0	0	112.3	A286 A287 A293 A294	A286-A290 WeakPolarHBondContact O-CB 3.03Å; A286-A290 PolarHBondContact O-N 3.28Å; A287-A290 PolarHBondContact O-N 2.86Å; A290-A293 PolarHBondContact O-N 2.84Å; A290-A294 WeakPolarHBondContact O-CB 3.3Å; A290-A294 PolarHBondContact O-N 3.44Å
291	A	46	Very low	46.8	Very low	61 Å²	61	76 Å²	76	50%	0.504	54%	0.54	S	S	.	.	H	α-helix	trans	-65.1	-39.8	174.6	0	0	0	0	0	112.3	A287 A288 A294 A295	A287-A291 WeakPolarHBondContact O-CB 3.45Å; A287-A291 PolarHBondContact O-N 3.16Å; A288-A291 PolarHBondContact O-N 2.83Å; A291-A294 PolarHBondContact O-N 3.45Å; A291-A295 VanDerWaalsContact O-CB 3.3Å; A291-A295 WeakPolarHBondContact O-CB 3.33Å; A291-A295 PolarHBondContact O-N 2.97Å
292	A	50.7	Low	45.4	Very low	57 Å²	57	79.4 Å²	79.4	47%	0.471	55%	0.553	S	S	.	*	H	α-helix	trans	-67.6	-36.5	175.1	0	0	0	0	0	112.7	A288 A289 T296	A288-A292 WeakPolarHBondContact O-CB 3.24Å; A288-A292 PolarHBondContact O-N 3.03Å; A289-A292 PolarHBondContact O-N 2.89Å; A292-T296 PolarHBondContact O-N 2.8Å; A292-T296 VanDerWaalsContact O-N 3.15Å; A292-T296 PolarHBondContact O-OG1 3.44Å
293	A	49.8	Very low	43.9	Very low	51 Å²	51	81.1 Å²	81.1	42%	0.421	57%	0.565	S	S	.	*	H	α-helix	trans	-64.2	-50.7	172	0	0	0	0	0	111.2	A289 A290 A295 T296 T297	A289-A293 WeakPolarHBondContact O-CB 3.49Å; A289-A293 PolarHBondContact O-N 3.32Å; A290-A293 PolarHBondContact O-N 2.84Å; A293-A295 VanDerWaalsContact C-N 3.28Å; A293-A295 PolarHBondContact O-N 3.3Å; A293-T296 PolarHBondContact O-N 2.92Å; A293-T296 PolarHBondContact O-OG1 3.45Å; A293-T297 PolarHBondContact O-N 2.93Å; A293-T297 PolarHBondContact O-OG1 2.9Å
294	A	47.9	Very low	42.8	Very low	61 Å²	61	84.1 Å²	84.1	50%	0.504	59%	0.586	S	S	.	*	H	α-helix	trans	-58.1	-39.5	177.5	0	0	0	0	0	112.7	A290 A291 T296 T297 G298	A290-A294 WeakPolarHBondContact O-CB 3.3Å; A290-A294 PolarHBondContact O-N 3.44Å; A291-A294 PolarHBondContact O-N 3.45Å; A294-T296 VanDerWaalsContact C-N 3.31Å; A294-T296 PolarHBondContact O-N 2.94Å; A294-T297 WeakPolarHBondContact CA-OG1 3.43Å; A294-T297 PolarHBondContact O-OG1 3.38Å; A294-T297 VanDerWaalsContact O-OG1 3.12Å; A294-G298 PolarHBondContact O-N 3.36Å
295	A	42.3	Very low	42.3	Very low	64 Å²	64	89.7 Å²	89.7	53%	0.529	61%	0.61	S	S	.	*	H	α-helix	trans	-70.4	-22.4	176.7	0	0	0	0	0	114	A291 A293	A291-A295 VanDerWaalsContact O-CB 3.3Å; A291-A295 WeakPolarHBondContact O-CB 3.33Å; A291-A295 PolarHBondContact O-N 2.97Å; A293-A295 VanDerWaalsContact C-N 3.28Å; A293-A295 PolarHBondContact O-N 3.3Å
296	T	45.4	Very low	41.5	Very low	100 Å²	100	92.1 Å²	92.1	61%	0.613	62%	0.624	S	S	*	*	H	α-helix	trans	-91.6	-26.7	175.9	42.5	0	0	0	0	112.8	A292 A293 A294 G298	A292-T296 PolarHBondContact O-N 2.8Å; A292-T296 VanDerWaalsContact O-N 3.15Å; A292-T296 PolarHBondContact O-OG1 3.44Å; A293-T296 PolarHBondContact O-N 2.92Å; A293-T296 PolarHBondContact O-OG1 3.45Å; A294-T296 VanDerWaalsContact C-N 3.31Å; A294-T296 PolarHBondContact O-N 2.94Å; T296-G298 VanDerWaalsContact C-N 3.32Å
297	T	47.4	Very low	41.1	Very low	114 Å²	114	99.5 Å²	99.5	70%	0.699	64%	0.639	S	S	*	*	H	α-helix	trans	-80.4	-9.1	169.9	53.8	0	0	0	0	114.2	A293 A294	A293-T297 PolarHBondContact O-N 2.93Å; A293-T297 PolarHBondContact O-OG1 2.9Å; A294-T297 WeakPolarHBondContact CA-OG1 3.43Å; A294-T297 PolarHBondContact O-OG1 3.38Å; A294-T297 VanDerWaalsContact O-OG1 3.12Å
298	G	39.2	Very low	40.6	Very low	47 Å²	47	103.1 Å²	103.1	49%	0.485	65%	0.651	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.1	2.9	-173.5	0	0	0	0	0	116.3	A294 T296	A294-G298 PolarHBondContact O-N 3.36Å; T296-G298 VanDerWaalsContact C-N 3.32Å
299	L	36.2	Very low	39.8	Very low	137 Å²	137	104.1 Å²	104.1	72%	0.717	67%	0.667	S	S	*	*	S	Bend	trans	-93	-9.3	-166.4	-68.3	171.3	0	0	0	115.5
300	D	33	Very low	38.9	Very low	163 Å²	163	105.3 Å²	105.3	87%	0.872	69%	0.685	S	S	*	*	S	Bend	trans	-104.1	17.3	-172.6	-62.6	-37.6	0	0	0	114.1
301	A	32.5	Very low	37.8	Very low	89 Å²	89	106.3 Å²	106.3	74%	0.736	70%	0.702	S	S	*	*			trans	-133.7	27.9	-164.3	0	0	0	0	0	117.1
302	E	31.2	Very low	37	Very low	194 Å²	194	106.5 Å²	106.5	91%	0.907	71%	0.71	S	S	*	*			trans	-106.4	86.4	175.2	-73.7	-154.7	118.3	0	0	114.1
303	S	29.9	Very low	35.9	Very low	112 Å²	112	111.8 Å²	111.8	78%	0.783	73%	0.73	S	S	*	*			trans	-164.7	89.4	152.9	51.9	0	0	0	0	114.8
304	S	33.9	Very low	35	Very low	112 Å²	112	113.1 Å²	113.1	78%	0.783	74%	0.741	S	S	*	*	S	Bend	trans	-169.2	109.7	147.9	-89.5	0	0	0	0	114.4
305	L	32	Very low	33.9	Very low	169 Å²	169	118.1 Å²	118.1	89%	0.885	76%	0.759	S	S	*	*			trans	59.2	96.4	143.8	-69.4	147.8	0	0	0	119.1
306	S	30.9	Very low	33.4	Very low	111 Å²	111	118.9 Å²	118.9	78%	0.776	77%	0.774	S	S	*	*			trans	-61.2	157.2	159.1	-26	0	0	0	0	112.6
307	R	38.7	Very low	32.6	Very low	214 Å²	214	120.3 Å²	120.3	81%	0.808	78%	0.777	S	S	*	*				-176.8	149.1	117	-98.9	172.2	76.7	170.1	6.4	114.7
308	D	36.9	Very low	31.9	Very low	129 Å²	129	123 Å²	123	69%	0.69	79%	0.786	S	S	*	*			trans	45.4	116	147.6	-50.4	-24.4	0	0	0	120.9
309	G	30.4	Very low	31.3	Very low	81 Å²	81	127.3 Å²	127.3	84%	0.835	80%	0.798	S	S	*	*				115.8	78.5	127.3	0	0	0	0	0	120.4
310	G	30.3	Very low	31	Very low	85 Å²	85	127.6 Å²	127.6	88%	0.876	80%	0.801	S	S	*	*			trans	46.3	116.9	131.6	0	0	0	0	0	122.8
311	G	28.8	Very low	31	Very low	82 Å²	82	125.6 Å²	125.6	85%	0.845	79%	0.79	S	S	*	*				94.4	80.4	121.4	0	0	0	0	0	120
312	G	28.7	Very low	31.2	Very low	65 Å²	65	127.9 Å²	127.9	67%	0.67	79%	0.79	S	S	*	*			trans	79.2	121	137.9	0	0	0	0	0	119.5
313	N	28.5	Very low	31.5	Very low	167 Å²	167	125.8 Å²	125.8	89%	0.893	79%	0.785	S	S	*	*				177.6	156.5	112.7	-89.4	-36.1	0	0	0	113
314	A	30	Very low	31.7	Very low	79 Å²	79	123 Å²	123	65%	0.653	77%	0.768	S	S	*	*			trans	55.4	118.8	149	0	0	0	0	0	121.7
315	D	26.7	Very low	31.8	Very low	167 Å²	167	120.7 Å²	120.7	89%	0.893	75%	0.752	S	S	*	*				54.9	81.4	121.5	-47.9	-27	0	0	0	119.2
316	G	30.8	Very low	31.9	Very low	80 Å²	80	115.8 Å²	115.8	83%	0.825	73%	0.732	S	S	*	*			trans	-122.6	83.9	170	0	0	0	0	0	113.2	L318	G316-L318 PolarHBondContact O-N 3.27Å
317	N	28.8	Very low	32.4	Very low	129 Å²	129	113.1 Å²	113.1	69%	0.69	71%	0.709	S	S	*	*			trans	-62.5	121.3	175.4	151.1	70.7	0	0	0	112.6	N319	N317-N319 PolarHBondContact OD1-ND2 3.4Å
318	L	32.3	Very low	32.6	Very low	170 Å²	170	105.7 Å²	105.7	89%	0.89	69%	0.694	S	S	*	*			trans	-144.6	119.1	153.6	-92.1	178.1	0	0	0	110.6	G316	G316-L318 PolarHBondContact O-N 3.27Å
319	N	27.7	Very low	32.8	Very low	138 Å²	138	102 Å²	102	74%	0.738	67%	0.673	S	S	*	*			trans	-88.3	137.5	171.6	-47.3	-90.2	0	0	0	108.9	N317	N317-N319 PolarHBondContact OD1-ND2 3.4Å
320	N	29.6	Very low	33.2	Very low	143 Å²	143	100.7 Å²	100.7	77%	0.765	65%	0.647	S	S	*	*			trans	166.2	70.5	142.7	-177.1	44.1	0	0	0	112
321	D	31.5	Very low	33.9	Very low	122 Å²	122	100.7 Å²	100.7	65%	0.652	63%	0.627	S	S	*	*			trans	-148	47.2	-176.3	-114.2	-38.1	0	0	0	114.6	N323 A324	D321-N323 PolarHBondContact O-N 3.46Å; D321-A324 HydrophobicContact CB-CB 4.44Å; D321-A324 PolarHBondContact O-N 2.86Å; D321-A324 VanDerWaalsContact O-N 3.08Å
322	N	38.2	Very low	34.4	Very low	136 Å²	136	99 Å²	99	73%	0.727	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	-14.9	-172.6	-66.2	-15.9	0	0	0	115.2
323	N	36.7	Very low	34.9	Very low	151 Å²	151	97.8 Å²	97.8	81%	0.807	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-19.8	179.6	-64.8	-18.3	0	0	0	113.4	D321	D321-N323 PolarHBondContact O-N 3.46Å
324	A	34.2	Very low	35.3	Very low	52 Å²	52	92.6 Å²	92.6	43%	0.43	56%	0.56	S	S	.	*	H	α-helix	trans	-76.2	-33.7	179.7	0	0	0	0	0	112.3	D321 S326 L327 A328	D321-A324 HydrophobicContact CB-CB 4.44Å; D321-A324 PolarHBondContact O-N 2.86Å; D321-A324 VanDerWaalsContact O-N 3.08Å; A324-S326 PolarHBondContact O-N 2.83Å; A324-L327 PolarHBondContact O-N 3.07Å; A324-A328 WeakPolarHBondContact O-CB 3.31Å; A324-A328 PolarHBondContact O-N 3.33Å
325	S	35.7	Very low	35.6	Very low	64 Å²	64	93.6 Å²	93.6	45%	0.448	55%	0.554	S	S	.	*	H	α-helix	trans	-57.3	-43.9	-174.5	-57.7	0	0	0	0	113.6	L327 A328 I329	S325-L327 VanDerWaalsContact C-N 3.31Å; S325-L327 PolarHBondContact O-N 2.82Å; S325-A328 PolarHBondContact O-N 2.82Å; S325-I329 WeakPolarHBondContact O-CB 3.46Å; S325-I329 WeakPolarHBondContact O-CD1 3.26Å; S325-I329 WeakPolarHBondContact O-CG1 3.43Å; S325-I329 PolarHBondContact O-N 3Å
326	S	34.3	Very low	35.9	Very low	67 Å²	67	89.2 Å²	89.2	47%	0.469	54%	0.536	S	S	.	.	H	α-helix	trans	-60.3	-41.1	-177.3	-47	0	0	0	0	112.5	A324 L330	A324-S326 PolarHBondContact O-N 2.83Å; S326-L330 WeakPolarHBondContact O-CG 2.92Å; S326-L330 PolarHBondContact O-N 3.33Å
327	L	42	Very low	36.1	Very low	54 Å²	54	89.6 Å²	89.6	28%	0.283	52%	0.523	S	S	.	.	H	α-helix	trans	-79.3	-35.7	-178.1	-150	152.9	0	0	0	110.8	A324 S325 L330 N331	A324-L327 PolarHBondContact O-N 3.07Å; S325-L327 VanDerWaalsContact C-N 3.31Å; S325-L327 PolarHBondContact O-N 2.82Å; L327-L330 PolarHBondContact O-N 3.16Å; L327-N331 WeakPolarHBondContact O-CB 3.4Å; L327-N331 PolarHBondContact O-N 2.82Å
328	A	43	Very low	36.1	Very low	59 Å²	59	87.7 Å²	87.7	49%	0.488	52%	0.52	S	S	.	.	H	α-helix	trans	-62.1	-40.6	170	0	0	0	0	0	112.8	A324 S325 N331 A332	A324-A328 WeakPolarHBondContact O-CB 3.31Å; A324-A328 PolarHBondContact O-N 3.33Å; S325-A328 PolarHBondContact O-N 2.82Å; A328-N331 PolarHBondContact O-N 2.65Å; A328-A332 WeakPolarHBondContact O-CB 3.47Å; A328-A332 PolarHBondContact O-N 3.16Å
329	I	40.6	Very low	36.1	Very low	50 Å²	50	83.6 Å²	83.6	26%	0.256	51%	0.51	S	S	.	.	H	α-helix	trans	-68.6	-39.3	178	-66.2	160	0	0	0	111.2	S325 A332 L333 L359	S325-I329 WeakPolarHBondContact O-CB 3.46Å; S325-I329 WeakPolarHBondContact O-CD1 3.26Å; S325-I329 WeakPolarHBondContact O-CG1 3.43Å; S325-I329 PolarHBondContact O-N 3Å; I329-A332 PolarHBondContact O-N 3.31Å; I329-L333 HydrophobicContact CG2-CD1 4.32Å; I329-L333 WeakPolarHBondContact O-CD1 3.22Å; I329-L333 PolarHBondContact O-N 3.26Å; I329-L359 HydrophobicContact CG2-CD1 4.37Å; I329-L359 HydrophobicContact CG2-CD2 3.72Å; I329-L359 HydrophobicContact CG2-CG 4.19Å
330	L	38.9	Very low	36.2	Very low	55 Å²	55	81.9 Å²	81.9	29%	0.288	51%	0.509	S	S	.	.	H	α-helix	trans	-65.9	-42.1	174.1	-76.7	163.7	0	0	0	112.3	L280 S326 L327 A332 L333 S334 L373	L280-L330 HydrophobicContact CD1-CD1 3.63Å; L280-L330 HydrophobicContact CD2-CD1 3.48Å; L280-L330 VanDerWaalsContact CD2-CD1 3.48Å; L280-L330 HydrophobicContact CG-CD1 4.12Å; S326-L330 WeakPolarHBondContact O-CG 2.92Å; S326-L330 PolarHBondContact O-N 3.33Å; L327-L330 PolarHBondContact O-N 3.16Å; L330-A332 VanDerWaalsContact C-N 3.32Å; L330-A332 PolarHBondContact O-N 3.02Å; L330-L333 PolarHBondContact O-N 3.46Å; L330-S334 PolarHBondContact O-N 2.96Å; L330-L373 HydrophobicContact CD2-CD2 4.14Å
331	N	43.9	Very low	36.1	Very low	85 Å²	85	80.6 Å²	80.6	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-64	-37	172	-77	-15.1	0	0	0	111.9	L327 A328 S334 N335	L327-N331 WeakPolarHBondContact O-CB 3.4Å; L327-N331 PolarHBondContact O-N 2.82Å; A328-N331 PolarHBondContact O-N 2.65Å; N331-S334 PolarHBondContact O-N 2.83Å; N331-N335 VanDerWaalsContact O-CB 3.24Å; N331-N335 WeakPolarHBondContact O-CB 3.4Å; N331-N335 PolarHBondContact O-N 2.9Å; N331-N335 PolarHBondContact O-ND2 3.37Å
332	A	40.4	Very low	35.9	Very low	46 Å²	46	79.6 Å²	79.6	38%	0.38	52%	0.52	S	S	.	.	H	α-helix	trans	-65.2	-38.3	174	0	0	0	0	0	112.2	A328 I329 L330 S336	A328-A332 WeakPolarHBondContact O-CB 3.47Å; A328-A332 PolarHBondContact O-N 3.16Å; I329-A332 PolarHBondContact O-N 3.31Å; L330-A332 VanDerWaalsContact C-N 3.32Å; L330-A332 PolarHBondContact O-N 3.02Å; A332-S336 WeakPolarHBondContact O-CB 3.12Å; A332-S336 PolarHBondContact O-N 3.33Å; A332-S336 PolarHBondContact O-OG 3.34Å
333	L	38.7	Very low	35.3	Very low	39 Å²	39	76.7 Å²	76.7	20%	0.204	52%	0.523	C	S	.	.	H	α-helix	trans	-63.6	-52.1	171.6	-101.5	66.1	0	0	0	111	I329 L330 N335 S336 T337 L359 V374	I329-L333 HydrophobicContact CG2-CD1 4.32Å; I329-L333 WeakPolarHBondContact O-CD1 3.22Å; I329-L333 PolarHBondContact O-N 3.26Å; L330-L333 PolarHBondContact O-N 3.46Å; L333-N335 PolarHBondContact O-N 3.13Å; L333-S336 PolarHBondContact O-N 3.31Å; L333-S336 PolarHBondContact O-OG 3.1Å; L333-T337 PolarHBondContact O-N 3.4Å; L333-L359 HydrophobicContact CD1-CD1 4Å; L333-L359 HydrophobicContact CD2-CD1 3.95Å; L333-V374 HydrophobicContact CD2-CG2 4.4Å
334	S	36.6	Very low	34.7	Very low	59 Å²	59	74.7 Å²	74.7	41%	0.413	52%	0.52	S	S	.	.	H	α-helix	trans	-54.7	-53.4	178.5	-170.5	0	0	0	0	111.6	L330 N331 S336 T337	L330-S334 PolarHBondContact O-N 2.96Å; N331-S334 PolarHBondContact O-N 2.83Å; S334-S336 VanDerWaalsContact C-N 3.3Å; S334-S336 PolarHBondContact O-N 3.43Å; S334-T337 PolarHBondContact O-N 2.84Å; S334-T337 VanDerWaalsContact O-N 3.09Å; S334-T337 PolarHBondContact O-OG1 2.87Å
335	N	36.1	Very low	34.3	Very low	99 Å²	99	77.6 Å²	77.6	53%	0.529	53%	0.533	S	S	.	.	H	α-helix	trans	-69.6	-25.8	-176.3	-64.6	-7.9	0	0	0	113	N331 L333 T337 S338	N331-N335 VanDerWaalsContact O-CB 3.24Å; N331-N335 WeakPolarHBondContact O-CB 3.4Å; N331-N335 PolarHBondContact O-N 2.9Å; N331-N335 PolarHBondContact O-ND2 3.37Å; L333-N335 PolarHBondContact O-N 3.13Å; N335-T337 PolarHBondContact O-N 2.97Å; N335-S338 WeakPolarHBondContact CA-OG 3.06Å; N335-S338 PolarHBondContact O-N 3.33Å; N335-S338 PolarHBondContact O-OG 3.06Å
336	S	35.1	Very low	33.8	Very low	75 Å²	75	81.9 Å²	81.9	52%	0.524	55%	0.549	S	S	.	.	H	α-helix	trans	-69.8	-16.2	173.4	71.3	0	0	0	0	114	A332 L333 S334	A332-S336 WeakPolarHBondContact O-CB 3.12Å; A332-S336 PolarHBondContact O-N 3.33Å; A332-S336 PolarHBondContact O-OG 3.34Å; L333-S336 PolarHBondContact O-N 3.31Å; L333-S336 PolarHBondContact O-OG 3.1Å; S334-S336 VanDerWaalsContact C-N 3.3Å; S334-S336 PolarHBondContact O-N 3.43Å
337	T	34	Very low	33.6	Very low	88 Å²	88	84.7 Å²	84.7	54%	0.54	56%	0.563	S	S	.	*	H	α-helix	trans	-92	-23.4	174.9	64.7	0	0	0	0	113.6	L333 S334 N335	L333-T337 PolarHBondContact O-N 3.4Å; S334-T337 PolarHBondContact O-N 2.84Å; S334-T337 VanDerWaalsContact O-N 3.09Å; S334-T337 PolarHBondContact O-OG1 2.87Å; N335-T337 PolarHBondContact O-N 2.97Å
338	S	29.8	Very low	33.1	Very low	90 Å²	90	87.2 Å²	87.2	63%	0.629	58%	0.577	S	S	*	*	H	α-helix	trans	-85.3	-9.5	178.7	48.5	0	0	0	0	114.5	N335 S340	N335-S338 WeakPolarHBondContact CA-OG 3.06Å; N335-S338 PolarHBondContact O-N 3.33Å; N335-S338 PolarHBondContact O-OG 3.06Å; S338-S340 PolarHBondContact O-N 3.17Å
339	A	32	Very low	33	Very low	84 Å²	84	88.7 Å²	88.7	69%	0.694	58%	0.584	S	S	*	*			trans	-99.9	54.9	-175.2	0	0	0	0	0	113.1
340	S	28.2	Very low	32.5	Very low	102 Å²	102	89.3 Å²	89.3	71%	0.713	59%	0.592	S	S	*	*			trans	-139.9	38.9	-179	69.4	0	0	0	0	114.7	S338	S338-S340 PolarHBondContact O-N 3.17Å
341	S	27.6	Very low	32.5	Very low	115 Å²	115	89.2 Å²	89.2	80%	0.804	60%	0.6	S	S	*	*			trans	-76.8	127.3	163.3	56.9	0	0	0	0	110.4
342	A	28.5	Very low	32.5	Very low	101 Å²	101	88.6 Å²	88.6	84%	0.835	60%	0.602	S	S	*	*	S	Bend	trans	72.4	96.8	179.8	0	0	0	0	0	117.4
343	G	25.5	Very low	32.9	Very low	76 Å²	76	89.9 Å²	89.9	78%	0.784	61%	0.605	S	S	*	*				82.7	122.7	127.5	0	0	0	0	0	120.3
344	S	24.4	Very low	33.9	Very low	108 Å²	108	92.7 Å²	92.7	76%	0.755	62%	0.62	S	S	*	*			trans	90.9	136.8	154.3	-159.8	0	0	0	0	119.7
345	T	26.1	Very low	35	Very low	114 Å²	114	94.8 Å²	94.8	70%	0.699	62%	0.622	S	S	*	*			trans	53.7	100.7	151.1	41	0	0	0	0	120.1
346	I	24.1	Very low	35.6	Very low	153 Å²	153	92.6 Å²	92.6	79%	0.785	61%	0.61	S	S	*	*			trans	43	87.8	134.4	-46.9	174.2	0	0	0	115	D348	I346-D348 PolarHBondContact O-N 3.5Å
347	V	30.6	Very low	36.9	Very low	126 Å²	126	92.9 Å²	92.9	76%	0.764	61%	0.605	S	S	*	*			trans	-76.1	118.8	161.8	-155.1	0	0	0	0	107.9	S349	V347-S349 PolarHBondContact O-N 3.18Å
348	D	30.1	Very low	38.3	Very low	107 Å²	107	93.9 Å²	93.9	57%	0.572	60%	0.603	S	S	*	*			trans	-61.5	123.2	-173.9	-116.6	-37.2	0	0	0	111.9	I346 S350 A351	I346-D348 PolarHBondContact O-N 3.5Å; D348-S350 PolarHBondContact O-N 3.26Å; D348-A351 WeakPolarHBondContact O-CB 3.2Å; D348-A351 PolarHBondContact O-N 3.26Å
349	S	41.3	Very low	39.6	Very low	91 Å²	91	90.6 Å²	90.6	64%	0.636	58%	0.578	S	S	*	*	H	α-helix	trans	-59.3	-23.1	-176.9	-55.4	0	0	0	0	113.3	V347 V353	V347-S349 PolarHBondContact O-N 3.18Å; S349-V353 WeakPolarHBondContact O-CG2 3.37Å
350	S	31.6	Very low	41.1	Very low	62 Å²	62	87.1 Å²	87.1	43%	0.434	55%	0.551	S	S	.	*	H	α-helix	trans	-68.6	-36.5	175	58.6	0	0	0	0	112.9	D348 V353 N354	D348-S350 PolarHBondContact O-N 3.26Å; S350-V353 PolarHBondContact O-N 2.89Å; S350-N354 VanDerWaalsContact O-CB 3.23Å; S350-N354 WeakPolarHBondContact O-CB 3.42Å; S350-N354 PolarHBondContact O-N 3.46Å; S350-N354 PolarHBondContact O-ND2 2.97Å
351	A	37.3	Very low	42.9	Very low	54 Å²	54	88.7 Å²	88.7	45%	0.446	55%	0.551	S	S	.	*	H	α-helix	trans	-66.1	-46.1	-173.9	0	0	0	0	0	111.9	D348 K355	D348-A351 WeakPolarHBondContact O-CB 3.2Å; D348-A351 PolarHBondContact O-N 3.26Å; A351-K355 WeakPolarHBondContact O-CB 3.45Å; A351-K355 PolarHBondContact O-N 3.14Å
352	S	44.8	Very low	44.2	Very low	72 Å²	72	88.9 Å²	88.9	50%	0.503	54%	0.54	S	S	.	.	H	α-helix	trans	-67.4	-37.4	178.8	-58.9	0	0	0	0	112.3	L356	S352-L356 WeakPolarHBondContact O-CG 3.43Å; S352-L356 PolarHBondContact O-N 3.15Å; S352-L356 VanDerWaalsContact O-N 3.09Å
353	V	48.4	Very low	45.7	Very low	72 Å²	72	87.2 Å²	87.2	44%	0.436	52%	0.519	S	S	.	.	H	α-helix	trans	-71.5	-44.3	177.4	173.5	0	0	0	0	111.2	S349 S350 K355 L356 I357	S349-V353 WeakPolarHBondContact O-CG2 3.37Å; S350-V353 PolarHBondContact O-N 2.89Å; V353-K355 VanDerWaalsContact C-N 3.3Å; V353-K355 PolarHBondContact O-N 3.03Å; V353-L356 PolarHBondContact O-N 3.15Å; V353-L356 VanDerWaalsContact O-N 3.17Å; V353-I357 HydrophobicContact CG1-CD1 3.9Å; V353-I357 WeakPolarHBondContact O-CG1 3.21Å; V353-I357 PolarHBondContact O-N 3.08Å
354	N	59.6	Low	47.8	Very low	99 Å²	99	87.2 Å²	87.2	53%	0.529	52%	0.519	S	S	.	.	H	α-helix	trans	-60.9	-40.3	175.4	-72	-15.1	0	0	0	111.4	S350 L356 I357 E358	S350-N354 VanDerWaalsContact O-CB 3.23Å; S350-N354 WeakPolarHBondContact O-CB 3.42Å; S350-N354 PolarHBondContact O-N 3.46Å; S350-N354 PolarHBondContact O-ND2 2.97Å; N354-L356 VanDerWaalsContact C-N 3.34Å; N354-L356 PolarHBondContact O-N 2.67Å; N354-I357 PolarHBondContact O-N 3Å; N354-E358 WeakPolarHBondContact O-CB 3.46Å; N354-E358 PolarHBondContact O-N 3Å
355	K	59.1	Low	49.5	Very low	102 Å²	102	84.2 Å²	84.2	44%	0.443	49%	0.494	S	S	.	.	H	α-helix	trans	-67.6	-31.5	176.5	-161	169.7	-171.8	177.1	0	112.9	A351 V353 L359	A351-K355 WeakPolarHBondContact O-CB 3.45Å; A351-K355 PolarHBondContact O-N 3.14Å; V353-K355 VanDerWaalsContact C-N 3.3Å; V353-K355 PolarHBondContact O-N 3.03Å; K355-L359 WeakPolarHBondContact O-CB 3.47Å; K355-L359 PolarHBondContact O-N 3.45Å
356	L	50.4	Low	51.3	Low	54 Å²	54	81.5 Å²	81.5	28%	0.283	48%	0.48	S	S	.	.	H	α-helix	trans	-71.7	-35.6	170	-76.6	167.6	0	0	0	112.7	S352 V353 N354 G360 L370	S352-L356 WeakPolarHBondContact O-CG 3.43Å; S352-L356 PolarHBondContact O-N 3.15Å; S352-L356 VanDerWaalsContact O-N 3.09Å; V353-L356 PolarHBondContact O-N 3.15Å; V353-L356 VanDerWaalsContact O-N 3.17Å; N354-L356 VanDerWaalsContact C-N 3.34Å; N354-L356 PolarHBondContact O-N 2.67Å; L356-G360 PolarHBondContact O-N 3.02Å; L356-L370 HydrophobicContact CD2-CB 4.12Å; L356-L370 HydrophobicContact CD2-CD1 4.46Å; L356-L370 WeakPolarHBondContact O-CD1 3.2Å
357	I	60.6	Low	52.9	Low	80 Å²	80	78.4 Å²	78.4	41%	0.41	47%	0.469	S	S	.	.	H	α-helix	trans	-67.3	-43.2	173.5	-69	164.3	0	0	0	110.4	V353 N354 G360 N361	V353-I357 HydrophobicContact CG1-CD1 3.9Å; V353-I357 WeakPolarHBondContact O-CG1 3.21Å; V353-I357 PolarHBondContact O-N 3.08Å; N354-I357 PolarHBondContact O-N 3Å; I357-G360 PolarHBondContact O-N 3.05Å; I357-G360 VanDerWaalsContact O-N 3.17Å; I357-N361 PolarHBondContact O-N 3.08Å; I357-N361 PolarHBondContact O-ND2 3.29Å
358	E	64	Low	54.2	Low	110 Å²	110	74 Å²	74	51%	0.514	45%	0.446	S	S	.	.	H	α-helix	trans	-61.7	-45.5	175.1	-175.7	171	-147	0	0	111.5	N354 G360 N361 Q362	N354-E358 WeakPolarHBondContact O-CB 3.46Å; N354-E358 PolarHBondContact O-N 3Å; E358-G360 VanDerWaalsContact C-N 3.34Å; E358-G360 PolarHBondContact O-N 3.47Å; E358-N361 PolarHBondContact O-N 3.43Å; E358-Q362 WeakPolarHBondContact O-CB 3.43Å; E358-Q362 VanDerWaalsContact O-CG 3.3Å; E358-Q362 WeakPolarHBondContact O-CG 3.19Å; E358-Q362 PolarHBondContact O-N 3.13Å
359	L	57.3	Low	55.6	Low	20 Å²	20	69.2 Å²	69.2	11%	0.105	42%	0.422	C	S	.	.	H	α-helix	trans	-55.7	-44.4	168.8	-100.6	159.9	0	0	0	112.7	I329 L333 K355 Q362 T363 L370	I329-L359 HydrophobicContact CG2-CD1 4.37Å; I329-L359 HydrophobicContact CG2-CD2 3.72Å; I329-L359 HydrophobicContact CG2-CG 4.19Å; L333-L359 HydrophobicContact CD1-CD1 4Å; L333-L359 HydrophobicContact CD2-CD1 3.95Å; K355-L359 WeakPolarHBondContact O-CB 3.47Å; K355-L359 PolarHBondContact O-N 3.45Å; L359-Q362 PolarHBondContact O-N 2.94Å; L359-T363 HydrophobicContact CD2-CG2 4.32Å; L359-T363 WeakPolarHBondContact O-CB 3.5Å; L359-T363 WeakPolarHBondContact O-CG2 3.36Å; L359-T363 PolarHBondContact O-N 2.92Å; L359-T363 PolarHBondContact O-OG1 2.88Å; L359-L370 HydrophobicContact CB-CD1 3.99Å; L359-L370 HydrophobicContact CB-CD2 4.34Å
360	G	63.9	Low	56.3	Low	11 Å²	11	65.2 Å²	65.2	11%	0.113	39%	0.393	C	S	.	.	H	α-helix	trans	-63.6	-42.3	178.4	0	0	0	0	0	112.2	L356 I357 E358 Q362 T363 G364 L365	L356-G360 PolarHBondContact O-N 3.02Å; I357-G360 PolarHBondContact O-N 3.05Å; I357-G360 VanDerWaalsContact O-N 3.17Å; E358-G360 VanDerWaalsContact C-N 3.34Å; E358-G360 PolarHBondContact O-N 3.47Å; G360-Q362 VanDerWaalsContact C-N 3.35Å; G360-Q362 PolarHBondContact O-N 3.37Å; G360-T363 PolarHBondContact O-N 3.03Å; G360-G364 WeakPolarHBondContact O-CA 3.4Å; G360-G364 PolarHBondContact O-N 3.25Å; G360-L365 WeakPolarHBondContact CA-O 3.48Å
361	N	65.2	Low	57.8	Low	135 Å²	135	64.6 Å²	64.6	72%	0.722	39%	0.387	S	S	*	.	H	α-helix	trans	-66.5	-34.3	175.7	-66.2	-19.9	0	0	0	112.5	I357 E358	I357-N361 PolarHBondContact O-N 3.08Å; I357-N361 PolarHBondContact O-ND2 3.29Å; E358-N361 PolarHBondContact O-N 3.43Å
362	Q	54.6	Low	58.7	Low	120 Å²	120	62.1 Å²	62.1	56%	0.561	37%	0.366	S	S	*	.	H	α-helix	trans	-78.5	-27.5	177.4	-72	175	12	0	0	113.7	E358 L359 G360	E358-Q362 WeakPolarHBondContact O-CB 3.43Å; E358-Q362 VanDerWaalsContact O-CG 3.3Å; E358-Q362 WeakPolarHBondContact O-CG 3.19Å; E358-Q362 PolarHBondContact O-N 3.13Å; L359-Q362 PolarHBondContact O-N 2.94Å; G360-Q362 VanDerWaalsContact C-N 3.35Å; G360-Q362 PolarHBondContact O-N 3.37Å
363	T	61.1	Low	59.1	Low	66 Å²	66	59.4 Å²	59.4	41%	0.405	35%	0.346	S	S	.	.	H	α-helix	trans	-110.7	-11	-173.1	59.7	0	0	0	0	114.6	L359 G360 L365	L359-T363 HydrophobicContact CD2-CG2 4.32Å; L359-T363 WeakPolarHBondContact O-CB 3.5Å; L359-T363 WeakPolarHBondContact O-CG2 3.36Å; L359-T363 PolarHBondContact O-N 2.92Å; L359-T363 PolarHBondContact O-OG1 2.88Å; G360-T363 PolarHBondContact O-N 3.03Å; T363-L365 PolarHBondContact O-N 2.64Å; T363-L365 WeakPolarHBondContact OG1-CB 3.34Å; T363-L365 PolarHBondContact OG1-N 3.31Å
364	G	69.9	Low	59.2	Low	75 Å²	75	58 Å²	58	77%	0.773	34%	0.337	S	S	*	.			trans	69.7	3.3	-170.7	0	0	0	0	0	114.3	G360	G360-G364 WeakPolarHBondContact O-CA 3.4Å; G360-G364 PolarHBondContact O-N 3.25Å
365	L	60.1	Low	58.8	Low	45 Å²	45	54.8 Å²	54.8	24%	0.236	32%	0.324	C	S	.	.			trans	-78.7	138.8	-179.7	-65.6	175	0	0	0	111.1	I272 G360 T363 A369 L370	I272-L365 HydrophobicContact CG2-CD2 4.47Å; G360-L365 WeakPolarHBondContact CA-O 3.48Å; T363-L365 PolarHBondContact O-N 2.64Å; T363-L365 WeakPolarHBondContact OG1-CB 3.34Å; T363-L365 PolarHBondContact OG1-N 3.31Å; L365-A369 HydrophobicContact CB-CB 4.25Å; L365-A369 HydrophobicContact CD2-CB 4.25Å; L365-L370 HydrophobicContact CB-CD2 4.09Å; L365-L370 HydrophobicContact CB-CG 3.98Å; L365-L370 HydrophobicContact CD1-CD2 3.83Å
366	S	64	Low	58.2	Low	57 Å²	57	52.5 Å²	52.5	40%	0.399	32%	0.321	S	S	.	.			trans	-66.9	154.5	171.9	73.1	0	0	0	0	111	A368 A369 L370	S366-A368 PolarHBondContact O-N 2.88Å; S366-A368 VanDerWaalsContact O-N 3.14Å; S366-A369 WeakPolarHBondContact O-CA 3.22Å; S366-A369 WeakPolarHBondContact O-CB 3.49Å; S366-A369 PolarHBondContact O-N 2.76Å; S366-A369 PolarHBondContact OG-N 2.82Å; S366-L370 PolarHBondContact O-N 2.84Å
367	P	58	Low	58	Low	88 Å²	88	54.2 Å²	54.2	57%	0.571	33%	0.334	S	S	*	.	H	α-helix	trans	-54.8	-33.4	174.4	-28.3	36.2	0	0	0	113.2	L370 V371	P367-L370 PolarHBondContact O-N 3.26Å; P367-V371 WeakPolarHBondContact O-CB 3.32Å; P367-V371 VanDerWaalsContact O-CG2 3.3Å; P367-V371 WeakPolarHBondContact O-CG2 3.33Å; P367-V371 PolarHBondContact O-N 3.27Å
368	A	56.9	Low	57.1	Low	34 Å²	34	52.8 Å²	52.8	28%	0.281	34%	0.339	S	S	.	.	H	α-helix	trans	-67.5	-37.8	174.2	0	0	0	0	0	112.8	S366 A372	S366-A368 PolarHBondContact O-N 2.88Å; S366-A368 VanDerWaalsContact O-N 3.14Å; A368-A372 VanDerWaalsContact O-CB 3.28Å; A368-A372 WeakPolarHBondContact O-CB 3.4Å; A368-A372 PolarHBondContact O-N 3.2Å
369	A	58.8	Low	55.8	Low	7 Å²	7	51 Å²	51	6%	0.058	34%	0.339	C	S	.	.	H	α-helix	trans	-68.9	-37.5	174.9	0	0	0	0	0	112	L365 S366 A372 L373	L365-A369 HydrophobicContact CB-CB 4.25Å; L365-A369 HydrophobicContact CD2-CB 4.25Å; S366-A369 WeakPolarHBondContact O-CA 3.22Å; S366-A369 WeakPolarHBondContact O-CB 3.49Å; S366-A369 PolarHBondContact O-N 2.76Å; S366-A369 PolarHBondContact OG-N 2.82Å; A369-A372 PolarHBondContact O-N 3.02Å; A369-L373 WeakPolarHBondContact O-CB 3.23Å; A369-L373 PolarHBondContact O-N 3.01Å
370	L	57.6	Low	55	Low	6 Å²	6	51.6 Å²	51.6	3%	0.031	35%	0.347	C	S	.	.	H	α-helix	trans	-66.8	-43.5	173.6	-69	169.7	0	0	0	112.2	L356 L359 L365 S366 P367 A372 L373 V374	L356-L370 HydrophobicContact CD2-CB 4.12Å; L356-L370 HydrophobicContact CD2-CD1 4.46Å; L356-L370 WeakPolarHBondContact O-CD1 3.2Å; L359-L370 HydrophobicContact CB-CD1 3.99Å; L359-L370 HydrophobicContact CB-CD2 4.34Å; L365-L370 HydrophobicContact CB-CD2 4.09Å; L365-L370 HydrophobicContact CB-CG 3.98Å; L365-L370 HydrophobicContact CD1-CD2 3.83Å; S366-L370 PolarHBondContact O-N 2.84Å; P367-L370 PolarHBondContact O-N 3.26Å; L370-A372 VanDerWaalsContact C-N 3.32Å; L370-A372 PolarHBondContact O-N 2.94Å; L370-L373 WeakPolarHBondContact O-CB 3.3Å; L370-L373 PolarHBondContact O-N 3.18Å; L370-V374 WeakPolarHBondContact O-CG2 3.22Å; L370-V374 PolarHBondContact O-N 3.01Å
371	V	62.1	Low	53.7	Low	49 Å²	49	56.8 Å²	56.8	30%	0.297	38%	0.381	S	S	.	.	H	α-helix	trans	-62.5	-40	173.5	168.8	0	0	0	0	111.1	P367 V374 A375	P367-V371 WeakPolarHBondContact O-CB 3.32Å; P367-V371 VanDerWaalsContact O-CG2 3.3Å; P367-V371 WeakPolarHBondContact O-CG2 3.33Å; P367-V371 PolarHBondContact O-N 3.27Å; V371-V374 PolarHBondContact O-N 2.85Å; V371-A375 VanDerWaalsContact O-CB 3.22Å; V371-A375 WeakPolarHBondContact O-CB 3.44Å; V371-A375 PolarHBondContact O-N 2.79Å
372	A	57.4	Low	52.3	Low	2 Å²	2	52.7 Å²	52.7	2%	0.017	37%	0.371	C	S	.	.	H	α-helix	trans	-62.4	-40.7	173.3	0	0	0	0	0	112.4	L259 A273 A368 A369 L370 A375 S376	L259-A372 HydrophobicContact CD1-CB 3.65Å; A273-A372 HydrophobicContact CB-CB 3.69Å; A368-A372 VanDerWaalsContact O-CB 3.28Å; A368-A372 WeakPolarHBondContact O-CB 3.4Å; A368-A372 PolarHBondContact O-N 3.2Å; A369-A372 PolarHBondContact O-N 3.02Å; L370-A372 VanDerWaalsContact C-N 3.32Å; L370-A372 PolarHBondContact O-N 2.94Å; A372-A375 PolarHBondContact O-N 3.27Å; A372-S376 PolarHBondContact O-N 2.77Å
373	L	53.5	Low	51.5	Low	16 Å²	16	50.7 Å²	50.7	8%	0.084	36%	0.364	C	S	.	.	H	α-helix	trans	-62	-49.6	176.5	-155.3	80.5	0	0	0	111.1	A276 A277 L280 L330 A369 L370 A375 S376 T377	A276-L373 HydrophobicContact CB-CD1 3.97Å; A277-L373 HydrophobicContact CB-CD1 4.49Å; L280-L373 HydrophobicContact CD1-CD1 4.05Å; L280-L373 HydrophobicContact CD1-CD2 3.94Å; L280-L373 HydrophobicContact CD1-CG 4.39Å; L330-L373 HydrophobicContact CD2-CD2 4.14Å; A369-L373 WeakPolarHBondContact O-CB 3.23Å; A369-L373 PolarHBondContact O-N 3.01Å; L370-L373 WeakPolarHBondContact O-CB 3.3Å; L370-L373 PolarHBondContact O-N 3.18Å; L373-A375 VanDerWaalsContact C-N 3.34Å; L373-A375 PolarHBondContact O-N 3.06Å; L373-S376 WeakPolarHBondContact O-CB 3.28Å; L373-S376 PolarHBondContact O-N 3.28Å; L373-S376 PolarHBondContact O-OG 2.97Å; L373-T377 PolarHBondContact O-N 3.12Å
374	V	50	Low	50.2	Low	42 Å²	42	50.7 Å²	50.7	26%	0.255	37%	0.366	S	S	.	.	H	α-helix	trans	-67.9	-32.2	178.2	177.9	0	0	0	0	112	L333 L370 V371 S376 T377 L383	L333-V374 HydrophobicContact CD2-CG2 4.4Å; L370-V374 WeakPolarHBondContact O-CG2 3.22Å; L370-V374 PolarHBondContact O-N 3.01Å; V371-V374 PolarHBondContact O-N 2.85Å; V374-S376 VanDerWaalsContact C-N 3.26Å; V374-S376 PolarHBondContact O-N 3.27Å; V374-T377 PolarHBondContact O-OG1 2.78Å; V374-L383 HydrophobicContact CG1-CD1 3.54Å
375	A	51.7	Low	48.3	Very low	31 Å²	31	51 Å²	51	26%	0.256	36%	0.357	S	S	.	.	H	α-helix	trans	-69.6	-22.9	171.7	0	0	0	0	0	112.9	R255 L259 V371 A372 L373	R255-A375 PolarHBondContact NH2-O 3.24Å; L259-A375 HydrophobicContact CD1-CB 4.47Å; V371-A375 VanDerWaalsContact O-CB 3.22Å; V371-A375 WeakPolarHBondContact O-CB 3.44Å; V371-A375 PolarHBondContact O-N 2.79Å; A372-A375 PolarHBondContact O-N 3.27Å; L373-A375 VanDerWaalsContact C-N 3.34Å; L373-A375 PolarHBondContact O-N 3.06Å
376	S	46.4	Very low	47	Very low	54 Å²	54	52.2 Å²	52.2	38%	0.378	37%	0.369	S	S	.	.	H	α-helix	trans	-76.5	-35.5	179.3	80	0	0	0	0	113.2	R255 A372 L373 V374 G378	R255-S376 PolarHBondContact NH2-O 2.83Å; A372-S376 PolarHBondContact O-N 2.77Å; L373-S376 WeakPolarHBondContact O-CB 3.28Å; L373-S376 PolarHBondContact O-N 3.28Å; L373-S376 PolarHBondContact O-OG 2.97Å; V374-S376 VanDerWaalsContact C-N 3.26Å; V374-S376 PolarHBondContact O-N 3.27Å; S376-G378 PolarHBondContact O-N 3.21Å; S376-G378 VanDerWaalsContact O-N 3.16Å
377	T	45.8	Very low	45.6	Very low	90 Å²	90	53.8 Å²	53.8	55%	0.552	37%	0.372	S	S	*	.	S	Bend	trans	-72.4	-7.1	-174.6	62.6	0	0	0	0	115.1	L373 V374 S379	L373-T377 PolarHBondContact O-N 3.12Å; V374-T377 PolarHBondContact O-OG1 2.78Å; T377-S379 VanDerWaalsContact C-N 3.34Å; T377-S379 PolarHBondContact O-N 3.41Å
378	G	40.4	Very low	44.7	Very low	50 Å²	50	55.7 Å²	55.7	52%	0.515	37%	0.374	S	S	.	.	S	Bend	trans	88.1	-18.1	172.4	0	0	0	0	0	115.6	S376 A380	S376-G378 PolarHBondContact O-N 3.21Å; S376-G378 VanDerWaalsContact O-N 3.16Å; G378-A380 PolarHBondContact O-N 3.12Å
379	S	37.4	Very low	43.7	Very low	73 Å²	73	60.4 Å²	60.4	51%	0.51	39%	0.39	S	S	.	.			trans	-73.2	18.2	-177.7	-44.5	0	0	0	0	115.4	T377 S381	T377-S379 VanDerWaalsContact C-N 3.34Å; T377-S379 PolarHBondContact O-N 3.41Å; S379-S381 PolarHBondContact O-N 3.03Å
380	A	41.3	Very low	42.4	Very low	32 Å²	32	64.2 Å²	64.2	26%	0.264	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-87.9	10	-159.6	0	0	0	0	0	116.1	G378 G382 L383	G378-A380 PolarHBondContact O-N 3.12Å; A380-G382 PolarHBondContact O-N 2.77Å; A380-G382 VanDerWaalsContact O-N 3.11Å; A380-L383 HydrophobicContact CB-CD1 4.19Å; A380-L383 PolarHBondContact O-N 3.27Å
381	S	36.4	Very low	41.4	Very low	120 Å²	120	71 Å²	71	84%	0.839	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-58.7	-27.4	-172.3	55.1	0	0	0	0	114.7	S379	S379-S381 PolarHBondContact O-N 3.03Å
382	G	35	Very low	40.1	Very low	49 Å²	49	79 Å²	79	51%	0.505	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-84.6	-21	174.8	0	0	0	0	0	115.7	A380	A380-G382 PolarHBondContact O-N 2.77Å; A380-G382 VanDerWaalsContact O-N 3.11Å
383	L	37.1	Very low	39	Very low	79 Å²	79	82 Å²	82	41%	0.414	49%	0.491	S	S	.	.	H	α-helix	trans	-78.8	-25.8	-165.6	-72.7	168	0	0	0	114.3	V374 A380 S385 S386 L387	V374-L383 HydrophobicContact CG1-CD1 3.54Å; A380-L383 HydrophobicContact CB-CD1 4.19Å; A380-L383 PolarHBondContact O-N 3.27Å; L383-S385 PolarHBondContact O-N 3.09Å; L383-S386 PolarHBondContact O-N 2.63Å; L383-L387 PolarHBondContact O-N 2.88Å
384	S	33.8	Very low	37.9	Very low	65 Å²	65	88.1 Å²	88.1	46%	0.455	52%	0.523	S	S	.	.	H	α-helix	trans	-58	-37.9	-179.9	-169.5	0	0	0	0	112.3	Q388	S384-Q388 PolarHBondContact O-N 3.25Å
385	S	31.1	Very low	36.8	Very low	83 Å²	83	91.2 Å²	91.2	58%	0.58	55%	0.547	S	S	*	.	H	α-helix	trans	-67.3	-35.4	179.3	-56.7	0	0	0	0	113.4	L383	L383-S385 PolarHBondContact O-N 3.09Å
386	S	32.2	Very low	35.8	Very low	70 Å²	70	94.9 Å²	94.9	49%	0.49	57%	0.571	S	S	.	*	H	α-helix	trans	-76.4	-37.3	179.3	-58.9	0	0	0	0	112.1	L383 Q388 Q389	L383-S386 PolarHBondContact O-N 2.63Å; S386-Q388 VanDerWaalsContact C-N 3.35Å; S386-Q388 PolarHBondContact O-N 3.11Å; S386-Q389 PolarHBondContact O-N 3.2Å
387	L	35.5	Very low	35	Very low	89 Å²	89	98.7 Å²	98.7	47%	0.466	59%	0.592	S	S	.	*	H	α-helix	trans	-62.8	-39.8	177.1	-78.3	162	0	0	0	112	L383 Q389 L390	L383-L387 PolarHBondContact O-N 2.88Å; L387-Q389 PolarHBondContact O-N 3.11Å; L387-Q389 VanDerWaalsContact O-N 3.16Å; L387-L390 HydrophobicContact CD2-CD1 4.33Å; L387-L390 PolarHBondContact O-N 3.4Å; L387-L390 VanDerWaalsContact O-N 3.12Å
388	Q	38.9	Very low	34.1	Very low	128 Å²	128	100.1 Å²	100.1	60%	0.598	60%	0.604	S	S	*	*	H	α-helix	trans	-65.5	-14.7	176.2	-69.1	-175	14.2	0	0	114.8	S384 S386	S384-Q388 PolarHBondContact O-N 3.25Å; S386-Q388 VanDerWaalsContact C-N 3.35Å; S386-Q388 PolarHBondContact O-N 3.11Å
389	Q	35.9	Very low	33.8	Very low	133 Å²	133	104.1 Å²	104.1	62%	0.621	62%	0.618	S	S	*	*	H	α-helix	trans	-87.5	-24.2	174	-67.6	-172.2	-8.8	0	0	112.9	S386 L387 R392 S393	S386-Q389 PolarHBondContact O-N 3.2Å; L387-Q389 PolarHBondContact O-N 3.11Å; L387-Q389 VanDerWaalsContact O-N 3.16Å; Q389-R392 PolarHBondContact O-N 2.9Å; Q389-S393 PolarHBondContact O-N 2.87Å; Q389-S393 PolarHBondContact O-OG 3.49Å
390	L	32.3	Very low	33.5	Very low	88 Å²	88	106.1 Å²	106.1	46%	0.461	63%	0.633	S	S	.	*	H	α-helix	trans	-70.2	-38	177.9	-74.3	162.7	0	0	0	112.1	L387 R392 S393 N394	L387-L390 HydrophobicContact CD2-CD1 4.33Å; L387-L390 PolarHBondContact O-N 3.4Å; L387-L390 VanDerWaalsContact O-N 3.12Å; L390-R392 PolarHBondContact O-N 3.25Å; L390-S393 WeakPolarHBondContact CA-OG 3.31Å; L390-S393 PolarHBondContact O-N 2.87Å; L390-S393 PolarHBondContact O-OG 3.49Å; L390-N394 PolarHBondContact O-ND2 3.29Å; L390-N394 VanDerWaalsContact O-ND2 3.17Å
391	D	34.7	Very low	33	Very low	147 Å²	147	110.8 Å²	110.8	79%	0.786	65%	0.653	S	S	*	*	H	α-helix	trans	-65.9	-17.8	173.3	-79.2	-28.6	0	0	0	113.6
392	R	36.5	Very low	32.6	Very low	219 Å²	219	110.6 Å²	110.6	83%	0.826	64%	0.643	S	S	*	*	H	α-helix	trans	-99.2	-12.5	179.1	-75	-178.6	169.6	166	-0.3	114.5	Q389 L390	Q389-R392 PolarHBondContact O-N 2.9Å; L390-R392 PolarHBondContact O-N 3.25Å
393	S	32.7	Very low	32.4	Very low	65 Å²	65	112.5 Å²	112.5	46%	0.455	65%	0.654	S	S	.	*	H	α-helix	trans	-103.7	-20.1	-174.2	40.7	0	0	0	0	114.1	Q389 L390 S395	Q389-S393 PolarHBondContact O-N 2.87Å; Q389-S393 PolarHBondContact O-OG 3.49Å; L390-S393 WeakPolarHBondContact CA-OG 3.31Å; L390-S393 PolarHBondContact O-N 2.87Å; L390-S393 PolarHBondContact O-OG 3.49Å; S393-S395 PolarHBondContact O-N 2.95Å; S393-S395 VanDerWaalsContact O-N 3.15Å
394	N	31.8	Very low	32.1	Very low	143 Å²	143	118 Å²	118	77%	0.765	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	27.8	176.4	-69.9	-54.3	0	0	0	114.4	L390	L390-N394 PolarHBondContact O-ND2 3.29Å; L390-N394 VanDerWaalsContact O-ND2 3.17Å
395	S	27.4	Very low	31.9	Very low	108 Å²	108	120 Å²	120	76%	0.755	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.5	30.9	-177.1	-173.2	0	0	0	0	113.6	S393	S393-S395 PolarHBondContact O-N 2.95Å; S393-S395 VanDerWaalsContact O-N 3.15Å
396	S	29.9	Very low	32	Very low	107 Å²	107	120.6 Å²	120.6	75%	0.748	69%	0.693	S	S	*	*	S	Bend	trans	-146	149.9	169	54.1	0	0	0	0	111.9
397	T	30.2	Very low	32	Very low	135 Å²	135	125.4 Å²	125.4	83%	0.828	70%	0.704	S	S	*	*			trans	-86.1	150	-172.8	45.7	0	0	0	0	113.4
398	C	25	Very low	31.9	Very low	120 Å²	120	129 Å²	129	81%	0.811	72%	0.719	S	S	*	*			trans	-63.4	144.4	176.5	54.6	0	0	0	0	115
399	V	34.8	Very low	31.5	Very low	133 Å²	133	127.4 Å²	127.4	81%	0.806	72%	0.722	S	S	*	*			trans	-143.6	121.9	150.9	178.1	0	0	0	0	110.5
400	S	32	Very low	31.2	Very low	116 Å²	116	128.3 Å²	128.3	81%	0.811	73%	0.729	S	S	*	*			trans	30	140.1	151.6	-52.5	0	0	0	0	123.8
401	N	30	Very low	31.1	Very low	129.5 Å²	129.5	129.1 Å²	129.1	69%	0.693	74%	0.743	S	S	*	*			trans	-110.9	158.7	162.8	-90.6	-46.1	0	0	0	113.3	S439 P440 I724	N401-S439 VanDerWaalsContact CA-OG 3.27Å; N401-S439 WeakPolarHBondContact CA-OG 3.48Å; N401-S439 PolarHBondContact N-OG 3.42Å; N401-P440 WeakPolarHBondContact OD1-CG 3.39Å; N401-I724 HydrophobicContact CB-CD1 3.91Å
402	N	28.2	Very low	30.9	Very low	117 Å²	117	126.3 Å²	126.3	63%	0.626	74%	0.739	S	S	*	*			trans	177.6	144.7	163.4	-115.2	-15.5	0	0	0	117.8	P440	N402-P440 HydrophobicContact CB-CG 4.05Å; N402-P440 VanDerWaalsContact ND2-CD 3.27Å; N402-P440 WeakPolarHBondContact ND2-CD 3.19Å
403	A	30	Very low	30.4	Very low	88.5 Å²	88.5	122.4 Å²	122.4	73%	0.731	74%	0.74	S	S	*	*			trans	149	126.6	156.3	0	0	0	0	0	116.2
404	K	31.4	Very low	30.2	Very low	194 Å²	194	123.5 Å²	123.5	84%	0.843	75%	0.748	S	S	*	*			trans	144.5	124.5	158.5	-64.6	176.4	-179.2	175.4	0	117.5
405	S	30.2	Very low	30.2	Very low	106 Å²	106	124.1 Å²	124.1	74%	0.741	75%	0.746	S	S	*	*				156.5	135	127.4	62.4	0	0	0	0	112.1
406	S	31.8	Very low	30.2	Very low	97.5 Å²	97.5	126 Å²	126	68%	0.682	75%	0.748	S	S	*	*				68.1	137.9	106.7	11.6	0	0	0	0	114.6
407	K	33.9	Very low	30.2	Very low	169.5 Å²	169.5	125.7 Å²	125.7	74%	0.737	75%	0.752	S	S	*	*			cis	-153.2	169.8	5.2	-86.9	167.1	-175.9	171.8	0	108
408	Q	32.4	Very low	30.2	Very low	165 Å²	165	122.6 Å²	122.6	77%	0.771	75%	0.747	S	S	*	*				128.1	142.5	82.9	-112.2	163.5	-35.7	0	0	115.2
409	S	30	Very low	30.4	Very low	95 Å²	95	124.3 Å²	124.3	66%	0.664	74%	0.743	S	S	*	*				122.9	163.3	68	54.7	0	0	0	0	115.1
410	I	30.8	Very low	30.3	Very low	151.5 Å²	151.5	125.4 Å²	125.4	78%	0.777	74%	0.736	S	S	*	*				128.1	136.3	73.2	-46.5	162.2	0	0	0	114
411	S	29.5	Very low	30.1	Very low	105.5 Å²	105.5	124.9 Å²	124.9	74%	0.738	73%	0.733	S	S	*	*				130.5	151.3	89.5	39.7	0	0	0	0	115
412	A	30.3	Very low	30.1	Very low	86.5 Å²	86.5	126.1 Å²	126.1	72%	0.715	74%	0.739	S	S	*	*			cis	131.9	146.5	21	0	0	0	0	0	113.7
413	T	27.1	Very low	30.1	Very low	137 Å²	137	131 Å²	131	84%	0.84	75%	0.749	S	S	*	*			trans	45.3	132.5	157.7	-47.3	0	0	0	0	117.4
414	S	28	Very low	30.1	Very low	88 Å²	88	131.3 Å²	131.3	62%	0.615	75%	0.745	S	S	*	*			cis	-173.2	160.2	28.6	-165.5	0	0	0	0	113
415	Q	32.2	Very low	29.8	Very low	157.5 Å²	157.5	129.1 Å²	129.1	74%	0.736	74%	0.742	S	S	*	*			trans	55.9	119.6	144.5	-73.2	163.3	-2.7	0	0	123.1
416	N	26.6	Very low	29.8	Very low	146.5 Å²	146.5	134.8 Å²	134.8	78%	0.783	75%	0.748	S	S	*	*				58.9	133.7	124	-61.9	-7.4	0	0	0	121.1
417	A	30.7	Very low	29.6	Very low	101.5 Å²	101.5	135.4 Å²	135.4	84%	0.839	75%	0.752	S	S	*	*			cis	126	137.8	49.2	0	0	0	0	0	116
418	G	28.6	Very low	29.3	Very low	70 Å²	70	132.3 Å²	132.3	72%	0.722	75%	0.751	S	S	*	*			trans	104	130.3	156.9	0	0	0	0	0	116.6
419	E	29.7	Very low	29	Very low	154.5 Å²	154.5	129.3 Å²	129.3	72%	0.722	75%	0.749	S	S	*	*				132.2	161.1	63	-89.2	-155.9	152	0	0	114.4
420	K	33.2	Very low	28.9	Very low	156 Å²	156	130 Å²	130	68%	0.678	75%	0.754	S	S	*	*				123.6	134.7	-113.6	-86.9	163.3	-172.7	149.2	0	112.2
421	S	27.2	Very low	28.8	Very low	107 Å²	107	128.2 Å²	128.2	75%	0.748	76%	0.755	S	S	*	*				70.6	132.8	121.2	-128.7	0	0	0	0	116.1
422	L	30	Very low	29	Very low	153.5 Å²	153.5	128.6 Å²	128.6	80%	0.804	76%	0.755	S	S	*	*				-163.9	162.8	57.5	-103.8	165.3	0	0	0	109.6
423	R	28.8	Very low	28.8	Very low	221.5 Å²	221.5	129.6 Å²	129.6	84%	0.836	76%	0.757	S	S	*	*				-119.3	167.5	-88.9	-114.8	176.4	-176	152.6	-1.1	110.2
424	S	28.9	Very low	28.9	Very low	93 Å²	93	134 Å²	134	65%	0.65	76%	0.758	S	S	*	*				134.9	149.9	94.8	-103.9	0	0	0	0	117.5
425	N	26.9	Very low	28.8	Very low	148 Å²	148	136.8 Å²	136.8	79%	0.791	76%	0.764	S	S	*	*			trans	45.3	101.1	151.7	-64.7	-0.3	0	0	0	119.7
426	R	29	Very low	28.6	Very low	225.5 Å²	225.5	134.6 Å²	134.6	85%	0.851	76%	0.761	S	S	*	*				-162.6	165	78.8	-127.2	178.6	-178.7	-163	-0.4	109.7
427	S	27.8	Very low	28.5	Very low	110 Å²	110	132.1 Å²	132.1	77%	0.769	76%	0.755	S	S	*	*			trans	63.5	144.8	160.8	-56.3	0	0	0	0	117.1
428	S	27.4	Very low	28.4	Very low	104.5 Å²	104.5	135.2 Å²	135.2	73%	0.731	75%	0.752	S	S	*	*			cis	-172	166.9	0.2	45.3	0	0	0	0	111
429	S	25.7	Very low	28.3	Very low	102.5 Å²	102.5	135.8 Å²	135.8	72%	0.717	74%	0.744	S	S	*	*			trans	119.6	130.3	135.4	49.5	0	0	0	0	118
430	S	29.3	Very low	28.5	Very low	109 Å²	109	132 Å²	132	76%	0.762	73%	0.733	S	S	*	*			trans	77.1	139.8	149.5	75.2	0	0	0	0	120.4
431	S	27.4	Very low	28.3	Very low	115 Å²	115	129.9 Å²	129.9	80%	0.804	73%	0.729	S	S	*	*				131.8	151	-114.1	-79.9	0	0	0	0	114
432	P	33.3	Very low	28.3	Very low	114.5 Å²	114.5	126.7 Å²	126.7	74%	0.744	71%	0.707	S	S	*	*				-119.4	168.4	-117.8	39.1	-30	0	0	0	113.6
433	S	27.5	Very low	28.1	Very low	107 Å²	107	124.8 Å²	124.8	75%	0.748	70%	0.697	S	S	*	*			trans	114.6	126.5	157.1	-72.9	0	0	0	0	114.9
434	R	29.1	Very low	28.1	Very low	228 Å²	228	117.6 Å²	117.6	86%	0.86	68%	0.681	S	S	*	*				-155.7	136.6	61	-158.3	171.1	-66.9	-155.8	0.6	111.4	V436	R434-V436 HydrophobicContact CB-CG2 4.49Å; R434-V436 HydrophobicContact CG-CG2 3.82Å
435	I	25.6	Very low	28.4	Very low	147.5 Å²	147.5	121.5 Å²	121.5	76%	0.756	69%	0.686	S	S	*	*			trans	-71.2	130.6	169	-61.1	162.3	0	0	0	109.4
436	V	26.9	Very low	28.4	Very low	111 Å²	111	119.7 Å²	119.7	67%	0.673	68%	0.683	S	S	*	*			trans	-142.2	123.2	158.2	-174.9	0	0	0	0	108.6	R434	R434-V436 HydrophobicContact CB-CG2 4.49Å; R434-V436 HydrophobicContact CG-CG2 3.82Å
437	C	25.1	Very low	28.4	Very low	95 Å²	95	116.2 Å²	116.2	64%	0.642	68%	0.679	S	S	*	*			trans	-90.8	133.3	-177	-48.6	0	0	0	0	111.2
438	H	29.2	Very low	28.4	Very low	167 Å²	167	115.8 Å²	115.8	77%	0.773	68%	0.676	S	S	*	*			trans	-143.2	153	166.5	-77.7	99.4	0	0	0	112.1
439	S	26.6	Very low	28.7	Very low	81 Å²	81	116 Å²	116	57%	0.566	68%	0.675	S	S	*	*			trans	-167.7	160.4	-173.2	-119.4	0	0	0	0	108.8	N401	N401-S439 VanDerWaalsContact CA-OG 3.27Å; N401-S439 WeakPolarHBondContact CA-OG 3.48Å; N401-S439 PolarHBondContact N-OG 3.42Å
440	P	33	Very low	28.7	Very low	76 Å²	76	115.6 Å²	115.6	49%	0.494	67%	0.665	S	S	.	*			cis	-135.4	-173.8	-39.2	37.5	-21.5	0	0	0	113.1	N401 N402 N721	N401-P440 WeakPolarHBondContact OD1-CG 3.39Å; N402-P440 HydrophobicContact CB-CG 4.05Å; N402-P440 VanDerWaalsContact ND2-CD 3.27Å; N402-P440 WeakPolarHBondContact ND2-CD 3.19Å; P440-N721 PolarHBondContact O-ND2 3.42Å
441	N	29.1	Very low	28.8	Very low	111.5 Å²	111.5	116.2 Å²	116.2	60%	0.596	66%	0.659	S	S	*	*			trans	87.3	150.7	144.7	-116.6	-18.7	0	0	0	123.2	N722	N441-N722 PolarHBondContact ND2-OD1 3.42Å
442	S	27.3	Very low	28.8	Very low	40.5 Å²	40.5	117.1 Å²	117.1	28%	0.283	66%	0.655	S	S	.	*			trans	74.9	158.3	146.1	69.8	0	0	0	0	121.2	S720 N721	S442-S720 WeakPolarHBondContact OG-CA 3.32Å; S442-N721 WeakPolarHBondContact OG-CA 3.26Å; S442-N721 PolarHBondContact OG-N 3.22Å; S442-N721 VanDerWaalsContact OG-N 3.09Å
443	L	26.4	Very low	28.8	Very low	112 Å²	112	117.8 Å²	117.8	59%	0.586	65%	0.653	S	S	*	*			trans	124.2	154.1	-131.8	-123.2	67.6	0	0	0	113.8	T719	L443-T719 WeakPolarHBondContact O-CA 3.21Å; L443-T719 PolarHBondContact O-N 3.32Å
444	S	28.1	Very low	28.9	Very low	71.5 Å²	71.5	118.6 Å²	118.6	50%	0.5	65%	0.648	S	S	.	*				130.7	142	111.5	68.2	0	0	0	0	120.9	I718	S444-I718 PolarHBondContact OG-O 3.46Å
445	K	34.8	Very low	29	Very low	175.5 Å²	175.5	113.7 Å²	113.7	76%	0.763	64%	0.64	S	S	*	*			trans	-125.9	166.4	135.6	-80.1	167	-176.5	170.8	0	111.7
446	P	28.7	Very low	29.3	Very low	110 Å²	110	113.1 Å²	113.1	71%	0.714	64%	0.638	S	S	*	*			trans	-134.2	175.4	161.2	25.9	-4.9	0	0	0	114.4
447	I	28.6	Very low	29.3	Very low	152 Å²	152	114.4 Å²	114.4	78%	0.779	64%	0.638	S	S	*	*			trans	90.5	112.2	138.7	-60.5	163	0	0	0	111.7
448	S	27.7	Very low	29.6	Very low	100.5 Å²	100.5	117 Å²	117	70%	0.703	64%	0.643	S	S	*	*				77.3	151.8	51.9	-127.3	0	0	0	0	113.8
449	P	33.4	Very low	29.5	Very low	108.5 Å²	108.5	114.8 Å²	114.8	71%	0.705	64%	0.637	S	S	*	*			cis	-136.8	178	14.4	42.8	-25.3	0	0	0	117.7
450	N	26.4	Very low	29.6	Very low	95 Å²	95	117.5 Å²	117.5	51%	0.508	64%	0.643	S	S	.	*			trans	-2.1	144.8	152.6	-146.9	72.5	0	0	0	115.7	N996	N450-N996 HydrophobicContact CB-CB 3.86Å; N450-N996 PolarHBondContact OD1-ND2 2.75Å
451	N	30.6	Very low	29.3	Very low	120.5 Å²	120.5	119.8 Å²	119.8	64%	0.644	65%	0.651	S	S	*	*				-158.7	134.9	70.8	-130.6	17.7	0	0	0	113.4	N453	N451-N453 PolarHBondContact ND2-OD1 3.12Å
452	N	27.5	Very low	29.2	Very low	135.5 Å²	135.5	122.5 Å²	122.5	73%	0.725	66%	0.662	S	S	*	*			trans	-37.7	126.2	145.3	-62	6	0	0	0	115.3
453	N	33.2	Very low	29.3	Very low	128.5 Å²	128.5	127.5 Å²	127.5	69%	0.687	68%	0.682	S	S	*	*			trans	-149.7	137.7	131.3	-81	15.4	0	0	0	106.4	N451	N451-N453 PolarHBondContact ND2-OD1 3.12Å
454	N	30.3	Very low	29.4	Very low	123 Å²	123	127 Å²	127	66%	0.658	69%	0.687	S	S	*	*			cis	125.6	144.3	49	-89.9	18.1	0	0	0	111.4
455	D	30.5	Very low	29.4	Very low	126.5 Å²	126.5	131.1 Å²	131.1	68%	0.676	70%	0.699	S	S	*	*				141.7	132.2	96.7	-70.7	-38.9	0	0	0	118.9
456	N	31.3	Very low	29.1	Very low	134.5 Å²	134.5	128.4 Å²	128.4	72%	0.719	69%	0.692	S	S	*	*			trans	59.6	144.1	131.7	-55	-30.2	0	0	0	120.3
457	M	26.8	Very low	29	Very low	137.5 Å²	137.5	128.6 Å²	128.6	68%	0.677	69%	0.692	S	S	*	*			cis	-171.3	151.2	-16.5	-129.6	166.3	50.4	0	0	108.9
458	M	33	Very low	28.9	Very low	149.5 Å²	149.5	125.8 Å²	125.8	74%	0.736	68%	0.677	S	S	*	*			trans	65.8	146.8	151.3	-79	179.2	176.2	0	0	119
459	D	26.7	Very low	29	Very low	121 Å²	121	127.6 Å²	127.6	65%	0.647	68%	0.679	S	S	*	*			cis	-161.4	176.7	-18.8	-139.8	-21.7	0	0	0	112.1
460	I	29.4	Very low	28.7	Very low	138 Å²	138	127 Å²	127	71%	0.708	67%	0.673	S	S	*	*			trans	65.1	96.7	151.6	-65.5	157.6	0	0	0	117.6
461	N	25.3	Very low	28.8	Very low	124 Å²	124	129.5 Å²	129.5	66%	0.663	69%	0.685	S	S	*	*				37.6	128.4	115	-129.3	33.2	0	0	0	120.4	E463	N461-E463 PolarHBondContact ND2-OE1 3.26Å
462	M	28.2	Very low	28.6	Very low	168 Å²	168	129 Å²	129	83%	0.828	69%	0.687	S	S	*	*			trans	145.2	141.6	149	-116.7	168.1	153.9	0	0	114
463	E	29	Very low	28.7	Very low	147 Å²	147	129.6 Å²	129.6	69%	0.687	69%	0.69	S	S	*	*				-123.4	171.1	-81.6	-94.2	154.3	-172.5	0	0	110.9	N461	N461-E463 PolarHBondContact ND2-OE1 3.26Å
464	S	28	Very low	28.6	Very low	99.5 Å²	99.5	131.5 Å²	131.5	70%	0.696	70%	0.695	S	S	*	*			trans	3.4	147	173.4	49.8	0	0	0	0	118.2
465	E	28.6	Very low	28.7	Very low	159.5 Å²	159.5	132.5 Å²	132.5	75%	0.745	70%	0.699	S	S	*	*				80.1	98.9	117.3	-65.6	-170.8	-179.1	0	0	117.6
466	N	28.1	Very low	28.7	Very low	118.5 Å²	118.5	131.3 Å²	131.3	63%	0.634	70%	0.7	S	S	*	*			trans	47.1	159.6	137.7	-66.2	-20.9	0	0	0	122.6	F1005	N466-F1005 HydrophobicContact CB-CB 3.4Å; N466-F1005 PolarHBondContact ND2-O 3.18Å; N466-F1005 VanDerWaalsContact ND2-O 3.17Å; N466-F1005 VanDerWaalsContact O-CB 3.31Å; N466-F1005 WeakPolarHBondContact O-CB 3.42Å; N466-F1005 VanDerWaalsContact O-CD1 3.3Å; N466-F1005 WeakPolarHBondContact O-CD1 3.06Å; N466-F1005 WeakPolarHBondContact O-CG 3.44Å
467	T	27.2	Very low	28.8	Very low	114.5 Å²	114.5	131.9 Å²	131.9	70%	0.702	70%	0.704	S	S	*	*			trans	141.3	131.2	169.1	46.1	0	0	0	0	112.8	F1005 G1006	T467-F1005 HydrophobicContact CG2-CD1 3.96Å; T467-F1005 HydrophobicContact CG2-CE1 4.17Å; T467-G1006 VanDerWaalsContact C-CA 3.45Å; T467-G1006 WeakPolarHBondContact O-CA 3.43Å
468	I	26.6	Very low	28.9	Very low	92.5 Å²	92.5	131.2 Å²	131.2	47%	0.474	71%	0.707	S	S	.	*			cis	68.9	97.4	30.4	-53.5	-178	0	0	0	114.8	L1004 F1005 G1006 L1007	I468-L1004 HydrophobicContact CD1-CB 4.33Å; I468-L1004 HydrophobicContact CD1-CD2 4.45Å; I468-L1004 HydrophobicContact CD1-CG 4.44Å; I468-L1004 HydrophobicContact CG2-CD2 4.07Å; I468-F1005 HydrophobicContact CB-CD1 4.32Å; I468-F1005 VanDerWaalsContact CD1-N 3.28Å; I468-G1006 VanDerWaalsContact CG1-O 3.26Å; I468-G1006 WeakPolarHBondContact CG1-O 3.29Å; I468-L1007 HydrophobicContact CD1-CG 4.43Å; I468-L1007 HydrophobicContact CG1-CB 4.12Å; I468-L1007 HydrophobicContact CG1-CG 3.95Å
469	N	28.5	Very low	28.8	Very low	138 Å²	138	130 Å²	130	74%	0.738	71%	0.708	S	S	*	*				-173.3	144.4	119	-99.6	-35.4	0	0	0	110.7
470	V	26.9	Very low	28.9	Very low	97 Å²	97	129.8 Å²	129.8	59%	0.588	71%	0.712	S	S	*	*				111.7	137.4	51.1	138.3	0	0	0	0	114.1	L1007	V470-L1007 HydrophobicContact CG2-CD1 4.41Å
471	I	28.9	Very low	28.8	Very low	145.5 Å²	145.5	128.8 Å²	128.8	75%	0.746	71%	0.712	S	S	*	*			trans	141	103.5	157.8	-62.5	173.7	0	0	0	112.8
472	T	27.2	Very low	28.9	Very low	111.5 Å²	111.5	128.6 Å²	128.6	68%	0.684	72%	0.716	S	S	*	*				124.9	126.4	112.2	52.7	0	0	0	0	110.5
473	D	30	Very low	28.9	Very low	148 Å²	148	128.7 Å²	128.7	79%	0.791	72%	0.718	S	S	*	*				-153.4	153.7	60.6	-76.2	-24	0	0	0	113.4
474	E	30.8	Very low	28.8	Very low	169 Å²	169	126.6 Å²	126.6	79%	0.79	72%	0.72	S	S	*	*			trans	-10.5	146.8	155.3	-65.5	-122.2	104.4	0	0	118.7
475	L	32.4	Very low	28.8	Very low	144 Å²	144	127.5 Å²	127.5	75%	0.754	73%	0.726	S	S	*	*			trans	86.5	93.7	146.9	-65.7	164.5	0	0	0	121.6
476	S	30.8	Very low	28.9	Very low	99.5 Å²	99.5	124.7 Å²	124.7	70%	0.696	73%	0.729	S	S	*	*			trans	82.1	117.5	130.8	60.6	0	0	0	0	122.2
477	D	31.9	Very low	29	Very low	147.5 Å²	147.5	124.8 Å²	124.8	79%	0.789	74%	0.74	S	S	*	*			trans	70.1	106.2	133.2	-60.7	-5	0	0	0	121.8
478	T	30	Very low	29.1	Very low	122.5 Å²	122.5	123 Å²	123	75%	0.752	74%	0.743	S	S	*	*				154.1	121	60.9	58.6	0	0	0	0	116.2
479	T	31.2	Very low	29.1	Very low	125 Å²	125	124.8 Å²	124.8	77%	0.767	76%	0.759	S	S	*	*			trans	161.4	114.7	158.6	48.5	0	0	0	0	116.9
480	T	27.8	Very low	29.1	Very low	117 Å²	117	126.2 Å²	126.2	72%	0.718	77%	0.766	S	S	*	*				78.7	142.5	81.7	-0.5	0	0	0	0	118.8
481	T	28.3	Very low	29.1	Very low	117.5 Å²	117.5	127.5 Å²	127.5	72%	0.721	77%	0.774	S	S	*	*			trans	71.7	94.2	159.8	36	0	0	0	0	119.3
482	T	25.9	Very low	29.1	Very low	118.5 Å²	118.5	125.3 Å²	125.3	73%	0.727	77%	0.77	S	S	*	*				42.7	129.6	100.2	64.5	0	0	0	0	118.6
483	I	28.6	Very low	29.1	Very low	170.5 Å²	170.5	125.4 Å²	125.4	87%	0.874	77%	0.77	S	S	*	*				-167	149.1	124.2	-96.5	151.4	0	0	0	111.6
484	S	27.9	Very low	29	Very low	103.5 Å²	103.5	124 Å²	124	72%	0.724	76%	0.761	S	S	*	*			trans	-58.9	143.9	-175.3	-51.3	0	0	0	0	120
485	S	27.7	Very low	28.9	Very low	119 Å²	119	121.3 Å²	121.3	83%	0.832	76%	0.757	S	S	*	*				67.3	117.6	124.8	-60	0	0	0	0	123.6
486	A	30.6	Very low	28.7	Very low	99 Å²	99	120.2 Å²	120.2	82%	0.818	75%	0.751	S	S	*	*			trans	146.7	134	130.8	0	0	0	0	0	115.9
487	S	30.6	Very low	28.7	Very low	121 Å²	121	120.7 Å²	120.7	85%	0.846	75%	0.751	S	S	*	*			trans	-42.3	140.3	156.2	-56.6	0	0	0	0	116.7
488	G	29.5	Very low	28.5	Very low	76 Å²	76	121 Å²	121	78%	0.784	75%	0.75	S	S	*	*				-177.4	108.8	86.2	0	0	0	0	0	111.3
489	T	26	Very low	28.5	Very low	132 Å²	132	124.5 Å²	124.5	81%	0.81	76%	0.755	S	S	*	*			trans	-125.1	139.2	-172.8	43.9	0	0	0	0	111.5
490	L	27.3	Very low	28.3	Very low	167 Å²	167	124.9 Å²	124.9	87%	0.874	75%	0.753	S	S	*	*			trans	136.6	147.7	152.9	-83.1	164.9	0	0	0	114
491	T	28	Very low	28.3	Very low	123.5 Å²	123.5	128 Å²	128	76%	0.758	76%	0.759	S	S	*	*			trans	-86.4	144.1	175.3	48.9	0	0	0	0	110.7
492	P	28.7	Very low	28.3	Very low	100.5 Å²	100.5	128.4 Å²	128.4	65%	0.653	76%	0.762	S	S	*	*				-126.8	156.6	86.4	10	13.5	0	0	0	112.3
493	T	26.4	Very low	28.4	Very low	112 Å²	112	130 Å²	130	69%	0.687	77%	0.765	S	S	*	*			cis	82.1	104.2	43.1	-51.1	0	0	0	0	114.4
494	I	29.2	Very low	28.4	Very low	119.5 Å²	119.5	132.3 Å²	132.3	61%	0.613	77%	0.769	S	S	*	*			trans	156.4	114.7	149.6	-74.9	176.2	0	0	0	114.1
495	T	27.7	Very low	28.3	Very low	113 Å²	113	131.5 Å²	131.5	69%	0.693	77%	0.769	S	S	*	*			trans	-17.8	160.4	158.8	56	0	0	0	0	116.3
496	N	28.4	Very low	28.3	Very low	119.5 Å²	119.5	133.2 Å²	133.2	64%	0.639	77%	0.768	S	S	*	*				172	162.5	53.2	-124.8	8.7	0	0	0	108.5
497	T	30.7	Very low	28.2	Very low	111.5 Å²	111.5	136.1 Å²	136.1	68%	0.684	77%	0.77	S	S	*	*				135.7	135.2	-95.3	46.1	0	0	0	0	108.7
498	I	28.8	Very low	28	Very low	152.5 Å²	152.5	135.1 Å²	135.1	78%	0.782	77%	0.77	S	S	*	*			cis	-38.3	100.6	41.5	-54.8	173.8	0	0	0	110.3
499	F	28.4	Very low	28	Very low	195.5 Å²	195.5	136.4 Å²	136.4	86%	0.857	77%	0.766	S	S	*	*	S	Bend		118.8	116.4	116.5	-116.6	-92.2	0	0	0	111.1
500	N	27.6	Very low	28.3	Very low	134.5 Å²	134.5	137.3 Å²	137.3	72%	0.719	77%	0.765	S	S	*	*			trans	-100.6	155.2	-174.8	-94.5	5.1	0	0	0	111.2
501	E	27.8	Very low	28.5	Very low	181 Å²	181	135.6 Å²	135.6	85%	0.846	76%	0.756	S	S	*	*			trans	7.6	104.3	164.3	-58.3	168.8	115.7	0	0	114.3
502	T	28.6	Very low	28.7	Very low	126 Å²	126	137.1 Å²	137.1	77%	0.773	76%	0.755	S	S	*	*				-146.8	159.5	87.2	48	0	0	0	0	110.2
503	L	27.1	Very low	29	Very low	153 Å²	153	141 Å²	141	80%	0.801	76%	0.761	S	S	*	*				130.4	102.7	-105.1	-91.7	165.4	0	0	0	109.6	A505	L503-A505 PolarHBondContact O-N 2.72Å
504	F	28.6	Very low	29.4	Very low	218.5 Å²	218.5	142 Å²	142	96%	0.958	76%	0.763	S	S	*	*			trans	-109.5	110.1	151.6	-85.2	-83.6	0	0	0	109.6
505	A	27.1	Very low	29.5	Very low	86.5 Å²	86.5	141.6 Å²	141.6	72%	0.715	77%	0.765	S	S	*	*			trans	-133.4	137	167	0	0	0	0	0	108.4	L503	L503-A505 PolarHBondContact O-N 2.72Å
506	N	28	Very low	29.9	Very low	154.5 Å²	154.5	140.3 Å²	140.3	83%	0.826	76%	0.757	S	S	*	*	S	Bend	trans	0.1	130.3	-178	-49.3	-37.8	0	0	0	113.7
507	D	28.2	Very low	30.1	Very low	161 Å²	161	139.8 Å²	139.8	86%	0.861	76%	0.759	S	S	*	*			trans	130.3	121.5	153.5	-82.8	-32.1	0	0	0	115.2	S509	D507-S509 PolarHBondContact O-N 3.48Å
508	A	26.8	Very low	30.4	Very low	100 Å²	100	138.9 Å²	138.9	83%	0.826	75%	0.749	S	S	*	*				179.9	112.5	122.6	0	0	0	0	0	114
509	S	27.9	Very low	30.7	Very low	102 Å²	102	137.9 Å²	137.9	71%	0.713	75%	0.745	S	S	*	*			trans	136.5	73.2	168.3	-174	0	0	0	0	116.8	D507 N511	D507-S509 PolarHBondContact O-N 3.48Å; S509-N511 PolarHBondContact O-N 3.21Å; S509-N511 PolarHBondContact OG-ND2 3.18Å
510	I	33.3	Very low	31.3	Very low	152 Å²	152	136 Å²	136	78%	0.779	74%	0.744	S	S	*	*			trans	-101.9	110.3	162.2	-58.2	-179.6	0	0	0	110.1
511	N	32.4	Very low	31.6	Very low	131 Å²	131	136.7 Å²	136.7	70%	0.701	74%	0.741	S	S	*	*			trans	-84.2	119	177.2	-83.5	-57.8	0	0	0	111.8	S509 K513	S509-N511 PolarHBondContact O-N 3.21Å; S509-N511 PolarHBondContact OG-ND2 3.18Å; N511-K513 PolarHBondContact O-N 2.96Å
512	H	31.8	Very low	32.3	Very low	155 Å²	155	131.9 Å²	131.9	72%	0.718	73%	0.732	S	S	*	*			trans	-73.3	68.7	174.5	-76.2	-76	0	0	0	113.2	N514	H512-N514 PolarHBondContact O-N 3.46Å
513	K	33.7	Very low	33	Very low	182.5 Å²	182.5	128.2 Å²	128.2	79%	0.793	71%	0.707	S	S	*	*			trans	-104.6	61.7	169.6	-75.3	-172.4	175.2	-179.8	0	111.7	N511	N511-K513 PolarHBondContact O-N 2.96Å
514	N	35.6	Very low	33.9	Very low	134 Å²	134	124.2 Å²	124.2	72%	0.717	69%	0.687	S	S	*	*			trans	-128.9	108.3	170.5	-95.7	-12.5	0	0	0	111.4	H512 P525	H512-N514 PolarHBondContact O-N 3.46Å; N514-P525 VanDerWaalsContact O-CD 3.26Å; N514-P525 WeakPolarHBondContact O-CD 3.38Å; N514-P525 WeakPolarHBondContact O-CG 3.2Å
515	T	31.4	Very low	34.8	Very low	109.5 Å²	109.5	116.7 Å²	116.7	67%	0.672	66%	0.66	S	S	*	*			trans	-82	125.4	172	47.6	0	0	0	0	110.8	T517	T515-T517 PolarHBondContact O-N 2.85Å
516	V	36.8	Very low	36	Very low	86.5 Å²	86.5	118 Å²	118	52%	0.524	65%	0.654	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.8	106.8	173.5	-178	0	0	0	0	109.2	I518 L523	V516-I518 HydrophobicContact CG1-CD1 4.38Å; V516-I518 HydrophobicContact CG1-CG1 4.21Å; V516-L523 PolarHBondContact N-O 2.92Å; V516-L523 PolarHBondContact O-N 3.36Å
517	T	32.2	Very low	37.1	Very low	109 Å²	109	114.3 Å²	114.3	67%	0.669	63%	0.631	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.4	112.7	176.5	49.3	0	0	0	0	111.4	T515 F521 A522	T515-T517 PolarHBondContact O-N 2.85Å; T517-F521 WeakPolarHBondContact CA-O 3.44Å; T517-A522 HydrophobicContact CG2-CB 4.13Å
518	I	37	Very low	38.3	Very low	92.5 Å²	92.5	108.2 Å²	108.2	47%	0.474	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.8	117.7	168.9	-54.8	179.3	0	0	0	107.8	V516 N520 F521	V516-I518 HydrophobicContact CG1-CD1 4.38Å; V516-I518 HydrophobicContact CG1-CG1 4.21Å; I518-N520 VanDerWaalsContact C-N 3.33Å; I518-N520 PolarHBondContact O-N 3.4Å; I518-F521 PolarHBondContact N-O 2.97Å; I518-F521 WeakPolarHBondContact O-CB 3.49Å; I518-F521 PolarHBondContact O-N 3.44Å
519	N	35.3	Very low	39.5	Very low	132 Å²	132	106 Å²	106	71%	0.706	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	48.8	61.3	175.5	-61.5	-8.4	0	0	0	115.4	F521	N519-F521 WeakPolarHBondContact O-CD2 3.44Å; N519-F521 PolarHBondContact O-N 3.43Å; N519-F521 VanDerWaalsContact O-N 3.15Å
520	N	39.9	Very low	40.7	Very low	155.5 Å²	155.5	104.5 Å²	104.5	83%	0.832	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	55.9	60.5	173	-64.6	6.1	0	0	0	118.1	I518	I518-N520 VanDerWaalsContact C-N 3.33Å; I518-N520 PolarHBondContact O-N 3.4Å
521	F	35	Very low	41.7	Very low	149 Å²	149	98.1 Å²	98.1	65%	0.654	54%	0.535	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-5.4	100.7	173.7	-55.1	-78	0	0	0	113	T517 I518 N519 L523	T517-F521 WeakPolarHBondContact CA-O 3.44Å; I518-F521 PolarHBondContact N-O 2.97Å; I518-F521 WeakPolarHBondContact O-CB 3.49Å; I518-F521 PolarHBondContact O-N 3.44Å; N519-F521 WeakPolarHBondContact O-CD2 3.44Å; N519-F521 PolarHBondContact O-N 3.43Å; N519-F521 VanDerWaalsContact O-N 3.15Å; F521-L523 HydrophobicContact CB-CD2 3.75Å; F521-L523 HydrophobicContact CB-CG 4.22Å; F521-L523 PolarHBondContact O-N 3.44Å
522	A	40.9	Very low	42.8	Very low	80 Å²	80	92.9 Å²	92.9	66%	0.661	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	110.1	164	0	0	0	0	0	109.4	T517	T517-A522 HydrophobicContact CG2-CB 4.13Å
523	L	43.1	Very low	44	Very low	48.5 Å²	48.5	91.5 Å²	91.5	25%	0.254	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	136.2	179.3	-60.4	-176.7	0	0	0	110.4	V516 F521 E527 V528	V516-L523 PolarHBondContact N-O 2.92Å; V516-L523 PolarHBondContact O-N 3.36Å; F521-L523 HydrophobicContact CB-CD2 3.75Å; F521-L523 HydrophobicContact CB-CG 4.22Å; F521-L523 PolarHBondContact O-N 3.44Å; L523-E527 HydrophobicContact CB-CB 4.3Å; L523-E527 HydrophobicContact CD2-CB 4.25Å; L523-V528 HydrophobicContact CB-CG2 3.98Å; L523-V528 HydrophobicContact CD1-CG2 4.33Å
524	N	47.5	Very low	45.2	Very low	69.5 Å²	69.5	84 Å²	84	37%	0.372	47%	0.472	S	S	.	.			trans	-69.5	154.2	172	133.9	-2.5	0	0	0	110.8	I526 E527 V528	N524-I526 PolarHBondContact O-N 3.2Å; N524-I526 VanDerWaalsContact O-N 3.07Å; N524-I526 WeakPolarHBondContact OD1-CA 3.47Å; N524-I526 WeakPolarHBondContact OD1-CB 3.29Å; N524-I526 WeakPolarHBondContact OD1-CG1 3.32Å; N524-I526 PolarHBondContact OD1-N 3.08Å; N524-E527 HydrophobicContact CB-CB 4.33Å; N524-E527 HydrophobicContact CB-CG 4.02Å; N524-E527 WeakPolarHBondContact CB-OE2 3.24Å; N524-E527 VanDerWaalsContact CG-OE1 3.3Å; N524-E527 PolarHBondContact N-OE1 3.05Å; N524-E527 PolarHBondContact N-OE2 3.23Å; N524-E527 WeakPolarHBondContact ND2-CG 3.49Å; N524-E527 PolarHBondContact ND2-OE1 3.4Å; N524-E527 CarbonylContact O-C 3.49Å; N524-E527 WeakPolarHBondContact O-CA 3.47Å; N524-E527 WeakPolarHBondContact O-CB 3.32Å; N524-E527 PolarHBondContact O-N 3.15Å; N524-E527 PolarHBondContact OD1-N 3.47Å; N524-V528 PolarHBondContact O-N 3.38Å; N524-V528 VanDerWaalsContact O-N 3.09Å
525	P	46.9	Very low	46.1	Very low	60.5 Å²	60.5	78.5 Å²	78.5	39%	0.393	45%	0.445	S	S	.	.	H	α-helix	trans	-56.9	-30	178.1	-28.5	37.3	0	0	0	114.4	N514 V528 A529	N514-P525 VanDerWaalsContact O-CD 3.26Å; N514-P525 WeakPolarHBondContact O-CD 3.38Å; N514-P525 WeakPolarHBondContact O-CG 3.2Å; P525-V528 PolarHBondContact O-N 3.24Å; P525-A529 WeakPolarHBondContact O-CB 3.38Å; P525-A529 PolarHBondContact O-N 3.09Å
526	I	52.7	Low	47.3	Very low	114 Å²	114	76.3 Å²	76.3	59%	0.585	43%	0.429	S	S	*	.	H	α-helix	trans	-69.6	-37.6	174.5	-57.8	170	0	0	0	110.5	N524 V528 A529 N530	N524-I526 PolarHBondContact O-N 3.2Å; N524-I526 VanDerWaalsContact O-N 3.07Å; N524-I526 WeakPolarHBondContact OD1-CA 3.47Å; N524-I526 WeakPolarHBondContact OD1-CB 3.29Å; N524-I526 WeakPolarHBondContact OD1-CG1 3.32Å; N524-I526 PolarHBondContact OD1-N 3.08Å; I526-V528 VanDerWaalsContact C-N 3.33Å; I526-V528 PolarHBondContact O-N 3.04Å; I526-A529 PolarHBondContact O-N 3.43Å; I526-N530 VanDerWaalsContact O-CB 3.25Å; I526-N530 WeakPolarHBondContact O-CB 3.26Å; I526-N530 VanDerWaalsContact O-CG 3.25Å; I526-N530 PolarHBondContact O-N 2.76Å; I526-N530 PolarHBondContact O-ND2 2.88Å; I526-N530 VanDerWaalsContact O-ND2 3.11Å
527	E	51.3	Low	48.2	Very low	76 Å²	76	75.5 Å²	75.5	36%	0.355	42%	0.421	S	S	.	.	H	α-helix	trans	-68.2	-37.8	173.7	-70.7	173.2	-156.2	0	0	111.9	L523 N524 N530 A531	L523-E527 HydrophobicContact CB-CB 4.3Å; L523-E527 HydrophobicContact CD2-CB 4.25Å; N524-E527 HydrophobicContact CB-CB 4.33Å; N524-E527 HydrophobicContact CB-CG 4.02Å; N524-E527 WeakPolarHBondContact CB-OE2 3.24Å; N524-E527 VanDerWaalsContact CG-OE1 3.3Å; N524-E527 PolarHBondContact N-OE1 3.05Å; N524-E527 PolarHBondContact N-OE2 3.23Å; N524-E527 WeakPolarHBondContact ND2-CG 3.49Å; N524-E527 PolarHBondContact ND2-OE1 3.4Å; N524-E527 CarbonylContact O-C 3.49Å; N524-E527 WeakPolarHBondContact O-CA 3.47Å; N524-E527 WeakPolarHBondContact O-CB 3.32Å; N524-E527 PolarHBondContact O-N 3.15Å; N524-E527 PolarHBondContact OD1-N 3.47Å; E527-N530 PolarHBondContact O-N 3.49Å; E527-A531 VanDerWaalsContact O-CB 3.28Å; E527-A531 WeakPolarHBondContact O-CB 3.45Å; E527-A531 PolarHBondContact O-N 2.96Å
528	V	53.9	Low	49.1	Very low	33 Å²	33	72.8 Å²	72.8	20%	0.2	40%	0.401	C	S	.	.	H	α-helix	trans	-66.4	-39.6	172.9	179.4	0	0	0	0	111.2	A278 L523 N524 P525 I526 N530 A531 A532	A278-V528 HydrophobicContact CB-CG1 3.97Å; L523-V528 HydrophobicContact CB-CG2 3.98Å; L523-V528 HydrophobicContact CD1-CG2 4.33Å; N524-V528 PolarHBondContact O-N 3.38Å; N524-V528 VanDerWaalsContact O-N 3.09Å; P525-V528 PolarHBondContact O-N 3.24Å; I526-V528 VanDerWaalsContact C-N 3.33Å; I526-V528 PolarHBondContact O-N 3.04Å; V528-N530 PolarHBondContact O-N 2.72Å; V528-A531 WeakPolarHBondContact O-CB 3.47Å; V528-A531 PolarHBondContact O-N 3.02Å; V528-A532 WeakPolarHBondContact O-CB 3.41Å; V528-A532 PolarHBondContact O-N 3.18Å
529	A	50.3	Low	49.8	Very low	54.5 Å²	54.5	69.8 Å²	69.8	45%	0.45	39%	0.39	S	S	.	.	H	α-helix	trans	-68.5	-42.2	175.3	0	0	0	0	0	112.6	P525 I526 A531 A532 K533	P525-A529 WeakPolarHBondContact O-CB 3.38Å; P525-A529 PolarHBondContact O-N 3.09Å; I526-A529 PolarHBondContact O-N 3.43Å; A529-A531 PolarHBondContact O-N 2.8Å; A529-A532 PolarHBondContact O-N 3.43Å; A529-K533 VanDerWaalsContact O-CB 3.22Å; A529-K533 WeakPolarHBondContact O-CB 3.37Å; A529-K533 PolarHBondContact O-N 3.18Å
530	N	54.6	Low	50.1	Low	71 Å²	71	67.8 Å²	67.8	38%	0.38	38%	0.376	S	S	.	.	H	α-helix	trans	-65.6	-36.6	173	-75	-22.6	0	0	0	111.5	I526 E527 V528 K533 V534	I526-N530 VanDerWaalsContact O-CB 3.25Å; I526-N530 WeakPolarHBondContact O-CB 3.26Å; I526-N530 VanDerWaalsContact O-CG 3.25Å; I526-N530 PolarHBondContact O-N 2.76Å; I526-N530 PolarHBondContact O-ND2 2.88Å; I526-N530 VanDerWaalsContact O-ND2 3.11Å; E527-N530 PolarHBondContact O-N 3.49Å; V528-N530 PolarHBondContact O-N 2.72Å; N530-K533 CarbonylContact O-C 3.58Å; N530-K533 PolarHBondContact O-N 2.98Å; N530-V534 WeakPolarHBondContact O-CB 3.44Å; N530-V534 WeakPolarHBondContact O-CG2 3.33Å; N530-V534 PolarHBondContact O-N 3.28Å
531	A	54.5	Low	50	Low	16 Å²	16	64.2 Å²	64.2	13%	0.132	36%	0.362	C	S	.	.	H	α-helix	trans	-62.9	-51.3	172	0	0	0	0	0	111.2	E527 V528 A529 K533 V534 A535	E527-A531 VanDerWaalsContact O-CB 3.28Å; E527-A531 WeakPolarHBondContact O-CB 3.45Å; E527-A531 PolarHBondContact O-N 2.96Å; V528-A531 WeakPolarHBondContact O-CB 3.47Å; V528-A531 PolarHBondContact O-N 3.02Å; A529-A531 PolarHBondContact O-N 2.8Å; A531-K533 VanDerWaalsContact C-N 3.34Å; A531-K533 PolarHBondContact O-N 3.4Å; A531-K533 VanDerWaalsContact O-N 3.09Å; A531-V534 PolarHBondContact O-N 3.18Å; A531-V534 VanDerWaalsContact O-N 3.08Å; A531-A535 VanDerWaalsContact O-CB 3.27Å; A531-A535 WeakPolarHBondContact O-CB 3.24Å; A531-A535 PolarHBondContact O-N 3.06Å
532	A	55.5	Low	50.1	Low	21.5 Å²	21.5	64.3 Å²	64.3	18%	0.178	37%	0.368	C	S	.	.	H	α-helix	trans	-56.9	-38.9	174.4	0	0	0	0	0	112.2	V528 A529 A535 L536	V528-A532 WeakPolarHBondContact O-CB 3.41Å; V528-A532 PolarHBondContact O-N 3.18Å; A529-A532 PolarHBondContact O-N 3.43Å; A532-A535 PolarHBondContact O-N 2.96Å; A532-L536 VanDerWaalsContact O-CB 3.3Å; A532-L536 WeakPolarHBondContact O-CB 3.35Å; A532-L536 WeakPolarHBondContact O-CD1 3.38Å; A532-L536 VanDerWaalsContact O-CG 3.23Å; A532-L536 WeakPolarHBondContact O-CG 3.45Å; A532-L536 PolarHBondContact O-N 2.87Å
533	K	55.8	Low	49.9	Very low	127 Å²	127	68.7 Å²	68.7	55%	0.552	38%	0.375	S	S	*	.	H	α-helix	trans	-66.4	-42.7	175.7	-171.8	175.6	-177	176.4	0	113.2	A529 N530 A531 L536 L537	A529-K533 VanDerWaalsContact O-CB 3.22Å; A529-K533 WeakPolarHBondContact O-CB 3.37Å; A529-K533 PolarHBondContact O-N 3.18Å; N530-K533 CarbonylContact O-C 3.58Å; N530-K533 PolarHBondContact O-N 2.98Å; A531-K533 VanDerWaalsContact C-N 3.34Å; A531-K533 PolarHBondContact O-N 3.4Å; A531-K533 VanDerWaalsContact O-N 3.09Å; K533-L536 PolarHBondContact O-N 3.03Å; K533-L537 HydrophobicContact CG-CD1 4.37Å; K533-L537 WeakPolarHBondContact O-CB 3.27Å; K533-L537 WeakPolarHBondContact O-CD1 3.35Å; K533-L537 WeakPolarHBondContact O-CG 3.43Å; K533-L537 PolarHBondContact O-N 3.31Å
534	V	58.2	Low	49.6	Very low	25.5 Å²	25.5	74 Å²	74	16%	0.155	40%	0.399	C	S	.	.	H	α-helix	trans	-68.4	-42.1	175.3	169.7	0	0	0	0	110.7	N530 A531 L536 L537 M538	N530-V534 WeakPolarHBondContact O-CB 3.44Å; N530-V534 WeakPolarHBondContact O-CG2 3.33Å; N530-V534 PolarHBondContact O-N 3.28Å; A531-V534 PolarHBondContact O-N 3.18Å; A531-V534 VanDerWaalsContact O-N 3.08Å; V534-L536 PolarHBondContact O-N 3.25Å; V534-L537 CarbonylContact O-C 3.37Å; V534-L537 WeakPolarHBondContact O-CA 3.29Å; V534-L537 PolarHBondContact O-N 3.49Å; V534-L537 VanDerWaalsContact O-N 3.12Å; V534-M538 HydrophobicContact CG1-CE 4.42Å; V534-M538 HydrophobicContact CG1-CG 4.27Å; V534-M538 WeakPolarHBondContact O-CB 3.1Å; V534-M538 VanDerWaalsContact O-CG 3.27Å; V534-M538 WeakPolarHBondContact O-CG 3.37Å; V534-M538 PolarHBondContact O-N 3.07Å
535	A	55.9	Low	49.3	Very low	17 Å²	17	74.6 Å²	74.6	14%	0.14	41%	0.406	C	S	.	.	H	α-helix	trans	-58.4	-46.5	173.3	0	0	0	0	0	111.4	W256 A531 A532 L537 M538 A539	W256-A535 HydrophobicContact CH2-CB 3.7Å; W256-A535 HydrophobicContact CZ2-CB 4.11Å; W256-A535 HydrophobicContact CZ3-CB 4Å; A531-A535 VanDerWaalsContact O-CB 3.27Å; A531-A535 WeakPolarHBondContact O-CB 3.24Å; A531-A535 PolarHBondContact O-N 3.06Å; A532-A535 PolarHBondContact O-N 2.96Å; A535-L537 VanDerWaalsContact C-N 3.31Å; A535-L537 PolarHBondContact O-N 2.85Å; A535-M538 PolarHBondContact O-N 3.34Å; A535-A539 WeakPolarHBondContact O-CA 3.38Å; A535-A539 WeakPolarHBondContact O-CB 3.36Å; A535-A539 PolarHBondContact O-N 3.37Å
536	L	55.1	Low	49.6	Very low	64.5 Å²	64.5	78.9 Å²	78.9	34%	0.338	42%	0.418	S	S	.	.	H	α-helix	trans	-62.6	-33.9	174.1	-74.2	166.4	0	0	0	112.7	L270 A532 K533 V534 M538 H540	L270-L536 HydrophobicContact CD2-CD2 4.25Å; A532-L536 VanDerWaalsContact O-CB 3.3Å; A532-L536 WeakPolarHBondContact O-CB 3.35Å; A532-L536 WeakPolarHBondContact O-CD1 3.38Å; A532-L536 VanDerWaalsContact O-CG 3.23Å; A532-L536 WeakPolarHBondContact O-CG 3.45Å; A532-L536 PolarHBondContact O-N 2.87Å; K533-L536 PolarHBondContact O-N 3.03Å; V534-L536 PolarHBondContact O-N 3.25Å; L536-M538 PolarHBondContact O-N 3.45Å; L536-H540 CarbonylContact O-C 3.53Å; L536-H540 VanDerWaalsContact O-C 3.27Å; L536-H540 WeakPolarHBondContact O-CA 3.37Å; L536-H540 VanDerWaalsContact O-CB 3.28Å; L536-H540 WeakPolarHBondContact O-CB 3.35Å; L536-H540 PolarHBondContact O-N 2.92Å; L536-H540 VanDerWaalsContact O-O 3.1Å
537	L	56.4	Low	50.5	Low	69.5 Å²	69.5	81 Å²	81	36%	0.364	42%	0.419	S	S	.	.	H	α-helix	trans	-74.5	-26.2	175.6	-74	167	0	0	0	113.8	K533 V534 A535 P541 L542	K533-L537 HydrophobicContact CG-CD1 4.37Å; K533-L537 WeakPolarHBondContact O-CB 3.27Å; K533-L537 WeakPolarHBondContact O-CD1 3.35Å; K533-L537 WeakPolarHBondContact O-CG 3.43Å; K533-L537 PolarHBondContact O-N 3.31Å; V534-L537 CarbonylContact O-C 3.37Å; V534-L537 WeakPolarHBondContact O-CA 3.29Å; V534-L537 PolarHBondContact O-N 3.49Å; V534-L537 VanDerWaalsContact O-N 3.12Å; A535-L537 VanDerWaalsContact C-N 3.31Å; A535-L537 PolarHBondContact O-N 2.85Å; L537-P541 WeakPolarHBondContact O-CA 3.46Å; L537-L542 HydrophobicContact CD2-CD1 3.78Å; L537-L542 HydrophobicContact CD2-CD2 4.32Å; L537-L542 HydrophobicContact CD2-CG 3.67Å
538	M	52.4	Low	51.9	Low	52 Å²	52	79.6 Å²	79.6	26%	0.256	42%	0.416	S	S	.	.	H	α-helix	trans	-91.7	-40.6	178.7	-63.1	-56.4	142.1	0	0	112.4	L241 V534 A535 L536 H540	L241-M538 HydrophobicContact CD2-CE 3.54Å; L241-M538 HydrophobicContact CD2-SD 4Å; L241-M538 HydrophobicContact CG-CE 4.19Å; L241-M538 HydrophobicContact CG-SD 4.05Å; V534-M538 HydrophobicContact CG1-CE 4.42Å; V534-M538 HydrophobicContact CG1-CG 4.27Å; V534-M538 WeakPolarHBondContact O-CB 3.1Å; V534-M538 VanDerWaalsContact O-CG 3.27Å; V534-M538 WeakPolarHBondContact O-CG 3.37Å; V534-M538 PolarHBondContact O-N 3.07Å; A535-M538 PolarHBondContact O-N 3.34Å; L536-M538 PolarHBondContact O-N 3.45Å; M538-H540 VanDerWaalsContact C-N 3.3Å; M538-H540 PolarHBondContact O-N 3.47Å
539	A	50	Low	53.4	Low	29 Å²	29	80.5 Å²	80.5	24%	0.24	43%	0.427	C	S	.	.	H	α-helix	trans	-78.8	18.2	-179.4	0	0	0	0	0	112.1	L270 A535	L270-A539 HydrophobicContact CD2-CB 3.97Å; A535-A539 WeakPolarHBondContact O-CA 3.38Å; A535-A539 WeakPolarHBondContact O-CB 3.36Å; A535-A539 PolarHBondContact O-N 3.37Å
540	H	42.1	Very low	55.3	Low	90 Å²	90	78.1 Å²	78.1	42%	0.417	41%	0.407	S	S	.	.	S	Bend	trans	150	108.4	179.1	-49.8	-59.4	0	0	0	112.8	T267 L270 L536 M538 L542	T267-H540 HydrophobicContact CG2-CB 3.88Å; T267-H540 WeakPolarHBondContact CG2-CD2 3.32Å; L270-H540 WeakPolarHBondContact CD2-NE2 3.35Å; L536-H540 CarbonylContact O-C 3.53Å; L536-H540 VanDerWaalsContact O-C 3.27Å; L536-H540 WeakPolarHBondContact O-CA 3.37Å; L536-H540 VanDerWaalsContact O-CB 3.28Å; L536-H540 WeakPolarHBondContact O-CB 3.35Å; L536-H540 PolarHBondContact O-N 2.92Å; L536-H540 VanDerWaalsContact O-O 3.1Å; M538-H540 VanDerWaalsContact C-N 3.3Å; M538-H540 PolarHBondContact O-N 3.47Å; H540-L542 PolarHBondContact O-N 2.83Å
541	P	38.7	Very low	56.7	Low	81 Å²	81	79.8 Å²	79.8	53%	0.526	43%	0.43	S	S	.	.			trans	-59.4	133.8	170.5	26.5	-34.5	0	0	0	110	L537 E543	L537-P541 WeakPolarHBondContact O-CA 3.46Å; P541-E543 PolarHBondContact O-N 2.9Å
542	L	36.6	Very low	58.1	Low	151 Å²	151	84.4 Å²	84.4	79%	0.791	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	87.6	-178.3	-71.5	165.9	0	0	0	112.6	L537 H540 E544	L537-L542 HydrophobicContact CD2-CD1 3.78Å; L537-L542 HydrophobicContact CD2-CD2 4.32Å; L537-L542 HydrophobicContact CD2-CG 3.67Å; H540-L542 PolarHBondContact O-N 2.83Å; L542-E544 PolarHBondContact O-N 2.98Å
543	E	36.9	Very low	59.7	Low	171.5 Å²	171.5	85.8 Å²	85.8	80%	0.801	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	104.9	177.7	-67.5	-168.6	114.3	0	0	111.7	P541 P545	P541-E543 PolarHBondContact O-N 2.9Å; E543-P545 WeakPolarHBondContact O-CD 3.37Å; E543-P545 VanDerWaalsContact O-N 3.15Å
544	E	37.2	Very low	61.1	Low	161 Å²	161	83.3 Å²	83.3	75%	0.752	46%	0.463	S	S	*	.	S	Bend	trans	-62	123.6	149.6	-83.4	-149.6	172.9	0	0	107.7	L542 K546	L542-E544 PolarHBondContact O-N 2.98Å; E544-K546 PolarHBondContact O-N 2.93Å
545	P	40.7	Very low	62.4	Low	80.5 Å²	80.5	88.4 Å²	88.4	52%	0.523	48%	0.483	S	S	.	.			trans	-61.7	104.6	-176	-3.2	2.9	0	0	0	111.6	E543 R547 K558	E543-P545 WeakPolarHBondContact O-CD 3.37Å; E543-P545 VanDerWaalsContact O-N 3.15Å; P545-R547 WeakPolarHBondContact O-CA 3.39Å; P545-R547 WeakPolarHBondContact O-CG 3.28Å; P545-R547 PolarHBondContact O-N 3.12Å; P545-K558 CarbonylContact C-O 3.58Å; P545-K558 WeakPolarHBondContact CB-O 3.33Å
546	K	53.7	Low	63.8	Low	150.5 Å²	150.5	96.1 Å²	96.1	65%	0.654	51%	0.508	S	S	*	.			trans	-42.6	104.4	-174.9	-78	-179.3	177	173.2	0	110.4	G265 E544 V548	G265-K546 PolarHBondContact O-NZ 2.9Å; E544-K546 PolarHBondContact O-N 2.93Å; K546-V548 VanDerWaalsContact C-N 3.32Å; K546-V548 WeakPolarHBondContact O-CG2 3.38Å; K546-V548 PolarHBondContact O-N 3.12Å
547	R	71.1	Confident	65.4	Low	159 Å²	159	95.1 Å²	95.1	60%	0.6	50%	0.501	S	S	*	.			trans	-75.9	84.2	-171	-68.1	-164.6	-174.6	-150.9	8.2	111.6	P545 A549 R556 F557	P545-R547 WeakPolarHBondContact O-CA 3.39Å; P545-R547 WeakPolarHBondContact O-CG 3.28Å; P545-R547 PolarHBondContact O-N 3.12Å; R547-A549 PolarHBondContact O-N 2.87Å; R547-R556 HydrophobicContact CB-CB 4.28Å; R547-F557 CarbonylContact C-O 3.35Å; R547-F557 VanDerWaalsContact CA-O 3.25Å; R547-F557 WeakPolarHBondContact CA-O 3.42Å
548	V	80.2	Confident	66.7	Low	47.5 Å²	47.5	99 Å²	99	29%	0.288	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	126.2	-175.4	-150.8	0	0	0	0	110.6	K546 F557 L563	K546-V548 VanDerWaalsContact C-N 3.32Å; K546-V548 WeakPolarHBondContact O-CG2 3.38Å; K546-V548 PolarHBondContact O-N 3.12Å; V548-F557 PolarHBondContact N-O 3.35Å; V548-F557 VanDerWaalsContact N-O 3.11Å; V548-F557 PolarHBondContact O-N 2.9Å; V548-L563 HydrophobicContact CB-CB 4.46Å; V548-L563 HydrophobicContact CB-CD2 3.77Å; V548-L563 HydrophobicContact CG1-CD2 3.44Å; V548-L563 VanDerWaalsContact CG1-CD2 3.44Å
549	A	85.3	Confident	68.2	Low	52 Å²	52	99.6 Å²	99.6	43%	0.43	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	149.1	179.7	0	0	0	0	0	111.8	R547 A551 K555 R556 L563	R547-A549 PolarHBondContact O-N 2.87Å; A549-A551 PolarHBondContact O-N 3.42Å; A549-K555 CarbonylContact C-O 3.56Å; A549-K555 WeakPolarHBondContact CA-O 3.31Å; A549-R556 HydrophobicContact CB-CG 4.26Å; A549-L563 WeakPolarHBondContact O-CD2 3.39Å
550	C	90.7	Very high	69.8	Low	4 Å²	4	102.8 Å²	102.8	3%	0.027	53%	0.53	C	S	.	.	P	Polyproline II helix	trans	-77.1	124.6	167.7	-179.2	0	0	0	0	111	I552 C553 A554 K555 F557 L563 H566 M567 H570	C550-I552 PolarHBondContact O-N 3.02Å; C550-I552 VanDerWaalsContact O-N 3.16Å; C550-I552 PolarHBondContact SG-N 3.07Å; C550-I552 VanDerWaalsContact SG-N 3.44Å; C550-C553 PolarHBondContact O-N 3.37Å; C550-C553 PolarHBondContact SG-N 2.81Å; C550-C553 VanDerWaalsContact SG-N 3.36Å; C550-A554 VanDerWaalsContact O-CA 3.22Å; C550-A554 WeakPolarHBondContact O-CA 3.39Å; C550-A554 PolarHBondContact O-N 2.99Å; C550-K555 PolarHBondContact N-O 3.14Å; C550-F557 HydrophobicContact CB-CE2 4.31Å; C550-L563 HydrophobicContact CB-CD1 3.91Å; C550-H566 WeakPolarHBondContact CB-NE2 3.27Å; C550-H566 PolarHBondContact SG-NE2 3.14Å; C550-H566 VanDerWaalsContact SG-NE2 3.43Å; C550-M567 HydrophobicContact CB-CE 4.12Å; C550-H570 PolarHBondContact SG-CD2 3.21Å; C550-H570 VanDerWaalsContact SG-CD2 3.54Å; C550-H570 PolarHBondContact SG-NE2 2.97Å
551	A	83	Confident	71.8	Confident	105 Å²	105	102.7 Å²	102.7	87%	0.868	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.9	175.8	0	0	0	0	0	114	A549	A549-A551 PolarHBondContact O-N 3.42Å
552	I	84.6	Confident	74.1	Confident	113 Å²	113	100.3 Å²	100.3	58%	0.579	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-27.4	-172.5	-55.7	173.4	0	0	0	112.4	C550 M567 H570	C550-I552 PolarHBondContact O-N 3.02Å; C550-I552 VanDerWaalsContact O-N 3.16Å; C550-I552 PolarHBondContact SG-N 3.07Å; C550-I552 VanDerWaalsContact SG-N 3.44Å; I552-M567 HydrophobicContact CD1-SD 4.04Å; I552-M567 HydrophobicContact CG1-SD 4.39Å; I552-H570 HydrophobicContact CD1-CB 3.67Å; I552-H570 HydrophobicContact CG2-CB 4.46Å; I552-H570 VanDerWaalsContact CG2-ND1 3.35Å; I552-H570 WeakPolarHBondContact CG2-ND1 3.45Å
553	C	90.2	Very high	76.7	Confident	51.5 Å²	51.5	93.6 Å²	93.6	35%	0.348	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.7	21.1	176.9	74.3	0	0	0	0	115.9	C550 K555 H566 H570	C550-C553 PolarHBondContact O-N 3.37Å; C550-C553 PolarHBondContact SG-N 2.81Å; C550-C553 VanDerWaalsContact SG-N 3.36Å; C553-K555 PolarHBondContact O-N 3.01Å; C553-H566 PolarHBondContact SG-NE2 3.21Å; C553-H566 VanDerWaalsContact SG-NE2 3.38Å; C553-H570 PolarHBondContact SG-CE1 3.11Å; C553-H570 PolarHBondContact SG-NE2 3.08Å; C553-H570 VanDerWaalsContact SG-NE2 3.39Å
554	A	84	Confident	79	Confident	75 Å²	75	89.4 Å²	89.4	62%	0.62	47%	0.473	S	S	*	.			trans	58	-5.6	175.1	0	0	0	0	0	118	C550 R556	C550-A554 VanDerWaalsContact O-CA 3.22Å; C550-A554 WeakPolarHBondContact O-CA 3.39Å; C550-A554 PolarHBondContact O-N 2.99Å; A554-R556 PolarHBondContact O-N 3.26Å
555	K	85.1	Confident	81.4	Confident	132.5 Å²	132.5	83.6 Å²	83.6	58%	0.576	46%	0.458	S	S	*	.			trans	-56.3	131.2	178.5	-70.9	-176.6	-179.4	-177.4	0	110.9	A549 C550 C553 F557	A549-K555 CarbonylContact C-O 3.56Å; A549-K555 WeakPolarHBondContact CA-O 3.31Å; C550-K555 PolarHBondContact N-O 3.14Å; C553-K555 PolarHBondContact O-N 3.01Å; K555-F557 HydrophobicContact CB-CE2 3.52Å; K555-F557 VanDerWaalsContact CB-CE2 3.49Å; K555-F557 HydrophobicContact CB-CZ 3.78Å; K555-F557 VanDerWaalsContact O-CD2 3.22Å; K555-F557 WeakPolarHBondContact O-CD2 3.42Å; K555-F557 WeakPolarHBondContact O-CE2 3.41Å
556	R	86.5	Confident	83.7	Confident	177.5 Å²	177.5	80.7 Å²	80.7	67%	0.67	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	122.9	-174.7	-59.6	-179.3	76.2	178.4	6.2	111.1	R547 A549 A554	R547-R556 HydrophobicContact CB-CB 4.28Å; A549-R556 HydrophobicContact CB-CG 4.26Å; A554-R556 PolarHBondContact O-N 3.26Å
557	F	88.7	Confident	85.1	Confident	43.5 Å²	43.5	76.1 Å²	76.1	19%	0.191	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	144.5	-173.7	-67.3	-87	0	0	0	112.1	R547 V548 C550 K555 N559 A562 L563 H566	R547-F557 CarbonylContact C-O 3.35Å; R547-F557 VanDerWaalsContact CA-O 3.25Å; R547-F557 WeakPolarHBondContact CA-O 3.42Å; V548-F557 PolarHBondContact N-O 3.35Å; V548-F557 VanDerWaalsContact N-O 3.11Å; V548-F557 PolarHBondContact O-N 2.9Å; C550-F557 HydrophobicContact CB-CE2 4.31Å; K555-F557 HydrophobicContact CB-CE2 3.52Å; K555-F557 VanDerWaalsContact CB-CE2 3.49Å; K555-F557 HydrophobicContact CB-CZ 3.78Å; K555-F557 VanDerWaalsContact O-CD2 3.22Å; K555-F557 WeakPolarHBondContact O-CD2 3.42Å; K555-F557 WeakPolarHBondContact O-CE2 3.41Å; F557-N559 PolarHBondContact O-N 2.99Å; F557-N559 VanDerWaalsContact O-N 3.12Å; F557-A562 HydrophobicContact CB-CB 4.02Å; F557-A562 HydrophobicContact CD1-CB 4.2Å; F557-L563 HydrophobicContact CB-CB 4.14Å; F557-L563 HydrophobicContact CD2-CB 4.41Å; F557-L563 HydrophobicContact CD2-CD1 3.78Å; F557-L563 HydrophobicContact CE2-CD1 4.31Å; F557-L563 HydrophobicContact CG-CB 4.42Å; F557-L563 HydrophobicContact CG-CD1 4.34Å; F557-H566 HydrophobicContact CD1-CB 4.18Å; F557-H566 HydrophobicContact CD2-CB 4.43Å; F557-H566 HydrophobicContact CE1-CB 3.58Å; F557-H566 AromaticContact CE1-CG 3.83Å; F557-H566 HydrophobicContact CE2-CB 3.86Å; F557-H566 AromaticContact CE2-CD2 3.08Å; F557-H566 WeakPolarHBondContact CE2-CD2 3.38Å; F557-H566 AromaticContact CE2-CG 3.48Å; F557-H566 VanDerWaalsContact CE2-CG 3.48Å; F557-H566 AromaticContact CE2-NE2 3.7Å; F557-H566 HydrophobicContact CZ-CB 3.41Å; F557-H566 VanDerWaalsContact CZ-CB 3.41Å; F557-H566 AromaticContact CZ-CD2 3.26Å; F557-H566 WeakPolarHBondContact CZ-CD2 3.13Å; F557-H566 AromaticContact CZ-CE1 3.98Å; F557-H566 AromaticContact CZ-CG 3.13Å; F557-H566 AromaticContact CZ-ND1 3.65Å; F557-H566 AromaticContact CZ-NE2 3.8Å
558	K	82.6	Confident	85.7	Confident	151.5 Å²	151.5	78.6 Å²	78.6	66%	0.659	43%	0.428	S	S	*	.	S	Bend	trans	-60	-22.1	-174.4	65.3	175.9	-178.4	176.3	0	115.4	P545 A562	P545-K558 CarbonylContact C-O 3.58Å; P545-K558 WeakPolarHBondContact CB-O 3.33Å; K558-A562 HydrophobicContact CG-CB 4.19Å
559	N	84.5	Confident	85.6	Confident	65.5 Å²	65.5	82.5 Å²	82.5	35%	0.35	45%	0.446	S	S	.	.	S	Bend	trans	-162.3	169.1	175.1	60.5	9.9	0	0	0	110.7	F557 S561 A562 L563	F557-N559 PolarHBondContact O-N 2.99Å; F557-N559 VanDerWaalsContact O-N 3.12Å; N559-S561 PolarHBondContact O-N 3.43Å; N559-S561 PolarHBondContact OD1-N 2.8Å; N559-A562 PolarHBondContact O-N 3.13Å; N559-A562 VanDerWaalsContact OD1-CB 3.26Å; N559-A562 WeakPolarHBondContact OD1-CB 3.43Å; N559-A562 PolarHBondContact OD1-N 3.45Å; N559-L563 PolarHBondContact O-N 3.11Å
560	Q	82.8	Confident	85.4	Confident	96.5 Å²	96.5	82.9 Å²	82.9	45%	0.451	44%	0.439	S	S	.	.	H	α-helix	trans	-56.8	-33	177.9	-169.3	63	34.6	0	0	112.8	A562 L563 N564	Q560-A562 PolarHBondContact O-N 2.84Å; Q560-L563 PolarHBondContact O-N 3.08Å; Q560-N564 PolarHBondContact NE2-OD1 3.01Å; Q560-N564 WeakPolarHBondContact O-CB 3.34Å; Q560-N564 PolarHBondContact O-N 3.29Å; Q560-N564 PolarHBondContact O-OD1 3.13Å
561	S	84.6	Confident	83.8	Confident	87.5 Å²	87.5	85.5 Å²	85.5	61%	0.612	47%	0.466	S	S	*	.	H	α-helix	trans	-64.7	-42	177.1	-47.1	0	0	0	0	112.4	N559 N564 G565	N559-S561 PolarHBondContact O-N 3.43Å; N559-S561 PolarHBondContact OD1-N 2.8Å; S561-N564 PolarHBondContact O-N 2.95Å; S561-G565 PolarHBondContact O-N 2.91Å
562	A	88	Confident	82.1	Confident	30.5 Å²	30.5	83.1 Å²	83.1	25%	0.252	45%	0.452	S	S	.	.	H	α-helix	trans	-70.6	-34.7	175.1	0	0	0	0	0	111.9	F557 K558 N559 Q560 G565 H566	F557-A562 HydrophobicContact CB-CB 4.02Å; F557-A562 HydrophobicContact CD1-CB 4.2Å; K558-A562 HydrophobicContact CG-CB 4.19Å; N559-A562 PolarHBondContact O-N 3.13Å; N559-A562 VanDerWaalsContact OD1-CB 3.26Å; N559-A562 WeakPolarHBondContact OD1-CB 3.43Å; N559-A562 PolarHBondContact OD1-N 3.45Å; Q560-A562 PolarHBondContact O-N 2.84Å; A562-G565 PolarHBondContact O-N 3.12Å; A562-H566 WeakPolarHBondContact O-CB 3.33Å; A562-H566 PolarHBondContact O-N 2.87Å
563	L	91.3	Very high	80.1	Confident	10.5 Å²	10.5	88.5 Å²	88.5	6%	0.055	47%	0.467	C	S	.	.	H	α-helix	trans	-63.7	-47.9	170.6	178.4	62.2	0	0	0	111.5	V548 A549 C550 F557 N559 Q560 G565 H566 M567	V548-L563 HydrophobicContact CB-CB 4.46Å; V548-L563 HydrophobicContact CB-CD2 3.77Å; V548-L563 HydrophobicContact CG1-CD2 3.44Å; V548-L563 VanDerWaalsContact CG1-CD2 3.44Å; A549-L563 WeakPolarHBondContact O-CD2 3.39Å; C550-L563 HydrophobicContact CB-CD1 3.91Å; F557-L563 HydrophobicContact CB-CB 4.14Å; F557-L563 HydrophobicContact CD2-CB 4.41Å; F557-L563 HydrophobicContact CD2-CD1 3.78Å; F557-L563 HydrophobicContact CE2-CD1 4.31Å; F557-L563 HydrophobicContact CG-CB 4.42Å; F557-L563 HydrophobicContact CG-CD1 4.34Å; N559-L563 PolarHBondContact O-N 3.11Å; Q560-L563 PolarHBondContact O-N 3.08Å; L563-G565 VanDerWaalsContact C-N 3.31Å; L563-G565 PolarHBondContact O-N 3.33Å; L563-H566 CarbonylContact O-C 3.33Å; L563-H566 WeakPolarHBondContact O-CA 3.31Å; L563-H566 WeakPolarHBondContact O-CB 3.36Å; L563-H566 PolarHBondContact O-N 3.14Å; L563-M567 HydrophobicContact CD1-CE 3.65Å; L563-M567 HydrophobicContact CD2-CE 4.43Å; L563-M567 HydrophobicContact CG-CE 3.65Å; L563-M567 PolarHBondContact O-N 3.17Å
564	N	84.9	Confident	77.5	Confident	82 Å²	82	88.7 Å²	88.7	44%	0.439	48%	0.477	S	S	.	.	H	α-helix	trans	-61.7	-39	177.6	-71.2	-1.3	0	0	0	111.6	Q560 S561 H566 M567 R568	Q560-N564 PolarHBondContact NE2-OD1 3.01Å; Q560-N564 WeakPolarHBondContact O-CB 3.34Å; Q560-N564 PolarHBondContact O-N 3.29Å; Q560-N564 PolarHBondContact O-OD1 3.13Å; S561-N564 PolarHBondContact O-N 2.95Å; N564-H566 VanDerWaalsContact C-N 3.31Å; N564-H566 PolarHBondContact O-N 3.03Å; N564-M567 PolarHBondContact O-N 3.07Å; N564-R568 PolarHBondContact O-N 2.86Å
565	G	87	Confident	75.2	Confident	40.5 Å²	40.5	91.8 Å²	91.8	42%	0.418	49%	0.491	S	S	.	.	H	α-helix	trans	-62.5	-39.6	172.7	0	0	0	0	0	112.7	S561 A562 L563 R568	S561-G565 PolarHBondContact O-N 2.91Å; A562-G565 PolarHBondContact O-N 3.12Å; L563-G565 VanDerWaalsContact C-N 3.31Å; L563-G565 PolarHBondContact O-N 3.33Å; G565-R568 WeakPolarHBondContact O-CB 3.27Å; G565-R568 PolarHBondContact O-N 2.91Å
566	H	89.6	Confident	72.9	Confident	19.5 Å²	19.5	90.1 Å²	90.1	9%	0.09	50%	0.502	C	S	.	.	H	α-helix	trans	-71.1	-33.1	172.8	167.5	60.2	0	0	0	113.4	C550 C553 F557 A562 L563 N564 R568 L569 H570	C550-H566 WeakPolarHBondContact CB-NE2 3.27Å; C550-H566 PolarHBondContact SG-NE2 3.14Å; C550-H566 VanDerWaalsContact SG-NE2 3.43Å; C553-H566 PolarHBondContact SG-NE2 3.21Å; C553-H566 VanDerWaalsContact SG-NE2 3.38Å; F557-H566 HydrophobicContact CD1-CB 4.18Å; F557-H566 HydrophobicContact CD2-CB 4.43Å; F557-H566 HydrophobicContact CE1-CB 3.58Å; F557-H566 AromaticContact CE1-CG 3.83Å; F557-H566 HydrophobicContact CE2-CB 3.86Å; F557-H566 AromaticContact CE2-CD2 3.08Å; F557-H566 WeakPolarHBondContact CE2-CD2 3.38Å; F557-H566 AromaticContact CE2-CG 3.48Å; F557-H566 VanDerWaalsContact CE2-CG 3.48Å; F557-H566 AromaticContact CE2-NE2 3.7Å; F557-H566 HydrophobicContact CZ-CB 3.41Å; F557-H566 VanDerWaalsContact CZ-CB 3.41Å; F557-H566 AromaticContact CZ-CD2 3.26Å; F557-H566 WeakPolarHBondContact CZ-CD2 3.13Å; F557-H566 AromaticContact CZ-CE1 3.98Å; F557-H566 AromaticContact CZ-CG 3.13Å; F557-H566 AromaticContact CZ-ND1 3.65Å; F557-H566 AromaticContact CZ-NE2 3.8Å; A562-H566 WeakPolarHBondContact O-CB 3.33Å; A562-H566 PolarHBondContact O-N 2.87Å; L563-H566 CarbonylContact O-C 3.33Å; L563-H566 WeakPolarHBondContact O-CA 3.31Å; L563-H566 WeakPolarHBondContact O-CB 3.36Å; L563-H566 PolarHBondContact O-N 3.14Å; N564-H566 VanDerWaalsContact C-N 3.31Å; N564-H566 PolarHBondContact O-N 3.03Å; H566-R568 PolarHBondContact O-N 3.46Å; H566-L569 WeakPolarHBondContact O-CA 3.41Å; H566-L569 VanDerWaalsContact O-CB 3.24Å; H566-L569 WeakPolarHBondContact O-CB 3.45Å; H566-L569 PolarHBondContact O-N 3.01Å; H566-H570 AromaticContact CD2-NE2 3.96Å; H566-H570 AromaticContact CE1-CD2 3.86Å; H566-H570 AromaticContact CE1-NE2 3.24Å; H566-H570 PolarHBondContact CE1-NE2 2.96Å; H566-H570 VanDerWaalsContact CE1-NE2 3.27Å; H566-H570 AromaticContact NE2-CD2 3.63Å; H566-H570 AromaticContact NE2-NE2 3.01Å; H566-H570 PolarHBondContact NE2-NE2 2.85Å
567	M	81.6	Confident	70.2	Confident	54 Å²	54	84.6 Å²	84.6	27%	0.266	50%	0.501	S	S	.	.	H	α-helix	trans	-64.4	-23.6	-179.6	-147.7	59.8	61.3	0	0	112.5	C550 I552 L563 N564 L569 H570 G571	C550-M567 HydrophobicContact CB-CE 4.12Å; I552-M567 HydrophobicContact CD1-SD 4.04Å; I552-M567 HydrophobicContact CG1-SD 4.39Å; L563-M567 HydrophobicContact CD1-CE 3.65Å; L563-M567 HydrophobicContact CD2-CE 4.43Å; L563-M567 HydrophobicContact CG-CE 3.65Å; L563-M567 PolarHBondContact O-N 3.17Å; N564-M567 PolarHBondContact O-N 3.07Å; M567-L569 PolarHBondContact O-N 3.08Å; M567-L569 VanDerWaalsContact O-N 3.12Å; M567-H570 PolarHBondContact O-N 3.18Å; M567-H570 VanDerWaalsContact O-N 3.12Å; M567-H570 HydrophobicContact SD-CB 4.43Å; M567-G571 PolarHBondContact O-N 2.91Å
568	R	84.5	Confident	67.5	Low	211 Å²	211	90 Å²	90	80%	0.796	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-19.4	168.2	-62.2	177.1	176.1	-164.6	-4.1	113.7	N564 G565 H566	N564-R568 PolarHBondContact O-N 2.86Å; G565-R568 WeakPolarHBondContact O-CB 3.27Å; G565-R568 PolarHBondContact O-N 2.91Å; H566-R568 PolarHBondContact O-N 3.46Å
569	L	78.7	Confident	65.2	Low	128.5 Å²	128.5	90.9 Å²	90.9	67%	0.673	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-9.4	175.2	-54.6	176.2	0	0	0	113.1	V164 H566 M567	V164-L569 HydrophobicContact CG2-CD2 4.15Å; H566-L569 WeakPolarHBondContact O-CA 3.41Å; H566-L569 VanDerWaalsContact O-CB 3.24Å; H566-L569 WeakPolarHBondContact O-CB 3.45Å; H566-L569 PolarHBondContact O-N 3.01Å; M567-L569 PolarHBondContact O-N 3.08Å; M567-L569 VanDerWaalsContact O-N 3.12Å
570	H	81.1	Confident	62.6	Low	61.5 Å²	61.5	90.8 Å²	90.8	29%	0.285	56%	0.555	S	S	.	*	S	Bend	trans	-101.4	-22.8	173.9	-68	-65.3	0	0	0	112.8	C550 I552 C553 H566 M567 G572	C550-H570 PolarHBondContact SG-CD2 3.21Å; C550-H570 VanDerWaalsContact SG-CD2 3.54Å; C550-H570 PolarHBondContact SG-NE2 2.97Å; I552-H570 HydrophobicContact CD1-CB 3.67Å; I552-H570 HydrophobicContact CG2-CB 4.46Å; I552-H570 VanDerWaalsContact CG2-ND1 3.35Å; I552-H570 WeakPolarHBondContact CG2-ND1 3.45Å; C553-H570 PolarHBondContact SG-CE1 3.11Å; C553-H570 PolarHBondContact SG-NE2 3.08Å; C553-H570 VanDerWaalsContact SG-NE2 3.39Å; H566-H570 AromaticContact CD2-NE2 3.96Å; H566-H570 AromaticContact CE1-CD2 3.86Å; H566-H570 AromaticContact CE1-NE2 3.24Å; H566-H570 PolarHBondContact CE1-NE2 2.96Å; H566-H570 VanDerWaalsContact CE1-NE2 3.27Å; H566-H570 AromaticContact NE2-CD2 3.63Å; H566-H570 AromaticContact NE2-NE2 3.01Å; H566-H570 PolarHBondContact NE2-NE2 2.85Å; M567-H570 PolarHBondContact O-N 3.18Å; M567-H570 VanDerWaalsContact O-N 3.12Å; M567-H570 HydrophobicContact SD-CB 4.43Å; H570-G572 PolarHBondContact O-N 3.28Å; H570-G572 VanDerWaalsContact O-N 3.09Å
571	G	57.5	Low	60.2	Low	57.5 Å²	57.5	94.9 Å²	94.9	59%	0.593	58%	0.576	S	S	*	*	S	Bend	trans	4.1	86.1	172.2	0	0	0	0	0	112.6	M567 Y573	M567-G571 PolarHBondContact O-N 2.91Å; G571-Y573 PolarHBondContact O-N 3.47Å
572	G	46.5	Very low	57.7	Low	55 Å²	55	97.4 Å²	97.4	57%	0.567	58%	0.583	S	S	*	*	S	Bend	trans	-151.5	126.9	164.4	0	0	0	0	0	113.5	H570	H570-G572 PolarHBondContact O-N 3.28Å; H570-G572 VanDerWaalsContact O-N 3.09Å
573	Y	42.9	Very low	55	Low	227.5 Å²	227.5	103.6 Å²	103.6	89%	0.892	61%	0.612	S	S	*	*			trans	61.2	132.1	167	-59.3	-81.3	0	0	0	119	G571	G571-Y573 PolarHBondContact O-N 3.47Å
574	G	35.4	Very low	52.2	Low	55 Å²	55	109 Å²	109	57%	0.567	65%	0.646	S	S	*	*			trans	-84.1	-176	168.6	0	0	0	0	0	112.8	A576	G574-A576 PolarHBondContact O-N 2.99Å
575	P	36.4	Very low	49.9	Very low	140.5 Å²	140.5	110.5 Å²	110.5	91%	0.912	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	65.4	-169.1	32.1	-37.6	0	0	0	114.3
576	A	35.2	Very low	47.3	Very low	97.5 Å²	97.5	114.5 Å²	114.5	81%	0.806	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.2	73.4	167.2	0	0	0	0	0	111.3	G574	G574-A576 PolarHBondContact O-N 2.99Å
577	G	30.4	Very low	44.5	Very low	62 Å²	62	117.8 Å²	117.8	64%	0.639	70%	0.698	S	S	*	*			trans	175.8	68.6	-178.7	0	0	0	0	0	115.7	I579	G577-I579 PolarHBondContact O-N 3.48Å; G577-I579 VanDerWaalsContact O-N 3.12Å
578	L	31.5	Very low	42.1	Very low	155.5 Å²	155.5	118.5 Å²	118.5	81%	0.814	71%	0.705	S	S	*	*			trans	-95.1	105.4	168.1	-79.4	171.5	0	0	0	110.8
579	I	34.9	Very low	39.7	Very low	171.5 Å²	171.5	111.9 Å²	111.9	88%	0.879	69%	0.688	S	S	*	*			trans	147.7	111	176.9	-48.2	166.9	0	0	0	108.9	G577	G577-I579 PolarHBondContact O-N 3.48Å; G577-I579 VanDerWaalsContact O-N 3.12Å
580	G	29.9	Very low	37.3	Very low	63 Å²	63	109.8 Å²	109.8	65%	0.649	68%	0.681	S	S	*	*				170.3	73.5	-90.1	0	0	0	0	0	116.2
581	M	32.2	Very low	34.9	Very low	182.5 Å²	182.5	112.6 Å²	112.6	90%	0.899	70%	0.702	S	S	*	*			trans	-25.5	93.4	164.7	-65.2	-171.6	74.8	0	0	114.8
582	N	32.4	Very low	33.5	Very low	139 Å²	139	114.2 Å²	114.2	74%	0.743	70%	0.701	S	S	*	*			trans	-8.7	134.2	143.8	-61.9	-1.9	0	0	0	116
583	N	31.8	Very low	32.7	Very low	162.5 Å²	162.5	116.9 Å²	116.9	87%	0.869	71%	0.706	S	S	*	*			trans	146.2	124.5	149.6	-78.2	-18.3	0	0	0	114.1
584	T	32.7	Very low	32	Very low	124 Å²	124	111.4 Å²	111.4	76%	0.761	70%	0.697	S	S	*	*			trans	-106.2	171.5	-177.7	53.7	0	0	0	0	110.1
585	P	36	Very low	31.6	Very low	113.5 Å²	113.5	114.5 Å²	114.5	74%	0.737	70%	0.704	S	S	*	*			cis	-133.8	132.8	16.8	23.3	-3.6	0	0	0	113
586	T	32.3	Very low	31.3	Very low	122.5 Å²	122.5	113.5 Å²	113.5	75%	0.752	70%	0.696	S	S	*	*			trans	-115.1	142.6	172.5	21.7	0	0	0	0	112.8	N1191	T586-N1191 PolarHBondContact O-ND2 3.24Å
587	T	30.9	Very low	30.9	Very low	90.5 Å²	90.5	113 Å²	113	56%	0.555	69%	0.687	S	S	*	*			trans	-36.2	148.6	156.3	17	0	0	0	0	116.1	V693	T587-V693 HydrophobicContact CG2-CG2 3.58Å; T587-V693 WeakPolarHBondContact OG1-CG2 3.34Å
588	T	31.3	Very low	31.1	Very low	67.5 Å²	67.5	118.5 Å²	118.5	41%	0.414	70%	0.696	S	S	.	*			trans	92.9	152	150.1	14.5	0	0	0	0	117.7	T691 F692 V693 M1192 S1193	T588-T691 WeakPolarHBondContact CB-O 3.41Å; T588-T691 VanDerWaalsContact CG2-C 3.41Å; T588-T691 WeakPolarHBondContact CG2-OG1 3.42Å; T588-F692 VanDerWaalsContact CG2-N 3.33Å; T588-V693 HydrophobicContact CG2-CG2 3.84Å; T588-M1192 WeakPolarHBondContact O-CE 3.46Å; T588-S1193 VanDerWaalsContact CA-CB 3.42Å; T588-S1193 PolarHBondContact OG1-OG 3.23Å
589	T	33.5	Very low	31	Very low	73 Å²	73	115.1 Å²	115.1	45%	0.448	69%	0.685	S	S	.	*				-125.3	154.6	-60.7	-41.7	0	0	0	0	113.5	T690 T691 F692 M1192	T589-T690 VanDerWaalsContact O-CB 3.23Å; T589-T690 WeakPolarHBondContact O-CB 3.05Å; T589-T690 PolarHBondContact O-OG1 3.41Å; T589-T691 VanDerWaalsContact CA-O 3.28Å; T589-T691 WeakPolarHBondContact CA-O 3.25Å; T589-F692 HydrophobicContact CG2-CD2 3.87Å; T589-M1192 HydrophobicContact CG2-CB 4.2Å; T589-M1192 HydrophobicContact CG2-CG 3.72Å; T589-M1192 HydrophobicContact CG2-SD 3.46Å; T589-M1192 WeakPolarHBondContact CG2-SD 3.36Å; T589-M1192 PolarHBondContact OG1-O 3.39Å
590	T	28.9	Very low	30.7	Very low	83.5 Å²	83.5	113.3 Å²	113.3	51%	0.512	68%	0.677	S	S	.	*			trans	-27.5	144.2	170.6	9.3	0	0	0	0	117.3	P689 T690 T691	T590-P689 HydrophobicContact CG2-CB 4.2Å; T590-T690 PolarHBondContact OG1-O 2.77Å; T590-T691 PolarHBondContact N-O 3.36Å; T590-T691 PolarHBondContact OG1-O 3.49Å
591	T	30.9	Very low	31.1	Very low	120.5 Å²	120.5	119.2 Å²	119.2	74%	0.739	69%	0.688	S	S	*	*			trans	139.1	151.4	134.4	-16.3	0	0	0	0	113.2
592	T	28	Very low	31	Very low	91 Å²	91	115.4 Å²	115.4	56%	0.558	68%	0.675	S	S	*	*				-126	150.4	-102.9	37	0	0	0	0	110.3	T687 R688	T592-T687 VanDerWaalsContact CG2-CB 3.44Å; T592-T687 VanDerWaalsContact CG2-OG1 3.23Å; T592-T687 WeakPolarHBondContact CG2-OG1 3.04Å; T592-R688 WeakPolarHBondContact CG2-O 3.35Å
593	V	29.3	Very low	31	Very low	112.5 Å²	112.5	119.3 Å²	119.3	68%	0.682	68%	0.681	S	S	*	*			trans	116.7	149	143.7	-163.7	0	0	0	0	113.4	T687	V593-T687 HydrophobicContact CG1-CG2 4.21Å; V593-T687 HydrophobicContact CG2-CG2 4.12Å
594	T	28	Very low	30.7	Very low	112.5 Å²	112.5	116.9 Å²	116.9	69%	0.69	67%	0.672	S	S	*	*				-55.1	151.5	76.7	15.5	0	0	0	0	114.9
595	T	27.3	Very low	30.6	Very low	119 Å²	119	116.8 Å²	116.8	73%	0.73	67%	0.672	S	S	*	*				18.6	163.6	109.1	59.5	0	0	0	0	114.4
596	T	29.5	Very low	30.3	Very low	119.5 Å²	119.5	116.9 Å²	116.9	73%	0.733	67%	0.67	S	S	*	*				138.4	131.2	109.5	-38.9	0	0	0	0	114.8
597	S	27.8	Very low	30.2	Very low	88.5 Å²	88.5	117.9 Å²	117.9	62%	0.619	67%	0.669	S	S	*	*			trans	113.3	171.4	-133.4	65.1	0	0	0	0	115
598	Q	33.9	Very low	30.2	Very low	177.5 Å²	177.5	120.4 Å²	120.4	83%	0.829	68%	0.679	S	S	*	*			trans	69.3	134.1	164.9	-62.6	172.9	14.9	0	0	116.8
599	S	28.8	Very low	30.2	Very low	83.5 Å²	83.5	121.3 Å²	121.3	58%	0.584	69%	0.689	S	S	*	*			cis	151.7	158.5	-2.4	61.7	0	0	0	0	110.6
600	N	29.3	Very low	30.2	Very low	133.5 Å²	133.5	124.3 Å²	124.3	71%	0.714	70%	0.702	S	S	*	*			trans	64.9	117.3	158.9	-55	-16.7	0	0	0	118.5
601	Q	38.8	Very low	30.3	Very low	186.333 Å²	186.333	126.6 Å²	126.6	87%	0.871	71%	0.71	S	S	*	*				-150.2	110.1	104.7	-107.7	168.3	62.1	0	0	111.8
602	T	29.5	Very low	30.4	Very low	103 Å²	103	127.1 Å²	127.1	63%	0.632	71%	0.708	S	S	*	*			trans	-47.2	119.3	162.2	-43.7	0	0	0	0	114.3	T604	T602-T604 HydrophobicContact CG2-CG2 3.78Å
603	Y	32.4	Very low	30.6	Very low	221 Å²	221	128.6 Å²	128.6	87%	0.867	71%	0.712	S	S	*	*			trans	-120.4	119.6	150.2	-75.8	-77.7	0	0	0	108.5
604	T	26.5	Very low	30.6	Very low	112 Å²	112	129.4 Å²	129.4	69%	0.687	71%	0.713	S	S	*	*			trans	-77	119.7	149.2	57.3	0	0	0	0	112	T602	T602-T604 HydrophobicContact CG2-CG2 3.78Å
605	T	30.9	Very low	30.9	Very low	122 Å²	122	131 Å²	131	75%	0.748	71%	0.713	S	S	*	*				-168.3	125.9	120.6	22.4	0	0	0	0	108.1
606	T	28.8	Very low	31	Very low	115 Å²	115	132.5 Å²	132.5	71%	0.706	71%	0.711	S	S	*	*				79.5	126.6	64.6	53.6	0	0	0	0	112.4
607	I	29.9	Very low	31.1	Very low	143.667 Å²	143.667	131.7 Å²	131.7	74%	0.737	71%	0.711	S	S	*	*				155.2	140.9	92.1	-95.4	158.9	0	0	0	111.6
608	D	30.6	Very low	31.2	Very low	142.667 Å²	142.667	134.2 Å²	134.2	76%	0.763	72%	0.717	S	S	*	*			trans	-100.9	134.5	138.1	-82.5	-44.1	0	0	0	112.1
609	S	31.4	Very low	31.2	Very low	88 Å²	88	133.5 Å²	133.5	62%	0.615	71%	0.711	S	S	*	*				119.6	105.5	76.3	-62.4	0	0	0	0	111.1
610	D	33.9	Very low	31.3	Very low	136 Å²	136	135.6 Å²	135.6	73%	0.727	72%	0.723	S	S	*	*				141	120.1	116.1	-80.9	-23	0	0	0	116.2
611	I	31.5	Very low	31.3	Very low	131.333 Å²	131.333	136.5 Å²	136.5	67%	0.674	73%	0.726	S	S	*	*				69.2	116.1	116.9	-62.5	170.9	0	0	0	116.5
612	N	32.9	Very low	30.9	Very low	131 Å²	131	134.7 Å²	134.7	70%	0.701	72%	0.717	S	S	*	*				174.7	147.6	106.3	-105.8	-17.2	0	0	0	115.2
613	D	30.7	Very low	30.7	Very low	122.333 Å²	122.333	138.2 Å²	138.2	65%	0.654	72%	0.724	S	S	*	*				38.4	138.6	127.9	-64.9	-42.5	0	0	0	116.4
614	N	31.1	Very low	30.5	Very low	128.667 Å²	128.667	133.8 Å²	133.8	69%	0.688	72%	0.715	S	S	*	*				114.9	133.7	117.6	-74.6	-47	0	0	0	117.9
615	Q	32.3	Very low	30.6	Very low	147 Å²	147	134.8 Å²	134.8	69%	0.687	72%	0.716	S	S	*	*				98.7	119	114.4	-86.7	-173.7	-61.9	0	0	118.6
616	E	29.6	Very low	30.4	Very low	150.667 Å²	150.667	138 Å²	138	70%	0.704	72%	0.72	S	S	*	*				53.4	134.4	111.5	-93.1	171	167.8	0	0	119.9
617	S	32.1	Very low	30.3	Very low	102.667 Å²	102.667	141 Å²	141	72%	0.718	73%	0.726	S	S	*	*			trans	172	140.4	139.1	38.2	0	0	0	0	113.7	K619	S617-K619 PolarHBondContact O-N 3.19Å
618	N	30.5	Very low	30.2	Very low	140.667 Å²	140.667	138.1 Å²	138.1	75%	0.752	72%	0.723	S	S	*	*			trans	-11	97.5	162.3	-68.8	-54.1	0	0	0	117.2
619	K	32.5	Very low	30	Very low	162.667 Å²	162.667	136.1 Å²	136.1	71%	0.707	72%	0.72	S	S	*	*			trans	78.8	127.8	137.4	-74.6	171.3	-179.3	-179.1	0	116.6	S617 I621 Q1173	S617-K619 PolarHBondContact O-N 3.19Å; K619-I621 HydrophobicContact CB-CB 4.37Å; K619-I621 HydrophobicContact CB-CD1 3.83Å; K619-I621 HydrophobicContact CB-CG1 3.84Å; K619-I621 HydrophobicContact CD-CD1 3.65Å; K619-I621 HydrophobicContact CG-CD1 3.48Å; K619-I621 VanDerWaalsContact CG-CD1 3.48Å; K619-I621 HydrophobicContact CG-CG1 3.89Å; K619-I621 PolarHBondContact O-N 2.88Å; K619-Q1173 VanDerWaalsContact NZ-OE1 3.16Å
620	P	30.9	Very low	29.9	Very low	128 Å²	128	136.9 Å²	136.9	83%	0.831	73%	0.726	S	S	*	*			trans	-94.7	109.1	-167.2	33.4	-28.4	0	0	0	110.8	H622	P620-H622 PolarHBondContact O-N 2.85Å; P620-H622 VanDerWaalsContact O-N 3.17Å
621	I	30.1	Very low	29.7	Very low	152 Å²	152	137.5 Å²	137.5	78%	0.779	73%	0.729	S	S	*	*			trans	-92.1	115.7	-170.2	-65.5	-179.8	0	0	0	111.6	K619	K619-I621 HydrophobicContact CB-CB 4.37Å; K619-I621 HydrophobicContact CB-CD1 3.83Å; K619-I621 HydrophobicContact CB-CG1 3.84Å; K619-I621 HydrophobicContact CD-CD1 3.65Å; K619-I621 HydrophobicContact CG-CD1 3.48Å; K619-I621 VanDerWaalsContact CG-CD1 3.48Å; K619-I621 HydrophobicContact CG-CG1 3.89Å; K619-I621 PolarHBondContact O-N 2.88Å
622	H	31.2	Very low	29.5	Very low	147.333 Å²	147.333	138.5 Å²	138.5	68%	0.682	73%	0.73	S	S	*	*			trans	-82.4	129.3	163.3	173	-58.3	0	0	0	114.8	P620 N624	P620-H622 PolarHBondContact O-N 2.85Å; P620-H622 VanDerWaalsContact O-N 3.17Å; H622-N624 PolarHBondContact CD2-ND2 2.78Å; H622-N624 PolarHBondContact CD2-OD1 3.36Å; H622-N624 VanDerWaalsContact NE2-CG 3.29Å; H622-N624 PolarHBondContact NE2-ND2 3.28Å
623	F	25.7	Very low	29.3	Very low	178.333 Å²	178.333	137.3 Å²	137.3	78%	0.782	73%	0.728	S	S	*	*			trans	-156.7	128.6	166.7	-77.2	-91.5	0	0	0	110.6	L625	F623-L625 HydrophobicContact CD1-CD2 4.32Å; F623-L625 HydrophobicContact CE1-CD2 4.47Å
624	N	27.5	Very low	29.4	Very low	127.333 Å²	127.333	139.6 Å²	139.6	68%	0.681	73%	0.732	S	S	*	*				-104	151.3	71.1	-84.3	-31.9	0	0	0	111.6	H622	H622-N624 PolarHBondContact CD2-ND2 2.78Å; H622-N624 PolarHBondContact CD2-OD1 3.36Å; H622-N624 VanDerWaalsContact NE2-CG 3.29Å; H622-N624 PolarHBondContact NE2-ND2 3.28Å
625	L	28.1	Very low	29.5	Very low	134 Å²	134	141.9 Å²	141.9	70%	0.702	74%	0.736	S	S	*	*				101.9	123.5	93	-139	61.8	0	0	0	113.3	F623	F623-L625 HydrophobicContact CD1-CD2 4.32Å; F623-L625 HydrophobicContact CE1-CD2 4.47Å
626	F	26.9	Very low	29.4	Very low	189 Å²	189	140.8 Å²	140.8	83%	0.829	74%	0.735	S	S	*	*			trans	75.1	89	137.3	-81.4	-78.9	0	0	0	114.2
627	H	27.2	Very low	29.5	Very low	178.333 Å²	178.333	139.5 Å²	139.5	83%	0.826	73%	0.733	S	S	*	*			trans	-167.9	134.2	133.3	-105.3	-96.2	0	0	0	107.7
628	A	26.5	Very low	29.3	Very low	82.6667 Å²	82.6667	141.4 Å²	141.4	68%	0.683	74%	0.735	S	S	*	*			cis	-173.6	110.7	33	0	0	0	0	0	110.7
629	S	26.4	Very low	29.4	Very low	100 Å²	100	140.7 Å²	140.7	70%	0.699	74%	0.735	S	S	*	*			trans	-80.3	147.3	144.3	-30	0	0	0	0	113.2
630	S	29	Very low	29.3	Very low	105.667 Å²	105.667	139.9 Å²	139.9	74%	0.739	74%	0.738	S	S	*	*				72.3	93.6	122.4	-170.4	0	0	0	0	112.5
631	D	29.8	Very low	29.3	Very low	147 Å²	147	139.8 Å²	139.8	79%	0.786	73%	0.73	S	S	*	*				-158.2	140	118.7	-109.7	-41.5	0	0	0	112.2
632	H	28.9	Very low	29.5	Very low	152.333 Å²	152.333	137.1 Å²	137.1	71%	0.705	73%	0.725	S	S	*	*			trans	-99.4	153.1	-170.5	-115.7	-75.5	0	0	0	111.1
633	V	28.4	Very low	29.6	Very low	106.333 Å²	106.333	138.6 Å²	138.6	64%	0.644	73%	0.729	S	S	*	*			trans	83.8	127.1	133.3	164.4	0	0	0	0	116.4
634	K	32.6	Very low	30	Very low	170.333 Å²	170.333	139.3 Å²	139.3	74%	0.741	73%	0.732	S	S	*	*			trans	90.3	124.2	144	-80.9	147	-160.6	160.1	0	116.4
635	K	33.2	Very low	30.2	Very low	178 Å²	178	143 Å²	143	77%	0.774	74%	0.742	S	S	*	*				128.1	136.8	85.1	-90.6	178.3	175.9	-177.7	0	114.5
636	N	30.8	Very low	30.4	Very low	124.333 Å²	124.333	140 Å²	140	67%	0.665	74%	0.744	S	S	*	*				96.4	143	83.2	-94.9	35.3	0	0	0	112.8
637	N	31.5	Very low	30.4	Very low	123.333 Å²	123.333	136.5 Å²	136.5	66%	0.66	74%	0.742	S	S	*	*			trans	95.2	129.1	153	-69.1	0.4	0	0	0	111.3
638	N	28.6	Very low	30.5	Very low	142.333 Å²	142.333	132.4 Å²	132.4	76%	0.761	73%	0.733	S	S	*	*				99	151.2	56.7	-71.6	-8.8	0	0	0	111.8
639	V	31.7	Very low	30.7	Very low	124.333 Å²	124.333	134.6 Å²	134.6	75%	0.754	74%	0.738	S	S	*	*			trans	150.2	129.3	133.8	141.6	0	0	0	0	107.9
640	L	31.3	Very low	30.9	Very low	147 Å²	147	134.7 Å²	134.7	77%	0.77	74%	0.739	S	S	*	*				99.2	157.7	62.3	-129.6	76.2	0	0	0	112.2
641	D	29.6	Very low	31.1	Very low	126 Å²	126	135 Å²	135	67%	0.674	74%	0.737	S	S	*	*			trans	-52.6	150.4	-174.2	-90.8	-59.5	0	0	0	115.7
642	S	34.8	Very low	31	Very low	94.3333 Å²	94.3333	134.3 Å²	134.3	66%	0.66	73%	0.733	S	S	*	*				156.3	138.3	102.9	42	0	0	0	0	117.7
643	K	33.1	Very low	31.2	Very low	179.333 Å²	179.333	134.3 Å²	134.3	78%	0.78	74%	0.736	S	S	*	*			trans	53	116.3	148.8	-66.9	155.5	-172.9	155.4	0	117.5
644	K	34.2	Very low	31.2	Very low	193 Å²	193	135.4 Å²	135.4	84%	0.839	74%	0.738	S	S	*	*				112.2	131.9	119.8	-90.8	177.2	178.5	178.3	0	118.6
645	K	32.9	Very low	31.3	Very low	204.333 Å²	204.333	132.2 Å²	132.2	89%	0.888	74%	0.738	S	S	*	*			trans	46	134.3	149.2	-62.9	-176.1	173.4	-170.4	0	116.3
646	G	31.1	Very low	31.1	Very low	73 Å²	73	131.6 Å²	131.6	75%	0.753	74%	0.742	S	S	*	*			trans	136.5	135.7	146	0	0	0	0	0	115.4
647	C	27.8	Very low	31.2	Very low	115 Å²	115	134.1 Å²	134.1	78%	0.777	75%	0.747	S	S	*	*			trans	-156.5	162.2	171.4	-129.1	0	0	0	0	113
648	S	28.8	Very low	31.2	Very low	91.6667 Å²	91.6667	133.2 Å²	133.2	64%	0.641	75%	0.75	S	S	*	*			trans	61.5	127.4	158	-45.4	0	0	0	0	116
649	T	31.4	Very low	31.2	Very low	129 Å²	129	136.5 Å²	136.5	79%	0.791	76%	0.758	S	S	*	*			trans	70.5	136.9	131	63.7	0	0	0	0	117.9
650	S	29.5	Very low	31.1	Very low	102.667 Å²	102.667	135.8 Å²	135.8	72%	0.718	76%	0.759	S	S	*	*				110.8	136.3	50.9	168	0	0	0	0	114.1
651	T	33	Very low	31.1	Very low	112.333 Å²	112.333	136.4 Å²	136.4	69%	0.689	76%	0.762	S	S	*	*			trans	53.6	150.4	162.5	57.7	0	0	0	0	117.5
652	D	29	Very low	31.1	Very low	132.333 Å²	132.333	139.2 Å²	139.2	71%	0.708	77%	0.768	S	S	*	*			trans	101.5	131	131.9	-73.8	-27.5	0	0	0	118.1
653	I	32	Very low	30.8	Very low	150.667 Å²	150.667	139.2 Å²	139.2	77%	0.773	77%	0.768	S	S	*	*				97.2	126.9	125.2	-71.6	163.9	0	0	0	115.6
654	D	28.9	Very low	30.5	Very low	129.667 Å²	129.667	139.5 Å²	139.5	69%	0.693	77%	0.772	S	S	*	*			trans	24.3	141.8	149.1	-91.2	-59	0	0	0	118.8	K657	D654-K657 IonicContact OD1-NZ 3.23Å; D654-K657 PolarHBondContact OD1-NZ 3.31Å; D654-K657 IonicContact OD2-NZ 3.44Å; D654-K657 PolarHBondContact OD2-NZ 3.06Å
655	S	34.3	Very low	30.2	Very low	104 Å²	104	134.8 Å²	134.8	73%	0.727	76%	0.764	S	S	*	*			trans	153	95.4	131.8	-77.8	0	0	0	0	115.9	K657	S655-K657 PolarHBondContact O-N 3.36Å
656	L	29.2	Very low	30	Very low	165.333 Å²	165.333	134.5 Å²	134.5	87%	0.866	76%	0.763	S	S	*	*			trans	-10.1	97.7	154.1	-67.6	177.3	0	0	0	115.5
657	K	33.4	Very low	29.9	Very low	176.667 Å²	176.667	135.6 Å²	135.6	77%	0.768	76%	0.764	S	S	*	*			trans	-160.6	92.5	155.8	-69.8	178.7	-178	149.3	0	112.8	D654 S655	D654-K657 IonicContact OD1-NZ 3.23Å; D654-K657 PolarHBondContact OD1-NZ 3.31Å; D654-K657 IonicContact OD2-NZ 3.44Å; D654-K657 PolarHBondContact OD2-NZ 3.06Å; S655-K657 PolarHBondContact O-N 3.36Å
658	S	30.6	Very low	29.9	Very low	104 Å²	104	139 Å²	139	73%	0.727	77%	0.766	S	S	*	*				55.8	110.8	115.4	66.5	0	0	0	0	114.1
659	F	29.2	Very low	29.9	Very low	212 Å²	212	141.1 Å²	141.1	93%	0.93	78%	0.775	S	S	*	*			trans	-67.7	123.8	138.9	-94.7	-92	0	0	0	111.5
660	S	29.8	Very low	29.7	Very low	109.333 Å²	109.333	139.4 Å²	139.4	77%	0.765	78%	0.775	S	S	*	*			trans	-156.6	127.5	150.1	-145.1	0	0	0	0	112.8
661	L	31.2	Very low	29.8	Very low	159 Å²	159	139.9 Å²	139.9	83%	0.832	78%	0.778	S	S	*	*			trans	-86.7	137.1	156.5	-76.6	165.5	0	0	0	109.9
662	K	29.1	Very low	29.7	Very low	185.333 Å²	185.333	143.3 Å²	143.3	81%	0.806	78%	0.783	S	S	*	*			trans	67.9	124.1	131.3	-87.9	166	178.9	176.3	0	114.8
663	S	27.9	Very low	29.7	Very low	95.3333 Å²	95.3333	143.9 Å²	143.9	67%	0.667	79%	0.786	S	S	*	*				75.4	117.2	71.6	65.5	0	0	0	0	116.4
664	H	27.5	Very low	29.8	Very low	184 Å²	184	141.7 Å²	141.7	85%	0.852	78%	0.784	S	S	*	*			trans	-134.2	152.5	135.7	-100.5	-63.5	0	0	0	111.2
665	S	28.4	Very low	29.8	Very low	96 Å²	96	144.8 Å²	144.8	67%	0.671	79%	0.787	S	S	*	*			trans	-173.3	156.7	166	64.5	0	0	0	0	115.1	A667	S665-A667 PolarHBondContact O-N 2.84Å
666	K	28.6	Very low	29.7	Very low	198 Å²	198	146.6 Å²	146.6	86%	0.861	79%	0.789	S	S	*	*			trans	-129.6	126.4	146.6	-77.2	172.8	-178.5	179	0	114
667	A	28.5	Very low	29.9	Very low	95 Å²	95	143.5 Å²	143.5	79%	0.785	78%	0.781	S	S	*	*			trans	-126.1	124.5	156.2	0	0	0	0	0	108.7	S665	S665-A667 PolarHBondContact O-N 2.84Å
668	F	26.7	Very low	29.8	Very low	186.667 Å²	186.667	140.9 Å²	140.9	82%	0.819	78%	0.78	S	S	*	*			trans	-149.8	110.7	135.2	-127.8	-73.4	0	0	0	111.2	A670	F668-A670 PolarHBondContact O-N 2.96Å
669	T	29.4	Very low	29.8	Very low	136 Å²	136	143.1 Å²	143.1	83%	0.834	78%	0.782	S	S	*	*			trans	-123	114.7	173.9	46	0	0	0	0	110.1	S671	T669-S671 PolarHBondContact O-N 2.74Å
670	A	27.5	Very low	29.8	Very low	94 Å²	94	137.5 Å²	137.5	78%	0.777	77%	0.77	S	S	*	*			trans	-84.4	145.3	146	0	0	0	0	0	113.4	F668 K672	F668-A670 PolarHBondContact O-N 2.96Å; A670-K672 PolarHBondContact O-N 3.16Å
671	S	30.7	Very low	29.8	Very low	112 Å²	112	136.9 Å²	136.9	78%	0.783	77%	0.765	S	S	*	*			trans	168.4	117.8	151.5	174.1	0	0	0	0	114.4	T669 N673	T669-S671 PolarHBondContact O-N 2.74Å; S671-N673 PolarHBondContact O-N 2.84Å
672	K	31.4	Very low	29.8	Very low	183.667 Å²	183.667	136.2 Å²	136.2	80%	0.799	76%	0.761	S	S	*	*			trans	-65.4	127.2	151.2	-78.2	-179	175.3	-179.9	0	114.5	A670	A670-K672 PolarHBondContact O-N 3.16Å
673	N	29.9	Very low	29.9	Very low	146 Å²	146	134.3 Å²	134.3	78%	0.781	77%	0.765	S	S	*	*			trans	92.2	125.5	140.9	-63.5	3.3	0	0	0	117.4	S671	S671-N673 PolarHBondContact O-N 2.84Å
674	S	33.1	Very low	30.1	Very low	103 Å²	103	133 Å²	133	72%	0.72	77%	0.766	S	S	*	*				172.7	127.3	110.7	-154.2	0	0	0	0	113.5
675	Y	29.5	Very low	30.4	Very low	195.667 Å²	195.667	128.6 Å²	128.6	77%	0.767	76%	0.762	S	S	*	*				30.3	131.1	121.2	-62.7	-73.8	0	0	0	117.4
676	D	31.4	Very low	30.5	Very low	141.667 Å²	141.667	131.2 Å²	131.2	76%	0.758	77%	0.768	S	S	*	*			cis	-162.8	167.2	46.4	-85.4	-34.8	0	0	0	116.7
677	S	34.1	Very low	30.8	Very low	99.6667 Å²	99.6667	127.6 Å²	127.6	70%	0.697	76%	0.763	S	S	*	*				159.7	139.7	80.2	154.7	0	0	0	0	116
678	V	32.4	Very low	31	Very low	122 Å²	122	133.4 Å²	133.4	74%	0.739	77%	0.765	S	S	*	*				89.4	134.2	126.6	151.7	0	0	0	0	117.1
679	L	29.1	Very low	31.5	Very low	150.667 Å²	150.667	129.1 Å²	129.1	79%	0.789	76%	0.755	S	S	*	*			trans	100.1	147	148.4	-123.4	71.9	0	0	0	117
680	S	29.8	Very low	31.7	Very low	95.3333 Å²	95.3333	126.9 Å²	126.9	67%	0.667	74%	0.742	S	S	*	*				98.7	153	120.7	51.8	0	0	0	0	117.3
681	S	29.5	Very low	32	Very low	95.6667 Å²	95.6667	127.5 Å²	127.5	67%	0.669	74%	0.736	S	S	*	*			cis	165.1	155	23.4	-103.3	0	0	0	0	115.9
682	I	30.6	Very low	32	Very low	145 Å²	145	130.5 Å²	130.5	74%	0.744	74%	0.735	S	S	*	*			trans	58.2	106.1	136.1	-62.9	163.9	0	0	0	119.4
683	V	31.6	Very low	32	Very low	145.333 Å²	145.333	126.1 Å²	126.1	88%	0.881	72%	0.724	S	S	*	*				67.8	141.5	117.9	176.6	0	0	0	0	117.9
684	G	32.8	Very low	32.1	Very low	66.6667 Å²	66.6667	126.7 Å²	126.7	69%	0.687	72%	0.723	S	S	*	*			cis	148.7	151	-14.6	0	0	0	0	0	113.8
685	A	34.3	Very low	32	Very low	93 Å²	93	126.9 Å²	126.9	77%	0.769	72%	0.72	S	S	*	*			trans	72.1	130.7	134.3	0	0	0	0	0	119.6
686	N	30.2	Very low	32	Very low	150.333 Å²	150.333	123.7 Å²	123.7	80%	0.804	72%	0.721	S	S	*	*			trans	60.1	147.7	166.4	-48.5	-47.5	0	0	0	116.3
687	T	35	Very low	31.9	Very low	123 Å²	123	121.5 Å²	121.5	76%	0.755	72%	0.723	S	S	*	*				-169.8	-169.9	64.2	21.4	0	0	0	0	113.9	T592 V593	T592-T687 VanDerWaalsContact CG2-CB 3.44Å; T592-T687 VanDerWaalsContact CG2-OG1 3.23Å; T592-T687 WeakPolarHBondContact CG2-OG1 3.04Å; V593-T687 HydrophobicContact CG1-CG2 4.21Å; V593-T687 HydrophobicContact CG2-CG2 4.12Å
688	R	32.8	Very low	31.7	Very low	217 Å²	217	121 Å²	121	82%	0.819	73%	0.725	S	S	*	*			trans	-84.7	170.2	-169.7	-117.2	-173.2	158.9	-164.1	-5.2	114.8	T592	T592-R688 WeakPolarHBondContact CG2-O 3.35Å
689	P	36.6	Very low	31.5	Very low	95.3333 Å²	95.3333	120.4 Å²	120.4	62%	0.619	73%	0.726	S	S	*	*			cis	-139.4	-177.5	26.8	40.1	-20.2	0	0	0	118.4	T590	T590-P689 HydrophobicContact CG2-CB 4.2Å
690	T	34.3	Very low	31.6	Very low	90.3333 Å²	90.3333	118.3 Å²	118.3	55%	0.554	72%	0.724	S	S	*	*			trans	90.1	139.2	146.9	20.1	0	0	0	0	117.5	T589 T590	T589-T690 VanDerWaalsContact O-CB 3.23Å; T589-T690 WeakPolarHBondContact O-CB 3.05Å; T589-T690 PolarHBondContact O-OG1 3.41Å; T590-T690 PolarHBondContact OG1-O 2.77Å
691	T	32.8	Very low	31.6	Very low	106 Å²	106	121.1 Å²	121.1	65%	0.65	73%	0.731	S	S	*	*				90.4	170.2	127.7	56.2	0	0	0	0	116.4	T588 T589 T590	T588-T691 WeakPolarHBondContact CB-O 3.41Å; T588-T691 VanDerWaalsContact CG2-C 3.41Å; T588-T691 WeakPolarHBondContact CG2-OG1 3.42Å; T589-T691 VanDerWaalsContact CA-O 3.28Å; T589-T691 WeakPolarHBondContact CA-O 3.25Å; T590-T691 PolarHBondContact N-O 3.36Å; T590-T691 PolarHBondContact OG1-O 3.49Å
692	F	30.7	Very low	31.9	Very low	174.333 Å²	174.333	121.9 Å²	121.9	77%	0.765	74%	0.735	S	S	*	*				-141.2	157.1	128.5	-135	-98.7	0	0	0	111.1	T588 T589	T588-F692 VanDerWaalsContact CG2-N 3.33Å; T589-F692 HydrophobicContact CG2-CD2 3.87Å
693	V	31.8	Very low	31.9	Very low	93 Å²	93	119.6 Å²	119.6	56%	0.564	73%	0.731	S	S	*	*			trans	-163.3	145.1	154.9	169.2	0	0	0	0	112.5	T587 T588	T587-V693 HydrophobicContact CG2-CG2 3.58Å; T587-V693 WeakPolarHBondContact OG1-CG2 3.34Å; T588-V693 HydrophobicContact CG2-CG2 3.84Å
694	M	31.3	Very low	31.7	Very low	157 Å²	157	119.9 Å²	119.9	77%	0.773	73%	0.728	S	S	*	*				-156.6	138.6	98	-91.1	-143.6	-151.1	0	0	108.2
695	T	30.9	Very low	31.5	Very low	107.333 Å²	107.333	121.4 Å²	121.4	66%	0.658	73%	0.728	S	S	*	*				62.7	136.4	77.3	-23.6	0	0	0	0	113.6
696	T	30	Very low	31.4	Very low	128 Å²	128	122.7 Å²	122.7	79%	0.785	73%	0.726	S	S	*	*			cis	154.4	161.6	13	35.3	0	0	0	0	111.2
697	A	29.2	Very low	31.5	Very low	96.3333 Å²	96.3333	122.2 Å²	122.2	80%	0.796	72%	0.724	S	S	*	*			trans	97	157.7	167.2	0	0	0	0	0	115.5
698	A	29.2	Very low	31.3	Very low	89.3333 Å²	89.3333	123.9 Å²	123.9	74%	0.738	73%	0.728	S	S	*	*			cis	-162.5	153.6	5.6	0	0	0	0	0	115.2
699	S	28.2	Very low	31.3	Very low	109.667 Å²	109.667	118.1 Å²	118.1	77%	0.767	72%	0.72	S	S	*	*			trans	72.4	146.3	135.5	-179.5	0	0	0	0	119.4
700	S	31.9	Very low	31.1	Very low	105.667 Å²	105.667	119 Å²	119	74%	0.739	72%	0.724	S	S	*	*			trans	102.9	121.9	143.2	24.8	0	0	0	0	117.7
701	N	30.8	Very low	31.1	Very low	154.333 Å²	154.333	120.6 Å²	120.6	83%	0.825	73%	0.734	S	S	*	*			trans	-62.9	162.5	151.5	-82.8	-14.5	0	0	0	110.9
702	P	35.3	Very low	31.1	Very low	113.667 Å²	113.667	126.5 Å²	126.5	74%	0.738	74%	0.744	S	S	*	*			cis	-137.5	170.7	48.3	27.8	-6.4	0	0	0	114.8
703	S	29.3	Very low	31.3	Very low	95.6667 Å²	95.6667	121.9 Å²	121.9	67%	0.669	74%	0.738	S	S	*	*				25.3	145.6	124.3	-9.4	0	0	0	0	120.4
704	N	28.4	Very low	31.4	Very low	151.333 Å²	151.333	123.4 Å²	123.4	81%	0.809	75%	0.748	S	S	*	*			trans	96.5	136.1	143.8	-71	-4.7	0	0	0	120.6
705	S	28.7	Very low	31.4	Very low	99.3333 Å²	99.3333	122.8 Å²	122.8	70%	0.695	75%	0.748	S	S	*	*				100.9	155.1	120.2	65	0	0	0	0	117.4
706	T	32	Very low	31.4	Very low	118.667 Å²	118.667	122.8 Å²	122.8	73%	0.728	75%	0.748	S	S	*	*				70.4	137.7	116.2	45.9	0	0	0	0	117.8
707	D	32.6	Very low	31.3	Very low	141 Å²	141	122.2 Å²	122.2	75%	0.754	74%	0.744	S	S	*	*				-122.5	149.2	94.8	-80.4	-55.9	0	0	0	113
708	L	30.2	Very low	31.2	Very low	159.333 Å²	159.333	124.1 Å²	124.1	83%	0.834	74%	0.74	S	S	*	*				172.9	114.9	95.6	-166.5	72.9	0	0	0	112.6	T710	L708-T710 PolarHBondContact O-N 3.09Å
709	S	32.5	Very low	31.2	Very low	94 Å²	94	125.1 Å²	125.1	66%	0.657	74%	0.737	S	S	*	*			trans	46.3	135.2	160.5	56.1	0	0	0	0	118.3
710	T	33.9	Very low	31.2	Very low	115.333 Å²	115.333	123.8 Å²	123.8	71%	0.708	73%	0.728	S	S	*	*				112.3	119.9	100.8	-40.9	0	0	0	0	117.7	L708	L708-T710 PolarHBondContact O-N 3.09Å
711	T	33.8	Very low	31.1	Very low	122.333 Å²	122.333	124.7 Å²	124.7	75%	0.751	72%	0.724	S	S	*	*				90.3	159	126.5	36.8	0	0	0	0	117.6
712	R	32.3	Very low	31.1	Very low	231 Å²	231	123.1 Å²	123.1	87%	0.872	72%	0.715	S	S	*	*			cis	169.8	130.6	20.6	-132.3	178.2	179.3	162	-0.9	112.2
713	A	35.1	Very low	30.8	Very low	78.3333 Å²	78.3333	121.6 Å²	121.6	65%	0.647	71%	0.708	S	S	*	*				105	142.6	76.5	0	0	0	0	0	116.8
714	T	34.7	Very low	30.8	Very low	124.333 Å²	124.333	123.5 Å²	123.5	76%	0.763	71%	0.709	S	S	*	*				174.3	133	114.9	20.7	0	0	0	0	115.3
715	N	30.3	Very low	30.9	Very low	143.333 Å²	143.333	122.3 Å²	122.3	77%	0.766	71%	0.707	S	S	*	*			trans	105.3	152.3	146.8	-85.5	-3.5	0	0	0	117.5
716	T	31.2	Very low	30.9	Very low	108.667 Å²	108.667	124.1 Å²	124.1	67%	0.667	71%	0.709	S	S	*	*			cis	171.2	122.3	4.1	26.9	0	0	0	0	115.4
717	T	27.4	Very low	30.8	Very low	115.333 Å²	115.333	123.9 Å²	123.9	71%	0.708	71%	0.708	S	S	*	*				51.6	141.3	126.8	31.2	0	0	0	0	122.8
718	I	28.4	Very low	30.7	Very low	136.333 Å²	136.333	124 Å²	124	70%	0.699	71%	0.708	S	S	*	*				114.7	119.4	129.1	-70.1	168	0	0	0	113.6	S444	S444-I718 PolarHBondContact OG-O 3.46Å
719	T	28.1	Very low	30.7	Very low	110 Å²	110	121.7 Å²	121.7	68%	0.675	71%	0.706	S	S	*	*				70.7	138.4	90.1	59.7	0	0	0	0	119.3	L443	L443-T719 WeakPolarHBondContact O-CA 3.21Å; L443-T719 PolarHBondContact O-N 3.32Å
720	S	29.2	Very low	30.8	Very low	82.3333 Å²	82.3333	122.7 Å²	122.7	58%	0.576	71%	0.71	S	S	*	*				103.1	134.7	108.3	64.6	0	0	0	0	118.7	S442	S442-S720 WeakPolarHBondContact OG-CA 3.32Å
721	N	28.7	Very low	30.5	Very low	123.667 Å²	123.667	122.2 Å²	122.2	66%	0.661	71%	0.711	S	S	*	*				96.7	129.3	85.6	-80	30.3	0	0	0	118.4	P440 S442	P440-N721 PolarHBondContact O-ND2 3.42Å; S442-N721 WeakPolarHBondContact OG-CA 3.26Å; S442-N721 PolarHBondContact OG-N 3.22Å; S442-N721 VanDerWaalsContact OG-N 3.09Å
722	N	30.6	Very low	30.3	Very low	120.333 Å²	120.333	120.8 Å²	120.8	64%	0.643	71%	0.706	S	S	*	*			trans	73.5	137.7	146.9	-62.2	-1.4	0	0	0	119.2	N441	N441-N722 PolarHBondContact ND2-OD1 3.42Å
723	S	29.6	Very low	30.3	Very low	82.6667 Å²	82.6667	115.5 Å²	115.5	58%	0.578	70%	0.699	S	S	*	*			cis	161.7	151.6	39.9	46.3	0	0	0	0	116.1
724	I	28.1	Very low	29.9	Very low	135.667 Å²	135.667	118.2 Å²	118.2	70%	0.696	70%	0.702	S	S	*	*			trans	63.4	121.1	145.1	-61.2	159.9	0	0	0	118.8	N401	N401-I724 HydrophobicContact CB-CD1 3.91Å
725	T	32.3	Very low	29.7	Very low	126.667 Å²	126.667	120.2 Å²	120.2	78%	0.777	70%	0.7	S	S	*	*				161.2	154.1	116	48.5	0	0	0	0	112.3
726	N	28.8	Very low	29.7	Very low	136.667 Å²	136.667	119.3 Å²	119.3	73%	0.731	70%	0.696	S	S	*	*			cis	172.1	134.7	1	-159.3	31.6	0	0	0	112.1
727	V	29.4	Very low	29.7	Very low	115.333 Å²	115.333	121.4 Å²	121.4	70%	0.699	70%	0.702	S	S	*	*			trans	-53.6	147	166	-101.8	0	0	0	0	117.8
728	N	30.8	Very low	29.9	Very low	143 Å²	143	121.2 Å²	121.2	77%	0.765	70%	0.701	S	S	*	*			trans	73.7	130	155.9	-56.1	-36.1	0	0	0	115.3
729	S	29.2	Very low	30	Very low	111.333 Å²	111.333	121.6 Å²	121.6	78%	0.779	70%	0.704	S	S	*	*				153.2	177.8	68.7	-58.8	0	0	0	0	111.3
730	P	35.9	Very low	30.3	Very low	115 Å²	115	120.6 Å²	120.6	75%	0.747	71%	0.707	S	S	*	*				-120.7	-175.4	-97.5	39.7	-27	0	0	0	115.1
731	S	27.5	Very low	30.4	Very low	104 Å²	104	122.3 Å²	122.3	73%	0.727	72%	0.719	S	S	*	*			trans	91.1	152.2	148.3	115.2	0	0	0	0	117.2
732	S	29.3	Very low	30.9	Very low	93 Å²	93	121 Å²	121	65%	0.65	72%	0.717	S	S	*	*				86.4	161.4	124.5	65	0	0	0	0	114.8
733	T	30.8	Very low	30.9	Very low	118.667 Å²	118.667	121.8 Å²	121.8	73%	0.728	72%	0.722	S	S	*	*			cis	158.6	149.7	-8.2	35.8	0	0	0	0	112.9
734	L	27.2	Very low	30.9	Very low	136 Å²	136	123.1 Å²	123.1	71%	0.712	73%	0.726	S	S	*	*				94.2	167.3	127.4	-85.4	166.7	0	0	0	116.7
735	F	31.1	Very low	31	Very low	165.333 Å²	165.333	123.6 Å²	123.6	73%	0.725	73%	0.729	S	S	*	*			trans	99	128	146.6	-84.1	-64.4	0	0	0	117.7
736	D	30.9	Very low	30.8	Very low	126.333 Å²	126.333	123.2 Å²	123.2	68%	0.676	72%	0.722	S	S	*	*				105.5	152.8	107.5	-94.8	3	0	0	0	121.1
737	L	31.2	Very low	30.9	Very low	152 Å²	152	123.6 Å²	123.6	80%	0.796	72%	0.724	S	S	*	*			trans	96.9	119.2	148.5	-95.5	87.3	0	0	0	117.5
738	V	31.4	Very low	30.8	Very low	111.333 Å²	111.333	126.3 Å²	126.3	68%	0.675	73%	0.726	S	S	*	*				98.8	132.7	61.8	146.6	0	0	0	0	115.6
739	N	30.1	Very low	30.7	Very low	145 Å²	145	125.8 Å²	125.8	78%	0.775	72%	0.722	S	S	*	*				87.2	127.5	108.2	-75.4	-29.9	0	0	0	119.6
740	A	34.2	Very low	30.6	Very low	88.3333 Å²	88.3333	127 Å²	127	73%	0.73	72%	0.715	S	S	*	*				95.9	104.6	118	0	0	0	0	0	116.7
741	S	31.9	Very low	30.1	Very low	118.333 Å²	118.333	125.8 Å²	125.8	83%	0.828	71%	0.71	S	S	*	*				60.7	152.3	65.9	-125.4	0	0	0	0	117.4
742	P	38.5	Very low	30.2	Very low	95.6667 Å²	95.6667	125.3 Å²	125.3	62%	0.621	71%	0.706	S	S	*	*			cis	-137.1	-158.7	-34.4	39.1	-18.8	0	0	0	115
743	N	30.4	Very low	30.2	Very low	138 Å²	138	126.7 Å²	126.7	74%	0.738	71%	0.706	S	S	*	*			trans	79	150.2	156.7	-62.9	-18.9	0	0	0	117.9
744	T	29.7	Very low	30.1	Very low	110.333 Å²	110.333	125.3 Å²	125.3	68%	0.677	70%	0.701	S	S	*	*			cis	-164.1	160.6	-8.5	17.6	0	0	0	0	110.5
745	L	31.2	Very low	30.3	Very low	145 Å²	145	126.6 Å²	126.6	76%	0.759	70%	0.704	S	S	*	*			trans	62.6	147.2	149.6	-89	102.7	0	0	0	120.8
746	D	27.9	Very low	30.3	Very low	118.333 Å²	118.333	124.8 Å²	124.8	63%	0.633	70%	0.702	S	S	*	*			trans	-129.8	154.5	134.1	-85.2	-38.2	0	0	0	116.9
747	L	30.1	Very low	30.3	Very low	145.333 Å²	145.333	126.3 Å²	126.3	76%	0.761	70%	0.704	S	S	*	*				150.2	146.2	105.4	-95.5	167.5	0	0	0	113.1
748	K	28.4	Very low	30.2	Very low	171.667 Å²	171.667	129.7 Å²	129.7	75%	0.746	71%	0.706	S	S	*	*			trans	83.2	151.8	169.7	-100.3	170.2	-179.6	167.8	0	116
749	I	28.8	Very low	30.2	Very low	132 Å²	132	132.2 Å²	132.2	68%	0.677	71%	0.711	S	S	*	*			trans	146.9	135.3	143.2	-93.6	158.4	0	0	0	111.4
750	Q	25.8	Very low	30.2	Very low	136.333 Å²	136.333	134 Å²	134	64%	0.637	71%	0.714	S	S	*	*			trans	-36.6	140.5	157.2	-89.8	166.4	-14.1	0	0	115.7	Q1165	Q750-Q1165 VanDerWaalsContact CD-CD 3.43Å; Q750-Q1165 VanDerWaalsContact NE2-CD 3.31Å
751	S	26.8	Very low	30.2	Very low	91.6667 Å²	91.6667	134.9 Å²	134.9	64%	0.641	71%	0.712	S	S	*	*				81.4	151.6	99.1	63	0	0	0	0	116.5
752	S	28.9	Very low	29.9	Very low	91.6667 Å²	91.6667	137.7 Å²	137.7	64%	0.641	71%	0.714	S	S	*	*				163.3	144.2	103.1	42.3	0	0	0	0	111.5
753	N	28.4	Very low	29.4	Very low	122.667 Å²	122.667	140.3 Å²	140.3	66%	0.656	72%	0.723	S	S	*	*				95.3	145	76.2	-76.1	2.7	0	0	0	113.2
754	S	28.8	Very low	29.2	Very low	89.3333 Å²	89.3333	137.7 Å²	137.7	63%	0.625	72%	0.716	S	S	*	*			cis	158.5	151.8	-12.1	56	0	0	0	0	111.2
755	H	32.3	Very low	29.1	Very low	164 Å²	164	139.2 Å²	139.2	76%	0.759	72%	0.719	S	S	*	*				-153.4	160	116.9	-104.3	-29.4	0	0	0	111.7
756	D	30	Very low	29.1	Very low	128.333 Å²	128.333	138.2 Å²	138.2	69%	0.686	71%	0.714	S	S	*	*			trans	-144.2	134.9	-158.8	-97.7	-34.6	0	0	0	116.4
757	H	32.1	Very low	29.1	Very low	156.333 Å²	156.333	138.6 Å²	138.6	72%	0.724	72%	0.716	S	S	*	*			trans	28.6	143.4	152.4	-58.9	-47.8	0	0	0	118
758	R	29.6	Very low	29.1	Very low	223.333 Å²	223.333	136.7 Å²	136.7	84%	0.843	71%	0.706	S	S	*	*				-175.9	147.5	90.1	-98	164	-175.9	-147.4	0.6	111.3
759	H	31.4	Very low	29.1	Very low	165.333 Å²	165.333	132.9 Å²	132.9	77%	0.765	69%	0.694	S	S	*	*			trans	57.9	124.2	167.3	-55	-78.7	0	0	0	117
760	H	29.2	Very low	29.1	Very low	182 Å²	182	132.8 Å²	132.8	84%	0.843	70%	0.695	S	S	*	*				-166.3	164.4	101.5	-79.7	-66.2	0	0	0	111.8
761	P	33.7	Very low	29.2	Very low	107 Å²	107	132.7 Å²	132.7	70%	0.695	70%	0.699	S	S	*	*				-130.5	-171.1	-56.7	39.7	-22.2	0	0	0	114.6
762	M	26.9	Very low	29.3	Very low	178 Å²	178	133.8 Å²	133.8	88%	0.877	70%	0.702	S	S	*	*			trans	29.8	148.4	162.3	-62	-140.4	166.5	0	0	116.8
763	N	26.5	Very low	29.3	Very low	149.667 Å²	149.667	139.7 Å²	139.7	80%	0.8	71%	0.71	S	S	*	*				-156.8	168.9	91.5	-150.9	-0.9	0	0	0	113.4
764	S	27.5	Very low	29.3	Very low	83.3333 Å²	83.3333	139.1 Å²	139.1	58%	0.583	72%	0.716	S	S	*	*			trans	-70.2	153.1	172.3	61.3	0	0	0	0	117.7
765	N	27.9	Very low	29.3	Very low	141 Å²	141	144.6 Å²	144.6	75%	0.754	72%	0.724	S	S	*	*				-163.8	143.7	98.3	-106.8	-12.7	0	0	0	111.9
766	I	29.8	Very low	29.2	Very low	125 Å²	125	142.6 Å²	142.6	64%	0.641	73%	0.726	S	S	*	*				66.4	116.2	110.2	-61.5	172	0	0	0	117.5
767	N	28.5	Very low	29.2	Very low	126 Å²	126	144.1 Å²	144.1	67%	0.674	73%	0.733	S	S	*	*				86.2	139.4	115.8	-72.8	6	0	0	0	119.2
768	N	29	Very low	29	Very low	106 Å²	106	143.8 Å²	143.8	57%	0.567	74%	0.737	S	S	*	*				94.1	139.7	104.5	-82.4	50.7	0	0	0	119.3	I1099 L1101	N768-I1099 WeakPolarHBondContact CA-O 3.2Å; N768-I1099 PolarHBondContact N-O 3.43Å; N768-L1101 PolarHBondContact ND2-O 3.25Å
769	D	28.6	Very low	29.1	Very low	92.3333 Å²	92.3333	141.3 Å²	141.3	49%	0.494	73%	0.732	S	S	.	*				93.6	119.5	107.5	-61.4	-26.4	0	0	0	118.8	N1098 I1099 H1100	D769-N1098 VanDerWaalsContact O-CB 3.28Å; D769-N1098 WeakPolarHBondContact O-CB 3.34Å; D769-N1098 PolarHBondContact O-OD1 3.14Å; D769-I1099 VanDerWaalsContact C-N 3.33Å; D769-H1100 HydrophobicContact CB-CB 4.19Å; D769-H1100 VanDerWaalsContact OD1-CA 3.23Å; D769-H1100 WeakPolarHBondContact OD1-CA 3.41Å; D769-H1100 IonicContact OD1-CD2 3.29Å; D769-H1100 PolarHBondContact OD1-CD2 2.92Å; D769-H1100 IonicContact OD1-CE1 2.75Å; D769-H1100 IonicContact OD1-CG 3.87Å; D769-H1100 VanDerWaalsContact OD1-CG 3.23Å; D769-H1100 IonicContact OD1-ND1 3.22Å; D769-H1100 IonicContact OD1-NE2 3.05Å
770	N	28.6	Very low	29	Very low	128.667 Å²	128.667	141 Å²	141	69%	0.688	73%	0.731	S	S	*	*			trans	89.9	136.9	137.7	-63.9	-41.2	0	0	0	119.1	N1098	N770-N1098 HydrophobicContact CB-CB 4.4Å
771	N	29.8	Very low	29	Very low	134.333 Å²	134.333	139.3 Å²	139.3	72%	0.718	73%	0.727	S	S	*	*			trans	-176.7	144.1	162.4	-95.1	-38	0	0	0	113.5	N1267	N771-N1267 PolarHBondContact OD1-ND2 3.3Å
772	T	27.6	Very low	28.8	Very low	115.667 Å²	115.667	141.6 Å²	141.6	71%	0.71	73%	0.732	S	S	*	*			trans	23.7	122.4	159.2	3.7	0	0	0	0	115.2	S774	T772-S774 PolarHBondContact O-N 3.43Å; T772-S774 VanDerWaalsContact O-N 3.11Å
773	W	28.5	Very low	28.9	Very low	215 Å²	215	142.1 Å²	142.1	81%	0.814	73%	0.732	S	S	*	*			trans	-110.2	99.3	141.2	-75.5	55.7	0	0	0	112.1	Y775	W773-Y775 HydrophobicContact CE3-CE2 4.25Å
774	S	28.1	Very low	28.9	Very low	110 Å²	110	139.8 Å²	139.8	77%	0.769	73%	0.728	S	S	*	*			trans	-94	127.9	167.6	-60.6	0	0	0	0	110.1	T772	T772-S774 PolarHBondContact O-N 3.43Å; T772-S774 VanDerWaalsContact O-N 3.11Å
775	Y	29	Very low	29	Very low	205.333 Å²	205.333	140.8 Å²	140.8	81%	0.805	74%	0.735	S	S	*	*			trans	-102.4	133.1	165	-91.3	-91.4	0	0	0	109.6	W773 L777	W773-Y775 HydrophobicContact CE3-CE2 4.25Å; Y775-L777 PolarHBondContact O-N 3.31Å
776	P	31.6	Very low	29.1	Very low	122 Å²	122	145.1 Å²	145.1	79%	0.792	74%	0.742	S	S	*	*			trans	-72	129	179.1	13.9	-12.8	0	0	0	112	N778	P776-N778 VanDerWaalsContact C-N 3.26Å; P776-N778 PolarHBondContact O-N 3.11Å
777	L	28.6	Very low	28.9	Very low	160.333 Å²	160.333	145.7 Å²	145.7	84%	0.839	75%	0.747	S	S	*	*			trans	-81	107.5	174	-172.5	78.1	0	0	0	110.1	Y775 K779	Y775-L777 PolarHBondContact O-N 3.31Å; L777-K779 PolarHBondContact O-N 2.76Å
778	N	29.1	Very low	29.1	Very low	149.667 Å²	149.667	145.7 Å²	145.7	80%	0.8	75%	0.751	S	S	*	*			trans	-127.8	115.1	163.6	-135.8	-15.4	0	0	0	110.2	P776	P776-N778 VanDerWaalsContact C-N 3.26Å; P776-N778 PolarHBondContact O-N 3.11Å
779	K	30.6	Very low	29.1	Very low	171.333 Å²	171.333	146.1 Å²	146.1	75%	0.745	76%	0.763	S	S	*	*			trans	-130.7	112	157.9	-155.5	-166.2	177.4	-169.1	0	110.1	L777	L777-K779 PolarHBondContact O-N 2.76Å
780	Q	29.4	Very low	29.2	Very low	159.333 Å²	159.333	148.4 Å²	148.4	75%	0.745	77%	0.774	S	S	*	*			trans	176.2	133.2	134.8	-88.8	170	-37.3	0	0	116.2
781	I	30.1	Very low	29.3	Very low	145.667 Å²	145.667	149.5 Å²	149.5	75%	0.747	78%	0.779	S	S	*	*			trans	86.8	115.6	146.8	-70.5	159.5	0	0	0	114.3
782	L	29.1	Very low	29.3	Very low	155 Å²	155	149.7 Å²	149.7	81%	0.812	78%	0.779	S	S	*	*			trans	-69.6	120.6	145.7	-93.7	127.9	0	0	0	115.7	S784	L782-S784 PolarHBondContact O-N 2.97Å
783	E	28.1	Very low	29.6	Very low	188.333 Å²	188.333	152.4 Å²	152.4	88%	0.88	78%	0.784	S	S	*	*			trans	-93.3	108.3	162.5	-67.3	176.2	135.6	0	0	110.2
784	S	27.8	Very low	29.6	Very low	101.333 Å²	101.333	147 Å²	147	71%	0.709	78%	0.778	S	S	*	*			trans	-141.8	126.2	165.1	55.7	0	0	0	0	112.8	L782	L782-S784 PolarHBondContact O-N 2.97Å
785	S	28.7	Very low	29.7	Very low	105 Å²	105	146.6 Å²	146.6	73%	0.734	77%	0.774	S	S	*	*			trans	87.5	89.8	168.5	54.7	0	0	0	0	116.3
786	Y	29.7	Very low	29.8	Very low	230.667 Å²	230.667	143.7 Å²	143.7	91%	0.905	77%	0.772	S	S	*	*				-148.6	85.9	125.4	-101	-72.7	0	0	0	110.6
787	N	27.3	Very low	29.7	Very low	138.667 Å²	138.667	143.3 Å²	143.3	74%	0.742	77%	0.773	S	S	*	*			trans	-114.7	132.2	169.4	-138.8	-10.7	0	0	0	109.7
788	T	31	Very low	29.9	Very low	124 Å²	124	141 Å²	141	76%	0.761	77%	0.767	S	S	*	*			trans	77.4	108.1	170.8	63.2	0	0	0	0	115.4	L790	T788-L790 VanDerWaalsContact CB-N 3.34Å; T788-L790 HydrophobicContact CG2-CB 4.15Å; T788-L790 WeakPolarHBondContact CG2-O 3.37Å; T788-L790 PolarHBondContact O-N 2.97Å
789	S	29.2	Very low	29.9	Very low	115 Å²	115	140.3 Å²	140.3	80%	0.804	76%	0.763	S	S	*	*			trans	-93.1	113.5	134.9	58.6	0	0	0	0	111.8
790	L	30.5	Very low	29.8	Very low	142 Å²	142	139.7 Å²	139.7	74%	0.743	77%	0.765	S	S	*	*			trans	-163.4	103.1	138.8	-142.3	140.1	0	0	0	107.7	T788 D792	T788-L790 VanDerWaalsContact CB-N 3.34Å; T788-L790 HydrophobicContact CG2-CB 4.15Å; T788-L790 WeakPolarHBondContact CG2-O 3.37Å; T788-L790 PolarHBondContact O-N 2.97Å; L790-D792 PolarHBondContact O-N 3.37Å; L790-D792 VanDerWaalsContact O-N 3.11Å
791	I	32	Very low	29.7	Very low	151.667 Å²	151.667	138.6 Å²	138.6	78%	0.778	76%	0.764	S	S	*	*			trans	-78.8	109.4	172	-65.8	174.5	0	0	0	112.2
792	D	29.8	Very low	29.8	Very low	136.667 Å²	136.667	136.4 Å²	136.4	73%	0.731	76%	0.761	S	S	*	*			trans	-111	146.6	159	-104.6	-17.3	0	0	0	112.7	L790	L790-D792 PolarHBondContact O-N 3.37Å; L790-D792 VanDerWaalsContact O-N 3.11Å
793	H	32.8	Very low	30	Very low	173.333 Å²	173.333	136.8 Å²	136.8	80%	0.802	76%	0.759	S	S	*	*			trans	158.9	134.2	158.2	-107.6	-26.6	0	0	0	113.1
794	C	29.2	Very low	30.2	Very low	101.333 Å²	101.333	135.2 Å²	135.2	69%	0.685	75%	0.751	S	S	*	*			trans	-114.8	166.5	172.9	-85.6	0	0	0	0	111.5
795	C	31.1	Very low	30.4	Very low	102 Å²	102	137.6 Å²	137.6	69%	0.689	75%	0.751	S	S	*	*			trans	117.4	124.1	160.6	-75.7	0	0	0	0	115.4
796	N	30.4	Very low	30.5	Very low	143.667 Å²	143.667	140.1 Å²	140.1	77%	0.768	75%	0.749	S	S	*	*			trans	-157.6	138.1	137.2	-63	-38.6	0	0	0	114.4
797	S	29.4	Very low	30.6	Very low	115 Å²	115	133.3 Å²	133.3	80%	0.804	74%	0.735	S	S	*	*				-93.6	168	118.8	-67.2	0	0	0	0	113.2
798	P	33.2	Very low	30.7	Very low	111.667 Å²	111.667	133.7 Å²	133.7	73%	0.725	73%	0.733	S	S	*	*				-135.6	166.6	77.8	42.1	-29	0	0	0	118.3
799	N	27.8	Very low	30.6	Very low	135.667 Å²	135.667	134.7 Å²	134.7	73%	0.725	73%	0.733	S	S	*	*			trans	67.8	129.9	150.4	-84	-17.5	0	0	0	120
800	M	28.8	Very low	30.4	Very low	157 Å²	157	134.3 Å²	134.3	77%	0.773	73%	0.725	S	S	*	*				103.2	162	106	-70.1	-88.9	130.5	0	0	114.4
801	L	28.7	Very low	30.4	Very low	137.5 Å²	137.5	136 Å²	136	72%	0.72	73%	0.727	S	S	*	*			cis	-150.4	145.5	-13.4	-167.7	74.7	0	0	0	109.4
802	S	31	Very low	30.2	Very low	99 Å²	99	135.6 Å²	135.6	69%	0.692	73%	0.726	S	S	*	*			trans	114.5	142.7	150.4	52.1	0	0	0	0	111.3
803	Q	32.6	Very low	30.3	Very low	162.5 Å²	162.5	136.2 Å²	136.2	76%	0.759	72%	0.724	S	S	*	*			cis	132.4	154.7	25.5	-92.4	176.4	21.9	0	0	110.8
804	Q	32.7	Very low	30.2	Very low	156 Å²	156	135.5 Å²	135.5	73%	0.729	72%	0.721	S	S	*	*				-128.8	154.5	83.2	-66.7	161.9	-10	0	0	110
805	Q	33.5	Very low	30.2	Very low	150.5 Å²	150.5	136.3 Å²	136.3	70%	0.703	72%	0.724	S	S	*	*			cis	-167.6	151.7	44.3	-92.4	169.5	-1.3	0	0	110	N1408	Q805-N1408 PolarHBondContact NE2-OD1 2.89Å; Q805-N1408 PolarHBondContact OE1-ND2 2.7Å
806	K	29.9	Very low	30.2	Very low	158.75 Å²	158.75	140.2 Å²	140.2	69%	0.69	73%	0.731	S	S	*	*			trans	126.7	116.5	139	-129	-167.5	178.4	-155.5	0	113.8
807	S	31.4	Very low	30.4	Very low	87.75 Å²	87.75	138.3 Å²	138.3	61%	0.614	73%	0.73	S	S	*	*				-165.6	139.6	-105.2	44.1	0	0	0	0	109.6	H1403 Q1404	S807-H1403 WeakPolarHBondContact CB-CD2 2.77Å; S807-Q1404 VanDerWaalsContact O-CG 3.31Å; S807-Q1404 WeakPolarHBondContact O-CG 3.12Å; S807-Q1404 PolarHBondContact O-NE2 2.71Å; S807-Q1404 VanDerWaalsContact OG-CA 3.24Å; S807-Q1404 WeakPolarHBondContact OG-CA 3.06Å; S807-Q1404 WeakPolarHBondContact OG-CG 3.34Å; S807-Q1404 PolarHBondContact OG-O 3.31Å
808	Q	29.2	Very low	30.6	Very low	147.5 Å²	147.5	140.9 Å²	140.9	69%	0.689	73%	0.734	S	S	*	*			trans	126.4	126.1	157.7	-123.9	-174.8	8	0	0	113.5	Q1402 H1403 Q1404	Q808-Q1402 HydrophobicContact CB-CB 4.45Å; Q808-Q1402 HydrophobicContact CB-CG 4.33Å; Q808-Q1402 HydrophobicContact CG-CB 3.65Å; Q808-Q1402 HydrophobicContact CG-CG 3.95Å; Q808-H1403 HydrophobicContact CB-CB 3.65Å; Q808-H1403 HydrophobicContact CG-CB 3.83Å; Q808-H1403 PolarHBondContact NE2-O 2.83Å; Q808-Q1404 HydrophobicContact CB-CB 3.51Å; Q808-Q1404 HydrophobicContact CB-CG 3.28Å; Q808-Q1404 HydrophobicContact CG-CB 4.1Å; Q808-Q1404 HydrophobicContact CG-CG 4.37Å; Q808-Q1404 PolarHBondContact O-NE2 2.89Å
809	L	29.4	Very low	30.5	Very low	145 Å²	145	139.9 Å²	139.9	76%	0.759	73%	0.729	S	S	*	*			trans	-166.5	120.3	155.2	-90.8	172.6	0	0	0	110.7
810	T	26	Very low	30.7	Very low	105 Å²	105	140.3 Å²	140.3	64%	0.644	73%	0.731	S	S	*	*			trans	-95	137	158.6	10.1	0	0	0	0	112.8
811	F	29.3	Very low	30.9	Very low	179 Å²	179	139.1 Å²	139.1	79%	0.785	73%	0.727	S	S	*	*			trans	-150.2	117.9	147.3	-101.1	-95.2	0	0	0	116	H813	F811-H813 VanDerWaalsContact C-N 3.26Å; F811-H813 HydrophobicContact CD1-CB 3.86Å; F811-H813 AromaticContact CD1-CE1 3.73Å; F811-H813 AromaticContact CD1-NE2 3.63Å; F811-H813 HydrophobicContact CE1-CB 3.92Å; F811-H813 PolarHBondContact O-N 3.01Å
812	D	28.7	Very low	31	Very low	143.25 Å²	143.25	137.8 Å²	137.8	77%	0.766	73%	0.725	S	S	*	*			trans	-92.3	114.2	155	-68.2	-58.1	0	0	0	113.1
813	H	31.1	Very low	31.1	Very low	147.75 Å²	147.75	138.8 Å²	138.8	68%	0.684	73%	0.726	S	S	*	*				129	125.6	115.1	-108.9	-41.9	0	0	0	115.1	F811	F811-H813 VanDerWaalsContact C-N 3.26Å; F811-H813 HydrophobicContact CD1-CB 3.86Å; F811-H813 AromaticContact CD1-CE1 3.73Å; F811-H813 AromaticContact CD1-NE2 3.63Å; F811-H813 HydrophobicContact CE1-CB 3.92Å; F811-H813 PolarHBondContact O-N 3.01Å
814	Q	30.5	Very low	31.1	Very low	159.25 Å²	159.25	135.7 Å²	135.7	74%	0.744	72%	0.722	S	S	*	*			trans	78.7	131.9	135.6	-72.7	170.4	15.6	0	0	113.2
815	T	29	Very low	31.1	Very low	119 Å²	119	133.1 Å²	133.1	73%	0.73	72%	0.72	S	S	*	*				90.9	141	77.8	27.1	0	0	0	0	114.5
816	E	32.4	Very low	31.1	Very low	182.75 Å²	182.75	133.6 Å²	133.6	85%	0.854	72%	0.722	S	S	*	*			trans	135.6	152.2	143.8	-67.9	-173.7	160.6	0	0	113.9	L818	E816-L818 PolarHBondContact O-N 2.81Å
817	S	33.4	Very low	31.3	Very low	104.25 Å²	104.25	133.2 Å²	133.2	73%	0.729	72%	0.723	S	S	*	*			cis	-133	147.8	-21.9	59.1	0	0	0	0	113.8	S819	S817-S819 PolarHBondContact O-N 3.29Å
818	L	33.7	Very low	31.4	Very low	169.75 Å²	169.75	134.1 Å²	134.1	89%	0.889	73%	0.728	S	S	*	*			trans	-36.4	132.1	157.2	-65.4	148.9	0	0	0	117.3	E816	E816-L818 PolarHBondContact O-N 2.81Å
819	S	30.9	Very low	31.7	Very low	90 Å²	90	134.9 Å²	134.9	63%	0.629	73%	0.732	S	S	*	*			trans	-161.7	139.6	152.2	58.5	0	0	0	0	112.9	S817	S817-S819 PolarHBondContact O-N 3.29Å
820	N	32.4	Very low	31.8	Very low	145.25 Å²	145.25	134.2 Å²	134.2	78%	0.777	72%	0.724	S	S	*	*			trans	80.6	105.1	148.9	-70.3	-21.7	0	0	0	117.8
821	I	32.9	Very low	32.1	Very low	130.75 Å²	130.75	136.8 Å²	136.8	67%	0.671	73%	0.728	S	S	*	*				-153.3	135.7	59.5	-104.7	154.2	0	0	0	110.8	V823 N1370	I821-V823 HydrophobicContact CG2-CG2 4.08Å; I821-N1370 HydrophobicContact CB-CB 4.07Å; I821-N1370 HydrophobicContact CD1-CB 3.72Å; I821-N1370 HydrophobicContact CG1-CB 3.78Å; I821-N1370 HydrophobicContact CG2-CB 3.39Å
822	V	31.6	Very low	32.2	Very low	111.75 Å²	111.75	135.9 Å²	135.9	68%	0.677	73%	0.727	S	S	*	*			trans	-48.5	129.3	165	-177.3	0	0	0	0	114.3	S824	V822-S824 PolarHBondContact O-N 3.49Å
823	V	33.5	Very low	32.3	Very low	119.25 Å²	119.25	134.6 Å²	134.6	72%	0.723	73%	0.726	S	S	*	*			trans	-136.5	129.2	143.7	154.3	0	0	0	0	110.9	I821 C825	I821-V823 HydrophobicContact CG2-CG2 4.08Å; V823-C825 PolarHBondContact O-N 3.19Å
824	S	31.6	Very low	32.4	Very low	97.75 Å²	97.75	134.4 Å²	134.4	68%	0.684	73%	0.728	S	S	*	*			trans	-87.4	142.8	171.5	-13	0	0	0	0	117.5	V822	V822-S824 PolarHBondContact O-N 3.49Å
825	C	33.1	Very low	32.2	Very low	100.5 Å²	100.5	134 Å²	134	68%	0.679	73%	0.731	S	S	*	*			trans	-105.6	151.8	167	-141.2	0	0	0	0	111.2	V823 Q827	V823-C825 PolarHBondContact O-N 3.19Å; C825-Q827 PolarHBondContact O-N 2.88Å
826	H	33.4	Very low	32.2	Very low	161 Å²	161	134.2 Å²	134.2	75%	0.745	73%	0.732	S	S	*	*			trans	-135.4	131.5	-145.9	-130.1	-67.4	0	0	0	111.1
827	Q	34.5	Very low	32.1	Very low	151 Å²	151	130 Å²	130	71%	0.706	72%	0.723	S	S	*	*			trans	64.1	112.9	164.3	-122.3	77.2	19.9	0	0	119.8	C825 N1240	C825-Q827 PolarHBondContact O-N 2.88Å; Q827-N1240 PolarHBondContact OE1-ND2 2.81Å
828	C	33.2	Very low	31.9	Very low	106.25 Å²	106.25	129 Å²	129	72%	0.718	72%	0.721	S	S	*	*			trans	-163.1	132.9	171.7	-74.3	0	0	0	0	112.6
829	Q	34.3	Very low	31.7	Very low	165.25 Å²	165.25	126.2 Å²	126.2	77%	0.772	71%	0.714	S	S	*	*			trans	-32.4	150.5	139	-72.3	170.7	-37.3	0	0	114.5
830	H	31.4	Very low	31.6	Very low	129 Å²	129	126.5 Å²	126.5	60%	0.597	72%	0.716	S	S	*	*			trans	-140.2	150.6	130.2	-91.8	-74.8	0	0	0	114.5	E1747 L1748 R1750	H830-E1747 IonicContact CE1-OE1 2.62Å; H830-E1747 PolarHBondContact CE1-OE1 2.73Å; H830-E1747 VanDerWaalsContact CE1-OE1 3.23Å; H830-E1747 IonicContact ND1-OE1 3.69Å; H830-L1748 HydrophobicContact CB-CD1 4.46Å; H830-L1748 WeakPolarHBondContact CE1-CD1 3.42Å; H830-L1748 VanDerWaalsContact ND1-CD1 3.33Å; H830-L1748 WeakPolarHBondContact ND1-CD1 3.31Å; H830-L1748 WeakPolarHBondContact NE2-CD1 2.72Å; H830-R1750 VanDerWaalsContact N-NH2 3.18Å; H830-R1750 PolarHBondContact O-NH1 3.45Å; H830-R1750 VanDerWaalsContact O-NH1 3.15Å; H830-R1750 PolarHBondContact O-NH2 3.13Å
831	H	33	Very low	31.5	Very low	159.25 Å²	159.25	125.2 Å²	125.2	74%	0.737	71%	0.714	S	S	*	*			trans	-152.4	150.1	138.7	-81.4	-67.1	0	0	0	115	E1747 L1748	H831-E1747 IonicContact CE1-OE1 3.84Å; H831-E1747 PolarHBondContact CE1-OE1 3.19Å; H831-E1747 VanDerWaalsContact CE1-OE1 3.24Å; H831-E1747 IonicContact CE1-OE2 2.73Å; H831-E1747 PolarHBondContact CE1-OE2 3Å; H831-E1747 IonicContact NE2-OE1 3.52Å; H831-E1747 IonicContact NE2-OE2 3.05Å; H831-L1748 WeakPolarHBondContact NE2-CD1 2.99Å
832	Q	31.9	Very low	31.3	Very low	161.75 Å²	161.75	123.2 Å²	123.2	76%	0.756	71%	0.711	S	S	*	*			trans	-21.8	151.1	142.5	-71.6	-156.4	-7.2	0	0	114.6	I834	Q832-I834 PolarHBondContact O-N 3.28Å; Q832-I834 VanDerWaalsContact O-N 3.1Å
833	P	31.1	Very low	31.3	Very low	114.5 Å²	114.5	124.4 Å²	124.4	74%	0.744	71%	0.712	S	S	*	*			trans	-97.7	143.2	132.8	20.5	-12.5	0	0	0	113.1	L835	P833-L835 PolarHBondContact O-N 2.92Å
834	I	32.8	Very low	31.3	Very low	143.75 Å²	143.75	126.3 Å²	126.3	74%	0.737	71%	0.713	S	S	*	*			trans	14.4	126.5	154	-67.2	170.2	0	0	0	114.2	Q832 T836	Q832-I834 PolarHBondContact O-N 3.28Å; Q832-I834 VanDerWaalsContact O-N 3.1Å; I834-T836 HydrophobicContact CG2-CG2 4.47Å; I834-T836 PolarHBondContact O-N 3.25Å
835	L	25.9	Very low	31.2	Very low	151.25 Å²	151.25	127.6 Å²	127.6	79%	0.792	71%	0.713	S	S	*	*			trans	-21.1	116.9	152.3	-75.4	120.9	0	0	0	114.8	P833	P833-L835 PolarHBondContact O-N 2.92Å
836	T	30.1	Very low	31.1	Very low	122.75 Å²	122.75	129.6 Å²	129.6	75%	0.753	72%	0.716	S	S	*	*			trans	-153	142.4	138.4	29.7	0	0	0	0	111	I834 I1120 L1121	I834-T836 HydrophobicContact CG2-CG2 4.47Å; I834-T836 PolarHBondContact O-N 3.25Å; T836-I1120 WeakPolarHBondContact O-CA 3.02Å; T836-L1121 PolarHBondContact O-N 3.15Å
837	S	30.4	Very low	30.9	Very low	95.25 Å²	95.25	126.3 Å²	126.3	67%	0.666	71%	0.712	S	S	*	*			trans	-60	156.5	140.3	38.3	0	0	0	0	116.5	S1118 V1119	S837-S1118 CarbonylContact O-C 3.06Å; S837-S1118 VanDerWaalsContact O-CA 3.3Å; S837-S1118 WeakPolarHBondContact O-CA 3.19Å; S837-V1119 CarbonylContact C-O 3.41Å; S837-V1119 PolarHBondContact O-N 3.33Å
838	A	28.6	Very low	30.7	Very low	83 Å²	83	129.1 Å²	129.1	69%	0.686	72%	0.716	S	S	*	*			trans	92.9	120.9	147.7	0	0	0	0	0	118.6	S1118 V1119	A838-S1118 VanDerWaalsContact C-C 3.4Å; A838-S1118 CarbonylContact C-O 3.16Å; A838-S1118 VanDerWaalsContact CA-C 3.45Å; A838-S1118 VanDerWaalsContact CA-N 3.29Å; A838-S1118 VanDerWaalsContact N-C 3.28Å; A838-V1119 PolarHBondContact N-O 3.05Å
839	C	28.5	Very low	30.4	Very low	110.75 Å²	110.75	130.4 Å²	130.4	75%	0.748	72%	0.715	S	S	*	*			trans	144.9	115.4	149.6	-78.5	0	0	0	0	113.1	S1117 S1118	C839-S1117 WeakPolarHBondContact CA-OG 3.12Å; C839-S1117 PolarHBondContact N-OG 3.38Å; C839-S1118 VanDerWaalsContact C-OG 3.28Å; C839-S1118 PolarHBondContact O-OG 2.88Å
840	S	29.1	Very low	30.2	Very low	95.75 Å²	95.75	125.7 Å²	125.7	67%	0.67	70%	0.7	S	S	*	*				91.3	135.2	61.6	-58.9	0	0	0	0	114.3	S1118	S840-S1118 PolarHBondContact N-OG 2.76Å
841	T	30.8	Very low	30.2	Very low	119.5 Å²	119.5	126 Å²	126	73%	0.733	70%	0.702	S	S	*	*				147.8	153.9	91.6	49.9	0	0	0	0	116.3	V1115	T841-V1115 HydrophobicContact CG2-CB 4.37Å
842	S	29.2	Very low	30	Very low	87.25 Å²	87.25	124.2 Å²	124.2	61%	0.61	70%	0.697	S	S	*	*			cis	127.9	160	25.7	63.9	0	0	0	0	113.1	V1115 S1116	S842-V1115 WeakPolarHBondContact OG-CG1 3.27Å; S842-S1116 WeakPolarHBondContact CB-OG 3Å; S842-S1116 VanDerWaalsContact OG-CB 3.28Å; S842-S1116 WeakPolarHBondContact OG-CB 2.98Å; S842-S1116 PolarHBondContact OG-OG 3Å
843	I	30.9	Very low	29.9	Very low	137.5 Å²	137.5	122.2 Å²	122.2	71%	0.705	69%	0.692	S	S	*	*				137.4	133.4	90.4	-72.5	171	0	0	0	113.3	V1115	I843-V1115 HydrophobicContact CD1-CG1 3.31Å; I843-V1115 HydrophobicContact CG1-CG1 3.67Å
844	H	33.3	Very low	29.9	Very low	159.25 Å²	159.25	123.1 Å²	123.1	74%	0.737	69%	0.69	S	S	*	*				-138.1	162.1	115.2	-113.6	-101.3	0	0	0	113.3
845	D	29.8	Very low	29.9	Very low	125.5 Å²	125.5	123.7 Å²	123.7	67%	0.671	69%	0.69	S	S	*	*				-145.7	147.4	81.3	-96.5	-38	0	0	0	112.7
846	N	31	Very low	30.2	Very low	142.5 Å²	142.5	122.1 Å²	122.1	76%	0.762	69%	0.687	S	S	*	*			trans	108.5	121.2	145.8	-79	-50.8	0	0	0	116
847	S	29.8	Very low	30.3	Very low	92 Å²	92	122 Å²	122	64%	0.643	69%	0.691	S	S	*	*			trans	84.9	135.4	147.6	88.8	0	0	0	0	115.1
848	W	29.1	Very low	30.4	Very low	209.75 Å²	209.75	120.8 Å²	120.8	80%	0.795	69%	0.694	S	S	*	*				-156.7	119.9	67.4	-79.8	61.6	0	0	0	109.3	K1734 H1735 T1736	W848-K1734 CarbonylContact C-O 3.38Å; W848-K1734 VanDerWaalsContact C-O 3.25Å; W848-K1734 CarbonylContact O-C 3.57Å; W848-H1735 HydrophobicContact CB-CB 3.63Å; W848-H1735 WeakPolarHBondContact CB-ND1 3.21Å; W848-H1735 HydrophobicContact CD2-CB 3.72Å; W848-H1735 HydrophobicContact CE3-CB 3.38Å; W848-H1735 AromaticContact CE3-CD2 3.94Å; W848-H1735 AromaticContact CE3-CG 3.5Å; W848-H1735 VanDerWaalsContact CE3-CG 3.5Å; W848-H1735 HydrophobicContact CG-CB 3.89Å; W848-H1735 HydrophobicContact CZ3-CB 4.12Å; W848-H1735 WeakPolarHBondContact O-CA 3.49Å; W848-H1735 PolarHBondContact O-ND1 2.86Å; W848-H1735 VanDerWaalsContact O-ND1 3.09Å; W848-T1736 CarbonylContact C-O 3.33Å; W848-T1736 WeakPolarHBondContact CA-O 3.16Å; W848-T1736 PolarHBondContact N-O 2.75Å
849	L	27.7	Very low	30.5	Very low	133 Å²	133	125.8 Å²	125.8	70%	0.696	70%	0.703	S	S	*	*				60	152.2	75.6	-103	-176.2	0	0	0	114.4	K1734 T1736	L849-K1734 CarbonylContact C-O 3.46Å; L849-K1734 WeakPolarHBondContact CA-O 3.47Å; L849-K1734 PolarHBondContact N-O 3.43Å; L849-T1736 VanDerWaalsContact CB-O 3.3Å; L849-T1736 WeakPolarHBondContact CB-O 3.07Å; L849-T1736 WeakPolarHBondContact CD1-OG1 3.14Å; L849-T1736 PolarHBondContact N-O 2.69Å
850	S	29.9	Very low	30.6	Very low	65.5 Å²	65.5	128 Å²	128	46%	0.458	70%	0.702	S	S	.	*			cis	-177.6	157.9	0.5	-116.8	0	0	0	0	112.1	K1734	S850-K1734 WeakPolarHBondContact CB-O 3.31Å; S850-K1734 PolarHBondContact N-O 3.3Å; S850-K1734 WeakPolarHBondContact OG-CG 3.04Å
851	Q	30.7	Very low	30.7	Very low	137.25 Å²	137.25	130.8 Å²	130.8	64%	0.641	70%	0.704	S	S	*	*				133.3	148.8	93.1	-104.6	168.2	-46.8	0	0	115	K1734	Q851-K1734 VanDerWaalsContact CD-NZ 3.27Å
852	N	29.2	Very low	30.7	Very low	120 Å²	120	131.9 Å²	131.9	64%	0.642	70%	0.701	S	S	*	*				90.1	145.5	85.6	-93.1	46.7	0	0	0	116.6
853	D	30.7	Very low	30.7	Very low	120 Å²	120	134.4 Å²	134.4	64%	0.642	71%	0.707	S	S	*	*				135.7	158.8	71.6	-95.8	-40.9	0	0	0	118	H855	D853-H855 IonicContact OD1-CE1 3.31Å; D853-H855 PolarHBondContact OD1-CE1 2.74Å; D853-H855 VanDerWaalsContact OD1-CE1 3.31Å; D853-H855 IonicContact OD1-ND1 3.62Å
854	D	30.8	Very low	30.5	Very low	133.25 Å²	133.25	136.2 Å²	136.2	71%	0.713	71%	0.71	S	S	*	*				140.9	138.5	116.3	-106.1	-14.4	0	0	0	116.6
855	H	33	Very low	30.2	Very low	157.5 Å²	157.5	138.7 Å²	138.7	73%	0.729	71%	0.713	S	S	*	*			trans	132.9	143.6	147	-79.4	-21	0	0	0	114.9	D853	D853-H855 IonicContact OD1-CE1 3.31Å; D853-H855 PolarHBondContact OD1-CE1 2.74Å; D853-H855 VanDerWaalsContact OD1-CE1 3.31Å; D853-H855 IonicContact OD1-ND1 3.62Å
856	T	31.6	Very low	30.2	Very low	117.75 Å²	117.75	139.7 Å²	139.7	72%	0.722	72%	0.717	S	S	*	*			cis	-144.2	153.2	-11	17.1	0	0	0	0	111.5
857	S	32.3	Very low	30	Very low	120 Å²	120	138.6 Å²	138.6	84%	0.839	71%	0.711	S	S	*	*			trans	45.3	141.1	149.9	54.7	0	0	0	0	116.4
858	G	31.5	Very low	30	Very low	70 Å²	70	139 Å²	139	72%	0.722	71%	0.714	S	S	*	*			cis	147.2	144.8	-6.2	0	0	0	0	0	114.1
859	Q	32	Very low	30.1	Very low	188 Å²	188	133.5 Å²	133.5	88%	0.879	71%	0.708	S	S	*	*			trans	136.8	130	165.7	-80.9	-176.9	-19.4	0	0	114.8
860	Q	30.8	Very low	30.4	Very low	157.25 Å²	157.25	135.1 Å²	135.1	74%	0.735	71%	0.711	S	S	*	*			trans	-13.6	127.2	135.9	-71.4	174.7	-32.1	0	0	112	D881	Q860-D881 CarbonylContact C-O 3.27Å
861	Q	31.4	Very low	30.5	Very low	153.25 Å²	153.25	140.6 Å²	140.6	72%	0.716	73%	0.727	S	S	*	*				144.7	93.1	56.5	-91.8	-175.1	-9.4	0	0	114.1	L863 I878 K879 K880 D881	Q861-L863 PolarHBondContact O-N 3.36Å; Q861-I878 PolarHBondContact NE2-O 2.74Å; Q861-K879 WeakPolarHBondContact CB-O 3.33Å; Q861-K879 VanDerWaalsContact CD-N 3.25Å; Q861-K879 VanDerWaalsContact NE2-N 3.11Å; Q861-K880 WeakPolarHBondContact CB-O 3.45Å; Q861-K880 PolarHBondContact N-O 3.38Å; Q861-K880 VanDerWaalsContact N-O 3.12Å; Q861-D881 PolarHBondContact N-O 3.07Å
862	Q	29.8	Very low	30.6	Very low	143.25 Å²	143.25	139.6 Å²	139.6	67%	0.669	73%	0.726	S	S	*	*			trans	-157.3	129.9	168.1	-88.1	177.8	19.7	0	0	113.5	F864 K879 D881 T882	Q862-F864 HydrophobicContact CB-CD2 4.47Å; Q862-F864 HydrophobicContact CG-CD2 4.07Å; Q862-F864 HydrophobicContact CG-CE2 4.46Å; Q862-K879 VanDerWaalsContact CB-O 3.29Å; Q862-K879 WeakPolarHBondContact CB-O 3.48Å; Q862-K879 WeakPolarHBondContact CG-O 3.42Å; Q862-K879 PolarHBondContact NE2-O 3.32Å; Q862-K879 PolarHBondContact OE1-O 2.85Å; Q862-K879 VanDerWaalsContact OE1-O 3.12Å; Q862-D881 PolarHBondContact N-O 3.38Å; Q862-D881 VanDerWaalsContact N-O 3.16Å; Q862-D881 CarbonylContact O-C 3.51Å; Q862-T882 VanDerWaalsContact O-CA 3.22Å; Q862-T882 WeakPolarHBondContact O-CA 3.21Å; Q862-T882 PolarHBondContact O-N 3.46Å
863	L	28.8	Very low	30.9	Very low	139.25 Å²	139.25	140.5 Å²	140.5	73%	0.729	73%	0.727	S	S	*	*				131.9	126.3	79	-110.4	156.2	0	0	0	113.6	Q861 R865	Q861-L863 PolarHBondContact O-N 3.36Å; L863-R865 PolarHBondContact O-N 3.39Å
864	F	26.5	Very low	31.1	Very low	175.5 Å²	175.5	141.2 Å²	141.2	77%	0.77	73%	0.729	S	S	*	*			trans	-149.1	123.4	140.9	-99.9	-60.1	0	0	0	113.9	Q862 I866	Q862-F864 HydrophobicContact CB-CD2 4.47Å; Q862-F864 HydrophobicContact CG-CD2 4.07Å; Q862-F864 HydrophobicContact CG-CE2 4.46Å; F864-I866 PolarHBondContact O-N 3.33Å
865	R	27.5	Very low	31.4	Very low	212 Å²	212	140.4 Å²	140.4	80%	0.8	73%	0.729	S	S	*	*			trans	-14.7	132.4	153.2	-95.4	177	-174.2	-172.4	0.8	115.2	L863	L863-R865 PolarHBondContact O-N 3.39Å
866	I	29.3	Very low	31.5	Very low	147 Å²	147	138.7 Å²	138.7	75%	0.754	73%	0.725	S	S	*	*				-160.5	128.7	125.2	-69.8	168.1	0	0	0	111.8	F864 S868	F864-I866 PolarHBondContact O-N 3.33Å; I866-S868 PolarHBondContact O-N 3.07Å
867	N	27.3	Very low	31.7	Very low	119.5 Å²	119.5	139 Å²	139	64%	0.639	72%	0.721	S	S	*	*			trans	-5.1	134.9	151.2	-57.8	-5.8	0	0	0	118.6	S869	N867-S869 PolarHBondContact O-N 2.78Å; N867-S869 VanDerWaalsContact O-N 3.11Å
868	S	30.8	Very low	32	Very low	100.25 Å²	100.25	139.4 Å²	139.4	70%	0.701	71%	0.712	S	S	*	*			trans	-164	118.8	141.3	-76.8	0	0	0	0	112.6	I866 E870 F871 D872	I866-S868 PolarHBondContact O-N 3.07Å; S868-E870 PolarHBondContact O-N 2.9Å; S868-E870 VanDerWaalsContact O-N 3.11Å; S868-F871 PolarHBondContact O-N 3.08Å; S868-D872 PolarHBondContact O-N 2.92Å
869	S	30.7	Very low	32.3	Very low	94.75 Å²	94.75	143.3 Å²	143.3	66%	0.663	71%	0.709	S	S	*	*			trans	42.8	88.6	136.2	64	0	0	0	0	117.8	N867	N867-S869 PolarHBondContact O-N 2.78Å; N867-S869 VanDerWaalsContact O-N 3.11Å
870	E	34	Very low	32.4	Very low	166 Å²	166	141.4 Å²	141.4	78%	0.776	70%	0.698	S	S	*	*			trans	76.9	102.1	160.1	-78.6	166.3	158	0	0	114.7	S868 I874	S868-E870 PolarHBondContact O-N 2.9Å; S868-E870 VanDerWaalsContact O-N 3.11Å; E870-I874 WeakPolarHBondContact O-CG1 3.42Å
871	F	31.1	Very low	32.6	Very low	180.5 Å²	180.5	138.6 Å²	138.6	79%	0.792	69%	0.688	S	S	*	*				-164.2	109.6	115.6	-106.4	-101.2	0	0	0	110.6	S868 H873 I874 V875	S868-F871 PolarHBondContact O-N 3.08Å; F871-H873 VanDerWaalsContact C-N 3.25Å; F871-H873 PolarHBondContact O-N 3.44Å; F871-I874 PolarHBondContact O-N 3.22Å; F871-V875 PolarHBondContact O-N 3.35Å
872	D	34.1	Very low	32.8	Very low	116.75 Å²	116.75	136.3 Å²	136.3	62%	0.624	68%	0.684	S	S	*	*			trans	-66.3	170.6	178.7	-100.4	-12.9	0	0	0	111.5	S868 I874 V875 D876	S868-D872 PolarHBondContact O-N 2.92Å; D872-I874 VanDerWaalsContact C-N 3.29Å; D872-I874 PolarHBondContact O-N 3.33Å; D872-V875 PolarHBondContact O-N 2.92Å; D872-D876 WeakPolarHBondContact O-CB 3.49Å; D872-D876 PolarHBondContact O-N 3.09Å
873	H	33.8	Very low	33.1	Very low	139.25 Å²	139.25	136.4 Å²	136.4	65%	0.645	69%	0.685	S	S	*	*			trans	33.6	118.3	168.7	-101.2	-51.2	0	0	0	115	F871 I877	F871-H873 VanDerWaalsContact C-N 3.25Å; F871-H873 PolarHBondContact O-N 3.44Å; H873-I877 WeakPolarHBondContact O-CD1 3.26Å; H873-I877 VanDerWaalsContact O-CG1 3.26Å; H873-I877 WeakPolarHBondContact O-CG1 3.21Å; H873-I877 PolarHBondContact O-N 3.36Å
874	I	36.3	Very low	33.2	Very low	135 Å²	135	135.5 Å²	135.5	69%	0.692	69%	0.685	S	S	*	*			trans	-153.4	88	148.4	-78.3	164.5	0	0	0	110.1	E870 F871 D872 D876 I877 I878	E870-I874 WeakPolarHBondContact O-CG1 3.42Å; F871-I874 PolarHBondContact O-N 3.22Å; D872-I874 VanDerWaalsContact C-N 3.29Å; D872-I874 PolarHBondContact O-N 3.33Å; I874-D876 VanDerWaalsContact C-N 3.32Å; I874-D876 PolarHBondContact O-N 3.15Å; I874-I877 PolarHBondContact O-N 3.01Å; I874-I878 HydrophobicContact CG2-CD1 4.04Å; I874-I878 WeakPolarHBondContact O-CG1 3.44Å; I874-I878 PolarHBondContact O-N 3.47Å; I874-I878 VanDerWaalsContact O-N 3.08Å
875	V	37	Very low	33.5	Very low	116.5 Å²	116.5	132.8 Å²	132.8	71%	0.706	68%	0.683	S	S	*	*				-92.2	119.8	129.5	-170.6	0	0	0	0	109.4	F871 D872 I878 K879	F871-V875 PolarHBondContact O-N 3.35Å; D872-V875 PolarHBondContact O-N 2.92Å; V875-I878 PolarHBondContact O-N 2.74Å; V875-K879 HydrophobicContact CG1-CD 4.13Å; V875-K879 VanDerWaalsContact CG1-CE 3.44Å; V875-K879 WeakPolarHBondContact O-CG 3.44Å; V875-K879 PolarHBondContact O-N 3.21Å
876	D	34.4	Very low	33.5	Very low	120.5 Å²	120.5	129.3 Å²	129.3	64%	0.644	68%	0.68	S	S	*	*			trans	-118.2	-160.5	159.4	-144.4	11.1	0	0	0	111.2	D872 I874 K879 K880	D872-D876 WeakPolarHBondContact O-CB 3.49Å; D872-D876 PolarHBondContact O-N 3.09Å; I874-D876 VanDerWaalsContact C-N 3.32Å; I874-D876 PolarHBondContact O-N 3.15Å; D876-K879 IonicContact OD1-NZ 3.37Å; D876-K880 WeakPolarHBondContact O-CB 3.4Å; D876-K880 WeakPolarHBondContact O-CG 3.11Å; D876-K880 PolarHBondContact O-N 2.98Å
877	I	36.7	Very low	33.5	Very low	125 Å²	125	128.9 Å²	128.9	64%	0.641	68%	0.68	S	S	*	*			trans	2.1	115.3	173.4	-46.9	175.5	0	0	0	113.5	H873 I874 K879 K880 D881	H873-I877 WeakPolarHBondContact O-CD1 3.26Å; H873-I877 VanDerWaalsContact O-CG1 3.26Å; H873-I877 WeakPolarHBondContact O-CG1 3.21Å; H873-I877 PolarHBondContact O-N 3.36Å; I874-I877 PolarHBondContact O-N 3.01Å; I877-K879 VanDerWaalsContact C-N 3.34Å; I877-K879 PolarHBondContact O-N 3.47Å; I877-K880 PolarHBondContact O-N 3.02Å; I877-K880 VanDerWaalsContact O-N 3.13Å; I877-D881 PolarHBondContact O-N 2.95Å; I877-D881 VanDerWaalsContact O-N 3.08Å
878	I	37.5	Very low	33.6	Very low	128 Å²	128	128.6 Å²	128.6	66%	0.656	68%	0.682	S	S	*	*			trans	-133.3	127.1	142.7	-75.4	-176.7	0	0	0	111.8	Q861 I874 V875 T882	Q861-I878 PolarHBondContact NE2-O 2.74Å; I874-I878 HydrophobicContact CG2-CD1 4.04Å; I874-I878 WeakPolarHBondContact O-CG1 3.44Å; I874-I878 PolarHBondContact O-N 3.47Å; I874-I878 VanDerWaalsContact O-N 3.08Å; V875-I878 PolarHBondContact O-N 2.74Å; I878-T882 WeakPolarHBondContact O-CG2 3.19Å; I878-T882 PolarHBondContact O-N 2.93Å; I878-T882 PolarHBondContact O-OG1 2.98Å
879	K	37.6	Very low	33.6	Very low	151 Å²	151	130.7 Å²	130.7	66%	0.657	68%	0.684	S	S	*	*				-126.2	140	91.1	-107.3	170.4	-175.4	175.5	0	109.6	Q861 Q862 V875 D876 I877 T882 H883	Q861-K879 WeakPolarHBondContact CB-O 3.33Å; Q861-K879 VanDerWaalsContact CD-N 3.25Å; Q861-K879 VanDerWaalsContact NE2-N 3.11Å; Q862-K879 VanDerWaalsContact CB-O 3.29Å; Q862-K879 WeakPolarHBondContact CB-O 3.48Å; Q862-K879 WeakPolarHBondContact CG-O 3.42Å; Q862-K879 PolarHBondContact NE2-O 3.32Å; Q862-K879 PolarHBondContact OE1-O 2.85Å; Q862-K879 VanDerWaalsContact OE1-O 3.12Å; V875-K879 HydrophobicContact CG1-CD 4.13Å; V875-K879 VanDerWaalsContact CG1-CE 3.44Å; V875-K879 WeakPolarHBondContact O-CG 3.44Å; V875-K879 PolarHBondContact O-N 3.21Å; D876-K879 IonicContact OD1-NZ 3.37Å; I877-K879 VanDerWaalsContact C-N 3.34Å; I877-K879 PolarHBondContact O-N 3.47Å; K879-T882 WeakPolarHBondContact CA-OG1 3.23Å; K879-T882 PolarHBondContact O-N 2.72Å; K879-T882 PolarHBondContact O-OG1 3.08Å; K879-H883 PolarHBondContact O-CD2 3.47Å
880	K	35	Very low	33.4	Very low	149 Å²	149	131.9 Å²	131.9	65%	0.648	69%	0.688	S	S	*	*			trans	-120.9	162.4	173.8	-129.8	-178.6	167.6	-120.1	0	112.5	Q861 D876 I877	Q861-K880 WeakPolarHBondContact CB-O 3.45Å; Q861-K880 PolarHBondContact N-O 3.38Å; Q861-K880 VanDerWaalsContact N-O 3.12Å; D876-K880 WeakPolarHBondContact O-CB 3.4Å; D876-K880 WeakPolarHBondContact O-CG 3.11Å; D876-K880 PolarHBondContact O-N 2.98Å; I877-K880 PolarHBondContact O-N 3.02Å; I877-K880 VanDerWaalsContact O-N 3.13Å
881	D	34.7	Very low	33.3	Very low	98.25 Å²	98.25	130.7 Å²	130.7	53%	0.525	69%	0.687	S	S	.	*			trans	30.5	150.1	164.8	-66.3	-45.5	0	0	0	114.8	Q860 Q861 Q862 I877	Q860-D881 CarbonylContact C-O 3.27Å; Q861-D881 PolarHBondContact N-O 3.07Å; Q862-D881 PolarHBondContact N-O 3.38Å; Q862-D881 VanDerWaalsContact N-O 3.16Å; Q862-D881 CarbonylContact O-C 3.51Å; I877-D881 PolarHBondContact O-N 2.95Å; I877-D881 VanDerWaalsContact O-N 3.08Å
882	T	35.7	Very low	33.1	Very low	104.5 Å²	104.5	128.7 Å²	128.7	64%	0.641	68%	0.684	S	S	*	*				-129.3	143.6	103.7	34.3	0	0	0	0	112.1	Q862 I878 K879	Q862-T882 VanDerWaalsContact O-CA 3.22Å; Q862-T882 WeakPolarHBondContact O-CA 3.21Å; Q862-T882 PolarHBondContact O-N 3.46Å; I878-T882 WeakPolarHBondContact O-CG2 3.19Å; I878-T882 PolarHBondContact O-N 2.93Å; I878-T882 PolarHBondContact O-OG1 2.98Å; K879-T882 WeakPolarHBondContact CA-OG1 3.23Å; K879-T882 PolarHBondContact O-N 2.72Å; K879-T882 PolarHBondContact O-OG1 3.08Å
883	H	35.6	Very low	33.1	Very low	146.75 Å²	146.75	128.7 Å²	128.7	68%	0.679	69%	0.688	S	S	*	*			trans	-114.3	115.1	150.3	-75.9	-64.4	0	0	0	116.1	K879	K879-H883 PolarHBondContact O-CD2 3.47Å
884	T	32.2	Very low	32.9	Very low	119.75 Å²	119.75	128.6 Å²	128.6	74%	0.735	69%	0.692	S	S	*	*			trans	-94.1	114.5	138.2	-9.1	0	0	0	0	114.6
885	T	31.2	Very low	32.5	Very low	117.5 Å²	117.5	127.7 Å²	127.7	72%	0.721	69%	0.689	S	S	*	*				-161.7	135.7	63.6	26.4	0	0	0	0	112.8
886	N	28.8	Very low	32.2	Very low	139.75 Å²	139.75	130.8 Å²	130.8	75%	0.747	69%	0.693	S	S	*	*			trans	48.8	122.7	151.1	-66.5	-11	0	0	0	117
887	N	29.6	Very low	31.9	Very low	138.5 Å²	138.5	129.3 Å²	129.3	74%	0.741	69%	0.692	S	S	*	*				-175	113.8	102.5	-103	-19.1	0	0	0	111.9
888	T	28.8	Very low	31.5	Very low	113.75 Å²	113.75	133.2 Å²	133.2	70%	0.698	70%	0.698	S	S	*	*				70.5	119.8	109.4	39.6	0	0	0	0	115.6
889	I	30.5	Very low	31.2	Very low	144.5 Å²	144.5	134.3 Å²	134.3	74%	0.741	70%	0.7	S	S	*	*			trans	90.7	112.9	156.4	-67.2	166.6	0	0	0	110.7	D891	I889-D891 PolarHBondContact O-N 3.46Å
890	T	27.7	Very low	30.8	Very low	118.75 Å²	118.75	134.1 Å²	134.1	73%	0.729	70%	0.701	S	S	*	*				124.8	114.8	68.1	25.6	0	0	0	0	111.8
891	D	30.9	Very low	30.5	Very low	142 Å²	142	132.7 Å²	132.7	76%	0.759	71%	0.706	S	S	*	*			trans	-115.4	134.7	143.1	-81.7	-36.6	0	0	0	111.3	I889	I889-D891 PolarHBondContact O-N 3.46Å
892	N	27.3	Very low	30.2	Very low	138 Å²	138	132.8 Å²	132.8	74%	0.738	71%	0.713	S	S	*	*				-177.2	127.5	110.5	-162.6	0.6	0	0	0	112
893	V	32.7	Very low	29.8	Very low	116.25 Å²	116.25	133.7 Å²	133.7	71%	0.705	72%	0.719	S	S	*	*			trans	126.3	105.7	152.5	170.6	0	0	0	0	113.3
894	N	29.7	Very low	29.6	Very low	136.75 Å²	136.75	133.8 Å²	133.8	73%	0.731	72%	0.724	S	S	*	*				93.4	152.6	121.1	-89.3	-42	0	0	0	118.9
895	N	29.3	Very low	29.6	Very low	116.25 Å²	116.25	136.1 Å²	136.1	62%	0.622	73%	0.727	S	S	*	*			trans	83	128	158.2	-87	-42.1	0	0	0	118
896	K	30.3	Very low	29.5	Very low	182 Å²	182	135.9 Å²	135.9	79%	0.791	73%	0.73	S	S	*	*				93.1	143.4	122.7	-79	169	-177.3	158.8	0	116.3
897	S	28.8	Very low	29.6	Very low	88.75 Å²	88.75	134.4 Å²	134.4	62%	0.621	73%	0.73	S	S	*	*				122.7	118.9	112.4	-170.4	0	0	0	0	115.3
898	R	28.4	Very low	29.7	Very low	206.75 Å²	206.75	133.8 Å²	133.8	78%	0.78	73%	0.732	S	S	*	*				55.7	138.3	125.9	-59.6	172.3	-178.6	169.6	-0.5	117.7
899	H	30.3	Very low	29.7	Very low	150.75 Å²	150.75	135 Å²	135	70%	0.698	73%	0.733	S	S	*	*				142.8	144.9	111	-81.4	-74.1	0	0	0	113.8
900	H	29.2	Very low	29.6	Very low	146.75 Å²	146.75	136.1 Å²	136.1	68%	0.679	73%	0.733	S	S	*	*			cis	-141.7	148.9	-1.5	-93.9	-97.2	0	0	0	110.9
901	V	28.6	Very low	29.7	Very low	121.25 Å²	121.25	139.4 Å²	139.4	74%	0.735	74%	0.737	S	S	*	*				70.9	129.4	83.6	173.5	0	0	0	0	112.2	V903	V901-V903 HydrophobicContact CG1-CG2 4.18Å
902	S	28.5	Very low	29.7	Very low	98.5 Å²	98.5	135.8 Å²	135.8	69%	0.689	73%	0.733	S	S	*	*				21.7	148	116.9	5.9	0	0	0	0	113.8
903	V	28	Very low	29.8	Very low	124.75 Å²	124.75	135 Å²	135	76%	0.756	74%	0.739	S	S	*	*				52.7	114.4	106.5	-176.1	0	0	0	0	113.6	V901	V901-V903 HydrophobicContact CG1-CG2 4.18Å
904	D	30.6	Very low	29.6	Very low	148.5 Å²	148.5	133.2 Å²	133.2	79%	0.794	74%	0.736	S	S	*	*				-155.6	157.5	122	-112	-38.7	0	0	0	109.7
905	E	32.5	Very low	29.6	Very low	167.75 Å²	167.75	135.3 Å²	135.3	78%	0.784	74%	0.739	S	S	*	*			trans	-11.1	124.2	157.2	-62	-155	126.2	0	0	115.3	S907	E905-S907 PolarHBondContact O-N 3.02Å; E905-S907 VanDerWaalsContact O-N 3.1Å
906	S	28.1	Very low	29.5	Very low	113 Å²	113	134.8 Å²	134.8	79%	0.79	74%	0.744	S	S	*	*				64.6	98.7	129.7	-5.1	0	0	0	0	116.1
907	S	30.6	Very low	29.5	Very low	108.5 Å²	108.5	131 Å²	131	76%	0.759	74%	0.741	S	S	*	*			trans	140	124.5	145.3	-12.7	0	0	0	0	113.4	E905	E905-S907 PolarHBondContact O-N 3.02Å; E905-S907 VanDerWaalsContact O-N 3.1Å
908	V	32.3	Very low	29.6	Very low	126.75 Å²	126.75	133 Å²	133	77%	0.768	75%	0.75	S	S	*	*				102.6	115.4	69.5	172.2	0	0	0	0	112.8
909	L	29	Very low	29.8	Very low	138.25 Å²	138.25	128.3 Å²	128.3	72%	0.724	75%	0.748	S	S	*	*			trans	-47.5	137.3	137.7	-77.6	159.5	0	0	0	114.2	F911	L909-F911 HydrophobicContact CD2-CD2 4.36Å
910	K	29.3	Very low	29.8	Very low	168.25 Å²	168.25	128.2 Å²	128.2	73%	0.732	75%	0.752	S	S	*	*			trans	142.7	125.1	146.2	-90.3	162.9	-177.8	175	0	115
911	F	29.5	Very low	30	Very low	187.5 Å²	187.5	127 Å²	127	82%	0.822	76%	0.755	S	S	*	*				-16.5	132.2	87	-80.9	-86.2	0	0	0	113	L909	L909-F911 HydrophobicContact CD2-CD2 4.36Å
912	G	29.7	Very low	30.1	Very low	65.5 Å²	65.5	128.9 Å²	128.9	68%	0.675	75%	0.753	S	S	*	*			trans	113.8	125.9	134.6	0	0	0	0	0	115
913	S	29.8	Very low	30.2	Very low	122.5 Å²	122.5	128.9 Å²	128.9	86%	0.857	75%	0.749	S	S	*	*			trans	41	140.2	170.4	65.5	0	0	0	0	117
914	A	29.2	Very low	30.4	Very low	77.5 Å²	77.5	128.2 Å²	128.2	64%	0.64	75%	0.745	S	S	*	*				-172.1	152.3	73.1	0	0	0	0	0	113
915	F	28.9	Very low	30.4	Very low	180.75 Å²	180.75	126 Å²	126	79%	0.793	74%	0.737	S	S	*	*			trans	38	137.4	141.8	-64.7	-80.4	0	0	0	117.9	Y1172 Q1173	F915-Y1172 WeakPolarHBondContact CE1-O 3.14Å; F915-Y1172 WeakPolarHBondContact CZ-O 3.47Å; F915-Q1173 HydrophobicContact CE1-CB 4.31Å; F915-Q1173 HydrophobicContact CE2-CB 3.67Å; F915-Q1173 VanDerWaalsContact CE2-CD 3.49Å; F915-Q1173 HydrophobicContact CE2-CG 3.9Å; F915-Q1173 HydrophobicContact CZ-CB 3.33Å; F915-Q1173 HydrophobicContact CZ-CG 3.58Å
916	S	28.3	Very low	30.7	Very low	105.5 Å²	105.5	123.3 Å²	123.3	74%	0.738	73%	0.734	S	S	*	*				146	154.8	117.8	-70.1	0	0	0	0	112
917	S	30.4	Very low	30.8	Very low	102.75 Å²	102.75	123.6 Å²	123.6	72%	0.719	73%	0.731	S	S	*	*				-174.6	138.7	74.5	-53.8	0	0	0	0	112.6
918	T	30.7	Very low	30.7	Very low	132.25 Å²	132.25	122.9 Å²	122.9	81%	0.811	73%	0.727	S	S	*	*			trans	56.6	113.8	144.8	51.7	0	0	0	0	118.1
919	S	32.1	Very low	30.6	Very low	106.75 Å²	106.75	122.6 Å²	122.6	75%	0.747	73%	0.725	S	S	*	*				169.6	132.1	77.7	123	0	0	0	0	110.9
920	L	30.9	Very low	30.6	Very low	148 Å²	148	121.3 Å²	121.3	78%	0.775	72%	0.723	S	S	*	*				65.4	108.8	117.7	-98.9	83.9	0	0	0	115.7
921	V	32.3	Very low	30.6	Very low	123 Å²	123	120.3 Å²	120.3	75%	0.745	73%	0.725	S	S	*	*				143.4	137.6	75.2	145.5	0	0	0	0	108.7
922	K	31.7	Very low	30.6	Very low	160.25 Å²	160.25	115 Å²	115	70%	0.697	71%	0.711	S	S	*	*				140.5	131.7	60.7	-98.1	174.8	179.2	-171.1	0	112.7
923	T	30.4	Very low	30.6	Very low	99.75 Å²	99.75	119 Å²	119	61%	0.612	72%	0.716	S	S	*	*				67.7	134.9	95.1	10.1	0	0	0	0	117.2	Q1646 Q1647	T923-Q1646 HydrophobicContact CG2-CG 3.96Å; T923-Q1646 VanDerWaalsContact CG2-NE2 3.33Å; T923-Q1647 VanDerWaalsContact C-OE1 3.3Å; T923-Q1647 PolarHBondContact O-NE2 3.16Å
924	T	32.6	Very low	30.7	Very low	108.5 Å²	108.5	116.4 Å²	116.4	67%	0.666	71%	0.71	S	S	*	*				131.2	138.6	117.6	34.8	0	0	0	0	113.9	Q1645 Q1647	T924-Q1645 HydrophobicContact CG2-CB 3.64Å; T924-Q1645 HydrophobicContact CG2-CG 3.96Å; T924-Q1647 VanDerWaalsContact C-CG 3.5Å; T924-Q1647 WeakPolarHBondContact O-CG 3.13Å; T924-Q1647 PolarHBondContact O-NE2 3.18Å
925	T	29.9	Very low	30.7	Very low	102 Å²	102	118 Å²	118	63%	0.626	72%	0.716	S	S	*	*			cis	-155.2	153.9	27.2	23	0	0	0	0	111.8	Q1646 Q1647 Q1648	T925-Q1646 WeakPolarHBondContact CG2-O 3.4Å; T925-Q1646 VanDerWaalsContact OG1-C 3.22Å; T925-Q1646 WeakPolarHBondContact OG1-CA 3.48Å; T925-Q1646 PolarHBondContact OG1-N 3.28Å; T925-Q1646 VanDerWaalsContact OG1-N 3.16Å; T925-Q1647 PolarHBondContact OG1-N 3.24Å; T925-Q1648 HydrophobicContact CG2-CB 4Å
926	P	39.3	Very low	30.6	Very low	111 Å²	111	114.8 Å²	114.8	72%	0.721	72%	0.715	S	S	*	*			trans	-108.9	155.8	160.8	32.1	-21.9	0	0	0	112.4
927	T	29.7	Very low	30.7	Very low	119.75 Å²	119.75	114.4 Å²	114.4	74%	0.735	71%	0.712	S	S	*	*				173.6	135	100.2	25	0	0	0	0	109.7
928	S	28.9	Very low	30.7	Very low	95.25 Å²	95.25	116 Å²	116	67%	0.666	71%	0.712	S	S	*	*				126.7	144.4	70	-56.4	0	0	0	0	113.8
929	T	29.6	Very low	30.5	Very low	120 Å²	120	116.1 Å²	116.1	74%	0.736	71%	0.706	S	S	*	*			trans	114.4	130	149.8	34.7	0	0	0	0	114.2
930	T	28.5	Very low	30.4	Very low	110 Å²	110	115 Å²	115	68%	0.675	70%	0.699	S	S	*	*			cis	130.4	162.5	47.8	32.3	0	0	0	0	113.5
931	I	30.9	Very low	30.3	Very low	148.25 Å²	148.25	118.2 Å²	118.2	76%	0.76	70%	0.701	S	S	*	*			trans	86.4	133.8	143.1	-61.9	161	0	0	0	113.6	Y1652 P1653	I931-Y1652 CarbonylContact C-O 3.22Å; I931-P1653 WeakPolarHBondContact O-CD 3.33Å
932	S	29.3	Very low	30.2	Very low	76.75 Å²	76.75	117.2 Å²	117.2	54%	0.537	69%	0.691	S	S	.	*			cis	-160.2	150.1	7.9	63	0	0	0	0	110.7	K1651	S932-K1651 VanDerWaalsContact OG-CD 3.27Å; S932-K1651 WeakPolarHBondContact OG-CD 3.49Å; S932-K1651 VanDerWaalsContact OG-CE 3.27Å; S932-K1651 WeakPolarHBondContact OG-CE 3.31Å; S932-K1651 PolarHBondContact OG-NZ 3.26Å
933	N	29	Very low	30.1	Very low	147.5 Å²	147.5	115.4 Å²	115.4	79%	0.789	69%	0.685	S	S	*	*				61.4	123.1	104.6	-73.4	-1.2	0	0	0	114.8	S935 P1653	N933-S935 PolarHBondContact O-N 3.14Å; N933-P1653 WeakPolarHBondContact OD1-CD 3.11Å
934	G	31.5	Very low	30.2	Very low	69.25 Å²	69.25	117.3 Å²	117.3	71%	0.714	69%	0.685	S	S	*	*			trans	168.5	123.4	148.3	0	0	0	0	0	111.4
935	S	29.1	Very low	30	Very low	110.5 Å²	110.5	120 Å²	120	77%	0.773	69%	0.688	S	S	*	*				80	138.3	50.9	-0.2	0	0	0	0	114.1	N933	N933-S935 PolarHBondContact O-N 3.14Å
936	C	26.9	Very low	30.3	Very low	114.25 Å²	114.25	119.7 Å²	119.7	77%	0.772	69%	0.687	S	S	*	*			trans	90.8	140.3	160.7	-69.4	0	0	0	0	113.9
937	S	30.6	Very low	29.8	Very low	96 Å²	96	120.7 Å²	120.7	67%	0.671	69%	0.686	S	S	*	*			cis	135.8	150.9	45	-80.3	0	0	0	0	113.1
938	L	30.5	Very low	29.7	Very low	137.5 Å²	137.5	120.2 Å²	120.2	72%	0.72	68%	0.683	S	S	*	*			cis	136.3	159.2	43.6	-74.9	175.1	0	0	0	111.4	Q1175 L1176	L938-Q1175 CarbonylContact C-O 3.54Å; L938-Q1175 VanDerWaalsContact C-O 3.26Å; L938-Q1175 CarbonylContact O-C 3.13Å; L938-L1176 HydrophobicContact CB-CB 4.25Å; L938-L1176 PolarHBondContact O-N 2.96Å
939	L	27.5	Very low	29.8	Very low	133.5 Å²	133.5	122.6 Å²	122.6	70%	0.699	69%	0.687	S	S	*	*			trans	55.9	155.3	153.9	-85.1	95.2	0	0	0	114.5	Q1175	L939-Q1175 HydrophobicContact CB-CB 3.87Å; L939-Q1175 VanDerWaalsContact CD2-OE1 3.25Å; L939-Q1175 PolarHBondContact N-O 2.9Å
940	S	29.2	Very low	29.7	Very low	83.75 Å²	83.75	123.3 Å²	123.3	59%	0.586	69%	0.686	S	S	*	*			cis	-159.4	154.4	-0.3	-128.8	0	0	0	0	111.2
941	R	28.5	Very low	29.7	Very low	216 Å²	216	123.8 Å²	123.8	82%	0.815	69%	0.689	S	S	*	*			trans	66	143.9	131.9	-94.5	175.6	178.1	154.8	-0.7	117.1
942	N	29.8	Very low	29.7	Very low	101.75 Å²	101.75	121.6 Å²	121.6	54%	0.544	69%	0.687	S	S	.	*				148.9	131.4	84.2	-92.5	13.4	0	0	0	113	S1625 F1626	N942-S1625 PolarHBondContact ND2-OG 3.11Å; N942-S1625 PolarHBondContact OD1-OG 3.02Å; N942-F1626 WeakPolarHBondContact ND2-CD2 2.98Å; N942-F1626 WeakPolarHBondContact ND2-CE2 2.66Å; N942-F1626 WeakPolarHBondContact ND2-CZ 3.4Å
943	E	31.1	Very low	29.7	Very low	121.25 Å²	121.25	127.2 Å²	127.2	57%	0.567	70%	0.702	S	S	*	*				85.1	135.5	96	-76.2	172.2	-137	0	0	117.2	H1622 L1623 Y1624 S1625	E943-H1622 PolarHBondContact O-ND1 3.24Å; E943-L1623 HydrophobicContact CB-CB 4.3Å; E943-L1623 HydrophobicContact CB-CD1 3.41Å; E943-L1623 VanDerWaalsContact CB-CD1 3.41Å; E943-L1623 HydrophobicContact CB-CG 3.44Å; E943-L1623 VanDerWaalsContact CB-CG 3.44Å; E943-L1623 HydrophobicContact CG-CG 4.07Å; E943-L1623 WeakPolarHBondContact OE2-CG 3.48Å; E943-Y1624 HydrophobicContact CB-CD1 4.02Å; E943-Y1624 HydrophobicContact CB-CG 4.5Å; E943-Y1624 HydrophobicContact CG-CD1 3.6Å; E943-Y1624 HydrophobicContact CG-CG 3.99Å; E943-Y1624 VanDerWaalsContact CG-N 3.27Å; E943-Y1624 WeakPolarHBondContact OE2-CA 2.87Å; E943-Y1624 PolarHBondContact OE2-N 2.81Å; E943-S1625 WeakPolarHBondContact OE2-CB 3.38Å
944	K	32.7	Very low	30	Very low	140 Å²	140	125.8 Å²	125.8	61%	0.609	70%	0.701	S	S	*	*				-176.9	161	64	-116.7	164.9	-159.3	164.8	0	112.7	H1622 L1623 Y1624	K944-H1622 VanDerWaalsContact C-CG 3.44Å; K944-H1622 HydrophobicContact CB-CB 3.92Å; K944-H1622 PolarHBondContact O-CE1 2.71Å; K944-H1622 PolarHBondContact O-ND1 3.11Å; K944-H1622 PolarHBondContact O-NE2 3.25Å; K944-L1623 VanDerWaalsContact CB-C 3.49Å; K944-L1623 VanDerWaalsContact CB-CA 3.45Å; K944-L1623 VanDerWaalsContact CD-O 3.26Å; K944-L1623 WeakPolarHBondContact CD-O 3.13Å; K944-L1623 WeakPolarHBondContact CE-O 3.03Å; K944-L1623 PolarHBondContact NZ-O 3.23Å; K944-Y1624 HydrophobicContact CB-CD1 4.3Å; K944-Y1624 HydrophobicContact CB-CD2 3.71Å; K944-Y1624 HydrophobicContact CB-CE2 4.12Å; K944-Y1624 HydrophobicContact CB-CG 3.77Å; K944-Y1624 HydrophobicContact CG-CD2 3.56Å; K944-Y1624 HydrophobicContact CG-CE2 3.99Å; K944-Y1624 HydrophobicContact CG-CG 4.09Å
945	F	27.1	Very low	30	Very low	166 Å²	166	127.1 Å²	127.1	73%	0.728	70%	0.699	S	S	*	*			trans	-62.6	163	157.4	-84.7	-98.4	0	0	0	111.3	L947 E1621 H1622 Y1624	F945-L947 HydrophobicContact CD1-CB 4.14Å; F945-L947 HydrophobicContact CD1-CD1 3.68Å; F945-L947 HydrophobicContact CD1-CG 3.65Å; F945-L947 HydrophobicContact CE1-CD1 4.02Å; F945-L947 HydrophobicContact CE1-CG 3.93Å; F945-L947 HydrophobicContact CG-CD1 4.48Å; F945-E1621 CarbonylContact O-C 3.46Å; F945-H1622 VanDerWaalsContact CA-CD2 3.43Å; F945-H1622 WeakPolarHBondContact CA-CD2 3.32Å; F945-H1622 WeakPolarHBondContact CA-NE2 3.08Å; F945-H1622 PolarHBondContact N-CD2 3.33Å; F945-H1622 VanDerWaalsContact N-CG 3.28Å; F945-H1622 PolarHBondContact N-NE2 3.43Å; F945-Y1624 HydrophobicContact CD2-CE2 4.44Å
946	P	36.2	Very low	30.1	Very low	95.75 Å²	95.75	130 Å²	130	62%	0.622	70%	0.7	S	S	*	*			cis	-122.8	179.3	-12.1	30.3	-13.9	0	0	0	113.4	E1621	P946-E1621 PolarHBondContact O-N 2.78Å
947	L	28.1	Very low	30.4	Very low	131.25 Å²	131.25	130.1 Å²	130.1	69%	0.687	70%	0.698	S	S	*	*				126.3	138.5	92.2	-87.1	166.1	0	0	0	114.2	F945 Q1620 E1621	F945-L947 HydrophobicContact CD1-CB 4.14Å; F945-L947 HydrophobicContact CD1-CD1 3.68Å; F945-L947 HydrophobicContact CD1-CG 3.65Å; F945-L947 HydrophobicContact CE1-CD1 4.02Å; F945-L947 HydrophobicContact CE1-CG 3.93Å; F945-L947 HydrophobicContact CG-CD1 4.48Å; L947-Q1620 HydrophobicContact CD1-CB 4.23Å; L947-Q1620 HydrophobicContact CD1-CG 3.72Å; L947-E1621 PolarHBondContact N-OE1 3.19Å
948	T	28.9	Very low	30.4	Very low	110.25 Å²	110.25	131 Å²	131	68%	0.676	70%	0.699	S	S	*	*			trans	102.5	139.8	141.3	4.8	0	0	0	0	115.2
949	I	30	Very low	30.3	Very low	145 Å²	145	132.2 Å²	132.2	74%	0.744	70%	0.703	S	S	*	*				-155.3	139.9	72.1	-87	178.3	0	0	0	113.9
950	N	27.8	Very low	30.3	Very low	134.5 Å²	134.5	132.3 Å²	132.3	72%	0.719	70%	0.704	S	S	*	*			trans	41.2	135.5	156.4	-70.3	-0.8	0	0	0	118.4
951	T	29.8	Very low	30.5	Very low	121.25 Å²	121.25	134.8 Å²	134.8	74%	0.744	71%	0.709	S	S	*	*				133.1	133.7	95.7	39.4	0	0	0	0	113.4
952	S	29.7	Very low	30.6	Very low	101.5 Å²	101.5	129.4 Å²	129.4	71%	0.71	70%	0.7	S	S	*	*				90.2	122.8	75.2	58	0	0	0	0	117.3
953	F	29.5	Very low	30.6	Very low	195.25 Å²	195.25	129.9 Å²	129.9	86%	0.856	70%	0.703	S	S	*	*			trans	-20	158.6	155	-71.9	-89	0	0	0	115.1
954	P	35	Very low	30.6	Very low	118 Å²	118	130.7 Å²	130.7	77%	0.766	71%	0.706	S	S	*	*				-120	146.4	68.8	36.2	-26	0	0	0	115.7
955	S	32	Very low	30.5	Very low	96.25 Å²	96.25	126.6 Å²	126.6	67%	0.673	70%	0.704	S	S	*	*			trans	-93.7	142.1	141.2	111.7	0	0	0	0	110.8
956	E	31.1	Very low	30.7	Very low	171 Å²	171	124 Å²	124	80%	0.799	70%	0.702	S	S	*	*				-154.2	163.9	82	-126.1	144.9	-129.3	0	0	108.9
957	T	33.2	Very low	30.5	Very low	117.25 Å²	117.25	125.5 Å²	125.5	72%	0.719	71%	0.709	S	S	*	*				-139.4	130.2	-77	-24.8	0	0	0	0	112.6
958	T	29.6	Very low	31.2	Very low	114.5 Å²	114.5	123.6 Å²	123.6	70%	0.702	71%	0.705	S	S	*	*				20.8	135.9	122.2	-7.9	0	0	0	0	116.7	L960	T958-L960 HydrophobicContact CG2-CD1 3.7Å; T958-L960 HydrophobicContact CG2-CG 3.88Å
959	M	28.9	Very low	31.4	Very low	162 Å²	162	122.9 Å²	122.9	80%	0.798	70%	0.702	S	S	*	*				-180	132.7	116	-92.4	179.6	172.6	0	0	111.6
960	L	28.8	Very low	31.5	Very low	136.5 Å²	136.5	122 Å²	122	72%	0.715	70%	0.698	S	S	*	*				84.7	145.2	56.8	-83.7	173	0	0	0	115.1	T958	T958-L960 HydrophobicContact CG2-CD1 3.7Å; T958-L960 HydrophobicContact CG2-CG 3.88Å
961	I	32.4	Very low	31.6	Very low	136 Å²	136	123.4 Å²	123.4	70%	0.697	70%	0.698	S	S	*	*			trans	97	113	149.9	-69	162.2	0	0	0	113.1
962	T	31	Very low	31.7	Very low	102.5 Å²	102.5	124.3 Å²	124.3	63%	0.629	69%	0.693	S	S	*	*				62.1	153.6	120.6	66.7	0	0	0	0	115.4
963	D	29.6	Very low	31.7	Very low	111.5 Å²	111.5	124.8 Å²	124.8	60%	0.596	69%	0.692	S	S	*	*			cis	172.1	153.8	30.4	-128.9	-24.4	0	0	0	115.3
964	Q	30.3	Very low	31.9	Very low	137.5 Å²	137.5	120 Å²	120	64%	0.643	68%	0.683	S	S	*	*			trans	42.7	131	161.4	-50	-71.1	-27.5	0	0	121.2
965	G	31.8	Very low	31.6	Very low	54.25 Å²	54.25	121.4 Å²	121.4	56%	0.559	68%	0.683	S	S	*	*			trans	124.5	89	140.4	0	0	0	0	0	120.4
966	T	31.5	Very low	31.8	Very low	112.75 Å²	112.75	122.1 Å²	122.1	69%	0.692	69%	0.685	S	S	*	*			trans	31.9	141.9	153	58.7	0	0	0	0	119.8
967	T	31.5	Very low	31.8	Very low	125.75 Å²	125.75	118.7 Å²	118.7	77%	0.771	68%	0.68	S	S	*	*			trans	-58.7	177.8	146.8	64.3	0	0	0	0	113.6
968	P	42.4	Very low	31.7	Very low	91.5 Å²	91.5	118 Å²	118	59%	0.594	68%	0.68	S	S	*	*			cis	-117.6	177.3	-36	39.8	-24.4	0	0	0	113.9
969	P	33.9	Very low	31.9	Very low	96.25 Å²	96.25	119.7 Å²	119.7	63%	0.625	68%	0.683	S	S	*	*			trans	-139.9	147.5	152.9	33.6	-15.8	0	0	0	116.6
970	I	30.6	Very low	32	Very low	126.75 Å²	126.75	120 Å²	120	65%	0.65	68%	0.682	S	S	*	*				60.3	142.1	88.1	-52.5	170.6	0	0	0	115.8
971	K	31.3	Very low	32	Very low	163 Å²	163	118.1 Å²	118.1	71%	0.709	68%	0.68	S	S	*	*			trans	139.6	133.8	156.6	-77.5	-170.6	170.2	-173.8	0	114.9
972	H	30.7	Very low	32	Very low	140.25 Å²	140.25	118.8 Å²	118.8	65%	0.649	68%	0.684	S	S	*	*				132.8	151.8	110.9	-83.3	-73.5	0	0	0	113.4	L1607 L1608 G1609	H972-L1607 PolarHBondContact CE1-O 3.42Å; H972-L1607 PolarHBondContact NE2-O 3.43Å; H972-L1608 PolarHBondContact CE1-N 3.43Å; H972-G1609 VanDerWaalsContact CA-O 3.29Å; H972-G1609 WeakPolarHBondContact CA-O 2.8Å
973	T	31.3	Very low	32	Very low	112.25 Å²	112.25	118.7 Å²	118.7	69%	0.689	69%	0.688	S	S	*	*			trans	-157.4	154.7	150.5	34.7	0	0	0	0	115.4	L975 L1608	T973-L975 HydrophobicContact CG2-CD1 4.03Å; T973-L975 HydrophobicContact CG2-CG 4.45Å; T973-L1608 HydrophobicContact CG2-CB 4.45Å; T973-L1608 VanDerWaalsContact CG2-O 3.29Å; T973-L1608 WeakPolarHBondContact CG2-O 3.27Å
974	S	32.3	Very low	32.1	Very low	94 Å²	94	120.6 Å²	120.6	66%	0.657	70%	0.697	S	S	*	*				173.7	142.5	55.8	46.4	0	0	0	0	113	Y1584	S974-Y1584 WeakPolarHBondContact CB-O 3.45Å; S974-Y1584 PolarHBondContact OG-O 3.08Å
975	L	30.2	Very low	32.2	Very low	148.25 Å²	148.25	118.4 Å²	118.4	78%	0.776	70%	0.697	S	S	*	*				61	160.9	111.6	-85.2	118.9	0	0	0	114.5	T973 S977	T973-L975 HydrophobicContact CG2-CD1 4.03Å; T973-L975 HydrophobicContact CG2-CG 4.45Å; L975-S977 WeakPolarHBondContact CD2-OG 3.22Å
976	P	36	Very low	32.2	Very low	110.5 Å²	110.5	123.2 Å²	123.2	72%	0.718	71%	0.708	S	S	*	*			cis	-134.1	161.8	13.9	34.7	-16.2	0	0	0	116.4
977	S	29.9	Very low	32.2	Very low	98.5 Å²	98.5	125 Å²	125	69%	0.689	71%	0.712	S	S	*	*			trans	31.7	150.2	143.2	7.4	0	0	0	0	119.6	L975	L975-S977 WeakPolarHBondContact CD2-OG 3.22Å
978	S	32.6	Very low	32.1	Very low	102.5 Å²	102.5	124 Å²	124	72%	0.717	71%	0.707	S	S	*	*			cis	-177.1	150	35.8	-11	0	0	0	0	113.6
979	I	33.1	Very low	31.6	Very low	152 Å²	152	125.9 Å²	125.9	78%	0.779	72%	0.716	S	S	*	*			trans	88.3	115	137.3	-68.6	168	0	0	0	117.3
980	H	30	Very low	31.4	Very low	166.75 Å²	166.75	126.6 Å²	126.6	77%	0.772	72%	0.722	S	S	*	*				66.5	133.3	129.6	-101.8	-104	0	0	0	121.2
981	C	30	Very low	31.4	Very low	97.5 Å²	97.5	125.4 Å²	125.4	66%	0.659	73%	0.725	S	S	*	*				171.4	144.4	75.3	-110.2	0	0	0	0	116.4
982	L	32.7	Very low	31.4	Very low	150.75 Å²	150.75	124 Å²	124	79%	0.789	73%	0.725	S	S	*	*			trans	59.6	107.2	144.6	-66.3	165.6	0	0	0	120.6
983	S	31	Very low	31.4	Very low	100.75 Å²	100.75	126 Å²	126	71%	0.705	73%	0.732	S	S	*	*				18	147.7	129.2	55.5	0	0	0	0	115.6
984	N	31.8	Very low	31.2	Very low	150.25 Å²	150.25	129.5 Å²	129.5	80%	0.803	74%	0.738	S	S	*	*				-175.3	138.6	124.8	-101.9	-9.1	0	0	0	112.5
985	S	31.7	Very low	31.2	Very low	91 Å²	91	131.8 Å²	131.8	64%	0.636	74%	0.742	S	S	*	*				120.8	144.2	61.1	53.4	0	0	0	0	114.9
986	I	31.1	Very low	31	Very low	155.5 Å²	155.5	131 Å²	131	80%	0.797	74%	0.739	S	S	*	*			trans	80.8	142.1	149.5	-54.5	171.6	0	0	0	112.3	T988	I986-T988 HydrophobicContact CG2-CG2 4.1Å
987	I	31.9	Very low	30.6	Very low	151 Å²	151	130.2 Å²	130.2	77%	0.774	74%	0.736	S	S	*	*			trans	-169.4	128.8	161.7	-86.1	166.3	0	0	0	110
988	T	30.2	Very low	30.6	Very low	105.75 Å²	105.75	130.5 Å²	130.5	65%	0.649	74%	0.738	S	S	*	*				143.5	138.8	104.2	28.3	0	0	0	0	115.1	I986	I986-T988 HydrophobicContact CG2-CG2 4.1Å
989	T	30.8	Very low	30.4	Very low	130.75 Å²	130.75	131.8 Å²	131.8	80%	0.802	74%	0.741	S	S	*	*			trans	166.8	139.6	141.1	24.4	0	0	0	0	110.3
990	C	29.6	Very low	30.2	Very low	109.75 Å²	109.75	132.6 Å²	132.6	74%	0.742	74%	0.742	S	S	*	*			cis	143.7	133.4	29.2	-77	0	0	0	0	113.4
991	S	31.4	Very low	30	Very low	102 Å²	102	135.2 Å²	135.2	71%	0.713	75%	0.745	S	S	*	*			cis	-177.8	163.5	35.9	-93.6	0	0	0	0	115.1
992	N	30.1	Very low	29.9	Very low	133.75 Å²	133.75	134.9 Å²	134.9	72%	0.715	74%	0.744	S	S	*	*			trans	-1.9	149.4	-174.5	-57.3	-65.7	0	0	0	116
993	K	31.3	Very low	29.7	Very low	183.25 Å²	183.25	135.2 Å²	135.2	80%	0.797	74%	0.741	S	S	*	*				-169.8	136.1	53.5	-104	161.2	-175.1	170.3	0	108.3
994	F	28	Very low	29.6	Very low	184.5 Å²	184.5	136.9 Å²	136.9	81%	0.809	74%	0.742	S	S	*	*				57.1	134.1	91.8	-87.1	-92.4	0	0	0	115.9
995	L	31.4	Very low	29.4	Very low	142.75 Å²	142.75	138.1 Å²	138.1	75%	0.747	74%	0.74	S	S	*	*				139.4	140.7	115.3	-81.7	160.6	0	0	0	116.1
996	N	27	Very low	29.3	Very low	132.5 Å²	132.5	136.7 Å²	136.7	71%	0.709	74%	0.741	S	S	*	*			trans	62.2	148.1	137.2	-88.2	0.3	0	0	0	120.1	N450	N450-N996 HydrophobicContact CB-CB 3.86Å; N450-N996 PolarHBondContact OD1-ND2 2.75Å
997	S	28	Very low	29.1	Very low	92 Å²	92	136.6 Å²	136.6	64%	0.643	74%	0.741	S	S	*	*			trans	82.9	121.6	139.8	39.2	0	0	0	0	119.1	T999	S997-T999 PolarHBondContact O-N 2.91Å
998	S	27.8	Very low	29	Very low	104.75 Å²	104.75	136.6 Å²	136.6	73%	0.733	74%	0.739	S	S	*	*				52	143.8	119.6	64.1	0	0	0	0	117.4
999	T	28.8	Very low	29	Very low	129.5 Å²	129.5	138.1 Å²	138.1	79%	0.794	74%	0.743	S	S	*	*			trans	130.6	146.2	140.9	29.5	0	0	0	0	114.6	S997	S997-T999 PolarHBondContact O-N 2.91Å
1000	Q	29.2	Very low	28.9	Very low	170.75 Å²	170.75	137.7 Å²	137.7	80%	0.798	74%	0.736	S	S	*	*			trans	-95	136.3	150.1	-79.3	172.6	-14.8	0	0	113.6
1001	R	26.4	Very low	28.8	Very low	221.2 Å²	221.2	137.8 Å²	137.8	84%	0.835	73%	0.73	S	S	*	*				87.9	125.9	113.2	-96.6	-177.4	170.4	-176.9	-4.3	117.5
1002	S	28.5	Very low	28.8	Very low	89.6 Å²	89.6	138.4 Å²	138.4	63%	0.627	72%	0.724	S	S	*	*				85.6	140.9	119.9	-64.1	0	0	0	0	118.5
1003	E	28.1	Very low	28.9	Very low	157.4 Å²	157.4	141 Å²	141	74%	0.736	72%	0.724	S	S	*	*			cis	161.3	134.1	23.2	-80	162.4	176.2	0	0	113.2	F1005	E1003-F1005 HydrophobicContact CB-CE2 4Å; E1003-F1005 WeakPolarHBondContact O-CD2 3.46Å; E1003-F1005 WeakPolarHBondContact O-CE2 3.33Å
1004	L	28.4	Very low	28.8	Very low	137.6 Å²	137.6	143 Å²	143	72%	0.72	73%	0.727	S	S	*	*				70.7	148.6	101.3	-130.7	83.4	0	0	0	116.4	I468	I468-L1004 HydrophobicContact CD1-CB 4.33Å; I468-L1004 HydrophobicContact CD1-CD2 4.45Å; I468-L1004 HydrophobicContact CD1-CG 4.44Å; I468-L1004 HydrophobicContact CG2-CD2 4.07Å
1005	F	28.1	Very low	28.9	Very low	174.6 Å²	174.6	140 Å²	140	77%	0.766	72%	0.715	S	S	*	*			trans	72.3	134.1	166.1	-64.8	-80.4	0	0	0	118.3	N466 T467 I468 E1003	N466-F1005 HydrophobicContact CB-CB 3.4Å; N466-F1005 PolarHBondContact ND2-O 3.18Å; N466-F1005 VanDerWaalsContact ND2-O 3.17Å; N466-F1005 VanDerWaalsContact O-CB 3.31Å; N466-F1005 WeakPolarHBondContact O-CB 3.42Å; N466-F1005 VanDerWaalsContact O-CD1 3.3Å; N466-F1005 WeakPolarHBondContact O-CD1 3.06Å; N466-F1005 WeakPolarHBondContact O-CG 3.44Å; T467-F1005 HydrophobicContact CG2-CD1 3.96Å; T467-F1005 HydrophobicContact CG2-CE1 4.17Å; I468-F1005 HydrophobicContact CB-CD1 4.32Å; I468-F1005 VanDerWaalsContact CD1-N 3.28Å; E1003-F1005 HydrophobicContact CB-CE2 4Å; E1003-F1005 WeakPolarHBondContact O-CD2 3.46Å; E1003-F1005 WeakPolarHBondContact O-CE2 3.33Å
1006	G	28.6	Very low	28.9	Very low	62.8 Å²	62.8	138.1 Å²	138.1	65%	0.647	71%	0.711	S	S	*	*			trans	162.2	114	146.4	0	0	0	0	0	116.9	T467 I468	T467-G1006 VanDerWaalsContact C-CA 3.45Å; T467-G1006 WeakPolarHBondContact O-CA 3.43Å; I468-G1006 VanDerWaalsContact CG1-O 3.26Å; I468-G1006 WeakPolarHBondContact CG1-O 3.29Å
1007	L	28.5	Very low	28.9	Very low	152.4 Å²	152.4	137.9 Å²	137.9	80%	0.798	71%	0.709	S	S	*	*				86.9	143.5	114	-70.7	176	0	0	0	116	I468 V470	I468-L1007 HydrophobicContact CD1-CG 4.43Å; I468-L1007 HydrophobicContact CG1-CB 4.12Å; I468-L1007 HydrophobicContact CG1-CG 3.95Å; V470-L1007 HydrophobicContact CG2-CD1 4.41Å
1008	M	28.4	Very low	28.9	Very low	150.4 Å²	150.4	137.6 Å²	137.6	74%	0.741	71%	0.707	S	S	*	*			trans	83.4	118.6	148.7	-87.1	154.8	62.8	0	0	116.3
1009	N	30.1	Very low	28.9	Very low	137.4 Å²	137.4	138.8 Å²	138.8	74%	0.735	71%	0.706	S	S	*	*				154.4	141.1	90	-98.9	6.1	0	0	0	112.6
1010	N	28.4	Very low	29.1	Very low	123 Å²	123	137.4 Å²	137.4	66%	0.658	70%	0.699	S	S	*	*			trans	64	148.4	141.1	-62.5	3.7	0	0	0	115.1
1011	D	29.2	Very low	29	Very low	112.2 Å²	112.2	135.2 Å²	135.2	60%	0.6	70%	0.697	S	S	*	*				91.3	150	88	-54.5	-35.5	0	0	0	114.4	H1438 Q1439 Q1640	D1011-H1438 HydrophobicContact CB-CB 4.35Å; D1011-H1438 IonicContact OD1-CG 3.54Å; D1011-H1438 IonicContact OD1-ND1 3.31Å; D1011-H1438 PolarHBondContact OD1-ND1 3.36Å; D1011-H1438 IonicContact OD2-CE1 3.23Å; D1011-H1438 PolarHBondContact OD2-CE1 2.74Å; D1011-H1438 VanDerWaalsContact OD2-CE1 3.24Å; D1011-H1438 IonicContact OD2-ND1 3.82Å; D1011-H1438 PolarHBondContact OD2-ND1 3.36Å; D1011-H1438 VanDerWaalsContact OD2-ND1 3.1Å; D1011-Q1439 PolarHBondContact O-NE2 3.23Å; D1011-Q1439 VanDerWaalsContact O-NE2 3.14Å; D1011-Q1640 VanDerWaalsContact CG-NE2 3.3Å; D1011-Q1640 PolarHBondContact OD1-NE2 2.75Å; D1011-Q1640 PolarHBondContact OD2-NE2 3.07Å
1012	D	31.1	Very low	29	Very low	113.4 Å²	113.4	131.9 Å²	131.9	61%	0.606	70%	0.696	S	S	*	*			cis	116.4	142.8	46.4	-89	-5.1	0	0	0	112.3	R1437 H1438 Q1439	D1012-R1437 VanDerWaalsContact CB-O 3.31Å; D1012-R1437 WeakPolarHBondContact CB-O 3.39Å; D1012-R1437 IonicContact OD1-CZ 2.65Å; D1012-R1437 IonicContact OD1-NH1 3.24Å; D1012-R1437 PolarHBondContact OD1-NH1 3.25Å; D1012-R1437 IonicContact OD1-NH2 3.79Å; D1012-R1437 PolarHBondContact OD1-NH2 3.24Å; D1012-R1437 IonicContact OD2-CZ 2.67Å; D1012-R1437 VanDerWaalsContact OD2-CZ 3.31Å; D1012-R1437 IonicContact OD2-NH1 3.42Å; D1012-R1437 PolarHBondContact OD2-NH1 3.23Å; D1012-R1437 IonicContact OD2-NH2 3.62Å; D1012-R1437 PolarHBondContact OD2-NH2 2.79Å; D1012-H1438 IonicContact OD2-CD2 3.86Å; D1012-H1438 PolarHBondContact OD2-CD2 3.04Å; D1012-H1438 IonicContact OD2-CG 3.1Å; D1012-H1438 IonicContact OD2-NE2 3.32Å; D1012-Q1439 WeakPolarHBondContact O-CB 3.14Å; D1012-Q1439 VanDerWaalsContact O-CD 3.27Å; D1012-Q1439 WeakPolarHBondContact O-CG 3.42Å; D1012-Q1439 PolarHBondContact O-NE2 2.73Å
1013	W	30.6	Very low	29	Very low	188.8 Å²	188.8	132.3 Å²	132.3	72%	0.715	70%	0.699	S	S	*	*				115.1	125.8	64.5	-88.3	32.2	0	0	0	115.5	H1015 I1017	W1013-H1015 HydrophobicContact CB-CB 3.72Å; W1013-H1015 AromaticContact CD1-CD2 3.66Å; W1013-H1015 AromaticContact CD1-CG 3.69Å; W1013-H1015 AromaticContact CD1-ND1 3.9Å; W1013-H1015 AromaticContact CD1-NE2 3.81Å; W1013-H1015 HydrophobicContact CD2-CB 3.77Å; W1013-H1015 AromaticContact CD2-CD2 3.48Å; W1013-H1015 VanDerWaalsContact CD2-CD2 3.48Å; W1013-H1015 AromaticContact CD2-CE1 3.56Å; W1013-H1015 AromaticContact CD2-CG 3.64Å; W1013-H1015 AromaticContact CD2-ND1 3.43Å; W1013-H1015 AromaticContact CD2-NE2 3.63Å; W1013-H1015 AromaticContact CE2-CD2 3.92Å; W1013-H1015 AromaticContact CE2-CE1 3.42Å; W1013-H1015 VanDerWaalsContact CE2-CE1 3.42Å; W1013-H1015 AromaticContact CE2-CG 3.72Å; W1013-H1015 AromaticContact CE2-ND1 3.84Å; W1013-H1015 AromaticContact CE2-NE2 3.54Å; W1013-H1015 HydrophobicContact CE3-CB 3.79Å; W1013-H1015 AromaticContact CE3-CE1 3.81Å; W1013-H1015 AromaticContact CE3-CG 3.39Å; W1013-H1015 AromaticContact CE3-ND1 3.27Å; W1013-H1015 VanDerWaalsContact CE3-ND1 3.27Å; W1013-H1015 HydrophobicContact CG-CB 4.06Å; W1013-H1015 AromaticContact CG-CD2 3.29Å; W1013-H1015 AromaticContact CG-CG 3.77Å; W1013-H1015 AromaticContact CG-NE2 3.72Å; W1013-H1015 HydrophobicContact CH2-CB 4.27Å; W1013-H1015 AromaticContact CH2-CE1 3.8Å; W1013-H1015 AromaticContact CH2-ND1 3.8Å; W1013-H1015 HydrophobicContact CZ2-CB 3.96Å; W1013-H1015 AromaticContact CZ2-CE1 3.57Å; W1013-H1015 AromaticContact CZ2-ND1 3.97Å; W1013-H1015 HydrophobicContact CZ3-CB 4.35Å; W1013-H1015 AromaticContact CZ3-CE1 3.92Å; W1013-H1015 AromaticContact CZ3-ND1 3.45Å; W1013-H1015 WeakPolarHBondContact CZ3-ND1 3.46Å; W1013-H1015 AromaticContact NE1-CE1 3.93Å; W1013-H1015 AromaticContact NE1-CG 3.52Å; W1013-H1015 AromaticContact NE1-ND1 3.43Å; W1013-H1015 PolarHBondContact NE1-ND1 2.59Å; W1013-H1015 AromaticContact NE1-NE2 3.61Å; W1013-I1017 HydrophobicContact CH2-CD1 3.7Å; W1013-I1017 HydrophobicContact CH2-CG1 3.9Å; W1013-I1017 HydrophobicContact CZ2-CD1 3.96Å; W1013-I1017 HydrophobicContact CZ2-CG1 3.61Å
1014	W	30.2	Very low	29.1	Very low	226.2 Å²	226.2	131.5 Å²	131.5	86%	0.857	70%	0.699	S	S	*	*				-155.5	133.5	129.8	-84.5	97.7	0	0	0	115.9	N1436	W1014-N1436 PolarHBondContact O-ND2 2.92Å
1015	H	30.9	Very low	29.4	Very low	120.2 Å²	120.2	132.7 Å²	132.7	56%	0.556	70%	0.701	S	S	*	*			trans	-142.9	157.8	-173.9	-84.3	-87.9	0	0	0	112.5	W1013 I1017 N1436 R1437	W1013-H1015 HydrophobicContact CB-CB 3.72Å; W1013-H1015 AromaticContact CD1-CD2 3.66Å; W1013-H1015 AromaticContact CD1-CG 3.69Å; W1013-H1015 AromaticContact CD1-ND1 3.9Å; W1013-H1015 AromaticContact CD1-NE2 3.81Å; W1013-H1015 HydrophobicContact CD2-CB 3.77Å; W1013-H1015 AromaticContact CD2-CD2 3.48Å; W1013-H1015 VanDerWaalsContact CD2-CD2 3.48Å; W1013-H1015 AromaticContact CD2-CE1 3.56Å; W1013-H1015 AromaticContact CD2-CG 3.64Å; W1013-H1015 AromaticContact CD2-ND1 3.43Å; W1013-H1015 AromaticContact CD2-NE2 3.63Å; W1013-H1015 AromaticContact CE2-CD2 3.92Å; W1013-H1015 AromaticContact CE2-CE1 3.42Å; W1013-H1015 VanDerWaalsContact CE2-CE1 3.42Å; W1013-H1015 AromaticContact CE2-CG 3.72Å; W1013-H1015 AromaticContact CE2-ND1 3.84Å; W1013-H1015 AromaticContact CE2-NE2 3.54Å; W1013-H1015 HydrophobicContact CE3-CB 3.79Å; W1013-H1015 AromaticContact CE3-CE1 3.81Å; W1013-H1015 AromaticContact CE3-CG 3.39Å; W1013-H1015 AromaticContact CE3-ND1 3.27Å; W1013-H1015 VanDerWaalsContact CE3-ND1 3.27Å; W1013-H1015 HydrophobicContact CG-CB 4.06Å; W1013-H1015 AromaticContact CG-CD2 3.29Å; W1013-H1015 AromaticContact CG-CG 3.77Å; W1013-H1015 AromaticContact CG-NE2 3.72Å; W1013-H1015 HydrophobicContact CH2-CB 4.27Å; W1013-H1015 AromaticContact CH2-CE1 3.8Å; W1013-H1015 AromaticContact CH2-ND1 3.8Å; W1013-H1015 HydrophobicContact CZ2-CB 3.96Å; W1013-H1015 AromaticContact CZ2-CE1 3.57Å; W1013-H1015 AromaticContact CZ2-ND1 3.97Å; W1013-H1015 HydrophobicContact CZ3-CB 4.35Å; W1013-H1015 AromaticContact CZ3-CE1 3.92Å; W1013-H1015 AromaticContact CZ3-ND1 3.45Å; W1013-H1015 WeakPolarHBondContact CZ3-ND1 3.46Å; W1013-H1015 AromaticContact NE1-CE1 3.93Å; W1013-H1015 AromaticContact NE1-CG 3.52Å; W1013-H1015 AromaticContact NE1-ND1 3.43Å; W1013-H1015 PolarHBondContact NE1-ND1 2.59Å; W1013-H1015 AromaticContact NE1-NE2 3.61Å; H1015-I1017 HydrophobicContact CB-CD1 4.32Å; H1015-I1017 HydrophobicContact CB-CG1 4.22Å; H1015-I1017 PolarHBondContact ND1-N 2.96Å; H1015-N1436 PolarHBondContact CE1-O 3.09Å; H1015-N1436 VanDerWaalsContact CE1-O 3.22Å; H1015-N1436 WeakPolarHBondContact NE2-CB 3.43Å; H1015-N1436 PolarHBondContact NE2-O 2.9Å; H1015-R1437 PolarHBondContact NE2-N 3.33Å
1016	P	30.4	Very low	29.5	Very low	102.4 Å²	102.4	129.9 Å²	129.9	67%	0.665	69%	0.694	S	S	*	*				-116.2	151.8	114.4	27.6	-16.7	0	0	0	111.7	Y1434	P1016-Y1434 HydrophobicContact CB-CE1 3.96Å
1017	I	27.7	Very low	29.7	Very low	129.4 Å²	129.4	133.5 Å²	133.5	66%	0.664	70%	0.699	S	S	*	*				85	111.1	121.8	-71	170.4	0	0	0	110.3	W1013 H1015 H1234 Q1235 Y1434	W1013-I1017 HydrophobicContact CH2-CD1 3.7Å; W1013-I1017 HydrophobicContact CH2-CG1 3.9Å; W1013-I1017 HydrophobicContact CZ2-CD1 3.96Å; W1013-I1017 HydrophobicContact CZ2-CG1 3.61Å; H1015-I1017 HydrophobicContact CB-CD1 4.32Å; H1015-I1017 HydrophobicContact CB-CG1 4.22Å; H1015-I1017 PolarHBondContact ND1-N 2.96Å; I1017-H1234 CarbonylContact O-C 3.45Å; I1017-Q1235 HydrophobicContact CG2-CB 4.5Å; I1017-Q1235 VanDerWaalsContact O-CA 3.32Å; I1017-Q1235 WeakPolarHBondContact O-CA 3.39Å; I1017-Y1434 WeakPolarHBondContact O-CE1 3.33Å
1018	S	28	Very low	29.9	Very low	86 Å²	86	133.4 Å²	133.4	60%	0.601	70%	0.698	S	S	*	*			trans	-104.5	134.2	169.2	58.1	0	0	0	0	114.8	H1234 Q1235 H1236 Y1434	S1018-H1234 CarbonylContact C-O 3.44Å; S1018-H1234 WeakPolarHBondContact CA-O 3.23Å; S1018-Q1235 VanDerWaalsContact C-C 3.41Å; S1018-Q1235 CarbonylContact O-C 3.43Å; S1018-H1236 CarbonylContact O-C 3.11Å; S1018-H1236 PolarHBondContact O-N 2.95Å; S1018-Y1434 WeakPolarHBondContact OG-CB 2.9Å; S1018-Y1434 WeakPolarHBondContact OG-CD1 3.26Å
1019	N	26.9	Very low	30.1	Very low	130.4 Å²	130.4	132.1 Å²	132.1	70%	0.697	70%	0.699	S	S	*	*			trans	-126.6	144.8	154.8	-105.9	-5.8	0	0	0	113.4	E1233 H1234 Q1235	N1019-E1233 WeakPolarHBondContact CB-O 3.41Å; N1019-E1233 PolarHBondContact ND2-O 3.35Å; N1019-H1234 WeakPolarHBondContact CA-O 3.28Å; N1019-H1234 HydrophobicContact CB-CB 4.39Å; N1019-H1234 VanDerWaalsContact CB-O 3.28Å; N1019-H1234 WeakPolarHBondContact CB-O 3.37Å; N1019-H1234 VanDerWaalsContact CG-C 3.49Å; N1019-H1234 PolarHBondContact N-O 2.73Å; N1019-Q1235 PolarHBondContact OD1-N 2.93Å
1020	P	32.7	Very low	30.1	Very low	99.6 Å²	99.6	133.8 Å²	133.8	65%	0.647	70%	0.702	S	S	*	*			trans	-106.6	160.1	144.2	29.6	-21.2	0	0	0	113.5	N1022 Q1235	P1020-N1022 PolarHBondContact O-N 3.4Å; P1020-Q1235 WeakPolarHBondContact CD-O 3.5Å
1021	T	28.1	Very low	30.1	Very low	125 Å²	125	133.1 Å²	133.1	77%	0.767	71%	0.706	S	S	*	*			trans	48	115.1	151.1	59	0	0	0	0	115.7
1022	N	26.6	Very low	30.4	Very low	151.8 Å²	151.8	133.2 Å²	133.2	81%	0.812	71%	0.713	S	S	*	*				171.4	128.9	105.5	-133.7	-5.5	0	0	0	114.8	P1020	P1020-N1022 PolarHBondContact O-N 3.4Å
1023	S	29.1	Very low	30.3	Very low	97.4 Å²	97.4	134.9 Å²	134.9	68%	0.681	72%	0.72	S	S	*	*			trans	155.9	112.5	152.9	64.2	0	0	0	0	114.2	H1025	S1023-H1025 PolarHBondContact O-N 2.79Å
1024	N	29.6	Very low	30.2	Very low	139.6 Å²	139.6	132.2 Å²	132.2	75%	0.747	72%	0.72	S	S	*	*			trans	-131.8	134.1	150.9	-72.4	-4.8	0	0	0	115
1025	H	33.6	Very low	30.1	Very low	163.6 Å²	163.6	128.8 Å²	128.8	76%	0.757	72%	0.715	S	S	*	*			trans	94.4	110.4	144.7	-88.3	-61.5	0	0	0	116.4	S1023	S1023-H1025 PolarHBondContact O-N 2.79Å
1026	D	31.2	Very low	30.2	Very low	116 Å²	116	130.4 Å²	130.4	62%	0.62	72%	0.723	S	S	*	*				55.3	125.8	120.9	-64.2	-24.4	0	0	0	116.6
1027	N	33.1	Very low	30.1	Very low	139.2 Å²	139.2	132 Å²	132	74%	0.744	73%	0.725	S	S	*	*			trans	108.6	150.5	132.8	-65.8	-28.7	0	0	0	114.8
1028	D	31.4	Very low	30.2	Very low	148.8 Å²	148.8	134.3 Å²	134.3	80%	0.796	73%	0.73	S	S	*	*			trans	-178.5	164.3	131.3	-82.2	-43.5	0	0	0	116.7
1029	V	33.3	Very low	30.4	Very low	124 Å²	124	135.7 Å²	135.7	75%	0.752	73%	0.73	S	S	*	*			trans	-156.6	135.5	163.1	155.6	0	0	0	0	113.1
1030	Q	30.8	Very low	30.6	Very low	172.4 Å²	172.4	135.5 Å²	135.5	81%	0.806	73%	0.725	S	S	*	*			trans	72.2	131.6	162	-140.6	68.1	-0.1	0	0	116.5
1031	C	27.9	Very low	30.5	Very low	108.2 Å²	108.2	138.8 Å²	138.8	73%	0.731	73%	0.73	S	S	*	*			trans	-83.8	166.2	173.4	-57.3	0	0	0	0	112.4	I1033	C1031-I1033 HydrophobicContact CB-CD1 3.94Å; C1031-I1033 HydrophobicContact CB-CG1 3.89Å
1032	P	34.6	Very low	30.5	Very low	115.2 Å²	115.2	143.4 Å²	143.4	75%	0.748	73%	0.733	S	S	*	*			cis	-127.7	158.6	24.6	30.4	-16.9	0	0	0	114.8
1033	I	30.5	Very low	30.6	Very low	148.2 Å²	148.2	141 Å²	141	76%	0.76	73%	0.728	S	S	*	*				79.9	146.1	128.8	-69.4	163.5	0	0	0	113.6	C1031 M1035	C1031-I1033 HydrophobicContact CB-CD1 3.94Å; C1031-I1033 HydrophobicContact CB-CG1 3.89Å; I1033-M1035 PolarHBondContact O-N 3.41Å
1034	D	27.1	Very low	30.6	Very low	132.2 Å²	132.2	140.4 Å²	140.4	71%	0.707	72%	0.724	S	S	*	*			trans	-103.7	149.7	160.6	-103.7	-37.3	0	0	0	114	H1036	D1034-H1036 PolarHBondContact O-N 3.07Å
1035	M	29.1	Very low	30.7	Very low	155.6 Å²	155.6	140.7 Å²	140.7	77%	0.767	72%	0.724	S	S	*	*				106.3	120.4	111.2	-136.6	-175.1	53.3	0	0	116	I1033	I1033-M1035 PolarHBondContact O-N 3.41Å
1036	H	31.7	Very low	30.5	Very low	153.2 Å²	153.2	140.6 Å²	140.6	71%	0.709	72%	0.724	S	S	*	*			trans	-162.7	121.5	154.1	-104.4	-74.8	0	0	0	112.6	D1034	D1034-H1036 PolarHBondContact O-N 3.07Å
1037	I	29.8	Very low	30.5	Very low	137 Å²	137	142.4 Å²	142.4	70%	0.703	73%	0.728	S	S	*	*				93.9	118.8	128.8	-67.9	166.4	0	0	0	114
1038	F	30	Very low	30.3	Very low	177.8 Å²	177.8	141.8 Å²	141.8	78%	0.78	72%	0.724	S	S	*	*				179.7	155.6	99.5	-128.9	-109.4	0	0	0	111.4
1039	D	31.3	Very low	30.2	Very low	113.8 Å²	113.8	142.6 Å²	142.6	61%	0.609	72%	0.723	S	S	*	*				73.2	142	113.5	-115.2	-16.7	0	0	0	117.2
1040	Q	30.5	Very low	29.9	Very low	127.2 Å²	127.2	141.5 Å²	141.5	59%	0.594	72%	0.72	S	S	*	*			trans	100.6	123.5	139.5	-124.6	175.6	62.5	0	0	116.2	H1839 Y1840	Q1040-H1839 PolarHBondContact NE2-O 3.14Å; Q1040-H1839 PolarHBondContact OE1-O 3.4Å; Q1040-Y1840 HydrophobicContact CB-CD2 3.5Å; Q1040-Y1840 VanDerWaalsContact CB-CD2 3.5Å; Q1040-Y1840 HydrophobicContact CB-CE2 3.72Å; Q1040-Y1840 HydrophobicContact CB-CG 4.05Å; Q1040-Y1840 HydrophobicContact CG-CD2 3.57Å; Q1040-Y1840 HydrophobicContact CG-CE2 3.74Å
1041	K	30.3	Very low	29.8	Very low	169.2 Å²	169.2	138 Å²	138	74%	0.736	72%	0.715	S	S	*	*				-159.8	124	121.3	-115.2	176.1	-175.8	172.5	0	112.4
1042	W	29.7	Very low	29.8	Very low	221.6 Å²	221.6	139.7 Å²	139.7	84%	0.839	72%	0.717	S	S	*	*				164.6	126.6	98.2	-87.4	50.2	0	0	0	110.6
1043	S	27.6	Very low	29.7	Very low	100.4 Å²	100.4	142 Å²	142	70%	0.702	72%	0.717	S	S	*	*				-157.5	139.7	88.3	-65.5	0	0	0	0	111.7
1044	S	29.9	Very low	29.7	Very low	85.6 Å²	85.6	141.2 Å²	141.2	60%	0.599	71%	0.714	S	S	*	*				115.8	135.8	114.7	-63.1	0	0	0	0	114.9
1045	I	30.8	Very low	29.9	Very low	144.6 Å²	144.6	141.3 Å²	141.3	74%	0.742	72%	0.715	S	S	*	*				111	110.3	127.7	-79.2	163.7	0	0	0	111	H1047	I1045-H1047 HydrophobicContact CG2-CB 4.13Å
1046	E	30.4	Very low	30	Very low	161.6 Å²	161.6	140.1 Å²	140.1	76%	0.755	71%	0.712	S	S	*	*				165.7	151.5	85.5	-80.6	175.8	167.9	0	0	114.3
1047	H	30.6	Very low	30	Very low	155.2 Å²	155.2	139.4 Å²	139.4	72%	0.719	71%	0.713	S	S	*	*			trans	163.5	145.1	148.3	-95.6	-76.3	0	0	0	115.6	I1045	I1045-H1047 HydrophobicContact CG2-CB 4.13Å
1048	I	28.7	Very low	30.1	Very low	125.6 Å²	125.6	139.5 Å²	139.5	64%	0.644	72%	0.715	S	S	*	*				161.1	136.5	94.5	-94.2	171.2	0	0	0	114.8
1049	Q	29.1	Very low	30.1	Very low	167 Å²	167	137.4 Å²	137.4	78%	0.78	71%	0.712	S	S	*	*			trans	72.2	107.6	149.4	-72.2	167.4	-14.6	0	0	117.2
1050	S	27.3	Very low	30.1	Very low	99 Å²	99	139.6 Å²	139.6	69%	0.692	72%	0.716	S	S	*	*				97.3	111.9	120.3	66.2	0	0	0	0	116.6	N1052	S1050-N1052 PolarHBondContact O-N 2.99Å
1051	S	29.2	Very low	30.1	Very low	100.8 Å²	100.8	139.5 Å²	139.5	71%	0.705	72%	0.723	S	S	*	*			trans	88.6	127.2	135.3	68.9	0	0	0	0	116.1	H1053	S1051-H1053 PolarHBondContact O-N 3.02Å; S1051-H1053 VanDerWaalsContact O-N 3.14Å
1052	N	27.5	Very low	30	Very low	143.4 Å²	143.4	137.8 Å²	137.8	77%	0.767	72%	0.722	S	S	*	*			trans	53.5	128.3	137.7	-88.9	-21.4	0	0	0	117.6	S1050	S1050-N1052 PolarHBondContact O-N 2.99Å
1053	H	32.7	Very low	30.1	Very low	162.8 Å²	162.8	130.7 Å²	130.7	75%	0.754	71%	0.71	S	S	*	*			trans	162.2	135.2	137	-102.2	8	0	0	0	114.8	S1051	S1051-H1053 PolarHBondContact O-N 3.02Å; S1051-H1053 VanDerWaalsContact O-N 3.14Å
1054	N	29.8	Very low	30.2	Very low	131 Å²	131	131.6 Å²	131.6	70%	0.701	71%	0.707	S	S	*	*			trans	-12.2	143.5	144.4	-66.4	-21	0	0	0	115.4
1055	N	31.8	Very low	30.3	Very low	135.8 Å²	135.8	136.1 Å²	136.1	73%	0.726	72%	0.716	S	S	*	*				170.2	131.5	114.3	-91.5	-29.8	0	0	0	114.9	K1672	N1055-K1672 HydrophobicContact CB-CD 4.1Å; N1055-K1672 VanDerWaalsContact OD1-CE 3.29Å; N1055-K1672 WeakPolarHBondContact OD1-CE 3.42Å; N1055-K1672 PolarHBondContact OD1-NZ 2.94Å
1056	N	30.4	Very low	30.3	Very low	128.6 Å²	128.6	136.3 Å²	136.3	69%	0.688	71%	0.714	S	S	*	*			trans	-111.1	164.4	154	-85.5	-35.1	0	0	0	114.7	K1672 N1706	N1056-K1672 WeakPolarHBondContact O-CE 3.3Å; N1056-K1672 PolarHBondContact O-NZ 3.25Å; N1056-N1706 PolarHBondContact ND2-O 3.3Å
1057	N	32.7	Very low	30.2	Very low	138.8 Å²	138.8	134.9 Å²	134.9	74%	0.742	71%	0.711	S	S	*	*			trans	40.4	133.6	166.6	-57.5	-42.1	0	0	0	115.5	L1059	N1057-L1059 PolarHBondContact O-N 2.89Å
1058	N	31	Very low	30.3	Very low	139 Å²	139	135.8 Å²	135.8	74%	0.743	71%	0.713	S	S	*	*				-162.1	139.6	107.8	-100.5	-33.9	0	0	0	111.4
1059	L	31.6	Very low	30.4	Very low	135 Å²	135	136.2 Å²	136.2	71%	0.707	72%	0.716	S	S	*	*			trans	141.9	134.2	135.1	-106	78.5	0	0	0	111.8	N1057	N1057-L1059 PolarHBondContact O-N 2.89Å
1060	K	30	Very low	30.7	Very low	159 Å²	159	133.2 Å²	133.2	69%	0.691	71%	0.711	S	S	*	*				106.6	126.2	94.8	-98.3	175.9	179.2	170.7	0	111.8	L1062 T1708 K1709	K1060-L1062 HydrophobicContact CD-CD1 4.37Å; K1060-L1062 HydrophobicContact CG-CD1 4.04Å; K1060-T1708 WeakPolarHBondContact CD-O 3.4Å; K1060-T1708 PolarHBondContact NZ-OG1 3.07Å; K1060-K1709 WeakPolarHBondContact CE-O 2.95Å; K1060-K1709 PolarHBondContact NZ-O 2.65Å
1061	V	31.5	Very low	30.9	Very low	125.4 Å²	125.4	133.1 Å²	133.1	76%	0.76	71%	0.706	S	S	*	*				157.2	134	68.9	179.9	0	0	0	0	107.8
1062	L	28.5	Very low	31	Very low	134.6 Å²	134.6	134.8 Å²	134.8	71%	0.705	71%	0.708	S	S	*	*				112.8	143.1	57	-116.6	120.6	0	0	0	112.4	K1060 Q1689 L1690	K1060-L1062 HydrophobicContact CD-CD1 4.37Å; K1060-L1062 HydrophobicContact CG-CD1 4.04Å; L1062-Q1689 HydrophobicContact CB-CG 4.36Å; L1062-Q1689 HydrophobicContact CD1-CB 3.87Å; L1062-Q1689 HydrophobicContact CD1-CG 3.47Å; L1062-Q1689 VanDerWaalsContact CD1-CG 3.47Å; L1062-Q1689 HydrophobicContact CG-CB 3.79Å; L1062-Q1689 HydrophobicContact CG-CG 3.6Å; L1062-L1690 HydrophobicContact CD1-CD1 4.1Å
1063	A	31.5	Very low	31.1	Very low	70.8 Å²	70.8	133.8 Å²	133.8	59%	0.585	71%	0.707	S	S	*	*				158.9	153.2	107.6	0	0	0	0	0	114.6	N1688	A1063-N1688 WeakPolarHBondContact CB-OD1 3.36Å
1064	N	29	Very low	31	Very low	120.2 Å²	120.2	131.6 Å²	131.6	64%	0.643	71%	0.705	S	S	*	*			trans	-163	165	132.5	-82.5	-32.1	0	0	0	112.5
1065	F	32.2	Very low	31.1	Very low	179.6 Å²	179.6	129.1 Å²	129.1	79%	0.788	70%	0.703	S	S	*	*			trans	113.4	127.7	140.7	-71.3	-91.6	0	0	0	114.7
1066	Q	29.7	Very low	31	Very low	149.6 Å²	149.6	130.6 Å²	130.6	70%	0.699	70%	0.703	S	S	*	*			cis	115.8	141.6	11.4	-110.5	-136.1	26.9	0	0	113.5
1067	L	30.2	Very low	31.1	Very low	131.2 Å²	131.2	132.5 Å²	132.5	69%	0.687	71%	0.706	S	S	*	*			trans	165.2	135.5	171.6	-80.4	150.3	0	0	0	114.5	Q1388	L1067-Q1388 CarbonylContact O-C 2.85Å
1068	K	32.5	Very low	31.1	Very low	175 Å²	175	131.9 Å²	131.9	76%	0.761	70%	0.702	S	S	*	*				-179.7	149.2	79.6	-117.2	170.8	-177.1	-177.5	0	115.3	Q1386 Q1387 Q1388	K1068-Q1386 VanDerWaalsContact CD-OE1 3.27Å; K1068-Q1387 CarbonylContact C-O 2.88Å; K1068-Q1387 VanDerWaalsContact CA-O 3.23Å; K1068-Q1387 WeakPolarHBondContact CA-O 3.11Å; K1068-Q1387 HydrophobicContact CB-CB 3.79Å; K1068-Q1387 HydrophobicContact CB-CG 4.18Å; K1068-Q1387 WeakPolarHBondContact CB-O 3.39Å; K1068-Q1387 HydrophobicContact CD-CB 3.98Å; K1068-Q1387 VanDerWaalsContact CD-CD 3.45Å; K1068-Q1387 HydrophobicContact CD-CG 3.97Å; K1068-Q1387 PolarHBondContact N-O 2.67Å; K1068-Q1388 PolarHBondContact N-O 2.65Å
1069	N	29.2	Very low	31.2	Very low	133.2 Å²	133.2	131.3 Å²	131.3	71%	0.712	70%	0.695	S	S	*	*			trans	-105.8	168.4	175.7	-124.2	6.2	0	0	0	109.9	T1071 Q1386	N1069-T1071 HydrophobicContact CB-CG2 4.43Å; N1069-T1071 VanDerWaalsContact ND2-CG2 3.27Å; N1069-T1071 WeakPolarHBondContact ND2-CG2 3.46Å; N1069-T1071 PolarHBondContact ND2-OG1 3.28Å; N1069-Q1386 CarbonylContact C-O 3.04Å; N1069-Q1386 CarbonylContact O-C 3.43Å; N1069-Q1386 VanDerWaalsContact O-C 3.27Å; N1069-Q1386 WeakPolarHBondContact O-CB 3.2Å
1070	P	37.4	Very low	31.2	Very low	105.4 Å²	105.4	131.5 Å²	131.5	68%	0.684	69%	0.69	S	S	*	*				-132.3	163.7	78.8	36.5	-18.1	0	0	0	114.6	N1072 E1385 Q1386	P1070-N1072 PolarHBondContact O-N 3.49Å; P1070-E1385 HydrophobicContact CG-CB 4.42Å; P1070-E1385 VanDerWaalsContact O-O 3.07Å; P1070-Q1386 VanDerWaalsContact N-O 3.15Å
1071	T	30.4	Very low	31.4	Very low	96 Å²	96	131 Å²	131	59%	0.589	69%	0.69	S	S	*	*			trans	-159.1	138.1	146.4	34.1	0	0	0	0	116.4	N1069 E1385	N1069-T1071 HydrophobicContact CB-CG2 4.43Å; N1069-T1071 VanDerWaalsContact ND2-CG2 3.27Å; N1069-T1071 WeakPolarHBondContact ND2-CG2 3.46Å; N1069-T1071 PolarHBondContact ND2-OG1 3.28Å; T1071-E1385 HydrophobicContact CG2-CB 4.27Å; T1071-E1385 VanDerWaalsContact OG1-CA 3.26Å; T1071-E1385 WeakPolarHBondContact OG1-CA 3.29Å; T1071-E1385 WeakPolarHBondContact OG1-CB 2.91Å; T1071-E1385 PolarHBondContact OG1-N 3.08Å; T1071-E1385 PolarHBondContact OG1-O 3.23Å
1072	N	31.1	Very low	31.3	Very low	136.2 Å²	136.2	132.5 Å²	132.5	73%	0.728	69%	0.691	S	S	*	*			trans	145.8	127.3	138.7	-84.5	-9.8	0	0	0	115.5	P1070 T1074	P1070-N1072 PolarHBondContact O-N 3.49Å; N1072-T1074 VanDerWaalsContact C-N 3.28Å
1073	T	30.6	Very low	31.6	Very low	122 Å²	122	132.4 Å²	132.4	75%	0.748	69%	0.689	S	S	*	*				88.6	119	118.1	0.6	0	0	0	0	115.4
1074	T	30.1	Very low	31.6	Very low	117.2 Å²	117.2	136.8 Å²	136.8	72%	0.719	70%	0.697	S	S	*	*			trans	-160.3	0	153.6	46.2	0	0	0	0	112.7	N1072	N1072-T1074 VanDerWaalsContact C-N 3.28Å
1075	A	30.8	Very low	31.6	Very low	78.6 Å²	78.6	135.6 Å²	135.6	65%	0.65	70%	0.695	S	S	*	*				0	139.6	0	0	0	0	0	0	110.3
1076	F	29.6	Very low	31.7	Very low	167.8 Å²	167.8	133.2 Å²	133.2	74%	0.736	70%	0.695	S	S	*	*				154.3	130.5	128.3	-90.7	-86.9	0	0	0	111.4
1077	F	33.1	Very low	31.6	Very low	168.8 Å²	168.8	132.3 Å²	132.3	74%	0.74	70%	0.695	S	S	*	*			trans	-121.6	161.6	161.1	-77.8	-93.5	0	0	0	113.7
1078	D	33	Very low	31.9	Very low	126.2 Å²	126.2	132.4 Å²	132.4	68%	0.675	70%	0.695	S	S	*	*				80.2	161.9	85.3	-128.5	-2.5	0	0	0	118.4
1079	E	32.7	Very low	31.8	Very low	126.4 Å²	126.4	130.6 Å²	130.6	59%	0.591	69%	0.693	S	S	*	*			trans	-118.3	141.4	-178.1	-120.4	-171.2	166.9	0	0	117.4	H1081	E1079-H1081 IonicContact OE1-CE1 3.13Å; E1079-H1081 PolarHBondContact OE1-CE1 2.51Å; E1079-H1081 IonicContact OE1-ND1 3.56Å
1080	K	32.8	Very low	32	Very low	137.4 Å²	137.4	130.4 Å²	130.4	60%	0.597	69%	0.692	S	S	*	*				62.1	135.5	125.3	-72.5	173	-176.6	138.1	0	121.3
1081	H	33.8	Very low	31.8	Very low	149.8 Å²	149.8	131.4 Å²	131.4	69%	0.694	69%	0.692	S	S	*	*				108.2	135.1	117.3	-86.6	-69.6	0	0	0	118	E1079	E1079-H1081 IonicContact OE1-CE1 3.13Å; E1079-H1081 PolarHBondContact OE1-CE1 2.51Å; E1079-H1081 IonicContact OE1-ND1 3.56Å
1082	M	30	Very low	31.9	Very low	157.2 Å²	157.2	132.3 Å²	132.3	77%	0.774	69%	0.693	S	S	*	*				74.7	152.3	115.9	-76	-104.9	-140.4	0	0	115.1
1083	I	33.2	Very low	31.9	Very low	131.6 Å²	131.6	132.8 Å²	132.8	68%	0.675	70%	0.696	S	S	*	*			cis	-162.4	141	21	-61.6	170.2	0	0	0	111.1	T1085	I1083-T1085 HydrophobicContact CG2-CG2 4.4Å
1084	H	32	Very low	32	Very low	163 Å²	163	134.6 Å²	134.6	76%	0.755	70%	0.699	S	S	*	*			trans	97.7	117.3	141.5	-83.6	-70.7	0	0	0	115.9
1085	T	29.9	Very low	32.2	Very low	96.2 Å²	96.2	136.6 Å²	136.6	59%	0.59	70%	0.702	S	S	*	*				52.1	135.1	96.3	64.2	0	0	0	0	114.8	I1083	I1083-T1085 HydrophobicContact CG2-CG2 4.4Å
1086	T	33.3	Very low	32.4	Very low	127.6 Å²	127.6	137.4 Å²	137.4	78%	0.783	70%	0.701	S	S	*	*				-161.9	143.1	63.1	43.5	0	0	0	0	115
1087	N	29	Very low	32.8	Very low	132 Å²	132	134.5 Å²	134.5	71%	0.706	70%	0.699	S	S	*	*				27.3	150.7	124.6	-133.5	2.7	0	0	0	117.3
1088	I	34.6	Very low	32.8	Very low	133.2 Å²	133.2	132.3 Å²	132.3	68%	0.683	70%	0.695	S	S	*	*			trans	103.2	107.6	140.2	-65.1	166.6	0	0	0	115.1
1089	N	31.1	Very low	32.9	Very low	136 Å²	136	133.1 Å²	133.1	73%	0.727	70%	0.698	S	S	*	*			trans	64	151.4	143.7	-66.2	7.1	0	0	0	121.8
1090	N	32.7	Very low	33	Very low	128.8 Å²	128.8	133.9 Å²	133.9	69%	0.689	70%	0.701	S	S	*	*			trans	81.9	142.3	147.6	-81.7	27.9	0	0	0	117.8
1091	D	33.6	Very low	33	Very low	126.8 Å²	126.8	133.4 Å²	133.4	68%	0.678	70%	0.704	S	S	*	*				111.5	140.9	120.7	-79.8	-17.2	0	0	0	118.4
1092	N	33.2	Very low	32.9	Very low	116 Å²	116	131.7 Å²	131.7	62%	0.62	71%	0.705	S	S	*	*				139.2	138.2	110.1	-90.5	-47	0	0	0	117.3	L1724	N1092-L1724 PolarHBondContact ND2-O 2.98Å
1093	N	30.8	Very low	33	Very low	145.2 Å²	145.2	129.1 Å²	129.1	78%	0.776	70%	0.702	S	S	*	*			trans	75.6	107.4	135.9	-71.7	-27.1	0	0	0	120.2
1094	I	32.1	Very low	33	Very low	160.6 Å²	160.6	130.4 Å²	130.4	82%	0.824	71%	0.709	S	S	*	*			trans	-155.3	133.2	140.7	-68.4	172.9	0	0	0	111
1095	M	35.4	Very low	33.1	Very low	159.8 Å²	159.8	129.6 Å²	129.6	79%	0.787	71%	0.71	S	S	*	*			trans	-130.2	151.9	175.2	-137.8	168	69.4	0	0	112.2
1096	P	34	Very low	33.3	Very low	94.8 Å²	94.8	133.6 Å²	133.6	62%	0.616	72%	0.719	S	S	*	*			trans	-99.7	167.5	175.1	36.2	-34.8	0	0	0	114.2
1097	P	39.4	Very low	33.2	Very low	106.8 Å²	106.8	134.5 Å²	134.5	69%	0.694	72%	0.718	S	S	*	*			trans	-108.9	146.7	-175.5	31.5	-21.8	0	0	0	115.8
1098	N	32	Very low	33.4	Very low	122.6 Å²	122.6	134.8 Å²	134.8	66%	0.656	72%	0.72	S	S	*	*			trans	167.2	129	157.5	-84.7	-28.6	0	0	0	114.5	D769 N770	D769-N1098 VanDerWaalsContact O-CB 3.28Å; D769-N1098 WeakPolarHBondContact O-CB 3.34Å; D769-N1098 PolarHBondContact O-OD1 3.14Å; N770-N1098 HydrophobicContact CB-CB 4.4Å
1099	I	35.9	Very low	33.3	Very low	143.6 Å²	143.6	134.3 Å²	134.3	74%	0.736	72%	0.718	S	S	*	*			trans	-151	125.2	149.3	-60.1	175.8	0	0	0	112.5	N768 D769 L1101 A1756	N768-I1099 WeakPolarHBondContact CA-O 3.2Å; N768-I1099 PolarHBondContact N-O 3.43Å; D769-I1099 VanDerWaalsContact C-N 3.33Å; I1099-L1101 PolarHBondContact O-N 3.42Å; I1099-A1756 HydrophobicContact CG2-CB 4.21Å
1100	H	33.5	Very low	33.4	Very low	142 Å²	142	134.9 Å²	134.9	66%	0.657	72%	0.722	S	S	*	*			trans	-145	133.6	176.1	-143.6	-67.4	0	0	0	114.3	D769 A1758	D769-H1100 HydrophobicContact CB-CB 4.19Å; D769-H1100 VanDerWaalsContact OD1-CA 3.23Å; D769-H1100 WeakPolarHBondContact OD1-CA 3.41Å; D769-H1100 IonicContact OD1-CD2 3.29Å; D769-H1100 PolarHBondContact OD1-CD2 2.92Å; D769-H1100 IonicContact OD1-CE1 2.75Å; D769-H1100 IonicContact OD1-CG 3.87Å; D769-H1100 VanDerWaalsContact OD1-CG 3.23Å; D769-H1100 IonicContact OD1-ND1 3.22Å; D769-H1100 IonicContact OD1-NE2 3.05Å; H1100-A1758 VanDerWaalsContact CD2-CA 3.42Å; H1100-A1758 WeakPolarHBondContact CD2-CA 3.46Å; H1100-A1758 PolarHBondContact CE1-N 3.24Å; H1100-A1758 VanDerWaalsContact CE1-N 3.28Å; H1100-A1758 PolarHBondContact ND1-N 3.14Å
1101	L	33	Very low	33.4	Very low	128.6 Å²	128.6	137.4 Å²	137.4	67%	0.673	73%	0.729	S	S	*	*			trans	-120	153.6	173.8	-83.3	158	0	0	0	113.8	N768 I1099 A1756 P1757 A1758	N768-L1101 PolarHBondContact ND2-O 3.25Å; I1099-L1101 PolarHBondContact O-N 3.42Å; L1101-A1756 HydrophobicContact CD1-CB 3.54Å; L1101-A1756 HydrophobicContact CG-CB 3.73Å; L1101-P1757 HydrophobicContact CB-CB 4.01Å; L1101-P1757 HydrophobicContact CD1-CB 4.19Å; L1101-A1758 HydrophobicContact CB-CB 4.18Å; L1101-A1758 WeakPolarHBondContact O-CB 2.91Å
1102	T	31.7	Very low	33.7	Very low	113.4 Å²	113.4	136.7 Å²	136.7	70%	0.696	73%	0.731	S	S	*	*			trans	149.7	141.1	160.3	42	0	0	0	0	114.2
1103	S	32.6	Very low	33.9	Very low	102.4 Å²	102.4	136.3 Å²	136.3	72%	0.716	74%	0.735	S	S	*	*				116.1	127.9	128.4	-67.2	0	0	0	0	116.5
1104	L	33	Very low	33.8	Very low	158.4 Å²	158.4	137.5 Å²	137.5	83%	0.829	74%	0.736	S	S	*	*				96.7	132.6	123.3	-76.4	168.1	0	0	0	115.6
1105	L	35	Very low	33.9	Very low	146.2 Å²	146.2	135.6 Å²	135.6	77%	0.765	73%	0.731	S	S	*	*			trans	170.8	139	135	-74.5	152.3	0	0	0	114.8
1106	K	33.2	Very low	33.5	Very low	181.4 Å²	181.4	132.4 Å²	132.4	79%	0.789	73%	0.725	S	S	*	*				145.7	124.3	121.3	-101.9	168.9	-179.5	176.3	0	114.2
1107	L	32	Very low	33.5	Very low	145 Å²	145	132.4 Å²	132.4	76%	0.759	73%	0.727	S	S	*	*				83.6	129.9	127.6	-69.1	172.3	0	0	0	118.1
1108	N	32.8	Very low	33.1	Very low	139 Å²	139	131.5 Å²	131.5	74%	0.743	72%	0.723	S	S	*	*			trans	113.8	133.7	144.4	-91.3	0.1	0	0	0	115.7
1109	N	32.4	Very low	33.1	Very low	122 Å²	122	131.1 Å²	131.1	65%	0.652	73%	0.725	S	S	*	*			trans	-97.2	149.2	138.3	-68.4	-19.1	0	0	0	114.3
1110	N	33.6	Very low	33	Very low	149.6 Å²	149.6	129.6 Å²	129.6	80%	0.8	72%	0.717	S	S	*	*				150.2	140.1	129.9	-79.1	-6.7	0	0	0	114.2
1111	E	32.4	Very low	32.9	Very low	181.8 Å²	181.8	128.5 Å²	128.5	85%	0.85	72%	0.716	S	S	*	*			trans	-76.3	158.6	177.2	-104.4	179.2	115.5	0	0	116
1112	P	39.1	Very low	32.8	Very low	110.6 Å²	110.6	128.6 Å²	128.6	72%	0.718	72%	0.717	S	S	*	*			trans	-88.7	-175.8	174.8	39.2	-37.1	0	0	0	112.1
1113	P	38.2	Very low	32.8	Very low	108.2 Å²	108.2	127.8 Å²	127.8	70%	0.703	72%	0.716	S	S	*	*				-114.2	165.1	90.3	34.2	-23.6	0	0	0	114.7
1114	H	29.3	Very low	32.8	Very low	170.8 Å²	170.8	127.8 Å²	127.8	79%	0.791	72%	0.716	S	S	*	*			trans	9.3	144.9	144.4	-74.9	-75.4	0	0	0	115.9
1115	V	32.4	Very low	32.7	Very low	120.6 Å²	120.6	127.5 Å²	127.5	73%	0.731	71%	0.714	S	S	*	*				161.6	137.3	121.2	-120.5	0	0	0	0	114.5	T841 S842 I843	T841-V1115 HydrophobicContact CG2-CB 4.37Å; S842-V1115 WeakPolarHBondContact OG-CG1 3.27Å; I843-V1115 HydrophobicContact CD1-CG1 3.31Å; I843-V1115 HydrophobicContact CG1-CG1 3.67Å
1116	S	28.9	Very low	32.6	Very low	93.6 Å²	93.6	127.5 Å²	127.5	66%	0.655	72%	0.715	S	S	*	*				172.4	153.8	125.2	-66.7	0	0	0	0	116.1	S842	S842-S1116 WeakPolarHBondContact CB-OG 3Å; S842-S1116 VanDerWaalsContact OG-CB 3.28Å; S842-S1116 WeakPolarHBondContact OG-CB 2.98Å; S842-S1116 PolarHBondContact OG-OG 3Å
1117	S	33	Very low	32.5	Very low	94.8 Å²	94.8	123.4 Å²	123.4	66%	0.663	71%	0.709	S	S	*	*			trans	135.9	138.5	154.6	-66.4	0	0	0	0	112.4	C839	C839-S1117 WeakPolarHBondContact CA-OG 3.12Å; C839-S1117 PolarHBondContact N-OG 3.38Å
1118	S	31.4	Very low	32.5	Very low	86.4 Å²	86.4	121.4 Å²	121.4	60%	0.604	71%	0.707	S	S	*	*				-176.8	156.5	53.7	7.3	0	0	0	0	114.6	S837 A838 C839 S840	S837-S1118 CarbonylContact O-C 3.06Å; S837-S1118 VanDerWaalsContact O-CA 3.3Å; S837-S1118 WeakPolarHBondContact O-CA 3.19Å; A838-S1118 VanDerWaalsContact C-C 3.4Å; A838-S1118 CarbonylContact C-O 3.16Å; A838-S1118 VanDerWaalsContact CA-C 3.45Å; A838-S1118 VanDerWaalsContact CA-N 3.29Å; A838-S1118 VanDerWaalsContact N-C 3.28Å; C839-S1118 VanDerWaalsContact C-OG 3.28Å; C839-S1118 PolarHBondContact O-OG 2.88Å; S840-S1118 PolarHBondContact N-OG 2.76Å
1119	V	32.6	Very low	32.5	Very low	114.2 Å²	114.2	119.6 Å²	119.6	69%	0.692	71%	0.705	S	S	*	*			trans	71.6	138.8	167	176.1	0	0	0	0	114	S837 A838 V1481	S837-V1119 CarbonylContact C-O 3.41Å; S837-V1119 PolarHBondContact O-N 3.33Å; A838-V1119 PolarHBondContact N-O 3.05Å; V1119-V1481 CarbonylContact C-O 3.57Å; V1119-V1481 VanDerWaalsContact O-O 3.14Å
1120	I	32.3	Very low	32.5	Very low	112.8 Å²	112.8	119 Å²	119	58%	0.578	71%	0.71	S	S	*	*			cis	-164.3	142	-30.3	-121.7	163.7	0	0	0	108.3	T836 Q1478 P1479 V1480 V1481	T836-I1120 WeakPolarHBondContact O-CA 3.02Å; I1120-Q1478 HydrophobicContact CD1-CB 3.67Å; I1120-Q1478 HydrophobicContact CD1-CG 3.75Å; I1120-Q1478 HydrophobicContact CG1-CB 4.03Å; I1120-Q1478 HydrophobicContact CG1-CG 3.92Å; I1120-Q1478 HydrophobicContact CG2-CB 4.1Å; I1120-P1479 WeakPolarHBondContact CD1-O 2.96Å; I1120-V1480 HydrophobicContact CG2-CG2 4.4Å; I1120-V1481 PolarHBondContact N-O 2.9Å; I1120-V1481 CarbonylContact O-C 3.13Å; I1120-V1481 VanDerWaalsContact O-CA 3.25Å; I1120-V1481 WeakPolarHBondContact O-CA 3.46Å
1121	L	31.9	Very low	32.5	Very low	118.2 Å²	118.2	117 Å²	117	62%	0.619	71%	0.708	S	S	*	*			trans	135.3	150.1	154	-80.2	176.4	0	0	0	116.6	T836	T836-L1121 PolarHBondContact O-N 3.15Å
1122	N	30.1	Very low	32.4	Very low	130.2 Å²	130.2	113.3 Å²	113.3	70%	0.696	70%	0.702	S	S	*	*				84.8	139.8	123	-78.2	-14.2	0	0	0	115.7
1123	S	32.2	Very low	32.1	Very low	98.4 Å²	98.4	113.1 Å²	113.1	69%	0.688	70%	0.704	S	S	*	*			cis	156.7	162.1	24.1	-19.9	0	0	0	0	111.4
1124	S	32.1	Very low	31.9	Very low	102.6 Å²	102.6	113.2 Å²	113.2	72%	0.717	71%	0.707	S	S	*	*			trans	115.4	144.3	153.6	-51.9	0	0	0	0	112.9
1125	L	31.9	Very low	31.9	Very low	150.6 Å²	150.6	110.4 Å²	110.4	79%	0.788	71%	0.707	S	S	*	*				115.7	143.6	80.1	-86.5	166.1	0	0	0	114.8
1126	L	32.9	Very low	32.4	Very low	146.6 Å²	146.6	110.2 Å²	110.2	77%	0.768	71%	0.708	S	S	*	*				115.4	147.1	121.4	-79.6	156.2	0	0	0	115.7
1127	S	32	Very low	32.8	Very low	95.6 Å²	95.6	111.1 Å²	111.1	67%	0.669	71%	0.711	S	S	*	*				96.5	134.6	109.5	-28.6	0	0	0	0	116.6
1128	S	31.8	Very low	32.6	Very low	101.8 Å²	101.8	114.1 Å²	114.1	71%	0.712	72%	0.719	S	S	*	*				101.6	146.6	70.1	59.5	0	0	0	0	116
1129	S	32.1	Very low	32.6	Very low	102.6 Å²	102.6	115.1 Å²	115.1	72%	0.717	73%	0.726	S	S	*	*			trans	68.8	124.5	130.4	42	0	0	0	0	119.9
1130	S	32.9	Very low	32.4	Very low	108.2 Å²	108.2	114.7 Å²	114.7	76%	0.757	73%	0.728	S	S	*	*				16.1	147.7	129.8	57.2	0	0	0	0	115.6
1131	S	32.1	Very low	32.4	Very low	107.8 Å²	107.8	114.3 Å²	114.3	75%	0.754	74%	0.735	S	S	*	*			trans	154.8	155	135	49.6	0	0	0	0	114.4
1132	S	32.2	Very low	32.3	Very low	104.6 Å²	104.6	113.4 Å²	113.4	73%	0.731	74%	0.739	S	S	*	*				-170.5	142.5	102.2	58.9	0	0	0	0	115.2
1133	S	31.9	Very low	32.2	Very low	107.2 Å²	107.2	118.5 Å²	118.5	75%	0.75	75%	0.749	S	S	*	*				138.2	149.6	118.2	52.1	0	0	0	0	114.1
1134	S	33.7	Very low	32.1	Very low	109 Å²	109	118.6 Å²	118.6	76%	0.762	75%	0.749	S	S	*	*			trans	-163.1	143.3	147.8	52.6	0	0	0	0	114.5
1135	S	30.5	Very low	32	Very low	113.4 Å²	113.4	119.3 Å²	119.3	79%	0.793	75%	0.75	S	S	*	*			trans	161.4	161.1	148.7	-58.4	0	0	0	0	113.8
1136	P	41.8	Very low	32.1	Very low	115.6 Å²	115.6	119.5 Å²	119.5	75%	0.751	75%	0.747	S	S	*	*				-104.7	-163.9	-117.1	40.4	-32.1	0	0	0	111.6
1137	P	37.1	Very low	32.1	Very low	111.6 Å²	111.6	119.7 Å²	119.7	73%	0.725	74%	0.744	S	S	*	*				-133.8	169.8	73.9	26.8	-9.1	0	0	0	116.3
1138	L	29.1	Very low	32.1	Very low	159.6 Å²	159.6	125.2 Å²	125.2	84%	0.836	75%	0.75	S	S	*	*			trans	54.2	137.2	132.9	-56.9	173.8	0	0	0	120.9
1139	S	30.9	Very low	32.2	Very low	105.6 Å²	105.6	128.2 Å²	128.2	74%	0.738	75%	0.75	S	S	*	*				146.6	141.9	102.7	37.8	0	0	0	0	116.4
1140	S	29.4	Very low	32.3	Very low	106.6 Å²	106.6	131.9 Å²	131.9	75%	0.745	76%	0.756	S	S	*	*			trans	11.8	129.5	160.3	54.8	0	0	0	0	119.3
1141	S	31.3	Very low	32.3	Very low	104.2 Å²	104.2	130.6 Å²	130.6	73%	0.729	75%	0.752	S	S	*	*				-172.3	142.6	101.6	49.9	0	0	0	0	112.2
1142	S	29.7	Very low	32.4	Very low	100.4 Å²	100.4	132.6 Å²	132.6	70%	0.702	75%	0.749	S	S	*	*				51.8	138	105.4	-129.4	0	0	0	0	116
1143	W	28.5	Very low	32.5	Very low	236.6 Å²	236.6	135.7 Å²	135.7	90%	0.896	75%	0.749	S	S	*	*			trans	-130.7	139.3	163.7	-71.5	-21.4	0	0	0	112.4
1144	S	29.5	Very low	32.6	Very low	99.8 Å²	99.8	135.2 Å²	135.2	70%	0.698	75%	0.746	S	S	*	*				161.1	133.9	61.6	47.2	0	0	0	0	111.2	P1521	S1144-P1521 VanDerWaalsContact CB-CD 3.47Å; S1144-P1521 WeakPolarHBondContact O-CD 3.41Å; S1144-P1521 VanDerWaalsContact O-CG 3.23Å; S1144-P1521 WeakPolarHBondContact O-CG 3.29Å
1145	T	31.1	Very low	32.5	Very low	118.4 Å²	118.4	134.6 Å²	134.6	73%	0.726	74%	0.742	S	S	*	*			trans	-142.9	148.2	161.3	-15	0	0	0	0	112.4	P1521 T1523	T1145-P1521 WeakPolarHBondContact CB-O 3.45Å; T1145-P1521 WeakPolarHBondContact CG2-O 3.49Å; T1145-P1521 PolarHBondContact OG1-O 2.98Å; T1145-T1523 HydrophobicContact CG2-CG2 3.75Å
1146	Q	33.3	Very low	32.7	Very low	154.6 Å²	154.6	138.6 Å²	138.6	72%	0.722	75%	0.745	S	S	*	*			trans	104.6	137.5	156.3	-111.6	161.6	13.3	0	0	116.1	P1521 S1522 C1524	Q1146-P1521 HydrophobicContact CB-CB 3.95Å; Q1146-P1521 VanDerWaalsContact CD-CB 3.41Å; Q1146-P1521 HydrophobicContact CG-CB 4.27Å; Q1146-P1521 VanDerWaalsContact OE1-CB 3.29Å; Q1146-S1522 VanDerWaalsContact CG-O 3.3Å; Q1146-S1522 WeakPolarHBondContact CG-O 3.3Å; Q1146-S1522 PolarHBondContact NE2-O 3.29Å; Q1146-C1524 WeakPolarHBondContact CG-SG 3.33Å; Q1146-C1524 PolarHBondContact O-SG 2.89Å
1147	Q	32.6	Very low	32.3	Very low	150.8 Å²	150.8	141.1 Å²	141.1	71%	0.705	75%	0.746	S	S	*	*			trans	-165.1	139.3	-179.2	-96.4	171	38.5	0	0	112.9	T1523	Q1147-T1523 VanDerWaalsContact O-CG2 3.3Å; Q1147-T1523 WeakPolarHBondContact O-CG2 3.37Å
1148	R	32.1	Very low	32.2	Very low	210.4 Å²	210.4	146.4 Å²	146.4	79%	0.794	75%	0.752	S	S	*	*			trans	-177.6	125.6	131.1	-108.4	171.1	-159.5	-176.8	-3.2	110.7	C1524 S1526	R1148-C1524 HydrophobicContact CG-CB 3.93Å; R1148-S1526 PolarHBondContact NE-O 3.31Å; R1148-S1526 PolarHBondContact NH2-O 3.12Å
1149	K	34.1	Very low	32.5	Very low	165.8 Å²	165.8	144 Å²	144	72%	0.721	75%	0.746	S	S	*	*				77.3	134.2	103.1	-80.4	179.9	177.3	-176.8	0	114.8	S1526	K1149-S1526 WeakPolarHBondContact CE-OG 3.17Å; K1149-S1526 PolarHBondContact NZ-OG 2.98Å
1150	Q	33.4	Very low	32.7	Very low	179 Å²	179	146.1 Å²	146.1	84%	0.836	75%	0.747	S	S	*	*			trans	72.4	110.3	144.1	-63	171.7	-24.5	0	0	118.7
1151	A	32.8	Very low	33.1	Very low	81 Å²	81	146.5 Å²	146.5	67%	0.669	75%	0.747	S	S	*	*				155.8	147.4	91.2	0	0	0	0	0	113.6
1152	H	35.3	Very low	33.3	Very low	150.2 Å²	150.2	149.3 Å²	149.3	70%	0.695	75%	0.749	S	S	*	*				115.5	128.5	89.3	-84.6	-59.3	0	0	0	117.3
1153	K	34.6	Very low	33.7	Very low	170.6 Å²	170.6	149.8 Å²	149.8	74%	0.742	75%	0.75	S	S	*	*			trans	-157.1	142.3	149.8	-95.4	155	175.6	-176.6	0	113.7
1154	S	34	Very low	34	Very low	96.6 Å²	96.6	145.4 Å²	145.4	68%	0.676	74%	0.743	S	S	*	*				153.9	143.5	117.5	60.5	0	0	0	0	114.8
1155	S	32	Very low	34.2	Very low	96.6 Å²	96.6	147.9 Å²	147.9	68%	0.676	74%	0.743	S	S	*	*			trans	162.5	131.3	159	-78.9	0	0	0	0	113.1
1156	F	33.3	Very low	34.3	Very low	196 Å²	196	149.6 Å²	149.6	86%	0.86	75%	0.747	S	S	*	*				-156.6	127.8	104.8	-97.4	-77.1	0	0	0	113.5	R1158	F1156-R1158 PolarHBondContact O-N 3.35Å
1157	H	34.7	Very low	34.2	Very low	168 Å²	168	148 Å²	148	78%	0.778	74%	0.742	S	S	*	*			trans	-41	138	156.1	-98.6	-61.5	0	0	0	115.2
1158	R	34	Very low	34.2	Very low	224.4 Å²	224.4	147.4 Å²	147.4	85%	0.847	74%	0.744	S	S	*	*			trans	-128.4	147.7	158.7	-88	-169	177.5	-113.4	1.9	111.8	F1156 I1160	F1156-R1158 PolarHBondContact O-N 3.35Å; R1158-I1160 HydrophobicContact CB-CG1 4.36Å
1159	P	36.7	Very low	34.2	Very low	108.8 Å²	108.8	144.3 Å²	144.3	71%	0.706	74%	0.739	S	S	*	*			trans	-104.9	162.1	-174.1	25.5	-14.3	0	0	0	113.3
1160	I	34.6	Very low	34.4	Very low	148.4 Å²	148.4	141.4 Å²	141.4	76%	0.761	74%	0.737	S	S	*	*			trans	-48.1	134.8	146.4	-52.2	169.5	0	0	0	110.8	R1158	R1158-I1160 HydrophobicContact CB-CG1 4.36Å
1161	P	38.3	Very low	34.3	Very low	115.2 Å²	115.2	139 Å²	139	75%	0.748	73%	0.729	S	S	*	*			trans	-100.7	143.5	163.8	5	13	0	0	0	112.7
1162	Q	34.6	Very low	34.2	Very low	164.6 Å²	164.6	144.9 Å²	144.9	77%	0.769	74%	0.736	S	S	*	*			trans	-40.8	148.9	143.4	-78	-177.8	-28.4	0	0	112.7	L1164	Q1162-L1164 PolarHBondContact O-N 2.89Å; Q1162-L1164 VanDerWaalsContact O-N 3.14Å
1163	P	39	Very low	33.9	Very low	111 Å²	111	145.4 Å²	145.4	72%	0.721	74%	0.739	S	S	*	*			trans	-97.1	148.8	-144.7	25.3	-16.8	0	0	0	111.7
1164	L	34	Very low	33.9	Very low	143.2 Å²	143.2	142.7 Å²	142.7	75%	0.75	74%	0.736	S	S	*	*			trans	-102.8	131	157	-72.3	167.5	0	0	0	110.3	Q1162 L1166	Q1162-L1164 PolarHBondContact O-N 2.89Å; Q1162-L1164 VanDerWaalsContact O-N 3.14Å; L1164-L1166 PolarHBondContact O-N 3.37Å; L1164-L1166 VanDerWaalsContact O-N 3.16Å
1165	Q	33.3	Very low	33.8	Very low	152.2 Å²	152.2	145.7 Å²	145.7	71%	0.711	74%	0.74	S	S	*	*			trans	-73.8	139.7	133.5	-77.1	178.4	-11.2	0	0	111	Q750	Q750-Q1165 VanDerWaalsContact CD-CD 3.43Å; Q750-Q1165 VanDerWaalsContact NE2-CD 3.31Å
1166	L	32.5	Very low	33.9	Very low	153.4 Å²	153.4	148.4 Å²	148.4	80%	0.803	75%	0.746	S	S	*	*			trans	-148.4	129.2	166.2	-93.6	164.7	0	0	0	111	L1164	L1164-L1166 PolarHBondContact O-N 3.37Å; L1164-L1166 VanDerWaalsContact O-N 3.16Å
1167	I	32.7	Very low	33.8	Very low	121.6 Å²	121.6	142.1 Å²	142.1	62%	0.624	74%	0.737	S	S	*	*			trans	-111.3	154.3	142.1	-89.8	165.3	0	0	0	112.2	Y1375 H1379	I1167-Y1375 HydrophobicContact CD1-CD1 3.89Å; I1167-Y1375 HydrophobicContact CD1-CE1 3.62Å; I1167-H1379 HydrophobicContact CD1-CB 4.29Å; I1167-H1379 WeakPolarHBondContact CG2-NE2 3.31Å
1168	N	32.5	Very low	33.7	Very low	137.6 Å²	137.6	141.7 Å²	141.7	74%	0.736	74%	0.739	S	S	*	*			trans	-160.1	121.6	156.2	-92.4	0.1	0	0	0	113.4
1169	E	32.3	Very low	33.6	Very low	145.6 Å²	145.6	136 Å²	136	68%	0.68	73%	0.733	S	S	*	*			trans	-55.8	164.3	141.6	-88.2	-131.3	163.3	0	0	113.5	Q1383 Q1387	E1169-Q1383 HydrophobicContact CB-CG 4.47Å; E1169-Q1383 VanDerWaalsContact CD-CD 3.49Å; E1169-Q1383 PolarHBondContact OE1-NE2 2.93Å; E1169-Q1383 VanDerWaalsContact OE2-CG 3.32Å; E1169-Q1383 WeakPolarHBondContact OE2-CG 3.33Å; E1169-Q1387 PolarHBondContact OE1-NE2 2.92Å; E1169-Q1387 PolarHBondContact OE2-NE2 3.4Å; E1169-Q1387 VanDerWaalsContact OE2-NE2 3.15Å
1170	P	38.4	Very low	33.3	Very low	104.6 Å²	104.6	135 Å²	135	68%	0.679	73%	0.729	S	S	*	*			cis	-123.8	154.8	26.9	36.7	-23	0	0	0	114.8	Y1172	P1170-Y1172 PolarHBondContact O-N 3.28Å
1171	N	29.8	Very low	33.2	Very low	128.8 Å²	128.8	135.6 Å²	135.6	69%	0.689	73%	0.728	S	S	*	*			trans	53.6	130.4	152	-116.4	-27.4	0	0	0	118.7
1172	Y	31.3	Very low	33	Very low	206.2 Å²	206.2	139.4 Å²	139.4	81%	0.809	73%	0.729	S	S	*	*			trans	-171.8	126.4	145.4	-92	-75.4	0	0	0	115.1	F915 P1170	F915-Y1172 WeakPolarHBondContact CE1-O 3.14Å; F915-Y1172 WeakPolarHBondContact CZ-O 3.47Å; P1170-Y1172 PolarHBondContact O-N 3.28Å
1173	Q	30	Very low	32.9	Very low	159.8 Å²	159.8	136.6 Å²	136.6	75%	0.747	73%	0.728	S	S	*	*			trans	-135.7	130	145.7	-162.4	176.6	14.3	0	0	112.7	K619 F915	K619-Q1173 VanDerWaalsContact NZ-OE1 3.16Å; F915-Q1173 HydrophobicContact CE1-CB 4.31Å; F915-Q1173 HydrophobicContact CE2-CB 3.67Å; F915-Q1173 VanDerWaalsContact CE2-CD 3.49Å; F915-Q1173 HydrophobicContact CE2-CG 3.9Å; F915-Q1173 HydrophobicContact CZ-CB 3.33Å; F915-Q1173 HydrophobicContact CZ-CG 3.58Å
1174	T	33	Very low	32.8	Very low	113.6 Å²	113.6	136.9 Å²	136.9	70%	0.697	73%	0.73	S	S	*	*			trans	-96.1	147	163.3	12	0	0	0	0	114.3
1175	Q	33.2	Very low	32.9	Very low	160.2 Å²	160.2	137.8 Å²	137.8	75%	0.749	73%	0.733	S	S	*	*				-138.4	153	54.7	-127.8	164.7	-2	0	0	111.3	L938 L939	L938-Q1175 CarbonylContact C-O 3.54Å; L938-Q1175 VanDerWaalsContact C-O 3.26Å; L938-Q1175 CarbonylContact O-C 3.13Å; L939-Q1175 HydrophobicContact CB-CB 3.87Å; L939-Q1175 VanDerWaalsContact CD2-OE1 3.25Å; L939-Q1175 PolarHBondContact N-O 2.9Å
1176	L	33.2	Very low	33	Very low	152.8 Å²	152.8	136.8 Å²	136.8	80%	0.8	74%	0.738	S	S	*	*			trans	-98.3	149.3	149.9	-84	162.3	0	0	0	110.5	L938	L938-L1176 HydrophobicContact CB-CB 4.25Å; L938-L1176 PolarHBondContact O-N 2.96Å
1177	G	31.2	Very low	33.5	Very low	65 Å²	65	135.2 Å²	135.2	67%	0.67	74%	0.736	S	S	*	*			cis	171.6	127.4	7.1	0	0	0	0	0	112.4
1178	I	33.6	Very low	33.5	Very low	159.6 Å²	159.6	133.6 Å²	133.6	82%	0.818	74%	0.742	S	S	*	*			trans	-133.1	139.4	162.9	15.7	166.4	0	0	0	113.8
1179	S	30.5	Very low	33.9	Very low	103.4 Å²	103.4	133 Å²	133	72%	0.723	75%	0.745	S	S	*	*			trans	66.5	135.6	144.7	-154.6	0	0	0	0	117.9
1180	S	31.6	Very low	33.9	Very low	88.2 Å²	88.2	134.8 Å²	134.8	62%	0.617	76%	0.756	S	S	*	*				-124	157	52.2	10.1	0	0	0	0	113.2
1181	Q	32.4	Very low	33.7	Very low	160.4 Å²	160.4	136.1 Å²	136.1	75%	0.75	76%	0.757	S	S	*	*			trans	95.8	115	146.6	-66	179.2	32.5	0	0	116	I1966	Q1181-I1966 HydrophobicContact CG-CD1 4.2Å
1182	Y	33.8	Very low	33.7	Very low	195.6 Å²	195.6	137.3 Å²	137.3	77%	0.767	76%	0.76	S	S	*	*			trans	-148.5	139.1	145.5	-95.2	-87	0	0	0	111.9	M1963 T1964 C1965	Y1182-M1963 HydrophobicContact CD1-CB 3.65Å; Y1182-M1963 WeakPolarHBondContact CD1-O 3.42Å; Y1182-M1963 HydrophobicContact CG-CB 3.93Å; Y1182-M1963 HydrophobicContact CG-CG 4.25Å; Y1182-T1964 WeakPolarHBondContact CA-OG1 3.31Å; Y1182-T1964 WeakPolarHBondContact CD1-O 3.41Å; Y1182-T1964 HydrophobicContact CD2-CG2 4.08Å; Y1182-T1964 WeakPolarHBondContact CD2-O 3.28Å; Y1182-T1964 WeakPolarHBondContact CD2-OG1 3.2Å; Y1182-T1964 WeakPolarHBondContact CE1-O 2.97Å; Y1182-T1964 HydrophobicContact CE2-CG2 4.1Å; Y1182-T1964 HydrophobicContact CG-CG2 4.43Å; Y1182-T1964 VanDerWaalsContact CG-N 3.35Å; Y1182-T1964 PolarHBondContact N-OG1 3.1Å; Y1182-T1964 WeakPolarHBondContact OH-CA 2.89Å; Y1182-C1965 HydrophobicContact CD2-CB 3.84Å; Y1182-C1965 WeakPolarHBondContact CD2-SG 3.45Å; Y1182-C1965 HydrophobicContact CE2-CB 4.21Å; Y1182-C1965 VanDerWaalsContact CG-N 3.29Å; Y1182-C1965 PolarHBondContact N-SG 3.28Å; Y1182-C1965 VanDerWaalsContact N-SG 3.41Å
1183	S	31.6	Very low	33.7	Very low	105.8 Å²	105.8	131.7 Å²	131.7	74%	0.74	75%	0.752	S	S	*	*			trans	-124	142.1	169.1	-66.8	0	0	0	0	112.6	I1185	S1183-I1185 PolarHBondContact O-N 2.97Å
1184	P	37.1	Very low	33.8	Very low	117.8 Å²	117.8	131.8 Å²	131.8	77%	0.765	75%	0.754	S	S	*	*			trans	-88.8	152.1	178.5	27.4	-22.3	0	0	0	112.5	T1186	P1184-T1186 PolarHBondContact O-N 3.46Å; P1184-T1186 VanDerWaalsContact O-N 3.13Å
1185	I	35.9	Very low	33.9	Very low	161.4 Å²	161.4	134.5 Å²	134.5	83%	0.828	76%	0.758	S	S	*	*			trans	-107.7	121.5	170.8	-60.4	174.8	0	0	0	110.6	S1183 P1187	S1183-I1185 PolarHBondContact O-N 2.97Å; I1185-P1187 HydrophobicContact CG2-CG 4.17Å
1186	T	37.2	Very low	33.8	Very low	132.4 Å²	132.4	132.5 Å²	132.5	81%	0.812	76%	0.757	S	S	*	*			trans	-96.8	135.8	173.7	22.8	0	0	0	0	111.5	P1184 A1188	P1184-T1186 PolarHBondContact O-N 3.46Å; P1184-T1186 VanDerWaalsContact O-N 3.13Å; T1186-A1188 PolarHBondContact O-N 3.33Å
1187	P	41.5	Very low	33.7	Very low	118 Å²	118	132.7 Å²	132.7	77%	0.766	76%	0.758	S	S	*	*			trans	-100	139.9	172.4	15.4	-1.4	0	0	0	111.4	I1185	I1185-P1187 HydrophobicContact CG2-CG 4.17Å
1188	A	34.4	Very low	33.5	Very low	88.6 Å²	88.6	134.5 Å²	134.5	73%	0.732	76%	0.76	S	S	*	*			trans	37.4	134.1	155.9	0	0	0	0	0	114	T1186 M1190	T1186-A1188 PolarHBondContact O-N 3.33Å; A1188-M1190 PolarHBondContact O-N 3.02Å; A1188-M1190 VanDerWaalsContact O-N 3.15Å
1189	P	39.3	Very low	33.6	Very low	124.6 Å²	124.6	133.1 Å²	133.1	81%	0.809	76%	0.76	S	S	*	*			trans	-87.8	135.9	162.2	34.4	-33.2	0	0	0	112.7	N1191	P1189-N1191 PolarHBondContact O-N 3.1Å
1190	M	33.6	Very low	33.5	Very low	183.4 Å²	183.4	136.8 Å²	136.8	90%	0.903	77%	0.766	S	S	*	*			trans	-101.2	135.3	162.2	-83.2	-177.2	-146.3	0	0	110.8	A1188	A1188-M1190 PolarHBondContact O-N 3.02Å; A1188-M1190 VanDerWaalsContact O-N 3.15Å
1191	N	32.4	Very low	33.6	Very low	133.4 Å²	133.4	139 Å²	139	71%	0.713	78%	0.78	S	S	*	*			trans	-104.1	144.4	162.9	-173.6	12	0	0	0	110.6	T586 P1189 S1193	T586-N1191 PolarHBondContact O-ND2 3.24Å; P1189-N1191 PolarHBondContact O-N 3.1Å; N1191-S1193 PolarHBondContact OD1-N 3.18Å; N1191-S1193 VanDerWaalsContact OD1-N 3.15Å
1192	M	30.4	Very low	33.8	Very low	152.8 Å²	152.8	135 Å²	135	75%	0.753	78%	0.781	S	S	*	*			trans	-132.3	120.9	149.6	-64.1	-143.3	25.8	0	0	110.3	T588 T589	T588-M1192 WeakPolarHBondContact O-CE 3.46Å; T589-M1192 HydrophobicContact CG2-CB 4.2Å; T589-M1192 HydrophobicContact CG2-CG 3.72Å; T589-M1192 HydrophobicContact CG2-SD 3.46Å; T589-M1192 WeakPolarHBondContact CG2-SD 3.36Å; T589-M1192 PolarHBondContact OG1-O 3.39Å
1193	S	31.9	Very low	33.8	Very low	89.6 Å²	89.6	129 Å²	129	63%	0.627	78%	0.779	S	S	*	*			trans	-86.4	140.9	168.4	-155.4	0	0	0	0	113.1	T588 N1191	T588-S1193 VanDerWaalsContact CA-CB 3.42Å; T588-S1193 PolarHBondContact OG1-OG 3.23Å; N1191-S1193 PolarHBondContact OD1-N 3.18Å; N1191-S1193 VanDerWaalsContact OD1-N 3.15Å
1194	M	32.3	Very low	34.2	Very low	161.4 Å²	161.4	129 Å²	129	80%	0.795	78%	0.776	S	S	*	*			trans	-108.3	138.1	170.9	-78.1	-82.9	-72.2	0	0	110.4	T1196	M1194-T1196 HydrophobicContact CE-CG2 4.43Å
1195	H	33.7	Very low	34.1	Very low	170.8 Å²	170.8	128.2 Å²	128.2	79%	0.791	77%	0.774	S	S	*	*			trans	-121.1	144.6	166.3	-90.5	-81.7	0	0	0	111.3
1196	T	31.6	Very low	33.8	Very low	118.2 Å²	118.2	127.3 Å²	127.3	73%	0.725	77%	0.77	S	S	*	*			trans	-122.6	145.1	157.5	31.4	0	0	0	0	111.9	M1194	M1194-T1196 HydrophobicContact CE-CG2 4.43Å
1197	L	31.2	Very low	33.6	Very low	157 Å²	157	126.8 Å²	126.8	82%	0.822	77%	0.767	S	S	*	*				-136.4	141.4	126.8	-84.4	161.2	0	0	0	110.2
1198	S	28.4	Very low	33.1	Very low	101.6 Å²	101.6	127.2 Å²	127.2	71%	0.71	77%	0.767	S	S	*	*				-171.6	130.1	94.9	-65.2	0	0	0	0	112.9
1199	T	33.8	Very low	32.9	Very low	131.6 Å²	131.6	130.4 Å²	130.4	81%	0.807	77%	0.771	S	S	*	*			trans	-177.2	123.3	153.3	38.9	0	0	0	0	109
1200	E	30.2	Very low	32.5	Very low	180.6 Å²	180.6	129.3 Å²	129.3	84%	0.844	77%	0.766	S	S	*	*				83.3	137.2	63.7	-72.9	-172.1	163	0	0	113
1201	C	33.7	Very low	32.3	Very low	134.8 Å²	134.8	125.5 Å²	125.5	91%	0.911	76%	0.758	S	S	*	*			trans	161.4	139.9	137.9	-108	0	0	0	0	113
1202	G	35.9	Very low	32.3	Very low	76.4 Å²	76.4	124.2 Å²	124.2	79%	0.788	76%	0.759	S	S	*	*			trans	113.2	151.8	162.8	0	0	0	0	0	115.1
1203	G	33.2	Very low	32.4	Very low	69.8 Å²	69.8	121.9 Å²	121.9	72%	0.72	76%	0.758	S	S	*	*			trans	-158.2	175.5	134.2	0	0	0	0	0	113
1204	P	40.3	Very low	32.4	Very low	105.2 Å²	105.2	123.4 Å²	123.4	68%	0.683	76%	0.763	S	S	*	*			cis	-123.3	170.7	11	40.3	-28.1	0	0	0	115.1
1205	S	34.4	Very low	32.2	Very low	100.8 Å²	100.8	122.4 Å²	122.4	71%	0.705	76%	0.761	S	S	*	*			trans	179.3	154.4	154.9	30.8	0	0	0	0	115.2
1206	N	30.8	Very low	32.1	Very low	142 Å²	142	121.2 Å²	121.2	76%	0.759	76%	0.759	S	S	*	*				-142.4	144	77	-79.7	-19.1	0	0	0	113.2
1207	T	32.9	Very low	32	Very low	121.8 Å²	121.8	121.3 Å²	121.3	75%	0.747	76%	0.759	S	S	*	*			trans	97.1	119.2	130.5	44.6	0	0	0	0	118.1
1208	T	29.7	Very low	32.1	Very low	125.8 Å²	125.8	119.4 Å²	119.4	77%	0.772	75%	0.754	S	S	*	*				48.8	132.9	126	-1.7	0	0	0	0	117.1
1209	I	31.9	Very low	32.2	Very low	157.2 Å²	157.2	121.7 Å²	121.7	81%	0.806	76%	0.757	S	S	*	*			trans	109.2	137.7	147.9	-53.2	172.1	0	0	0	113.2
1210	S	29.9	Very low	32.1	Very low	100.4 Å²	100.4	120.7 Å²	120.7	70%	0.702	75%	0.751	S	S	*	*			trans	-174.9	144.2	-169.1	-64	0	0	0	0	115.5
1211	S	30	Very low	32.1	Very low	104.8 Å²	104.8	119.2 Å²	119.2	73%	0.733	75%	0.749	S	S	*	*				78	137.5	125.3	17.7	0	0	0	0	120.2
1212	S	32.3	Very low	31.9	Very low	106.6 Å²	106.6	117.5 Å²	117.5	75%	0.745	74%	0.737	S	S	*	*			trans	63.7	149.8	145	64.7	0	0	0	0	117.6
1213	S	32.1	Very low	31.7	Very low	104.4 Å²	104.4	120.9 Å²	120.9	73%	0.73	74%	0.736	S	S	*	*			cis	-167.6	136.1	18	43.8	0	0	0	0	113.1
1214	V	31.6	Very low	31.5	Very low	120.4 Å²	120.4	123.8 Å²	123.8	73%	0.73	74%	0.735	S	S	*	*				70.4	129	120.9	-164.4	0	0	0	0	114.8
1215	N	29.4	Very low	31.1	Very low	141 Å²	141	123.8 Å²	123.8	75%	0.754	73%	0.733	S	S	*	*			trans	177.9	149.8	138.1	-111	-19.7	0	0	0	116.9
1216	I	30.4	Very low	31.1	Very low	145.4 Å²	145.4	125.2 Å²	125.2	75%	0.746	73%	0.732	S	S	*	*			trans	103.9	118.8	148	-69.2	162.8	0	0	0	114.9
1217	T	30.8	Very low	31.3	Very low	119.8 Å²	119.8	122.8 Å²	122.8	74%	0.735	73%	0.727	S	S	*	*			trans	-177.6	134.4	144.5	30	0	0	0	0	115.8
1218	T	31.7	Very low	31.2	Very low	116.4 Å²	116.4	123.7 Å²	123.7	71%	0.714	73%	0.727	S	S	*	*			trans	108.6	124.6	140.1	20.2	0	0	0	0	117
1219	I	31.7	Very low	31.3	Very low	149.6 Å²	149.6	124 Å²	124	77%	0.767	72%	0.723	S	S	*	*				116.3	124.4	94.8	-73.1	170.9	0	0	0	115.1
1220	T	30.6	Very low	31.2	Very low	111.8 Å²	111.8	124.9 Å²	124.9	69%	0.686	72%	0.722	S	S	*	*			trans	71.6	135.5	146	-17.8	0	0	0	0	115.9
1221	N	30.8	Very low	31.2	Very low	148.2 Å²	148.2	126.9 Å²	126.9	79%	0.793	72%	0.723	S	S	*	*				-176.9	152	120.2	-99.2	-22.9	0	0	0	111.9
1222	C	29	Very low	31.3	Very low	99 Å²	99	126.2 Å²	126.2	67%	0.669	72%	0.723	S	S	*	*			cis	-151.7	152.4	18.9	-86	0	0	0	0	113.7
1223	I	32.2	Very low	31.3	Very low	148.6 Å²	148.6	128.1 Å²	128.1	76%	0.762	72%	0.72	S	S	*	*			trans	61.9	135.6	157.9	-26.2	168.7	0	0	0	115
1224	N	29.5	Very low	31.3	Very low	130.8 Å²	130.8	130.4 Å²	130.4	70%	0.699	72%	0.719	S	S	*	*			cis	157.4	138.7	42.7	-144	36.9	0	0	0	112.9
1225	V	32.4	Very low	31.3	Very low	106 Å²	106	130.8 Å²	130.8	64%	0.642	71%	0.714	S	S	*	*				56.7	137.1	111.3	-156.6	0	0	0	0	115.4
1226	D	32.8	Very low	31.4	Very low	129 Å²	129	131.2 Å²	131.2	69%	0.69	71%	0.711	S	S	*	*			cis	177	157.6	48.2	-111.8	-37.7	0	0	0	116.9	N1228	D1226-N1228 PolarHBondContact OD2-ND2 3.3Å
1227	S	35.8	Very low	31.4	Very low	92.6 Å²	92.6	131.3 Å²	131.3	65%	0.648	71%	0.712	S	S	*	*				62.6	131.2	119.8	-77.9	0	0	0	0	119.2
1228	N	31	Very low	31.6	Very low	139 Å²	139	130.5 Å²	130.5	74%	0.743	71%	0.709	S	S	*	*				85.1	138.7	74.2	-82.5	-45.7	0	0	0	114.6	D1226	D1226-N1228 PolarHBondContact OD2-ND2 3.3Å
1229	L	31.4	Very low	31.6	Very low	133.2 Å²	133.2	131.1 Å²	131.1	70%	0.697	71%	0.712	S	S	*	*				105.9	121.1	90.1	-152.4	74.6	0	0	0	115
1230	F	29.8	Very low	31.6	Very low	175.6 Å²	175.6	129.5 Å²	129.5	77%	0.77	71%	0.705	S	S	*	*				90.2	148.7	105.8	-87.2	-82.1	0	0	0	117.6
1231	I	29.5	Very low	31.7	Very low	142.6 Å²	142.6	130.7 Å²	130.7	73%	0.731	71%	0.707	S	S	*	*				101.5	142.3	124	-66.2	150.9	0	0	0	114.7	E1233	I1231-E1233 HydrophobicContact CB-CG 3.8Å; I1231-E1233 HydrophobicContact CG2-CG 3.85Å
1232	A	33.1	Very low	31.7	Very low	89.2 Å²	89.2	128.3 Å²	128.3	74%	0.737	70%	0.702	S	S	*	*			trans	-170.8	143.1	141.4	0	0	0	0	0	113
1233	E	30.8	Very low	31.9	Very low	146.8 Å²	146.8	127.5 Å²	127.5	69%	0.686	70%	0.703	S	S	*	*			trans	159.3	152.6	155.7	-96.9	-161.6	120.4	0	0	114.8	N1019 I1231 Q1235	N1019-E1233 WeakPolarHBondContact CB-O 3.41Å; N1019-E1233 PolarHBondContact ND2-O 3.35Å; I1231-E1233 HydrophobicContact CB-CG 3.8Å; I1231-E1233 HydrophobicContact CG2-CG 3.85Å; E1233-Q1235 HydrophobicContact CG-CG 4.26Å; E1233-Q1235 PolarHBondContact OE1-NE2 3.18Å; E1233-Q1235 PolarHBondContact OE2-NE2 2.87Å
1234	H	32.8	Very low	31.9	Very low	153.2 Å²	153.2	127.8 Å²	127.8	71%	0.709	70%	0.701	S	S	*	*			trans	160.9	149.6	144.2	-80.3	-4	0	0	0	114.3	I1017 S1018 N1019	I1017-H1234 CarbonylContact O-C 3.45Å; S1018-H1234 CarbonylContact C-O 3.44Å; S1018-H1234 WeakPolarHBondContact CA-O 3.23Å; N1019-H1234 WeakPolarHBondContact CA-O 3.28Å; N1019-H1234 HydrophobicContact CB-CB 4.39Å; N1019-H1234 VanDerWaalsContact CB-O 3.28Å; N1019-H1234 WeakPolarHBondContact CB-O 3.37Å; N1019-H1234 VanDerWaalsContact CG-C 3.49Å; N1019-H1234 PolarHBondContact N-O 2.73Å
1235	Q	30.9	Very low	31.9	Very low	129.8 Å²	129.8	126.7 Å²	126.7	61%	0.607	70%	0.702	S	S	*	*			trans	-145.1	155	149.9	-67.9	155.9	10.4	0	0	114.9	I1017 S1018 N1019 P1020 E1233	I1017-Q1235 HydrophobicContact CG2-CB 4.5Å; I1017-Q1235 VanDerWaalsContact O-CA 3.32Å; I1017-Q1235 WeakPolarHBondContact O-CA 3.39Å; S1018-Q1235 VanDerWaalsContact C-C 3.41Å; S1018-Q1235 CarbonylContact O-C 3.43Å; N1019-Q1235 PolarHBondContact OD1-N 2.93Å; P1020-Q1235 WeakPolarHBondContact CD-O 3.5Å; E1233-Q1235 HydrophobicContact CG-CG 4.26Å; E1233-Q1235 PolarHBondContact OE1-NE2 3.18Å; E1233-Q1235 PolarHBondContact OE2-NE2 2.87Å
1236	H	32.4	Very low	31.9	Very low	149 Å²	149	127.5 Å²	127.5	69%	0.69	70%	0.703	S	S	*	*			trans	91.1	120.9	146.7	-67.2	-70.7	0	0	0	119.5	S1018	S1018-H1236 CarbonylContact O-C 3.11Å; S1018-H1236 PolarHBondContact O-N 2.95Å
1237	L	29.5	Very low	31.8	Very low	147.6 Å²	147.6	127.3 Å²	127.3	77%	0.773	70%	0.702	S	S	*	*				45.9	158.7	100.4	-98.4	95.2	0	0	0	115.8
1238	P	35.3	Very low	31.6	Very low	102.6 Å²	102.6	127.4 Å²	127.4	67%	0.666	70%	0.702	S	S	*	*				-121.5	177.7	-75.6	30	-12.8	0	0	0	113.7
1239	V	33.1	Very low	31.7	Very low	129.4 Å²	129.4	126.8 Å²	126.8	78%	0.784	70%	0.699	S	S	*	*			trans	-178.5	142.6	150.9	169.9	0	0	0	0	113.2
1240	N	31.3	Very low	31.7	Very low	114.6 Å²	114.6	128.1 Å²	128.1	61%	0.613	70%	0.699	S	S	*	*			trans	-45.7	145.5	176	-70.4	-16.3	0	0	0	117.8	Q827	Q827-N1240 PolarHBondContact OE1-ND2 2.81Å
1241	N	32.5	Very low	31.8	Very low	137.2 Å²	137.2	124.4 Å²	124.4	73%	0.734	70%	0.695	S	S	*	*				137	133.6	127	-77.2	-32.9	0	0	0	114.4	C1256	N1241-C1256 VanDerWaalsContact OD1-C 3.23Å; N1241-C1256 PolarHBondContact OD1-N 2.93Å; N1241-C1256 PolarHBondContact OD1-O 2.73Å
1242	S	30.6	Very low	31.9	Very low	98.6 Å²	98.6	122.8 Å²	122.8	69%	0.69	70%	0.696	S	S	*	*				159.2	142.2	101.8	47.3	0	0	0	0	115.6
1243	A	33.6	Very low	31.8	Very low	82.8 Å²	82.8	123.4 Å²	123.4	68%	0.684	70%	0.695	S	S	*	*			trans	78.6	132.5	170.9	0	0	0	0	0	114.3
1244	E	30.8	Very low	31.8	Very low	154.4 Å²	154.4	120.9 Å²	120.9	72%	0.721	69%	0.694	S	S	*	*			cis	134.6	155.5	24.7	-120.4	172.9	-173	0	0	112.4	R1491 P1557	E1244-R1491 VanDerWaalsContact CB-NH1 3.31Å; E1244-R1491 PolarHBondContact O-NH1 2.72Å; E1244-R1491 PolarHBondContact O-NH2 3.28Å; E1244-R1491 IonicContact OE2-CZ 3.57Å; E1244-R1491 IonicContact OE2-NE 3.3Å; E1244-R1491 IonicContact OE2-NH1 2.7Å; E1244-R1491 PolarHBondContact OE2-NH1 3.05Å; E1244-P1557 HydrophobicContact CB-CB 3.86Å; E1244-P1557 HydrophobicContact CB-CG 3.72Å; E1244-P1557 HydrophobicContact CG-CB 4.23Å; E1244-P1557 HydrophobicContact CG-CG 3.78Å; E1244-P1557 WeakPolarHBondContact OE2-CB 3.24Å
1245	C	31.2	Very low	31.7	Very low	107 Å²	107	120.5 Å²	120.5	72%	0.723	70%	0.696	S	S	*	*			trans	-116.4	139.7	179.6	-71.5	0	0	0	0	114.6	K1250 R1491	C1245-K1250 PolarHBondContact O-NZ 2.72Å; C1245-R1491 VanDerWaalsContact CB-NH1 3.31Å; C1245-R1491 VanDerWaalsContact N-NH1 3.15Å; C1245-R1491 PolarHBondContact O-NH2 2.73Å
1246	D	31.3	Very low	31.6	Very low	123.6 Å²	123.6	118.8 Å²	118.8	66%	0.661	70%	0.697	S	S	*	*				155.6	150.3	122.2	-116.6	2.4	0	0	0	118.2	K1250 T1555 S1556 P1557	D1246-K1250 WeakPolarHBondContact O-CE 3.31Å; D1246-K1250 PolarHBondContact O-NZ 3.44Å; D1246-T1555 CarbonylContact O-C 3.4Å; D1246-T1555 VanDerWaalsContact O-CB 3.32Å; D1246-T1555 WeakPolarHBondContact O-CB 3.41Å; D1246-T1555 VanDerWaalsContact O-O 3.07Å; D1246-T1555 PolarHBondContact OD2-OG1 2.9Å; D1246-S1556 VanDerWaalsContact O-CA 3.29Å; D1246-S1556 WeakPolarHBondContact O-CA 3.4Å; D1246-S1556 PolarHBondContact O-N 3.14Å; D1246-P1557 HydrophobicContact CB-CG 4.06Å; D1246-P1557 WeakPolarHBondContact O-CD 3.34Å
1247	N	30.9	Very low	31.6	Very low	124.8 Å²	124.8	116.6 Å²	116.6	67%	0.667	70%	0.697	S	S	*	*			trans	27.6	114.7	149.9	-87.1	-46	0	0	0	120.7	T1555	N1247-T1555 WeakPolarHBondContact CB-OG1 3.5Å; N1247-T1555 PolarHBondContact N-OG1 3.2Å; N1247-T1555 PolarHBondContact ND2-OG1 3Å
1248	S	31.2	Very low	31.6	Very low	93.6 Å²	93.6	118.3 Å²	118.3	66%	0.655	70%	0.698	S	S	*	*				140.5	137.7	104.1	67.6	0	0	0	0	117.4
1249	N	34	Very low	31.4	Very low	126.8 Å²	126.8	119.9 Å²	119.9	68%	0.678	70%	0.701	S	S	*	*			trans	94	113.5	143.8	-80.5	-52.4	0	0	0	116.4	N1482	N1249-N1482 PolarHBondContact O-ND2 3.35Å
1250	K	31.8	Very low	31.2	Very low	161.2 Å²	161.2	117.1 Å²	117.1	70%	0.701	69%	0.692	S	S	*	*			trans	50.2	135.5	135.1	-64.1	172.9	-179.2	168.4	0	117.4	C1245 D1246	C1245-K1250 PolarHBondContact O-NZ 2.72Å; D1246-K1250 WeakPolarHBondContact O-CE 3.31Å; D1246-K1250 PolarHBondContact O-NZ 3.44Å
1251	S	30.9	Very low	31.2	Very low	97 Å²	97	117.7 Å²	117.7	68%	0.678	70%	0.695	S	S	*	*			cis	-160.5	144.8	5.9	-28	0	0	0	0	112.1	N1482	S1251-N1482 PolarHBondContact N-ND2 3.1Å
1252	S	32	Very low	31.3	Very low	109.2 Å²	109.2	121.1 Å²	121.1	76%	0.764	70%	0.698	S	S	*	*			trans	-26.1	133.9	159	-35.5	0	0	0	0	115.8
1253	S	30.7	Very low	31.5	Very low	102.4 Å²	102.4	123.5 Å²	123.5	72%	0.716	70%	0.702	S	S	*	*				-177.9	154.4	96.3	51.2	0	0	0	0	111.9
1254	S	30.9	Very low	31.4	Very low	93.4 Å²	93.4	122.5 Å²	122.5	65%	0.653	70%	0.7	S	S	*	*			cis	152.9	161.7	25.2	105.1	0	0	0	0	113.9
1255	I	31.5	Very low	31.5	Very low	146.2 Å²	146.2	123 Å²	123	75%	0.75	71%	0.706	S	S	*	*			trans	56.2	137.8	138.9	-65.5	163.6	0	0	0	114.5	F1258	I1255-F1258 HydrophobicContact CG2-CE2 4.2Å
1256	C	29	Very low	31.5	Very low	94 Å²	94	120.9 Å²	120.9	64%	0.635	70%	0.703	S	S	*	*				-158.8	147.9	110.1	-70.4	0	0	0	0	115	N1241	N1241-C1256 VanDerWaalsContact OD1-C 3.23Å; N1241-C1256 PolarHBondContact OD1-N 2.93Å; N1241-C1256 PolarHBondContact OD1-O 2.73Å
1257	C	31.9	Very low	31.5	Very low	103 Å²	103	121.1 Å²	121.1	70%	0.696	70%	0.704	S	S	*	*			trans	167.8	149.6	141.1	-78.2	0	0	0	0	116.1
1258	F	29.7	Very low	31.6	Very low	182.2 Å²	182.2	124.5 Å²	124.5	80%	0.799	71%	0.713	S	S	*	*				-164.2	152.3	111.3	-74.7	-94.5	0	0	0	111.7	I1255	I1255-F1258 HydrophobicContact CG2-CE2 4.2Å
1259	D	29.5	Very low	31.5	Very low	136 Å²	136	124.6 Å²	124.6	73%	0.727	71%	0.714	S	S	*	*				-135.7	159.8	60	-144.6	-12.4	0	0	0	113.1	N1261	D1259-N1261 PolarHBondContact OD1-N 3.03Å; D1259-N1261 PolarHBondContact OD1-ND2 2.71Å; D1259-N1261 PolarHBondContact OD2-ND2 2.93Å
1260	A	29.9	Very low	31.2	Very low	70.2 Å²	70.2	125.9 Å²	125.9	58%	0.58	72%	0.721	S	S	*	*			trans	-140.4	127.8	-135.7	0	0	0	0	0	114.3	R1262	A1260-R1262 PolarHBondContact O-N 3.17Å
1261	N	31.7	Very low	31.1	Very low	128.6 Å²	128.6	123.2 Å²	123.2	69%	0.688	72%	0.722	S	S	*	*			trans	121.5	112.3	164.4	-84.8	-81.2	0	0	0	117.6	D1259	D1259-N1261 PolarHBondContact OD1-N 3.03Å; D1259-N1261 PolarHBondContact OD1-ND2 2.71Å; D1259-N1261 PolarHBondContact OD2-ND2 2.93Å
1262	R	33.1	Very low	31.1	Very low	207.8 Å²	207.8	126.2 Å²	126.2	78%	0.784	73%	0.73	S	S	*	*			trans	161.4	112.1	142.1	-85.5	177.9	-174.1	-100.3	-4.3	117.9	A1260 G1264	A1260-R1262 PolarHBondContact O-N 3.17Å; R1262-G1264 PolarHBondContact O-N 3.38Å
1263	L	35	Very low	31	Very low	150.2 Å²	150.2	128 Å²	128	79%	0.786	73%	0.731	S	S	*	*			trans	58.4	128.6	138.3	-66.9	167.9	0	0	0	114.1	H1735 T1736	L1263-H1735 CarbonylContact C-O 3.49Å; L1263-T1736 CarbonylContact C-O 3.08Å
1264	G	32.3	Very low	31	Very low	61.6 Å²	61.6	132.2 Å²	132.2	64%	0.635	74%	0.736	S	S	*	*				153.1	126.5	72.8	0	0	0	0	0	112.5	R1262 H1735 T1736 T1737	R1262-G1264 PolarHBondContact O-N 3.38Å; G1264-H1735 PolarHBondContact N-O 2.92Å; G1264-T1736 PolarHBondContact N-O 3.33Å; G1264-T1736 CarbonylContact O-C 3.59Å; G1264-T1736 VanDerWaalsContact O-CA 3.28Å; G1264-T1736 WeakPolarHBondContact O-CA 3.32Å; G1264-T1736 PolarHBondContact O-N 3.29Å; G1264-T1737 CarbonylContact C-O 3.35Å; G1264-T1737 VanDerWaalsContact CA-N 3.3Å; G1264-T1737 PolarHBondContact O-N 3.02Å
1265	L	33.6	Very low	30.9	Very low	163.6 Å²	163.6	133.6 Å²	133.6	86%	0.857	74%	0.743	S	S	*	*			trans	-93	151.3	150.4	-65.3	148.3	0	0	0	110	T1737	L1265-T1737 WeakPolarHBondContact CD1-O 3.45Å; L1265-T1737 VanDerWaalsContact CG-O 3.28Å; L1265-T1737 WeakPolarHBondContact CG-O 3.36Å; L1265-T1737 PolarHBondContact N-O 3.36Å
1266	G	29.9	Very low	30.8	Very low	64 Å²	64	131.3 Å²	131.3	66%	0.66	74%	0.74	S	S	*	*			cis	136.4	149.7	49	0	0	0	0	0	111.7
1267	N	31.7	Very low	30.6	Very low	127.4 Å²	127.4	134.2 Å²	134.2	68%	0.681	75%	0.746	S	S	*	*			trans	104.5	126.6	173.3	-78	-1	0	0	0	115.2	N771	N771-N1267 PolarHBondContact OD1-ND2 3.3Å
1268	F	33.1	Very low	30.4	Very low	195.4 Å²	195.4	138.6 Å²	138.6	86%	0.857	75%	0.749	S	S	*	*			trans	167.3	159	142.7	-83.6	-73.4	0	0	0	114.2
1269	S	29.4	Very low	30.4	Very low	96.6 Å²	96.6	135.5 Å²	135.5	68%	0.676	74%	0.741	S	S	*	*			trans	-111.8	163.3	-159	-54.6	0	0	0	0	112.9	S1271	S1269-S1271 PolarHBondContact O-N 3.43Å
1270	D	26.9	Very low	30.4	Very low	153.8 Å²	153.8	135.8 Å²	135.8	82%	0.822	74%	0.743	S	S	*	*			trans	49.3	132.3	155.8	-60.9	-47.4	0	0	0	119.4
1271	S	30	Very low	30.5	Very low	103.8 Å²	103.8	139.3 Å²	139.3	73%	0.726	75%	0.752	S	S	*	*			trans	114.1	109.6	157.3	-70	0	0	0	0	116.9	S1269	S1269-S1271 PolarHBondContact O-N 3.43Å
1272	L	31.1	Very low	30.4	Very low	160 Å²	160	136.3 Å²	136.3	84%	0.838	75%	0.751	S	S	*	*				81.3	130.4	129	-59.1	174.3	0	0	0	116.1
1273	L	30.6	Very low	30.3	Very low	148.2 Å²	148.2	133 Å²	133	78%	0.776	75%	0.75	S	S	*	*			trans	96.6	109.4	142.3	-75.7	144.4	0	0	0	117.7
1274	F	29.5	Very low	30.1	Very low	190 Å²	190	132.4 Å²	132.4	83%	0.833	75%	0.747	S	S	*	*			trans	-25.1	155	143.8	-66.6	-77.6	0	0	0	112.8	S1276	F1274-S1276 PolarHBondContact O-N 2.99Å
1275	P	30.2	Very low	30.1	Very low	122.4 Å²	122.4	136.8 Å²	136.8	80%	0.795	76%	0.755	S	S	*	*				-124.9	155.2	72.2	37.4	-27.2	0	0	0	115.2
1276	S	27.8	Very low	29.9	Very low	99.2 Å²	99.2	135.6 Å²	135.6	69%	0.694	75%	0.748	S	S	*	*			trans	-115.5	132.4	152.7	-156.3	0	0	0	0	114.4	F1274 Y1278	F1274-S1276 PolarHBondContact O-N 2.99Å; S1276-Y1278 PolarHBondContact O-N 3.21Å
1277	M	25.9	Very low	29.9	Very low	153.4 Å²	153.4	139.4 Å²	139.4	76%	0.756	75%	0.752	S	S	*	*			trans	41.3	130.5	145.3	-58.7	-99.1	-75.8	0	0	113.1
1278	Y	28.4	Very low	29.8	Very low	195.2 Å²	195.2	137.3 Å²	137.3	77%	0.765	75%	0.752	S	S	*	*				155.6	138	124.1	-104.8	-111.5	0	0	0	114.2	S1276 N1283	S1276-Y1278 PolarHBondContact O-N 3.21Å; Y1278-N1283 PolarHBondContact OH-ND2 3.37Å
1279	N	29.1	Very low	29.5	Very low	117.8 Å²	117.8	134.5 Å²	134.5	63%	0.63	75%	0.746	S	S	*	*			trans	-46	130.5	132.2	-171.1	25.1	0	0	0	113.7	N1281	N1279-N1281 PolarHBondContact O-N 2.87Å; N1279-N1281 PolarHBondContact OD1-N 2.71Å; N1279-N1281 PolarHBondContact OD1-ND2 3.09Å; N1279-N1281 VanDerWaalsContact OD1-ND2 3.14Å; N1279-N1281 PolarHBondContact OD1-OD1 2.83Å
1280	N	29	Very low	29.5	Very low	143.2 Å²	143.2	136.8 Å²	136.8	77%	0.766	75%	0.751	S	S	*	*			trans	-146.1	134.6	134.5	-88.6	-44	0	0	0	112.4
1281	N	31.3	Very low	29.7	Very low	142.4 Å²	142.4	134.9 Å²	134.9	76%	0.761	75%	0.745	S	S	*	*			trans	-111.9	140.8	165.6	-73.2	-29.6	0	0	0	111.9	N1279	N1279-N1281 PolarHBondContact O-N 2.87Å; N1279-N1281 PolarHBondContact OD1-N 2.71Å; N1279-N1281 PolarHBondContact OD1-ND2 3.09Å; N1279-N1281 VanDerWaalsContact OD1-ND2 3.14Å; N1279-N1281 PolarHBondContact OD1-OD1 2.83Å
1282	G	29.7	Very low	29.7	Very low	66 Å²	66	136.8 Å²	136.8	68%	0.68	75%	0.747	S	S	*	*			trans	-152.5	159.2	-177.3	0	0	0	0	0	114.3	N1284	G1282-N1284 PolarHBondContact O-N 3.27Å
1283	N	31.7	Very low	29.6	Very low	139.8 Å²	139.8	134.5 Å²	134.5	75%	0.748	74%	0.74	S	S	*	*			trans	56.1	111	147.3	-67.3	-2.2	0	0	0	115.4	Y1278 Q1473	Y1278-N1283 PolarHBondContact OH-ND2 3.37Å; N1283-Q1473 PolarHBondContact OD1-NE2 3.07Å
1284	N	31.5	Very low	29.7	Very low	135.8 Å²	135.8	133.6 Å²	133.6	73%	0.726	74%	0.736	S	S	*	*				-169.1	135.9	118.7	-82.8	-20.5	0	0	0	113.3	G1282 I1286	G1282-N1284 PolarHBondContact O-N 3.27Å; N1284-I1286 PolarHBondContact O-N 3.01Å
1285	L	30.6	Very low	29.7	Very low	155.8 Å²	155.8	130.1 Å²	130.1	82%	0.816	73%	0.726	S	S	*	*			trans	-134.1	113.9	140.1	-165.2	67.4	0	0	0	109.5	I1287	L1285-I1287 PolarHBondContact O-N 3.44Å
1286	I	29.7	Very low	29.8	Very low	137.4 Å²	137.4	130.7 Å²	130.7	71%	0.705	72%	0.722	S	S	*	*			trans	-101.7	121.1	131.8	-72.1	172.9	0	0	0	113.2	N1284 A1288	N1284-I1286 PolarHBondContact O-N 3.01Å; I1286-A1288 HydrophobicContact CG2-CB 4.26Å
1287	I	29.7	Very low	29.9	Very low	143.6 Å²	143.6	132.9 Å²	132.9	74%	0.736	73%	0.726	S	S	*	*			trans	-60.9	131.9	139.2	-68.7	172.1	0	0	0	112.7	L1285 D1289	L1285-I1287 PolarHBondContact O-N 3.44Å; I1287-D1289 VanDerWaalsContact C-N 3.35Å; I1287-D1289 PolarHBondContact O-N 3.02Å
1288	A	29.6	Very low	30.3	Very low	82.8 Å²	82.8	132.9 Å²	132.9	68%	0.684	73%	0.728	S	S	*	*			trans	-126	127.7	164.3	0	0	0	0	0	111.6	I1286 N1290	I1286-A1288 HydrophobicContact CG2-CB 4.26Å; A1288-N1290 PolarHBondContact O-N 3.31Å
1289	D	28.1	Very low	30.4	Very low	137 Å²	137	132.5 Å²	132.5	73%	0.733	73%	0.73	S	S	*	*			trans	-84.7	136.6	146.6	-77.3	-48.3	0	0	0	113.4	I1287 T1291	I1287-D1289 VanDerWaalsContact C-N 3.35Å; I1287-D1289 PolarHBondContact O-N 3.02Å; D1289-T1291 PolarHBondContact O-N 3.12Å; D1289-T1291 VanDerWaalsContact O-N 3.15Å
1290	N	28.7	Very low	30.5	Very low	144.6 Å²	144.6	132.7 Å²	132.7	77%	0.773	74%	0.738	S	S	*	*			trans	-165.6	134.4	135.9	-112.9	-37.7	0	0	0	113.6	A1288	A1288-N1290 PolarHBondContact O-N 3.31Å
1291	T	31.6	Very low	30.5	Very low	115.2 Å²	115.2	130.5 Å²	130.5	71%	0.707	73%	0.734	S	S	*	*			trans	-114.7	122.5	145.3	54.9	0	0	0	0	113.4	D1289 T1293	D1289-T1291 PolarHBondContact O-N 3.12Å; D1289-T1291 VanDerWaalsContact O-N 3.15Å; T1291-T1293 PolarHBondContact O-N 3.37Å
1292	N	30.6	Very low	30.4	Very low	142.2 Å²	142.2	131.2 Å²	131.2	76%	0.76	74%	0.738	S	S	*	*				44.3	121	129.6	-144.5	3	0	0	0	115.2	N1294	N1292-N1294 PolarHBondContact O-N 3Å; N1292-N1294 PolarHBondContact OD1-ND2 2.95Å
1293	T	28.9	Very low	30.6	Very low	113.4 Å²	113.4	135.4 Å²	135.4	70%	0.696	74%	0.743	S	S	*	*			trans	-115.9	134	148.9	12.4	0	0	0	0	112.5	T1291	T1291-T1293 PolarHBondContact O-N 3.37Å
1294	N	31.2	Very low	30.5	Very low	128 Å²	128	133.3 Å²	133.3	68%	0.684	74%	0.739	S	S	*	*			trans	153.4	141.1	150.6	-77.1	-40.1	0	0	0	115.5	N1292 F1450	N1292-N1294 PolarHBondContact O-N 3Å; N1292-N1294 PolarHBondContact OD1-ND2 2.95Å; N1294-F1450 HydrophobicContact CB-CD1 4.22Å; N1294-F1450 HydrophobicContact CB-CE1 3.49Å; N1294-F1450 VanDerWaalsContact CB-CE1 3.49Å; N1294-F1450 HydrophobicContact CB-CZ 3.73Å; N1294-F1450 VanDerWaalsContact O-CZ 3.27Å; N1294-F1450 WeakPolarHBondContact O-CZ 3.11Å
1295	N	30.6	Very low	30.6	Very low	116.8 Å²	116.8	134.6 Å²	134.6	63%	0.625	74%	0.743	S	S	*	*			trans	95.9	119.5	131.2	-78.8	-28.3	0	0	0	117.5	F1450 N1451	N1295-F1450 HydrophobicContact CB-CB 4.41Å; N1295-F1450 HydrophobicContact CB-CD1 4.01Å; N1295-F1450 HydrophobicContact CB-CD2 3.84Å; N1295-F1450 HydrophobicContact CB-CE1 4.27Å; N1295-F1450 HydrophobicContact CB-CE2 4.13Å; N1295-F1450 HydrophobicContact CB-CG 3.81Å; N1295-F1450 HydrophobicContact CB-CZ 4.33Å; N1295-N1451 HydrophobicContact CB-CB 4.07Å; N1295-N1451 VanDerWaalsContact CG-ND2 3.31Å; N1295-N1451 PolarHBondContact ND2-ND2 3.11Å; N1295-N1451 VanDerWaalsContact ND2-ND2 3.18Å; N1295-N1451 PolarHBondContact ND2-O 2.99Å; N1295-N1451 PolarHBondContact OD1-ND2 3.29Å
1296	N	31.9	Very low	30.7	Very low	135 Å²	135	133.7 Å²	133.7	72%	0.722	74%	0.737	S	S	*	*			trans	62.1	125.8	145.3	-57.5	-28.2	0	0	0	118.6	N1451	N1296-N1451 HydrophobicContact CB-CB 4.47Å; N1296-N1451 PolarHBondContact ND2-ND2 3.06Å
1297	N	31.1	Very low	30.9	Very low	146.4 Å²	146.4	131.9 Å²	131.9	78%	0.783	73%	0.734	S	S	*	*				101	138.8	120.5	-85.9	-11.1	0	0	0	117.8
1298	I	33.6	Very low	30.9	Very low	153.4 Å²	153.4	130.2 Å²	130.2	79%	0.787	74%	0.735	S	S	*	*			trans	116.9	143.9	146.4	-73.5	153.1	0	0	0	114	P1631	I1298-P1631 HydrophobicContact CD1-CG 3.58Å
1299	K	30.1	Very low	31.2	Very low	185 Å²	185	133.4 Å²	133.4	80%	0.804	74%	0.738	S	S	*	*			trans	-94.8	158.7	-179.7	-81	-179.6	176.1	-179.2	0	113.4	S1301	K1299-S1301 PolarHBondContact O-N 3.44Å
1300	P	30.9	Very low	31.6	Very low	123 Å²	123	131.9 Å²	131.9	80%	0.799	73%	0.73	S	S	*	*			trans	-84.7	128.8	-175.8	23.2	-19.8	0	0	0	112.2
1301	S	28.8	Very low	32.2	Very low	97.4 Å²	97.4	132.3 Å²	132.3	68%	0.681	73%	0.727	S	S	*	*			trans	158.7	76.3	135.3	20.3	0	0	0	0	113.1	K1299 I1303	K1299-S1301 PolarHBondContact O-N 3.44Å; S1301-I1303 PolarHBondContact O-N 3.13Å; S1301-I1303 VanDerWaalsContact O-N 3.16Å
1302	D	30.7	Very low	32.7	Very low	157.4 Å²	157.4	131.8 Å²	131.8	84%	0.842	72%	0.72	S	S	*	*			trans	-167	121.1	157.1	-84.2	-32.2	0	0	0	111.9
1303	I	33.9	Very low	33.4	Very low	153.8 Å²	153.8	133.4 Å²	133.4	79%	0.789	72%	0.715	S	S	*	*				-140.8	130.6	127.8	-75.3	169	0	0	0	111.9	S1301 M1305 I1306	S1301-I1303 PolarHBondContact O-N 3.13Å; S1301-I1303 VanDerWaalsContact O-N 3.16Å; I1303-M1305 PolarHBondContact O-N 2.97Å; I1303-M1305 VanDerWaalsContact O-N 3.13Å; I1303-I1306 HydrophobicContact CG2-CD1 4.31Å
1304	S	29.1	Very low	34.3	Very low	95.8 Å²	95.8	133.4 Å²	133.4	67%	0.67	71%	0.71	S	S	*	*			trans	-114.5	157.5	174.4	64.6	0	0	0	0	113
1305	M	33	Very low	35.2	Very low	162.6 Å²	162.6	132.8 Å²	132.8	80%	0.801	71%	0.707	S	S	*	*			trans	112	120.6	135.5	-64.9	-167.3	-171.9	0	0	117.2	I1303 P1307	I1303-M1305 PolarHBondContact O-N 2.97Å; I1303-M1305 VanDerWaalsContact O-N 3.13Å; M1305-P1307 WeakPolarHBondContact O-CD 3.3Å
1306	I	32.6	Very low	36.1	Very low	136.2 Å²	136.2	132.4 Å²	132.4	70%	0.698	70%	0.704	S	S	*	*			trans	-101.1	144	157.9	-74.2	169.7	0	0	0	108.8	I1303 S1308	I1303-I1306 HydrophobicContact CG2-CD1 4.31Å; I1306-S1308 PolarHBondContact O-N 2.9Å
1307	P	35.2	Very low	37.4	Very low	99.8 Å²	99.8	131.2 Å²	131.2	65%	0.648	70%	0.697	S	S	*	*			trans	-92.8	150	-175.2	7.3	7.1	0	0	0	114.5	M1305 M1309	M1305-P1307 WeakPolarHBondContact O-CD 3.3Å; P1307-M1309 PolarHBondContact O-N 3Å
1308	S	29.3	Very low	38.5	Very low	107.8 Å²	107.8	128.4 Å²	128.4	75%	0.754	69%	0.685	S	S	*	*			trans	-55.5	128.3	160	165.7	0	0	0	0	113.7	I1306 N1310	I1306-S1308 PolarHBondContact O-N 2.9Å; S1308-N1310 PolarHBondContact O-N 3.11Å; S1308-N1310 VanDerWaalsContact O-N 3.12Å
1309	M	35.3	Very low	39.7	Very low	149.6 Å²	149.6	125 Å²	125	74%	0.737	67%	0.672	S	S	*	*			trans	-122.2	133.6	155.1	-77.8	-164.9	-21.9	0	0	111.1	P1307 H1311	P1307-M1309 PolarHBondContact O-N 3Å; M1309-H1311 PolarHBondContact O-N 3.24Å
1310	N	36.5	Very low	41	Very low	105.8 Å²	105.8	122.3 Å²	122.3	57%	0.566	66%	0.662	S	S	*	*			trans	-88.4	117.3	-175.5	-81.1	-31.6	0	0	0	113.1	S1308 D1312 R1313 L1314	S1308-N1310 PolarHBondContact O-N 3.11Å; S1308-N1310 VanDerWaalsContact O-N 3.12Å; N1310-D1312 PolarHBondContact O-N 3.04Å; N1310-D1312 VanDerWaalsContact O-N 3.13Å; N1310-R1313 HydrophobicContact CB-CG 4.49Å; N1310-R1313 PolarHBondContact O-N 2.74Å; N1310-L1314 PolarHBondContact O-N 3.02Å
1311	H	41.2	Very low	42.4	Very low	154 Å²	154	123.8 Å²	123.8	71%	0.713	66%	0.656	S	S	*	*	H	α-helix	trans	-95.7	-63.2	165.6	-103	-35.2	0	0	0	113.4	M1309 R1313 L1314 L1315	M1309-H1311 PolarHBondContact O-N 3.24Å; H1311-R1313 VanDerWaalsContact C-N 3.33Å; H1311-R1313 PolarHBondContact O-N 2.95Å; H1311-L1314 WeakPolarHBondContact O-CB 3.3Å; H1311-L1314 PolarHBondContact O-N 3.13Å; H1311-L1314 VanDerWaalsContact O-N 3.15Å; H1311-L1315 WeakPolarHBondContact O-CB 3.34Å; H1311-L1315 VanDerWaalsContact O-CG 3.31Å; H1311-L1315 WeakPolarHBondContact O-CG 3.38Å; H1311-L1315 PolarHBondContact O-N 3Å; H1311-L1315 VanDerWaalsContact O-N 3.11Å
1312	D	43.2	Very low	43.8	Very low	103.4 Å²	103.4	127.5 Å²	127.5	55%	0.553	66%	0.655	S	S	*	*	H	α-helix	trans	-76	-34.6	-169.6	-68	-55.8	0	0	0	114.4	N1310 L1314 L1315 N1316 R1322	N1310-D1312 PolarHBondContact O-N 3.04Å; N1310-D1312 VanDerWaalsContact O-N 3.13Å; D1312-L1314 VanDerWaalsContact C-N 3.32Å; D1312-L1314 PolarHBondContact O-N 3.08Å; D1312-L1315 PolarHBondContact O-N 2.7Å; D1312-N1316 WeakPolarHBondContact O-CB 3.29Å; D1312-N1316 PolarHBondContact O-N 3.27Å; D1312-R1322 WeakPolarHBondContact OD2-CD 3.37Å; D1312-R1322 IonicContact OD2-CZ 3.65Å; D1312-R1322 IonicContact OD2-NE 3.66Å; D1312-R1322 IonicContact OD2-NH1 2.69Å; D1312-R1322 PolarHBondContact OD2-NH1 3.13Å
1313	R	44.4	Very low	45.2	Very low	177.2 Å²	177.2	124.8 Å²	124.8	67%	0.669	64%	0.64	S	S	*	*	H	α-helix	trans	-65.2	-22.3	168.9	-89.1	-173.9	-173.7	-155.8	-1.6	112.4	N1310 H1311 N1316 I1317 Q1320 K1321 R1322	N1310-R1313 HydrophobicContact CB-CG 4.49Å; N1310-R1313 PolarHBondContact O-N 2.74Å; H1311-R1313 VanDerWaalsContact C-N 3.33Å; H1311-R1313 PolarHBondContact O-N 2.95Å; R1313-N1316 PolarHBondContact O-N 3.41Å; R1313-I1317 WeakPolarHBondContact O-CB 3.02Å; R1313-I1317 WeakPolarHBondContact O-CD1 3.31Å; R1313-I1317 VanDerWaalsContact O-CG1 3.26Å; R1313-I1317 WeakPolarHBondContact O-CG1 3.41Å; R1313-I1317 PolarHBondContact O-N 3.11Å; R1313-Q1320 CarbonylContact C-O 3.14Å; R1313-Q1320 WeakPolarHBondContact CB-O 3.29Å; R1313-Q1320 VanDerWaalsContact CD-O 3.31Å; R1313-Q1320 WeakPolarHBondContact CD-O 3.19Å; R1313-Q1320 WeakPolarHBondContact CG-O 3.33Å; R1313-Q1320 CarbonylContact O-C 2.85Å; R1313-K1321 VanDerWaalsContact C-N 3.28Å; R1313-K1321 CarbonylContact O-C 3.52Å; R1313-K1321 PolarHBondContact O-N 2.79Å; R1313-R1322 WeakPolarHBondContact O-CA 3.39Å; R1313-R1322 WeakPolarHBondContact O-CB 3.27Å; R1313-R1322 PolarHBondContact O-N 2.86Å
1314	L	46.9	Very low	46.5	Very low	113.4 Å²	113.4	123.1 Å²	123.1	59%	0.594	63%	0.632	S	S	*	*	H	α-helix	trans	-78.5	-30	169.6	-96	160	0	0	0	114.6	N1310 H1311 D1312 N1316 T1318 T1319 Q1320	N1310-L1314 PolarHBondContact O-N 3.02Å; H1311-L1314 WeakPolarHBondContact O-CB 3.3Å; H1311-L1314 PolarHBondContact O-N 3.13Å; H1311-L1314 VanDerWaalsContact O-N 3.15Å; D1312-L1314 VanDerWaalsContact C-N 3.32Å; D1312-L1314 PolarHBondContact O-N 3.08Å; L1314-N1316 PolarHBondContact O-N 3.19Å; L1314-T1318 WeakPolarHBondContact O-CB 3.36Å; L1314-T1318 WeakPolarHBondContact O-CG2 3.38Å; L1314-T1318 PolarHBondContact O-N 2.99Å; L1314-T1318 PolarHBondContact O-OG1 3.04Å; L1314-T1319 CarbonylContact O-C 3.55Å; L1314-T1319 VanDerWaalsContact O-C 3.28Å; L1314-T1319 VanDerWaalsContact O-O 3.13Å; L1314-Q1320 PolarHBondContact N-O 2.98Å; L1314-Q1320 CarbonylContact O-C 3.05Å; L1314-Q1320 PolarHBondContact O-N 2.91Å; L1314-Q1320 VanDerWaalsContact O-N 3.16Å
1315	L	51.5	Low	48	Very low	115.4 Å²	115.4	122.2 Å²	122.2	60%	0.604	63%	0.626	S	S	*	*	H	α-helix	trans	-56.1	-1.6	174.2	-133.1	87.8	0	0	0	112.8	H1311 D1312 T1318 T1319 Q1320	H1311-L1315 WeakPolarHBondContact O-CB 3.34Å; H1311-L1315 VanDerWaalsContact O-CG 3.31Å; H1311-L1315 WeakPolarHBondContact O-CG 3.38Å; H1311-L1315 PolarHBondContact O-N 3Å; H1311-L1315 VanDerWaalsContact O-N 3.11Å; D1312-L1315 PolarHBondContact O-N 2.7Å; L1315-T1318 WeakPolarHBondContact CA-OG1 3.43Å; L1315-T1318 PolarHBondContact O-N 2.9Å; L1315-T1318 PolarHBondContact O-OG1 3.02Å; L1315-T1318 VanDerWaalsContact O-OG1 3.09Å; L1315-T1319 VanDerWaalsContact O-CB 3.28Å; L1315-T1319 WeakPolarHBondContact O-CB 3.39Å; L1315-T1319 PolarHBondContact O-N 3.04Å; L1315-T1319 PolarHBondContact O-OG1 3.18Å; L1315-Q1320 HydrophobicContact CD1-CG 3.69Å
1316	N	49.5	Very low	49.4	Very low	107.4 Å²	107.4	121 Å²	121	57%	0.574	62%	0.616	S	S	*	*	H	α-helix	trans	-64.8	-85.2	159.3	-161.1	1.2	0	0	0	111.6	D1312 R1313 L1314 T1318 T1319 Q1320	D1312-N1316 WeakPolarHBondContact O-CB 3.29Å; D1312-N1316 PolarHBondContact O-N 3.27Å; R1313-N1316 PolarHBondContact O-N 3.41Å; L1314-N1316 PolarHBondContact O-N 3.19Å; N1316-T1318 VanDerWaalsContact C-N 3.32Å; N1316-T1318 CarbonylContact O-C 3.2Å; N1316-T1318 VanDerWaalsContact O-C 3.3Å; N1316-T1318 PolarHBondContact O-N 3.14Å; N1316-T1318 VanDerWaalsContact O-N 3.1Å; N1316-T1319 CarbonylContact O-C 3.05Å; N1316-T1319 WeakPolarHBondContact O-CB 3.41Å; N1316-T1319 PolarHBondContact O-N 3.2Å; N1316-T1319 VanDerWaalsContact O-N 3.12Å; N1316-Q1320 WeakPolarHBondContact O-CB 3.42Å; N1316-Q1320 WeakPolarHBondContact O-CG 3.3Å; N1316-Q1320 PolarHBondContact O-N 3.26Å; N1316-Q1320 PolarHBondContact OD1-NE2 3.01Å
1317	I	58.6	Low	50.7	Low	110.4 Å²	110.4	122.2 Å²	122.2	57%	0.566	61%	0.613	S	S	*	*	H	α-helix	trans	-42	-22	170.3	-64.2	162.2	0	0	0	111	R1313 T1319 Q1320 K1321	R1313-I1317 WeakPolarHBondContact O-CB 3.02Å; R1313-I1317 WeakPolarHBondContact O-CD1 3.31Å; R1313-I1317 VanDerWaalsContact O-CG1 3.26Å; R1313-I1317 WeakPolarHBondContact O-CG1 3.41Å; R1313-I1317 PolarHBondContact O-N 3.11Å; I1317-T1319 VanDerWaalsContact C-N 3.33Å; I1317-T1319 PolarHBondContact O-N 3.08Å; I1317-Q1320 PolarHBondContact O-N 3.15Å; I1317-K1321 VanDerWaalsContact O-CB 3.27Å; I1317-K1321 WeakPolarHBondContact O-CB 3.3Å; I1317-K1321 WeakPolarHBondContact O-CG 3.47Å; I1317-K1321 PolarHBondContact O-N 3.11Å
1318	T	54.7	Low	52	Low	87.4 Å²	87.4	123.8 Å²	123.8	54%	0.536	61%	0.612	S	S	.	*	H	α-helix	trans	-72.1	-30.8	180	23.9	0	0	0	0	112.2	L1314 L1315 N1316 R1322	L1314-T1318 WeakPolarHBondContact O-CB 3.36Å; L1314-T1318 WeakPolarHBondContact O-CG2 3.38Å; L1314-T1318 PolarHBondContact O-N 2.99Å; L1314-T1318 PolarHBondContact O-OG1 3.04Å; L1315-T1318 WeakPolarHBondContact CA-OG1 3.43Å; L1315-T1318 PolarHBondContact O-N 2.9Å; L1315-T1318 PolarHBondContact O-OG1 3.02Å; L1315-T1318 VanDerWaalsContact O-OG1 3.09Å; N1316-T1318 VanDerWaalsContact C-N 3.32Å; N1316-T1318 CarbonylContact O-C 3.2Å; N1316-T1318 VanDerWaalsContact O-C 3.3Å; N1316-T1318 PolarHBondContact O-N 3.14Å; N1316-T1318 VanDerWaalsContact O-N 3.1Å; T1318-R1322 WeakPolarHBondContact O-CB 3.28Å; T1318-R1322 WeakPolarHBondContact O-CG 3.41Å; T1318-R1322 PolarHBondContact O-N 3.23Å; T1318-R1322 VanDerWaalsContact O-N 3.08Å
1319	T	59.4	Low	53.7	Low	82.2 Å²	82.2	124.2 Å²	124.2	50%	0.504	60%	0.602	S	S	.	*	H	α-helix	trans	-75.6	-25.6	156	-40.4	0	0	0	0	112.9	L1314 L1315 N1316 I1317 R1322 N1323	L1314-T1319 CarbonylContact O-C 3.55Å; L1314-T1319 VanDerWaalsContact O-C 3.28Å; L1314-T1319 VanDerWaalsContact O-O 3.13Å; L1315-T1319 VanDerWaalsContact O-CB 3.28Å; L1315-T1319 WeakPolarHBondContact O-CB 3.39Å; L1315-T1319 PolarHBondContact O-N 3.04Å; L1315-T1319 PolarHBondContact O-OG1 3.18Å; N1316-T1319 CarbonylContact O-C 3.05Å; N1316-T1319 WeakPolarHBondContact O-CB 3.41Å; N1316-T1319 PolarHBondContact O-N 3.2Å; N1316-T1319 VanDerWaalsContact O-N 3.12Å; I1317-T1319 VanDerWaalsContact C-N 3.33Å; I1317-T1319 PolarHBondContact O-N 3.08Å; T1319-R1322 PolarHBondContact O-N 3.13Å; T1319-N1323 WeakPolarHBondContact O-CB 3.11Å; T1319-N1323 VanDerWaalsContact O-CG 3.27Å; T1319-N1323 PolarHBondContact O-N 3.21Å
1320	Q	57	Low	55.1	Low	128 Å²	128	123.1 Å²	123.1	60%	0.598	60%	0.595	S	S	*	*	H	α-helix	trans	-58.8	-71.1	157.9	-69.8	-177.9	4.7	0	0	112.5	R1313 L1314 L1315 N1316 I1317 R1322 N1323 L1324	R1313-Q1320 CarbonylContact C-O 3.14Å; R1313-Q1320 WeakPolarHBondContact CB-O 3.29Å; R1313-Q1320 VanDerWaalsContact CD-O 3.31Å; R1313-Q1320 WeakPolarHBondContact CD-O 3.19Å; R1313-Q1320 WeakPolarHBondContact CG-O 3.33Å; R1313-Q1320 CarbonylContact O-C 2.85Å; L1314-Q1320 PolarHBondContact N-O 2.98Å; L1314-Q1320 CarbonylContact O-C 3.05Å; L1314-Q1320 PolarHBondContact O-N 2.91Å; L1314-Q1320 VanDerWaalsContact O-N 3.16Å; L1315-Q1320 HydrophobicContact CD1-CG 3.69Å; N1316-Q1320 WeakPolarHBondContact O-CB 3.42Å; N1316-Q1320 WeakPolarHBondContact O-CG 3.3Å; N1316-Q1320 PolarHBondContact O-N 3.26Å; N1316-Q1320 PolarHBondContact OD1-NE2 3.01Å; I1317-Q1320 PolarHBondContact O-N 3.15Å; Q1320-R1322 VanDerWaalsContact C-N 3.31Å; Q1320-R1322 PolarHBondContact O-N 3.17Å; Q1320-N1323 PolarHBondContact O-N 3.24Å; Q1320-N1323 VanDerWaalsContact O-N 3.13Å; Q1320-L1324 WeakPolarHBondContact O-CB 3.43Å; Q1320-L1324 PolarHBondContact O-N 3.1Å
1321	K	59.4	Low	56.3	Low	154.4 Å²	154.4	123 Å²	123	67%	0.671	59%	0.591	S	S	*	*	H	α-helix	trans	-72.9	-19.6	152	-137.7	-178.8	-166.5	177.5	0	113.9	R1313 I1317 L1324 S1325	R1313-K1321 VanDerWaalsContact C-N 3.28Å; R1313-K1321 CarbonylContact O-C 3.52Å; R1313-K1321 PolarHBondContact O-N 2.79Å; I1317-K1321 VanDerWaalsContact O-CB 3.27Å; I1317-K1321 WeakPolarHBondContact O-CB 3.3Å; I1317-K1321 WeakPolarHBondContact O-CG 3.47Å; I1317-K1321 PolarHBondContact O-N 3.11Å; K1321-L1324 PolarHBondContact O-N 3.05Å; K1321-S1325 WeakPolarHBondContact O-CB 3.36Å; K1321-S1325 PolarHBondContact O-N 3.05Å; K1321-S1325 PolarHBondContact O-OG 3.35Å
1322	R	58.8	Low	57.4	Low	175.6 Å²	175.6	122.9 Å²	122.9	66%	0.663	59%	0.591	S	S	*	*	H	α-helix	trans	-86.4	-28.2	170.3	-114.7	-179.7	-173.2	146.3	-0.5	112	D1312 R1313 T1318 T1319 Q1320 S1325 K1326	D1312-R1322 WeakPolarHBondContact OD2-CD 3.37Å; D1312-R1322 IonicContact OD2-CZ 3.65Å; D1312-R1322 IonicContact OD2-NE 3.66Å; D1312-R1322 IonicContact OD2-NH1 2.69Å; D1312-R1322 PolarHBondContact OD2-NH1 3.13Å; R1313-R1322 WeakPolarHBondContact O-CA 3.39Å; R1313-R1322 WeakPolarHBondContact O-CB 3.27Å; R1313-R1322 PolarHBondContact O-N 2.86Å; T1318-R1322 WeakPolarHBondContact O-CB 3.28Å; T1318-R1322 WeakPolarHBondContact O-CG 3.41Å; T1318-R1322 PolarHBondContact O-N 3.23Å; T1318-R1322 VanDerWaalsContact O-N 3.08Å; T1319-R1322 PolarHBondContact O-N 3.13Å; Q1320-R1322 VanDerWaalsContact C-N 3.31Å; Q1320-R1322 PolarHBondContact O-N 3.17Å; R1322-S1325 WeakPolarHBondContact CA-OG 3.28Å; R1322-S1325 PolarHBondContact O-OG 3.4Å; R1322-K1326 VanDerWaalsContact O-CG 3.26Å; R1322-K1326 WeakPolarHBondContact O-CG 3.37Å; R1322-K1326 PolarHBondContact O-N 3.19Å; R1322-K1326 VanDerWaalsContact O-N 3.13Å
1323	N	59	Low	58.5	Low	100.6 Å²	100.6	124.2 Å²	124.2	54%	0.538	59%	0.594	S	S	.	*	H	α-helix	trans	-96.8	-59.2	162.5	-82.4	-2.3	0	0	0	111.8	T1319 Q1320 S1325 K1326 Y1327	T1319-N1323 WeakPolarHBondContact O-CB 3.11Å; T1319-N1323 VanDerWaalsContact O-CG 3.27Å; T1319-N1323 PolarHBondContact O-N 3.21Å; Q1320-N1323 PolarHBondContact O-N 3.24Å; Q1320-N1323 VanDerWaalsContact O-N 3.13Å; N1323-S1325 VanDerWaalsContact C-N 3.35Å; N1323-S1325 PolarHBondContact O-N 2.9Å; N1323-K1326 WeakPolarHBondContact O-CB 3.43Å; N1323-K1326 PolarHBondContact O-N 3.15Å; N1323-K1326 PolarHBondContact OD1-NZ 3.44Å; N1323-Y1327 PolarHBondContact O-N 2.94Å
1324	L	61.7	Low	59.3	Low	118.4 Å²	118.4	121.6 Å²	121.6	62%	0.62	59%	0.589	S	S	*	*	H	α-helix	trans	-66.8	-59.5	165.2	-151.7	68	0	0	0	112.9	Q1320 K1321 K1326 Y1327 Q1328	Q1320-L1324 WeakPolarHBondContact O-CB 3.43Å; Q1320-L1324 PolarHBondContact O-N 3.1Å; K1321-L1324 PolarHBondContact O-N 3.05Å; L1324-K1326 PolarHBondContact O-N 3.4Å; L1324-Y1327 WeakPolarHBondContact O-CB 3.43Å; L1324-Y1327 PolarHBondContact O-N 3.16Å; L1324-Q1328 WeakPolarHBondContact O-CG 3.43Å; L1324-Q1328 PolarHBondContact O-N 3.05Å
1325	S	60.9	Low	60.1	Low	76.2 Å²	76.2	121.9 Å²	121.9	53%	0.533	59%	0.587	S	S	.	*	H	α-helix	trans	-68.2	-42.6	155.8	99.8	0	0	0	0	115	K1321 R1322 N1323 Y1327 Q1328 Q1329	K1321-S1325 WeakPolarHBondContact O-CB 3.36Å; K1321-S1325 PolarHBondContact O-N 3.05Å; K1321-S1325 PolarHBondContact O-OG 3.35Å; R1322-S1325 WeakPolarHBondContact CA-OG 3.28Å; R1322-S1325 PolarHBondContact O-OG 3.4Å; N1323-S1325 VanDerWaalsContact C-N 3.35Å; N1323-S1325 PolarHBondContact O-N 2.9Å; S1325-Y1327 VanDerWaalsContact C-N 3.34Å; S1325-Y1327 PolarHBondContact O-N 3.43Å; S1325-Q1328 PolarHBondContact O-N 3.3Å; S1325-Q1329 VanDerWaalsContact O-CB 3.26Å; S1325-Q1329 WeakPolarHBondContact O-CB 3.43Å; S1325-Q1329 PolarHBondContact O-N 3.01Å
1326	K	62	Low	60.6	Low	138.6 Å²	138.6	124.1 Å²	124.1	60%	0.603	59%	0.589	S	S	*	*	H	α-helix	trans	-67.4	-62.6	151.1	-78.7	174.3	179.5	178.5	0	112.4	R1322 N1323 L1324 Q1329 Q1330	R1322-K1326 VanDerWaalsContact O-CG 3.26Å; R1322-K1326 WeakPolarHBondContact O-CG 3.37Å; R1322-K1326 PolarHBondContact O-N 3.19Å; R1322-K1326 VanDerWaalsContact O-N 3.13Å; N1323-K1326 WeakPolarHBondContact O-CB 3.43Å; N1323-K1326 PolarHBondContact O-N 3.15Å; N1323-K1326 PolarHBondContact OD1-NZ 3.44Å; L1324-K1326 PolarHBondContact O-N 3.4Å; K1326-Q1329 PolarHBondContact O-N 3.14Å; K1326-Q1330 WeakPolarHBondContact O-CB 3.31Å; K1326-Q1330 PolarHBondContact O-N 2.96Å
1327	Y	61.2	Low	61.1	Low	159.8 Å²	159.8	125.1 Å²	125.1	63%	0.627	59%	0.59	S	S	*	*	H	α-helix	trans	-22.6	-73.4	169.1	-137.2	-108.3	0	0	0	113.6	N1323 L1324 S1325 Q1329 Q1330 Q1331	N1323-Y1327 PolarHBondContact O-N 2.94Å; L1324-Y1327 WeakPolarHBondContact O-CB 3.43Å; L1324-Y1327 PolarHBondContact O-N 3.16Å; S1325-Y1327 VanDerWaalsContact C-N 3.34Å; S1325-Y1327 PolarHBondContact O-N 3.43Å; Y1327-Q1329 VanDerWaalsContact C-N 3.35Å; Y1327-Q1329 PolarHBondContact O-N 3.09Å; Y1327-Q1330 PolarHBondContact O-N 3.03Å; Y1327-Q1331 HydrophobicContact CE1-CG 4.4Å; Y1327-Q1331 PolarHBondContact O-N 3.13Å; Y1327-Q1331 VanDerWaalsContact O-N 3.07Å; Y1327-Q1331 PolarHBondContact OH-NE2 3.14Å; Y1327-Q1331 VanDerWaalsContact OH-NE2 3.12Å
1328	Q	62.6	Low	61.3	Low	134.4 Å²	134.4	125.9 Å²	125.9	63%	0.628	59%	0.591	S	S	*	*	H	α-helix	trans	-94.3	-76.7	141.7	-101	177.2	-38.8	0	0	112	L1324 S1325 Q1330 Q1331 Q1332	L1324-Q1328 WeakPolarHBondContact O-CG 3.43Å; L1324-Q1328 PolarHBondContact O-N 3.05Å; S1325-Q1328 PolarHBondContact O-N 3.3Å; Q1328-Q1330 VanDerWaalsContact C-N 3.32Å; Q1328-Q1330 PolarHBondContact O-N 2.87Å; Q1328-Q1331 PolarHBondContact O-N 3.16Å; Q1328-Q1332 WeakPolarHBondContact O-CB 3.46Å; Q1328-Q1332 PolarHBondContact O-N 3.19Å
1329	Q	64.3	Low	61.7	Low	116.8 Å²	116.8	127.4 Å²	127.4	55%	0.546	59%	0.592	S	S	.	*	H	α-helix	trans	-65.3	-32.7	164	-155.8	177.3	35.4	0	0	115.1	S1325 K1326 Y1327 Q1332 Q1333	S1325-Q1329 VanDerWaalsContact O-CB 3.26Å; S1325-Q1329 WeakPolarHBondContact O-CB 3.43Å; S1325-Q1329 PolarHBondContact O-N 3.01Å; K1326-Q1329 PolarHBondContact O-N 3.14Å; Y1327-Q1329 VanDerWaalsContact C-N 3.35Å; Y1327-Q1329 PolarHBondContact O-N 3.09Å; Q1329-Q1332 PolarHBondContact O-N 3.05Å; Q1329-Q1333 WeakPolarHBondContact O-CG 3.37Å; Q1329-Q1333 PolarHBondContact O-N 3.04Å; Q1329-Q1333 VanDerWaalsContact O-N 3.12Å
1330	Q	64.2	Low	61.8	Low	125.4 Å²	125.4	126.8 Å²	126.8	59%	0.586	59%	0.589	S	S	*	*	H	α-helix	trans	-74.5	-20.9	170.9	-137.6	171	-13.2	0	0	113.2	K1326 Y1327 Q1328 Q1332 Q1333 Q1334	K1326-Q1330 WeakPolarHBondContact O-CB 3.31Å; K1326-Q1330 PolarHBondContact O-N 2.96Å; Y1327-Q1330 PolarHBondContact O-N 3.03Å; Q1328-Q1330 VanDerWaalsContact C-N 3.32Å; Q1328-Q1330 PolarHBondContact O-N 2.87Å; Q1330-Q1332 VanDerWaalsContact C-N 3.33Å; Q1330-Q1332 PolarHBondContact O-N 3.34Å; Q1330-Q1333 PolarHBondContact O-N 3.24Å; Q1330-Q1334 PolarHBondContact O-N 3.08Å
1331	Q	62.3	Low	61.9	Low	104.6 Å²	104.6	125.9 Å²	125.9	49%	0.489	59%	0.588	S	S	.	*	H	α-helix	trans	-21.6	-17.6	137.3	-72.7	-171.8	15.1	0	0	113.4	Y1327 Q1328 Q1333 Q1334 H1335	Y1327-Q1331 HydrophobicContact CE1-CG 4.4Å; Y1327-Q1331 PolarHBondContact O-N 3.13Å; Y1327-Q1331 VanDerWaalsContact O-N 3.07Å; Y1327-Q1331 PolarHBondContact OH-NE2 3.14Å; Y1327-Q1331 VanDerWaalsContact OH-NE2 3.12Å; Q1328-Q1331 PolarHBondContact O-N 3.16Å; Q1331-Q1333 VanDerWaalsContact C-N 3.31Å; Q1331-Q1333 PolarHBondContact O-N 2.97Å; Q1331-Q1334 PolarHBondContact O-N 3.12Å; Q1331-H1335 WeakPolarHBondContact O-CB 3.35Å; Q1331-H1335 PolarHBondContact O-N 3.01Å
1332	Q	64.9	Low	61.9	Low	150.6 Å²	150.6	123.8 Å²	123.8	70%	0.704	58%	0.584	S	S	*	*	H	α-helix	trans	-67.7	0.9	158.5	-114.7	178.8	17.2	0	0	113.1	Q1328 Q1329 Q1330 Y1336	Q1328-Q1332 WeakPolarHBondContact O-CB 3.46Å; Q1328-Q1332 PolarHBondContact O-N 3.19Å; Q1329-Q1332 PolarHBondContact O-N 3.05Å; Q1330-Q1332 VanDerWaalsContact C-N 3.33Å; Q1330-Q1332 PolarHBondContact O-N 3.34Å; Q1332-Y1336 WeakPolarHBondContact O-CB 3.37Å; Q1332-Y1336 PolarHBondContact O-N 2.97Å; Q1332-Y1336 VanDerWaalsContact O-N 3.13Å
1333	Q	64.5	Low	61.9	Low	131 Å²	131	121.4 Å²	121.4	61%	0.612	58%	0.58	S	S	*	*	H	α-helix	trans	-26.3	-34.3	144.7	-73	-179.5	11.2	0	0	114.5	Q1329 Q1330 Q1331 H1335 Y1336 Q1337	Q1329-Q1333 WeakPolarHBondContact O-CG 3.37Å; Q1329-Q1333 PolarHBondContact O-N 3.04Å; Q1329-Q1333 VanDerWaalsContact O-N 3.12Å; Q1330-Q1333 PolarHBondContact O-N 3.24Å; Q1331-Q1333 VanDerWaalsContact C-N 3.31Å; Q1331-Q1333 PolarHBondContact O-N 2.97Å; Q1333-H1335 VanDerWaalsContact C-N 3.34Å; Q1333-H1335 PolarHBondContact O-N 3.47Å; Q1333-Y1336 PolarHBondContact O-N 3.13Å; Q1333-Q1337 WeakPolarHBondContact O-CB 3.35Å; Q1333-Q1337 PolarHBondContact O-N 3.06Å
1334	Q	62.8	Low	62	Low	122 Å²	122	122.6 Å²	122.6	57%	0.57	58%	0.583	S	S	*	*	H	α-helix	trans	-73	-83.2	165	-78.4	-179.4	-2.1	0	0	112.6	Q1330 Q1331 Y1336 Q1337 Q1338	Q1330-Q1334 PolarHBondContact O-N 3.08Å; Q1331-Q1334 PolarHBondContact O-N 3.12Å; Q1334-Y1336 VanDerWaalsContact C-N 3.34Å; Q1334-Y1336 PolarHBondContact O-N 3.24Å; Q1334-Q1337 PolarHBondContact O-N 3.12Å; Q1334-Q1338 WeakPolarHBondContact O-CG 3.36Å; Q1334-Q1338 PolarHBondContact O-N 2.99Å
1335	H	62.5	Low	62.1	Low	121 Å²	121	121.9 Å²	121.9	56%	0.56	58%	0.58	S	S	*	*	H	α-helix	trans	-69.6	-35.8	-176.8	-161.2	-105.2	0	0	0	113.1	Q1331 Q1333 Q1337 Q1338 Q1339	Q1331-H1335 WeakPolarHBondContact O-CB 3.35Å; Q1331-H1335 PolarHBondContact O-N 3.01Å; Q1333-H1335 VanDerWaalsContact C-N 3.34Å; Q1333-H1335 PolarHBondContact O-N 3.47Å; H1335-Q1337 VanDerWaalsContact C-N 3.32Å; H1335-Q1337 PolarHBondContact O-N 3.09Å; H1335-Q1338 PolarHBondContact O-N 3.32Å; H1335-Q1339 PolarHBondContact CE1-NE2 3.09Å; H1335-Q1339 PolarHBondContact NE2-NE2 3.48Å; H1335-Q1339 WeakPolarHBondContact O-CG 3.41Å; H1335-Q1339 PolarHBondContact O-N 3.01Å
1336	Y	61.5	Low	62.2	Low	161.4 Å²	161.4	125 Å²	125	63%	0.633	59%	0.585	S	S	*	*	H	α-helix	trans	-24.6	-24.7	163	-142	-97.5	0	0	0	114.8	Q1332 Q1333 Q1334 Q1339 T1340	Q1332-Y1336 WeakPolarHBondContact O-CB 3.37Å; Q1332-Y1336 PolarHBondContact O-N 2.97Å; Q1332-Y1336 VanDerWaalsContact O-N 3.13Å; Q1333-Y1336 PolarHBondContact O-N 3.13Å; Q1334-Y1336 VanDerWaalsContact C-N 3.34Å; Q1334-Y1336 PolarHBondContact O-N 3.24Å; Y1336-Q1339 PolarHBondContact O-N 3.05Å; Y1336-T1340 HydrophobicContact CD1-CG2 4.25Å; Y1336-T1340 HydrophobicContact CE1-CG2 3.81Å; Y1336-T1340 HydrophobicContact CE2-CG2 4.41Å; Y1336-T1340 PolarHBondContact O-N 3.03Å; Y1336-T1340 PolarHBondContact O-OG1 3.05Å; Y1336-T1340 VanDerWaalsContact O-OG1 3.08Å
1337	Q	61.9	Low	62.1	Low	128.8 Å²	128.8	127.4 Å²	127.4	60%	0.602	59%	0.591	S	S	*	*	H	α-helix	trans	-73.4	-48.8	157.4	-120.4	159	10	0	0	113.5	Q1333 Q1334 H1335 Q1339 T1340 N1341	Q1333-Q1337 WeakPolarHBondContact O-CB 3.35Å; Q1333-Q1337 PolarHBondContact O-N 3.06Å; Q1334-Q1337 PolarHBondContact O-N 3.12Å; H1335-Q1337 VanDerWaalsContact C-N 3.32Å; H1335-Q1337 PolarHBondContact O-N 3.09Å; Q1337-Q1339 VanDerWaalsContact C-N 3.33Å; Q1337-Q1339 PolarHBondContact O-N 3.49Å; Q1337-T1340 WeakPolarHBondContact CA-OG1 3.33Å; Q1337-T1340 PolarHBondContact NE2-OG1 3.47Å; Q1337-T1340 PolarHBondContact O-N 3.05Å; Q1337-T1340 PolarHBondContact O-OG1 3.2Å; Q1337-T1340 VanDerWaalsContact O-OG1 3.07Å; Q1337-N1341 PolarHBondContact NE2-OD1 2.91Å; Q1337-N1341 WeakPolarHBondContact O-CB 3.45Å; Q1337-N1341 VanDerWaalsContact O-CG 3.25Å; Q1337-N1341 PolarHBondContact O-N 3.32Å; Q1337-N1341 VanDerWaalsContact O-N 3.08Å; Q1337-N1341 PolarHBondContact O-OD1 3.47Å
1338	Q	61.6	Low	62.1	Low	127.4 Å²	127.4	125.5 Å²	125.5	60%	0.595	59%	0.587	S	S	*	*	H	α-helix	trans	-23.7	-6.3	152.8	-72.4	179.9	3.9	0	0	113.9	Q1334 H1335 N1341 N1342	Q1334-Q1338 WeakPolarHBondContact O-CG 3.36Å; Q1334-Q1338 PolarHBondContact O-N 2.99Å; H1335-Q1338 PolarHBondContact O-N 3.32Å; Q1338-N1341 PolarHBondContact O-N 2.97Å; Q1338-N1342 WeakPolarHBondContact O-CB 3.39Å; Q1338-N1342 VanDerWaalsContact O-CG 3.25Å; Q1338-N1342 PolarHBondContact O-N 2.97Å; Q1338-N1342 PolarHBondContact O-ND2 3.08Å; Q1338-N1342 PolarHBondContact O-OD1 3.22Å
1339	Q	62.8	Low	62	Low	118.2 Å²	118.2	125.4 Å²	125.4	55%	0.552	59%	0.587	S	S	*	*	H	α-helix	trans	-63	-13.7	143.7	-76	176.8	-3.9	0	0	111.7	H1335 Y1336 Q1337 N1342 Q1343	H1335-Q1339 PolarHBondContact CE1-NE2 3.09Å; H1335-Q1339 PolarHBondContact NE2-NE2 3.48Å; H1335-Q1339 WeakPolarHBondContact O-CG 3.41Å; H1335-Q1339 PolarHBondContact O-N 3.01Å; Y1336-Q1339 PolarHBondContact O-N 3.05Å; Q1337-Q1339 VanDerWaalsContact C-N 3.33Å; Q1337-Q1339 PolarHBondContact O-N 3.49Å; Q1339-N1342 PolarHBondContact O-N 3.39Å; Q1339-Q1343 WeakPolarHBondContact O-CG 3.42Å; Q1339-Q1343 PolarHBondContact O-N 3.26Å
1340	T	60.9	Low	61.8	Low	70.4 Å²	70.4	125.9 Å²	125.9	43%	0.432	59%	0.589	S	S	.	*	H	α-helix	trans	-68.9	-33.9	142.9	43.7	0	0	0	0	112.4	Y1336 Q1337 Q1343 Q1344	Y1336-T1340 HydrophobicContact CD1-CG2 4.25Å; Y1336-T1340 HydrophobicContact CE1-CG2 3.81Å; Y1336-T1340 HydrophobicContact CE2-CG2 4.41Å; Y1336-T1340 PolarHBondContact O-N 3.03Å; Y1336-T1340 PolarHBondContact O-OG1 3.05Å; Y1336-T1340 VanDerWaalsContact O-OG1 3.08Å; Q1337-T1340 WeakPolarHBondContact CA-OG1 3.33Å; Q1337-T1340 PolarHBondContact NE2-OG1 3.47Å; Q1337-T1340 PolarHBondContact O-N 3.05Å; Q1337-T1340 PolarHBondContact O-OG1 3.2Å; Q1337-T1340 VanDerWaalsContact O-OG1 3.07Å; T1340-Q1343 PolarHBondContact O-N 3.27Å; T1340-Q1344 WeakPolarHBondContact O-CB 3.35Å; T1340-Q1344 WeakPolarHBondContact O-CG 3.25Å; T1340-Q1344 PolarHBondContact O-N 3.07Å
1341	N	59.9	Low	61.6	Low	108.6 Å²	108.6	125.8 Å²	125.8	58%	0.581	59%	0.588	S	S	*	*	H	α-helix	trans	-22.4	-44.5	163.6	-74	-7.4	0	0	0	114.5	Q1337 Q1338 Q1343 Q1344 N1345	Q1337-N1341 PolarHBondContact NE2-OD1 2.91Å; Q1337-N1341 WeakPolarHBondContact O-CB 3.45Å; Q1337-N1341 VanDerWaalsContact O-CG 3.25Å; Q1337-N1341 PolarHBondContact O-N 3.32Å; Q1337-N1341 VanDerWaalsContact O-N 3.08Å; Q1337-N1341 PolarHBondContact O-OD1 3.47Å; Q1338-N1341 PolarHBondContact O-N 2.97Å; N1341-Q1343 PolarHBondContact O-N 2.93Å; N1341-Q1344 WeakPolarHBondContact O-CB 3.34Å; N1341-Q1344 PolarHBondContact O-N 3.28Å; N1341-Q1344 VanDerWaalsContact O-N 3.09Å; N1341-N1345 WeakPolarHBondContact O-CB 3.44Å; N1341-N1345 PolarHBondContact O-N 3.3Å
1342	N	59.4	Low	61.3	Low	110.8 Å²	110.8	125.5 Å²	125.5	59%	0.593	58%	0.583	S	S	*	*	H	α-helix	trans	-25.1	-38.2	158	-89.9	-17.6	0	0	0	112.7	Q1338 Q1339 Q1344 N1345 Q1346	Q1338-N1342 WeakPolarHBondContact O-CB 3.39Å; Q1338-N1342 VanDerWaalsContact O-CG 3.25Å; Q1338-N1342 PolarHBondContact O-N 2.97Å; Q1338-N1342 PolarHBondContact O-ND2 3.08Å; Q1338-N1342 PolarHBondContact O-OD1 3.22Å; Q1339-N1342 PolarHBondContact O-N 3.39Å; N1342-Q1344 VanDerWaalsContact C-N 3.31Å; N1342-Q1344 PolarHBondContact O-N 2.71Å; N1342-N1345 PolarHBondContact O-N 3.25Å; N1342-Q1346 WeakPolarHBondContact O-CB 3.26Å; N1342-Q1346 WeakPolarHBondContact O-CG 3.36Å; N1342-Q1346 PolarHBondContact O-N 3.38Å
1343	Q	59.7	Low	61.2	Low	124 Å²	124	123.4 Å²	123.4	58%	0.579	57%	0.573	S	S	*	*	H	α-helix	trans	-73	-53.3	163.1	-90.1	176.9	38	0	0	114	Q1339 T1340 N1341 R1347	Q1339-Q1343 WeakPolarHBondContact O-CG 3.42Å; Q1339-Q1343 PolarHBondContact O-N 3.26Å; T1340-Q1343 PolarHBondContact O-N 3.27Å; N1341-Q1343 PolarHBondContact O-N 2.93Å; Q1343-R1347 WeakPolarHBondContact O-CB 3.39Å; Q1343-R1347 WeakPolarHBondContact O-CG 3.46Å; Q1343-R1347 PolarHBondContact O-N 3.31Å; Q1343-R1347 PolarHBondContact O-NE 3.11Å
1344	Q	61.4	Low	61	Low	127.2 Å²	127.2	122.7 Å²	122.7	59%	0.594	57%	0.57	S	S	*	*	H	α-helix	trans	-26.2	-61.1	165.2	-85.7	175.1	9.2	0	0	113.6	T1340 N1341 N1342 Q1346 R1347 H1348	T1340-Q1344 WeakPolarHBondContact O-CB 3.35Å; T1340-Q1344 WeakPolarHBondContact O-CG 3.25Å; T1340-Q1344 PolarHBondContact O-N 3.07Å; N1341-Q1344 WeakPolarHBondContact O-CB 3.34Å; N1341-Q1344 PolarHBondContact O-N 3.28Å; N1341-Q1344 VanDerWaalsContact O-N 3.09Å; N1342-Q1344 VanDerWaalsContact C-N 3.31Å; N1342-Q1344 PolarHBondContact O-N 2.71Å; Q1344-Q1346 PolarHBondContact O-N 2.71Å; Q1344-R1347 WeakPolarHBondContact O-CB 3.38Å; Q1344-R1347 PolarHBondContact O-N 2.87Å; Q1344-R1347 VanDerWaalsContact O-N 3.14Å; Q1344-H1348 PolarHBondContact NE2-NE2 3.45Å; Q1344-H1348 PolarHBondContact O-CD2 2.93Å; Q1344-H1348 PolarHBondContact O-N 2.81Å; Q1344-H1348 PolarHBondContact O-ND1 3.09Å
1345	N	62	Low	60.8	Low	103.2 Å²	103.2	120.4 Å²	120.4	55%	0.552	56%	0.562	S	S	*	*	H	α-helix	trans	-100	-66.5	-154.5	-125.5	-5.6	0	0	0	110.2	N1341 N1342 R1347 H1348 H1349	N1341-N1345 WeakPolarHBondContact O-CB 3.44Å; N1341-N1345 PolarHBondContact O-N 3.3Å; N1342-N1345 PolarHBondContact O-N 3.25Å; N1345-R1347 VanDerWaalsContact C-N 3.31Å; N1345-R1347 PolarHBondContact O-N 3.1Å; N1345-H1348 PolarHBondContact O-N 3.15Å; N1345-H1349 WeakPolarHBondContact O-CB 3.49Å; N1345-H1349 PolarHBondContact O-N 3.23Å
1346	Q	64.5	Low	60.6	Low	140.4 Å²	140.4	119.5 Å²	119.5	66%	0.656	56%	0.557	S	S	*	*	H	α-helix	trans	-60	-25.3	164.9	-80.6	170.1	13.5	0	0	113.4	N1342 Q1344 H1349 H1350	N1342-Q1346 WeakPolarHBondContact O-CB 3.26Å; N1342-Q1346 WeakPolarHBondContact O-CG 3.36Å; N1342-Q1346 PolarHBondContact O-N 3.38Å; Q1344-Q1346 PolarHBondContact O-N 2.71Å; Q1346-H1349 PolarHBondContact O-N 2.98Å; Q1346-H1350 WeakPolarHBondContact O-CB 3.34Å; Q1346-H1350 PolarHBondContact O-N 3.07Å
1347	R	59.6	Low	60.5	Low	189.4 Å²	189.4	116.1 Å²	116.1	72%	0.715	55%	0.55	S	S	*	.	H	α-helix	trans	-27.1	-27.8	148.9	-75.7	-114.3	-137.9	174.6	1	114.6	Q1343 Q1344 N1345 H1350 Q1351	Q1343-R1347 WeakPolarHBondContact O-CB 3.39Å; Q1343-R1347 WeakPolarHBondContact O-CG 3.46Å; Q1343-R1347 PolarHBondContact O-N 3.31Å; Q1343-R1347 PolarHBondContact O-NE 3.11Å; Q1344-R1347 WeakPolarHBondContact O-CB 3.38Å; Q1344-R1347 PolarHBondContact O-N 2.87Å; Q1344-R1347 VanDerWaalsContact O-N 3.14Å; N1345-R1347 VanDerWaalsContact C-N 3.31Å; N1345-R1347 PolarHBondContact O-N 3.1Å; R1347-H1350 PolarHBondContact O-N 3.14Å; R1347-Q1351 VanDerWaalsContact O-CB 3.31Å; R1347-Q1351 WeakPolarHBondContact O-CB 3.39Å; R1347-Q1351 PolarHBondContact O-N 3.42Å
1348	H	60.4	Low	60.2	Low	120.2 Å²	120.2	116.3 Å²	116.3	56%	0.556	55%	0.551	S	S	*	*	H	α-helix	trans	-22.6	-25.7	165	-68.7	75	0	0	0	114.9	Q1344 N1345 H1350 Q1351 Y1352	Q1344-H1348 PolarHBondContact NE2-NE2 3.45Å; Q1344-H1348 PolarHBondContact O-CD2 2.93Å; Q1344-H1348 PolarHBondContact O-N 2.81Å; Q1344-H1348 PolarHBondContact O-ND1 3.09Å; N1345-H1348 PolarHBondContact O-N 3.15Å; H1348-H1350 PolarHBondContact O-N 3.1Å; H1348-Q1351 PolarHBondContact O-N 3.35Å; H1348-Y1352 WeakPolarHBondContact O-CB 3.33Å; H1348-Y1352 PolarHBondContact O-N 3.33Å
1349	H	60.4	Low	59.9	Low	131.6 Å²	131.6	114 Å²	114	61%	0.609	54%	0.542	S	S	*	.	H	α-helix	trans	-66.1	-61.2	167.1	-148.9	45.7	0	0	0	114	N1345 Q1346 Q1351 Y1352 Q1353	N1345-H1349 WeakPolarHBondContact O-CB 3.49Å; N1345-H1349 PolarHBondContact O-N 3.23Å; Q1346-H1349 PolarHBondContact O-N 2.98Å; H1349-Q1351 PolarHBondContact O-N 3.33Å; H1349-Y1352 WeakPolarHBondContact O-CB 3.39Å; H1349-Y1352 PolarHBondContact O-N 2.95Å; H1349-Y1352 VanDerWaalsContact O-N 3.13Å; H1349-Q1353 PolarHBondContact O-N 3.23Å
1350	H	61.6	Low	59.5	Low	127.2 Å²	127.2	113.8 Å²	113.8	59%	0.589	55%	0.545	S	S	*	.	H	α-helix	trans	-33.7	-4.1	162	-125	52.8	0	0	0	114.8	Q1346 R1347 H1348 Y1352 Q1353 Q1354	Q1346-H1350 WeakPolarHBondContact O-CB 3.34Å; Q1346-H1350 PolarHBondContact O-N 3.07Å; R1347-H1350 PolarHBondContact O-N 3.14Å; H1348-H1350 PolarHBondContact O-N 3.1Å; H1350-Y1352 VanDerWaalsContact C-N 3.33Å; H1350-Q1353 PolarHBondContact O-N 3.34Å; H1350-Q1354 PolarHBondContact CD2-NE2 3.4Å; H1350-Q1354 VanDerWaalsContact CD2-NE2 3.3Å; H1350-Q1354 PolarHBondContact NE2-NE2 3.11Å; H1350-Q1354 VanDerWaalsContact NE2-NE2 3.18Å; H1350-Q1354 WeakPolarHBondContact O-CG 3.45Å; H1350-Q1354 PolarHBondContact O-N 3.33Å; H1350-Q1354 VanDerWaalsContact O-N 3.14Å
1351	Q	59	Low	59	Low	123.8 Å²	123.8	116.9 Å²	116.9	58%	0.579	56%	0.559	S	S	*	*	H	α-helix	trans	-26	-34.3	150.2	-161.7	-174.9	-24	0	0	113.2	R1347 H1348 H1349 L1355	R1347-Q1351 VanDerWaalsContact O-CB 3.31Å; R1347-Q1351 WeakPolarHBondContact O-CB 3.39Å; R1347-Q1351 PolarHBondContact O-N 3.42Å; H1348-Q1351 PolarHBondContact O-N 3.35Å; H1349-Q1351 PolarHBondContact O-N 3.33Å; Q1351-L1355 PolarHBondContact O-N 2.98Å; Q1351-L1355 VanDerWaalsContact O-N 3.11Å
1352	Y	56.9	Low	58.3	Low	98.4 Å²	98.4	114.6 Å²	114.6	39%	0.386	55%	0.551	S	S	.	*	H	α-helix	trans	-72.5	-76.4	179.5	-136.5	-101.4	0	0	0	111.5	H1348 H1349 H1350 Q1354 L1355 H1356 Y1381 I1384 E1385	H1348-Y1352 WeakPolarHBondContact O-CB 3.33Å; H1348-Y1352 PolarHBondContact O-N 3.33Å; H1349-Y1352 WeakPolarHBondContact O-CB 3.39Å; H1349-Y1352 PolarHBondContact O-N 2.95Å; H1349-Y1352 VanDerWaalsContact O-N 3.13Å; H1350-Y1352 VanDerWaalsContact C-N 3.33Å; Y1352-Q1354 PolarHBondContact O-N 2.99Å; Y1352-L1355 WeakPolarHBondContact O-CB 3.28Å; Y1352-L1355 PolarHBondContact O-N 3.3Å; Y1352-L1355 VanDerWaalsContact O-N 3.11Å; Y1352-H1356 WeakPolarHBondContact O-CB 3.36Å; Y1352-H1356 PolarHBondContact O-N 3.09Å; Y1352-Y1381 HydrophobicContact CD1-CE2 4.31Å; Y1352-Y1381 HydrophobicContact CD2-CE2 4.33Å; Y1352-Y1381 HydrophobicContact CE1-CD2 4.26Å; Y1352-Y1381 HydrophobicContact CE1-CE1 4.29Å; Y1352-Y1381 AromaticContact CE1-CE2 3.7Å; Y1352-Y1381 HydrophobicContact CE1-CE2 3.7Å; Y1352-Y1381 VanDerWaalsContact CE1-CE2 3.48Å; Y1352-Y1381 AromaticContact CE1-CZ 3.5Å; Y1352-Y1381 WeakPolarHBondContact CE1-OH 3.38Å; Y1352-Y1381 HydrophobicContact CE2-CD2 4Å; Y1352-Y1381 AromaticContact CE2-CE2 3.53Å; Y1352-Y1381 HydrophobicContact CE2-CE2 3.99Å; Y1352-Y1381 AromaticContact CE2-CZ 3.99Å; Y1352-Y1381 AromaticContact CZ-CD2 3.85Å; Y1352-Y1381 AromaticContact CZ-CE2 3.69Å; Y1352-Y1381 AromaticContact CZ-CZ 3.9Å; Y1352-Y1381 WeakPolarHBondContact OH-CD2 3.42Å; Y1352-Y1381 VanDerWaalsContact OH-CE2 3.24Å; Y1352-Y1381 WeakPolarHBondContact OH-CE2 3.36Å; Y1352-Y1381 PolarHBondContact OH-O 2.85Å; Y1352-Y1381 PolarHBondContact OH-OH 2.99Å; Y1352-I1384 HydrophobicContact CD2-CB 4.44Å; Y1352-I1384 HydrophobicContact CD2-CG2 4.01Å; Y1352-I1384 HydrophobicContact CE2-CB 4.1Å; Y1352-I1384 HydrophobicContact CE2-CG2 3.99Å; Y1352-I1384 HydrophobicContact CG-CG2 4.46Å; Y1352-E1385 WeakPolarHBondContact OH-CG 3.3Å
1353	Q	61.7	Low	57.5	Low	105.4 Å²	105.4	115.6 Å²	115.6	49%	0.493	56%	0.557	S	S	.	*	H	α-helix	trans	-98.4	-75	166.2	-157.5	76.7	41.7	0	0	110.3	H1349 H1350 L1355 H1356 D1357	H1349-Q1353 PolarHBondContact O-N 3.23Å; H1350-Q1353 PolarHBondContact O-N 3.34Å; Q1353-L1355 VanDerWaalsContact C-N 3.3Å; Q1353-L1355 PolarHBondContact O-N 3.36Å; Q1353-H1356 PolarHBondContact NE2-ND1 3.48Å; Q1353-H1356 CarbonylContact O-C 3.47Å; Q1353-H1356 WeakPolarHBondContact O-CB 3.49Å; Q1353-H1356 PolarHBondContact O-N 2.98Å; Q1353-H1356 VanDerWaalsContact O-N 3.13Å; Q1353-D1357 PolarHBondContact NE2-OD1 3.14Å; Q1353-D1357 WeakPolarHBondContact O-CB 3.41Å; Q1353-D1357 PolarHBondContact O-N 3.11Å
1354	Q	60.9	Low	56.7	Low	116.8 Å²	116.8	113 Å²	113	55%	0.546	55%	0.552	S	S	.	*	H	α-helix	trans	-61.5	-35.2	176	-89.2	176.7	1.8	0	0	114	H1350 Y1352 Q1358	H1350-Q1354 PolarHBondContact CD2-NE2 3.4Å; H1350-Q1354 VanDerWaalsContact CD2-NE2 3.3Å; H1350-Q1354 PolarHBondContact NE2-NE2 3.11Å; H1350-Q1354 VanDerWaalsContact NE2-NE2 3.18Å; H1350-Q1354 WeakPolarHBondContact O-CG 3.45Å; H1350-Q1354 PolarHBondContact O-N 3.33Å; H1350-Q1354 VanDerWaalsContact O-N 3.14Å; Y1352-Q1354 PolarHBondContact O-N 2.99Å; Q1354-Q1358 WeakPolarHBondContact O-CB 3.33Å; Q1354-Q1358 VanDerWaalsContact O-CG 3.26Å; Q1354-Q1358 WeakPolarHBondContact O-CG 3.45Å; Q1354-Q1358 PolarHBondContact O-N 3.32Å; Q1354-Q1358 PolarHBondContact O-NE2 3.4Å; Q1354-Q1358 VanDerWaalsContact O-NE2 3.12Å
1355	L	57.3	Low	55.6	Low	75.2 Å²	75.2	116.9 Å²	116.9	39%	0.394	56%	0.562	S	S	.	*	H	α-helix	trans	-30.6	-18.9	165	-108.7	146.3	0	0	0	113.7	Q1351 Y1352 Q1353 Q1358 L1359 Q1377 L1380 I1384	Q1351-L1355 PolarHBondContact O-N 2.98Å; Q1351-L1355 VanDerWaalsContact O-N 3.11Å; Y1352-L1355 WeakPolarHBondContact O-CB 3.28Å; Y1352-L1355 PolarHBondContact O-N 3.3Å; Y1352-L1355 VanDerWaalsContact O-N 3.11Å; Q1353-L1355 VanDerWaalsContact C-N 3.3Å; Q1353-L1355 PolarHBondContact O-N 3.36Å; L1355-Q1358 PolarHBondContact O-N 3.22Å; L1355-L1359 WeakPolarHBondContact O-CG 3.36Å; L1355-L1359 PolarHBondContact O-N 3.08Å; L1355-Q1377 HydrophobicContact CD2-CG 4.01Å; L1355-Q1377 VanDerWaalsContact CD2-NE2 3.26Å; L1355-L1380 HydrophobicContact CD1-CD2 4.15Å; L1355-L1380 HydrophobicContact CD2-CD2 4.43Å; L1355-I1384 HydrophobicContact CD1-CD1 3.61Å
1356	H	58.4	Low	54.6	Low	101 Å²	101	120.1 Å²	120.1	47%	0.468	57%	0.574	S	S	.	*	H	α-helix	trans	-75.7	-56.2	174	-140.6	-80.3	0	0	0	112.8	Y1352 Q1353 Q1358 L1359 N1360 Y1381	Y1352-H1356 WeakPolarHBondContact O-CB 3.36Å; Y1352-H1356 PolarHBondContact O-N 3.09Å; Q1353-H1356 PolarHBondContact NE2-ND1 3.48Å; Q1353-H1356 CarbonylContact O-C 3.47Å; Q1353-H1356 WeakPolarHBondContact O-CB 3.49Å; Q1353-H1356 PolarHBondContact O-N 2.98Å; Q1353-H1356 VanDerWaalsContact O-N 3.13Å; H1356-Q1358 VanDerWaalsContact C-N 3.34Å; H1356-Q1358 PolarHBondContact O-N 2.98Å; H1356-L1359 WeakPolarHBondContact O-CB 3.28Å; H1356-L1359 PolarHBondContact O-N 3.24Å; H1356-N1360 PolarHBondContact CE1-ND2 3.21Å; H1356-N1360 PolarHBondContact ND1-ND2 2.92Å; H1356-N1360 PolarHBondContact NE2-ND2 3.45Å; H1356-N1360 VanDerWaalsContact NE2-ND2 3.14Å; H1356-N1360 WeakPolarHBondContact O-CB 3.24Å; H1356-N1360 PolarHBondContact O-N 3.17Å; H1356-N1360 PolarHBondContact O-ND2 3.02Å; H1356-Y1381 HydrophobicContact CB-CE2 4.14Å
1357	D	59.5	Low	53.3	Low	89.2 Å²	89.2	116.9 Å²	116.9	48%	0.477	57%	0.567	S	S	.	*	H	α-helix	trans	-81.3	-59.4	170.6	-75.1	-26	0	0	0	113.1	Q1353 N1361	Q1353-D1357 PolarHBondContact NE2-OD1 3.14Å; Q1353-D1357 WeakPolarHBondContact O-CB 3.41Å; Q1353-D1357 PolarHBondContact O-N 3.11Å; D1357-N1361 VanDerWaalsContact O-CB 3.3Å; D1357-N1361 WeakPolarHBondContact O-CB 3.36Å; D1357-N1361 PolarHBondContact O-N 3.2Å; D1357-N1361 VanDerWaalsContact O-N 3.08Å; D1357-N1361 PolarHBondContact O-ND2 3.09Å
1358	Q	57.2	Low	52.4	Low	134 Å²	134	117.2 Å²	117.2	63%	0.626	57%	0.574	S	S	*	*	H	α-helix	trans	-74.9	-33.2	166.3	-84.5	176	27.8	0	0	114.1	Q1354 L1355 H1356 N1361 S1362	Q1354-Q1358 WeakPolarHBondContact O-CB 3.33Å; Q1354-Q1358 VanDerWaalsContact O-CG 3.26Å; Q1354-Q1358 WeakPolarHBondContact O-CG 3.45Å; Q1354-Q1358 PolarHBondContact O-N 3.32Å; Q1354-Q1358 PolarHBondContact O-NE2 3.4Å; Q1354-Q1358 VanDerWaalsContact O-NE2 3.12Å; L1355-Q1358 PolarHBondContact O-N 3.22Å; H1356-Q1358 VanDerWaalsContact C-N 3.34Å; H1356-Q1358 PolarHBondContact O-N 2.98Å; Q1358-N1361 PolarHBondContact O-N 3.47Å; Q1358-S1362 WeakPolarHBondContact O-CB 3.44Å; Q1358-S1362 PolarHBondContact O-N 2.98Å
1359	L	55.5	Low	51.4	Low	79.2 Å²	79.2	114.9 Å²	114.9	42%	0.415	58%	0.582	S	S	.	*	H	α-helix	trans	-22.6	-27.1	159	-72.2	166	0	0	0	115.5	L1355 H1356 N1361 S1362 Q1377 Y1381	L1355-L1359 WeakPolarHBondContact O-CG 3.36Å; L1355-L1359 PolarHBondContact O-N 3.08Å; H1356-L1359 WeakPolarHBondContact O-CB 3.28Å; H1356-L1359 PolarHBondContact O-N 3.24Å; L1359-N1361 VanDerWaalsContact C-N 3.34Å; L1359-N1361 PolarHBondContact O-N 3.25Å; L1359-S1362 WeakPolarHBondContact O-CB 3.3Å; L1359-S1362 PolarHBondContact O-N 3.15Å; L1359-S1362 VanDerWaalsContact O-N 3.08Å; L1359-S1362 PolarHBondContact O-OG 3.14Å; L1359-Q1377 HydrophobicContact CD2-CB 4.08Å; L1359-Q1377 HydrophobicContact CD2-CG 3.83Å; L1359-Q1377 HydrophobicContact CG-CG 4.2Å; L1359-Y1381 HydrophobicContact CD1-CD2 3.93Å; L1359-Y1381 HydrophobicContact CD1-CE2 4.45Å; L1359-Y1381 HydrophobicContact CD1-CG 3.78Å
1360	N	52.8	Low	50.7	Low	113.8 Å²	113.8	114.7 Å²	114.7	61%	0.609	59%	0.585	S	S	*	*	H	α-helix	trans	-73	-3.6	164.2	-79.1	-15.6	0	0	0	114.9	H1356 S1362	H1356-N1360 PolarHBondContact CE1-ND2 3.21Å; H1356-N1360 PolarHBondContact ND1-ND2 2.92Å; H1356-N1360 PolarHBondContact NE2-ND2 3.45Å; H1356-N1360 VanDerWaalsContact NE2-ND2 3.14Å; H1356-N1360 WeakPolarHBondContact O-CB 3.24Å; H1356-N1360 PolarHBondContact O-N 3.17Å; H1356-N1360 PolarHBondContact O-ND2 3.02Å; N1360-S1362 VanDerWaalsContact C-N 3.29Å
1361	N	50.4	Low	50.3	Low	136.2 Å²	136.2	111.4 Å²	111.4	73%	0.728	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	28	171.3	-88.8	-58.9	0	0	0	114.1	D1357 Q1358 L1359 N1363 H1382 Q1383	D1357-N1361 VanDerWaalsContact O-CB 3.3Å; D1357-N1361 WeakPolarHBondContact O-CB 3.36Å; D1357-N1361 PolarHBondContact O-N 3.2Å; D1357-N1361 VanDerWaalsContact O-N 3.08Å; D1357-N1361 PolarHBondContact O-ND2 3.09Å; Q1358-N1361 PolarHBondContact O-N 3.47Å; L1359-N1361 VanDerWaalsContact C-N 3.34Å; L1359-N1361 PolarHBondContact O-N 3.25Å; N1361-N1363 PolarHBondContact O-N 3.12Å; N1361-H1382 PolarHBondContact OD1-CD2 3.17Å; N1361-Q1383 PolarHBondContact O-NE2 2.83Å; N1361-Q1383 PolarHBondContact O-OE1 3.25Å
1362	S	46.7	Very low	50	Low	59 Å²	59	111.5 Å²	111.5	41%	0.413	58%	0.58	S	S	.	*			trans	-106.8	123.8	166.3	67.3	0	0	0	0	112.3	Q1358 L1359 N1360 C1364 H1382 Q1383	Q1358-S1362 WeakPolarHBondContact O-CB 3.44Å; Q1358-S1362 PolarHBondContact O-N 2.98Å; L1359-S1362 WeakPolarHBondContact O-CB 3.3Å; L1359-S1362 PolarHBondContact O-N 3.15Å; L1359-S1362 VanDerWaalsContact O-N 3.08Å; L1359-S1362 PolarHBondContact O-OG 3.14Å; N1360-S1362 VanDerWaalsContact C-N 3.29Å; S1362-C1364 PolarHBondContact O-N 3.19Å; S1362-H1382 WeakPolarHBondContact CA-NE2 3.38Å; S1362-H1382 WeakPolarHBondContact CB-NE2 3.31Å; S1362-Q1383 WeakPolarHBondContact O-CG 3.23Å; S1362-Q1383 PolarHBondContact O-NE2 3.02Å
1363	N	42.7	Very low	49.9	Very low	132.2 Å²	132.2	112.1 Å²	112.1	71%	0.707	59%	0.594	S	S	*	*			trans	-106.6	87	173	-98.2	-4.6	0	0	0	112.5	N1361 Y1365 H1382 Q1383 I1384	N1361-N1363 PolarHBondContact O-N 3.12Å; N1363-Y1365 VanDerWaalsContact C-N 3.3Å; N1363-Y1365 PolarHBondContact O-N 3.39Å; N1363-H1382 PolarHBondContact N-CE1 3.34Å; N1363-H1382 PolarHBondContact N-ND1 2.78Å; N1363-H1382 PolarHBondContact ND2-O 2.82Å; N1363-H1382 PolarHBondContact O-CE1 3.48Å; N1363-H1382 PolarHBondContact O-ND1 2.64Å; N1363-Q1383 HydrophobicContact CB-CB 3.72Å; N1363-Q1383 HydrophobicContact CB-CG 3.87Å; N1363-I1384 HydrophobicContact CB-CB 4.41Å; N1363-I1384 HydrophobicContact CB-CD1 3.95Å; N1363-I1384 HydrophobicContact CB-CG1 4.26Å; N1363-I1384 WeakPolarHBondContact OD1-CD1 2.98Å; N1363-I1384 WeakPolarHBondContact OD1-CG1 3.4Å
1364	C	42.5	Very low	49.6	Very low	70.4 Å²	70.4	110 Å²	110	48%	0.476	59%	0.59	S	S	.	*			trans	-97.1	57.3	170.9	-89	0	0	0	0	112.8	S1362 E1366 S1367 C1371 C1374	S1362-C1364 PolarHBondContact O-N 3.19Å; C1364-E1366 VanDerWaalsContact C-N 3.28Å; C1364-E1366 PolarHBondContact O-N 3Å; C1364-S1367 PolarHBondContact O-N 3.44Å; C1364-S1367 PolarHBondContact O-OG 3.16Å; C1364-C1371 VanDerWaalsContact SG-CB 3.57Å; C1364-C1374 HydrophobicContact CB-CB 4.09Å; C1364-C1374 WeakPolarHBondContact CB-SG 3.42Å; C1364-C1374 WeakPolarHBondContact SG-CB 3.4Å; C1364-C1374 CovalentContact SG-SG 2.04Å; C1364-C1374 PolarHBondContact SG-SG 3.4Å
1365	Y	38.3	Very low	49.3	Very low	207.6 Å²	207.6	113.1 Å²	113.1	81%	0.814	60%	0.598	S	S	*	*			trans	-99.3	143.6	-176.6	-92.2	-89	0	0	0	112.1	N1363	N1363-Y1365 VanDerWaalsContact C-N 3.3Å; N1363-Y1365 PolarHBondContact O-N 3.39Å
1366	E	40.6	Very low	49.1	Very low	172 Å²	172	113.2 Å²	113.2	80%	0.804	61%	0.605	S	S	*	*	S	Bend	trans	169	9.1	160.4	-97.8	-159.6	131.1	0	0	114.2	C1364 K1368	C1364-E1366 VanDerWaalsContact C-N 3.28Å; C1364-E1366 PolarHBondContact O-N 3Å; E1366-K1368 PolarHBondContact O-N 3.01Å; E1366-K1368 WeakPolarHBondContact OE1-CD 3.35Å; E1366-K1368 WeakPolarHBondContact OE1-CE 3.49Å; E1366-K1368 IonicContact OE1-NZ 3.86Å; E1366-K1368 PolarHBondContact OE1-NZ 3.04Å
1367	S	38.2	Very low	49	Very low	73 Å²	73	113.2 Å²	113.2	51%	0.51	61%	0.605	S	S	.	*			trans	-102.2	125	165.9	76.7	0	0	0	0	112.2	C1364 G1369	C1364-S1367 PolarHBondContact O-N 3.44Å; C1364-S1367 PolarHBondContact O-OG 3.16Å; S1367-G1369 VanDerWaalsContact C-N 3.26Å; S1367-G1369 PolarHBondContact O-N 3.08Å; S1367-G1369 VanDerWaalsContact O-N 3.09Å
1368	K	39.9	Very low	48.9	Very low	195.8 Å²	195.8	115.2 Å²	115.2	85%	0.851	61%	0.611	S	S	*	*			trans	-21.7	120.7	160.1	-62.5	176.1	179.9	172	0	112.9	E1366 N1370	E1366-K1368 PolarHBondContact O-N 3.01Å; E1366-K1368 WeakPolarHBondContact OE1-CD 3.35Å; E1366-K1368 WeakPolarHBondContact OE1-CE 3.49Å; E1366-K1368 IonicContact OE1-NZ 3.86Å; E1366-K1368 PolarHBondContact OE1-NZ 3.04Å; K1368-N1370 PolarHBondContact O-N 3.1Å; K1368-N1370 VanDerWaalsContact O-N 3.13Å
1369	G	39.8	Very low	49	Very low	70.4 Å²	70.4	114.2 Å²	114.2	73%	0.726	61%	0.607	S	S	*	*	S	Bend	trans	98.8	11.3	158.4	0	0	0	0	0	116.2	S1367	S1367-G1369 VanDerWaalsContact C-N 3.26Å; S1367-G1369 PolarHBondContact O-N 3.08Å; S1367-G1369 VanDerWaalsContact O-N 3.09Å
1370	N	45.4	Very low	49.1	Very low	128.2 Å²	128.2	115.3 Å²	115.3	69%	0.686	61%	0.612	S	S	*	*			trans	-91.3	36.5	-171.2	-77.6	13.4	0	0	0	116.9	I821 K1368 N1372	I821-N1370 HydrophobicContact CB-CB 4.07Å; I821-N1370 HydrophobicContact CD1-CB 3.72Å; I821-N1370 HydrophobicContact CG1-CB 3.78Å; I821-N1370 HydrophobicContact CG2-CB 3.39Å; K1368-N1370 PolarHBondContact O-N 3.1Å; K1368-N1370 VanDerWaalsContact O-N 3.13Å; N1370-N1372 PolarHBondContact O-N 3.22Å; N1370-N1372 VanDerWaalsContact O-N 3.08Å
1371	C	51.9	Low	49.2	Very low	57 Å²	57	115.3 Å²	115.3	39%	0.385	61%	0.605	S	S	.	*			trans	-94.1	111.1	-178.7	-141.7	0	0	0	0	113.7	C1364 V1373 C1374 Y1375	C1364-C1371 VanDerWaalsContact SG-CB 3.57Å; C1371-V1373 PolarHBondContact O-N 3.3Å; C1371-V1373 VanDerWaalsContact O-N 3.14Å; C1371-C1374 HydrophobicContact CB-CB 4.01Å; C1371-C1374 PolarHBondContact O-N 3.15Å; C1371-C1374 VanDerWaalsContact O-N 3.11Å; C1371-C1374 PolarHBondContact SG-N 2.99Å; C1371-C1374 PolarHBondContact SG-SG 3.31Å; C1371-Y1375 PolarHBondContact O-N 2.9Å
1372	N	53.4	Low	49.7	Very low	126.6 Å²	126.6	113.9 Å²	113.9	68%	0.677	59%	0.594	S	S	*	*	H	α-helix	trans	-57.6	-10.3	157.8	-81.6	-14.2	0	0	0	114.1	N1370 S1376	N1370-N1372 PolarHBondContact O-N 3.22Å; N1370-N1372 VanDerWaalsContact O-N 3.08Å; N1372-S1376 VanDerWaalsContact O-CB 3.29Å; N1372-S1376 WeakPolarHBondContact O-CB 3.43Å; N1372-S1376 PolarHBondContact O-N 2.97Å; N1372-S1376 PolarHBondContact O-OG 3.1Å
1373	V	54.3	Low	50.3	Low	111.8 Å²	111.8	115.6 Å²	115.6	68%	0.678	60%	0.595	S	S	*	*	H	α-helix	trans	-69.4	-70.1	152.9	177.7	0	0	0	0	111.4	C1371 Y1375 S1376 Q1377	C1371-V1373 PolarHBondContact O-N 3.3Å; C1371-V1373 VanDerWaalsContact O-N 3.14Å; V1373-Y1375 VanDerWaalsContact C-N 3.34Å; V1373-Y1375 PolarHBondContact O-N 3.26Å; V1373-S1376 PolarHBondContact O-N 3.19Å; V1373-Q1377 WeakPolarHBondContact O-CB 3.33Å; V1373-Q1377 PolarHBondContact O-N 3.18Å
1374	C	56	Low	51.1	Low	61 Å²	61	112.9 Å²	112.9	41%	0.412	58%	0.58	S	S	.	*	H	α-helix	trans	-101.2	-75.7	-168.9	-78.2	0	0	0	0	110.5	C1364 C1371 S1376 Q1377 H1378	C1364-C1374 HydrophobicContact CB-CB 4.09Å; C1364-C1374 WeakPolarHBondContact CB-SG 3.42Å; C1364-C1374 WeakPolarHBondContact SG-CB 3.4Å; C1364-C1374 CovalentContact SG-SG 2.04Å; C1364-C1374 PolarHBondContact SG-SG 3.4Å; C1371-C1374 HydrophobicContact CB-CB 4.01Å; C1371-C1374 PolarHBondContact O-N 3.15Å; C1371-C1374 VanDerWaalsContact O-N 3.11Å; C1371-C1374 PolarHBondContact SG-N 2.99Å; C1371-C1374 PolarHBondContact SG-SG 3.31Å; C1374-S1376 PolarHBondContact O-N 2.94Å; C1374-Q1377 PolarHBondContact O-N 3.01Å; C1374-H1378 WeakPolarHBondContact O-CB 3.35Å; C1374-H1378 PolarHBondContact O-CD2 3.44Å; C1374-H1378 PolarHBondContact O-N 3.06Å
1375	Y	54.1	Low	51.8	Low	182 Å²	182	113.9 Å²	113.9	71%	0.714	58%	0.577	S	S	*	*	H	α-helix	trans	-64.8	-77.8	171.3	-157.2	-107.5	0	0	0	112	I1167 C1371 V1373 H1378 H1379	I1167-Y1375 HydrophobicContact CD1-CD1 3.89Å; I1167-Y1375 HydrophobicContact CD1-CE1 3.62Å; C1371-Y1375 PolarHBondContact O-N 2.9Å; V1373-Y1375 VanDerWaalsContact C-N 3.34Å; V1373-Y1375 PolarHBondContact O-N 3.26Å; Y1375-H1378 PolarHBondContact O-N 3.48Å; Y1375-H1379 WeakPolarHBondContact O-CB 3.37Å; Y1375-H1379 PolarHBondContact O-N 3.09Å
1376	S	54.5	Low	52.7	Low	75.8 Å²	75.8	109.3 Å²	109.3	53%	0.53	56%	0.564	S	S	.	*	H	α-helix	trans	-101.5	-80.1	174.5	-66	0	0	0	0	110.7	N1372 V1373 C1374 H1379 L1380	N1372-S1376 VanDerWaalsContact O-CB 3.29Å; N1372-S1376 WeakPolarHBondContact O-CB 3.43Å; N1372-S1376 PolarHBondContact O-N 2.97Å; N1372-S1376 PolarHBondContact O-OG 3.1Å; V1373-S1376 PolarHBondContact O-N 3.19Å; C1374-S1376 PolarHBondContact O-N 2.94Å; S1376-H1379 PolarHBondContact O-N 3Å; S1376-L1380 WeakPolarHBondContact O-CB 3.39Å; S1376-L1380 PolarHBondContact O-N 3.18Å
1377	Q	55.2	Low	53.3	Low	102.4 Å²	102.4	106.9 Å²	106.9	48%	0.479	55%	0.552	S	S	.	*	H	α-helix	trans	-98.9	-73.1	-169.5	-166.1	111	2.5	0	0	111.4	L1355 L1359 V1373 C1374 L1380 Y1381	L1355-Q1377 HydrophobicContact CD2-CG 4.01Å; L1355-Q1377 VanDerWaalsContact CD2-NE2 3.26Å; L1359-Q1377 HydrophobicContact CD2-CB 4.08Å; L1359-Q1377 HydrophobicContact CD2-CG 3.83Å; L1359-Q1377 HydrophobicContact CG-CG 4.2Å; V1373-Q1377 WeakPolarHBondContact O-CB 3.33Å; V1373-Q1377 PolarHBondContact O-N 3.18Å; C1374-Q1377 PolarHBondContact O-N 3.01Å; Q1377-L1380 WeakPolarHBondContact O-CB 3.43Å; Q1377-L1380 PolarHBondContact O-N 2.99Å; Q1377-Y1381 WeakPolarHBondContact O-CB 3.45Å; Q1377-Y1381 PolarHBondContact O-N 3.3Å
1378	H	57.6	Low	54	Low	130.2 Å²	130.2	108.1 Å²	108.1	60%	0.603	55%	0.55	S	S	*	.	H	α-helix	trans	-38.5	-9.7	168.7	-129.5	-96.9	0	0	0	116.4	C1374 Y1375 L1380 Y1381 H1382	C1374-H1378 WeakPolarHBondContact O-CB 3.35Å; C1374-H1378 PolarHBondContact O-CD2 3.44Å; C1374-H1378 PolarHBondContact O-N 3.06Å; Y1375-H1378 PolarHBondContact O-N 3.48Å; H1378-L1380 VanDerWaalsContact C-N 3.32Å; H1378-L1380 PolarHBondContact O-N 2.98Å; H1378-Y1381 PolarHBondContact O-N 3.07Å; H1378-H1382 WeakPolarHBondContact O-CB 3.4Å; H1378-H1382 PolarHBondContact O-N 2.88Å
1379	H	58.9	Low	54.5	Low	114.4 Å²	114.4	104.9 Å²	104.9	53%	0.53	54%	0.538	S	S	.	.	H	α-helix	trans	-21.9	-50.6	158.9	-137	-59.5	0	0	0	116.9	I1167 Y1375 S1376 Y1381 Q1383	I1167-H1379 HydrophobicContact CD1-CB 4.29Å; I1167-H1379 WeakPolarHBondContact CG2-NE2 3.31Å; Y1375-H1379 WeakPolarHBondContact O-CB 3.37Å; Y1375-H1379 PolarHBondContact O-N 3.09Å; S1376-H1379 PolarHBondContact O-N 3Å; H1379-Y1381 VanDerWaalsContact C-N 3.33Å; H1379-Y1381 PolarHBondContact O-N 3.34Å; H1379-Q1383 PolarHBondContact CE1-OE1 3.37Å; H1379-Q1383 PolarHBondContact ND1-OE1 2.8Å; H1379-Q1383 VanDerWaalsContact ND1-OE1 3.08Å; H1379-Q1383 VanDerWaalsContact O-CB 3.25Å; H1379-Q1383 WeakPolarHBondContact O-CB 3.41Å; H1379-Q1383 PolarHBondContact O-N 3.14Å; H1379-Q1383 VanDerWaalsContact O-N 3.08Å
1380	L	58.5	Low	54.9	Low	101 Å²	101	108.4 Å²	108.4	53%	0.529	54%	0.535	S	S	.	.	H	α-helix	trans	-80.3	-58.3	170.5	-163.7	71.4	0	0	0	113.9	L1355 S1376 Q1377 H1378 Q1383 I1384	L1355-L1380 HydrophobicContact CD1-CD2 4.15Å; L1355-L1380 HydrophobicContact CD2-CD2 4.43Å; S1376-L1380 WeakPolarHBondContact O-CB 3.39Å; S1376-L1380 PolarHBondContact O-N 3.18Å; Q1377-L1380 WeakPolarHBondContact O-CB 3.43Å; Q1377-L1380 PolarHBondContact O-N 2.99Å; H1378-L1380 VanDerWaalsContact C-N 3.32Å; H1378-L1380 PolarHBondContact O-N 2.98Å; L1380-Q1383 PolarHBondContact O-N 2.97Å; L1380-I1384 HydrophobicContact CD1-CD1 4.47Å; L1380-I1384 HydrophobicContact CG-CD1 4.16Å; L1380-I1384 WeakPolarHBondContact O-CD1 3.28Å; L1380-I1384 VanDerWaalsContact O-CG1 3.3Å; L1380-I1384 WeakPolarHBondContact O-CG1 3.4Å; L1380-I1384 PolarHBondContact O-N 2.91Å; L1380-I1384 VanDerWaalsContact O-N 3.09Å
1381	Y	55.4	Low	55	Low	113.8 Å²	113.8	105.8 Å²	105.8	45%	0.446	53%	0.527	S	S	.	.	H	α-helix	trans	-63	-65.5	176.8	-154.1	-93.8	0	0	0	114.4	Y1352 H1356 L1359 Q1377 H1378 H1379 Q1383 I1384 E1385	Y1352-Y1381 HydrophobicContact CD1-CE2 4.31Å; Y1352-Y1381 HydrophobicContact CD2-CE2 4.33Å; Y1352-Y1381 HydrophobicContact CE1-CD2 4.26Å; Y1352-Y1381 HydrophobicContact CE1-CE1 4.29Å; Y1352-Y1381 AromaticContact CE1-CE2 3.7Å; Y1352-Y1381 HydrophobicContact CE1-CE2 3.7Å; Y1352-Y1381 VanDerWaalsContact CE1-CE2 3.48Å; Y1352-Y1381 AromaticContact CE1-CZ 3.5Å; Y1352-Y1381 WeakPolarHBondContact CE1-OH 3.38Å; Y1352-Y1381 HydrophobicContact CE2-CD2 4Å; Y1352-Y1381 AromaticContact CE2-CE2 3.53Å; Y1352-Y1381 HydrophobicContact CE2-CE2 3.99Å; Y1352-Y1381 AromaticContact CE2-CZ 3.99Å; Y1352-Y1381 AromaticContact CZ-CD2 3.85Å; Y1352-Y1381 AromaticContact CZ-CE2 3.69Å; Y1352-Y1381 AromaticContact CZ-CZ 3.9Å; Y1352-Y1381 WeakPolarHBondContact OH-CD2 3.42Å; Y1352-Y1381 VanDerWaalsContact OH-CE2 3.24Å; Y1352-Y1381 WeakPolarHBondContact OH-CE2 3.36Å; Y1352-Y1381 PolarHBondContact OH-O 2.85Å; Y1352-Y1381 PolarHBondContact OH-OH 2.99Å; H1356-Y1381 HydrophobicContact CB-CE2 4.14Å; L1359-Y1381 HydrophobicContact CD1-CD2 3.93Å; L1359-Y1381 HydrophobicContact CD1-CE2 4.45Å; L1359-Y1381 HydrophobicContact CD1-CG 3.78Å; Q1377-Y1381 WeakPolarHBondContact O-CB 3.45Å; Q1377-Y1381 PolarHBondContact O-N 3.3Å; H1378-Y1381 PolarHBondContact O-N 3.07Å; H1379-Y1381 VanDerWaalsContact C-N 3.33Å; H1379-Y1381 PolarHBondContact O-N 3.34Å; Y1381-Q1383 VanDerWaalsContact C-N 3.26Å; Y1381-Q1383 PolarHBondContact O-N 2.99Å; Y1381-I1384 WeakPolarHBondContact O-CB 3.42Å; Y1381-I1384 PolarHBondContact O-N 3.04Å; Y1381-I1384 VanDerWaalsContact O-N 3.08Å; Y1381-E1385 HydrophobicContact CD1-CG 4.32Å; Y1381-E1385 VanDerWaalsContact CE1-CD 3.48Å; Y1381-E1385 HydrophobicContact CE1-CG 4.05Å; Y1381-E1385 WeakPolarHBondContact CE1-OE1 3.38Å; Y1381-E1385 WeakPolarHBondContact CE1-OE2 3.49Å; Y1381-E1385 PolarHBondContact O-N 3.13Å; Y1381-E1385 VanDerWaalsContact O-N 3.07Å
1382	H	60.4	Low	54.9	Low	107.4 Å²	107.4	109.8 Å²	109.8	50%	0.497	54%	0.539	S	S	.	.	H	α-helix	trans	-90.3	-50.5	165.1	-137.8	-32.5	0	0	0	115.1	N1361 S1362 N1363 H1378 E1385 Q1386	N1361-H1382 PolarHBondContact OD1-CD2 3.17Å; S1362-H1382 WeakPolarHBondContact CA-NE2 3.38Å; S1362-H1382 WeakPolarHBondContact CB-NE2 3.31Å; N1363-H1382 PolarHBondContact N-CE1 3.34Å; N1363-H1382 PolarHBondContact N-ND1 2.78Å; N1363-H1382 PolarHBondContact ND2-O 2.82Å; N1363-H1382 PolarHBondContact O-CE1 3.48Å; N1363-H1382 PolarHBondContact O-ND1 2.64Å; H1378-H1382 WeakPolarHBondContact O-CB 3.4Å; H1378-H1382 PolarHBondContact O-N 2.88Å; H1382-E1385 IonicContact ND1-OE2 2.73Å; H1382-E1385 PolarHBondContact ND1-OE2 3.48Å; H1382-E1385 PolarHBondContact O-N 3.34Å; H1382-Q1386 PolarHBondContact CE1-NE2 2.8Å; H1382-Q1386 WeakPolarHBondContact O-CG 3.38Å; H1382-Q1386 PolarHBondContact O-N 3.17Å
1383	Q	58.8	Low	54.5	Low	95.2 Å²	95.2	108 Å²	108	45%	0.445	54%	0.537	S	S	.	.	H	α-helix	trans	-86.1	-51.5	-174.5	-169.6	177.4	15.8	0	0	114.8	E1169 N1361 S1362 N1363 H1379 L1380 Y1381 Q1387	E1169-Q1383 HydrophobicContact CB-CG 4.47Å; E1169-Q1383 VanDerWaalsContact CD-CD 3.49Å; E1169-Q1383 PolarHBondContact OE1-NE2 2.93Å; E1169-Q1383 VanDerWaalsContact OE2-CG 3.32Å; E1169-Q1383 WeakPolarHBondContact OE2-CG 3.33Å; N1361-Q1383 PolarHBondContact O-NE2 2.83Å; N1361-Q1383 PolarHBondContact O-OE1 3.25Å; S1362-Q1383 WeakPolarHBondContact O-CG 3.23Å; S1362-Q1383 PolarHBondContact O-NE2 3.02Å; N1363-Q1383 HydrophobicContact CB-CB 3.72Å; N1363-Q1383 HydrophobicContact CB-CG 3.87Å; H1379-Q1383 PolarHBondContact CE1-OE1 3.37Å; H1379-Q1383 PolarHBondContact ND1-OE1 2.8Å; H1379-Q1383 VanDerWaalsContact ND1-OE1 3.08Å; H1379-Q1383 VanDerWaalsContact O-CB 3.25Å; H1379-Q1383 WeakPolarHBondContact O-CB 3.41Å; H1379-Q1383 PolarHBondContact O-N 3.14Å; H1379-Q1383 VanDerWaalsContact O-N 3.08Å; L1380-Q1383 PolarHBondContact O-N 2.97Å; Y1381-Q1383 VanDerWaalsContact C-N 3.26Å; Y1381-Q1383 PolarHBondContact O-N 2.99Å; Q1383-Q1387 WeakPolarHBondContact O-CG 3.37Å; Q1383-Q1387 PolarHBondContact O-N 3.29Å; Q1383-Q1387 PolarHBondContact O-NE2 2.86Å
1384	I	58.8	Low	54.1	Low	75.6 Å²	75.6	111.6 Å²	111.6	39%	0.388	54%	0.539	S	S	.	.	H	α-helix	trans	-109.7	-67.6	-174.4	-87.1	163.8	0	0	0	109.2	Y1352 L1355 N1363 L1380 Y1381 Q1386 Q1387 Q1388	Y1352-I1384 HydrophobicContact CD2-CB 4.44Å; Y1352-I1384 HydrophobicContact CD2-CG2 4.01Å; Y1352-I1384 HydrophobicContact CE2-CB 4.1Å; Y1352-I1384 HydrophobicContact CE2-CG2 3.99Å; Y1352-I1384 HydrophobicContact CG-CG2 4.46Å; L1355-I1384 HydrophobicContact CD1-CD1 3.61Å; N1363-I1384 HydrophobicContact CB-CB 4.41Å; N1363-I1384 HydrophobicContact CB-CD1 3.95Å; N1363-I1384 HydrophobicContact CB-CG1 4.26Å; N1363-I1384 WeakPolarHBondContact OD1-CD1 2.98Å; N1363-I1384 WeakPolarHBondContact OD1-CG1 3.4Å; L1380-I1384 HydrophobicContact CD1-CD1 4.47Å; L1380-I1384 HydrophobicContact CG-CD1 4.16Å; L1380-I1384 WeakPolarHBondContact O-CD1 3.28Å; L1380-I1384 VanDerWaalsContact O-CG1 3.3Å; L1380-I1384 WeakPolarHBondContact O-CG1 3.4Å; L1380-I1384 PolarHBondContact O-N 2.91Å; L1380-I1384 VanDerWaalsContact O-N 3.09Å; Y1381-I1384 WeakPolarHBondContact O-CB 3.42Å; Y1381-I1384 PolarHBondContact O-N 3.04Å; Y1381-I1384 VanDerWaalsContact O-N 3.08Å; I1384-Q1386 VanDerWaalsContact C-N 3.32Å; I1384-Q1386 PolarHBondContact O-N 3.25Å; I1384-Q1387 CarbonylContact O-C 3.31Å; I1384-Q1387 WeakPolarHBondContact O-CA 3.34Å; I1384-Q1387 WeakPolarHBondContact O-CB 3.34Å; I1384-Q1387 PolarHBondContact O-N 3.11Å; I1384-Q1387 VanDerWaalsContact O-N 3.13Å; I1384-Q1388 PolarHBondContact O-N 2.8Å
1385	E	57.6	Low	53.7	Low	90.8 Å²	90.8	115.2 Å²	115.2	42%	0.424	55%	0.55	S	S	.	.	H	α-helix	trans	-96.5	-80	164.9	-108.9	-170.4	132.4	0	0	111.8	P1070 T1071 Y1352 Y1381 H1382 Q1387 Q1388 Q1389	P1070-E1385 HydrophobicContact CG-CB 4.42Å; P1070-E1385 VanDerWaalsContact O-O 3.07Å; T1071-E1385 HydrophobicContact CG2-CB 4.27Å; T1071-E1385 VanDerWaalsContact OG1-CA 3.26Å; T1071-E1385 WeakPolarHBondContact OG1-CA 3.29Å; T1071-E1385 WeakPolarHBondContact OG1-CB 2.91Å; T1071-E1385 PolarHBondContact OG1-N 3.08Å; T1071-E1385 PolarHBondContact OG1-O 3.23Å; Y1352-E1385 WeakPolarHBondContact OH-CG 3.3Å; Y1381-E1385 HydrophobicContact CD1-CG 4.32Å; Y1381-E1385 VanDerWaalsContact CE1-CD 3.48Å; Y1381-E1385 HydrophobicContact CE1-CG 4.05Å; Y1381-E1385 WeakPolarHBondContact CE1-OE1 3.38Å; Y1381-E1385 WeakPolarHBondContact CE1-OE2 3.49Å; Y1381-E1385 PolarHBondContact O-N 3.13Å; Y1381-E1385 VanDerWaalsContact O-N 3.07Å; H1382-E1385 IonicContact ND1-OE2 2.73Å; H1382-E1385 PolarHBondContact ND1-OE2 3.48Å; H1382-E1385 PolarHBondContact O-N 3.34Å; E1385-Q1387 VanDerWaalsContact C-N 3.3Å; E1385-Q1387 PolarHBondContact O-N 3.23Å; E1385-Q1388 WeakPolarHBondContact O-CB 3.45Å; E1385-Q1388 PolarHBondContact O-N 3.25Å; E1385-Q1388 VanDerWaalsContact O-N 3.12Å; E1385-Q1389 WeakPolarHBondContact O-CG 3.33Å; E1385-Q1389 PolarHBondContact O-N 3.18Å
1386	Q	56.5	Low	53.4	Low	111.6 Å²	111.6	112.6 Å²	112.6	52%	0.521	55%	0.547	S	S	.	.	H	α-helix	trans	-28.1	-14	167.9	-67.2	-177.2	29	0	0	116.7	K1068 N1069 P1070 H1382 I1384 Q1388 H1390	K1068-Q1386 VanDerWaalsContact CD-OE1 3.27Å; N1069-Q1386 CarbonylContact C-O 3.04Å; N1069-Q1386 CarbonylContact O-C 3.43Å; N1069-Q1386 VanDerWaalsContact O-C 3.27Å; N1069-Q1386 WeakPolarHBondContact O-CB 3.2Å; P1070-Q1386 VanDerWaalsContact N-O 3.15Å; H1382-Q1386 PolarHBondContact CE1-NE2 2.8Å; H1382-Q1386 WeakPolarHBondContact O-CG 3.38Å; H1382-Q1386 PolarHBondContact O-N 3.17Å; I1384-Q1386 VanDerWaalsContact C-N 3.32Å; I1384-Q1386 PolarHBondContact O-N 3.25Å; Q1386-Q1388 VanDerWaalsContact C-N 3.33Å; Q1386-H1390 WeakPolarHBondContact O-CB 3.37Å; Q1386-H1390 PolarHBondContact O-CD2 3.04Å; Q1386-H1390 PolarHBondContact O-N 3.02Å; Q1386-H1390 VanDerWaalsContact O-N 3.14Å
1387	Q	54.6	Low	53.4	Low	120 Å²	120	114.2 Å²	114.2	56%	0.561	55%	0.549	S	S	*	.	H	α-helix	trans	-107.7	1.1	158.7	-95.4	178.6	35.3	0	0	110.9	K1068 E1169 Q1383 I1384 E1385 H1390 S1391	K1068-Q1387 CarbonylContact C-O 2.88Å; K1068-Q1387 VanDerWaalsContact CA-O 3.23Å; K1068-Q1387 WeakPolarHBondContact CA-O 3.11Å; K1068-Q1387 HydrophobicContact CB-CB 3.79Å; K1068-Q1387 HydrophobicContact CB-CG 4.18Å; K1068-Q1387 WeakPolarHBondContact CB-O 3.39Å; K1068-Q1387 HydrophobicContact CD-CB 3.98Å; K1068-Q1387 VanDerWaalsContact CD-CD 3.45Å; K1068-Q1387 HydrophobicContact CD-CG 3.97Å; K1068-Q1387 PolarHBondContact N-O 2.67Å; E1169-Q1387 PolarHBondContact OE1-NE2 2.92Å; E1169-Q1387 PolarHBondContact OE2-NE2 3.4Å; E1169-Q1387 VanDerWaalsContact OE2-NE2 3.15Å; Q1383-Q1387 WeakPolarHBondContact O-CG 3.37Å; Q1383-Q1387 PolarHBondContact O-N 3.29Å; Q1383-Q1387 PolarHBondContact O-NE2 2.86Å; I1384-Q1387 CarbonylContact O-C 3.31Å; I1384-Q1387 WeakPolarHBondContact O-CA 3.34Å; I1384-Q1387 WeakPolarHBondContact O-CB 3.34Å; I1384-Q1387 PolarHBondContact O-N 3.11Å; I1384-Q1387 VanDerWaalsContact O-N 3.13Å; E1385-Q1387 VanDerWaalsContact C-N 3.3Å; E1385-Q1387 PolarHBondContact O-N 3.23Å; Q1387-H1390 CarbonylContact O-C 3.42Å; Q1387-H1390 WeakPolarHBondContact O-CB 3.45Å; Q1387-H1390 PolarHBondContact O-N 2.98Å; Q1387-H1390 VanDerWaalsContact O-N 3.14Å; Q1387-S1391 WeakPolarHBondContact O-CB 3.39Å; Q1387-S1391 PolarHBondContact O-N 2.98Å; Q1387-S1391 PolarHBondContact O-OG 3.37Å
1388	Q	52.7	Low	53	Low	98.8 Å²	98.8	113.8 Å²	113.8	46%	0.462	55%	0.55	S	S	.	*	H	α-helix	trans	-24.9	-73.3	158.5	-143.9	171.3	27.3	0	0	113.7	L1067 K1068 I1384 E1385 Q1386 H1390 S1391 E1392	L1067-Q1388 CarbonylContact O-C 2.85Å; K1068-Q1388 PolarHBondContact N-O 2.65Å; I1384-Q1388 PolarHBondContact O-N 2.8Å; E1385-Q1388 WeakPolarHBondContact O-CB 3.45Å; E1385-Q1388 PolarHBondContact O-N 3.25Å; E1385-Q1388 VanDerWaalsContact O-N 3.12Å; Q1386-Q1388 VanDerWaalsContact C-N 3.33Å; Q1388-H1390 VanDerWaalsContact C-N 3.3Å; Q1388-H1390 PolarHBondContact O-N 3.07Å; Q1388-S1391 WeakPolarHBondContact CA-OG 3.25Å; Q1388-S1391 CarbonylContact O-C 3.6Å; Q1388-S1391 WeakPolarHBondContact O-CA 3.21Å; Q1388-S1391 WeakPolarHBondContact O-CB 3.37Å; Q1388-S1391 PolarHBondContact O-N 3.02Å; Q1388-S1391 VanDerWaalsContact O-N 3.09Å; Q1388-S1391 PolarHBondContact O-OG 3.19Å; Q1388-E1392 HydrophobicContact CG-CG 4.37Å; Q1388-E1392 VanDerWaalsContact CG-OE1 3.28Å; Q1388-E1392 WeakPolarHBondContact CG-OE1 3.28Å; Q1388-E1392 PolarHBondContact NE2-OE1 2.9Å; Q1388-E1392 WeakPolarHBondContact O-CG 3.34Å; Q1388-E1392 PolarHBondContact O-N 3.32Å
1389	Q	49.3	Very low	52.6	Low	129.2 Å²	129.2	113.9 Å²	113.9	60%	0.604	55%	0.551	S	S	*	*	H	α-helix	trans	-65.3	-30	-178.8	-72	-175.6	-8.6	0	0	112.7	E1385 S1391 S1393	E1385-Q1389 WeakPolarHBondContact O-CG 3.33Å; E1385-Q1389 PolarHBondContact O-N 3.18Å; Q1389-S1391 VanDerWaalsContact C-N 3.26Å; Q1389-S1391 PolarHBondContact O-N 3.26Å; Q1389-S1393 VanDerWaalsContact O-CB 3.31Å; Q1389-S1393 WeakPolarHBondContact O-CB 3.4Å; Q1389-S1393 PolarHBondContact O-N 3.09Å; Q1389-S1393 PolarHBondContact O-OG 3.13Å
1390	H	49.6	Very low	52.2	Low	144.4 Å²	144.4	113.5 Å²	113.5	67%	0.669	55%	0.552	S	S	*	*	H	α-helix	trans	-101	-47.9	148.5	-113.3	-48.4	0	0	0	112.2	Q1386 Q1387 Q1388 R1394	Q1386-H1390 WeakPolarHBondContact O-CB 3.37Å; Q1386-H1390 PolarHBondContact O-CD2 3.04Å; Q1386-H1390 PolarHBondContact O-N 3.02Å; Q1386-H1390 VanDerWaalsContact O-N 3.14Å; Q1387-H1390 CarbonylContact O-C 3.42Å; Q1387-H1390 WeakPolarHBondContact O-CB 3.45Å; Q1387-H1390 PolarHBondContact O-N 2.98Å; Q1387-H1390 VanDerWaalsContact O-N 3.14Å; Q1388-H1390 VanDerWaalsContact C-N 3.3Å; Q1388-H1390 PolarHBondContact O-N 3.07Å; H1390-R1394 WeakPolarHBondContact O-CB 3.43Å; H1390-R1394 WeakPolarHBondContact O-CG 3.26Å; H1390-R1394 PolarHBondContact O-N 3.39Å; H1390-R1394 VanDerWaalsContact O-N 3.1Å
1391	S	47.1	Very low	51.4	Low	72.2 Å²	72.2	114.6 Å²	114.6	51%	0.505	55%	0.554	S	S	.	*	H	α-helix	trans	-82.1	-3.4	169.9	21.6	0	0	0	0	114.3	Q1387 Q1388 Q1389 R1394 Q1395	Q1387-S1391 WeakPolarHBondContact O-CB 3.39Å; Q1387-S1391 PolarHBondContact O-N 2.98Å; Q1387-S1391 PolarHBondContact O-OG 3.37Å; Q1388-S1391 WeakPolarHBondContact CA-OG 3.25Å; Q1388-S1391 CarbonylContact O-C 3.6Å; Q1388-S1391 WeakPolarHBondContact O-CA 3.21Å; Q1388-S1391 WeakPolarHBondContact O-CB 3.37Å; Q1388-S1391 PolarHBondContact O-N 3.02Å; Q1388-S1391 VanDerWaalsContact O-N 3.09Å; Q1388-S1391 PolarHBondContact O-OG 3.19Å; Q1389-S1391 VanDerWaalsContact C-N 3.26Å; Q1389-S1391 PolarHBondContact O-N 3.26Å; S1391-R1394 PolarHBondContact O-N 3.18Å; S1391-Q1395 WeakPolarHBondContact O-CG 3.48Å; S1391-Q1395 PolarHBondContact O-N 3.08Å
1392	E	48.5	Very low	50.6	Low	140.6 Å²	140.6	115.2 Å²	115.2	66%	0.657	56%	0.561	S	S	*	*	H	α-helix	trans	-24.7	-49.6	163	-65.6	177.6	167	0	0	114.9	Q1388 R1394 Q1395 L1396	Q1388-E1392 HydrophobicContact CG-CG 4.37Å; Q1388-E1392 VanDerWaalsContact CG-OE1 3.28Å; Q1388-E1392 WeakPolarHBondContact CG-OE1 3.28Å; Q1388-E1392 PolarHBondContact NE2-OE1 2.9Å; Q1388-E1392 WeakPolarHBondContact O-CG 3.34Å; Q1388-E1392 PolarHBondContact O-N 3.32Å; E1392-R1394 VanDerWaalsContact C-N 3.27Å; E1392-R1394 PolarHBondContact O-N 3.03Å; E1392-Q1395 PolarHBondContact O-N 3.17Å; E1392-L1396 WeakPolarHBondContact O-CB 3.41Å; E1392-L1396 PolarHBondContact O-N 2.8Å
1393	S	45.4	Very low	49.7	Very low	89.8 Å²	89.8	116.6 Å²	116.6	63%	0.628	57%	0.567	S	S	*	*	H	α-helix	trans	-76	1.1	176.4	-56.2	0	0	0	0	114.3	Q1389 L1397	Q1389-S1393 VanDerWaalsContact O-CB 3.31Å; Q1389-S1393 WeakPolarHBondContact O-CB 3.4Å; Q1389-S1393 PolarHBondContact O-N 3.09Å; Q1389-S1393 PolarHBondContact O-OG 3.13Å; S1393-L1397 WeakPolarHBondContact O-CB 3.41Å; S1393-L1397 PolarHBondContact O-N 3.11Å
1394	R	46.9	Very low	48.6	Very low	188 Å²	188	118.3 Å²	118.3	71%	0.709	58%	0.575	S	S	*	*	H	α-helix	trans	-86.6	-20.5	164.1	-82.4	-178.9	-179.9	-85.3	-0.9	114.1	H1390 S1391 E1392 L1396 L1397 D1398	H1390-R1394 WeakPolarHBondContact O-CB 3.43Å; H1390-R1394 WeakPolarHBondContact O-CG 3.26Å; H1390-R1394 PolarHBondContact O-N 3.39Å; H1390-R1394 VanDerWaalsContact O-N 3.1Å; S1391-R1394 PolarHBondContact O-N 3.18Å; E1392-R1394 VanDerWaalsContact C-N 3.27Å; E1392-R1394 PolarHBondContact O-N 3.03Å; R1394-L1396 VanDerWaalsContact C-N 3.29Å; R1394-L1396 PolarHBondContact O-N 3.03Å; R1394-L1397 CarbonylContact O-C 3.16Å; R1394-L1397 WeakPolarHBondContact O-CB 3.41Å; R1394-L1397 PolarHBondContact O-N 3.01Å; R1394-L1397 VanDerWaalsContact O-N 3.13Å; R1394-D1398 WeakPolarHBondContact O-CB 3.37Å; R1394-D1398 VanDerWaalsContact O-CG 3.26Å; R1394-D1398 PolarHBondContact O-N 3.28Å
1395	Q	48	Very low	47.4	Very low	137 Å²	137	120.1 Å²	120.1	64%	0.64	59%	0.586	S	S	*	*	H	α-helix	trans	-60.7	-19.2	157.9	-76.1	172.3	16.7	0	0	112.2	S1391 E1392 H1399	S1391-Q1395 WeakPolarHBondContact O-CG 3.48Å; S1391-Q1395 PolarHBondContact O-N 3.08Å; E1392-Q1395 PolarHBondContact O-N 3.17Å; Q1395-H1399 VanDerWaalsContact O-CB 3.26Å; Q1395-H1399 WeakPolarHBondContact O-CB 3.26Å; Q1395-H1399 PolarHBondContact O-CD2 2.91Å; Q1395-H1399 PolarHBondContact O-N 2.99Å
1396	L	48	Very low	46.4	Very low	126 Å²	126	122.4 Å²	122.4	66%	0.66	60%	0.596	S	S	*	*	H	α-helix	trans	-81.1	-23.4	150.5	-162.2	125.1	0	0	0	111.8	E1392 R1394 H1399 I1400	E1392-L1396 WeakPolarHBondContact O-CB 3.41Å; E1392-L1396 PolarHBondContact O-N 2.8Å; R1394-L1396 VanDerWaalsContact C-N 3.29Å; R1394-L1396 PolarHBondContact O-N 3.03Å; L1396-H1399 PolarHBondContact O-N 3.32Å; L1396-I1400 HydrophobicContact CD2-CD1 3.7Å; L1396-I1400 HydrophobicContact CD2-CG1 4.36Å; L1396-I1400 HydrophobicContact CG-CD1 4.17Å; L1396-I1400 VanDerWaalsContact O-CG1 3.28Å; L1396-I1400 WeakPolarHBondContact O-CG1 3.35Å; L1396-I1400 PolarHBondContact O-N 3.4Å; L1396-I1400 VanDerWaalsContact O-N 3.11Å
1397	L	52.6	Low	45.2	Very low	110 Å²	110	123.9 Å²	123.9	58%	0.576	61%	0.607	S	S	*	*	H	α-helix	trans	-34.4	-53.6	167.9	-159.2	65.7	0	0	0	115.3	S1393 R1394 H1399 I1400 E1401	S1393-L1397 WeakPolarHBondContact O-CB 3.41Å; S1393-L1397 PolarHBondContact O-N 3.11Å; R1394-L1397 CarbonylContact O-C 3.16Å; R1394-L1397 WeakPolarHBondContact O-CB 3.41Å; R1394-L1397 PolarHBondContact O-N 3.01Å; R1394-L1397 VanDerWaalsContact O-N 3.13Å; L1397-H1399 VanDerWaalsContact C-N 3.28Å; L1397-H1399 PolarHBondContact O-N 2.94Å; L1397-I1400 WeakPolarHBondContact O-CB 3.26Å; L1397-I1400 PolarHBondContact O-N 2.97Å; L1397-I1400 VanDerWaalsContact O-N 3.16Å; L1397-E1401 WeakPolarHBondContact O-CB 3.27Å; L1397-E1401 PolarHBondContact O-N 3.09Å
1398	D	48	Very low	44.1	Very low	94.2 Å²	94.2	124.6 Å²	124.6	50%	0.504	62%	0.615	S	S	.	*	H	α-helix	trans	-19.1	-7.8	168	-80.8	-25.9	0	0	0	114.7	R1394 E1401 Q1402	R1394-D1398 WeakPolarHBondContact O-CB 3.37Å; R1394-D1398 VanDerWaalsContact O-CG 3.26Å; R1394-D1398 PolarHBondContact O-N 3.28Å; D1398-E1401 PolarHBondContact O-N 3.22Å; D1398-Q1402 WeakPolarHBondContact O-CB 3.42Å; D1398-Q1402 WeakPolarHBondContact O-CG 3.35Å; D1398-Q1402 PolarHBondContact O-N 3.02Å
1399	H	48.6	Very low	43.1	Very low	131.8 Å²	131.8	126.8 Å²	126.8	61%	0.61	63%	0.628	S	S	*	*	H	α-helix	trans	-74.4	-46.6	179.9	-108.3	-1.6	0	0	0	112.5	Q1395 L1396 L1397 E1401 Q1402 H1403	Q1395-H1399 VanDerWaalsContact O-CB 3.26Å; Q1395-H1399 WeakPolarHBondContact O-CB 3.26Å; Q1395-H1399 PolarHBondContact O-CD2 2.91Å; Q1395-H1399 PolarHBondContact O-N 2.99Å; L1396-H1399 PolarHBondContact O-N 3.32Å; L1397-H1399 VanDerWaalsContact C-N 3.28Å; L1397-H1399 PolarHBondContact O-N 2.94Å; H1399-E1401 VanDerWaalsContact C-N 3.33Å; H1399-Q1402 PolarHBondContact O-N 3.45Å; H1399-H1403 WeakPolarHBondContact O-CB 3.25Å; H1399-H1403 PolarHBondContact O-CD2 3.23Å; H1399-H1403 VanDerWaalsContact O-CD2 3.3Å; H1399-H1403 PolarHBondContact O-N 3.3Å
1400	I	51.1	Low	42.1	Very low	107 Å²	107	125.9 Å²	125.9	55%	0.549	64%	0.635	S	S	.	*	H	α-helix	trans	-73	-17.1	157.1	-69.7	166.4	0	0	0	111.5	L1396 L1397 H1403 Q1404	L1396-I1400 HydrophobicContact CD2-CD1 3.7Å; L1396-I1400 HydrophobicContact CD2-CG1 4.36Å; L1396-I1400 HydrophobicContact CG-CD1 4.17Å; L1396-I1400 VanDerWaalsContact O-CG1 3.28Å; L1396-I1400 WeakPolarHBondContact O-CG1 3.35Å; L1396-I1400 PolarHBondContact O-N 3.4Å; L1396-I1400 VanDerWaalsContact O-N 3.11Å; L1397-I1400 WeakPolarHBondContact O-CB 3.26Å; L1397-I1400 PolarHBondContact O-N 2.97Å; L1397-I1400 VanDerWaalsContact O-N 3.16Å; I1400-H1403 PolarHBondContact O-N 3.02Å; I1400-Q1404 WeakPolarHBondContact O-CG 3.17Å; I1400-Q1404 PolarHBondContact O-N 3.25Å
1401	E	42	Very low	41.3	Very low	123.2 Å²	123.2	126.9 Å²	126.9	58%	0.576	64%	0.644	S	S	*	*	H	α-helix	trans	-74.9	-56.1	171.2	-111.5	-163.1	117.5	0	0	114.5	L1397 D1398 H1399 H1403 Q1404 N1405	L1397-E1401 WeakPolarHBondContact O-CB 3.27Å; L1397-E1401 PolarHBondContact O-N 3.09Å; D1398-E1401 PolarHBondContact O-N 3.22Å; H1399-E1401 VanDerWaalsContact C-N 3.33Å; E1401-H1403 VanDerWaalsContact C-N 3.26Å; E1401-H1403 PolarHBondContact O-N 2.97Å; E1401-H1403 IonicContact OE1-CE1 2.75Å; E1401-H1403 IonicContact OE1-CG 3.45Å; E1401-H1403 IonicContact OE1-ND1 2.69Å; E1401-H1403 PolarHBondContact OE1-ND1 3.25Å; E1401-Q1404 PolarHBondContact O-N 3.35Å; E1401-N1405 WeakPolarHBondContact CG-ND2 3.41Å; E1401-N1405 VanDerWaalsContact O-CB 3.32Å; E1401-N1405 WeakPolarHBondContact O-CB 3.39Å; E1401-N1405 PolarHBondContact O-N 3.19Å; E1401-N1405 PolarHBondContact O-ND2 3.29Å
1402	Q	38	Very low	40.6	Very low	127 Å²	127	130.4 Å²	130.4	59%	0.593	66%	0.657	S	S	*	*	H	α-helix	trans	-34.3	-16	162.2	-72.6	-172.2	21.2	0	0	117.4	Q808 D1398 H1399 Q1406	Q808-Q1402 HydrophobicContact CB-CB 4.45Å; Q808-Q1402 HydrophobicContact CB-CG 4.33Å; Q808-Q1402 HydrophobicContact CG-CB 3.65Å; Q808-Q1402 HydrophobicContact CG-CG 3.95Å; D1398-Q1402 WeakPolarHBondContact O-CB 3.42Å; D1398-Q1402 WeakPolarHBondContact O-CG 3.35Å; D1398-Q1402 PolarHBondContact O-N 3.02Å; H1399-Q1402 PolarHBondContact O-N 3.45Å; Q1402-Q1406 WeakPolarHBondContact O-CB 3.44Å; Q1402-Q1406 WeakPolarHBondContact O-CG 3.39Å; Q1402-Q1406 PolarHBondContact O-N 3.3Å; Q1402-Q1406 PolarHBondContact O-NE2 2.85Å
1403	H	40.5	Very low	39.9	Very low	136.8 Å²	136.8	128.7 Å²	128.7	63%	0.633	66%	0.658	S	S	*	*	H	α-helix	trans	-92.6	0.7	-177.8	-89.1	-79.5	0	0	0	115.6	S807 Q808 H1399 I1400 E1401 L1407	S807-H1403 WeakPolarHBondContact CB-CD2 2.77Å; Q808-H1403 HydrophobicContact CB-CB 3.65Å; Q808-H1403 HydrophobicContact CG-CB 3.83Å; Q808-H1403 PolarHBondContact NE2-O 2.83Å; H1399-H1403 WeakPolarHBondContact O-CB 3.25Å; H1399-H1403 PolarHBondContact O-CD2 3.23Å; H1399-H1403 VanDerWaalsContact O-CD2 3.3Å; H1399-H1403 PolarHBondContact O-N 3.3Å; I1400-H1403 PolarHBondContact O-N 3.02Å; E1401-H1403 VanDerWaalsContact C-N 3.26Å; E1401-H1403 PolarHBondContact O-N 2.97Å; E1401-H1403 IonicContact OE1-CE1 2.75Å; E1401-H1403 IonicContact OE1-CG 3.45Å; E1401-H1403 IonicContact OE1-ND1 2.69Å; E1401-H1403 PolarHBondContact OE1-ND1 3.25Å; H1403-L1407 WeakPolarHBondContact O-CG 3.05Å; H1403-L1407 PolarHBondContact O-N 3.24Å
1404	Q	37.3	Very low	39.2	Very low	131 Å²	131	129.7 Å²	129.7	61%	0.612	67%	0.665	S	S	*	*	H	α-helix	trans	-95.6	-41	147.1	-83.6	-169.4	9.5	0	0	117.1	S807 Q808 I1400 E1401 Q1406 L1407	S807-Q1404 VanDerWaalsContact O-CG 3.31Å; S807-Q1404 WeakPolarHBondContact O-CG 3.12Å; S807-Q1404 PolarHBondContact O-NE2 2.71Å; S807-Q1404 VanDerWaalsContact OG-CA 3.24Å; S807-Q1404 WeakPolarHBondContact OG-CA 3.06Å; S807-Q1404 WeakPolarHBondContact OG-CG 3.34Å; S807-Q1404 PolarHBondContact OG-O 3.31Å; Q808-Q1404 HydrophobicContact CB-CB 3.51Å; Q808-Q1404 HydrophobicContact CB-CG 3.28Å; Q808-Q1404 HydrophobicContact CG-CB 4.1Å; Q808-Q1404 HydrophobicContact CG-CG 4.37Å; Q808-Q1404 PolarHBondContact O-NE2 2.89Å; I1400-Q1404 WeakPolarHBondContact O-CG 3.17Å; I1400-Q1404 PolarHBondContact O-N 3.25Å; E1401-Q1404 PolarHBondContact O-N 3.35Å; Q1404-Q1406 VanDerWaalsContact C-N 3.25Å; Q1404-Q1406 PolarHBondContact O-N 3.35Å; Q1404-Q1406 VanDerWaalsContact O-N 3.14Å; Q1404-L1407 PolarHBondContact O-N 3.22Å
1405	N	33.9	Very low	38.4	Very low	113.4 Å²	113.4	125.9 Å²	125.9	61%	0.606	67%	0.667	S	S	*	*			trans	-89.5	38.1	-179.5	-84.7	-57.2	0	0	0	116	E1401 L1407 N1408 I1409	E1401-N1405 WeakPolarHBondContact CG-ND2 3.41Å; E1401-N1405 VanDerWaalsContact O-CB 3.32Å; E1401-N1405 WeakPolarHBondContact O-CB 3.39Å; E1401-N1405 PolarHBondContact O-N 3.19Å; E1401-N1405 PolarHBondContact O-ND2 3.29Å; N1405-L1407 VanDerWaalsContact C-N 3.31Å; N1405-L1407 PolarHBondContact O-N 2.98Å; N1405-N1408 PolarHBondContact O-N 2.97Å; N1405-I1409 WeakPolarHBondContact O-CG1 3.45Å
1406	Q	34.8	Very low	37.5	Very low	138.8 Å²	138.8	124.4 Å²	124.4	65%	0.649	67%	0.672	S	S	*	*			trans	-125.1	93.4	162.5	-72	-166.5	52.5	0	0	113	Q1402 Q1404 N1408	Q1402-Q1406 WeakPolarHBondContact O-CB 3.44Å; Q1402-Q1406 WeakPolarHBondContact O-CG 3.39Å; Q1402-Q1406 PolarHBondContact O-N 3.3Å; Q1402-Q1406 PolarHBondContact O-NE2 2.85Å; Q1404-Q1406 VanDerWaalsContact C-N 3.25Å; Q1404-Q1406 PolarHBondContact O-N 3.35Å; Q1404-Q1406 VanDerWaalsContact O-N 3.14Å; Q1406-N1408 PolarHBondContact O-N 3.13Å
1407	L	32.3	Very low	36.7	Very low	143 Å²	143	123.4 Å²	123.4	75%	0.749	68%	0.675	S	S	*	*			trans	-116.4	83	170.2	-68.8	171.5	0	0	0	115	H1403 Q1404 N1405	H1403-L1407 WeakPolarHBondContact O-CG 3.05Å; H1403-L1407 PolarHBondContact O-N 3.24Å; Q1404-L1407 PolarHBondContact O-N 3.22Å; N1405-L1407 VanDerWaalsContact C-N 3.31Å; N1405-L1407 PolarHBondContact O-N 2.98Å
1408	N	32.1	Very low	35.8	Very low	134 Å²	134	123.2 Å²	123.2	72%	0.717	68%	0.683	S	S	*	*			trans	167.8	99.9	132.7	-108.6	-19.7	0	0	0	116.8	Q805 N1405 Q1406	Q805-N1408 PolarHBondContact NE2-OD1 2.89Å; Q805-N1408 PolarHBondContact OE1-ND2 2.7Å; N1405-N1408 PolarHBondContact O-N 2.97Å; Q1406-N1408 PolarHBondContact O-N 3.13Å
1409	I	31.6	Very low	35	Very low	144.6 Å²	144.6	124 Å²	124	74%	0.742	69%	0.691	S	S	*	*			trans	-153.8	104.4	157.3	-65.6	172	0	0	0	112.3	N1405	N1405-I1409 WeakPolarHBondContact O-CG1 3.45Å
1410	C	28	Very low	34.2	Very low	111.2 Å²	111.2	125.8 Å²	125.8	75%	0.751	70%	0.7	S	S	*	*			trans	121.5	128.8	151.4	-83.1	0	0	0	0	116.6
1411	L	33.4	Very low	33.2	Very low	165.8 Å²	165.8	124.7 Å²	124.7	87%	0.868	70%	0.702	S	S	*	*				-172.8	143.2	123	-99.4	159.8	0	0	0	113.1
1412	L	31.3	Very low	32.7	Very low	145 Å²	145	126.7 Å²	126.7	76%	0.759	72%	0.715	S	S	*	*			trans	-93.8	169.6	179	-89	75.6	0	0	0	113.4
1413	P	34	Very low	32.3	Very low	105.6 Å²	105.6	128.1 Å²	128.1	69%	0.686	72%	0.722	S	S	*	*			cis	-127.8	-179.8	-29.9	38.2	-23.1	0	0	0	113.9
1414	S	29.8	Very low	31.8	Very low	110 Å²	110	128.4 Å²	128.4	77%	0.769	73%	0.727	S	S	*	*			trans	116.8	141.8	155.9	-61.4	0	0	0	0	117.8
1415	S	30.6	Very low	31.5	Very low	108.4 Å²	108.4	128.7 Å²	128.7	76%	0.758	73%	0.733	S	S	*	*			trans	65.1	118.8	141.3	46.1	0	0	0	0	118.7	F1497	S1415-F1497 VanDerWaalsContact CA-CE1 3.45Å; S1415-F1497 VanDerWaalsContact CB-CZ 3.47Å
1416	S	30.1	Very low	31.5	Very low	105.4 Å²	105.4	129.7 Å²	129.7	74%	0.737	74%	0.737	S	S	*	*			trans	153.9	152.7	138.1	45.7	0	0	0	0	116.7	F1497	S1416-F1497 WeakPolarHBondContact O-CD2 3.21Å; S1416-F1497 WeakPolarHBondContact O-CG 2.92Å
1417	S	31.2	Very low	31.5	Very low	105 Å²	105	128.2 Å²	128.2	73%	0.734	74%	0.74	S	S	*	*			trans	-132.4	144.7	170.7	64.2	0	0	0	0	115.8	E1496	S1417-E1496 WeakPolarHBondContact CA-OE2 3.28Å; S1417-E1496 VanDerWaalsContact N-CD 3.31Å; S1417-E1496 VanDerWaalsContact N-CG 3.26Å; S1417-E1496 PolarHBondContact N-OE2 2.8Å
1418	S	32.6	Very low	31.7	Very low	105 Å²	105	126.9 Å²	126.9	73%	0.734	74%	0.739	S	S	*	*			trans	5.5	131.1	156.2	56.3	0	0	0	0	117.8	E1496	S1418-E1496 WeakPolarHBondContact CA-OE1 3.49Å; S1418-E1496 VanDerWaalsContact N-CB 3.28Å; S1418-E1496 PolarHBondContact N-OE1 2.81Å; S1418-E1496 PolarHBondContact N-OE2 3.36Å
1419	V	31.4	Very low	31.6	Very low	111.2 Å²	111.2	125.7 Å²	125.7	67%	0.674	74%	0.741	S	S	*	*				-112.4	131.9	111.7	-139.9	0	0	0	0	115.2	H1495 E1496	V1419-H1495 HydrophobicContact CG2-CB 4.39Å; V1419-E1496 PolarHBondContact N-OE1 3.43Å; V1419-E1496 VanDerWaalsContact N-OE1 3.12Å
1420	Q	31.6	Very low	31.6	Very low	171.2 Å²	171.2	124.1 Å²	124.1	80%	0.8	74%	0.743	S	S	*	*			trans	-139.9	151.4	150.2	-104.9	157.6	6.2	0	0	112.7
1421	S	30.3	Very low	31.8	Very low	84 Å²	84	123.8 Å²	123.8	59%	0.587	74%	0.743	S	S	*	*			trans	-63.6	134.3	177	14.4	0	0	0	0	115.3
1422	L	31.6	Very low	31.8	Very low	164.8 Å²	164.8	120.1 Å²	120.1	86%	0.863	73%	0.73	S	S	*	*				-141.3	141.6	103.9	-82.7	167.7	0	0	0	111.2
1423	Q	30.9	Very low	31.8	Very low	156 Å²	156	122.8 Å²	122.8	73%	0.729	73%	0.732	S	S	*	*			trans	81.3	134.9	140	-159.8	104.5	-7.1	0	0	114.6	N1425	Q1423-N1425 PolarHBondContact NE2-ND2 3.01Å; Q1423-N1425 PolarHBondContact NE2-OD1 2.84Å
1424	L	30	Very low	31.8	Very low	143.6 Å²	143.6	125 Å²	125	75%	0.752	73%	0.728	S	S	*	*			trans	90.6	131.8	164.2	-62.9	171.1	0	0	0	115.7	I1426	L1424-I1426 HydrophobicContact CD2-CD1 3.6Å
1425	N	30.6	Very low	32.3	Very low	137 Å²	137	123.8 Å²	123.8	73%	0.733	72%	0.717	S	S	*	*				-161	147	97.4	-101.7	-27.1	0	0	0	110.5	Q1423	Q1423-N1425 PolarHBondContact NE2-ND2 3.01Å; Q1423-N1425 PolarHBondContact NE2-OD1 2.84Å
1426	I	34.1	Very low	32.3	Very low	134.2 Å²	134.2	123.7 Å²	123.7	69%	0.688	71%	0.708	S	S	*	*				-150.3	147.1	112.5	-65.9	168.6	0	0	0	109.5	L1424	L1424-I1426 HydrophobicContact CD2-CD1 3.6Å
1427	P	35	Very low	32.4	Very low	107.8 Å²	107.8	126.6 Å²	126.6	70%	0.7	70%	0.703	S	S	*	*			cis	-134.8	-169.1	6.1	41	-23.3	0	0	0	113.1
1428	P	35.1	Very low	32.6	Very low	114.6 Å²	114.6	126.8 Å²	126.8	74%	0.744	69%	0.692	S	S	*	*			trans	-106.2	164.5	170.9	37.8	-30.9	0	0	0	113.5
1429	S	30.8	Very low	32.6	Very low	108.4 Å²	108.4	127.4 Å²	127.4	76%	0.758	68%	0.683	S	S	*	*			trans	156.6	142.5	139.7	-58.9	0	0	0	0	116
1430	S	32.2	Very low	32.7	Very low	112.6 Å²	112.6	130.4 Å²	130.4	79%	0.787	68%	0.684	S	S	*	*			trans	84	140.5	155.7	58.8	0	0	0	0	117.6
1431	S	30.9	Very low	32.8	Very low	104.6 Å²	104.6	129 Å²	129	73%	0.731	68%	0.677	S	S	*	*				158.6	136.7	126.1	150.9	0	0	0	0	114.9
1432	S	32.8	Very low	33	Very low	87.8 Å²	87.8	132 Å²	132	61%	0.614	68%	0.682	S	S	*	*			trans	73.4	126	136.1	82.7	0	0	0	0	119.5
1433	Y	32.9	Very low	33.2	Very low	202 Å²	202	131.1 Å²	131.1	79%	0.792	67%	0.673	S	S	*	*				-146.5	130.4	107.6	-95.5	-83.4	0	0	0	113.4
1434	Y	32.5	Very low	33.3	Very low	151 Å²	151	126.2 Å²	126.2	59%	0.592	66%	0.664	S	S	*	*				34.3	138.6	98.9	-98.5	-110.2	0	0	0	116.6	P1016 I1017 S1018	P1016-Y1434 HydrophobicContact CB-CE1 3.96Å; I1017-Y1434 WeakPolarHBondContact O-CE1 3.33Å; S1018-Y1434 WeakPolarHBondContact OG-CB 2.9Å; S1018-Y1434 WeakPolarHBondContact OG-CD1 3.26Å
1435	P	40.3	Very low	33.4	Very low	84.8 Å²	84.8	126.2 Å²	126.2	55%	0.551	67%	0.665	S	S	*	*			cis	-137.6	172.6	-19.3	36	-17.8	0	0	0	114.8
1436	N	31.9	Very low	33.6	Very low	106 Å²	106	122.2 Å²	122.2	57%	0.567	66%	0.656	S	S	*	*				71.2	150.8	126.4	-115.9	-20	0	0	0	117.4	W1014 H1015 Q1644 Q1645	W1014-N1436 PolarHBondContact O-ND2 2.92Å; H1015-N1436 PolarHBondContact CE1-O 3.09Å; H1015-N1436 VanDerWaalsContact CE1-O 3.22Å; H1015-N1436 WeakPolarHBondContact NE2-CB 3.43Å; H1015-N1436 PolarHBondContact NE2-O 2.9Å; N1436-Q1644 PolarHBondContact OD1-O 3.36Å; N1436-Q1645 PolarHBondContact ND2-O 3.14Å; N1436-Q1645 PolarHBondContact OD1-O 2.61Å
1437	R	32	Very low	33.6	Very low	166.2 Å²	166.2	122.3 Å²	122.3	63%	0.627	66%	0.658	S	S	*	*			cis	-173.4	160	-31.2	-127.4	-162.6	147.8	-156	-4.2	113.3	D1012 H1015	D1012-R1437 VanDerWaalsContact CB-O 3.31Å; D1012-R1437 WeakPolarHBondContact CB-O 3.39Å; D1012-R1437 IonicContact OD1-CZ 2.65Å; D1012-R1437 IonicContact OD1-NH1 3.24Å; D1012-R1437 PolarHBondContact OD1-NH1 3.25Å; D1012-R1437 IonicContact OD1-NH2 3.79Å; D1012-R1437 PolarHBondContact OD1-NH2 3.24Å; D1012-R1437 IonicContact OD2-CZ 2.67Å; D1012-R1437 VanDerWaalsContact OD2-CZ 3.31Å; D1012-R1437 IonicContact OD2-NH1 3.42Å; D1012-R1437 PolarHBondContact OD2-NH1 3.23Å; D1012-R1437 IonicContact OD2-NH2 3.62Å; D1012-R1437 PolarHBondContact OD2-NH2 2.79Å; H1015-R1437 PolarHBondContact NE2-N 3.33Å
1438	H	34.2	Very low	33.6	Very low	110.2 Å²	110.2	122.9 Å²	122.9	51%	0.51	66%	0.655	S	S	.	*			trans	63.9	156.2	166.5	-68.2	-55.1	0	0	0	118	D1011 D1012	D1011-H1438 HydrophobicContact CB-CB 4.35Å; D1011-H1438 IonicContact OD1-CG 3.54Å; D1011-H1438 IonicContact OD1-ND1 3.31Å; D1011-H1438 PolarHBondContact OD1-ND1 3.36Å; D1011-H1438 IonicContact OD2-CE1 3.23Å; D1011-H1438 PolarHBondContact OD2-CE1 2.74Å; D1011-H1438 VanDerWaalsContact OD2-CE1 3.24Å; D1011-H1438 IonicContact OD2-ND1 3.82Å; D1011-H1438 PolarHBondContact OD2-ND1 3.36Å; D1011-H1438 VanDerWaalsContact OD2-ND1 3.1Å; D1012-H1438 IonicContact OD2-CD2 3.86Å; D1012-H1438 PolarHBondContact OD2-CD2 3.04Å; D1012-H1438 IonicContact OD2-CG 3.1Å; D1012-H1438 IonicContact OD2-NE2 3.32Å
1439	Q	33.9	Very low	33.6	Very low	116.8 Å²	116.8	124 Å²	124	55%	0.546	65%	0.65	S	S	.	*			cis	-161.2	157.3	-1.3	-121.4	171.6	-24.6	0	0	110.7	D1011 D1012 Y1639	D1011-Q1439 PolarHBondContact O-NE2 3.23Å; D1011-Q1439 VanDerWaalsContact O-NE2 3.14Å; D1012-Q1439 WeakPolarHBondContact O-CB 3.14Å; D1012-Q1439 VanDerWaalsContact O-CD 3.27Å; D1012-Q1439 WeakPolarHBondContact O-CG 3.42Å; D1012-Q1439 PolarHBondContact O-NE2 2.73Å; Q1439-Y1639 VanDerWaalsContact O-CB 3.31Å; Q1439-Y1639 WeakPolarHBondContact O-CB 3.12Å; Q1439-Y1639 WeakPolarHBondContact O-CD2 3.43Å
1440	Y	32.4	Very low	33.7	Very low	175.4 Å²	175.4	126.5 Å²	126.5	69%	0.688	65%	0.648	S	S	*	*			trans	71.5	156.2	138.8	-65.8	-56.1	0	0	0	118.8	H1638 Y1639	Y1440-H1638 WeakPolarHBondContact CA-CD2 3.14Å; Y1440-H1638 CarbonylContact O-C 2.94Å; Y1440-H1638 VanDerWaalsContact O-CA 3.25Å; Y1440-H1638 WeakPolarHBondContact O-CA 3.07Å; Y1440-H1638 WeakPolarHBondContact O-CB 3.26Å; Y1440-H1638 PolarHBondContact O-CD2 2.83Å; Y1440-Y1639 VanDerWaalsContact C-CG 3.43Å; Y1440-Y1639 VanDerWaalsContact CB-CD2 3.41Å; Y1440-Y1639 HydrophobicContact CG-CE2 4.35Å; Y1440-Y1639 VanDerWaalsContact O-CA 3.31Å; Y1440-Y1639 WeakPolarHBondContact O-CA 3.32Å; Y1440-Y1639 WeakPolarHBondContact O-CB 3.29Å; Y1440-Y1639 PolarHBondContact O-N 3.5Å
1441	H	35.3	Very low	33.6	Very low	141.6 Å²	141.6	126.7 Å²	126.7	66%	0.656	64%	0.64	S	S	*	*				135.9	141.7	82	-113.5	-92.9	0	0	0	113.3	H1638 Y1639	H1441-H1638 VanDerWaalsContact CA-CE1 3.48Å; H1441-H1638 WeakPolarHBondContact CA-CE1 3.23Å; H1441-H1638 WeakPolarHBondContact CA-ND1 3Å; H1441-H1638 AromaticContact CD2-CE1 3.19Å; H1441-H1638 PolarHBondContact CD2-CE1 3.3Å; H1441-H1638 AromaticContact CD2-NE2 3.29Å; H1441-H1638 PolarHBondContact CD2-NE2 2.94Å; H1441-H1638 VanDerWaalsContact CD2-NE2 3.29Å; H1441-H1638 AromaticContact CG-CE1 3.47Å; H1441-H1638 VanDerWaalsContact CG-CE1 3.47Å; H1441-H1638 AromaticContact CG-NE2 3.91Å; H1441-H1638 PolarHBondContact N-CD2 3.32Å; H1441-H1638 AromaticContact NE2-CE1 3.6Å; H1441-H1638 AromaticContact NE2-NE2 3.92Å; H1441-Y1639 VanDerWaalsContact C-N 3.3Å; H1441-Y1639 WeakPolarHBondContact O-CA 2.88Å; H1441-Y1639 WeakPolarHBondContact O-CD1 3.25Å; H1441-Y1639 WeakPolarHBondContact O-CE1 3.1Å
1442	E	34.7	Very low	33.6	Very low	146.4 Å²	146.4	128 Å²	128	68%	0.684	64%	0.639	S	S	*	*				-140.8	170.2	67.9	-93.8	173.4	170.3	0	0	109.9	H1638 Y1639	E1442-H1638 VanDerWaalsContact C-N 3.33Å; E1442-H1638 CarbonylContact O-C 3.05Å; E1442-H1638 VanDerWaalsContact O-C 3.26Å; E1442-H1638 VanDerWaalsContact O-CA 3.29Å; E1442-H1638 WeakPolarHBondContact O-CA 3.48Å; E1442-H1638 PolarHBondContact O-N 3.07Å; E1442-Y1639 VanDerWaalsContact N-N 3.17Å; E1442-Y1639 PolarHBondContact O-N 2.95Å
1443	Q	34.4	Very low	33.6	Very low	146.6 Å²	146.6	129.3 Å²	129.3	69%	0.685	64%	0.639	S	S	*	*			cis	116.3	149.5	28.4	-123.3	170.4	33.6	0	0	112.3	H1635 H1637	Q1443-H1635 PolarHBondContact NE2-CD2 3.32Å; Q1443-H1635 PolarHBondContact NE2-NE2 3.08Å; Q1443-H1637 HydrophobicContact CB-CB 4.35Å
1444	G	33.8	Very low	33.5	Very low	52.6 Å²	52.6	125.2 Å²	125.2	54%	0.542	63%	0.63	S	S	.	*			cis	165.2	151.7	-7.3	0	0	0	0	0	113.6	H1635 H1636	G1444-H1635 PolarHBondContact O-ND1 3.36Å; G1444-H1636 CarbonylContact C-O 2.98Å; G1444-H1636 WeakPolarHBondContact CA-O 2.7Å
1445	N	32.2	Very low	33.6	Very low	144.2 Å²	144.2	124.1 Å²	124.1	77%	0.771	64%	0.635	S	S	*	*			trans	62.9	129.2	137.3	-62.4	10.1	0	0	0	115.9	H1635 H1636	N1445-H1635 CarbonylContact O-C 3.21Å; N1445-H1635 VanDerWaalsContact O-C 3.29Å; N1445-H1635 VanDerWaalsContact O-CA 3.28Å; N1445-H1635 WeakPolarHBondContact O-CA 3.27Å; N1445-H1636 PolarHBondContact O-N 2.93Å
1446	G	35	Very low	33.3	Very low	52.8 Å²	52.8	126.4 Å²	126.4	54%	0.544	64%	0.642	S	S	.	*				141	130.9	115.5	0	0	0	0	0	115.4	H1634 H1635	G1446-H1634 CarbonylContact O-C 3.34Å; G1446-H1634 VanDerWaalsContact O-CA 3.27Å; G1446-H1634 WeakPolarHBondContact O-CA 3.29Å; G1446-H1635 VanDerWaalsContact O-CA 3.3Å; G1446-H1635 WeakPolarHBondContact O-CA 3.45Å; G1446-H1635 PolarHBondContact O-N 3.38Å
1447	D	33.7	Very low	33.3	Very low	135 Å²	135	127.4 Å²	127.4	72%	0.722	65%	0.648	S	S	*	*			trans	-60.1	148	137.9	-62.4	-51	0	0	0	113.8	S1632 P1633 H1634	D1447-S1632 VanDerWaalsContact OD2-C 3.24Å; D1447-P1633 VanDerWaalsContact CG-N 3.33Å; D1447-P1633 WeakPolarHBondContact OD1-CA 3.43Å; D1447-P1633 WeakPolarHBondContact OD1-CD 3.47Å; D1447-H1634 PolarHBondContact OD1-N 2.62Å
1448	D	35	Very low	33.4	Very low	120.4 Å²	120.4	125.1 Å²	125.1	64%	0.644	65%	0.653	S	S	*	*				-173.8	145.6	84.6	-122.9	-16.3	0	0	0	116.4
1449	H	34.5	Very low	33.3	Very low	138 Å²	138	126.8 Å²	126.8	64%	0.639	66%	0.664	S	S	*	*			trans	45.7	127.9	146.3	-77.2	-64.1	0	0	0	122.9
1450	F	34.2	Very low	33.2	Very low	162.4 Å²	162.4	126.1 Å²	126.1	71%	0.712	67%	0.671	S	S	*	*				72.3	118.9	127.2	-79.8	-88.1	0	0	0	120	N1294 N1295 N1452	N1294-F1450 HydrophobicContact CB-CD1 4.22Å; N1294-F1450 HydrophobicContact CB-CE1 3.49Å; N1294-F1450 VanDerWaalsContact CB-CE1 3.49Å; N1294-F1450 HydrophobicContact CB-CZ 3.73Å; N1294-F1450 VanDerWaalsContact O-CZ 3.27Å; N1294-F1450 WeakPolarHBondContact O-CZ 3.11Å; N1295-F1450 HydrophobicContact CB-CB 4.41Å; N1295-F1450 HydrophobicContact CB-CD1 4.01Å; N1295-F1450 HydrophobicContact CB-CD2 3.84Å; N1295-F1450 HydrophobicContact CB-CE1 4.27Å; N1295-F1450 HydrophobicContact CB-CE2 4.13Å; N1295-F1450 HydrophobicContact CB-CG 3.81Å; N1295-F1450 HydrophobicContact CB-CZ 4.33Å; F1450-N1452 PolarHBondContact O-N 3.02Å; F1450-N1452 VanDerWaalsContact O-N 3.11Å
1451	N	29.9	Very low	33.1	Very low	116 Å²	116	127.5 Å²	127.5	62%	0.62	68%	0.675	S	S	*	*				47.4	122.6	115.5	-154.2	18.9	0	0	0	117.5	N1295 N1296	N1295-N1451 HydrophobicContact CB-CB 4.07Å; N1295-N1451 VanDerWaalsContact CG-ND2 3.31Å; N1295-N1451 PolarHBondContact ND2-ND2 3.11Å; N1295-N1451 VanDerWaalsContact ND2-ND2 3.18Å; N1295-N1451 PolarHBondContact ND2-O 2.99Å; N1295-N1451 PolarHBondContact OD1-ND2 3.29Å; N1296-N1451 HydrophobicContact CB-CB 4.47Å; N1296-N1451 PolarHBondContact ND2-ND2 3.06Å
1452	N	30.9	Very low	32.9	Very low	131.8 Å²	131.8	130.4 Å²	130.4	71%	0.705	68%	0.68	S	S	*	*				94.3	149.9	117.8	-122	-12	0	0	0	116.7	F1450	F1450-N1452 PolarHBondContact O-N 3.02Å; F1450-N1452 VanDerWaalsContact O-N 3.11Å
1453	N	31.1	Very low	32.7	Very low	114.6 Å²	114.6	129.4 Å²	129.4	61%	0.613	68%	0.679	S	S	*	*			trans	-80.8	143	164.5	-84.3	-42.8	0	0	0	116
1454	N	32.3	Very low	32.7	Very low	116 Å²	116	128.1 Å²	128.1	62%	0.62	68%	0.681	S	S	*	*				102.8	139.5	121.9	-85.2	-25.3	0	0	0	117.4
1455	N	33.6	Very low	32.7	Very low	128.8 Å²	128.8	133 Å²	133	69%	0.689	69%	0.69	S	S	*	*				91.2	126.3	111.5	-71.6	-36.2	0	0	0	117.3
1456	N	34.1	Very low	32.9	Very low	131.6 Å²	131.6	130.7 Å²	130.7	70%	0.704	68%	0.683	S	S	*	*				-127.3	148.9	115.6	-77.5	-46.4	0	0	0	114.9
1457	N	32.4	Very low	32.8	Very low	128.6 Å²	128.6	132.6 Å²	132.6	69%	0.688	69%	0.688	S	S	*	*				106.4	141.5	108.4	-81.2	-44.6	0	0	0	112.6
1458	T	33.4	Very low	32.9	Very low	118.2 Å²	118.2	130.4 Å²	130.4	73%	0.725	68%	0.684	S	S	*	*				-128.9	148.1	87.8	48.8	0	0	0	0	113.9
1459	I	32.2	Very low	32.8	Very low	144.8 Å²	144.8	132.6 Å²	132.6	74%	0.743	69%	0.689	S	S	*	*			trans	70.6	97.5	134.8	-56.4	166.7	0	0	0	115.4
1460	C	31.3	Very low	32.6	Very low	102.4 Å²	102.4	132.3 Å²	132.3	69%	0.692	70%	0.697	S	S	*	*				160.1	135.1	57.5	-94.9	0	0	0	0	112.4
1461	R	30.7	Very low	32.4	Very low	205.6 Å²	205.6	130 Å²	130	78%	0.776	70%	0.7	S	S	*	*			trans	70.6	140.3	133.7	-74.5	173.2	176.2	178.8	-1.6	113.6
1462	R	30.7	Very low	32.3	Very low	202.4 Å²	202.4	129.3 Å²	129.3	76%	0.764	71%	0.705	S	S	*	*			cis	-167.4	142.6	24.1	-119	179.9	-105.5	157.4	-2.2	111.2
1463	N	30.7	Very low	32.3	Very low	123.6 Å²	123.6	130.9 Å²	130.9	66%	0.661	71%	0.708	S	S	*	*				68.6	151.3	108.8	-57.5	19.4	0	0	0	116.6
1464	T	34.4	Very low	32.2	Very low	120 Å²	120	135.3 Å²	135.3	74%	0.736	72%	0.717	S	S	*	*			cis	-175.7	151	20.1	-4.9	0	0	0	0	111.6
1465	E	34.3	Very low	32.1	Very low	156.2 Å²	156.2	134.5 Å²	134.5	73%	0.73	72%	0.721	S	S	*	*				-153.7	163	112.8	-93.8	-166.1	166.3	0	0	115.1
1466	P	37.5	Very low	31.9	Very low	96 Å²	96	138 Å²	138	62%	0.623	73%	0.725	S	S	*	*			trans	-136.7	-179.3	-162.3	41.6	-24.5	0	0	0	118
1467	S	32.8	Very low	31.8	Very low	92.4 Å²	92.4	140.7 Å²	140.7	65%	0.646	73%	0.727	S	S	*	*			trans	62.9	143.8	157.3	56.6	0	0	0	0	121.4
1468	S	34.3	Very low	31.7	Very low	89.4 Å²	89.4	140.8 Å²	140.8	63%	0.625	72%	0.724	S	S	*	*				169.5	145	82.2	56.4	0	0	0	0	117.4
1469	H	33.5	Very low	31.7	Very low	165.4 Å²	165.4	140.8 Å²	140.8	77%	0.766	73%	0.725	S	S	*	*			trans	49.6	142.4	158	-58.1	-53.7	0	0	0	121
1470	T	30.3	Very low	31.6	Very low	131.8 Å²	131.8	138.8 Å²	138.8	81%	0.809	72%	0.72	S	S	*	*				157.8	139.5	65.4	27.3	0	0	0	0	114.3
1471	C	28.8	Very low	31.6	Very low	113.8 Å²	113.8	138.7 Å²	138.7	77%	0.769	72%	0.716	S	S	*	*			trans	-32.8	146.4	141.1	-156.5	0	0	0	0	117.4
1472	S	29.5	Very low	31.6	Very low	102.4 Å²	102.4	134.3 Å²	134.3	72%	0.716	71%	0.708	S	S	*	*			trans	163.2	141.7	132.1	-65.6	0	0	0	0	115.5
1473	Q	30.8	Very low	31.5	Very low	164 Å²	164	129.2 Å²	129.2	77%	0.766	70%	0.703	S	S	*	*			trans	117.4	137	144.8	-72.8	-170	19	0	0	116.4	N1283	N1283-Q1473 PolarHBondContact OD1-NE2 3.07Å
1474	Y	28.1	Very low	31.5	Very low	208.8 Å²	208.8	130.6 Å²	130.6	82%	0.819	71%	0.71	S	S	*	*			trans	76.9	122.5	152.2	-85	-85.9	0	0	0	118.2
1475	S	30	Very low	31.3	Very low	98.8 Å²	98.8	128.3 Å²	128.3	69%	0.691	71%	0.71	S	S	*	*			trans	69.1	118.2	132.7	-60.6	0	0	0	0	119.4
1476	Y	28.9	Very low	31.1	Very low	200.8 Å²	200.8	125.7 Å²	125.7	79%	0.787	71%	0.709	S	S	*	*				102.9	122.4	121.6	-101.2	-102.2	0	0	0	114.6
1477	Y	32.1	Very low	30.8	Very low	188.4 Å²	188.4	128.8 Å²	128.8	74%	0.739	72%	0.717	S	S	*	*			trans	106.6	128.9	144.7	-87	-102.2	0	0	0	115.4	V1480	Y1477-V1480 HydrophobicContact CD1-CG2 4.16Å
1478	Q	31.6	Very low	30.6	Very low	132 Å²	132	130.9 Å²	130.9	62%	0.617	72%	0.721	S	S	*	*			trans	-107.3	148.7	144.8	-73	174.3	-32.6	0	0	112.8	I1120 V1480 V1481	I1120-Q1478 HydrophobicContact CD1-CB 3.67Å; I1120-Q1478 HydrophobicContact CD1-CG 3.75Å; I1120-Q1478 HydrophobicContact CG1-CB 4.03Å; I1120-Q1478 HydrophobicContact CG1-CG 3.92Å; I1120-Q1478 HydrophobicContact CG2-CB 4.1Å; Q1478-V1480 HydrophobicContact CB-CG2 3.86Å; Q1478-V1480 WeakPolarHBondContact CB-O 3.01Å; Q1478-V1480 WeakPolarHBondContact CG-O 3.28Å; Q1478-V1480 PolarHBondContact NE2-O 2.89Å; Q1478-V1480 VanDerWaalsContact NE2-O 3.14Å; Q1478-V1480 PolarHBondContact O-N 3.3Å; Q1478-V1480 VanDerWaalsContact OE1-CG2 3.31Å; Q1478-V1480 PolarHBondContact OE1-O 3.4Å; Q1478-V1480 VanDerWaalsContact OE1-O 3.11Å; Q1478-V1481 PolarHBondContact OE1-O 2.67Å; Q1478-V1481 VanDerWaalsContact OE1-O 3.11Å
1479	P	33.2	Very low	30.5	Very low	116.8 Å²	116.8	134.7 Å²	134.7	76%	0.758	73%	0.727	S	S	*	*				-113.8	123.5	125.7	35.7	-27	0	0	0	112	I1120 V1481	I1120-P1479 WeakPolarHBondContact CD1-O 2.96Å; P1479-V1481 PolarHBondContact O-N 3.21Å
1480	V	30.6	Very low	30.4	Very low	102.8 Å²	102.8	131.9 Å²	131.9	62%	0.623	72%	0.722	S	S	*	*			trans	-91	120.8	154.3	169.7	0	0	0	0	108.5	I1120 Y1477 Q1478 N1482	I1120-V1480 HydrophobicContact CG2-CG2 4.4Å; Y1477-V1480 HydrophobicContact CD1-CG2 4.16Å; Q1478-V1480 HydrophobicContact CB-CG2 3.86Å; Q1478-V1480 WeakPolarHBondContact CB-O 3.01Å; Q1478-V1480 WeakPolarHBondContact CG-O 3.28Å; Q1478-V1480 PolarHBondContact NE2-O 2.89Å; Q1478-V1480 VanDerWaalsContact NE2-O 3.14Å; Q1478-V1480 PolarHBondContact O-N 3.3Å; Q1478-V1480 VanDerWaalsContact OE1-CG2 3.31Å; Q1478-V1480 PolarHBondContact OE1-O 3.4Å; Q1478-V1480 VanDerWaalsContact OE1-O 3.11Å; V1480-N1482 VanDerWaalsContact C-N 3.3Å; V1480-N1482 WeakPolarHBondContact CG1-OD1 2.99Å; V1480-N1482 PolarHBondContact O-N 3.18Å
1481	V	30.5	Very low	30.4	Very low	102.2 Å²	102.2	134.4 Å²	134.4	62%	0.619	72%	0.716	S	S	*	*			trans	-27.5	115.8	140.7	-76.1	0	0	0	0	115.1	V1119 I1120 Q1478 P1479 S1483	V1119-V1481 CarbonylContact C-O 3.57Å; V1119-V1481 VanDerWaalsContact O-O 3.14Å; I1120-V1481 PolarHBondContact N-O 2.9Å; I1120-V1481 CarbonylContact O-C 3.13Å; I1120-V1481 VanDerWaalsContact O-CA 3.25Å; I1120-V1481 WeakPolarHBondContact O-CA 3.46Å; Q1478-V1481 PolarHBondContact OE1-O 2.67Å; Q1478-V1481 VanDerWaalsContact OE1-O 3.11Å; P1479-V1481 PolarHBondContact O-N 3.21Å; V1481-S1483 PolarHBondContact O-N 3.39Å
1482	N	30.1	Very low	30.4	Very low	112.8 Å²	112.8	135.3 Å²	135.3	60%	0.603	71%	0.709	S	S	*	*			trans	-40.2	127.9	166.7	-87.3	-1.1	0	0	0	114.1	N1249 S1251 V1480 L1484	N1249-N1482 PolarHBondContact O-ND2 3.35Å; S1251-N1482 PolarHBondContact N-ND2 3.1Å; V1480-N1482 VanDerWaalsContact C-N 3.3Å; V1480-N1482 WeakPolarHBondContact CG1-OD1 2.99Å; V1480-N1482 PolarHBondContact O-N 3.18Å; N1482-L1484 PolarHBondContact O-N 3.38Å
1483	S	29.6	Very low	30.3	Very low	95.4 Å²	95.4	138.2 Å²	138.2	67%	0.667	71%	0.709	S	S	*	*			trans	-21.5	133	148.7	-53.4	0	0	0	0	115.5	V1481	V1481-S1483 PolarHBondContact O-N 3.39Å
1484	L	30.7	Very low	30.3	Very low	152 Å²	152	135.5 Å²	135.5	80%	0.796	70%	0.704	S	S	*	*			trans	156.7	134.8	157.1	-85.9	130.1	0	0	0	112.1	N1482 S1486	N1482-L1484 PolarHBondContact O-N 3.38Å; L1484-S1486 PolarHBondContact O-N 3.26Å
1485	G	30.3	Very low	30.2	Very low	72.4 Å²	72.4	133.3 Å²	133.3	75%	0.746	70%	0.701	S	S	*	*			trans	-123.6	116.6	147.6	0	0	0	0	0	115.2
1486	S	30.6	Very low	30.1	Very low	100.4 Å²	100.4	135.4 Å²	135.4	70%	0.702	70%	0.7	S	S	*	*				-117.3	104.8	110.4	-152.1	0	0	0	0	111.9	L1484 D1488	L1484-S1486 PolarHBondContact O-N 3.26Å; S1486-D1488 VanDerWaalsContact CB-OD2 3.31Å; S1486-D1488 WeakPolarHBondContact CB-OD2 3Å; S1486-D1488 PolarHBondContact O-N 3.03Å; S1486-D1488 VanDerWaalsContact O-N 3.14Å; S1486-D1488 PolarHBondContact OG-OD2 3.5Å
1487	M	30.3	Very low	30	Very low	161.6 Å²	161.6	133.4 Å²	133.4	80%	0.796	70%	0.695	S	S	*	*			trans	-54.2	105.6	152.8	-72.3	-172.7	-69.6	0	0	112.5	F1489	M1487-F1489 VanDerWaalsContact C-N 3.33Å; M1487-F1489 HydrophobicContact CB-CD2 4.24Å; M1487-F1489 HydrophobicContact CB-CE2 4.12Å; M1487-F1489 HydrophobicContact CE-CE2 4.14Å; M1487-F1489 PolarHBondContact O-N 3.41Å; M1487-F1489 HydrophobicContact SD-CE2 4.18Å; M1487-F1489 HydrophobicContact SD-CZ 4.36Å
1488	D	29.1	Very low	29.9	Very low	137.6 Å²	137.6	131.9 Å²	131.9	74%	0.736	70%	0.697	S	S	*	*			trans	-101.9	136.3	146.2	-93.2	-47.4	0	0	0	111.8	S1486 T1490	S1486-D1488 VanDerWaalsContact CB-OD2 3.31Å; S1486-D1488 WeakPolarHBondContact CB-OD2 3Å; S1486-D1488 PolarHBondContact O-N 3.03Å; S1486-D1488 VanDerWaalsContact O-N 3.14Å; S1486-D1488 PolarHBondContact OG-OD2 3.5Å; D1488-T1490 PolarHBondContact O-N 3.41Å
1489	F	32.3	Very low	29.7	Very low	168 Å²	168	132.2 Å²	132.2	74%	0.737	70%	0.703	S	S	*	*			trans	-110.2	96.9	175.5	-113.3	-95.4	0	0	0	113.3	M1487 R1491	M1487-F1489 VanDerWaalsContact C-N 3.33Å; M1487-F1489 HydrophobicContact CB-CD2 4.24Å; M1487-F1489 HydrophobicContact CB-CE2 4.12Å; M1487-F1489 HydrophobicContact CE-CE2 4.14Å; M1487-F1489 PolarHBondContact O-N 3.41Å; M1487-F1489 HydrophobicContact SD-CE2 4.18Å; M1487-F1489 HydrophobicContact SD-CZ 4.36Å; F1489-R1491 HydrophobicContact CD1-CG 4.26Å; F1489-R1491 PolarHBondContact O-N 3.12Å
1490	T	30.9	Very low	29.5	Very low	107 Å²	107	132.2 Å²	132.2	66%	0.656	70%	0.701	S	S	*	*			trans	24.1	103.1	150.7	-26.5	0	0	0	0	117	D1488 Q1492	D1488-T1490 PolarHBondContact O-N 3.41Å; T1490-Q1492 HydrophobicContact CG2-CG 4.43Å; T1490-Q1492 PolarHBondContact O-N 3.18Å
1491	R	29.8	Very low	29.3	Very low	183.8 Å²	183.8	132.2 Å²	132.2	69%	0.694	70%	0.701	S	S	*	*			trans	-52.4	116.9	153.5	-72	178.2	177.7	-93.7	-0.6	112.9	E1244 C1245 F1489 F1493	E1244-R1491 VanDerWaalsContact CB-NH1 3.31Å; E1244-R1491 PolarHBondContact O-NH1 2.72Å; E1244-R1491 PolarHBondContact O-NH2 3.28Å; E1244-R1491 IonicContact OE2-CZ 3.57Å; E1244-R1491 IonicContact OE2-NE 3.3Å; E1244-R1491 IonicContact OE2-NH1 2.7Å; E1244-R1491 PolarHBondContact OE2-NH1 3.05Å; C1245-R1491 VanDerWaalsContact CB-NH1 3.31Å; C1245-R1491 VanDerWaalsContact N-NH1 3.15Å; C1245-R1491 PolarHBondContact O-NH2 2.73Å; F1489-R1491 HydrophobicContact CD1-CG 4.26Å; F1489-R1491 PolarHBondContact O-N 3.12Å; R1491-F1493 PolarHBondContact O-N 3.17Å; R1491-F1493 VanDerWaalsContact O-N 3.1Å
1492	Q	29	Very low	29.3	Very low	134 Å²	134	133.3 Å²	133.3	63%	0.626	71%	0.709	S	S	*	*				68.2	139	108.1	-97.3	176.6	-33.3	0	0	112.6	T1490	T1490-Q1492 HydrophobicContact CG2-CG 4.43Å; T1490-Q1492 PolarHBondContact O-N 3.18Å
1493	F	28.2	Very low	29.2	Very low	162 Å²	162	134 Å²	134	71%	0.711	72%	0.716	S	S	*	*				169.3	136	126.8	-96.1	-54.9	0	0	0	114.5	R1491	R1491-F1493 PolarHBondContact O-N 3.17Å; R1491-F1493 VanDerWaalsContact O-N 3.1Å
1494	T	29.3	Very low	29.2	Very low	108 Å²	108	135.7 Å²	135.7	66%	0.663	71%	0.714	S	S	*	*			trans	52.9	108	136.5	56.3	0	0	0	0	119.3	E1496	T1494-E1496 PolarHBondContact O-N 3.3Å
1495	H	26.6	Very low	29.1	Very low	161.6 Å²	161.6	133.8 Å²	133.8	75%	0.748	70%	0.704	S	S	*	*			trans	17.2	129.6	131.2	-110	-102.3	0	0	0	115.8	V1419 F1497	V1419-H1495 HydrophobicContact CG2-CB 4.39Å; H1495-F1497 VanDerWaalsContact C-N 3.32Å; H1495-F1497 AromaticContact CE1-CD2 3.76Å; H1495-F1497 AromaticContact CE1-CE2 3.58Å; H1495-F1497 AromaticContact ND1-CD2 3.48Å; H1495-F1497 WeakPolarHBondContact ND1-CD2 3.29Å; H1495-F1497 AromaticContact ND1-CE2 3.8Å; H1495-F1497 PolarHBondContact O-N 2.79Å
1496	E	28.6	Very low	29.1	Very low	143 Å²	143	135.6 Å²	135.6	67%	0.668	70%	0.697	S	S	*	*			trans	175.4	142.3	137.2	-96.8	177.4	-156	0	0	115.8	S1417 S1418 V1419 T1494 M1498	S1417-E1496 WeakPolarHBondContact CA-OE2 3.28Å; S1417-E1496 VanDerWaalsContact N-CD 3.31Å; S1417-E1496 VanDerWaalsContact N-CG 3.26Å; S1417-E1496 PolarHBondContact N-OE2 2.8Å; S1418-E1496 WeakPolarHBondContact CA-OE1 3.49Å; S1418-E1496 VanDerWaalsContact N-CB 3.28Å; S1418-E1496 PolarHBondContact N-OE1 2.81Å; S1418-E1496 PolarHBondContact N-OE2 3.36Å; V1419-E1496 PolarHBondContact N-OE1 3.43Å; V1419-E1496 VanDerWaalsContact N-OE1 3.12Å; T1494-E1496 PolarHBondContact O-N 3.3Å; E1496-M1498 PolarHBondContact O-N 2.97Å
1497	F	27.5	Very low	29.2	Very low	159.2 Å²	159.2	136.3 Å²	136.3	70%	0.698	69%	0.693	S	S	*	*			trans	-60.2	131.1	158	-99.2	-86.2	0	0	0	114.5	S1415 S1416 H1495	S1415-F1497 VanDerWaalsContact CA-CE1 3.45Å; S1415-F1497 VanDerWaalsContact CB-CZ 3.47Å; S1416-F1497 WeakPolarHBondContact O-CD2 3.21Å; S1416-F1497 WeakPolarHBondContact O-CG 2.92Å; H1495-F1497 VanDerWaalsContact C-N 3.32Å; H1495-F1497 AromaticContact CE1-CD2 3.76Å; H1495-F1497 AromaticContact CE1-CE2 3.58Å; H1495-F1497 AromaticContact ND1-CD2 3.48Å; H1495-F1497 WeakPolarHBondContact ND1-CD2 3.29Å; H1495-F1497 AromaticContact ND1-CE2 3.8Å; H1495-F1497 PolarHBondContact O-N 2.79Å
1498	M	28.8	Very low	29.3	Very low	157.2 Å²	157.2	134.1 Å²	134.1	77%	0.774	68%	0.684	S	S	*	*			trans	179.3	143.8	139.3	-87.8	-62.2	176.2	0	0	114.6	E1496	E1496-M1498 PolarHBondContact O-N 2.97Å
1499	N	27.7	Very low	29.5	Very low	138 Å²	138	133.4 Å²	133.4	74%	0.738	68%	0.68	S	S	*	*			trans	-86.6	142.1	169.4	-115.6	-21.9	0	0	0	114.5	T1501	N1499-T1501 PolarHBondContact O-N 2.66Å; N1499-T1501 VanDerWaalsContact O-N 3.14Å
1500	T	28.6	Very low	29.6	Very low	116.2 Å²	116.2	131.3 Å²	131.3	71%	0.713	68%	0.677	S	S	*	*			trans	-104.5	111.8	156.2	34.4	0	0	0	0	114.4
1501	T	27.7	Very low	29.8	Very low	104 Å²	104	132.3 Å²	132.3	64%	0.638	68%	0.678	S	S	*	*			trans	39	124.5	143.7	56.7	0	0	0	0	118.3	N1499	N1499-T1501 PolarHBondContact O-N 2.66Å; N1499-T1501 VanDerWaalsContact O-N 3.14Å
1502	T	29	Very low	30.1	Very low	125.8 Å²	125.8	129.4 Å²	129.4	77%	0.772	68%	0.676	S	S	*	*				-173	133.4	87.9	23	0	0	0	0	113.6
1503	V	28.3	Very low	30.4	Very low	126.6 Å²	126.6	128.9 Å²	128.9	77%	0.767	68%	0.678	S	S	*	*			trans	-88.3	119.2	156.7	167.6	0	0	0	0	115.5
1504	H	29.6	Very low	30.7	Very low	131.8 Å²	131.8	127.4 Å²	127.4	61%	0.61	68%	0.678	S	S	*	*			trans	169.4	153.5	157.9	-126.4	59.3	0	0	0	116.3	N1506	H1504-N1506 VanDerWaalsContact C-N 3.32Å; H1504-N1506 PolarHBondContact O-N 2.8Å; H1504-N1506 VanDerWaalsContact O-N 3.11Å
1505	N	28.8	Very low	30.9	Very low	111.8 Å²	111.8	128.7 Å²	128.7	60%	0.598	68%	0.681	S	S	*	*			trans	-122.9	141.4	171.2	-127.9	-0.7	0	0	0	111.3	N1507	N1505-N1507 VanDerWaalsContact C-N 3.31Å; N1505-N1507 PolarHBondContact O-N 3.49Å
1506	N	30.6	Very low	31.3	Very low	110.4 Å²	110.4	128 Å²	128	59%	0.59	68%	0.682	S	S	*	*			trans	-149.7	106.6	148.2	-90.2	-33.7	0	0	0	114.5	H1504	H1504-N1506 VanDerWaalsContact C-N 3.32Å; H1504-N1506 PolarHBondContact O-N 2.8Å; H1504-N1506 VanDerWaalsContact O-N 3.11Å
1507	N	31.4	Very low	31.3	Very low	115.6 Å²	115.6	125.8 Å²	125.8	62%	0.618	68%	0.683	S	S	*	*			trans	-115.8	131	148.1	-82.8	-40.5	0	0	0	113	N1505	N1505-N1507 VanDerWaalsContact C-N 3.31Å; N1505-N1507 PolarHBondContact O-N 3.49Å
1508	N	32.4	Very low	31.4	Very low	114.8 Å²	114.8	125.2 Å²	125.2	61%	0.614	69%	0.685	S	S	*	*			trans	-113.8	146.1	134.1	-81.7	-41.4	0	0	0	112.5
1509	N	34.1	Very low	31.4	Very low	122.4 Å²	122.4	126 Å²	126	66%	0.655	69%	0.685	S	S	*	*				154.6	151.9	115.5	-99.9	-14.2	0	0	0	114.1
1510	N	35.3	Very low	31.6	Very low	125 Å²	125	126.2 Å²	126.2	67%	0.668	68%	0.684	S	S	*	*			cis	-152.3	152.5	42	-109.4	-13.6	0	0	0	113.3
1511	N	35	Very low	31.9	Very low	127.8 Å²	127.8	125.3 Å²	125.3	68%	0.683	68%	0.68	S	S	*	*			trans	48.8	140	131.1	-79.9	-14.2	0	0	0	120.6
1512	N	36	Very low	32	Very low	121.6 Å²	121.6	124.4 Å²	124.4	65%	0.65	68%	0.678	S	S	*	*				100.9	110.7	121.8	-76.8	-13.8	0	0	0	119.2
1513	N	34.4	Very low	32.1	Very low	124 Å²	124	123.4 Å²	123.4	66%	0.663	67%	0.672	S	S	*	*				69.7	121.6	111.9	-62.9	-7	0	0	0	120.9
1514	N	35.6	Very low	32.1	Very low	130.6 Å²	130.6	121.7 Å²	121.7	70%	0.698	67%	0.665	S	S	*	*				120.9	136.8	107.9	-76.4	-14.3	0	0	0	116.6
1515	N	32.8	Very low	32.2	Very low	135.6 Å²	135.6	121.6 Å²	121.6	73%	0.725	67%	0.673	S	S	*	*				153.2	130	105.6	-80.2	-25.2	0	0	0	115.8
1516	N	34.3	Very low	32.3	Very low	146.2 Å²	146.2	120.4 Å²	120.4	78%	0.782	67%	0.674	S	S	*	*			trans	108.5	122.1	141.9	-73.8	-15.7	0	0	0	115.3
1517	S	30	Very low	32.3	Very low	97 Å²	97	121.9 Å²	121.9	68%	0.678	68%	0.681	S	S	*	*				87.1	125.5	104.4	112.3	0	0	0	0	116.4
1518	I	29.2	Very low	32.4	Very low	146 Å²	146	123.8 Å²	123.8	75%	0.749	69%	0.691	S	S	*	*				169	126.8	117.9	-74.5	163.3	0	0	0	112.7
1519	F	28.8	Very low	32.3	Very low	175.8 Å²	175.8	125.1 Å²	125.1	77%	0.771	70%	0.698	S	S	*	*				99.7	134.2	111.5	-100.5	-87.6	0	0	0	116.4
1520	I	31.1	Very low	32.4	Very low	140.8 Å²	140.8	123.4 Å²	123.4	72%	0.722	69%	0.693	S	S	*	*			trans	-66.3	146.9	153.3	-39.2	171.5	0	0	0	111.8	S1522	I1520-S1522 PolarHBondContact O-N 2.91Å
1521	P	34.6	Very low	32.3	Very low	96.8 Å²	96.8	124.2 Å²	124.2	63%	0.629	70%	0.698	S	S	*	*				-105.6	158.3	128.1	22.2	-5.4	0	0	0	112.8	S1144 T1145 Q1146	S1144-P1521 VanDerWaalsContact CB-CD 3.47Å; S1144-P1521 WeakPolarHBondContact O-CD 3.41Å; S1144-P1521 VanDerWaalsContact O-CG 3.23Å; S1144-P1521 WeakPolarHBondContact O-CG 3.29Å; T1145-P1521 WeakPolarHBondContact CB-O 3.45Å; T1145-P1521 WeakPolarHBondContact CG2-O 3.49Å; T1145-P1521 PolarHBondContact OG1-O 2.98Å; Q1146-P1521 HydrophobicContact CB-CB 3.95Å; Q1146-P1521 VanDerWaalsContact CD-CB 3.41Å; Q1146-P1521 HydrophobicContact CG-CB 4.27Å; Q1146-P1521 VanDerWaalsContact OE1-CB 3.29Å
1522	S	29.8	Very low	32.1	Very low	85.4 Å²	85.4	123.2 Å²	123.2	60%	0.597	70%	0.699	S	S	*	*			trans	-123	130.8	132	69.8	0	0	0	0	112.5	Q1146 I1520 C1524	Q1146-S1522 VanDerWaalsContact CG-O 3.3Å; Q1146-S1522 WeakPolarHBondContact CG-O 3.3Å; Q1146-S1522 PolarHBondContact NE2-O 3.29Å; I1520-S1522 PolarHBondContact O-N 2.91Å; S1522-C1524 PolarHBondContact O-N 3.23Å
1523	T	30.9	Very low	31.8	Very low	105.2 Å²	105.2	123.1 Å²	123.1	65%	0.645	71%	0.707	S	S	*	*				-137.6	118.9	126.1	19.8	0	0	0	0	112.4	T1145 Q1147	T1145-T1523 HydrophobicContact CG2-CG2 3.75Å; Q1147-T1523 VanDerWaalsContact O-CG2 3.3Å; Q1147-T1523 WeakPolarHBondContact O-CG2 3.37Å
1524	C	29	Very low	31.5	Very low	90.2 Å²	90.2	122.4 Å²	122.4	61%	0.609	71%	0.712	S	S	*	*			trans	57.2	117.8	144.1	-75	0	0	0	0	117.9	Q1146 R1148 S1522 S1526	Q1146-C1524 WeakPolarHBondContact CG-SG 3.33Å; Q1146-C1524 PolarHBondContact O-SG 2.89Å; R1148-C1524 HydrophobicContact CG-CB 3.93Å; S1522-C1524 PolarHBondContact O-N 3.23Å; C1524-S1526 PolarHBondContact O-N 2.65Å
1525	T	31.2	Very low	31.1	Very low	129.6 Å²	129.6	122 Å²	122	80%	0.795	71%	0.714	S	S	*	*			trans	-133.2	134	148.6	34.2	0	0	0	0	112.2
1526	S	31.8	Very low	31	Very low	87.6 Å²	87.6	123.4 Å²	123.4	61%	0.613	72%	0.718	S	S	*	*			cis	173.5	166.2	41.9	61.2	0	0	0	0	112.6	R1148 K1149 C1524	R1148-S1526 PolarHBondContact NE-O 3.31Å; R1148-S1526 PolarHBondContact NH2-O 3.12Å; K1149-S1526 WeakPolarHBondContact CE-OG 3.17Å; K1149-S1526 PolarHBondContact NZ-OG 2.98Å; C1524-S1526 PolarHBondContact O-N 2.65Å
1527	L	30.3	Very low	30.6	Very low	141.8 Å²	141.8	123.1 Å²	123.1	74%	0.742	72%	0.716	S	S	*	*			cis	-173.3	137.3	4.8	-112.3	70.6	0	0	0	111.7
1528	L	33.8	Very low	30.6	Very low	155 Å²	155	125 Å²	125	81%	0.812	72%	0.716	S	S	*	*			trans	163.6	126	134.7	-79.1	169.9	0	0	0	113.5
1529	N	29.3	Very low	30.6	Very low	143 Å²	143	123.2 Å²	123.2	77%	0.765	71%	0.712	S	S	*	*				175.7	166.5	112.2	-140.6	22.8	0	0	0	111.2
1530	P	37.4	Very low	30.7	Very low	86.4 Å²	86.4	122 Å²	122	56%	0.561	71%	0.713	S	S	*	*			cis	-131.4	-162.7	-45.4	37.1	-16.9	0	0	0	113.8
1531	N	32.2	Very low	30.6	Very low	142.2 Å²	142.2	119.8 Å²	119.8	76%	0.76	71%	0.71	S	S	*	*			trans	97.8	136	153.6	-67.7	-22.3	0	0	0	116.2
1532	C	31.4	Very low	30.3	Very low	105.6 Å²	105.6	120.1 Å²	120.1	71%	0.714	72%	0.715	S	S	*	*				106.4	129.7	75.2	-82.7	0	0	0	0	113.7
1533	C	30.1	Very low	30.4	Very low	121.2 Å²	121.2	121.3 Å²	121.3	82%	0.819	72%	0.721	S	S	*	*				49.1	121	100.9	-58.9	0	0	0	0	116.4
1534	S	27.2	Very low	30.3	Very low	109.2 Å²	109.2	121.5 Å²	121.5	76%	0.764	73%	0.726	S	S	*	*			trans	171.2	151.2	135.7	-124.5	0	0	0	0	115.2
1535	V	28.5	Very low	30.3	Very low	121.4 Å²	121.4	123.9 Å²	123.9	74%	0.736	73%	0.733	S	S	*	*			trans	72.9	121.6	160.6	-171.1	0	0	0	0	117.4	N1537	V1535-N1537 HydrophobicContact CG1-CB 4.1Å
1536	M	29.5	Very low	30.3	Very low	165.6 Å²	165.6	122.4 Å²	122.4	82%	0.816	73%	0.728	S	S	*	*			trans	84.1	114.6	150	-109.1	166.6	-131.6	0	0	113.7	M1538	M1536-M1538 HydrophobicContact CB-CG 4.29Å; M1536-M1538 HydrophobicContact CG-CG 3.63Å; M1536-M1538 PolarHBondContact O-N 3.36Å; M1536-M1538 HydrophobicContact SD-CE 4.21Å; M1536-M1538 HydrophobicContact SD-CG 3.82Å; M1536-M1538 HydrophobicContact SD-SD 4.41Å
1537	N	27.6	Very low	30.3	Very low	139.6 Å²	139.6	123.9 Å²	123.9	75%	0.747	73%	0.733	S	S	*	*				-122.9	137.2	68.5	-161.5	12.6	0	0	0	109.9	V1535	V1535-N1537 HydrophobicContact CG1-CB 4.1Å
1538	M	29.4	Very low	30.3	Very low	136.4 Å²	136.4	120.9 Å²	120.9	67%	0.672	73%	0.729	S	S	*	*			trans	162.1	124.2	159.6	-73.8	-102.6	-79.4	0	0	113.6	M1536	M1536-M1538 HydrophobicContact CB-CG 4.29Å; M1536-M1538 HydrophobicContact CG-CG 3.63Å; M1536-M1538 PolarHBondContact O-N 3.36Å; M1536-M1538 HydrophobicContact SD-CE 4.21Å; M1536-M1538 HydrophobicContact SD-CG 3.82Å; M1536-M1538 HydrophobicContact SD-SD 4.41Å
1539	T	29.5	Very low	30.1	Very low	109.2 Å²	109.2	121.9 Å²	121.9	67%	0.67	73%	0.727	S	S	*	*			trans	-61.9	126.6	148.5	40.9	0	0	0	0	115.1
1540	L	29.2	Very low	30.2	Very low	149.6 Å²	149.6	120.5 Å²	120.5	78%	0.783	72%	0.723	S	S	*	*				170.1	142.7	123.1	-80.9	167.9	0	0	0	112.7
1541	S	29.7	Very low	29.8	Very low	95.4 Å²	95.4	123.7 Å²	123.7	67%	0.667	74%	0.735	S	S	*	*			cis	108.7	137.5	46.9	85.2	0	0	0	0	114.2	C1543	S1541-C1543 PolarHBondContact O-N 3.4Å
1542	S	28.8	Very low	29.7	Very low	103.4 Å²	103.4	120.4 Å²	120.4	72%	0.723	73%	0.727	S	S	*	*			trans	76	130.4	163.4	75.5	0	0	0	0	114.3	C1544	S1542-C1544 PolarHBondContact O-SG 3.37Å
1543	C	32.6	Very low	29.7	Very low	109.2 Å²	109.2	121.2 Å²	121.2	74%	0.738	73%	0.729	S	S	*	*				-144.6	141	81.3	-86.7	0	0	0	0	111.8	S1541 D1716	S1541-C1543 PolarHBondContact O-N 3.4Å; C1543-D1716 PolarHBondContact SG-O 3.23Å
1544	C	28.7	Very low	29.7	Very low	109.4 Å²	109.4	120.5 Å²	120.5	74%	0.739	72%	0.721	S	S	*	*				121.7	119.4	115.4	-74.3	0	0	0	0	117.1	S1542	S1542-C1544 PolarHBondContact O-SG 3.37Å
1545	N	29.1	Very low	30	Very low	140.2 Å²	140.2	120.1 Å²	120.1	75%	0.75	72%	0.715	S	S	*	*				47.6	112.3	123	-67.4	-17	0	0	0	118.7
1546	S	30	Very low	30.1	Very low	98.8 Å²	98.8	118.9 Å²	118.9	69%	0.691	71%	0.711	S	S	*	*				145	127.5	99.9	-80.3	0	0	0	0	114.5
1547	T	31.1	Very low	30.5	Very low	119 Å²	119	115.6 Å²	115.6	73%	0.73	70%	0.703	S	S	*	*				103.6	131.9	100	47.8	0	0	0	0	116.4	V1561 T1562	T1547-V1561 VanDerWaalsContact OG1-CG2 3.25Å; T1547-V1561 WeakPolarHBondContact OG1-CG2 3.27Å; T1547-T1562 HydrophobicContact CG2-CG2 3.57Å; T1547-T1562 PolarHBondContact O-N 2.89Å
1548	A	30.3	Very low	30.8	Very low	78.6 Å²	78.6	115.9 Å²	115.9	65%	0.65	70%	0.703	S	S	*	*				113	149.3	79.2	0	0	0	0	0	116.7	T1562 S1563	A1548-T1562 CarbonylContact O-C 3.22Å; A1548-T1562 WeakPolarHBondContact O-CA 3.48Å; A1548-T1562 PolarHBondContact O-N 2.17Å; A1548-S1563 PolarHBondContact O-N 2.17Å
1549	K	30.9	Very low	30.9	Very low	176.8 Å²	176.8	114 Å²	114	77%	0.769	70%	0.703	S	S	*	*			trans	84.7	134.5	148.6	-83.9	177.9	-176.7	171.7	0	116	T1562 S1563 S1564	K1549-T1562 WeakPolarHBondContact CD-O 3.46Å; K1549-S1563 WeakPolarHBondContact CD-O 3.5Å; K1549-S1563 VanDerWaalsContact CE-C 3.42Å; K1549-S1563 WeakPolarHBondContact CE-O 3.07Å; K1549-S1563 PolarHBondContact NZ-O 2.18Å; K1549-S1564 WeakPolarHBondContact CE-O 3.17Å
1550	T	31.3	Very low	30.9	Very low	112.6 Å²	112.6	114.7 Å²	114.7	69%	0.691	71%	0.707	S	S	*	*				92.9	125.7	95.8	-65.8	0	0	0	0	116.1
1551	L	29.6	Very low	31	Very low	153.8 Å²	153.8	112.7 Å²	112.7	81%	0.805	70%	0.701	S	S	*	*				68	148.5	125.2	-126.3	68	0	0	0	115.5
1552	A	30.3	Very low	31.1	Very low	73 Å²	73	113.3 Å²	113.3	60%	0.603	70%	0.701	S	S	*	*			cis	151.4	160.1	11.8	0	0	0	0	0	114.1
1553	T	30.8	Very low	31.2	Very low	123.2 Å²	123.2	112.6 Å²	112.6	76%	0.756	70%	0.696	S	S	*	*			trans	118.5	136.7	145.5	36.8	0	0	0	0	116.3	T1555	T1553-T1555 PolarHBondContact O-N 2.18Å
1554	T	30.3	Very low	31.1	Very low	105.2 Å²	105.2	111.8 Å²	111.8	65%	0.645	69%	0.691	S	S	*	*				-80.8	151.5	96.9	38.3	0	0	0	0	113	S1556	T1554-S1556 PolarHBondContact O-N 3.37Å
1555	T	33.1	Very low	31.2	Very low	102 Å²	102	113.3 Å²	113.3	63%	0.626	69%	0.692	S	S	*	*			cis	-157.5	137.8	34.8	21.2	0	0	0	0	113.5	D1246 N1247 T1553	D1246-T1555 CarbonylContact O-C 3.4Å; D1246-T1555 VanDerWaalsContact O-CB 3.32Å; D1246-T1555 WeakPolarHBondContact O-CB 3.41Å; D1246-T1555 VanDerWaalsContact O-O 3.07Å; D1246-T1555 PolarHBondContact OD2-OG1 2.9Å; N1247-T1555 WeakPolarHBondContact CB-OG1 3.5Å; N1247-T1555 PolarHBondContact N-OG1 3.2Å; N1247-T1555 PolarHBondContact ND2-OG1 3Å; T1553-T1555 PolarHBondContact O-N 2.18Å
1556	S	31.3	Very low	31.2	Very low	95 Å²	95	115.3 Å²	115.3	66%	0.664	69%	0.694	S	S	*	*			trans	177.9	163.7	147.3	-52.2	0	0	0	0	113.7	D1246 T1554 L1558	D1246-S1556 VanDerWaalsContact O-CA 3.29Å; D1246-S1556 WeakPolarHBondContact O-CA 3.4Å; D1246-S1556 PolarHBondContact O-N 3.14Å; T1554-S1556 PolarHBondContact O-N 3.37Å; S1556-L1558 PolarHBondContact O-N 2.82Å
1557	P	38	Very low	31.3	Very low	97.8 Å²	97.8	116.6 Å²	116.6	64%	0.635	69%	0.692	S	S	*	*			trans	-126	163.4	-167.6	36.2	-21	0	0	0	115.1	E1244 D1246	E1244-P1557 HydrophobicContact CB-CB 3.86Å; E1244-P1557 HydrophobicContact CB-CG 3.72Å; E1244-P1557 HydrophobicContact CG-CB 4.23Å; E1244-P1557 HydrophobicContact CG-CG 3.78Å; E1244-P1557 WeakPolarHBondContact OE2-CB 3.24Å; D1246-P1557 HydrophobicContact CB-CG 4.06Å; D1246-P1557 WeakPolarHBondContact O-CD 3.34Å
1558	L	32.3	Very low	31.4	Very low	145 Å²	145	117.6 Å²	117.6	76%	0.759	69%	0.688	S	S	*	*			trans	158.7	125.5	136.3	-118.3	85.9	0	0	0	113.1	S1556	S1556-L1558 PolarHBondContact O-N 2.82Å
1559	S	31.7	Very low	31.4	Very low	96.2 Å²	96.2	118.9 Å²	118.9	67%	0.673	69%	0.688	S	S	*	*				84.1	148.1	112.4	67.5	0	0	0	0	118.4
1560	V	30.4	Very low	31.5	Very low	124.6 Å²	124.6	117.1 Å²	117.1	76%	0.755	69%	0.686	S	S	*	*				120	139.1	108	142.1	0	0	0	0	114.6
1561	V	31.2	Very low	31.4	Very low	107.6 Å²	107.6	116.4 Å²	116.4	65%	0.652	69%	0.686	S	S	*	*			cis	153.2	152.9	-6.9	109.1	0	0	0	0	114.3	T1547	T1547-V1561 VanDerWaalsContact OG1-CG2 3.25Å; T1547-V1561 WeakPolarHBondContact OG1-CG2 3.27Å
1562	T	31.1	Very low	31.6	Very low	108.4 Å²	108.4	114.7 Å²	114.7	67%	0.665	68%	0.682	S	S	*	*			trans	72.4	137.7	157.3	46.5	0	0	0	0	121.7	T1547 A1548 K1549	T1547-T1562 HydrophobicContact CG2-CG2 3.57Å; T1547-T1562 PolarHBondContact O-N 2.89Å; A1548-T1562 CarbonylContact O-C 3.22Å; A1548-T1562 WeakPolarHBondContact O-CA 3.48Å; A1548-T1562 PolarHBondContact O-N 2.17Å; K1549-T1562 WeakPolarHBondContact CD-O 3.46Å
1563	S	30.8	Very low	31.8	Very low	89.2 Å²	89.2	117 Å²	117	62%	0.624	69%	0.689	S	S	*	*				105.1	139.6	60.3	62.7	0	0	0	0	116.7	A1548 K1549	A1548-S1563 PolarHBondContact O-N 2.17Å; K1549-S1563 WeakPolarHBondContact CD-O 3.5Å; K1549-S1563 VanDerWaalsContact CE-C 3.42Å; K1549-S1563 WeakPolarHBondContact CE-O 3.07Å; K1549-S1563 PolarHBondContact NZ-O 2.18Å
1564	S	30.4	Very low	31.8	Very low	91.2 Å²	91.2	119.4 Å²	119.4	64%	0.638	69%	0.689	S	S	*	*			trans	69.2	132.6	147.4	75	0	0	0	0	119.1	K1549	K1549-S1564 WeakPolarHBondContact CE-O 3.17Å
1565	N	30.8	Very low	31.9	Very low	142 Å²	142	120.3 Å²	120.3	76%	0.759	69%	0.694	S	S	*	*			trans	78.4	134.4	137.3	-58.4	-14.6	0	0	0	118.1
1566	F	30.4	Very low	31.9	Very low	180.8 Å²	180.8	120.9 Å²	120.9	79%	0.793	70%	0.698	S	S	*	*				160	146.3	95.2	-115.5	-126.5	0	0	0	117
1567	I	32.2	Very low	31.9	Very low	126 Å²	126	124.7 Å²	124.7	65%	0.646	71%	0.705	S	S	*	*			trans	54.2	127.8	159.7	-52.9	174.1	0	0	0	119.2
1568	H	31.4	Very low	31.6	Very low	140.4 Å²	140.4	124.3 Å²	124.3	65%	0.65	71%	0.71	S	S	*	*				57	143.2	117.8	-90.5	-73	0	0	0	117.7	T2002 S2003 F2004	H1568-T2002 PolarHBondContact CD2-OG1 2.6Å; H1568-T2002 PolarHBondContact CE1-O 2.93Å; H1568-T2002 PolarHBondContact ND1-O 2.9Å; H1568-S2003 PolarHBondContact CE1-N 3.2Å; H1568-S2003 VanDerWaalsContact CE1-N 3.31Å; H1568-S2003 PolarHBondContact NE2-OG 3.36Å; H1568-F2004 AromaticContact CE1-CE2 3.56Å; H1568-F2004 AromaticContact NE2-CE2 3.69Å; H1568-F2004 AromaticContact NE2-CZ 3.88Å
1569	T	31.2	Very low	31.3	Very low	105.4 Å²	105.4	122.9 Å²	122.9	65%	0.647	71%	0.711	S	S	*	*				124.9	129	92	-45.3	0	0	0	0	118.6
1570	I	32.4	Very low	31.2	Very low	140.2 Å²	140.2	125.6 Å²	125.6	72%	0.719	72%	0.717	S	S	*	*			trans	55.1	120.1	150.3	-54.4	173.9	0	0	0	118.6
1571	S	30.2	Very low	31.2	Very low	98 Å²	98	124 Å²	124	69%	0.685	71%	0.711	S	S	*	*				175.9	150.4	70.6	-104.9	0	0	0	0	116.5
1572	T	34.1	Very low	31.1	Very low	117.4 Å²	117.4	125 Å²	125	72%	0.72	71%	0.713	S	S	*	*			trans	21.6	132.6	131.9	54.4	0	0	0	0	120.1
1573	T	33.3	Very low	31.1	Very low	122.2 Å²	122.2	127.5 Å²	127.5	75%	0.75	72%	0.717	S	S	*	*				170.4	150	117.7	48.9	0	0	0	0	116.7
1574	K	31	Very low	31.1	Very low	173.4 Å²	173.4	132.5 Å²	132.5	75%	0.754	72%	0.724	S	S	*	*			trans	-173.3	145.4	146.2	-86.9	176	178.6	178.8	0	114.1
1575	T	32.7	Very low	31.1	Very low	122.6 Å²	122.6	132.9 Å²	132.9	75%	0.752	73%	0.727	S	S	*	*			trans	96	143.8	153.2	51	0	0	0	0	114.4
1576	T	33.6	Very low	31	Very low	116.2 Å²	116.2	133.5 Å²	133.5	71%	0.713	73%	0.729	S	S	*	*				-173.3	145.4	96	50.2	0	0	0	0	114.8
1577	H	31.6	Very low	31	Very low	174.8 Å²	174.8	129.8 Å²	129.8	81%	0.809	73%	0.726	S	S	*	*				60.8	145.9	113.2	-75.6	-59.1	0	0	0	118	C1579	H1577-C1579 PolarHBondContact CD2-SG 2.37Å
1578	A	30.3	Very low	30.9	Very low	89.4 Å²	89.4	129.7 Å²	129.7	74%	0.739	73%	0.731	S	S	*	*			cis	163.7	160.9	34	0	0	0	0	0	115.4
1579	C	26.9	Very low	30.7	Very low	115.4 Å²	115.4	129.4 Å²	129.4	78%	0.78	73%	0.734	S	S	*	*			trans	-136.6	154.1	-156.4	-76.8	0	0	0	0	113.4	H1577	H1577-C1579 PolarHBondContact CD2-SG 2.37Å
1580	N	29.4	Very low	30.7	Very low	151.8 Å²	151.8	129.7 Å²	129.7	81%	0.812	74%	0.735	S	S	*	*			trans	61.8	138.4	169.7	-71.9	-20.6	0	0	0	114.6
1581	S	29.8	Very low	30.5	Very low	90.6 Å²	90.6	129.1 Å²	129.1	63%	0.634	73%	0.734	S	S	*	*			cis	151.4	156.1	24.2	121.5	0	0	0	0	111.1
1582	N	29.9	Very low	30.5	Very low	129.2 Å²	129.2	131.4 Å²	131.4	69%	0.691	74%	0.738	S	S	*	*			trans	86.8	138.1	172.8	-58.4	-25.6	0	0	0	113.8	Y1584	N1582-Y1584 HydrophobicContact CB-CD2 4.17Å; N1582-Y1584 HydrophobicContact CB-CE2 4.26Å
1583	Q	30.8	Very low	30.1	Very low	160.4 Å²	160.4	130.9 Å²	130.9	75%	0.75	74%	0.738	S	S	*	*				154.5	144.5	52.5	-88.1	171.1	22.4	0	0	110.8
1584	Y	29.7	Very low	29.9	Very low	195.4 Å²	195.4	134.6 Å²	134.6	77%	0.766	74%	0.744	S	S	*	*				174.6	147.9	72	-91.5	-66.8	0	0	0	109.8	S974 N1582	S974-Y1584 WeakPolarHBondContact CB-O 3.45Å; S974-Y1584 PolarHBondContact OG-O 3.08Å; N1582-Y1584 HydrophobicContact CB-CD2 4.17Å; N1582-Y1584 HydrophobicContact CB-CE2 4.26Å
1585	S	30.4	Very low	29.7	Very low	99.4 Å²	99.4	132.6 Å²	132.6	70%	0.695	74%	0.742	S	S	*	*			trans	-164.5	156.3	144.6	61.4	0	0	0	0	113.9
1586	L	29.6	Very low	29.6	Very low	154.2 Å²	154.2	133.8 Å²	133.8	81%	0.807	74%	0.743	S	S	*	*				-146.1	154.1	126.9	-104.8	77.1	0	0	0	111.7	V1588	L1586-V1588 HydrophobicContact CD2-CG2 4.31Å
1587	S	29.6	Very low	29.4	Very low	102.8 Å²	102.8	133.1 Å²	133.1	72%	0.719	74%	0.743	S	S	*	*			cis	-172	137.5	24.8	61.9	0	0	0	0	113.9
1588	V	30.9	Very low	29.3	Very low	124.4 Å²	124.4	135.6 Å²	135.6	75%	0.754	75%	0.745	S	S	*	*			trans	-137.1	127.9	139	178.8	0	0	0	0	109.8	L1586	L1586-V1588 HydrophobicContact CD2-CG2 4.31Å
1589	N	28.3	Very low	29.3	Very low	135 Å²	135	137.5 Å²	137.5	72%	0.722	74%	0.743	S	S	*	*				98.5	153.8	92.1	-159.8	19	0	0	0	113	N1591	N1589-N1591 PolarHBondContact ND2-OD1 3.2Å; N1589-N1591 PolarHBondContact OD1-N 2.97Å; N1589-N1591 VanDerWaalsContact OD1-N 3.15Å; N1589-N1591 PolarHBondContact OD1-OD1 2.82Å
1590	V	29.5	Very low	29.5	Very low	110.4 Å²	110.4	142.3 Å²	142.3	67%	0.669	75%	0.745	S	S	*	*				89.9	108.6	118	178.7	0	0	0	0	117.4
1591	N	29.1	Very low	29.5	Very low	128.8 Å²	128.8	141.6 Å²	141.6	69%	0.689	74%	0.74	S	S	*	*			trans	55	135.7	135.6	-69.2	-16.8	0	0	0	121.3	N1589	N1589-N1591 PolarHBondContact ND2-OD1 3.2Å; N1589-N1591 PolarHBondContact OD1-N 2.97Å; N1589-N1591 VanDerWaalsContact OD1-N 3.15Å; N1589-N1591 PolarHBondContact OD1-OD1 2.82Å
1592	N	29.6	Very low	29.6	Very low	145.2 Å²	145.2	144.3 Å²	144.3	78%	0.776	74%	0.743	S	S	*	*			trans	66.8	130	132.1	-75.1	-15.5	0	0	0	117.9
1593	C	26.1	Very low	29.5	Very low	107.4 Å²	107.4	147.6 Å²	147.6	73%	0.726	75%	0.747	S	S	*	*				91.4	141.8	127.7	-67.3	0	0	0	0	116.6
1594	F	29.7	Very low	29.6	Very low	199.6 Å²	199.6	147.8 Å²	147.8	88%	0.875	75%	0.745	S	S	*	*			trans	82.5	137.6	154.6	-80.3	-82.8	0	0	0	117.3
1595	N	26.7	Very low	29.8	Very low	130.8 Å²	130.8	146.2 Å²	146.2	70%	0.699	75%	0.745	S	S	*	*			trans	89.8	126.5	143.4	-154.2	6.1	0	0	0	114.7
1596	L	30.4	Very low	30.2	Very low	149.6 Å²	149.6	146.3 Å²	146.3	78%	0.783	74%	0.743	S	S	*	*			trans	58.1	130.2	146.7	-80.3	107.7	0	0	0	114
1597	S	29.1	Very low	30.3	Very low	100.4 Å²	100.4	145.6 Å²	145.6	70%	0.702	74%	0.739	S	S	*	*				158.8	133.9	84.6	58.9	0	0	0	0	113.3
1598	R	30.2	Very low	30.6	Very low	226.8 Å²	226.8	147.1 Å²	147.1	86%	0.856	74%	0.739	S	S	*	*				109	123.4	94.3	-110.4	-179.3	-173.8	176.6	3.5	114
1599	N	29.7	Very low	30.8	Very low	129.4 Å²	129.4	143.7 Å²	143.7	69%	0.692	73%	0.729	S	S	*	*			trans	61.6	130.9	139.4	-78.9	-39.7	0	0	0	115.4
1600	R	30.1	Very low	31.3	Very low	216.8 Å²	216.8	142.8 Å²	142.8	82%	0.818	73%	0.731	S	S	*	*				114.1	132.6	75.6	-156	-169	175.1	-175	-0.4	112.2
1601	L	30.8	Very low	31.4	Very low	138 Å²	138	142.5 Å²	142.5	72%	0.723	73%	0.733	S	S	*	*			trans	67.9	143.2	162.2	-59.9	173.8	0	0	0	113
1602	Q	30.5	Very low	31.6	Very low	145.8 Å²	145.8	143.4 Å²	143.4	68%	0.681	74%	0.737	S	S	*	*				175.2	160.2	63.8	-86	175.6	-10.4	0	0	111.1
1603	Y	29.5	Very low	31.6	Very low	198.6 Å²	198.6	140.4 Å²	140.4	78%	0.779	73%	0.727	S	S	*	*				-175.2	140.4	124.7	-91.1	-98	0	0	0	110.1
1604	K	31	Very low	31.8	Very low	165.6 Å²	165.6	139.6 Å²	139.6	72%	0.72	72%	0.723	S	S	*	*				106.3	139.3	67.7	-127.5	-171.7	178.5	-170.6	0	112.7	P1606 D1617	K1604-P1606 WeakPolarHBondContact O-CD 3.42Å; K1604-D1617 IonicContact NZ-OD1 3.13Å; K1604-D1617 PolarHBondContact NZ-OD1 3.29Å; K1604-D1617 IonicContact NZ-OD2 3.68Å
1605	Q	34.7	Very low	31.7	Very low	160.8 Å²	160.8	135.4 Å²	135.4	75%	0.751	71%	0.713	S	S	*	*				-119.7	-179.1	130	-99.8	178.1	-39.5	0	0	110.8
1606	P	39.3	Very low	31.8	Very low	102.6 Å²	102.6	135.6 Å²	135.6	67%	0.666	71%	0.714	S	S	*	*			trans	-119.7	-172.2	-177.5	27.2	-10.1	0	0	0	113.4	K1604	K1604-P1606 WeakPolarHBondContact O-CD 3.42Å
1607	L	32.2	Very low	31.7	Very low	138.4 Å²	138.4	134.4 Å²	134.4	73%	0.725	71%	0.708	S	S	*	*			trans	163.4	152.5	159.1	-104.1	69.7	0	0	0	112.3	H972	H972-L1607 PolarHBondContact CE1-O 3.42Å; H972-L1607 PolarHBondContact NE2-O 3.43Å
1608	L	34.8	Very low	31.7	Very low	134.8 Å²	134.8	135.9 Å²	135.9	71%	0.706	71%	0.707	S	S	*	*			cis	-163.7	146.3	12.5	-113.1	105.7	0	0	0	113.7	H972 T973 S1613	H972-L1608 PolarHBondContact CE1-N 3.43Å; T973-L1608 HydrophobicContact CG2-CB 4.45Å; T973-L1608 VanDerWaalsContact CG2-O 3.29Å; T973-L1608 WeakPolarHBondContact CG2-O 3.27Å; L1608-S1613 WeakPolarHBondContact CD2-OG 3.38Å
1609	G	35.5	Very low	31.6	Very low	53.6 Å²	53.6	131.4 Å²	131.4	55%	0.553	70%	0.696	S	S	*	*			trans	63.4	-171.1	156.7	0	0	0	0	0	115.8	H972	H972-G1609 VanDerWaalsContact CA-O 3.29Å; H972-G1609 WeakPolarHBondContact CA-O 2.8Å
1610	P	39.8	Very low	31.5	Very low	116.2 Å²	116.2	131.3 Å²	131.3	76%	0.755	69%	0.692	S	S	*	*			cis	-110.9	161.8	0.3	29.9	-12.7	0	0	0	113.1
1611	S	30.2	Very low	31.5	Very low	102.6 Å²	102.6	126.7 Å²	126.7	72%	0.717	68%	0.679	S	S	*	*				170.3	121.2	67.8	62.8	0	0	0	0	112.1
1612	I	33	Very low	31.5	Very low	148.8 Å²	148.8	126 Å²	126	76%	0.763	67%	0.672	S	S	*	*			trans	166.4	128.6	140.9	41.8	175.4	0	0	0	112.6	S1614 D1933	I1612-S1614 VanDerWaalsContact C-N 3.34Å; I1612-S1614 PolarHBondContact O-N 3.23Å; I1612-D1933 WeakPolarHBondContact CB-OD1 3.48Å; I1612-D1933 VanDerWaalsContact CG2-CG 3.49Å; I1612-D1933 WeakPolarHBondContact CG2-OD1 3.38Å; I1612-D1933 VanDerWaalsContact CG2-OD2 3.23Å; I1612-D1933 WeakPolarHBondContact CG2-OD2 3.23Å
1613	S	31	Very low	31.4	Very low	82.6 Å²	82.6	123.9 Å²	123.9	58%	0.578	67%	0.665	S	S	*	*				63.9	109.9	59.7	-56.5	0	0	0	0	114.5	L1608 D1933 Q1934	L1608-S1613 WeakPolarHBondContact CD2-OG 3.38Å; S1613-D1933 VanDerWaalsContact CB-OD1 3.25Å; S1613-D1933 WeakPolarHBondContact CB-OD1 3.46Å; S1613-D1933 WeakPolarHBondContact OG-CA 3.46Å; S1613-D1933 PolarHBondContact OG-OD1 3.08Å; S1613-Q1934 PolarHBondContact OG-N 2.87Å
1614	S	28.9	Very low	31.5	Very low	90.8 Å²	90.8	122.9 Å²	122.9	64%	0.635	66%	0.661	S	S	*	*				117.9	134	71.2	64.8	0	0	0	0	113.9	I1612	I1612-S1614 VanDerWaalsContact C-N 3.34Å; I1612-S1614 PolarHBondContact O-N 3.23Å
1615	T	28.5	Very low	31.4	Very low	110.4 Å²	110.4	118.9 Å²	118.9	68%	0.677	65%	0.654	S	S	*	*				90.8	128.7	129.5	-21.3	0	0	0	0	116
1616	L	28.8	Very low	31.2	Very low	135.2 Å²	135.2	120.2 Å²	120.2	71%	0.708	66%	0.657	S	S	*	*			trans	70.2	134.7	161.8	-66.5	168.1	0	0	0	116.6	L1618	L1616-L1618 HydrophobicContact CD2-CB 4.01Å; L1616-L1618 HydrophobicContact CD2-CD1 4.14Å
1617	D	28.4	Very low	31.2	Very low	123.8 Å²	123.8	120.5 Å²	120.5	66%	0.662	66%	0.659	S	S	*	*				-145.8	150.7	64.7	-87.8	-34	0	0	0	111	K1604	K1604-D1617 IonicContact NZ-OD1 3.13Å; K1604-D1617 PolarHBondContact NZ-OD1 3.29Å; K1604-D1617 IonicContact NZ-OD2 3.68Å
1618	L	29.2	Very low	31.5	Very low	132.2 Å²	132.2	118.7 Å²	118.7	69%	0.692	66%	0.656	S	S	*	*				62.8	127.8	88.8	-129.4	78.8	0	0	0	115.6	L1616	L1616-L1618 HydrophobicContact CD2-CB 4.01Å; L1616-L1618 HydrophobicContact CD2-CD1 4.14Å
1619	E	27.3	Very low	31.3	Very low	132.4 Å²	132.4	120.4 Å²	120.4	62%	0.619	66%	0.66	S	S	*	*				149.7	157.6	127.4	-99.9	-173	142.8	0	0	114.2	Y2497	E1619-Y2497 WeakPolarHBondContact OE1-CD2 3.46Å; E1619-Y2497 VanDerWaalsContact OE1-CE1 3.23Å; E1619-Y2497 WeakPolarHBondContact OE1-CE1 3.41Å; E1619-Y2497 WeakPolarHBondContact OE1-CE2 3.34Å; E1619-Y2497 PolarHBondContact OE1-OH 2.74Å; E1619-Y2497 WeakPolarHBondContact OE2-CE1 3.09Å; E1619-Y2497 PolarHBondContact OE2-OH 3.06Å; E1619-Y2497 VanDerWaalsContact OE2-OH 3.09Å
1620	Q	28.6	Very low	31.3	Very low	128.2 Å²	128.2	124.7 Å²	124.7	60%	0.599	67%	0.67	S	S	*	*				68.2	157.4	123.9	-94.9	167.5	42.3	0	0	114.9	L947 Y2497	L947-Q1620 HydrophobicContact CD1-CB 4.23Å; L947-Q1620 HydrophobicContact CD1-CG 3.72Å; Q1620-Y2497 VanDerWaalsContact NE2-CD2 3.3Å
1621	E	29.5	Very low	31.2	Very low	119 Å²	119	124.2 Å²	124.2	56%	0.556	67%	0.666	S	S	*	*				72.7	166.9	108.2	-70.3	-137.4	138.7	0	0	115.3	F945 P946 L947	F945-E1621 CarbonylContact O-C 3.46Å; P946-E1621 PolarHBondContact O-N 2.78Å; L947-E1621 PolarHBondContact N-OE1 3.19Å
1622	H	30.2	Very low	31.3	Very low	123.8 Å²	123.8	123.6 Å²	123.6	57%	0.573	66%	0.662	S	S	*	*			trans	157	161	168.1	-87.5	-179.7	0	0	0	115.1	E943 K944 F945	E943-H1622 PolarHBondContact O-ND1 3.24Å; K944-H1622 VanDerWaalsContact C-CG 3.44Å; K944-H1622 HydrophobicContact CB-CB 3.92Å; K944-H1622 PolarHBondContact O-CE1 2.71Å; K944-H1622 PolarHBondContact O-ND1 3.11Å; K944-H1622 PolarHBondContact O-NE2 3.25Å; F945-H1622 VanDerWaalsContact CA-CD2 3.43Å; F945-H1622 WeakPolarHBondContact CA-CD2 3.32Å; F945-H1622 WeakPolarHBondContact CA-NE2 3.08Å; F945-H1622 PolarHBondContact N-CD2 3.33Å; F945-H1622 VanDerWaalsContact N-CG 3.28Å; F945-H1622 PolarHBondContact N-NE2 3.43Å
1623	L	29.8	Very low	31.6	Very low	101.2 Å²	101.2	121.1 Å²	121.1	53%	0.53	66%	0.656	S	S	.	*				155.1	157	65.2	-93.9	152	0	0	0	113.5	E943 K944	E943-L1623 HydrophobicContact CB-CB 4.3Å; E943-L1623 HydrophobicContact CB-CD1 3.41Å; E943-L1623 VanDerWaalsContact CB-CD1 3.41Å; E943-L1623 HydrophobicContact CB-CG 3.44Å; E943-L1623 VanDerWaalsContact CB-CG 3.44Å; E943-L1623 HydrophobicContact CG-CG 4.07Å; E943-L1623 WeakPolarHBondContact OE2-CG 3.48Å; K944-L1623 VanDerWaalsContact CB-C 3.49Å; K944-L1623 VanDerWaalsContact CB-CA 3.45Å; K944-L1623 VanDerWaalsContact CD-O 3.26Å; K944-L1623 WeakPolarHBondContact CD-O 3.13Å; K944-L1623 WeakPolarHBondContact CE-O 3.03Å; K944-L1623 PolarHBondContact NZ-O 3.23Å
1624	Y	30.5	Very low	31.6	Very low	178.4 Å²	178.4	123.5 Å²	123.5	70%	0.7	66%	0.658	S	S	*	*			trans	67.5	150.2	156.4	-61.4	-101	0	0	0	116.6	E943 K944 F945	E943-Y1624 HydrophobicContact CB-CD1 4.02Å; E943-Y1624 HydrophobicContact CB-CG 4.5Å; E943-Y1624 HydrophobicContact CG-CD1 3.6Å; E943-Y1624 HydrophobicContact CG-CG 3.99Å; E943-Y1624 VanDerWaalsContact CG-N 3.27Å; E943-Y1624 WeakPolarHBondContact OE2-CA 2.87Å; E943-Y1624 PolarHBondContact OE2-N 2.81Å; K944-Y1624 HydrophobicContact CB-CD1 4.3Å; K944-Y1624 HydrophobicContact CB-CD2 3.71Å; K944-Y1624 HydrophobicContact CB-CE2 4.12Å; K944-Y1624 HydrophobicContact CB-CG 3.77Å; K944-Y1624 HydrophobicContact CG-CD2 3.56Å; K944-Y1624 HydrophobicContact CG-CE2 3.99Å; K944-Y1624 HydrophobicContact CG-CG 4.09Å; F945-Y1624 HydrophobicContact CD2-CE2 4.44Å
1625	S	29.5	Very low	31.7	Very low	80.4 Å²	80.4	125 Å²	125	56%	0.562	66%	0.655	S	S	*	*			cis	156.4	142.2	23.8	-92.8	0	0	0	0	114.5	N942 E943	N942-S1625 PolarHBondContact ND2-OG 3.11Å; N942-S1625 PolarHBondContact OD1-OG 3.02Å; E943-S1625 WeakPolarHBondContact OE2-CB 3.38Å
1626	F	29.9	Very low	31.8	Very low	189.2 Å²	189.2	126.5 Å²	126.5	83%	0.83	65%	0.653	S	S	*	*				69.4	151.9	124.6	-79.3	-66.1	0	0	0	117.2	N942	N942-F1626 WeakPolarHBondContact ND2-CD2 2.98Å; N942-F1626 WeakPolarHBondContact ND2-CE2 2.66Å; N942-F1626 WeakPolarHBondContact ND2-CZ 3.4Å
1627	P	40.7	Very low	31.9	Very low	108.2 Å²	108.2	126.3 Å²	126.3	70%	0.703	65%	0.649	S	S	*	*				-120.5	-153	-106	36.4	-18.9	0	0	0	111.4
1628	P	38.1	Very low	32	Very low	101.8 Å²	101.8	126.3 Å²	126.3	66%	0.661	64%	0.644	S	S	*	*			cis	-130.8	-174	-14.8	28.5	-6.8	0	0	0	113.8
1629	Q	30.4	Very low	32.1	Very low	170.6 Å²	170.6	128 Å²	128	80%	0.797	64%	0.643	S	S	*	*				95.1	148.9	105.4	-76.5	171.9	-1.7	0	0	118.5
1630	L	35.7	Very low	32.3	Very low	143.4 Å²	143.4	127.9 Å²	127.9	75%	0.751	64%	0.642	S	S	*	*			trans	-53.5	164.5	158.1	-81.2	68.6	0	0	0	113.2
1631	P	36.2	Very low	32.5	Very low	104.4 Å²	104.4	128.6 Å²	128.6	68%	0.678	65%	0.645	S	S	*	*			cis	-124.3	179.3	31.7	27.5	-11.5	0	0	0	114	I1298	I1298-P1631 HydrophobicContact CD1-CG 3.58Å
1632	S	33.6	Very low	32.7	Very low	91.4 Å²	91.4	129.4 Å²	129.4	64%	0.639	65%	0.649	S	S	*	*			trans	-60.4	178.7	144.4	-62.6	0	0	0	0	110.9	D1447	D1447-S1632 VanDerWaalsContact OD2-C 3.24Å
1633	P	38.2	Very low	32.8	Very low	96 Å²	96	130.2 Å²	130.2	62%	0.623	65%	0.653	S	S	*	*			cis	-138.2	-160.7	20.8	34.7	-14.3	0	0	0	116.9	D1447	D1447-P1633 VanDerWaalsContact CG-N 3.33Å; D1447-P1633 WeakPolarHBondContact OD1-CA 3.43Å; D1447-P1633 WeakPolarHBondContact OD1-CD 3.47Å
1634	H	30.7	Very low	33	Very low	133.6 Å²	133.6	132.1 Å²	132.1	62%	0.619	66%	0.659	S	S	*	*			trans	86.8	134	153.1	-70.2	-50.3	0	0	0	118.2	G1446 D1447	G1446-H1634 CarbonylContact O-C 3.34Å; G1446-H1634 VanDerWaalsContact O-CA 3.27Å; G1446-H1634 WeakPolarHBondContact O-CA 3.29Å; D1447-H1634 PolarHBondContact OD1-N 2.62Å
1635	H	31.1	Very low	33.1	Very low	122.4 Å²	122.4	129.3 Å²	129.3	57%	0.567	65%	0.652	S	S	*	*			cis	162.2	147.8	42.7	-100.1	4.5	0	0	0	117.1	Q1443 G1444 N1445 G1446	Q1443-H1635 PolarHBondContact NE2-CD2 3.32Å; Q1443-H1635 PolarHBondContact NE2-NE2 3.08Å; G1444-H1635 PolarHBondContact O-ND1 3.36Å; N1445-H1635 CarbonylContact O-C 3.21Å; N1445-H1635 VanDerWaalsContact O-C 3.29Å; N1445-H1635 VanDerWaalsContact O-CA 3.28Å; N1445-H1635 WeakPolarHBondContact O-CA 3.27Å; G1446-H1635 VanDerWaalsContact O-CA 3.3Å; G1446-H1635 WeakPolarHBondContact O-CA 3.45Å; G1446-H1635 PolarHBondContact O-N 3.38Å
1636	H	31.2	Very low	33.2	Very low	140 Å²	140	131.7 Å²	131.7	65%	0.648	65%	0.654	S	S	*	*			trans	53.6	151.3	145.8	-78.2	16.6	0	0	0	119.8	G1444 N1445	G1444-H1636 CarbonylContact C-O 2.98Å; G1444-H1636 WeakPolarHBondContact CA-O 2.7Å; N1445-H1636 PolarHBondContact O-N 2.93Å
1637	H	30.4	Very low	33.4	Very low	132.4 Å²	132.4	129.2 Å²	129.2	61%	0.613	65%	0.645	S	S	*	*				-170.3	145.4	80.6	-91.2	-48.2	0	0	0	114.1	Q1443	Q1443-H1637 HydrophobicContact CB-CB 4.35Å
1638	H	31.5	Very low	32.9	Very low	124 Å²	124	131.6 Å²	131.6	57%	0.574	65%	0.647	S	S	*	*				82.1	128	123.2	-97.9	21.8	0	0	0	119.3	Y1440 H1441 E1442	Y1440-H1638 WeakPolarHBondContact CA-CD2 3.14Å; Y1440-H1638 CarbonylContact O-C 2.94Å; Y1440-H1638 VanDerWaalsContact O-CA 3.25Å; Y1440-H1638 WeakPolarHBondContact O-CA 3.07Å; Y1440-H1638 WeakPolarHBondContact O-CB 3.26Å; Y1440-H1638 PolarHBondContact O-CD2 2.83Å; H1441-H1638 VanDerWaalsContact CA-CE1 3.48Å; H1441-H1638 WeakPolarHBondContact CA-CE1 3.23Å; H1441-H1638 WeakPolarHBondContact CA-ND1 3Å; H1441-H1638 AromaticContact CD2-CE1 3.19Å; H1441-H1638 PolarHBondContact CD2-CE1 3.3Å; H1441-H1638 AromaticContact CD2-NE2 3.29Å; H1441-H1638 PolarHBondContact CD2-NE2 2.94Å; H1441-H1638 VanDerWaalsContact CD2-NE2 3.29Å; H1441-H1638 AromaticContact CG-CE1 3.47Å; H1441-H1638 VanDerWaalsContact CG-CE1 3.47Å; H1441-H1638 AromaticContact CG-NE2 3.91Å; H1441-H1638 PolarHBondContact N-CD2 3.32Å; H1441-H1638 AromaticContact NE2-CE1 3.6Å; H1441-H1638 AromaticContact NE2-NE2 3.92Å; E1442-H1638 VanDerWaalsContact C-N 3.33Å; E1442-H1638 CarbonylContact O-C 3.05Å; E1442-H1638 VanDerWaalsContact O-C 3.26Å; E1442-H1638 VanDerWaalsContact O-CA 3.29Å; E1442-H1638 WeakPolarHBondContact O-CA 3.48Å; E1442-H1638 PolarHBondContact O-N 3.07Å
1639	Y	30.7	Very low	32.9	Very low	168.2 Å²	168.2	131.6 Å²	131.6	66%	0.66	65%	0.647	S	S	*	*				104.2	126.9	126.5	-102	-65	0	0	0	117.5	Q1439 Y1440 H1441 E1442	Q1439-Y1639 VanDerWaalsContact O-CB 3.31Å; Q1439-Y1639 WeakPolarHBondContact O-CB 3.12Å; Q1439-Y1639 WeakPolarHBondContact O-CD2 3.43Å; Y1440-Y1639 VanDerWaalsContact C-CG 3.43Å; Y1440-Y1639 VanDerWaalsContact CB-CD2 3.41Å; Y1440-Y1639 HydrophobicContact CG-CE2 4.35Å; Y1440-Y1639 VanDerWaalsContact O-CA 3.31Å; Y1440-Y1639 WeakPolarHBondContact O-CA 3.32Å; Y1440-Y1639 WeakPolarHBondContact O-CB 3.29Å; Y1440-Y1639 PolarHBondContact O-N 3.5Å; H1441-Y1639 VanDerWaalsContact C-N 3.3Å; H1441-Y1639 WeakPolarHBondContact O-CA 2.88Å; H1441-Y1639 WeakPolarHBondContact O-CD1 3.25Å; H1441-Y1639 WeakPolarHBondContact O-CE1 3.1Å; E1442-Y1639 VanDerWaalsContact N-N 3.17Å; E1442-Y1639 PolarHBondContact O-N 2.95Å
1640	Q	32.8	Very low	33	Very low	129 Å²	129	129.4 Å²	129.4	60%	0.603	65%	0.646	S	S	*	*				99.8	154.4	125.5	-98.8	-179.6	-3.3	0	0	117.2	D1011	D1011-Q1640 VanDerWaalsContact CG-NE2 3.3Å; D1011-Q1640 PolarHBondContact OD1-NE2 2.75Å; D1011-Q1640 PolarHBondContact OD2-NE2 3.07Å
1641	H	31.8	Very low	32.7	Very low	143.6 Å²	143.6	130.4 Å²	130.4	67%	0.665	64%	0.644	S	S	*	*			trans	-176.1	136.8	149.3	-100.4	-111.4	0	0	0	114.6
1642	H	33.5	Very low	32.4	Very low	136.4 Å²	136.4	135 Å²	135	63%	0.631	65%	0.649	S	S	*	*				110.5	148.8	104.7	-99.6	-31.6	0	0	0	115.2	Q1644	H1642-Q1644 PolarHBondContact O-N 2.75Å
1643	Q	32.4	Very low	32.7	Very low	139.6 Å²	139.6	135.4 Å²	135.4	65%	0.652	65%	0.65	S	S	*	*				144.9	152	114.9	-84.2	177	29.8	0	0	114.3
1644	Q	33.2	Very low	32.4	Very low	141 Å²	141	137.7 Å²	137.7	66%	0.659	66%	0.655	S	S	*	*				-173.1	141.1	106.5	-93.8	176.6	14.2	0	0	114	N1436 H1642	N1436-Q1644 PolarHBondContact OD1-O 3.36Å; H1642-Q1644 PolarHBondContact O-N 2.75Å
1645	Q	32.7	Very low	32.4	Very low	119 Å²	119	139.1 Å²	139.1	56%	0.556	66%	0.664	S	S	*	*				104.7	123.7	99.2	-85.1	-176.3	44.8	0	0	117.9	T924 N1436	T924-Q1645 HydrophobicContact CG2-CB 3.64Å; T924-Q1645 HydrophobicContact CG2-CG 3.96Å; N1436-Q1645 PolarHBondContact ND2-O 3.14Å; N1436-Q1645 PolarHBondContact OD1-O 2.61Å
1646	Q	33.5	Very low	32.3	Very low	131.4 Å²	131.4	138 Å²	138	61%	0.614	67%	0.67	S	S	*	*			trans	97.6	141.9	134.3	-83.7	179.8	65.1	0	0	121.1	T923 T925	T923-Q1646 HydrophobicContact CG2-CG 3.96Å; T923-Q1646 VanDerWaalsContact CG2-NE2 3.33Å; T925-Q1646 WeakPolarHBondContact CG2-O 3.4Å; T925-Q1646 VanDerWaalsContact OG1-C 3.22Å; T925-Q1646 WeakPolarHBondContact OG1-CA 3.48Å; T925-Q1646 PolarHBondContact OG1-N 3.28Å; T925-Q1646 VanDerWaalsContact OG1-N 3.16Å
1647	Q	33.3	Very low	32.2	Very low	136 Å²	136	136 Å²	136	64%	0.636	67%	0.672	S	S	*	*			trans	75.2	114.4	145.6	-80.6	172.7	58.1	0	0	118.2	T923 T924 T925	T923-Q1647 VanDerWaalsContact C-OE1 3.3Å; T923-Q1647 PolarHBondContact O-NE2 3.16Å; T924-Q1647 VanDerWaalsContact C-CG 3.5Å; T924-Q1647 WeakPolarHBondContact O-CG 3.13Å; T924-Q1647 PolarHBondContact O-NE2 3.18Å; T925-Q1647 PolarHBondContact OG1-N 3.24Å
1648	Q	30.2	Very low	32.2	Very low	159.8 Å²	159.8	135.8 Å²	135.8	75%	0.747	68%	0.68	S	S	*	*				57.3	153.5	98.3	-73.6	-163.2	46	0	0	119.9	T925	T925-Q1648 HydrophobicContact CG2-CB 4Å
1649	P	38.6	Very low	32.1	Very low	102 Å²	102	135 Å²	135	66%	0.662	69%	0.688	S	S	*	*			cis	-135.6	175.2	-24.8	42.1	-25.7	0	0	0	116.2
1650	T	30.9	Very low	32	Very low	124.4 Å²	124.4	132 Å²	132	76%	0.763	69%	0.692	S	S	*	*			trans	45.6	142.9	150.4	43.3	0	0	0	0	120.2
1651	K	30.3	Very low	32	Very low	164.4 Å²	164.4	131.2 Å²	131.2	72%	0.715	70%	0.701	S	S	*	*			trans	157.3	135.6	144.1	-118.7	176	170.1	-175	0	117.5	S932	S932-K1651 VanDerWaalsContact OG-CD 3.27Å; S932-K1651 WeakPolarHBondContact OG-CD 3.49Å; S932-K1651 VanDerWaalsContact OG-CE 3.27Å; S932-K1651 WeakPolarHBondContact OG-CE 3.31Å; S932-K1651 PolarHBondContact OG-NZ 3.26Å
1652	Y	30.5	Very low	32	Very low	200.8 Å²	200.8	129.2 Å²	129.2	79%	0.787	70%	0.703	S	S	*	*			trans	32.6	161.4	145.6	-63.4	-70.5	0	0	0	116.7	I931	I931-Y1652 CarbonylContact C-O 3.22Å
1653	P	39.1	Very low	31.9	Very low	100.4 Å²	100.4	129.3 Å²	129.3	65%	0.652	71%	0.708	S	S	*	*			cis	-138.7	176.4	2.8	38.8	-19.2	0	0	0	115.4	I931 N933	I931-P1653 WeakPolarHBondContact O-CD 3.33Å; N933-P1653 WeakPolarHBondContact OD1-CD 3.11Å
1654	I	31.9	Very low	31.9	Very low	142.8 Å²	142.8	131 Å²	131	73%	0.732	72%	0.716	S	S	*	*				59.8	129.4	112.3	-67	170.3	0	0	0	115.2
1655	M	30	Very low	31.9	Very low	163.4 Å²	163.4	127.7 Å²	127.7	81%	0.805	72%	0.719	S	S	*	*				-175	154.9	103.9	-102.7	169.9	54.6	0	0	114.8
1656	S	30.2	Very low	31.7	Very low	98.8 Å²	98.8	129.2 Å²	129.2	69%	0.691	73%	0.729	S	S	*	*			trans	115.2	134.2	158	-51.4	0	0	0	0	115.8
1657	S	28.7	Very low	31.4	Very low	99.6 Å²	99.6	133 Å²	133	70%	0.697	74%	0.74	S	S	*	*				106.7	130.5	124.4	60.8	0	0	0	0	116.5
1658	T	29.5	Very low	31.5	Very low	126.2 Å²	126.2	131.9 Å²	131.9	77%	0.774	74%	0.744	S	S	*	*				93.4	143	94.3	28	0	0	0	0	117.7
1659	S	29.8	Very low	31.5	Very low	107.8 Å²	107.8	129.1 Å²	129.1	75%	0.754	74%	0.742	S	S	*	*				118.3	140.8	116.6	57.2	0	0	0	0	118.6
1660	S	29.8	Very low	31.1	Very low	106 Å²	106	131.5 Å²	131.5	74%	0.741	75%	0.749	S	S	*	*			trans	108.3	142.1	145.3	62.8	0	0	0	0	116.6
1661	S	32.2	Very low	31.2	Very low	112.2 Å²	112.2	132.2 Å²	132.2	79%	0.785	75%	0.748	S	S	*	*			trans	77.7	145.5	154.4	71.8	0	0	0	0	115.8
1662	S	32.4	Very low	31.4	Very low	101.2 Å²	101.2	131.3 Å²	131.3	71%	0.708	74%	0.744	S	S	*	*			cis	-164.2	162.1	40.3	46.2	0	0	0	0	113.3
1663	N	31	Very low	31.5	Very low	137.6 Å²	137.6	128.4 Å²	128.4	74%	0.736	74%	0.741	S	S	*	*			trans	-56.7	150.9	151.9	-68.3	-38.5	0	0	0	114.5
1664	H	32.4	Very low	31.2	Very low	176.8 Å²	176.8	130.1 Å²	130.1	82%	0.819	74%	0.744	S	S	*	*				-165.3	156	118.7	-81.3	-78.2	0	0	0	113	I1666	H1664-I1666 VanDerWaalsContact ND1-CD1 3.3Å; H1664-I1666 WeakPolarHBondContact ND1-CD1 3.09Å
1665	G	31.9	Very low	31.1	Very low	70.4 Å²	70.4	130.2 Å²	130.2	73%	0.726	75%	0.746	S	S	*	*			trans	161.4	71.7	174.7	0	0	0	0	0	115.3
1666	I	29.4	Very low	31.1	Very low	151 Å²	151	127.6 Å²	127.6	77%	0.774	74%	0.743	S	S	*	*			trans	-176.1	127.4	130.5	-72.8	167.8	0	0	0	111.3	H1664	H1664-I1666 VanDerWaalsContact ND1-CD1 3.3Å; H1664-I1666 WeakPolarHBondContact ND1-CD1 3.09Å
1667	Y	27.9	Very low	31.1	Very low	211.2 Å²	211.2	133.6 Å²	133.6	83%	0.828	75%	0.75	S	S	*	*			trans	-74.8	150.1	160.3	-99.7	-112.1	0	0	0	113.2	S1669	Y1667-S1669 PolarHBondContact O-N 2.86Å
1668	P	34.6	Very low	31.2	Very low	113 Å²	113	136.9 Å²	136.9	73%	0.734	75%	0.752	S	S	*	*			trans	-126.5	161.1	137.5	32.6	-17.7	0	0	0	113.9	L1670	P1668-L1670 HydrophobicContact CB-CD1 4.43Å
1669	S	30.3	Very low	31.3	Very low	100.6 Å²	100.6	139.4 Å²	139.4	70%	0.703	75%	0.753	S	S	*	*			trans	-143.2	129.6	159.8	57.5	0	0	0	0	109.8	Y1667	Y1667-S1669 PolarHBondContact O-N 2.86Å
1670	L	30.9	Very low	31.4	Very low	152.6 Å²	152.6	141.1 Å²	141.1	80%	0.799	75%	0.754	S	S	*	*			trans	-19.6	129.4	152.4	-93.8	83.6	0	0	0	112.4	P1668	P1668-L1670 HydrophobicContact CB-CD1 4.43Å
1671	D	33.2	Very low	31.5	Very low	140 Å²	140	139 Å²	139	75%	0.749	75%	0.749	S	S	*	*				159.9	152.9	77.5	-126.6	-11.5	0	0	0	112.1
1672	K	33.1	Very low	31.7	Very low	145.2 Å²	145.2	139.3 Å²	139.3	63%	0.631	75%	0.746	S	S	*	*			trans	-135.5	136.3	-174.7	-93.5	171.8	-176.3	163.5	0	113.9	N1055 N1056	N1055-K1672 HydrophobicContact CB-CD 4.1Å; N1055-K1672 VanDerWaalsContact OD1-CE 3.29Å; N1055-K1672 WeakPolarHBondContact OD1-CE 3.42Å; N1055-K1672 PolarHBondContact OD1-NZ 2.94Å; N1056-K1672 WeakPolarHBondContact O-CE 3.3Å; N1056-K1672 PolarHBondContact O-NZ 3.25Å
1673	I	34.3	Very low	31.7	Very low	140.4 Å²	140.4	141.4 Å²	141.4	72%	0.72	74%	0.744	S	S	*	*			trans	103.1	120.8	148.1	-70.8	165.2	0	0	0	112.9	N1675	I1673-N1675 HydrophobicContact CG2-CB 4.44Å; I1673-N1675 PolarHBondContact O-N 3.29Å; I1673-N1675 VanDerWaalsContact O-N 3.16Å
1674	D	31.1	Very low	32	Very low	136.2 Å²	136.2	140.9 Å²	140.9	73%	0.728	74%	0.742	S	S	*	*				-127.6	135.7	89.2	-90.7	-46.2	0	0	0	112.4
1675	N	30.5	Very low	32.1	Very low	144.4 Å²	144.4	138.3 Å²	138.3	77%	0.772	73%	0.733	S	S	*	*			trans	158.4	133.6	137	-96.6	-44.7	0	0	0	115.5	I1673	I1673-N1675 HydrophobicContact CG2-CB 4.44Å; I1673-N1675 PolarHBondContact O-N 3.29Å; I1673-N1675 VanDerWaalsContact O-N 3.16Å
1676	C	29.8	Very low	32.3	Very low	108.6 Å²	108.6	140.7 Å²	140.7	73%	0.734	73%	0.729	S	S	*	*			trans	-120	121.6	-175.3	-84.9	0	0	0	0	114
1677	R	31.2	Very low	32.5	Very low	224 Å²	224	139.3 Å²	139.3	85%	0.845	72%	0.719	S	S	*	*			trans	164.7	102.8	137.3	-79.1	-173	-177.9	-142.7	0.1	114.8
1678	F	29.1	Very low	32.8	Very low	168.6 Å²	168.6	134.4 Å²	134.4	74%	0.739	71%	0.706	S	S	*	*			trans	56.5	128.3	145.1	-67.6	-69	0	0	0	114.6	P2572	F1678-P2572 HydrophobicContact CE1-CG 4.25Å
1679	F	32.4	Very low	32.8	Very low	180.6 Å²	180.6	133.9 Å²	133.9	79%	0.792	69%	0.694	S	S	*	*				-157.1	145.7	68.3	-99.9	-76.2	0	0	0	110.6
1680	N	32.2	Very low	32.9	Very low	142.2 Å²	142.2	133.9 Å²	133.9	76%	0.76	69%	0.686	S	S	*	*			trans	-10.8	133.4	157.8	-75.8	-10.2	0	0	0	114.3	L1684	N1680-L1684 HydrophobicContact CB-CD1 4.21Å
1681	G	32.7	Very low	33	Very low	62.2 Å²	62.2	131.9 Å²	131.9	64%	0.641	68%	0.676	S	S	*	*				-153.5	163.4	128.5	0	0	0	0	0	112.8	L1685	G1681-L1685 PolarHBondContact O-N 3.35Å
1682	T	35.4	Very low	33.1	Very low	118 Å²	118	132.3 Å²	132.3	72%	0.724	67%	0.673	S	S	*	*			trans	-140.3	154.4	165	48	0	0	0	0	111.4	L1684	T1682-L1684 PolarHBondContact O-N 3.5Å
1683	E	33.4	Very low	33.1	Very low	145 Å²	145	132.4 Å²	132.4	68%	0.678	68%	0.678	S	S	*	*			trans	-48.7	170.6	133.3	-98	-166.9	144.4	0	0	114.4	Q1687	E1683-Q1687 VanDerWaalsContact O-CB 3.24Å; E1683-Q1687 WeakPolarHBondContact O-CB 3.26Å; E1683-Q1687 PolarHBondContact O-N 3.15Å
1684	L	35.9	Very low	33	Very low	128.8 Å²	128.8	132.2 Å²	132.2	67%	0.674	68%	0.678	S	S	*	*			trans	-133.3	163.6	159.4	-82.8	170.5	0	0	0	111.1	N1680 T1682 Q1687 N1688	N1680-L1684 HydrophobicContact CB-CD1 4.21Å; T1682-L1684 PolarHBondContact O-N 3.5Å; L1684-Q1687 PolarHBondContact O-N 3.38Å; L1684-N1688 VanDerWaalsContact O-CB 3.3Å; L1684-N1688 WeakPolarHBondContact O-CB 3.15Å; L1684-N1688 PolarHBondContact O-N 3.43Å; L1684-N1688 PolarHBondContact O-ND2 3.43Å
1685	L	34.3	Very low	33.1	Very low	120.4 Å²	120.4	129 Å²	129	63%	0.63	68%	0.678	S	S	*	*			trans	-58.3	168.6	131.4	-149	97.2	0	0	0	112.3	G1681 Q1687 N1688 Q1689	G1681-L1685 PolarHBondContact O-N 3.35Å; L1685-Q1687 PolarHBondContact O-N 3.35Å; L1685-N1688 PolarHBondContact O-N 2.98Å; L1685-Q1689 WeakPolarHBondContact O-CG 3.27Å; L1685-Q1689 PolarHBondContact O-N 3.36Å
1686	L	36.7	Very low	33.2	Very low	122.4 Å²	122.4	126.9 Å²	126.9	64%	0.641	68%	0.675	S	S	*	*			trans	-171.7	104.4	161	-84.8	150.9	0	0	0	114	N1688 L1690	L1686-N1688 PolarHBondContact O-N 2.96Å; L1686-L1690 WeakPolarHBondContact O-CB 3.5Å; L1686-L1690 WeakPolarHBondContact O-CG 3.5Å; L1686-L1690 PolarHBondContact O-N 3.17Å
1687	Q	32.7	Very low	33.2	Very low	121.8 Å²	121.8	128.2 Å²	128.2	57%	0.569	67%	0.672	S	S	*	*			trans	-93.8	124.8	167.6	-171.2	84.4	24.2	0	0	112.8	E1683 L1684 L1685 Q1689 N1691	E1683-Q1687 VanDerWaalsContact O-CB 3.24Å; E1683-Q1687 WeakPolarHBondContact O-CB 3.26Å; E1683-Q1687 PolarHBondContact O-N 3.15Å; L1684-Q1687 PolarHBondContact O-N 3.38Å; L1685-Q1687 PolarHBondContact O-N 3.35Å; Q1687-Q1689 HydrophobicContact CG-CG 4.13Å; Q1687-Q1689 VanDerWaalsContact NE2-CD 3.34Å; Q1687-N1691 PolarHBondContact NE2-OD1 2.95Å; Q1687-N1691 WeakPolarHBondContact O-CB 3.38Å; Q1687-N1691 PolarHBondContact O-N 3.12Å; Q1687-N1691 PolarHBondContact O-ND2 2.99Å; Q1687-N1691 VanDerWaalsContact O-ND2 3.16Å; Q1687-N1691 PolarHBondContact O-OD1 3.35Å
1688	N	34.6	Very low	33.3	Very low	106.8 Å²	106.8	127.6 Å²	127.6	57%	0.571	67%	0.67	S	S	*	*			trans	-149.4	132	163.2	-96.8	-20.9	0	0	0	111.4	A1063 L1684 L1685 L1686 N1691 H1692 I1711 V1712	A1063-N1688 WeakPolarHBondContact CB-OD1 3.36Å; L1684-N1688 VanDerWaalsContact O-CB 3.3Å; L1684-N1688 WeakPolarHBondContact O-CB 3.15Å; L1684-N1688 PolarHBondContact O-N 3.43Å; L1684-N1688 PolarHBondContact O-ND2 3.43Å; L1685-N1688 PolarHBondContact O-N 2.98Å; L1686-N1688 PolarHBondContact O-N 2.96Å; N1688-N1691 PolarHBondContact O-N 3.01Å; N1688-H1692 PolarHBondContact O-N 2.68Å; N1688-I1711 CarbonylContact O-C 3.29Å; N1688-V1712 HydrophobicContact CB-CB 4.43Å; N1688-V1712 HydrophobicContact CB-CG2 3.82Å; N1688-V1712 WeakPolarHBondContact O-CA 3.27Å; N1688-V1712 WeakPolarHBondContact O-CB 3.22Å; N1688-V1712 PolarHBondContact O-N 3.02Å
1689	Q	34.4	Very low	33.2	Very low	103 Å²	103	125.8 Å²	125.8	48%	0.481	67%	0.668	S	S	.	*				59.8	143.3	57.4	-75.8	-157.6	54.1	0	0	113.4	L1062 L1685 Q1687 N1691 H1692 M1693 K1709 N1710 V1712	L1062-Q1689 HydrophobicContact CB-CG 4.36Å; L1062-Q1689 HydrophobicContact CD1-CB 3.87Å; L1062-Q1689 HydrophobicContact CD1-CG 3.47Å; L1062-Q1689 VanDerWaalsContact CD1-CG 3.47Å; L1062-Q1689 HydrophobicContact CG-CB 3.79Å; L1062-Q1689 HydrophobicContact CG-CG 3.6Å; L1685-Q1689 WeakPolarHBondContact O-CG 3.27Å; L1685-Q1689 PolarHBondContact O-N 3.36Å; Q1687-Q1689 HydrophobicContact CG-CG 4.13Å; Q1687-Q1689 VanDerWaalsContact NE2-CD 3.34Å; Q1689-N1691 VanDerWaalsContact C-N 3.33Å; Q1689-N1691 PolarHBondContact O-N 3.35Å; Q1689-N1691 PolarHBondContact OE1-ND2 3.09Å; Q1689-H1692 PolarHBondContact O-N 3.04Å; Q1689-M1693 PolarHBondContact O-N 3.09Å; Q1689-K1709 PolarHBondContact OE1-O 3.25Å; Q1689-N1710 WeakPolarHBondContact CA-O 2.91Å; Q1689-N1710 WeakPolarHBondContact CG-O 3.15Å; Q1689-N1710 PolarHBondContact N-O 3.3Å; Q1689-N1710 VanDerWaalsContact N-O 3.1Å; Q1689-N1710 PolarHBondContact NE2-O 3.32Å; Q1689-N1710 PolarHBondContact OE1-O 2.75Å; Q1689-V1712 VanDerWaalsContact N-CA 3.27Å; Q1689-V1712 VanDerWaalsContact N-N 3.14Å; Q1689-V1712 WeakPolarHBondContact O-CG2 3.28Å
1690	L	33.7	Very low	33.2	Very low	99.8 Å²	99.8	124.6 Å²	124.6	52%	0.523	67%	0.665	S	S	.	*				-148	171.2	53.2	-103.6	168.1	0	0	0	113.4	L1062 L1686 N1694 N1710	L1062-L1690 HydrophobicContact CD1-CD1 4.1Å; L1686-L1690 WeakPolarHBondContact O-CB 3.5Å; L1686-L1690 WeakPolarHBondContact O-CG 3.5Å; L1686-L1690 PolarHBondContact O-N 3.17Å; L1690-N1694 WeakPolarHBondContact O-CB 3.36Å; L1690-N1694 PolarHBondContact O-N 3.3Å; L1690-N1694 PolarHBondContact O-ND2 2.9Å; L1690-N1710 HydrophobicContact CD2-CB 3.91Å
1691	N	33.2	Very low	33	Very low	112.2 Å²	112.2	124 Å²	124	60%	0.6	66%	0.662	S	S	*	*			trans	-106.5	150.9	164.6	-65.4	-39.3	0	0	0	113.7	Q1687 N1688 Q1689 G1695 K1715	Q1687-N1691 PolarHBondContact NE2-OD1 2.95Å; Q1687-N1691 WeakPolarHBondContact O-CB 3.38Å; Q1687-N1691 PolarHBondContact O-N 3.12Å; Q1687-N1691 PolarHBondContact O-ND2 2.99Å; Q1687-N1691 VanDerWaalsContact O-ND2 3.16Å; Q1687-N1691 PolarHBondContact O-OD1 3.35Å; N1688-N1691 PolarHBondContact O-N 3.01Å; Q1689-N1691 VanDerWaalsContact C-N 3.33Å; Q1689-N1691 PolarHBondContact O-N 3.35Å; Q1689-N1691 PolarHBondContact OE1-ND2 3.09Å; N1691-G1695 PolarHBondContact O-N 3.45Å; N1691-K1715 PolarHBondContact O-NZ 3.22Å
1692	H	34.9	Very low	32.9	Very low	147.6 Å²	147.6	127.3 Å²	127.3	68%	0.683	67%	0.665	S	S	*	*				-167.2	147.4	68.4	-103.2	-67.2	0	0	0	113.5	N1688 Q1689	N1688-H1692 PolarHBondContact O-N 2.68Å; Q1689-H1692 PolarHBondContact O-N 3.04Å
1693	M	33.1	Very low	32.7	Very low	148.2 Å²	148.2	128.3 Å²	128.3	73%	0.73	66%	0.664	S	S	*	*			trans	44.5	127.7	147.3	-56.2	-155.6	-63.5	0	0	118.3	Q1689 G1695 S1696	Q1689-M1693 PolarHBondContact O-N 3.09Å; M1693-G1695 VanDerWaalsContact C-N 3.26Å; M1693-G1695 PolarHBondContact O-N 3.04Å; M1693-S1696 PolarHBondContact O-N 2.72Å
1694	N	32	Very low	32.6	Very low	134.4 Å²	134.4	125.9 Å²	125.9	72%	0.719	66%	0.663	S	S	*	*				159.2	115.3	91.4	-108.7	-16.6	0	0	0	115	L1690 E2023	L1690-N1694 WeakPolarHBondContact O-CB 3.36Å; L1690-N1694 PolarHBondContact O-N 3.3Å; L1690-N1694 PolarHBondContact O-ND2 2.9Å; N1694-E2023 PolarHBondContact ND2-OE1 2.85Å
1695	G	32.5	Very low	32.4	Very low	70 Å²	70	126.2 Å²	126.2	72%	0.722	67%	0.666	S	S	*	*			trans	87.2	114.3	156.6	0	0	0	0	0	114.4	N1691 M1693	N1691-G1695 PolarHBondContact O-N 3.45Å; M1693-G1695 VanDerWaalsContact C-N 3.26Å; M1693-G1695 PolarHBondContact O-N 3.04Å
1696	S	32	Very low	32.3	Very low	101.2 Å²	101.2	126.3 Å²	126.3	71%	0.708	67%	0.666	S	S	*	*			trans	-146.8	138.3	-148.2	-150.3	0	0	0	0	111.8	M1693	M1693-S1696 PolarHBondContact O-N 2.72Å
1697	I	31.4	Very low	32.1	Very low	134.2 Å²	134.2	126.9 Å²	126.9	69%	0.688	67%	0.67	S	S	*	*			trans	-98	115.2	143.6	-77	165.6	0	0	0	113.8	D2021	I1697-D2021 WeakPolarHBondContact CD1-OD1 3.21Å; I1697-D2021 WeakPolarHBondContact CG2-OD1 3.24Å
1698	R	31.6	Very low	32.2	Very low	212.2 Å²	212.2	125.6 Å²	125.6	80%	0.801	67%	0.671	S	S	*	*			trans	179.8	125.4	152.2	-108.8	175.2	-129.7	179.9	2.1	112.9
1699	N	28	Very low	32.2	Very low	130.4 Å²	130.4	127.8 Å²	127.8	70%	0.697	68%	0.675	S	S	*	*			trans	62.6	123.1	139.5	-84.1	11.6	0	0	0	116.9
1700	H	31.4	Very low	32.1	Very low	155.4 Å²	155.4	128.1 Å²	128.1	72%	0.719	68%	0.68	S	S	*	*				177.7	146.1	97.1	-101.8	-67.1	0	0	0	113.9
1701	N	29.7	Very low	32	Very low	130.4 Å²	130.4	130 Å²	130	70%	0.697	69%	0.69	S	S	*	*			trans	72	133	152.5	-58.9	-3.7	0	0	0	120.5
1702	N	29.7	Very low	32	Very low	131.2 Å²	131.2	129.9 Å²	129.9	70%	0.702	69%	0.693	S	S	*	*			trans	69.2	118.2	137.2	-68.4	-5	0	0	0	117.2
1703	I	30.7	Very low	32	Very low	139.4 Å²	139.4	128.3 Å²	128.3	72%	0.715	69%	0.69	S	S	*	*				93	119.2	94.6	-71	165.5	0	0	0	112.6
1704	S	31.8	Very low	31.9	Very low	93.4 Å²	93.4	126.9 Å²	126.9	65%	0.653	69%	0.685	S	S	*	*			trans	83.8	133	135.6	75.1	0	0	0	0	115.2
1705	N	31.3	Very low	31.9	Very low	136.8 Å²	136.8	128.2 Å²	128.2	73%	0.732	68%	0.684	S	S	*	*				-175	135.3	63.8	-106.6	-15.3	0	0	0	110.6	N1707	N1705-N1707 PolarHBondContact ND2-ND2 3.47Å; N1705-N1707 PolarHBondContact OD1-ND2 3.43Å
1706	N	32.4	Very low	32	Very low	120.6 Å²	120.6	130.1 Å²	130.1	65%	0.645	68%	0.678	S	S	*	*				106.5	110.3	67.2	-79.9	-32.6	0	0	0	115	N1056	N1056-N1706 PolarHBondContact ND2-O 3.3Å
1707	N	33.4	Very low	32.1	Very low	135.6 Å²	135.6	132.4 Å²	132.4	73%	0.725	68%	0.677	S	S	*	*				106	123	120.9	-79.5	-36.7	0	0	0	114.3	N1705	N1705-N1707 PolarHBondContact ND2-ND2 3.47Å; N1705-N1707 PolarHBondContact OD1-ND2 3.43Å
1708	T	34	Very low	32.1	Very low	95.4 Å²	95.4	131.9 Å²	131.9	59%	0.585	68%	0.676	S	S	*	*			cis	143.7	136.7	42.4	-9.9	0	0	0	0	110.8	K1060	K1060-T1708 WeakPolarHBondContact CD-O 3.4Å; K1060-T1708 PolarHBondContact NZ-OG1 3.07Å
1709	K	34	Very low	32	Very low	151.8 Å²	151.8	130.9 Å²	130.9	66%	0.66	67%	0.673	S	S	*	*				-154.5	144	90.2	-107.1	177.4	-176.9	176.3	0	109.4	K1060 Q1689	K1060-K1709 WeakPolarHBondContact CE-O 2.95Å; K1060-K1709 PolarHBondContact NZ-O 2.65Å; Q1689-K1709 PolarHBondContact OE1-O 3.25Å
1710	N	32.5	Very low	32.2	Very low	109.2 Å²	109.2	132 Å²	132	58%	0.584	67%	0.672	S	S	*	*				108.4	140.2	92.2	-80.4	-2.5	0	0	0	112.6	Q1689 L1690 D1713	Q1689-N1710 WeakPolarHBondContact CA-O 2.91Å; Q1689-N1710 WeakPolarHBondContact CG-O 3.15Å; Q1689-N1710 PolarHBondContact N-O 3.3Å; Q1689-N1710 VanDerWaalsContact N-O 3.1Å; Q1689-N1710 PolarHBondContact NE2-O 3.32Å; Q1689-N1710 PolarHBondContact OE1-O 2.75Å; L1690-N1710 HydrophobicContact CD2-CB 3.91Å; N1710-D1713 PolarHBondContact ND2-OD2 3.3Å
1711	I	32.6	Very low	32.2	Very low	141 Å²	141	131.9 Å²	131.9	72%	0.723	67%	0.672	S	S	*	*				-170.8	144.3	88	-94.2	163.9	0	0	0	110	N1688 D1713	N1688-I1711 CarbonylContact O-C 3.29Å; I1711-D1713 VanDerWaalsContact C-N 3.33Å; I1711-D1713 PolarHBondContact O-N 3.36Å
1712	V	33.3	Very low	32.3	Very low	109.8 Å²	109.8	131.9 Å²	131.9	67%	0.665	67%	0.671	S	S	*	*				53	137.2	126.9	143.6	0	0	0	0	114.2	N1688 Q1689 N1714	N1688-V1712 HydrophobicContact CB-CB 4.43Å; N1688-V1712 HydrophobicContact CB-CG2 3.82Å; N1688-V1712 WeakPolarHBondContact O-CA 3.27Å; N1688-V1712 WeakPolarHBondContact O-CB 3.22Å; N1688-V1712 PolarHBondContact O-N 3.02Å; Q1689-V1712 VanDerWaalsContact N-CA 3.27Å; Q1689-V1712 VanDerWaalsContact N-N 3.14Å; Q1689-V1712 WeakPolarHBondContact O-CG2 3.28Å; V1712-N1714 VanDerWaalsContact CG2-O 3.3Å; V1712-N1714 WeakPolarHBondContact CG2-O 3.33Å; V1712-N1714 PolarHBondContact O-N 2.98Å
1713	D	33.6	Very low	32.3	Very low	114 Å²	114	133.7 Å²	133.7	61%	0.61	67%	0.673	S	S	*	*			cis	-139.8	138.8	45.3	-106.7	-25.5	0	0	0	112.1	N1710 I1711	N1710-D1713 PolarHBondContact ND2-OD2 3.3Å; I1711-D1713 VanDerWaalsContact C-N 3.33Å; I1711-D1713 PolarHBondContact O-N 3.36Å
1714	N	31	Very low	32.3	Very low	118.8 Å²	118.8	133.2 Å²	133.2	64%	0.635	67%	0.671	S	S	*	*				70.6	150.3	104.9	-104.4	-39	0	0	0	118	V1712	V1712-N1714 VanDerWaalsContact CG2-O 3.3Å; V1712-N1714 WeakPolarHBondContact CG2-O 3.33Å; V1712-N1714 PolarHBondContact O-N 2.98Å
1715	K	33.3	Very low	32.2	Very low	161 Å²	161	138.3 Å²	138.3	70%	0.7	68%	0.676	S	S	*	*			trans	85	140.3	145.7	-77	166.9	177.4	-173.9	0	116.2	N1691	N1691-K1715 PolarHBondContact O-NZ 3.22Å
1716	D	34.3	Very low	32.1	Very low	111 Å²	111	137.7 Å²	137.7	59%	0.594	67%	0.672	S	S	*	*			cis	160.2	157.5	39.4	-101.7	-35	0	0	0	114	C1543	C1543-D1716 PolarHBondContact SG-O 3.23Å
1717	H	34.9	Very low	32.1	Very low	149.6 Å²	149.6	140 Å²	140	69%	0.693	68%	0.679	S	S	*	*				131.6	148.5	122.4	-76.5	-36.4	0	0	0	118.1
1718	N	29.7	Very low	31.9	Very low	123.2 Å²	123.2	141.6 Å²	141.6	66%	0.659	68%	0.682	S	S	*	*			trans	83.4	155.5	132.8	-102.3	-41.3	0	0	0	117.9
1719	Y	31	Very low	32.1	Very low	190.8 Å²	190.8	141.8 Å²	141.8	75%	0.748	69%	0.686	S	S	*	*				96.8	132	116.5	-87.9	-95.6	0	0	0	115.1
1720	K	31.8	Very low	32.1	Very low	154 Å²	154	141.5 Å²	141.5	67%	0.67	69%	0.691	S	S	*	*				99.4	133.2	105.1	-90.9	-178.8	176	-178.9	0	114.3
1721	H	31.7	Very low	32.1	Very low	153.6 Å²	153.6	140.4 Å²	140.4	71%	0.711	69%	0.692	S	S	*	*				109.1	144.1	123.5	-85.1	-93.8	0	0	0	115.4
1722	L	31.3	Very low	32.1	Very low	129.6 Å²	129.6	141.7 Å²	141.7	68%	0.679	69%	0.692	S	S	*	*			cis	172	152.1	17.6	-88.6	135.6	0	0	0	113.6
1723	F	29.6	Very low	32.1	Very low	170 Å²	170	142.1 Å²	142.1	75%	0.746	69%	0.69	S	S	*	*				114.3	146	124.3	-103.1	-91.3	0	0	0	118.2
1724	L	30.7	Very low	32.1	Very low	128.4 Å²	128.4	143.7 Å²	143.7	67%	0.672	69%	0.691	S	S	*	*			trans	51.2	140.2	151.2	-77.6	93.9	0	0	0	119.9	N1092	N1092-L1724 PolarHBondContact ND2-O 2.98Å
1725	R	29.3	Very low	32.1	Very low	201 Å²	201	144.3 Å²	144.3	76%	0.758	69%	0.69	S	S	*	*			cis	159.4	142.2	48.9	-114.7	-170.3	-176.1	-170.8	1.3	117.1	E1727	R1725-E1727 WeakPolarHBondContact CD-OE2 3.34Å; R1725-E1727 IonicContact CZ-OE1 2.99Å; R1725-E1727 IonicContact CZ-OE2 2.69Å; R1725-E1727 IonicContact NE-OE2 3.67Å; R1725-E1727 IonicContact NH1-OE1 2.61Å; R1725-E1727 PolarHBondContact NH1-OE1 3.08Å; R1725-E1727 IonicContact NH1-OE2 3.86Å; R1725-E1727 PolarHBondContact NH1-OE2 3.21Å
1726	N	29.5	Very low	32	Very low	123 Å²	123	141.5 Å²	141.5	66%	0.658	69%	0.687	S	S	*	*			trans	61.5	134.8	143.1	-69.2	21.9	0	0	0	118.8
1727	E	32.7	Very low	31.9	Very low	168.2 Å²	168.2	141.8 Å²	141.8	79%	0.786	69%	0.692	S	S	*	*				176.6	149.7	91	-88.6	160.8	-179	0	0	115.8	R1725	R1725-E1727 WeakPolarHBondContact CD-OE2 3.34Å; R1725-E1727 IonicContact CZ-OE1 2.99Å; R1725-E1727 IonicContact CZ-OE2 2.69Å; R1725-E1727 IonicContact NE-OE2 3.67Å; R1725-E1727 IonicContact NH1-OE1 2.61Å; R1725-E1727 PolarHBondContact NH1-OE1 3.08Å; R1725-E1727 IonicContact NH1-OE2 3.86Å; R1725-E1727 PolarHBondContact NH1-OE2 3.21Å
1728	Q	29.9	Very low	31.8	Very low	170 Å²	170	145 Å²	145	79%	0.794	70%	0.698	S	S	*	*			trans	-133.5	171.4	-174	-130.1	-152.6	-27.5	0	0	113.4
1729	P	38	Very low	31.8	Very low	100.4 Å²	100.4	143 Å²	143	65%	0.652	69%	0.694	S	S	*	*				-118.8	166.9	-116.2	39.6	-27.2	0	0	0	115.6
1730	D	33.5	Very low	32	Very low	144.8 Å²	144.8	141.4 Å²	141.4	77%	0.774	69%	0.693	S	S	*	*				175.9	151.8	116.3	-100	-18	0	0	0	117.3
1731	S	32.8	Very low	32	Very low	85.4 Å²	85.4	139 Å²	139	60%	0.597	70%	0.695	S	S	*	*			cis	158.8	163.6	24.7	69.6	0	0	0	0	116
1732	F	32.6	Very low	32	Very low	168.6 Å²	168.6	136.8 Å²	136.8	74%	0.739	70%	0.695	S	S	*	*				118.2	139	116.8	-88.4	-69.6	0	0	0	116.7	N1801	F1732-N1801 CarbonylContact C-O 3.51Å
1733	I	33.9	Very low	32	Very low	118.2 Å²	118.2	137.6 Å²	137.6	61%	0.606	70%	0.699	S	S	*	*				114.6	141.4	67.8	-94.6	171.3	0	0	0	115	H1735 G1800 N1801 S1802	I1733-H1735 VanDerWaalsContact CG2-CD2 3.45Å; I1733-H1735 WeakPolarHBondContact CG2-CD2 3.5Å; I1733-G1800 WeakPolarHBondContact CA-O 3.43Å; I1733-G1800 PolarHBondContact N-O 2.93Å; I1733-N1801 CarbonylContact C-O 3.42Å; I1733-N1801 WeakPolarHBondContact CA-O 3.48Å; I1733-N1801 PolarHBondContact N-O 2.89Å; I1733-N1801 CarbonylContact O-C 3.19Å; I1733-S1802 PolarHBondContact O-N 2.88Å
1734	K	32.2	Very low	32.1	Very low	149 Å²	149	135.1 Å²	135.1	65%	0.648	70%	0.698	S	S	*	*			cis	-165	146.6	-29.7	-115.9	166.7	-180	179.6	0	110.8	W848 L849 S850 Q851 N1801 S1802	W848-K1734 CarbonylContact C-O 3.38Å; W848-K1734 VanDerWaalsContact C-O 3.25Å; W848-K1734 CarbonylContact O-C 3.57Å; L849-K1734 CarbonylContact C-O 3.46Å; L849-K1734 WeakPolarHBondContact CA-O 3.47Å; L849-K1734 PolarHBondContact N-O 3.43Å; S850-K1734 WeakPolarHBondContact CB-O 3.31Å; S850-K1734 PolarHBondContact N-O 3.3Å; S850-K1734 WeakPolarHBondContact OG-CG 3.04Å; Q851-K1734 VanDerWaalsContact CD-NZ 3.27Å; K1734-N1801 VanDerWaalsContact N-CB 3.29Å; K1734-S1802 PolarHBondContact O-OG 2.98Å
1735	H	31.1	Very low	32.2	Very low	131.2 Å²	131.2	134.4 Å²	134.4	61%	0.607	70%	0.702	S	S	*	*			trans	147.2	138.6	143.7	-83	-43.3	0	0	0	116.2	W848 L1263 G1264 I1733 N1801 S1802	W848-H1735 HydrophobicContact CB-CB 3.63Å; W848-H1735 WeakPolarHBondContact CB-ND1 3.21Å; W848-H1735 HydrophobicContact CD2-CB 3.72Å; W848-H1735 HydrophobicContact CE3-CB 3.38Å; W848-H1735 AromaticContact CE3-CD2 3.94Å; W848-H1735 AromaticContact CE3-CG 3.5Å; W848-H1735 VanDerWaalsContact CE3-CG 3.5Å; W848-H1735 HydrophobicContact CG-CB 3.89Å; W848-H1735 HydrophobicContact CZ3-CB 4.12Å; W848-H1735 WeakPolarHBondContact O-CA 3.49Å; W848-H1735 PolarHBondContact O-ND1 2.86Å; W848-H1735 VanDerWaalsContact O-ND1 3.09Å; L1263-H1735 CarbonylContact C-O 3.49Å; G1264-H1735 PolarHBondContact N-O 2.92Å; I1733-H1735 VanDerWaalsContact CG2-CD2 3.45Å; I1733-H1735 WeakPolarHBondContact CG2-CD2 3.5Å; H1735-N1801 WeakPolarHBondContact CB-ND2 3.04Å; H1735-N1801 PolarHBondContact ND1-ND2 3.3Å; H1735-N1801 VanDerWaalsContact ND1-ND2 3.17Å; H1735-N1801 PolarHBondContact ND1-OD1 3.41Å; H1735-S1802 WeakPolarHBondContact CA-OG 3.3Å; H1735-S1802 PolarHBondContact N-OG 3.07Å
1736	T	32.2	Very low	32.5	Very low	102 Å²	102	132.4 Å²	132.4	63%	0.626	71%	0.706	S	S	*	*			trans	-175.7	155.5	150	46.4	0	0	0	0	114.4	W848 L849 L1263 G1264	W848-T1736 CarbonylContact C-O 3.33Å; W848-T1736 WeakPolarHBondContact CA-O 3.16Å; W848-T1736 PolarHBondContact N-O 2.75Å; L849-T1736 VanDerWaalsContact CB-O 3.3Å; L849-T1736 WeakPolarHBondContact CB-O 3.07Å; L849-T1736 WeakPolarHBondContact CD1-OG1 3.14Å; L849-T1736 PolarHBondContact N-O 2.69Å; L1263-T1736 CarbonylContact C-O 3.08Å; G1264-T1736 PolarHBondContact N-O 3.33Å; G1264-T1736 CarbonylContact O-C 3.59Å; G1264-T1736 VanDerWaalsContact O-CA 3.28Å; G1264-T1736 WeakPolarHBondContact O-CA 3.32Å; G1264-T1736 PolarHBondContact O-N 3.29Å
1737	T	32.3	Very low	32.7	Very low	117.2 Å²	117.2	133.9 Å²	133.9	72%	0.719	71%	0.709	S	S	*	*			trans	-175	150.3	161.2	44.3	0	0	0	0	117.1	G1264 L1265	G1264-T1737 CarbonylContact C-O 3.35Å; G1264-T1737 VanDerWaalsContact CA-N 3.3Å; G1264-T1737 PolarHBondContact O-N 3.02Å; L1265-T1737 WeakPolarHBondContact CD1-O 3.45Å; L1265-T1737 VanDerWaalsContact CG-O 3.28Å; L1265-T1737 WeakPolarHBondContact CG-O 3.36Å; L1265-T1737 PolarHBondContact N-O 3.36Å
1738	R	31.3	Very low	32.8	Very low	215.6 Å²	215.6	132.2 Å²	132.2	81%	0.814	71%	0.705	S	S	*	*			trans	-126.6	152.7	142.8	-164.8	174.7	176.9	-179.5	-1.5	113.5
1739	S	31.3	Very low	33	Very low	81.2 Å²	81.2	130.5 Å²	130.5	57%	0.568	70%	0.697	S	S	*	*			trans	-134.8	158.2	160.7	50.1	0	0	0	0	115.6
1740	H	33.9	Very low	32.8	Very low	158.6 Å²	158.6	134.4 Å²	134.4	73%	0.734	70%	0.699	S	S	*	*			trans	171.1	157.4	147	-82.4	-83.2	0	0	0	115
1741	C	32.1	Very low	32.8	Very low	104 Å²	104	134.6 Å²	134.6	70%	0.703	69%	0.692	S	S	*	*			trans	-178.7	157.2	177.8	-113.1	0	0	0	0	114.2
1742	C	31.2	Very low	33	Very low	105.4 Å²	105.4	140 Å²	140	71%	0.712	70%	0.7	S	S	*	*			cis	-159.8	169.4	5.3	-92.3	0	0	0	0	113.2
1743	L	32.5	Very low	33	Very low	147.4 Å²	147.4	139.1 Å²	139.1	77%	0.772	70%	0.698	S	S	*	*			trans	-130.9	153.4	156.8	-117.8	67	0	0	0	115.4
1744	T	31.8	Very low	33.1	Very low	117 Å²	117	140.5 Å²	140.5	72%	0.718	71%	0.705	S	S	*	*			trans	14.3	159.7	141.5	39.7	0	0	0	0	117.4
1745	C	31.2	Very low	33.1	Very low	113.2 Å²	113.2	138.1 Å²	138.1	77%	0.765	71%	0.707	S	S	*	*			trans	110.6	157.7	159.4	-63.2	0	0	0	0	113.8
1746	L	35.6	Very low	33.1	Very low	159 Å²	159	135.7 Å²	135.7	83%	0.832	71%	0.71	S	S	*	*			trans	168.6	135.7	135.9	-85.2	154.3	0	0	0	112.9
1747	E	34.1	Very low	33.4	Very low	154.6 Å²	154.6	136.4 Å²	136.4	72%	0.722	72%	0.716	S	S	*	*				64.7	134	124.6	-141.7	117.9	-138.7	0	0	115.1	H830 H831	H830-E1747 IonicContact CE1-OE1 2.62Å; H830-E1747 PolarHBondContact CE1-OE1 2.73Å; H830-E1747 VanDerWaalsContact CE1-OE1 3.23Å; H830-E1747 IonicContact ND1-OE1 3.69Å; H831-E1747 IonicContact CE1-OE1 3.84Å; H831-E1747 PolarHBondContact CE1-OE1 3.19Å; H831-E1747 VanDerWaalsContact CE1-OE1 3.24Å; H831-E1747 IonicContact CE1-OE2 2.73Å; H831-E1747 PolarHBondContact CE1-OE2 3Å; H831-E1747 IonicContact NE2-OE1 3.52Å; H831-E1747 IonicContact NE2-OE2 3.05Å
1748	L	36	Very low	33.3	Very low	133.8 Å²	133.8	134.5 Å²	134.5	70%	0.701	71%	0.712	S	S	*	*			trans	179.9	121.5	137.3	-124.5	91.8	0	0	0	112.4	H830 H831 R1750	H830-L1748 HydrophobicContact CB-CD1 4.46Å; H830-L1748 WeakPolarHBondContact CE1-CD1 3.42Å; H830-L1748 VanDerWaalsContact ND1-CD1 3.33Å; H830-L1748 WeakPolarHBondContact ND1-CD1 3.31Å; H830-L1748 WeakPolarHBondContact NE2-CD1 2.72Å; H831-L1748 WeakPolarHBondContact NE2-CD1 2.99Å; L1748-R1750 HydrophobicContact CD2-CB 4.47Å; L1748-R1750 HydrophobicContact CD2-CG 4.31Å
1749	E	33.3	Very low	33.5	Very low	133.2 Å²	133.2	131.2 Å²	131.2	62%	0.622	71%	0.709	S	S	*	*				155.1	127.8	86.2	-165.1	-166.4	-148.5	0	0	111.5	K1751	E1749-K1751 HydrophobicContact CG-CD 4.34Å; E1749-K1751 WeakPolarHBondContact OE1-CD 3.42Å; E1749-K1751 WeakPolarHBondContact OE1-CE 3.3Å; E1749-K1751 IonicContact OE1-NZ 3.08Å; E1749-K1751 PolarHBondContact OE1-NZ 3.21Å
1750	R	34.1	Very low	33.6	Very low	183.2 Å²	183.2	133.4 Å²	133.4	69%	0.691	72%	0.715	S	S	*	*			trans	-170.3	126.6	131.3	-89	145.5	179.2	123.2	0.2	111.5	H830 L1748	H830-R1750 VanDerWaalsContact N-NH2 3.18Å; H830-R1750 PolarHBondContact O-NH1 3.45Å; H830-R1750 VanDerWaalsContact O-NH1 3.15Å; H830-R1750 PolarHBondContact O-NH2 3.13Å; L1748-R1750 HydrophobicContact CD2-CB 4.47Å; L1748-R1750 HydrophobicContact CD2-CG 4.31Å
1751	K	34.3	Very low	33.5	Very low	148.2 Å²	148.2	131.9 Å²	131.9	64%	0.644	71%	0.712	S	S	*	*			trans	-155.7	116.4	134	-92.1	175.7	179	153.2	0	113.5	E1749	E1749-K1751 HydrophobicContact CG-CD 4.34Å; E1749-K1751 WeakPolarHBondContact OE1-CD 3.42Å; E1749-K1751 WeakPolarHBondContact OE1-CE 3.3Å; E1749-K1751 IonicContact OE1-NZ 3.08Å; E1749-K1751 PolarHBondContact OE1-NZ 3.21Å
1752	R	35.1	Very low	33.6	Very low	199 Å²	199	133.3 Å²	133.3	75%	0.751	71%	0.711	S	S	*	*			trans	-171.4	147.2	136.4	-57	151	-157.1	-168.5	1.2	111.4
1753	H	33.2	Very low	33.7	Very low	150.8 Å²	150.8	132.5 Å²	132.5	70%	0.698	71%	0.706	S	S	*	*				-158.7	136.4	75.3	-72.2	-89.3	0	0	0	113.7
1754	I	36.2	Very low	33.7	Very low	146.4 Å²	146.4	130.7 Å²	130.7	75%	0.751	70%	0.702	S	S	*	*			trans	174	129.9	138.1	-50.6	176.1	0	0	0	110
1755	S	32.4	Very low	33.7	Very low	98.4 Å²	98.4	133.4 Å²	133.4	69%	0.688	71%	0.707	S	S	*	*			cis	145.1	150.8	19.8	-21.8	0	0	0	0	112.4
1756	A	31.6	Very low	33.7	Very low	81.6 Å²	81.6	132.8 Å²	132.8	67%	0.674	70%	0.703	S	S	*	*			trans	-81	164.4	-178.4	0	0	0	0	0	113.2	I1099 L1101	I1099-A1756 HydrophobicContact CG2-CB 4.21Å; L1101-A1756 HydrophobicContact CD1-CB 3.54Å; L1101-A1756 HydrophobicContact CG-CB 3.73Å
1757	P	37.1	Very low	33.5	Very low	116 Å²	116	129.7 Å²	129.7	75%	0.753	70%	0.695	S	S	*	*				-130.5	169.9	78	33.4	-19.6	0	0	0	114.1	L1101	L1101-P1757 HydrophobicContact CB-CB 4.01Å; L1101-P1757 HydrophobicContact CD1-CB 4.19Å
1758	A	31.5	Very low	33.2	Very low	78 Å²	78	134 Å²	134	65%	0.645	71%	0.705	S	S	*	*			trans	58.4	151	130.7	0	0	0	0	0	114	H1100 L1101	H1100-A1758 VanDerWaalsContact CD2-CA 3.42Å; H1100-A1758 WeakPolarHBondContact CD2-CA 3.46Å; H1100-A1758 PolarHBondContact CE1-N 3.24Å; H1100-A1758 VanDerWaalsContact CE1-N 3.28Å; H1100-A1758 PolarHBondContact ND1-N 3.14Å; L1101-A1758 HydrophobicContact CB-CB 4.18Å; L1101-A1758 WeakPolarHBondContact O-CB 2.91Å
1759	I	35.3	Very low	33	Very low	146 Å²	146	132.8 Å²	132.8	75%	0.749	71%	0.708	S	S	*	*				-153.2	137.8	110.5	-83	166.8	0	0	0	111.6
1760	N	33.2	Very low	32.8	Very low	127.2 Å²	127.2	131.4 Å²	131.4	68%	0.68	71%	0.712	S	S	*	*			trans	37.5	148.6	154.3	-50.2	-22.6	0	0	0	120.3
1761	N	32	Very low	32.6	Very low	127.4 Å²	127.4	130.6 Å²	130.6	68%	0.681	72%	0.721	S	S	*	*				156.9	152.4	50.1	-106.2	-4.2	0	0	0	115.5
1762	I	34.2	Very low	32.4	Very low	134.4 Å²	134.4	128 Å²	128	69%	0.689	72%	0.722	S	S	*	*				110.7	140.1	105.2	-96.6	165.1	0	0	0	116
1763	S	32	Very low	32.2	Very low	86.8 Å²	86.8	126.1 Å²	126.1	61%	0.607	73%	0.725	S	S	*	*			trans	80.6	142.8	144.9	-123.1	0	0	0	0	118.9
1764	T	32.5	Very low	32.1	Very low	111 Å²	111	123.5 Å²	123.5	68%	0.681	72%	0.724	S	S	*	*				62.8	136	91.5	54.3	0	0	0	0	115.9
1765	Q	33.4	Very low	31.8	Very low	174.2 Å²	174.2	121.8 Å²	121.8	81%	0.814	73%	0.726	S	S	*	*			cis	-171.1	162.9	47.6	-114.2	161.9	-27.4	0	0	112.9
1766	S	29.8	Very low	31.7	Very low	99.8 Å²	99.8	122.1 Å²	122.1	70%	0.698	73%	0.727	S	S	*	*			trans	-80.9	151.5	149.8	71.4	0	0	0	0	114.1
1767	S	31.9	Very low	31.7	Very low	94 Å²	94	123.7 Å²	123.7	66%	0.657	73%	0.733	S	S	*	*			cis	179.8	132.3	45.3	51	0	0	0	0	113.3
1768	W	29	Very low	31.3	Very low	245.2 Å²	245.2	127.3 Å²	127.3	93%	0.929	74%	0.738	S	S	*	*			trans	63.6	148.6	155.2	-56.9	5.3	0	0	0	116.2
1769	S	30.7	Very low	31.3	Very low	108.8 Å²	108.8	128.8 Å²	128.8	76%	0.761	74%	0.744	S	S	*	*				-143.8	134.9	104.2	-49.3	0	0	0	0	111.1
1770	S	29.2	Very low	31	Very low	103 Å²	103	129.9 Å²	129.9	72%	0.72	75%	0.75	S	S	*	*				35	138.7	124.5	18.9	0	0	0	0	118.1
1771	L	30.9	Very low	30.9	Very low	166.6 Å²	166.6	129.2 Å²	129.2	87%	0.872	76%	0.755	S	S	*	*			trans	117.4	127.1	162	-66.5	172.9	0	0	0	112.4
1772	S	29	Very low	31	Very low	94 Å²	94	129.2 Å²	129.2	66%	0.657	76%	0.759	S	S	*	*			cis	139.6	142.1	43.6	67.1	0	0	0	0	111.4
1773	L	30.9	Very low	31.1	Very low	157.8 Å²	157.8	128.3 Å²	128.3	83%	0.826	76%	0.762	S	S	*	*			trans	109.3	134	138.3	-69.6	148.7	0	0	0	112.6
1774	S	30.6	Very low	31	Very low	96.4 Å²	96.4	131.2 Å²	131.2	67%	0.674	77%	0.771	S	S	*	*			cis	153.5	136.3	19.8	10.1	0	0	0	0	113
1775	S	29.9	Very low	30.9	Very low	111.4 Å²	111.4	131.1 Å²	131.1	78%	0.779	77%	0.774	S	S	*	*			trans	47.3	124.9	139.8	-35.3	0	0	0	0	119.1
1776	S	30.5	Very low	30.7	Very low	103.8 Å²	103.8	127.7 Å²	127.7	73%	0.726	77%	0.77	S	S	*	*			trans	88.8	119.3	140.2	63.5	0	0	0	0	118.1
1777	S	31.3	Very low	30.8	Very low	115 Å²	115	128.3 Å²	128.3	80%	0.804	77%	0.774	S	S	*	*			trans	-144.9	132.4	141.2	-54.3	0	0	0	0	113.7
1778	F	29.9	Very low	30.8	Very low	193.4 Å²	193.4	128 Å²	128	85%	0.848	77%	0.772	S	S	*	*			trans	-121.7	133.6	161.4	-79.7	-82.8	0	0	0	112.3
1779	S	30.6	Very low	31.1	Very low	109.6 Å²	109.6	124.3 Å²	124.3	77%	0.766	76%	0.764	S	S	*	*			trans	152.3	126.1	137.1	13.1	0	0	0	0	114.2
1780	L	29.8	Very low	31.1	Very low	167.2 Å²	167.2	126.1 Å²	126.1	88%	0.875	77%	0.765	S	S	*	*			trans	-53.5	127	159.9	-63.6	162.8	0	0	0	113.5
1781	S	30.9	Very low	31.2	Very low	113.2 Å²	113.2	126.2 Å²	126.2	79%	0.792	77%	0.766	S	S	*	*				173.5	138.8	102.1	-33.8	0	0	0	0	112.2
1782	V	33.4	Very low	31.3	Very low	126.6 Å²	126.6	123.1 Å²	123.1	77%	0.767	76%	0.759	S	S	*	*			trans	-74.6	143.6	149.6	-172.2	0	0	0	0	112.5	L1784	V1782-L1784 HydrophobicContact CG1-CD1 4.09Å
1783	P	36.8	Very low	31.6	Very low	116.4 Å²	116.4	126.3 Å²	126.3	76%	0.756	77%	0.767	S	S	*	*				-122.6	158	90.4	27	-8.9	0	0	0	112.9
1784	L	30	Very low	31.6	Very low	148.6 Å²	148.6	123.8 Å²	123.8	78%	0.778	76%	0.762	S	S	*	*				-114.7	141.3	124.9	-88.2	109	0	0	0	114.6	V1782	V1782-L1784 HydrophobicContact CG1-CD1 4.09Å
1785	S	30.2	Very low	31.9	Very low	107.2 Å²	107.2	124.8 Å²	124.8	75%	0.75	77%	0.766	S	S	*	*			trans	103.7	133	147	-52.6	0	0	0	0	116.6
1786	S	30	Very low	32	Very low	103.4 Å²	103.4	126.2 Å²	126.2	72%	0.723	77%	0.765	S	S	*	*			cis	147.8	141.4	20.1	59.3	0	0	0	0	114.2
1787	S	32	Very low	32.2	Very low	111.8 Å²	111.8	126.5 Å²	126.5	78%	0.782	76%	0.762	S	S	*	*			trans	73.4	145.9	154.6	78.7	0	0	0	0	116.6
1788	S	31.5	Very low	32.1	Very low	88 Å²	88	126.3 Å²	126.3	62%	0.615	76%	0.76	S	S	*	*			cis	-170.2	151.8	-16.2	46.8	0	0	0	0	112.3
1789	H	35.5	Very low	32.6	Very low	168.6 Å²	168.6	122.8 Å²	122.8	78%	0.781	76%	0.756	S	S	*	*			trans	81.1	123	155.1	-58.3	-52.7	0	0	0	118.1
1790	N	29.4	Very low	32.8	Very low	145.8 Å²	145.8	120.7 Å²	120.7	78%	0.78	75%	0.752	S	S	*	*				106.3	123.6	90.5	-81.2	-12.1	0	0	0	115.3
1791	S	33.1	Very low	32.9	Very low	105.8 Å²	105.8	119.6 Å²	119.6	74%	0.74	75%	0.747	S	S	*	*				176.3	132.3	126.3	19	0	0	0	0	112.3
1792	S	32.4	Very low	33	Very low	102 Å²	102	118.1 Å²	118.1	71%	0.713	74%	0.736	S	S	*	*				-164.2	148.6	58.8	55.6	0	0	0	0	111.5
1793	I	34.8	Very low	33	Very low	161 Å²	161	119.7 Å²	119.7	83%	0.826	74%	0.735	S	S	*	*			trans	157.3	129.2	141.7	-82.6	159	0	0	0	113
1794	S	31.5	Very low	32.8	Very low	104.2 Å²	104.2	119 Å²	119	73%	0.729	73%	0.733	S	S	*	*			trans	-37.1	165.4	167.8	-57.5	0	0	0	0	116.6
1795	P	36.3	Very low	32.9	Very low	117.4 Å²	117.4	119 Å²	119	76%	0.762	73%	0.729	S	S	*	*			cis	-106.8	175.1	3.5	33.9	-22.6	0	0	0	114.3
1796	L	32.7	Very low	33	Very low	141.8 Å²	141.8	121.1 Å²	121.1	74%	0.742	73%	0.731	S	S	*	*			trans	109.8	133.4	166.5	-67.7	135.3	0	0	0	114.4
1797	T	33.3	Very low	33	Very low	110.4 Å²	110.4	125.3 Å²	125.3	68%	0.677	74%	0.736	S	S	*	*			cis	-153.6	153.8	29.9	28.7	0	0	0	0	114.8
1798	C	30.9	Very low	33.4	Very low	110.8 Å²	110.8	125.1 Å²	125.1	75%	0.749	73%	0.732	S	S	*	*			trans	37.7	173.8	151.6	-52	0	0	0	0	116.7
1799	P	39.8	Very low	33.3	Very low	118.8 Å²	118.8	126.2 Å²	126.2	77%	0.771	74%	0.74	S	S	*	*			cis	-138	168.9	-28.2	40.1	-23.5	0	0	0	116.1
1800	G	34.2	Very low	33.1	Very low	65.8 Å²	65.8	122 Å²	122	68%	0.678	74%	0.735	S	S	*	*			trans	125.6	116.7	144.8	0	0	0	0	0	118.8	I1733	I1733-G1800 WeakPolarHBondContact CA-O 3.43Å; I1733-G1800 PolarHBondContact N-O 2.93Å
1801	N	32.6	Very low	33.2	Very low	144.4 Å²	144.4	122 Å²	122	77%	0.772	73%	0.734	S	S	*	*				61.7	153.3	126.9	-72.1	-3.6	0	0	0	121.1	F1732 I1733 K1734 H1735	F1732-N1801 CarbonylContact C-O 3.51Å; I1733-N1801 CarbonylContact C-O 3.42Å; I1733-N1801 WeakPolarHBondContact CA-O 3.48Å; I1733-N1801 PolarHBondContact N-O 2.89Å; I1733-N1801 CarbonylContact O-C 3.19Å; K1734-N1801 VanDerWaalsContact N-CB 3.29Å; H1735-N1801 WeakPolarHBondContact CB-ND2 3.04Å; H1735-N1801 PolarHBondContact ND1-ND2 3.3Å; H1735-N1801 VanDerWaalsContact ND1-ND2 3.17Å; H1735-N1801 PolarHBondContact ND1-OD1 3.41Å
1802	S	33.5	Very low	33.2	Very low	80.4 Å²	80.4	122.6 Å²	122.6	56%	0.562	73%	0.733	S	S	*	*			cis	-175.8	158.9	-21	54.9	0	0	0	0	114.3	I1733 K1734 H1735	I1733-S1802 PolarHBondContact O-N 2.88Å; K1734-S1802 PolarHBondContact O-OG 2.98Å; H1735-S1802 WeakPolarHBondContact CA-OG 3.3Å; H1735-S1802 PolarHBondContact N-OG 3.07Å
1803	Q	32.1	Very low	33.3	Very low	160.6 Å²	160.6	122.2 Å²	122.2	75%	0.75	73%	0.73	S	S	*	*			trans	60.9	148.7	154.5	-74.1	-177.1	-0.1	0	0	120.1	H1805 S2236	Q1803-H1805 HydrophobicContact CG-CB 4.27Å; Q1803-S2236 WeakPolarHBondContact CG-O 3.33Å; Q1803-S2236 PolarHBondContact NE2-O 3.09Å
1804	S	32.6	Very low	33.3	Very low	102.8 Å²	102.8	121.8 Å²	121.8	72%	0.719	73%	0.725	S	S	*	*			cis	-175	167.5	24.8	58.1	0	0	0	0	114.6
1805	H	32.1	Very low	33.4	Very low	147.4 Å²	147.4	124.5 Å²	124.5	68%	0.682	72%	0.723	S	S	*	*			cis	165.8	145.8	42	-132.9	-136.9	0	0	0	116.7	Q1803 S2236	Q1803-H1805 HydrophobicContact CG-CB 4.27Å; H1805-S2236 PolarHBondContact CD2-OG 2.97Å
1806	L	31.8	Very low	33.1	Very low	151 Å²	151	124.5 Å²	124.5	79%	0.791	72%	0.717	S	S	*	*			trans	80.8	157.8	147.3	-70.6	175.5	0	0	0	120.6
1807	K	31.5	Very low	33.1	Very low	192.4 Å²	192.4	125 Å²	125	84%	0.837	72%	0.715	S	S	*	*			trans	-160	161.6	-157	-117.7	-171.8	178.2	-177.8	0	112.5
1808	P	38.8	Very low	33.1	Very low	108.4 Å²	108.4	128.7 Å²	128.7	70%	0.704	72%	0.722	S	S	*	*				-121.3	-168.2	-80	39.7	-26.1	0	0	0	114
1809	S	31.2	Very low	33.2	Very low	110 Å²	110	130.1 Å²	130.1	77%	0.769	72%	0.722	S	S	*	*			trans	161.5	147.1	168.7	-62.7	0	0	0	0	115.2	K1815	S1809-K1815 CarbonylContact C-O 3.15Å
1810	A	31.4	Very low	32.8	Very low	81.8 Å²	81.8	130.1 Å²	130.1	68%	0.676	72%	0.715	S	S	*	*			cis	122.2	169.2	41.7	0	0	0	0	0	113.5	S1813 K1815 N1816	A1810-S1813 WeakPolarHBondContact CB-O 3.3Å; A1810-K1815 CarbonylContact C-O 3.3Å; A1810-K1815 WeakPolarHBondContact CA-O 3.19Å; A1810-K1815 PolarHBondContact N-O 3.03Å; A1810-K1815 CarbonylContact O-C 3.45Å; A1810-N1816 PolarHBondContact O-N 2.91Å
1811	L	31.6	Very low	32.7	Very low	144.6 Å²	144.6	135.1 Å²	135.1	76%	0.757	72%	0.718	S	S	*	*				160.4	146	125.3	-97.4	168.8	0	0	0	116	S1813 H1814	L1811-S1813 CarbonylContact C-O 3.39Å; L1811-S1813 PolarHBondContact N-O 3.33Å; L1811-S1813 CarbonylContact O-C 3.52Å; L1811-H1814 PolarHBondContact O-N 2.83Å; L1811-H1814 PolarHBondContact O-ND1 3.14Å
1812	T	33.2	Very low	32.6	Very low	118.4 Å²	118.4	132.9 Å²	132.9	73%	0.726	71%	0.714	S	S	*	*			trans	66.4	142.5	139	53.7	0	0	0	0	119.9	H1814	T1812-H1814 VanDerWaalsContact CG2-CE1 3.43Å; T1812-H1814 WeakPolarHBondContact CG2-CE1 3.42Å
1813	S	34	Very low	32.4	Very low	93.4 Å²	93.4	138.7 Å²	138.7	65%	0.653	73%	0.725	S	S	*	*			cis	146.7	152.5	17.2	-139	0	0	0	0	114.2	A1810 L1811	A1810-S1813 WeakPolarHBondContact CB-O 3.3Å; L1811-S1813 CarbonylContact C-O 3.39Å; L1811-S1813 PolarHBondContact N-O 3.33Å; L1811-S1813 CarbonylContact O-C 3.52Å
1814	H	33.9	Very low	32.2	Very low	153.4 Å²	153.4	140.3 Å²	140.3	71%	0.71	73%	0.73	S	S	*	*			cis	140.4	139.4	44.7	-93.1	-68.2	0	0	0	114.7	L1811 T1812	L1811-H1814 PolarHBondContact O-N 2.83Å; L1811-H1814 PolarHBondContact O-ND1 3.14Å; T1812-H1814 VanDerWaalsContact CG2-CE1 3.43Å; T1812-H1814 WeakPolarHBondContact CG2-CE1 3.42Å
1815	K	33.3	Very low	32	Very low	160.2 Å²	160.2	140.6 Å²	140.6	70%	0.697	73%	0.731	S	S	*	*			trans	138.6	146	160.1	-83.2	161.4	175.8	-176.7	0	112.9	S1809 A1810	S1809-K1815 CarbonylContact C-O 3.15Å; A1810-K1815 CarbonylContact C-O 3.3Å; A1810-K1815 WeakPolarHBondContact CA-O 3.19Å; A1810-K1815 PolarHBondContact N-O 3.03Å; A1810-K1815 CarbonylContact O-C 3.45Å
1816	N	30.6	Very low	31.9	Very low	118.2 Å²	118.2	141.4 Å²	141.4	63%	0.632	74%	0.739	S	S	*	*				112.2	135.5	75.1	-87	19.5	0	0	0	112.7	A1810	A1810-N1816 PolarHBondContact O-N 2.91Å
1817	E	33	Very low	32	Very low	151.6 Å²	151.6	139.1 Å²	139.1	71%	0.708	73%	0.733	S	S	*	*				-163.9	170.8	91.2	-109.3	149.6	-176.5	0	0	110.7
1818	F	32.4	Very low	31.8	Very low	187.6 Å²	187.6	137.7 Å²	137.7	82%	0.823	73%	0.73	S	S	*	*			trans	-126.4	132.7	151.1	-88.2	-92.4	0	0	0	114.7
1819	L	34.2	Very low	31.4	Very low	141.4 Å²	141.4	141.5 Å²	141.5	74%	0.74	73%	0.732	S	S	*	*			trans	-147.7	145.2	143.8	-84.4	157.1	0	0	0	113.9
1820	N	31.4	Very low	31.5	Very low	118.8 Å²	118.8	143.6 Å²	143.6	64%	0.635	73%	0.729	S	S	*	*				82	134.2	106.5	-115.2	-17	0	0	0	117	N1949	N1820-N1949 PolarHBondContact ND2-OD1 3.34Å
1821	K	32.1	Very low	31.4	Very low	170.8 Å²	170.8	144.3 Å²	144.3	74%	0.743	73%	0.729	S	S	*	*			trans	110.7	114.9	143.5	-83.9	178.7	-175	169.8	0	113.4	Y1823 N1949	K1821-Y1823 HydrophobicContact CD-CE2 4.37Å; K1821-N1949 PolarHBondContact NZ-OD1 3.17Å
1822	S	29.7	Very low	31.4	Very low	97.6 Å²	97.6	145.5 Å²	145.5	68%	0.683	73%	0.73	S	S	*	*				-168.6	139.5	114	52.4	0	0	0	0	111.8
1823	Y	29.4	Very low	31.3	Very low	202.2 Å²	202.2	147.4 Å²	147.4	79%	0.793	73%	0.73	S	S	*	*				-18.4	142.5	126.9	-76.6	-79.3	0	0	0	114.9	K1821	K1821-Y1823 HydrophobicContact CD-CE2 4.37Å
1824	F	29.1	Very low	31.2	Very low	194.4 Å²	194.4	152.8 Å²	152.8	85%	0.853	74%	0.738	S	S	*	*				-149.3	152	127.6	-88.1	-92.3	0	0	0	112.5
1825	C	28.1	Very low	31	Very low	109.2 Å²	109.2	155.6 Å²	155.6	74%	0.738	74%	0.742	S	S	*	*			trans	-151.6	154.2	148.7	-97.5	0	0	0	0	114.3
1826	L	29.6	Very low	30.9	Very low	164.4 Å²	164.4	154.6 Å²	154.6	86%	0.861	74%	0.744	S	S	*	*			trans	-40.3	152.4	154.6	-67.4	169.6	0	0	0	113.9
1827	P	33.2	Very low	30.9	Very low	102.6 Å²	102.6	155.7 Å²	155.7	67%	0.666	75%	0.745	S	S	*	*			cis	-120	169.7	11.7	39.2	-27.7	0	0	0	113.9
1828	E	28.7	Very low	30.9	Very low	163.4 Å²	163.4	155.4 Å²	155.4	76%	0.764	74%	0.743	S	S	*	*			trans	-145.4	132.3	154.7	-95.1	170.4	176	0	0	117	H1830	E1828-H1830 PolarHBondContact O-N 3.32Å; E1828-H1830 VanDerWaalsContact O-N 3.1Å; E1828-H1830 IonicContact OE2-CE1 3.72Å
1829	Y	29.7	Very low	31	Very low	187.6 Å²	187.6	153.7 Å²	153.7	74%	0.736	74%	0.738	S	S	*	*			trans	13.8	116.2	156.2	-77	-99.9	0	0	0	117.4
1830	H	32.9	Very low	30.7	Very low	153.6 Å²	153.6	155.9 Å²	155.9	71%	0.711	74%	0.737	S	S	*	*				-158.2	138	117.2	-102.1	78.6	0	0	0	115.3	E1828 H1832	E1828-H1830 PolarHBondContact O-N 3.32Å; E1828-H1830 VanDerWaalsContact O-N 3.1Å; E1828-H1830 IonicContact OE2-CE1 3.72Å; H1830-H1832 PolarHBondContact O-N 3.49Å
1831	S	29.5	Very low	30.8	Very low	97.2 Å²	97.2	157.6 Å²	157.6	68%	0.68	74%	0.741	S	S	*	*			trans	-52.7	131.2	166.6	-58.4	0	0	0	0	115.1	H1833	S1831-H1833 VanDerWaalsContact C-N 3.29Å; S1831-H1833 PolarHBondContact O-N 3.04Å
1832	H	31.6	Very low	30.8	Very low	169.8 Å²	169.8	157.4 Å²	157.4	79%	0.786	74%	0.742	S	S	*	*			trans	-104.8	117.5	139.1	-83.4	-79.3	0	0	0	112.6	H1830 Y1834	H1830-H1832 PolarHBondContact O-N 3.49Å; H1832-Y1834 PolarHBondContact O-N 3.17Å
1833	H	31.5	Very low	30.9	Very low	157.6 Å²	157.6	160.3 Å²	160.3	73%	0.73	75%	0.75	S	S	*	*			trans	-62.7	138.9	159	-91.6	-87.5	0	0	0	112	S1831 R1835	S1831-H1833 VanDerWaalsContact C-N 3.29Å; S1831-H1833 PolarHBondContact O-N 3.04Å; H1833-R1835 VanDerWaalsContact C-N 3.27Å; H1833-R1835 PolarHBondContact O-N 3.47Å
1834	Y	30.6	Very low	31	Very low	206.2 Å²	206.2	161.5 Å²	161.5	81%	0.809	75%	0.753	S	S	*	*				-118.6	124.9	110.2	-97.7	-81	0	0	0	110.5	H1832 L1836	H1832-Y1834 PolarHBondContact O-N 3.17Å; Y1834-L1836 HydrophobicContact CD1-CD1 4.19Å; Y1834-L1836 HydrophobicContact CE1-CD1 4.3Å; Y1834-L1836 PolarHBondContact O-N 3.32Å
1835	R	29.7	Very low	31.1	Very low	212.4 Å²	212.4	155.3 Å²	155.3	80%	0.802	74%	0.743	S	S	*	*			trans	-68.9	96.3	141.2	-156.9	-173.8	-173.1	169.5	3.5	111.2	H1833 H1837	H1833-R1835 VanDerWaalsContact C-N 3.27Å; H1833-R1835 PolarHBondContact O-N 3.47Å; R1835-H1837 PolarHBondContact O-N 3.16Å; R1835-H1837 VanDerWaalsContact O-N 3.11Å
1836	L	32.1	Very low	31.3	Very low	140.4 Å²	140.4	157.8 Å²	157.8	74%	0.735	74%	0.744	S	S	*	*			trans	-101.6	131.8	146.2	-104.6	85.7	0	0	0	111.1	Y1834 H1838	Y1834-L1836 HydrophobicContact CD1-CD1 4.19Å; Y1834-L1836 HydrophobicContact CE1-CD1 4.3Å; Y1834-L1836 PolarHBondContact O-N 3.32Å; L1836-H1838 PolarHBondContact O-N 3.25Å
1837	H	31.3	Very low	31.3	Very low	140.4 Å²	140.4	159.9 Å²	159.9	65%	0.65	74%	0.742	S	S	*	*				-47.1	126.8	128.3	-116.5	-109.6	0	0	0	112.8	R1835 H1839	R1835-H1837 PolarHBondContact O-N 3.16Å; R1835-H1837 VanDerWaalsContact O-N 3.11Å; H1837-H1839 PolarHBondContact O-N 3.01Å
1838	H	32.1	Very low	31.2	Very low	146 Å²	146	160.5 Å²	160.5	68%	0.676	75%	0.747	S	S	*	*			trans	-114.6	132.6	138.2	-93.3	-86.5	0	0	0	112.6	L1836	L1836-H1838 PolarHBondContact O-N 3.25Å
1839	H	33.7	Very low	31.3	Very low	152 Å²	152	162.4 Å²	162.4	70%	0.704	75%	0.753	S	S	*	*			trans	-115.1	134.5	162.9	-96.4	-70.4	0	0	0	111.2	Q1040 H1837 H1841	Q1040-H1839 PolarHBondContact NE2-O 3.14Å; Q1040-H1839 PolarHBondContact OE1-O 3.4Å; H1837-H1839 PolarHBondContact O-N 3.01Å; H1839-H1841 AromaticContact ND1-CD2 3.85Å
1840	Y	29.7	Very low	31.3	Very low	187 Å²	187	156.7 Å²	156.7	73%	0.733	75%	0.752	S	S	*	*				-102.2	145.8	129.2	-101.9	-99.4	0	0	0	108.5	Q1040	Q1040-Y1840 HydrophobicContact CB-CD2 3.5Å; Q1040-Y1840 VanDerWaalsContact CB-CD2 3.5Å; Q1040-Y1840 HydrophobicContact CB-CE2 3.72Å; Q1040-Y1840 HydrophobicContact CB-CG 4.05Å; Q1040-Y1840 HydrophobicContact CG-CD2 3.57Å; Q1040-Y1840 HydrophobicContact CG-CE2 3.74Å
1841	H	33.1	Very low	31.2	Very low	154.4 Å²	154.4	155.8 Å²	155.8	72%	0.715	76%	0.757	S	S	*	*			trans	-132.6	131.8	167.8	-135.9	-88.8	0	0	0	112.3	H1839 L1843	H1839-H1841 AromaticContact ND1-CD2 3.85Å; H1841-L1843 PolarHBondContact O-N 2.88Å
1842	H	30.9	Very low	31.3	Very low	166.4 Å²	166.4	156.3 Å²	156.3	77%	0.77	76%	0.76	S	S	*	*			trans	-50.6	134.4	159.7	-103.6	-77.2	0	0	0	112.8
1843	L	32.4	Very low	31.4	Very low	159 Å²	159	153.5 Å²	153.5	83%	0.832	76%	0.76	S	S	*	*			trans	-135.4	113	151.8	-101.5	149.3	0	0	0	112.2	H1841 G1845	H1841-L1843 PolarHBondContact O-N 2.88Å; L1843-G1845 PolarHBondContact O-N 3.28Å
1844	R	31.4	Very low	31.6	Very low	227.4 Å²	227.4	152.1 Å²	152.1	86%	0.858	77%	0.768	S	S	*	*			trans	-126.2	104.8	155.2	-157.4	-177.1	-174.5	-166.7	1.6	108.4
1845	G	31.4	Very low	31.7	Very low	63.8 Å²	63.8	145.4 Å²	145.4	66%	0.658	76%	0.761	S	S	*	*			trans	-86.3	143.9	178.7	0	0	0	0	0	113	L1843	L1843-G1845 PolarHBondContact O-N 3.28Å
1846	H	33	Very low	31.9	Very low	161.6 Å²	161.6	141.8 Å²	141.8	75%	0.748	76%	0.763	S	S	*	*			trans	-117.5	124.7	160.9	-87.3	-86.3	0	0	0	111.8
1847	Y	29.9	Very low	32.1	Very low	209 Å²	209	141.7 Å²	141.7	82%	0.82	77%	0.768	S	S	*	*			trans	-129.7	147	150.6	-76.2	-94.7	0	0	0	113.6
1848	C	29.7	Very low	32.2	Very low	115.4 Å²	115.4	137.7 Å²	137.7	78%	0.78	77%	0.765	S	S	*	*				-146.9	155.8	89.6	-85.6	0	0	0	0	116.4	G1850	C1848-G1850 PolarHBondContact O-N 3.25Å
1849	K	31.1	Very low	32.4	Very low	202.4 Å²	202.4	138 Å²	138	88%	0.88	77%	0.771	S	S	*	*			trans	-12.2	135.1	159.5	-69.2	173	178.4	177.5	0	114
1850	G	30.3	Very low	32.3	Very low	68.8 Å²	68.8	138.8 Å²	138.8	71%	0.709	78%	0.775	S	S	*	*				-179.3	133.4	124.6	0	0	0	0	0	110.8	C1848	C1848-G1850 PolarHBondContact O-N 3.25Å
1851	T	30.9	Very low	32.9	Very low	135.2 Å²	135.2	135.1 Å²	135.1	83%	0.829	77%	0.774	S	S	*	*			trans	-156.4	134.2	139.1	50.9	0	0	0	0	113.1
1852	S	31.5	Very low	33	Very low	106.8 Å²	106.8	132.1 Å²	132.1	75%	0.747	77%	0.771	S	S	*	*			trans	-165.3	155.2	142.5	48.6	0	0	0	0	114.6
1853	S	33.5	Very low	33.3	Very low	111.2 Å²	111.2	128.7 Å²	128.7	78%	0.778	77%	0.765	S	S	*	*				138.6	144.2	95.9	56.7	0	0	0	0	114.8
1854	S	34.7	Very low	33.4	Very low	129 Å²	129	127.9 Å²	127.9	90%	0.902	76%	0.762	S	S	*	*			trans	100.9	139.2	153.3	-177.6	0	0	0	0	115.3
1855	G	33	Very low	33.6	Very low	64.2 Å²	64.2	123.3 Å²	123.3	66%	0.662	76%	0.759	S	S	*	*			trans	158	124.9	175.5	0	0	0	0	0	110.4
1856	V	34.2	Very low	33.8	Very low	138.4 Å²	138.4	126.1 Å²	126.1	84%	0.839	76%	0.763	S	S	*	*				88.6	124.6	51.4	-177.6	0	0	0	0	111.4
1857	V	35.6	Very low	33.7	Very low	137.6 Å²	137.6	122.2 Å²	122.2	83%	0.834	76%	0.758	S	S	*	*			trans	78.6	136.7	142.7	179.8	0	0	0	0	113.6
1858	G	34.5	Very low	33.9	Very low	56.4 Å²	56.4	119.8 Å²	119.8	58%	0.581	75%	0.754	S	S	*	*				156	145.9	64	0	0	0	0	0	112.2
1859	D	36.1	Very low	34	Very low	151.2 Å²	151.2	121.4 Å²	121.4	81%	0.809	76%	0.755	S	S	*	*				-143.1	157.3	93.5	-67.5	-45.1	0	0	0	115
1860	Q	31.8	Very low	34.1	Very low	170.2 Å²	170.2	118.3 Å²	118.3	80%	0.795	75%	0.747	S	S	*	*			trans	-121	153.6	134.5	-123.1	-162	-2.4	0	0	113.8	S1862	Q1860-S1862 PolarHBondContact OE1-OG 2.88Å
1861	P	42.3	Very low	34.2	Very low	108.2 Å²	108.2	122.1 Å²	122.1	70%	0.703	75%	0.748	S	S	*	*			cis	-129.1	-176.7	-26.4	31	-11.1	0	0	0	113.4
1862	S	33.9	Very low	34.2	Very low	92.8 Å²	92.8	122.7 Å²	122.7	65%	0.649	74%	0.742	S	S	*	*			trans	69.5	133.9	145.4	52.3	0	0	0	0	115.1	Q1860	Q1860-S1862 PolarHBondContact OE1-OG 2.88Å
1863	S	37.2	Very low	34.2	Very low	93.4 Å²	93.4	121.6 Å²	121.6	65%	0.653	73%	0.734	S	S	*	*				52	148	64.2	73	0	0	0	0	115.8
1864	D	34.6	Very low	34.2	Very low	143.8 Å²	143.8	124 Å²	124	77%	0.769	73%	0.733	S	S	*	*			trans	74.6	144.5	143.3	-61	-29	0	0	0	117.2
1865	V	37.5	Very low	34.4	Very low	130.6 Å²	130.6	124.6 Å²	124.6	79%	0.792	72%	0.724	S	S	*	*			trans	96.3	108.1	167.8	175.4	0	0	0	0	112.6	A1867	V1865-A1867 PolarHBondContact O-N 3.41Å
1866	V	33.8	Very low	34.5	Very low	122.2 Å²	122.2	127.2 Å²	127.2	74%	0.741	73%	0.727	S	S	*	*				61.2	122.3	115.3	173.7	0	0	0	0	114.4
1867	A	31.6	Very low	34.5	Very low	79.2 Å²	79.2	126.4 Å²	126.4	66%	0.655	72%	0.718	S	S	*	*			trans	72.6	147.7	147.8	0	0	0	0	0	118.3	V1865	V1865-A1867 PolarHBondContact O-N 3.41Å
1868	E	33.6	Very low	34.8	Very low	157.8 Å²	157.8	124.4 Å²	124.4	74%	0.737	71%	0.708	S	S	*	*			trans	59	126.8	145	-108.2	178.9	160	0	0	114.3	L1870	E1868-L1870 HydrophobicContact CG-CD1 4.07Å
1869	L	33.4	Very low	34.9	Very low	151 Å²	151	129.1 Å²	129.1	79%	0.791	72%	0.72	S	S	*	*			trans	179.1	130.9	140	-76.5	137	0	0	0	113.4	M1871	L1869-M1871 PolarHBondContact O-N 3.35Å
1870	L	32.4	Very low	34.7	Very low	136.8 Å²	136.8	125.2 Å²	125.2	72%	0.716	72%	0.715	S	S	*	*				61.1	106.8	69.6	-86.1	168.5	0	0	0	115.5	E1868	E1868-L1870 HydrophobicContact CG-CD1 4.07Å
1871	M	31.5	Very low	34.8	Very low	148.6 Å²	148.6	124.8 Å²	124.8	73%	0.732	72%	0.718	S	S	*	*			trans	122.7	147.2	135.1	-80.3	175.6	-65.5	0	0	114.9	L1869	L1869-M1871 PolarHBondContact O-N 3.35Å
1872	Q	32	Very low	34.4	Very low	147.4 Å²	147.4	124.7 Å²	124.7	69%	0.689	72%	0.72	S	S	*	*			trans	73	131.2	141	-100.7	63.2	49.3	0	0	117.3	D1877	Q1872-D1877 WeakPolarHBondContact CB-OD2 3.24Å; Q1872-D1877 HydrophobicContact CG-CB 4.18Å; Q1872-D1877 VanDerWaalsContact CG-OD1 3.27Å; Q1872-D1877 WeakPolarHBondContact CG-OD1 3.46Å; Q1872-D1877 VanDerWaalsContact CG-OD2 3.24Å; Q1872-D1877 WeakPolarHBondContact CG-OD2 3.22Å
1873	S	30.6	Very low	34.3	Very low	84.4 Å²	84.4	125.4 Å²	125.4	59%	0.59	73%	0.725	S	S	*	*				73.8	138.3	96.8	59.3	0	0	0	0	115.2	D1877	S1873-D1877 VanDerWaalsContact O-OD1 3.05Å; S1873-D1877 PolarHBondContact OG-OD1 3.4Å
1874	H	34.5	Very low	34.1	Very low	161.6 Å²	161.6	128.1 Å²	128.1	75%	0.748	73%	0.731	S	S	*	*				93.1	146.4	88.7	-78.6	-71.6	0	0	0	113.5
1875	I	37.3	Very low	34	Very low	140.4 Å²	140.4	126.8 Å²	126.8	72%	0.72	73%	0.728	S	S	*	*				70.2	112	77.7	-74.7	160.9	0	0	0	111.2	D1877	I1875-D1877 VanDerWaalsContact O-CA 3.23Å; I1875-D1877 WeakPolarHBondContact O-CA 3.27Å; I1875-D1877 PolarHBondContact O-N 3.2Å
1876	T	36.4	Very low	33.7	Very low	118.8 Å²	118.8	125.9 Å²	125.9	73%	0.729	73%	0.727	S	S	*	*				50.9	134.8	106.6	27.4	0	0	0	0	115
1877	D	34.1	Very low	33.6	Very low	122.2 Å²	122.2	127.3 Å²	127.3	65%	0.653	73%	0.73	S	S	*	*				-112.4	179.7	82.9	-76.7	-57.5	0	0	0	110.2	Q1872 S1873 I1875	Q1872-D1877 WeakPolarHBondContact CB-OD2 3.24Å; Q1872-D1877 HydrophobicContact CG-CB 4.18Å; Q1872-D1877 VanDerWaalsContact CG-OD1 3.27Å; Q1872-D1877 WeakPolarHBondContact CG-OD1 3.46Å; Q1872-D1877 VanDerWaalsContact CG-OD2 3.24Å; Q1872-D1877 WeakPolarHBondContact CG-OD2 3.22Å; S1873-D1877 VanDerWaalsContact O-OD1 3.05Å; S1873-D1877 PolarHBondContact OG-OD1 3.4Å; I1875-D1877 VanDerWaalsContact O-CA 3.23Å; I1875-D1877 WeakPolarHBondContact O-CA 3.27Å; I1875-D1877 PolarHBondContact O-N 3.2Å
1878	P	41.8	Very low	33.7	Very low	95.2 Å²	95.2	130.5 Å²	130.5	62%	0.618	73%	0.733	S	S	*	*			cis	-131.4	-168	0.7	39.2	-20.9	0	0	0	115	G1880	P1878-G1880 PolarHBondContact O-N 3.22Å
1879	D	36.4	Very low	33.8	Very low	155.4 Å²	155.4	130.2 Å²	130.2	83%	0.831	73%	0.731	S	S	*	*			trans	65.9	128.4	136.8	-68	-35.5	0	0	0	119.7	L1881	D1879-L1881 PolarHBondContact O-N 2.83Å
1880	G	33	Very low	33.7	Very low	68.6 Å²	68.6	129.3 Å²	129.3	71%	0.707	73%	0.728	S	S	*	*			trans	118.8	125.2	146.6	0	0	0	0	0	115.2	P1878	P1878-G1880 PolarHBondContact O-N 3.22Å
1881	L	33.5	Very low	33.8	Very low	161.6 Å²	161.6	127.9 Å²	127.9	85%	0.846	73%	0.729	S	S	*	*				95.9	127.3	73.4	-68.4	175.2	0	0	0	113.5	D1879	D1879-L1881 PolarHBondContact O-N 2.83Å
1882	S	34	Very low	33.8	Very low	106.4 Å²	106.4	126.7 Å²	126.7	74%	0.744	73%	0.734	S	S	*	*				136.3	123.2	116.5	-76.4	0	0	0	0	114	L1884	S1882-L1884 WeakPolarHBondContact CB-O 3.19Å
1883	S	31	Very low	34.1	Very low	107.8 Å²	107.8	124.7 Å²	124.7	75%	0.754	73%	0.734	S	S	*	*				-34	145.9	116.6	-100.6	0	0	0	0	112.3
1884	L	33.9	Very low	34.3	Very low	150 Å²	150	127 Å²	127	79%	0.785	74%	0.744	S	S	*	*			trans	160.6	124.7	155.3	-77.3	170.8	0	0	0	112.5	S1882 C1886	S1882-L1884 WeakPolarHBondContact CB-O 3.19Å; L1884-C1886 HydrophobicContact CB-CB 4.09Å; L1884-C1886 HydrophobicContact CD1-CB 4.47Å
1885	T	31	Very low	34.3	Very low	116.6 Å²	116.6	124.7 Å²	124.7	72%	0.715	74%	0.742	S	S	*	*				50.1	122.3	115.6	65.1	0	0	0	0	118.3
1886	C	32.1	Very low	34.3	Very low	112 Å²	112	123.8 Å²	123.8	76%	0.757	75%	0.745	S	S	*	*			trans	68.4	131.7	148.8	-62	0	0	0	0	117	L1884	L1884-C1886 HydrophobicContact CB-CB 4.09Å; L1884-C1886 HydrophobicContact CD1-CB 4.47Å
1887	D	32.1	Very low	34.1	Very low	150.8 Å²	150.8	126.1 Å²	126.1	81%	0.806	75%	0.747	S	S	*	*			trans	-138.2	142.1	153.4	-87.2	-38.2	0	0	0	112.3	H1889	D1887-H1889 PolarHBondContact O-N 3.03Å
1888	M	33.2	Very low	34.1	Very low	147.4 Å²	147.4	127.4 Å²	127.4	73%	0.726	75%	0.754	S	S	*	*			trans	-153.9	106.1	153.4	-108.1	-130.4	79.1	0	0	112.4
1889	H	35.2	Very low	33.7	Very low	151.2 Å²	151.2	127 Å²	127	70%	0.7	75%	0.753	S	S	*	*			trans	61.9	125.4	153	-79.3	-58.5	0	0	0	117.1	D1887 S1891	D1887-H1889 PolarHBondContact O-N 3.03Å; H1889-S1891 VanDerWaalsContact C-N 3.28Å; H1889-S1891 PolarHBondContact O-N 3.48Å
1890	N	32.4	Very low	33.5	Very low	132.8 Å²	132.8	126.7 Å²	126.7	71%	0.71	75%	0.751	S	S	*	*				173.1	133.2	103.6	-86.6	-15.4	0	0	0	115
1891	S	33.5	Very low	33.6	Very low	107.4 Å²	107.4	129.3 Å²	129.3	75%	0.751	75%	0.753	S	S	*	*			trans	101.8	117.6	138.8	-65.9	0	0	0	0	116.5	H1889	H1889-S1891 VanDerWaalsContact C-N 3.28Å; H1889-S1891 PolarHBondContact O-N 3.48Å
1892	C	32.3	Very low	33.7	Very low	122.6 Å²	122.6	127.1 Å²	127.1	83%	0.828	75%	0.749	S	S	*	*			trans	-44.1	151.8	144.5	-107.8	0	0	0	0	113.4	T1894	C1892-T1894 PolarHBondContact SG-N 3.28Å
1893	P	37.8	Very low	33.6	Very low	106 Å²	106	129.6 Å²	129.6	69%	0.688	75%	0.752	S	S	*	*			trans	-123.5	158.9	161.7	38.6	-28.1	0	0	0	114.5
1894	T	34.1	Very low	33.9	Very low	131.4 Å²	131.4	129.9 Å²	129.9	81%	0.806	75%	0.751	S	S	*	*			trans	50	144.4	157.4	43.9	0	0	0	0	117.1	C1892	C1892-T1894 PolarHBondContact SG-N 3.28Å
1895	T	35.3	Very low	33.9	Very low	114.6 Å²	114.6	128.1 Å²	128.1	70%	0.703	75%	0.751	S	S	*	*			trans	-84.3	163.8	165.4	41.9	0	0	0	0	113.1
1896	P	38	Very low	34.4	Very low	121 Å²	121	128.5 Å²	128.5	79%	0.786	76%	0.756	S	S	*	*				-111.2	141	128.7	27.9	-20.1	0	0	0	112.6
1897	E	32.1	Very low	34.5	Very low	166.4 Å²	166.4	127.2 Å²	127.2	78%	0.778	75%	0.753	S	S	*	*			trans	-44.9	131.8	142.8	-70.4	-137.3	114.8	0	0	114
1898	L	34.1	Very low	34.5	Very low	150.2 Å²	150.2	127.6 Å²	127.6	79%	0.786	75%	0.754	S	S	*	*				-174.6	134.7	125	-82	175.6	0	0	0	112
1899	S	32.4	Very low	34.6	Very low	86 Å²	86	125.2 Å²	125.2	60%	0.601	76%	0.758	S	S	*	*				147.8	143	65.3	58.7	0	0	0	0	115.5
1900	L	31.8	Very low	34.5	Very low	150 Å²	150	125.8 Å²	125.8	79%	0.785	76%	0.761	S	S	*	*			trans	61.3	115.3	142.4	-57.7	170.9	0	0	0	120.4
1901	T	34.9	Very low	34.9	Very low	123.8 Å²	123.8	125.2 Å²	125.2	76%	0.76	76%	0.764	S	S	*	*				108.1	155.2	113.4	45.9	0	0	0	0	116.5
1902	P	36	Very low	35	Very low	115.4 Å²	115.4	124.5 Å²	124.5	75%	0.749	77%	0.765	S	S	*	*			trans	-115.2	149	-153.5	38.5	-28.4	0	0	0	115.5
1903	I	33.3	Very low	35.3	Very low	157.4 Å²	157.4	124 Å²	124	81%	0.807	76%	0.76	S	S	*	*			trans	177.2	151.6	165.7	-51.8	175.7	0	0	0	110.9
1904	P	37.3	Very low	35.1	Very low	115.2 Å²	115.2	126.7 Å²	126.7	75%	0.748	77%	0.768	S	S	*	*				-110.9	172.8	-97.2	33.8	-21.8	0	0	0	115.7
1905	S	33.4	Very low	35.3	Very low	111.6 Å²	111.6	125.7 Å²	125.7	78%	0.78	76%	0.764	S	S	*	*			trans	-56.3	151.6	167.3	-48.5	0	0	0	0	115.7	A1907	S1905-A1907 PolarHBondContact O-N 3.23Å
1906	P	41.7	Very low	35.2	Very low	126 Å²	126	125.1 Å²	125.1	82%	0.818	77%	0.765	S	S	*	*			trans	-108.7	145.5	139.4	29.2	-21.1	0	0	0	111.7
1907	A	32.9	Very low	35	Very low	85 Å²	85	127.7 Å²	127.7	70%	0.702	77%	0.766	S	S	*	*				174.6	140.8	125.5	0	0	0	0	0	112.7	S1905	S1905-A1907 PolarHBondContact O-N 3.23Å
1908	L	32.6	Very low	35.1	Very low	158 Å²	158	126.5 Å²	126.5	83%	0.827	76%	0.76	S	S	*	*			trans	74.1	136.8	174.4	-83.4	81.3	0	0	0	116
1909	A	35.4	Very low	35	Very low	96.6 Å²	96.6	126.6 Å²	126.6	80%	0.798	76%	0.757	S	S	*	*				-144.8	141	96.2	0	0	0	0	0	111.5
1910	Q	33.9	Very low	35	Very low	164 Å²	164	128.3 Å²	128.3	77%	0.766	76%	0.764	S	S	*	*			trans	-144.4	153	131.9	-77.1	-171.8	-43.1	0	0	112.2
1911	P	39.7	Very low	34.8	Very low	120 Å²	120	126 Å²	126	78%	0.779	76%	0.76	S	S	*	*			trans	-112.2	165.9	-154.3	22.6	-6.8	0	0	0	113.9
1912	A	35.9	Very low	34.6	Very low	93.2 Å²	93.2	127.4 Å²	127.4	77%	0.77	76%	0.762	S	S	*	*			trans	-54.1	155.8	171.7	0	0	0	0	0	116.7
1913	P	37.8	Very low	34.3	Very low	112.2 Å²	112.2	129.1 Å²	129.1	73%	0.729	76%	0.764	S	S	*	*			trans	-111.8	153.4	-156.7	37.9	-27.6	0	0	0	114.6
1914	L	35.1	Very low	34.2	Very low	162.4 Å²	162.4	127.9 Å²	127.9	85%	0.85	76%	0.764	S	S	*	*			trans	151.1	163.3	168.4	-76.4	158.2	0	0	0	113.4
1915	P	37.5	Very low	33.8	Very low	110.6 Å²	110.6	126.5 Å²	126.5	72%	0.718	76%	0.762	S	S	*	*			cis	-123	163.9	-11.3	35.7	-23.2	0	0	0	115.2
1916	S	33	Very low	33.6	Very low	102.2 Å²	102.2	132.4 Å²	132.4	72%	0.715	77%	0.767	S	S	*	*			trans	36.2	136.1	143.9	53	0	0	0	0	116.9
1917	Q	35.1	Very low	33	Very low	175.2 Å²	175.2	131.2 Å²	131.2	82%	0.819	76%	0.762	S	S	*	*				-163.3	153.8	97	-81.3	-172.1	1.2	0	0	113.1
1918	H	32.4	Very low	32.9	Very low	141.4 Å²	141.4	133.2 Å²	133.2	66%	0.655	77%	0.765	S	S	*	*			trans	-178.5	149.5	133.6	-107	-75.9	0	0	0	115.9
1919	Q	32.7	Very low	32.9	Very low	152.2 Å²	152.2	131.3 Å²	131.3	71%	0.711	76%	0.76	S	S	*	*				72.6	137.6	128.1	-85.2	169.1	9.8	0	0	118.7
1920	T	32	Very low	32.7	Very low	121.6 Å²	121.6	134.8 Å²	134.8	75%	0.746	76%	0.76	S	S	*	*				101.5	143.5	114.5	53.9	0	0	0	0	115.5
1921	S	29	Very low	32.6	Very low	103 Å²	103	133 Å²	133	72%	0.72	76%	0.76	S	S	*	*				-168.5	147.1	72.8	-92.6	0	0	0	0	115.7
1922	L	30.1	Very low	32.3	Very low	151.6 Å²	151.6	132.9 Å²	132.9	79%	0.794	76%	0.757	S	S	*	*			trans	60.5	122.1	150	-67.7	168.8	0	0	0	118.5
1923	L	29.2	Very low	32.1	Very low	152 Å²	152	134 Å²	134	80%	0.796	75%	0.75	S	S	*	*				90	145.8	99.6	-106.4	98.7	0	0	0	116.4
1924	V	30.9	Very low	31.9	Very low	132 Å²	132	136.1 Å²	136.1	80%	0.8	75%	0.75	S	S	*	*			trans	80.5	123.7	134.9	173.6	0	0	0	0	119
1925	A	30	Very low	31.7	Very low	85.4 Å²	85.4	133.1 Å²	133.1	71%	0.706	74%	0.743	S	S	*	*			trans	110.7	133.7	143.2	0	0	0	0	0	118.6
1926	R	28.8	Very low	31.3	Very low	235.6 Å²	235.6	136.7 Å²	136.7	89%	0.889	75%	0.748	S	S	*	*			trans	99	146.3	131.1	-84.4	178	165.4	169	-5.6	118.1
1927	S	29.7	Very low	31.1	Very low	102 Å²	102	136.3 Å²	136.3	71%	0.713	75%	0.745	S	S	*	*			trans	70.3	126.5	148.8	57.3	0	0	0	0	118.7
1928	T	30.9	Very low	31	Very low	125 Å²	125	133.9 Å²	133.9	77%	0.767	74%	0.737	S	S	*	*			cis	123.9	156.2	47.6	45.8	0	0	0	0	113.6
1929	V	32.5	Very low	30.9	Very low	119.8 Å²	119.8	133.7 Å²	133.7	73%	0.726	74%	0.739	S	S	*	*			trans	75.2	112.4	147.7	-170.9	0	0	0	0	115.7
1930	E	31.3	Very low	30.8	Very low	169 Å²	169	133.9 Å²	133.9	79%	0.79	74%	0.74	S	S	*	*				30.1	158.7	89.5	-71.7	171.5	174.4	0	0	116.3
1931	T	30.7	Very low	31	Very low	126 Å²	126	135 Å²	135	77%	0.773	74%	0.742	S	S	*	*			cis	165	138.9	42.3	43.2	0	0	0	0	115.6
1932	V	33	Very low	31.1	Very low	117.8 Å²	117.8	137.8 Å²	137.8	71%	0.714	74%	0.743	S	S	*	*			trans	59.4	116.9	143	177.4	0	0	0	0	115.4	Q1934	V1932-Q1934 HydrophobicContact CG1-CB 3.78Å; V1932-Q1934 VanDerWaalsContact CG1-CD 3.4Å; V1932-Q1934 HydrophobicContact CG1-CG 3.41Å; V1932-Q1934 VanDerWaalsContact CG1-CG 3.41Å; V1932-Q1934 PolarHBondContact O-N 3.4Å
1933	D	32.8	Very low	31.1	Very low	117.6 Å²	117.6	135.6 Å²	135.6	63%	0.629	74%	0.739	S	S	*	*				-113.5	153.6	120.3	-109.8	-2	0	0	0	117.2	I1612 S1613 S1935 R1946	I1612-D1933 WeakPolarHBondContact CB-OD1 3.48Å; I1612-D1933 VanDerWaalsContact CG2-CG 3.49Å; I1612-D1933 WeakPolarHBondContact CG2-OD1 3.38Å; I1612-D1933 VanDerWaalsContact CG2-OD2 3.23Å; I1612-D1933 WeakPolarHBondContact CG2-OD2 3.23Å; S1613-D1933 VanDerWaalsContact CB-OD1 3.25Å; S1613-D1933 WeakPolarHBondContact CB-OD1 3.46Å; S1613-D1933 WeakPolarHBondContact OG-CA 3.46Å; S1613-D1933 PolarHBondContact OG-OD1 3.08Å; D1933-S1935 PolarHBondContact OD2-N 2.83Å; D1933-R1946 VanDerWaalsContact CG-NH2 3.25Å; D1933-R1946 IonicContact OD1-CZ 3.18Å; D1933-R1946 IonicContact OD1-NH1 2.66Å; D1933-R1946 PolarHBondContact OD1-NH1 3.41Å; D1933-R1946 IonicContact OD1-NH2 2.87Å; D1933-R1946 PolarHBondContact OD1-NH2 3.2Å; D1933-R1946 IonicContact OD2-CZ 3.87Å; D1933-R1946 IonicContact OD2-NH2 2.83Å; D1933-R1946 PolarHBondContact OD2-NH2 2.78Å
1934	Q	33.1	Very low	31.1	Very low	154.8 Å²	154.8	134.5 Å²	134.5	72%	0.723	73%	0.734	S	S	*	*				-152.3	127.6	122.7	-112.7	173	28.9	0	0	114.2	S1613 V1932 F1936 I1948	S1613-Q1934 PolarHBondContact OG-N 2.87Å; V1932-Q1934 HydrophobicContact CG1-CB 3.78Å; V1932-Q1934 VanDerWaalsContact CG1-CD 3.4Å; V1932-Q1934 HydrophobicContact CG1-CG 3.41Å; V1932-Q1934 VanDerWaalsContact CG1-CG 3.41Å; V1932-Q1934 PolarHBondContact O-N 3.4Å; Q1934-F1936 PolarHBondContact O-N 2.86Å; Q1934-I1948 VanDerWaalsContact C-CD1 3.42Å
1935	S	30.3	Very low	31.1	Very low	100.8 Å²	100.8	138.1 Å²	138.1	71%	0.705	73%	0.734	S	S	*	*			trans	-89.1	139.8	174.6	42.4	0	0	0	0	113.9	D1933 I1948	D1933-S1935 PolarHBondContact OD2-N 2.83Å; S1935-I1948 VanDerWaalsContact O-CG1 3.31Å; S1935-I1948 WeakPolarHBondContact O-CG1 3.2Å
1936	F	29.5	Very low	31.2	Very low	186.4 Å²	186.4	143.2 Å²	143.2	82%	0.818	74%	0.736	S	S	*	*			trans	-104.9	124.8	137.8	-89.3	-88	0	0	0	112.6	Q1934 R1946	Q1934-F1936 PolarHBondContact O-N 2.86Å; F1936-R1946 WeakPolarHBondContact O-CG 3.49Å; F1936-R1946 PolarHBondContact O-NE 2.95Å; F1936-R1946 PolarHBondContact O-NH2 3.26Å
1937	S	28.5	Very low	31.4	Very low	92.8 Å²	92.8	137.4 Å²	137.4	65%	0.649	73%	0.728	S	S	*	*			trans	-144.8	135.1	144.9	51.8	0	0	0	0	110.9	R1946	S1937-R1946 WeakPolarHBondContact OG-CD 3.46Å; S1937-R1946 PolarHBondContact OG-NE 2.95Å
1938	I	32.7	Very low	31.6	Very low	126 Å²	126	138.7 Å²	138.7	65%	0.646	73%	0.726	S	S	*	*				-132.1	142.2	117.7	-74.9	171.4	0	0	0	107.8	E1940 C1943 L1944	I1938-E1940 HydrophobicContact CG2-CG 3.7Å; I1938-C1943 WeakPolarHBondContact CD1-O 3.23Å; I1938-L1944 CarbonylContact C-O 3.06Å; I1938-L1944 VanDerWaalsContact CA-O 3.31Å; I1938-L1944 WeakPolarHBondContact CA-O 3.31Å; I1938-L1944 VanDerWaalsContact CB-O 3.3Å; I1938-L1944 WeakPolarHBondContact CB-O 3.32Å; I1938-L1944 HydrophobicContact CD1-CB 3.98Å; I1938-L1944 HydrophobicContact CD1-CD1 4.49Å; I1938-L1944 HydrophobicContact CG1-CB 4.01Å; I1938-L1944 VanDerWaalsContact CG1-O 3.28Å; I1938-L1944 WeakPolarHBondContact CG1-O 3.47Å; I1938-L1944 PolarHBondContact N-O 3.41Å
1939	L	30.4	Very low	31.6	Very low	135.6 Å²	135.6	139.3 Å²	139.3	71%	0.71	72%	0.724	S	S	*	*				-53.3	155.8	129.6	-80.6	106.8	0	0	0	110.4	C1943 L1944	L1939-C1943 CarbonylContact C-O 3.11Å; L1939-L1944 CarbonylContact C-O 3.49Å; L1939-L1944 CarbonylContact O-C 3.35Å; L1939-L1944 PolarHBondContact O-N 3.36Å
1940	E	32.4	Very low	31.6	Very low	156.8 Å²	156.8	140.2 Å²	140.2	73%	0.733	72%	0.723	S	S	*	*				-155.7	129.3	126.2	-58.9	-177.3	170.7	0	0	110.7	I1938 E1942 C1943	I1938-E1940 HydrophobicContact CG2-CG 3.7Å; E1940-E1942 VanDerWaalsContact C-N 3.33Å; E1940-E1942 HydrophobicContact CB-CB 4.14Å; E1940-E1942 CarbonylContact O-C 3.46Å; E1940-E1942 PolarHBondContact O-N 3.27Å; E1940-E1942 VanDerWaalsContact O-N 3.17Å; E1940-E1942 VanDerWaalsContact OE2-CB 3.25Å; E1940-E1942 WeakPolarHBondContact OE2-CB 3.41Å; E1940-C1943 VanDerWaalsContact CB-N 3.28Å; E1940-C1943 VanDerWaalsContact CD-N 3.33Å; E1940-C1943 HydrophobicContact CG-CB 4.46Å; E1940-C1943 WeakPolarHBondContact CG-O 3.38Å; E1940-C1943 PolarHBondContact N-O 3.44Å; E1940-C1943 WeakPolarHBondContact OE2-CA 3.21Å; E1940-C1943 VanDerWaalsContact OE2-CB 3.25Å; E1940-C1943 WeakPolarHBondContact OE2-CB 3.32Å; E1940-C1943 PolarHBondContact OE2-N 2.96Å; E1940-C1943 PolarHBondContact OE2-SG 3.21Å; E1940-C1943 VanDerWaalsContact OE2-SG 3.35Å
1941	D	34.3	Very low	31.6	Very low	145.8 Å²	145.8	139.3 Å²	139.3	78%	0.78	72%	0.721	S	S	*	*				-112.2	153.7	124.1	-91.5	-50.7	0	0	0	111.2
1942	E	32.1	Very low	31.7	Very low	160.2 Å²	160.2	139.6 Å²	139.6	75%	0.749	72%	0.718	S	S	*	*			trans	66	161.8	162.9	-65.1	-116	114.3	0	0	116.2	E1940 L1944	E1940-E1942 VanDerWaalsContact C-N 3.33Å; E1940-E1942 HydrophobicContact CB-CB 4.14Å; E1940-E1942 CarbonylContact O-C 3.46Å; E1940-E1942 PolarHBondContact O-N 3.27Å; E1940-E1942 VanDerWaalsContact O-N 3.17Å; E1940-E1942 VanDerWaalsContact OE2-CB 3.25Å; E1940-E1942 WeakPolarHBondContact OE2-CB 3.41Å; E1942-L1944 WeakPolarHBondContact OE1-CD2 3.42Å; E1942-L1944 WeakPolarHBondContact OE2-CD2 3.43Å; E1942-L1944 VanDerWaalsContact OE2-CG 3.29Å; E1942-L1944 WeakPolarHBondContact OE2-CG 3.46Å
1943	C	30.1	Very low	31.6	Very low	105.6 Å²	105.6	140.7 Å²	140.7	71%	0.714	72%	0.72	S	S	*	*				-130	144.6	115.2	-79.2	0	0	0	0	113.4	I1938 L1939 E1940	I1938-C1943 WeakPolarHBondContact CD1-O 3.23Å; L1939-C1943 CarbonylContact C-O 3.11Å; E1940-C1943 VanDerWaalsContact CB-N 3.28Å; E1940-C1943 VanDerWaalsContact CD-N 3.33Å; E1940-C1943 HydrophobicContact CG-CB 4.46Å; E1940-C1943 WeakPolarHBondContact CG-O 3.38Å; E1940-C1943 PolarHBondContact N-O 3.44Å; E1940-C1943 WeakPolarHBondContact OE2-CA 3.21Å; E1940-C1943 VanDerWaalsContact OE2-CB 3.25Å; E1940-C1943 WeakPolarHBondContact OE2-CB 3.32Å; E1940-C1943 PolarHBondContact OE2-N 2.96Å; E1940-C1943 PolarHBondContact OE2-SG 3.21Å; E1940-C1943 VanDerWaalsContact OE2-SG 3.35Å
1944	L	28.7	Very low	31.5	Very low	128.8 Å²	128.8	143.4 Å²	143.4	67%	0.674	73%	0.731	S	S	*	*			trans	157.2	153.5	148.8	-89.8	170.2	0	0	0	117.3	I1938 L1939 E1942	I1938-L1944 CarbonylContact C-O 3.06Å; I1938-L1944 VanDerWaalsContact CA-O 3.31Å; I1938-L1944 WeakPolarHBondContact CA-O 3.31Å; I1938-L1944 VanDerWaalsContact CB-O 3.3Å; I1938-L1944 WeakPolarHBondContact CB-O 3.32Å; I1938-L1944 HydrophobicContact CD1-CB 3.98Å; I1938-L1944 HydrophobicContact CD1-CD1 4.49Å; I1938-L1944 HydrophobicContact CG1-CB 4.01Å; I1938-L1944 VanDerWaalsContact CG1-O 3.28Å; I1938-L1944 WeakPolarHBondContact CG1-O 3.47Å; I1938-L1944 PolarHBondContact N-O 3.41Å; L1939-L1944 CarbonylContact C-O 3.49Å; L1939-L1944 CarbonylContact O-C 3.35Å; L1939-L1944 PolarHBondContact O-N 3.36Å; E1942-L1944 WeakPolarHBondContact OE1-CD2 3.42Å; E1942-L1944 WeakPolarHBondContact OE2-CD2 3.43Å; E1942-L1944 VanDerWaalsContact OE2-CG 3.29Å; E1942-L1944 WeakPolarHBondContact OE2-CG 3.46Å
1945	Y	30.8	Very low	31.4	Very low	207.4 Å²	207.4	141.2 Å²	141.2	81%	0.813	73%	0.733	S	S	*	*			trans	94.9	143.7	160.6	-97	-105.1	0	0	0	115.1
1946	R	32.3	Very low	31.4	Very low	194 Å²	194	141.2 Å²	141.2	73%	0.732	73%	0.733	S	S	*	*			cis	-127.6	153.8	35.2	-90.9	-175.9	178.8	-137.3	-4.1	113.6	D1933 F1936 S1937	D1933-R1946 VanDerWaalsContact CG-NH2 3.25Å; D1933-R1946 IonicContact OD1-CZ 3.18Å; D1933-R1946 IonicContact OD1-NH1 2.66Å; D1933-R1946 PolarHBondContact OD1-NH1 3.41Å; D1933-R1946 IonicContact OD1-NH2 2.87Å; D1933-R1946 PolarHBondContact OD1-NH2 3.2Å; D1933-R1946 IonicContact OD2-CZ 3.87Å; D1933-R1946 IonicContact OD2-NH2 2.83Å; D1933-R1946 PolarHBondContact OD2-NH2 2.78Å; F1936-R1946 WeakPolarHBondContact O-CG 3.49Å; F1936-R1946 PolarHBondContact O-NE 2.95Å; F1936-R1946 PolarHBondContact O-NH2 3.26Å; S1937-R1946 WeakPolarHBondContact OG-CD 3.46Å; S1937-R1946 PolarHBondContact OG-NE 2.95Å
1947	P	34.4	Very low	31.6	Very low	112.8 Å²	112.8	140 Å²	140	73%	0.732	73%	0.733	S	S	*	*			trans	-110.9	151.8	-170.4	35.6	-27	0	0	0	114.6
1948	I	32.4	Very low	31.7	Very low	130.2 Å²	130.2	144.7 Å²	144.7	67%	0.668	74%	0.742	S	S	*	*			trans	-126	133.8	155.1	-65.3	165	0	0	0	113	Q1934 S1935 I1950	Q1934-I1948 VanDerWaalsContact C-CD1 3.42Å; S1935-I1948 VanDerWaalsContact O-CG1 3.31Å; S1935-I1948 WeakPolarHBondContact O-CG1 3.2Å; I1948-I1950 HydrophobicContact CG2-CD1 4.02Å; I1948-I1950 HydrophobicContact CG2-CG1 4.09Å
1949	N	30.4	Very low	32.2	Very low	137.4 Å²	137.4	143.5 Å²	143.5	74%	0.735	74%	0.743	S	S	*	*			trans	-140	131.7	157.8	-122.7	-29.7	0	0	0	112	N1820 K1821	N1820-N1949 PolarHBondContact ND2-OD1 3.34Å; K1821-N1949 PolarHBondContact NZ-OD1 3.17Å
1950	I	34.6	Very low	32.3	Very low	137.4 Å²	137.4	142.3 Å²	142.3	71%	0.705	74%	0.741	S	S	*	*			trans	-141.5	119.5	148.6	-66.9	177.7	0	0	0	112.2	I1948	I1948-I1950 HydrophobicContact CG2-CD1 4.02Å; I1948-I1950 HydrophobicContact CG2-CG1 4.09Å
1951	M	29.6	Very low	32.4	Very low	152 Å²	152	141.2 Å²	141.2	75%	0.749	74%	0.74	S	S	*	*			trans	16.7	145.1	130.5	-103.7	156.4	46.8	0	0	120.1
1952	N	33.6	Very low	32.3	Very low	131.8 Å²	131.8	142.4 Å²	142.4	71%	0.705	74%	0.739	S	S	*	*			trans	91.2	129.3	136.4	-73.9	-16.4	0	0	0	120.8
1953	N	30.4	Very low	32.3	Very low	140.6 Å²	140.6	141.8 Å²	141.8	75%	0.752	74%	0.738	S	S	*	*				77.1	136.7	109.2	-91.8	-27	0	0	0	115.9
1954	M	30.8	Very low	32.4	Very low	174.4 Å²	174.4	141.8 Å²	141.8	86%	0.859	74%	0.735	S	S	*	*			trans	164.7	151.5	139.6	-91.8	177.4	166.2	0	0	114.3
1955	S	31.4	Very low	32.5	Very low	108.6 Å²	108.6	140.4 Å²	140.4	76%	0.759	73%	0.734	S	S	*	*			trans	-148.6	154.8	176.1	-70.5	0	0	0	0	112.3
1956	S	30.9	Very low	32.6	Very low	101.6 Å²	101.6	137.4 Å²	137.4	71%	0.71	73%	0.731	S	S	*	*			trans	-167.1	152.4	141.9	74.9	0	0	0	0	114.1
1957	I	33.2	Very low	33	Very low	161.2 Å²	161.2	133.7 Å²	133.7	83%	0.827	73%	0.732	S	S	*	*			trans	120.2	123.9	149.6	-64.4	168.6	0	0	0	114.5
1958	F	30.9	Very low	32.9	Very low	189.8 Å²	189.8	133.4 Å²	133.4	83%	0.832	73%	0.733	S	S	*	*			trans	-107.4	176.7	165.4	-89	-74	0	0	0	111.9	T1960	F1958-T1960 HydrophobicContact CD1-CG2 3.87Å; F1958-T1960 HydrophobicContact CE1-CG2 4.47Å
1959	P	42.4	Very low	32.9	Very low	101.8 Å²	101.8	132.2 Å²	132.2	66%	0.661	74%	0.735	S	S	*	*			cis	-135.3	-178.4	-0.7	33.7	-11.8	0	0	0	115.8
1960	T	32.8	Very low	33	Very low	110.8 Å²	110.8	129.8 Å²	129.8	68%	0.68	73%	0.73	S	S	*	*				75.8	148.3	125.3	46.1	0	0	0	0	118.2	F1958	F1958-T1960 HydrophobicContact CD1-CG2 3.87Å; F1958-T1960 HydrophobicContact CE1-CG2 4.47Å
1961	N	33.6	Very low	32.9	Very low	132.2 Å²	132.2	132.3 Å²	132.3	71%	0.707	74%	0.736	S	S	*	*				177.3	138.2	56.8	-89.5	-40	0	0	0	114.1
1962	K	32.5	Very low	33	Very low	172.4 Å²	172.4	131.9 Å²	131.9	75%	0.75	74%	0.736	S	S	*	*				89.3	145.2	73	-90.7	-168	-179.6	-176.6	0	115.3
1963	M	32.6	Very low	32.9	Very low	147.6 Å²	147.6	131.4 Å²	131.4	73%	0.727	74%	0.737	S	S	*	*				82.1	143.2	129	-107	136.9	155.5	0	0	114.1	Y1182	Y1182-M1963 HydrophobicContact CD1-CB 3.65Å; Y1182-M1963 WeakPolarHBondContact CD1-O 3.42Å; Y1182-M1963 HydrophobicContact CG-CB 3.93Å; Y1182-M1963 HydrophobicContact CG-CG 4.25Å
1964	T	32.9	Very low	33	Very low	105.8 Å²	105.8	130.6 Å²	130.6	65%	0.649	74%	0.738	S	S	*	*			cis	166.4	172.3	35.4	-45.3	0	0	0	0	115.7	Y1182	Y1182-T1964 WeakPolarHBondContact CA-OG1 3.31Å; Y1182-T1964 WeakPolarHBondContact CD1-O 3.41Å; Y1182-T1964 HydrophobicContact CD2-CG2 4.08Å; Y1182-T1964 WeakPolarHBondContact CD2-O 3.28Å; Y1182-T1964 WeakPolarHBondContact CD2-OG1 3.2Å; Y1182-T1964 WeakPolarHBondContact CE1-O 2.97Å; Y1182-T1964 HydrophobicContact CE2-CG2 4.1Å; Y1182-T1964 HydrophobicContact CG-CG2 4.43Å; Y1182-T1964 VanDerWaalsContact CG-N 3.35Å; Y1182-T1964 PolarHBondContact N-OG1 3.1Å; Y1182-T1964 WeakPolarHBondContact OH-CA 2.89Å
1965	C	30.6	Very low	32.9	Very low	98.2 Å²	98.2	126.9 Å²	126.9	66%	0.664	73%	0.729	S	S	*	*			trans	-90.1	161.5	177.7	-53.3	0	0	0	0	114.4	Y1182	Y1182-C1965 HydrophobicContact CD2-CB 3.84Å; Y1182-C1965 WeakPolarHBondContact CD2-SG 3.45Å; Y1182-C1965 HydrophobicContact CE2-CB 4.21Å; Y1182-C1965 VanDerWaalsContact CG-N 3.29Å; Y1182-C1965 PolarHBondContact N-SG 3.28Å; Y1182-C1965 VanDerWaalsContact N-SG 3.41Å
1966	I	33.2	Very low	33	Very low	145.8 Å²	145.8	129.5 Å²	129.5	75%	0.748	73%	0.734	S	S	*	*				153.9	124.5	102.9	-64.4	170.2	0	0	0	112.2	Q1181	Q1181-I1966 HydrophobicContact CG-CD1 4.2Å
1967	P	39.3	Very low	33.1	Very low	115 Å²	115	129.7 Å²	129.7	75%	0.747	74%	0.735	S	S	*	*			trans	-124.8	156.6	135.2	39.2	-27.1	0	0	0	115.4
1968	S	32.1	Very low	33.4	Very low	107.4 Å²	107.4	127.5 Å²	127.5	75%	0.751	73%	0.731	S	S	*	*			trans	-168.1	144.7	162.1	-70.9	0	0	0	0	116
1969	S	33.5	Very low	33.4	Very low	103.6 Å²	103.6	124.4 Å²	124.4	72%	0.724	73%	0.728	S	S	*	*			trans	76.1	141.7	134.3	71.2	0	0	0	0	119.5
1970	S	32.9	Very low	33	Very low	88.6 Å²	88.6	126.3 Å²	126.3	62%	0.62	74%	0.737	S	S	*	*				144.5	140.9	59.9	-65.9	0	0	0	0	115.2
1971	F	31.1	Very low	32.9	Very low	189.2 Å²	189.2	126.2 Å²	126.2	83%	0.83	74%	0.742	S	S	*	*			trans	97.2	143.3	138.2	-75.1	-65.6	0	0	0	116.3
1972	L	33	Very low	33.4	Very low	142.8 Å²	142.8	125.2 Å²	125.2	75%	0.748	74%	0.742	S	S	*	*				118.1	138.3	57.1	-82.4	172.7	0	0	0	112.5
1973	V	31	Very low	33.9	Very low	121.2 Å²	121.2	122.6 Å²	122.6	74%	0.735	74%	0.743	S	S	*	*				66.9	141.7	65.2	-173.2	0	0	0	0	113.5
1974	T	31.8	Very low	34	Very low	124.8 Å²	124.8	121.3 Å²	121.3	77%	0.766	74%	0.743	S	S	*	*				-152.4	150.9	77.6	-25.7	0	0	0	0	112.4	L1976	T1974-L1976 HydrophobicContact CG2-CD2 4.33Å
1975	S	29.6	Very low	34.2	Very low	95.8 Å²	95.8	123.7 Å²	123.7	67%	0.67	75%	0.751	S	S	*	*			trans	-89.5	153	153.4	56.8	0	0	0	0	113.3
1976	L	34	Very low	34.6	Very low	164.6 Å²	164.6	123.6 Å²	123.6	86%	0.862	75%	0.749	S	S	*	*			trans	-179.2	153.9	132.9	-89.1	162.3	0	0	0	111.1	T1974	T1974-L1976 HydrophobicContact CG2-CD2 4.33Å
1977	S	31.6	Very low	34.6	Very low	105.6 Å²	105.6	125.6 Å²	125.6	74%	0.738	75%	0.753	S	S	*	*			trans	-136.5	169.5	-164.5	19.7	0	0	0	0	110.4
1978	P	40.2	Very low	34.4	Very low	114.2 Å²	114.2	125.2 Å²	125.2	74%	0.742	75%	0.753	S	S	*	*				-121.2	177.7	-109	35.4	-22.6	0	0	0	114.2
1979	T	30.4	Very low	34.3	Very low	125.4 Å²	125.4	127.5 Å²	127.5	77%	0.769	76%	0.756	S	S	*	*			trans	166.6	121	160.7	42.9	0	0	0	0	116.3
1980	T	33.4	Very low	34.6	Very low	140.6 Å²	140.6	127.9 Å²	127.9	86%	0.863	76%	0.756	S	S	*	*				136.5	148	128	37.4	0	0	0	0	116.5
1981	S	32.4	Very low	34.6	Very low	109.8 Å²	109.8	128.9 Å²	128.9	77%	0.768	76%	0.763	S	S	*	*			trans	-114.5	169.8	170.2	58.4	0	0	0	0	114.1
1982	P	43.4	Very low	34.6	Very low	111.4 Å²	111.4	124.2 Å²	124.2	72%	0.723	76%	0.759	S	S	*	*			trans	-108.6	-171.6	-140.7	36.4	-25.3	0	0	0	112.9	V1984	P1982-V1984 HydrophobicContact CG-CG2 4.33Å
1983	P	43.1	Very low	34.5	Very low	116.6 Å²	116.6	125.2 Å²	125.2	76%	0.757	76%	0.764	S	S	*	*				-121	160.9	94	31.8	-15.8	0	0	0	114.6
1984	V	35.3	Very low	34.5	Very low	121.8 Å²	121.8	124.2 Å²	124.2	74%	0.738	76%	0.763	S	S	*	*				76.1	119.8	120.8	-179.3	0	0	0	0	114.9	P1982	P1982-V1984 HydrophobicContact CG-CG2 4.33Å
1985	L	35.4	Very low	34.3	Very low	155.8 Å²	155.8	123.3 Å²	123.3	82%	0.816	76%	0.761	S	S	*	*				147.2	164.5	98.7	-85.2	177.8	0	0	0	112.2
1986	P	39.7	Very low	34.3	Very low	96 Å²	96	126.4 Å²	126.4	62%	0.623	77%	0.769	S	S	*	*				-132.8	-171.1	-88.7	40.6	-23.1	0	0	0	116.5
1987	F	33.3	Very low	34.1	Very low	188.4 Å²	188.4	123.1 Å²	123.1	83%	0.826	76%	0.759	S	S	*	*			trans	72.9	141.6	160.7	-70.3	-71.4	0	0	0	118.3
1988	S	34.7	Very low	34.2	Very low	106.4 Å²	106.4	125.1 Å²	125.1	74%	0.744	76%	0.757	S	S	*	*			cis	-167.9	147.7	24.1	-90.8	0	0	0	0	116.4
1989	L	31.6	Very low	33.8	Very low	154.8 Å²	154.8	126.7 Å²	126.7	81%	0.81	76%	0.755	S	S	*	*			trans	-81.8	178.2	162.8	-96.1	110.3	0	0	0	112.8
1990	P	39.8	Very low	34	Very low	111.4 Å²	111.4	128.1 Å²	128.1	72%	0.723	75%	0.753	S	S	*	*			cis	-141	-175.2	1.9	36.9	-14.9	0	0	0	116.8
1991	S	31.7	Very low	34	Very low	110.8 Å²	110.8	126.4 Å²	126.4	78%	0.775	74%	0.742	S	S	*	*			trans	72.3	140.1	152.7	-51.6	0	0	0	0	120.5
1992	A	32.1	Very low	34	Very low	90.4 Å²	90.4	126.4 Å²	126.4	75%	0.747	74%	0.738	S	S	*	*				127.4	127	125	0	0	0	0	0	117.7
1993	L	29.9	Very low	33.4	Very low	163.6 Å²	163.6	125.2 Å²	125.2	86%	0.857	73%	0.732	S	S	*	*				71.3	128.2	129.7	-69.8	169.2	0	0	0	116.8
1994	S	30.4	Very low	32.8	Very low	99.8 Å²	99.8	127.4 Å²	127.4	70%	0.698	73%	0.73	S	S	*	*				106.4	136.8	83.1	14.3	0	0	0	0	116.3
1995	S	29	Very low	32.5	Very low	106 Å²	106	129.9 Å²	129.9	74%	0.741	73%	0.731	S	S	*	*				97.1	144	95.5	-11.8	0	0	0	0	117.1
1996	I	29.9	Very low	32.2	Very low	160 Å²	160	127.5 Å²	127.5	82%	0.821	73%	0.727	S	S	*	*			trans	92.7	135.1	146	-99	169.4	0	0	0	113.1
1997	S	29.7	Very low	31.8	Very low	95.6 Å²	95.6	127.9 Å²	127.9	67%	0.669	73%	0.731	S	S	*	*				150.7	149	78.5	35.2	0	0	0	0	113.1
1998	Q	32.2	Very low	31.8	Very low	148.6 Å²	148.6	123.4 Å²	123.4	69%	0.694	73%	0.729	S	S	*	*				170.4	150.5	124.8	-111.1	173.2	-60.8	0	0	112.6
1999	E	33.3	Very low	31.6	Very low	147.2 Å²	147.2	124.9 Å²	124.9	69%	0.688	73%	0.728	S	S	*	*				68.7	155.8	119.9	-82.4	157.9	-164.3	0	0	117.4
2000	E	33.6	Very low	31.6	Very low	154.8 Å²	154.8	121.5 Å²	121.5	72%	0.723	72%	0.717	S	S	*	*			cis	-176.9	157	0.8	-118.1	-166.8	144.7	0	0	113.3
2001	T	33.8	Very low	31.3	Very low	104.5 Å²	104.5	123.6 Å²	123.6	64%	0.641	72%	0.717	S	S	*	*			trans	78.5	151.6	143.5	48.6	0	0	0	0	117.2
2002	T	32.1	Very low	31.3	Very low	111.25 Å²	111.25	124.6 Å²	124.6	68%	0.683	71%	0.713	S	S	*	*				83.8	142	102.5	46.5	0	0	0	0	114.9	H1568	H1568-T2002 PolarHBondContact CD2-OG1 2.6Å; H1568-T2002 PolarHBondContact CE1-O 2.93Å; H1568-T2002 PolarHBondContact ND1-O 2.9Å
2003	S	30.9	Very low	31.1	Very low	84.5 Å²	84.5	127.5 Å²	127.5	59%	0.591	71%	0.713	S	S	*	*			cis	172	166.2	9.4	57	0	0	0	0	112.3	H1568	H1568-S2003 PolarHBondContact CE1-N 3.2Å; H1568-S2003 VanDerWaalsContact CE1-N 3.31Å; H1568-S2003 PolarHBondContact NE2-OG 3.36Å
2004	F	29.6	Very low	31.1	Very low	163 Å²	163	125.3 Å²	125.3	72%	0.715	71%	0.707	S	S	*	*				134	129.5	124.2	-81.6	-66.2	0	0	0	117.2	H1568	H1568-F2004 AromaticContact CE1-CE2 3.56Å; H1568-F2004 AromaticContact NE2-CE2 3.69Å; H1568-F2004 AromaticContact NE2-CZ 3.88Å
2005	F	30.3	Very low	31	Very low	175.25 Å²	175.25	127.4 Å²	127.4	77%	0.769	71%	0.71	S	S	*	*				61	124.9	121.7	-73.7	-75.9	0	0	0	118.8
2006	S	29.3	Very low	31.1	Very low	105 Å²	105	127.1 Å²	127.1	73%	0.734	71%	0.708	S	S	*	*				136.3	144.1	73.6	-119	0	0	0	0	110.7
2007	C	29.7	Very low	30.9	Very low	105.25 Å²	105.25	128.9 Å²	128.9	71%	0.711	71%	0.71	S	S	*	*			cis	-157.2	148.9	10.9	-135.5	0	0	0	0	112.1	D2009	C2007-D2009 PolarHBondContact SG-OD2 2.92Å
2008	A	34.3	Very low	30.9	Very low	93 Å²	93	134.8 Å²	134.8	77%	0.769	72%	0.718	S	S	*	*			trans	133.3	133.4	156.6	0	0	0	0	0	113
2009	D	30.9	Very low	30.7	Very low	138 Å²	138	132.9 Å²	132.9	74%	0.738	72%	0.721	S	S	*	*			cis	-147.5	159.5	21.6	-101.9	-60.9	0	0	0	112.6	C2007	C2007-D2009 PolarHBondContact SG-OD2 2.92Å
2010	S	31.9	Very low	30.6	Very low	82.75 Å²	82.75	133.6 Å²	133.6	58%	0.579	73%	0.726	S	S	*	*				133.7	166.1	97.9	23.2	0	0	0	0	116.6
2011	H	33.3	Very low	30.3	Very low	156.5 Å²	156.5	132.1 Å²	132.1	73%	0.725	72%	0.724	S	S	*	*				136.7	129.1	82.1	-90.2	-29.6	0	0	0	115.6
2012	L	30.5	Very low	30.2	Very low	132 Å²	132	133.6 Å²	133.6	69%	0.691	73%	0.726	S	S	*	*				68	141.5	113.6	-60.6	174.6	0	0	0	116.7
2013	M	29.1	Very low	30.2	Very low	151.25 Å²	151.25	136 Å²	136	75%	0.745	73%	0.73	S	S	*	*			cis	-167.8	137.6	25.8	-116.1	168.8	-178.8	0	0	114.6
2014	T	29.2	Very low	30.2	Very low	117.75 Å²	117.75	138.8 Å²	138.8	72%	0.722	74%	0.738	S	S	*	*				-30.8	144	128.2	54.7	0	0	0	0	117.7
2015	N	28.8	Very low	30.4	Very low	142.25 Å²	142.25	138.2 Å²	138.2	76%	0.761	74%	0.741	S	S	*	*			trans	97	117.3	133.3	-86.4	-19.5	0	0	0	117.8	F2017	N2015-F2017 HydrophobicContact CB-CD2 4.42Å; N2015-F2017 HydrophobicContact CB-CE2 4.38Å; N2015-F2017 PolarHBondContact O-N 3.3Å; N2015-F2017 VanDerWaalsContact OD1-CE2 3.24Å; N2015-F2017 WeakPolarHBondContact OD1-CE2 3.42Å
2016	S	29.9	Very low	30.3	Very low	101.25 Å²	101.25	134.8 Å²	134.8	71%	0.708	74%	0.739	S	S	*	*			trans	140.1	108.3	147.5	-142.8	0	0	0	0	115.8	R2018	S2016-R2018 PolarHBondContact O-N 2.91Å
2017	F	27.2	Very low	30.4	Very low	196.5 Å²	196.5	136.3 Å²	136.3	86%	0.862	74%	0.738	S	S	*	*			trans	-56.6	113.7	153.6	-89.2	-85.5	0	0	0	113.9	N2015	N2015-F2017 HydrophobicContact CB-CD2 4.42Å; N2015-F2017 HydrophobicContact CB-CE2 4.38Å; N2015-F2017 PolarHBondContact O-N 3.3Å; N2015-F2017 VanDerWaalsContact OD1-CE2 3.24Å; N2015-F2017 WeakPolarHBondContact OD1-CE2 3.42Å
2018	R	29.5	Very low	30.5	Very low	220 Å²	220	139.4 Å²	139.4	83%	0.83	74%	0.742	S	S	*	*			trans	-164.7	131.5	147.3	-79.6	-179.6	-178.5	-109.8	0.1	112.7	S2016 M2020	S2016-R2018 PolarHBondContact O-N 2.91Å; R2018-M2020 HydrophobicContact CB-CE 4.35Å; R2018-M2020 HydrophobicContact CB-CG 4.22Å; R2018-M2020 HydrophobicContact CG-CE 4.2Å; R2018-M2020 HydrophobicContact CG-CG 3.9Å; R2018-M2020 HydrophobicContact CG-SD 3.86Å; R2018-M2020 PolarHBondContact NH1-SD 3.21Å; R2018-M2020 PolarHBondContact O-N 3.34Å
2019	S	27.4	Very low	30.4	Very low	108.75 Å²	108.75	142 Å²	142	76%	0.76	74%	0.738	S	S	*	*			trans	-103.5	136.6	175	-50.9	0	0	0	0	109.6
2020	M	30.6	Very low	30.4	Very low	161.5 Å²	161.5	142.8 Å²	142.8	80%	0.796	74%	0.737	S	S	*	*			trans	119.5	124.1	131.4	-74.4	-176	-57.3	0	0	111	R2018 I2022	R2018-M2020 HydrophobicContact CB-CE 4.35Å; R2018-M2020 HydrophobicContact CB-CG 4.22Å; R2018-M2020 HydrophobicContact CG-CE 4.2Å; R2018-M2020 HydrophobicContact CG-CG 3.9Å; R2018-M2020 HydrophobicContact CG-SD 3.86Å; R2018-M2020 PolarHBondContact NH1-SD 3.21Å; R2018-M2020 PolarHBondContact O-N 3.34Å; M2020-I2022 PolarHBondContact O-N 2.8Å
2021	D	27.9	Very low	30.4	Very low	124.75 Å²	124.75	145.8 Å²	145.8	67%	0.667	74%	0.742	S	S	*	*			trans	-90	165.6	165.1	-60.9	-66.2	0	0	0	111.6	I1697	I1697-D2021 WeakPolarHBondContact CD1-OD1 3.21Å; I1697-D2021 WeakPolarHBondContact CG2-OD1 3.24Å
2022	I	32.4	Very low	30.3	Very low	135 Å²	135	145.5 Å²	145.5	69%	0.692	74%	0.741	S	S	*	*			trans	69.7	126.2	158.5	-55	171.1	0	0	0	114.7	M2020 D2024	M2020-I2022 PolarHBondContact O-N 2.8Å; I2022-D2024 PolarHBondContact O-N 3.01Å
2023	E	31.8	Very low	30.4	Very low	162.25 Å²	162.25	146.5 Å²	146.5	76%	0.758	74%	0.742	S	S	*	*			trans	106.6	138.4	143.5	-75.3	163.4	-172.2	0	0	116.2	N1694 L2025	N1694-E2023 PolarHBondContact ND2-OE1 2.85Å; E2023-L2025 PolarHBondContact O-N 3.28Å
2024	D	30.8	Very low	30.5	Very low	142 Å²	142	146.3 Å²	146.3	76%	0.759	74%	0.739	S	S	*	*			trans	-13.4	132.4	161.3	-85.1	-26	0	0	0	113.3	I2022	I2022-D2024 PolarHBondContact O-N 3.01Å
2025	L	32.6	Very low	30.5	Very low	151.75 Å²	151.75	148.8 Å²	148.8	80%	0.795	74%	0.74	S	S	*	*			trans	-159.2	134.6	166.2	-107.5	95.3	0	0	0	109.3	E2023	E2023-L2025 PolarHBondContact O-N 3.28Å
2026	S	29.3	Very low	30.5	Very low	103.75 Å²	103.75	146.8 Å²	146.8	73%	0.726	74%	0.737	S	S	*	*				-162.4	155.4	109.4	-109.8	0	0	0	0	110.8
2027	I	31.9	Very low	30.7	Very low	136.25 Å²	136.25	150.9 Å²	150.9	70%	0.699	74%	0.742	S	S	*	*			trans	84.5	110.7	179.1	-56.1	159.5	0	0	0	112.4	Q2029	I2027-Q2029 HydrophobicContact CG2-CG 4.32Å
2028	E	31.3	Very low	30.9	Very low	169.25 Å²	169.25	147.4 Å²	147.4	79%	0.791	74%	0.737	S	S	*	*				137.2	135.4	92.2	-104.5	-175.7	143.3	0	0	110.4
2029	Q	31.1	Very low	31.2	Very low	149.25 Å²	149.25	142.4 Å²	142.4	70%	0.697	73%	0.733	S	S	*	*				90.8	121.1	72.8	-76	-163.3	25.7	0	0	114.1	I2027	I2027-Q2029 HydrophobicContact CG2-CG 4.32Å
2030	H	32.4	Very low	31.4	Very low	153.75 Å²	153.75	143.2 Å²	143.2	71%	0.712	73%	0.733	S	S	*	*				117.8	127.6	107.5	-95.1	57.4	0	0	0	114.3
2031	Q	31	Very low	31.4	Very low	146.75 Å²	146.75	143.2 Å²	143.2	69%	0.686	73%	0.731	S	S	*	*				129.7	131.9	97.1	-133.3	-178.9	68.6	0	0	112.7
2032	Q	31.3	Very low	31.7	Very low	150 Å²	150	144.9 Å²	144.9	70%	0.701	74%	0.735	S	S	*	*			cis	-176.5	159.2	40.5	-128.5	161.4	40.1	0	0	111
2033	Q	33	Very low	31.7	Very low	153.5 Å²	153.5	146 Å²	146	72%	0.717	74%	0.737	S	S	*	*			trans	66.8	150.8	155.7	-62.2	-176.2	20.1	0	0	117.6
2034	H	30.4	Very low	31.8	Very low	145 Å²	145	145.4 Å²	145.4	67%	0.671	73%	0.733	S	S	*	*			cis	-149.9	152.5	-21.3	-119.6	-131	0	0	0	112
2035	F	29.6	Very low	31.8	Very low	171.25 Å²	171.25	145.6 Å²	145.6	75%	0.751	73%	0.73	S	S	*	*			trans	64.2	148.8	143.7	-71.5	-98.8	0	0	0	117.6
2036	S	29.9	Very low	31.8	Very low	101 Å²	101	145.2 Å²	145.2	71%	0.706	72%	0.724	S	S	*	*			cis	-164.8	150.5	-36.3	-78.3	0	0	0	0	111.4
2037	K	32.4	Very low	32	Very low	186.5 Å²	186.5	148.4 Å²	148.4	81%	0.811	73%	0.728	S	S	*	*				138.4	146.7	102.8	-116.9	170	-179.8	179.3	0	114.1
2038	V	32.2	Very low	32	Very low	123.25 Å²	123.25	149.9 Å²	149.9	75%	0.747	73%	0.731	S	S	*	*			trans	80.3	146.8	154.8	172	0	0	0	0	115.7	T2040	V2038-T2040 HydrophobicContact CG1-CG2 4.22Å
2039	P	36.6	Very low	32	Very low	114.5 Å²	114.5	150.3 Å²	150.3	74%	0.744	73%	0.733	S	S	*	*			trans	-113.5	176.4	-177.6	34.6	-20.4	0	0	0	115.5
2040	T	31.1	Very low	32.1	Very low	126.75 Å²	126.75	151.8 Å²	151.8	78%	0.778	74%	0.737	S	S	*	*			trans	143.7	145.6	155.9	44.5	0	0	0	0	114.3	V2038	V2038-T2040 HydrophobicContact CG1-CG2 4.22Å
2041	H	31.4	Very low	32	Very low	160.75 Å²	160.75	151.3 Å²	151.3	74%	0.744	74%	0.739	S	S	*	*				-150.4	156.6	57	-128.2	-113.3	0	0	0	111.5
2042	H	33.3	Very low	32.1	Very low	161 Å²	161	149.5 Å²	149.5	75%	0.745	74%	0.74	S	S	*	*			trans	86	151.2	138.4	-84.4	-10.1	0	0	0	117.3
2043	H	32.2	Very low	32.3	Very low	157.5 Å²	157.5	149.6 Å²	149.6	73%	0.729	74%	0.744	S	S	*	*			cis	-146	165.2	-16.2	-135.9	-3.5	0	0	0	112
2044	H	33.6	Very low	32.1	Very low	149.5 Å²	149.5	147 Å²	147	69%	0.692	74%	0.743	S	S	*	*				131.6	-177.3	120.7	-125.2	22.7	0	0	0	116.2
2045	E	31.3	Very low	32.2	Very low	145.5 Å²	145.5	147 Å²	147	68%	0.68	75%	0.747	S	S	*	*				-122.7	165.2	-119.5	-134.5	-175.2	96.7	0	0	115.2
2046	Q	32.6	Very low	32.4	Very low	144.75 Å²	144.75	145.2 Å²	145.2	68%	0.676	74%	0.74	S	S	*	*			trans	173.3	149.5	162.1	-95.1	-178.9	49	0	0	115.8	H2048	Q2046-H2048 VanDerWaalsContact C-N 3.31Å; Q2046-H2048 PolarHBondContact O-CD2 3.06Å; Q2046-H2048 PolarHBondContact O-N 3.05Å; Q2046-H2048 PolarHBondContact OE1-CE1 3.3Å
2047	Q	32.7	Very low	32.5	Very low	171.25 Å²	171.25	146.8 Å²	146.8	80%	0.8	74%	0.74	S	S	*	*			trans	3.8	137.9	166.4	-65.1	-173.3	16.1	0	0	116.2	Q2049	Q2047-Q2049 PolarHBondContact O-N 3.2Å
2048	H	32.7	Very low	32.5	Very low	166 Å²	166	143.5 Å²	143.5	77%	0.769	74%	0.738	S	S	*	*			trans	-126.9	157.1	175.8	-83.2	-70.7	0	0	0	112.1	Q2046 K2050	Q2046-H2048 VanDerWaalsContact C-N 3.31Å; Q2046-H2048 PolarHBondContact O-CD2 3.06Å; Q2046-H2048 PolarHBondContact O-N 3.05Å; Q2046-H2048 PolarHBondContact OE1-CE1 3.3Å; H2048-K2050 PolarHBondContact O-N 2.86Å
2049	Q	31.5	Very low	32.3	Very low	178 Å²	178	144.7 Å²	144.7	83%	0.832	74%	0.739	S	S	*	*			trans	-104.5	153.1	163.9	-76.3	168.9	49.3	0	0	113.6	Q2047 L2051	Q2047-Q2049 PolarHBondContact O-N 3.2Å; Q2049-L2051 VanDerWaalsContact C-N 3.27Å; Q2049-L2051 VanDerWaalsContact O-CD1 3.31Å; Q2049-L2051 WeakPolarHBondContact O-CD1 3.1Å; Q2049-L2051 PolarHBondContact O-N 2.93Å
2050	K	34	Very low	32.1	Very low	181.25 Å²	181.25	145.5 Å²	145.5	79%	0.788	74%	0.741	S	S	*	*			trans	-163.6	111.5	-178.7	-176.7	178.5	177.6	-176.6	0	114.8	H2048	H2048-K2050 PolarHBondContact O-N 2.86Å
2051	L	28.8	Very low	32	Very low	142.5 Å²	142.5	144.7 Å²	144.7	75%	0.746	74%	0.741	S	S	*	*			trans	36.5	153.2	158.4	-64	156.5	0	0	0	118.5	Q2049 I2053	Q2049-L2051 VanDerWaalsContact C-N 3.27Å; Q2049-L2051 VanDerWaalsContact O-CD1 3.31Å; Q2049-L2051 WeakPolarHBondContact O-CD1 3.1Å; Q2049-L2051 PolarHBondContact O-N 2.93Å; L2051-I2053 HydrophobicContact CB-CG1 3.82Å; L2051-I2053 HydrophobicContact CD2-CG1 4.19Å; L2051-I2053 HydrophobicContact CG-CG1 4.49Å; L2051-I2053 PolarHBondContact O-N 3.16Å
2052	P	34.2	Very low	31.9	Very low	110.25 Å²	110.25	141.9 Å²	141.9	72%	0.716	74%	0.739	S	S	*	*				-108.3	151.2	66.4	34.8	-23.6	0	0	0	112.8	S2054	P2052-S2054 PolarHBondContact O-N 3.13Å; P2052-S2054 VanDerWaalsContact O-N 3.13Å
2053	I	34.2	Very low	31.5	Very low	152 Å²	152	139.2 Å²	139.2	78%	0.779	74%	0.738	S	S	*	*			trans	-126.4	135.3	165.3	-68.7	175.8	0	0	0	111.4	L2051 L2055	L2051-I2053 HydrophobicContact CB-CG1 3.82Å; L2051-I2053 HydrophobicContact CD2-CG1 4.19Å; L2051-I2053 HydrophobicContact CG-CG1 4.49Å; L2051-I2053 PolarHBondContact O-N 3.16Å; I2053-L2055 HydrophobicContact CG2-CB 4.5Å; I2053-L2055 HydrophobicContact CG2-CD1 4.15Å; I2053-L2055 HydrophobicContact CG2-CG 4.01Å; I2053-L2055 PolarHBondContact O-N 2.8Å
2054	S	29.1	Very low	31.3	Very low	98.5 Å²	98.5	137.1 Å²	137.1	69%	0.689	74%	0.74	S	S	*	*			trans	-115.9	144	-172.1	-82.4	0	0	0	0	111	P2052 D2473	P2052-S2054 PolarHBondContact O-N 3.13Å; P2052-S2054 VanDerWaalsContact O-N 3.13Å; S2054-D2473 WeakPolarHBondContact CB-OD2 3.45Å; S2054-D2473 PolarHBondContact OG-OD2 3.36Å
2055	L	33.3	Very low	31.1	Very low	144.5 Å²	144.5	136.5 Å²	136.5	76%	0.757	75%	0.747	S	S	*	*			trans	-139.9	135.2	152.9	-82.9	177.1	0	0	0	112.3	I2053 K2471	I2053-L2055 HydrophobicContact CG2-CB 4.5Å; I2053-L2055 HydrophobicContact CG2-CD1 4.15Å; I2053-L2055 HydrophobicContact CG2-CG 4.01Å; I2053-L2055 PolarHBondContact O-N 2.8Å; L2055-K2471 HydrophobicContact CD2-CD 4.29Å; L2055-K2471 VanDerWaalsContact CD2-NZ 3.25Å
2056	H	32.9	Very low	30.9	Very low	133.25 Å²	133.25	134.6 Å²	134.6	62%	0.617	75%	0.75	S	S	*	*				129.9	143.3	64.3	-138.1	-104.4	0	0	0	114.6	T2472 D2473	H2056-T2472 PolarHBondContact CD2-O 3.44Å; H2056-T2472 PolarHBondContact CE1-OG1 3.24Å; H2056-T2472 PolarHBondContact NE2-OG1 3.49Å; H2056-D2473 IonicContact CD2-OD1 3.7Å
2057	L	33.1	Very low	30.7	Very low	135 Å²	135	134.4 Å²	134.4	71%	0.707	75%	0.753	S	S	*	*			trans	146.7	148.1	156.9	-104.8	90.4	0	0	0	113.6
2058	P	31.6	Very low	30.5	Very low	117 Å²	117	133.8 Å²	133.8	76%	0.76	76%	0.755	S	S	*	*			cis	-122.1	153.5	30.8	37.4	-22.7	0	0	0	114.9
2059	I	28.4	Very low	30.4	Very low	149.5 Å²	149.5	132.1 Å²	132.1	77%	0.767	75%	0.751	S	S	*	*			trans	-140.8	131.4	164.4	-64.9	166.5	0	0	0	111.4
2060	T	31.3	Very low	30.3	Very low	130 Å²	130	131.8 Å²	131.8	80%	0.798	75%	0.75	S	S	*	*			trans	134.2	157.7	153.1	44.9	0	0	0	0	115
2061	S	30.1	Very low	30.2	Very low	111 Å²	111	127.8 Å²	127.8	78%	0.776	75%	0.745	S	S	*	*			trans	-162.5	119.6	176.6	48.5	0	0	0	0	114.1
2062	S	28.8	Very low	30.4	Very low	101 Å²	101	129.4 Å²	129.4	71%	0.706	75%	0.749	S	S	*	*			trans	-50.5	161.4	156.5	59.5	0	0	0	0	114.4
2063	C	26	Very low	30.3	Very low	105 Å²	105	131.1 Å²	131.1	71%	0.709	75%	0.751	S	S	*	*			trans	137.6	132	151.9	-76.7	0	0	0	0	114.3
2064	S	27.7	Very low	30.3	Very low	112.5 Å²	112.5	130.7 Å²	130.7	79%	0.787	75%	0.75	S	S	*	*				-135	146.8	-64.4	-57.6	0	0	0	0	112.3
2065	V	28	Very low	30.3	Very low	138.5 Å²	138.5	131.9 Å²	131.9	84%	0.839	75%	0.748	S	S	*	*			trans	-111.8	127.2	166.5	-159.9	0	0	0	0	111.1
2066	S	28.8	Very low	30.3	Very low	104 Å²	104	132.5 Å²	132.5	73%	0.727	75%	0.751	S	S	*	*			trans	-95.5	143.5	156.5	15.2	0	0	0	0	113.3
2067	N	27.7	Very low	30.2	Very low	141 Å²	141	131.4 Å²	131.4	75%	0.754	75%	0.754	S	S	*	*			trans	-126.3	152.9	154.5	-84.1	-38.7	0	0	0	112.7
2068	L	29.1	Very low	30.3	Very low	159.25 Å²	159.25	130.8 Å²	130.8	83%	0.834	76%	0.756	S	S	*	*			trans	40.9	138.4	150.7	-66.7	162.4	0	0	0	113.7
2069	N	29.6	Very low	30.5	Very low	129.75 Å²	129.75	130.4 Å²	130.4	69%	0.694	75%	0.753	S	S	*	*			cis	-150.3	161.1	-23.1	-116	-10.8	0	0	0	109.7
2070	Q	30.1	Very low	30.9	Very low	172.25 Å²	172.25	127.8 Å²	127.8	81%	0.805	75%	0.746	S	S	*	*			trans	75.5	159.3	164.5	-63.8	166.6	21.8	0	0	115.4
2071	S	30.8	Very low	30.9	Very low	96.25 Å²	96.25	126.1 Å²	126.1	67%	0.673	74%	0.739	S	S	*	*			cis	170.6	146.4	-27	-92.7	0	0	0	0	111.2
2072	E	34	Very low	30.9	Very low	177.25 Å²	177.25	127.1 Å²	127.1	83%	0.828	74%	0.735	S	S	*	*			trans	79.8	128.6	161.5	-67	172.2	-165	0	0	115
2073	L	30.8	Very low	31	Very low	146 Å²	146	127.1 Å²	127.1	76%	0.764	73%	0.731	S	S	*	*			cis	126.2	117	-3.2	-148.6	93.4	0	0	0	112.8
2074	L	34.9	Very low	31.2	Very low	144 Å²	144	129.6 Å²	129.6	75%	0.754	73%	0.732	S	S	*	*			trans	131.6	142.4	139.9	-68.9	-178.9	0	0	0	115.4
2075	D	29.7	Very low	31.4	Very low	123.75 Å²	123.75	129.8 Å²	129.8	66%	0.662	72%	0.724	S	S	*	*				74.4	145.4	97.6	-95.1	-27.7	0	0	0	115.9
2076	L	33.5	Very low	31.5	Very low	155.5 Å²	155.5	129.1 Å²	129.1	81%	0.814	72%	0.716	S	S	*	*			trans	109.6	105.7	148.8	-71.3	176.7	0	0	0	114.5
2077	T	30.6	Very low	31.6	Very low	111.75 Å²	111.75	130.2 Å²	130.2	69%	0.686	71%	0.713	S	S	*	*				55.7	111.3	124.4	-49.5	0	0	0	0	114.9
2078	V	34.7	Very low	31.6	Very low	121.75 Å²	121.75	130.2 Å²	130.2	74%	0.738	71%	0.712	S	S	*	*				42.3	146.1	114	-168.9	0	0	0	0	113.8	P2080	V2078-P2080 HydrophobicContact CG1-CB 4.23Å
2079	P	36.2	Very low	31.7	Very low	107.75 Å²	107.75	129.5 Å²	129.5	70%	0.7	71%	0.707	S	S	*	*			trans	-115.1	-176.4	150	38.1	-25.5	0	0	0	112.3
2080	P	35.8	Very low	31.6	Very low	95.5 Å²	95.5	129.9 Å²	129.9	62%	0.62	71%	0.71	S	S	*	*				-124.5	172.9	-86	35.7	-20.4	0	0	0	114.9	V2078 I2082 F2859	V2078-P2080 HydrophobicContact CG1-CB 4.23Å; P2080-I2082 HydrophobicContact CG-CD1 4.03Å; P2080-F2859 HydrophobicContact CB-CD1 4.44Å; P2080-F2859 HydrophobicContact CB-CE1 3.71Å; P2080-F2859 HydrophobicContact CB-CE2 4.12Å; P2080-F2859 HydrophobicContact CB-CZ 3.51Å; P2080-F2859 HydrophobicContact CG-CE1 3.76Å; P2080-F2859 HydrophobicContact CG-CZ 3.85Å
2081	S	30.9	Very low	31.6	Very low	93.5 Å²	93.5	126.5 Å²	126.5	65%	0.654	70%	0.704	S	S	*	*			trans	-173.2	131.8	150.6	-50.4	0	0	0	0	115.6	S2858 F2859	S2081-S2858 PolarHBondContact N-OG 3.24Å; S2081-F2859 WeakPolarHBondContact OG-CD1 3.46Å; S2081-F2859 VanDerWaalsContact OG-CE1 3.32Å; S2081-F2859 WeakPolarHBondContact OG-CE1 3.45Å
2082	I	30.8	Very low	31.5	Very low	133.5 Å²	133.5	129.3 Å²	129.3	69%	0.685	71%	0.711	S	S	*	*			trans	107.4	116.1	138.8	-83.1	162.3	0	0	0	116	P2080 S2858 F2859 H2860	P2080-I2082 HydrophobicContact CG-CD1 4.03Å; I2082-S2858 CarbonylContact C-O 3.53Å; I2082-S2858 WeakPolarHBondContact CA-O 3.44Å; I2082-S2858 PolarHBondContact N-O 3.21Å; I2082-F2859 HydrophobicContact CG1-CB 3.97Å; I2082-H2860 HydrophobicContact CD1-CB 4.23Å; I2082-H2860 HydrophobicContact CG1-CB 3.85Å
2083	T	30.6	Very low	31.5	Very low	101 Å²	101	127.2 Å²	127.2	62%	0.62	71%	0.705	S	S	*	*				133.5	150.2	65.9	44.1	0	0	0	0	117	S2858 F2859	T2083-S2858 PolarHBondContact N-O 3.44Å; T2083-F2859 WeakPolarHBondContact CA-O 3.33Å; T2083-F2859 PolarHBondContact N-O 3.45Å
2084	Q	31.4	Very low	31.4	Very low	157.25 Å²	157.25	128.2 Å²	128.2	74%	0.735	71%	0.706	S	S	*	*				98.5	139.7	116.6	-79.2	-179.5	11.5	0	0	117.6
2085	N	31.2	Very low	31.2	Very low	115.5 Å²	115.5	124.8 Å²	124.8	62%	0.618	71%	0.707	S	S	*	*				140.2	121.1	104.5	-76.4	-44.2	0	0	0	114.7
2086	N	30.9	Very low	31.2	Very low	124 Å²	124	127.5 Å²	127.5	66%	0.663	72%	0.715	S	S	*	*				62.1	119.1	95.9	-67.2	-8	0	0	0	117.5
2087	N	30.2	Very low	31.2	Very low	127.5 Å²	127.5	126.5 Å²	126.5	68%	0.682	71%	0.709	S	S	*	*				110	119.9	119.6	-75.9	-12.7	0	0	0	119.1
2088	I	28.5	Very low	31.5	Very low	140.25 Å²	140.25	126.4 Å²	126.4	72%	0.719	71%	0.708	S	S	*	*				88.5	155.5	117.5	-62.8	159.8	0	0	0	115.6
2089	I	31.1	Very low	31.7	Very low	144.5 Å²	144.5	128.5 Å²	128.5	74%	0.741	71%	0.708	S	S	*	*			trans	85	111.6	162.7	-54.3	178.5	0	0	0	115.7	C2091	I2089-C2091 HydrophobicContact CG2-CB 4.06Å; I2089-C2091 WeakPolarHBondContact CG2-SG 3.32Å
2090	N	27.3	Very low	31.8	Very low	140 Å²	140	132.5 Å²	132.5	75%	0.749	71%	0.714	S	S	*	*			trans	-92.9	165.2	150.4	-120.7	24.3	0	0	0	110.9
2091	C	28.9	Very low	31.8	Very low	99.75 Å²	99.75	133.3 Å²	133.3	67%	0.674	72%	0.718	S	S	*	*			trans	-172	110.8	146.5	-3.1	0	0	0	0	112.9	I2089 D2093	I2089-C2091 HydrophobicContact CG2-CB 4.06Å; I2089-C2091 WeakPolarHBondContact CG2-SG 3.32Å; C2091-D2093 PolarHBondContact O-N 2.85Å
2092	D	28.9	Very low	32.1	Very low	154.5 Å²	154.5	135.7 Å²	135.7	83%	0.826	72%	0.721	S	S	*	*			trans	52.3	131.2	140.4	-71.2	-28.4	0	0	0	115.9
2093	D	34.1	Very low	32.2	Very low	133 Å²	133	135.6 Å²	135.6	71%	0.711	72%	0.723	S	S	*	*			trans	142.5	145.3	150.7	-139	0.3	0	0	0	116.5	C2091	C2091-D2093 PolarHBondContact O-N 2.85Å
2094	Q	30.2	Very low	32.3	Very low	167.25 Å²	167.25	138.8 Å²	138.8	78%	0.782	73%	0.73	S	S	*	*			trans	65.7	106.3	151.6	-53	-62	-29.7	0	0	117.9
2095	G	29.7	Very low	32.4	Very low	74 Å²	74	136.9 Å²	136.9	76%	0.763	73%	0.73	S	S	*	*			trans	133	95.2	143.4	0	0	0	0	0	119.9	I2097	G2095-I2097 PolarHBondContact O-N 3.13Å
2096	E	29	Very low	32.4	Very low	179.75 Å²	179.75	137.4 Å²	137.4	84%	0.84	74%	0.737	S	S	*	*			trans	-20	115.6	151.2	-161.9	172.6	-155.2	0	0	116.8
2097	I	34.7	Very low	32.7	Very low	135 Å²	135	136.8 Å²	136.8	69%	0.692	74%	0.74	S	S	*	*				69.2	114.4	117.3	-62.7	170.4	0	0	0	116.7	G2095 K2099	G2095-I2097 PolarHBondContact O-N 3.13Å; I2097-K2099 HydrophobicContact CG2-CD 3.79Å; I2097-K2099 HydrophobicContact CG2-CG 4.12Å
2098	T	36.8	Very low	32.9	Very low	108.5 Å²	108.5	136.9 Å²	136.9	67%	0.666	74%	0.741	S	S	*	*			trans	-97	142.9	138.4	43.3	0	0	0	0	117
2099	K	37.6	Very low	33.3	Very low	166.25 Å²	166.25	136.2 Å²	136.2	72%	0.723	74%	0.738	S	S	*	*				137	143.5	96.2	-86.4	145.1	-166.8	160.6	0	113.3	I2097	I2097-K2099 HydrophobicContact CG2-CD 3.79Å; I2097-K2099 HydrophobicContact CG2-CG 4.12Å
2100	K	38.5	Very low	33.6	Very low	191.25 Å²	191.25	135 Å²	135	83%	0.832	73%	0.733	S	S	*	*			trans	121	155.9	130.6	-77.3	-178.6	179.2	178.6	0	113.5
2101	T	36.4	Very low	33.9	Very low	114 Å²	114	134.5 Å²	134.5	70%	0.699	73%	0.731	S	S	*	*			cis	-172	158.5	20.7	-87.1	0	0	0	0	112.7
2102	I	37.4	Very low	34.3	Very low	142.5 Å²	142.5	136.5 Å²	136.5	73%	0.731	74%	0.735	S	S	*	*				79.2	133.8	95.4	-65.7	174.1	0	0	0	114.8
2103	N	32.2	Very low	34.6	Very low	132.75 Å²	132.75	136.3 Å²	136.3	71%	0.71	73%	0.726	S	S	*	*			trans	-74.4	142	151.2	-71	-9.4	0	0	0	113.8
2104	Q	33.8	Very low	34.6	Very low	166.5 Å²	166.5	138.7 Å²	138.7	78%	0.778	73%	0.727	S	S	*	*				134.4	164.6	100.4	-92.8	-174.5	51.3	0	0	116.4
2105	T	33.5	Very low	34.8	Very low	118 Å²	118	137.8 Å²	137.8	72%	0.724	73%	0.726	S	S	*	*			trans	138.1	122.2	161.8	8.4	0	0	0	0	117.5
2106	T	31.1	Very low	35	Very low	125.5 Å²	125.5	139.2 Å²	139.2	77%	0.77	72%	0.723	S	S	*	*			trans	-13.5	156	135.1	17.1	0	0	0	0	115.7
2107	P	37.4	Very low	35.3	Very low	112.5 Å²	112.5	137.4 Å²	137.4	73%	0.731	72%	0.72	S	S	*	*			cis	-138.1	168.3	-8.1	35	-15.2	0	0	0	114.4
2108	N	33.2	Very low	35.3	Very low	130 Å²	130	135.9 Å²	135.9	70%	0.695	72%	0.721	S	S	*	*				73.4	127.5	128.7	-155.7	23.7	0	0	0	119.2	N2110	N2108-N2110 PolarHBondContact OD1-ND2 2.69Å
2109	N	36.6	Very low	35.2	Very low	124.25 Å²	124.25	134 Å²	134	66%	0.664	72%	0.723	S	S	*	*			trans	99.3	136.5	147.9	-91.2	-34.6	0	0	0	117.5	N2111	N2109-N2111 PolarHBondContact OD1-ND2 2.88Å
2110	N	37.8	Very low	35.2	Very low	119.25 Å²	119.25	133 Å²	133	64%	0.638	73%	0.726	S	S	*	*				88.1	132.4	89.3	-72.5	-15.9	0	0	0	117.4	N2108	N2108-N2110 PolarHBondContact OD1-ND2 2.69Å
2111	N	34.7	Very low	35	Very low	130.25 Å²	130.25	130.9 Å²	130.9	70%	0.697	72%	0.723	S	S	*	*			trans	92.1	134.2	131.6	-63.4	-32.2	0	0	0	118.3	N2109	N2109-N2111 PolarHBondContact OD1-ND2 2.88Å
2112	N	37.4	Very low	35	Very low	142 Å²	142	130.7 Å²	130.7	76%	0.759	73%	0.727	S	S	*	*			trans	93.8	137.2	140.2	-70	-41	0	0	0	117.7
2113	K	34.1	Very low	34.9	Very low	149 Å²	149	130.4 Å²	130.4	65%	0.648	73%	0.732	S	S	*	*			cis	139.1	145.6	34.2	-158.9	177.7	176.5	-164.4	0	114
2114	Y	34.6	Very low	35	Very low	184 Å²	184	128 Å²	128	72%	0.722	73%	0.73	S	S	*	*			trans	66.7	148.2	165.5	-55.1	-59.7	0	0	0	118.1
2115	L	34.6	Very low	34.9	Very low	148.25 Å²	148.25	124.7 Å²	124.7	78%	0.776	73%	0.731	S	S	*	*			cis	151.1	144.2	27.9	-154.5	59.9	0	0	0	111.9
2116	C	33.4	Very low	35	Very low	103.5 Å²	103.5	127.4 Å²	127.4	70%	0.699	73%	0.733	S	S	*	*				-134.7	161.8	99.5	55.4	0	0	0	0	114.7
2117	D	34.8	Very low	35.2	Very low	142.25 Å²	142.25	130.4 Å²	130.4	76%	0.761	74%	0.736	S	S	*	*				155.1	157.3	71.8	-144	-23.5	0	0	0	115.5
2118	S	35.2	Very low	35	Very low	103.75 Å²	103.75	129.8 Å²	129.8	73%	0.726	73%	0.734	S	S	*	*			trans	43.1	128.5	164.3	-59.2	0	0	0	0	119.4
2119	G	35.9	Very low	35.1	Very low	68.75 Å²	68.75	133.4 Å²	133.4	71%	0.709	74%	0.744	S	S	*	*			trans	158.6	92.3	153.9	0	0	0	0	0	117.4
2120	N	36.2	Very low	35	Very low	144.25 Å²	144.25	132.2 Å²	132.2	77%	0.771	75%	0.745	S	S	*	*				87.8	138.7	111.8	-7	18.2	0	0	0	113.7
2121	D	35.6	Very low	35	Very low	147 Å²	147	134.4 Å²	134.4	79%	0.786	76%	0.756	S	S	*	*				-125.2	157.2	-78.1	-87	-57.9	0	0	0	115.7
2122	S	35.4	Very low	35.1	Very low	111.25 Å²	111.25	131.9 Å²	131.9	78%	0.778	75%	0.754	S	S	*	*			trans	57.9	125.2	154	172.6	0	0	0	0	117.4
2123	V	35.5	Very low	35.2	Very low	136 Å²	136	133.5 Å²	133.5	82%	0.824	76%	0.756	S	S	*	*				-133.2	152	75.1	-167.1	0	0	0	0	110.9
2124	A	33.6	Very low	35.6	Very low	81 Å²	81	133.8 Å²	133.8	67%	0.669	77%	0.765	S	S	*	*			trans	3.1	120.7	168.3	0	0	0	0	0	117.7	K2126	A2124-K2126 HydrophobicContact CB-CB 4.18Å; A2124-K2126 HydrophobicContact CB-CD 4.11Å
2125	A	33.2	Very low	35.8	Very low	98.25 Å²	98.25	131.3 Å²	131.3	81%	0.812	76%	0.764	S	S	*	*				58.5	98	101	0	0	0	0	0	114
2126	K	35.5	Very low	36.3	Very low	174.25 Å²	174.25	131.4 Å²	131.4	76%	0.758	77%	0.765	S	S	*	*			trans	-167.7	148.5	130.7	-95.3	151.4	179.6	176	0	110.9	A2124	A2124-K2126 HydrophobicContact CB-CB 4.18Å; A2124-K2126 HydrophobicContact CB-CD 4.11Å
2127	F	34.4	Very low	36.5	Very low	189 Å²	189	135.5 Å²	135.5	83%	0.829	77%	0.771	S	S	*	*			trans	58.8	114.6	152.6	-56.8	-67.7	0	0	0	114.8
2128	S	34	Very low	36.7	Very low	100.25 Å²	100.25	138.4 Å²	138.4	70%	0.701	77%	0.771	S	S	*	*				76.7	134.4	60.8	-58.6	0	0	0	0	109.9
2129	K	35.3	Very low	36.9	Very low	204.5 Å²	204.5	139 Å²	139	89%	0.889	77%	0.767	S	S	*	*				54.6	88.6	105.2	-89.3	177.8	-177.3	179.7	0	113
2130	S	32.9	Very low	37.1	Very low	99.25 Å²	99.25	141.7 Å²	141.7	69%	0.694	77%	0.771	S	S	*	*			trans	143	106.7	153.4	68.7	0	0	0	0	113.9
2131	L	38.1	Very low	37.6	Very low	166.5 Å²	166.5	140.6 Å²	140.6	87%	0.872	77%	0.77	S	S	*	*				165.3	130.9	79.4	-133.2	74	0	0	0	107.1
2132	A	37.7	Very low	38.1	Very low	77.75 Å²	77.75	137.2 Å²	137.2	64%	0.643	76%	0.762	S	S	*	*				79.7	137.6	50.2	0	0	0	0	0	112.6	D2134	A2132-D2134 PolarHBondContact O-N 3.36Å
2133	E	40.1	Very low	38.7	Very low	174.75 Å²	174.75	139.7 Å²	139.7	82%	0.817	77%	0.766	S	S	*	*			trans	60.7	86.6	148.1	-64.3	-176.4	-163.3	0	0	116.1	N2135	E2133-N2135 PolarHBondContact O-N 3.49Å
2134	D	41.5	Very low	39.4	Very low	156.25 Å²	156.25	137.9 Å²	137.9	84%	0.836	76%	0.757	S	S	*	*				-136.5	112.7	115.6	-109.4	-41.2	0	0	0	112.3	A2132	A2132-D2134 PolarHBondContact O-N 3.36Å
2135	N	38.9	Very low	40.3	Very low	129.75 Å²	129.75	139.4 Å²	139.4	69%	0.694	76%	0.76	S	S	*	*			trans	-106.8	-174.9	174.9	-77.9	-69.6	0	0	0	113.2	E2133 F2137	E2133-N2135 PolarHBondContact O-N 3.49Å; N2135-F2137 VanDerWaalsContact C-N 3.32Å; N2135-F2137 PolarHBondContact O-N 2.9Å
2136	L	44.7	Very low	41.4	Very low	151.25 Å²	151.25	139.8 Å²	139.8	79%	0.792	75%	0.754	S	S	*	*			trans	47.2	89.3	174.8	-65.9	114.3	0	0	0	115.3
2137	F	37.3	Very low	42.1	Very low	189.25 Å²	189.25	140.7 Å²	140.7	83%	0.83	76%	0.758	S	S	*	*				-142.9	120.1	81.6	-121.8	-95.9	0	0	0	113.8	N2135	N2135-F2137 VanDerWaalsContact C-N 3.32Å; N2135-F2137 PolarHBondContact O-N 2.9Å
2138	R	39.3	Very low	42.8	Very low	203.25 Å²	203.25	141.3 Å²	141.3	77%	0.767	76%	0.76	S	S	*	*			trans	-87.9	134.2	177.4	-69.1	171	169.2	-109.4	-0.2	112.5	P2140	R2138-P2140 WeakPolarHBondContact O-CD 3.49Å
2139	N	39.1	Very low	43.4	Very low	117.5 Å²	117.5	145.1 Å²	145.1	63%	0.628	77%	0.769	S	S	*	*				-134.9	116.5	119.4	-172.1	-9.9	0	0	0	111.3	T2141 A2142	N2139-T2141 PolarHBondContact O-N 3.13Å; N2139-T2141 VanDerWaalsContact O-N 3.12Å; N2139-T2141 VanDerWaalsContact OD1-CB 3.24Å; N2139-T2141 WeakPolarHBondContact OD1-CB 3.48Å; N2139-T2141 PolarHBondContact OD1-N 2.96Å; N2139-T2141 VanDerWaalsContact OD1-N 3.09Å; N2139-T2141 PolarHBondContact OD1-OG1 3.21Å; N2139-A2142 HydrophobicContact CB-CB 3.8Å; N2139-A2142 PolarHBondContact O-N 3.16Å; N2139-A2142 VanDerWaalsContact O-N 3.14Å
2140	P	41.7	Very low	44.1	Very low	124.75 Å²	124.75	145.2 Å²	145.2	81%	0.81	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	28.4	-178.5	33	-32.8	0	0	0	114.1	R2138	R2138-P2140 WeakPolarHBondContact O-CD 3.49Å
2141	T	46.6	Very low	45.1	Very low	120.5 Å²	120.5	145.5 Å²	145.5	74%	0.739	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.3	22.2	177.3	-14.9	0	0	0	0	112.8	N2139 L2143	N2139-T2141 PolarHBondContact O-N 3.13Å; N2139-T2141 VanDerWaalsContact O-N 3.12Å; N2139-T2141 VanDerWaalsContact OD1-CB 3.24Å; N2139-T2141 WeakPolarHBondContact OD1-CB 3.48Å; N2139-T2141 PolarHBondContact OD1-N 2.96Å; N2139-T2141 VanDerWaalsContact OD1-N 3.09Å; N2139-T2141 PolarHBondContact OD1-OG1 3.21Å; T2141-L2143 PolarHBondContact O-N 3.04Å
2142	A	44.2	Very low	46.1	Very low	75.75 Å²	75.75	146.5 Å²	146.5	63%	0.626	77%	0.769	S	S	*	*			trans	-92.3	88.2	175.5	0	0	0	0	0	112.4	N2139	N2139-A2142 HydrophobicContact CB-CB 3.8Å; N2139-A2142 PolarHBondContact O-N 3.16Å; N2139-A2142 VanDerWaalsContact O-N 3.14Å
2143	L	49.7	Very low	47.1	Very low	164.75 Å²	164.75	148.4 Å²	148.4	86%	0.863	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-66.8	127.3	166.9	-75.1	171.8	0	0	0	109.5	T2141	T2141-L2143 PolarHBondContact O-N 3.04Å
2144	P	50.1	Low	48.3	Very low	97 Å²	97	144.1 Å²	144.1	63%	0.63	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-65.2	137.2	173.5	16.5	-17.7	0	0	0	109.4
2145	P	52.6	Low	49	Very low	112.75 Å²	112.75	142.6 Å²	142.6	73%	0.732	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-61.1	136.1	-179.7	25	-33.9	0	0	0	109.9	K2147	P2145-K2147 PolarHBondContact O-N 3.23Å
2146	P	55.1	Low	50.1	Low	106 Å²	106	143.6 Å²	143.6	69%	0.688	77%	0.772	S	S	*	*			trans	-62.7	113.9	-171.5	23.4	-33.1	0	0	0	110	K2148 L2339	P2146-K2148 VanDerWaalsContact C-N 3.3Å; P2146-K2148 PolarHBondContact O-N 3.03Å; P2146-L2339 HydrophobicContact CB-CD1 4.36Å; P2146-L2339 HydrophobicContact CG-CD1 4Å
2147	K	51	Low	50.7	Low	193 Å²	193	141.5 Å²	141.5	84%	0.839	77%	0.77	S	S	*	*			trans	-59.1	111.7	176.6	-70	-178.5	-179.9	177.4	0	107.5	P2145 M2149	P2145-K2147 PolarHBondContact O-N 3.23Å; K2147-M2149 VanDerWaalsContact C-N 3.29Å; K2147-M2149 PolarHBondContact O-N 3.02Å
2148	K	48.1	Very low	51.8	Low	202.25 Å²	202.25	138.5 Å²	138.5	88%	0.879	76%	0.761	S	S	*	*			trans	-59.8	103	178.3	-70.8	-177.2	178.8	177.7	0	108.4	P2146 K2150	P2146-K2148 VanDerWaalsContact C-N 3.3Å; P2146-K2148 PolarHBondContact O-N 3.03Å; K2148-K2150 VanDerWaalsContact C-N 3.3Å; K2148-K2150 PolarHBondContact O-N 3.22Å
2149	M	48.3	Very low	52.6	Low	180.25 Å²	180.25	133.3 Å²	133.3	89%	0.888	75%	0.754	S	S	*	*			trans	-67	108.8	175.5	-74.3	179.6	66.9	0	0	107.1	K2147 S2151	K2147-M2149 VanDerWaalsContact C-N 3.29Å; K2147-M2149 PolarHBondContact O-N 3.02Å; M2149-S2151 VanDerWaalsContact C-N 3.29Å; M2149-S2151 PolarHBondContact O-N 2.93Å
2150	K	49.2	Very low	53.3	Low	207.25 Å²	207.25	132.9 Å²	132.9	90%	0.901	76%	0.758	S	S	*	*			trans	-69	100.1	179.6	-150.3	163.5	-174.5	171.3	0	106.6	K2148 K2152	K2148-K2150 VanDerWaalsContact C-N 3.3Å; K2148-K2150 PolarHBondContact O-N 3.22Å; K2150-K2152 PolarHBondContact O-N 3.06Å
2151	S	53.7	Low	53.7	Low	105.25 Å²	105.25	133.9 Å²	133.9	74%	0.736	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-57.6	121.6	-169.9	168.8	0	0	0	0	109.4	M2149 P2153	M2149-S2151 VanDerWaalsContact C-N 3.29Å; M2149-S2151 PolarHBondContact O-N 2.93Å; S2151-P2153 VanDerWaalsContact O-CD 3.27Å; S2151-P2153 WeakPolarHBondContact O-CD 3.21Å; S2151-P2153 VanDerWaalsContact O-N 3.15Å
2152	K	58.4	Low	53.8	Low	187.25 Å²	187.25	134.5 Å²	134.5	81%	0.814	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-59.9	125.8	165.4	-69.8	-179.8	179	177.7	0	105.8	K2150 A2154	K2150-K2152 PolarHBondContact O-N 3.06Å; K2152-A2154 PolarHBondContact O-N 3.11Å
2153	P	60.6	Low	53.8	Low	118 Å²	118	133.2 Å²	133.2	77%	0.766	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-55	136.4	174.9	12.8	-17.9	0	0	0	108.4	S2151	S2151-P2153 VanDerWaalsContact O-CD 3.27Å; S2151-P2153 WeakPolarHBondContact O-CD 3.21Å; S2151-P2153 VanDerWaalsContact O-N 3.15Å
2154	A	63.2	Low	53.8	Low	84 Å²	84	129.9 Å²	129.9	69%	0.694	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-55	138.9	-179.8	0	0	0	0	0	109.3	K2152 I2156	K2152-A2154 PolarHBondContact O-N 3.11Å; A2154-I2156 PolarHBondContact O-N 3.14Å; A2154-I2156 VanDerWaalsContact O-N 3.15Å
2155	P	57.6	Low	53.5	Low	124 Å²	124	131.7 Å²	131.7	81%	0.805	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-55.5	128.1	178.9	12.4	-18.2	0	0	0	109.1	S2157	P2155-S2157 VanDerWaalsContact C-N 3.32Å; P2155-S2157 PolarHBondContact O-N 3.14Å
2156	I	61.8	Low	53.4	Low	151 Å²	151	133.5 Å²	133.5	77%	0.774	75%	0.752	S	S	*	*			trans	-65.3	103.3	-179.3	-63.2	176.6	0	0	0	107.2	A2154 I2158	A2154-I2156 PolarHBondContact O-N 3.14Å; A2154-I2156 VanDerWaalsContact O-N 3.15Å; I2156-I2158 VanDerWaalsContact C-N 3.3Å; I2156-I2158 HydrophobicContact CG2-CG1 4.13Å; I2156-I2158 PolarHBondContact O-N 3.16Å; I2156-I2158 VanDerWaalsContact O-N 3.07Å
2157	S	57.6	Low	53	Low	108.5 Å²	108.5	132.9 Å²	132.9	76%	0.759	75%	0.75	S	S	*	*			trans	-71.4	86.8	174.4	-179.3	0	0	0	0	108.7	P2155 P2159	P2155-S2157 VanDerWaalsContact C-N 3.32Å; P2155-S2157 PolarHBondContact O-N 3.14Å; S2157-P2159 VanDerWaalsContact O-CD 3.31Å; S2157-P2159 WeakPolarHBondContact O-CD 3.32Å
2158	I	60.3	Low	53.1	Low	125.75 Å²	125.75	133.1 Å²	133.1	65%	0.645	75%	0.746	S	S	*	*			trans	-66.2	116.1	169.4	-57.6	176.4	0	0	0	106.4	I2156 Q2161	I2156-I2158 VanDerWaalsContact C-N 3.3Å; I2156-I2158 HydrophobicContact CG2-CG1 4.13Å; I2156-I2158 PolarHBondContact O-N 3.16Å; I2156-I2158 VanDerWaalsContact O-N 3.07Å; I2158-Q2161 HydrophobicContact CG2-CG 4.33Å
2159	P	55.8	Low	53.1	Low	93.75 Å²	93.75	130.5 Å²	130.5	61%	0.609	74%	0.741	S	S	*	*			trans	-60.2	140.7	175.9	-21.4	33.6	0	0	0	109.7	S2157 Q2161	S2157-P2159 VanDerWaalsContact O-CD 3.31Å; S2157-P2159 WeakPolarHBondContact O-CD 3.32Å; P2159-Q2161 PolarHBondContact O-N 2.94Å
2160	P	54.2	Low	53.1	Low	109.75 Å²	109.75	132.8 Å²	132.8	71%	0.713	74%	0.74	S	S	*	*			trans	-56.5	127.7	170.9	25.5	-33.4	0	0	0	108.5	T2162	P2160-T2162 VanDerWaalsContact C-N 3.35Å; P2160-T2162 PolarHBondContact O-N 3.29Å
2161	Q	50.5	Low	53.1	Low	145.5 Å²	145.5	127.8 Å²	127.8	68%	0.68	73%	0.731	S	S	*	*			trans	-72.7	76.4	-165	-69.4	-174.8	-8.9	0	0	112.9	I2158 P2159 G2163	I2158-Q2161 HydrophobicContact CG2-CG 4.33Å; P2159-Q2161 PolarHBondContact O-N 2.94Å; Q2161-G2163 PolarHBondContact O-N 2.87Å
2162	T	47.4	Very low	52.8	Low	133.75 Å²	133.75	128.3 Å²	128.3	82%	0.821	73%	0.731	S	S	*	*			trans	-73	75.6	171.7	52.3	0	0	0	0	110.8	P2160	P2160-T2162 VanDerWaalsContact C-N 3.35Å; P2160-T2162 PolarHBondContact O-N 3.29Å
2163	G	45	Very low	52.7	Low	48.25 Å²	48.25	129.4 Å²	129.4	50%	0.497	73%	0.731	S	S	.	*	S	Bend	trans	104.8	111.5	164.6	0	0	0	0	0	117	Q2161 N2165	Q2161-G2163 PolarHBondContact O-N 2.87Å; G2163-N2165 VanDerWaalsContact C-N 3.32Å; G2163-N2165 PolarHBondContact O-N 3.05Å; G2163-N2165 VanDerWaalsContact O-N 3.1Å; G2163-N2165 PolarHBondContact O-ND2 2.83Å
2164	A	48.6	Very low	52.4	Low	94.5 Å²	94.5	129.9 Å²	129.9	78%	0.781	73%	0.731	S	S	*	*	S	Bend	trans	66.7	40.4	156.4	0	0	0	0	0	118.2	L2166	A2164-L2166 PolarHBondContact O-N 2.73Å
2165	N	44.3	Very low	52	Low	135.25 Å²	135.25	133.5 Å²	133.5	72%	0.723	73%	0.727	S	S	*	*			trans	-126.2	49.1	168.5	-75.9	-59.1	0	0	0	115.4	G2163 S2167	G2163-N2165 VanDerWaalsContact C-N 3.32Å; G2163-N2165 PolarHBondContact O-N 3.05Å; G2163-N2165 VanDerWaalsContact O-N 3.1Å; G2163-N2165 PolarHBondContact O-ND2 2.83Å; N2165-S2167 PolarHBondContact O-N 3.2Å
2166	L	51	Low	51.7	Low	150.25 Å²	150.25	132.1 Å²	132.1	79%	0.787	72%	0.72	S	S	*	*			trans	-63.8	136.6	164.9	-68.1	174.3	0	0	0	111	A2164 R2168	A2164-L2166 PolarHBondContact O-N 2.73Å; L2166-R2168 VanDerWaalsContact C-N 3.31Å; L2166-R2168 PolarHBondContact O-N 3.05Å
2167	S	46.3	Very low	51.1	Low	92.75 Å²	92.75	130.3 Å²	130.3	65%	0.649	72%	0.721	S	S	*	*			trans	-48.9	89.1	174.8	52.1	0	0	0	0	114.2	N2165 L2169 R2170	N2165-S2167 PolarHBondContact O-N 3.2Å; S2167-L2169 PolarHBondContact O-N 3.07Å; S2167-R2170 PolarHBondContact O-N 2.96Å; S2167-R2170 VanDerWaalsContact O-N 3.09Å
2168	R	52.9	Low	51	Low	198.75 Å²	198.75	134.7 Å²	134.7	75%	0.75	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	15.8	172.6	-66.5	-178	122.9	169.7	-2.1	114.4	L2166 R2170 Q2200	L2166-R2168 VanDerWaalsContact C-N 3.31Å; L2166-R2168 PolarHBondContact O-N 3.05Å; R2168-R2170 CarbonylContact O-C 3.55Å; R2168-R2170 PolarHBondContact O-N 3.44Å; R2168-Q2200 PolarHBondContact NH1-O 3.46Å
2169	L	48.2	Very low	50.3	Low	146 Å²	146	138.9 Å²	138.9	76%	0.764	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.5	38.9	177	-64	176.9	0	0	0	111.3	S2167 M2194	S2167-L2169 PolarHBondContact O-N 3.07Å; L2169-M2194 HydrophobicContact CD1-CE 3.88Å; L2169-M2194 HydrophobicContact CD1-SD 4.18Å; L2169-M2194 HydrophobicContact CD2-CG 4.18Å; L2169-M2194 HydrophobicContact CD2-SD 3.86Å
2170	R	48.4	Very low	49.7	Very low	228.5 Å²	228.5	139.5 Å²	139.5	86%	0.862	74%	0.741	S	S	*	*	S	Bend	trans	-152.6	93.3	169.7	-76.2	179.9	179.7	-173.7	-0.9	112.5	S2167 R2168 P2172	S2167-R2170 PolarHBondContact O-N 2.96Å; S2167-R2170 VanDerWaalsContact O-N 3.09Å; R2168-R2170 CarbonylContact O-C 3.55Å; R2168-R2170 PolarHBondContact O-N 3.44Å; R2170-P2172 WeakPolarHBondContact O-CD 3.12Å; R2170-P2172 VanDerWaalsContact O-N 3.09Å
2171	S	49.9	Very low	49.4	Very low	104 Å²	104	138.3 Å²	138.3	73%	0.727	74%	0.735	S	S	*	*	S	Bend	trans	-129.5	138.3	152.9	87	0	0	0	0	111.8	R2173	S2171-R2173 PolarHBondContact O-N 3.15Å; S2171-R2173 VanDerWaalsContact O-N 3.07Å
2172	P	46.7	Very low	49.6	Very low	113.75 Å²	113.75	139.7 Å²	139.7	74%	0.739	75%	0.746	S	S	*	*			trans	-56.6	131.9	167.1	-23.6	34.9	0	0	0	109.8	R2170 V2174	R2170-P2172 WeakPolarHBondContact O-CD 3.12Å; R2170-P2172 VanDerWaalsContact O-N 3.09Å; P2172-V2174 PolarHBondContact O-N 3.17Å; P2172-V2174 VanDerWaalsContact O-N 3.13Å
2173	R	56	Low	50	Low	212.25 Å²	212.25	140.7 Å²	140.7	80%	0.801	75%	0.746	S	S	*	*			trans	-78.6	97.2	-176	-157.7	179.8	-167	163.2	2.6	109.2	S2171 W2175	S2171-R2173 PolarHBondContact O-N 3.15Å; S2171-R2173 VanDerWaalsContact O-N 3.07Å; R2173-W2175 PolarHBondContact O-N 2.87Å; R2173-W2175 VanDerWaalsContact O-N 3.11Å
2174	V	55.1	Low	50.4	Low	128.25 Å²	128.25	142.2 Å²	142.2	78%	0.777	75%	0.749	S	S	*	*			trans	-52.5	109	176.2	-177.6	0	0	0	0	109.5	P2172 S2176	P2172-V2174 PolarHBondContact O-N 3.17Å; P2172-V2174 VanDerWaalsContact O-N 3.13Å; V2174-S2176 PolarHBondContact O-N 3.14Å; V2174-S2176 VanDerWaalsContact O-N 3.09Å
2175	W	54.4	Low	50.8	Low	158 Å²	158	142.4 Å²	142.4	60%	0.598	75%	0.745	S	S	*	*			trans	-80.2	102.7	178.3	-123	-52.9	0	0	0	109.2	R2173 S2177 P2186	R2173-W2175 PolarHBondContact O-N 2.87Å; R2173-W2175 VanDerWaalsContact O-N 3.11Å; W2175-S2177 PolarHBondContact O-N 2.88Å; W2175-S2177 PolarHBondContact O-OG 2.85Å; W2175-P2186 HydrophobicContact CH2-CB 4.31Å; W2175-P2186 VanDerWaalsContact CH2-CD 3.46Å; W2175-P2186 HydrophobicContact CH2-CG 3.66Å; W2175-P2186 HydrophobicContact CZ2-CB 3.9Å; W2175-P2186 HydrophobicContact CZ2-CG 3.92Å; W2175-P2186 HydrophobicContact CZ3-CG 4.2Å
2176	S	51.8	Low	51.7	Low	96.25 Å²	96.25	140 Å²	140	67%	0.673	74%	0.737	S	S	*	*			trans	-62.3	117.3	176.8	35.6	0	0	0	0	110.5	V2174 K2178 R2179	V2174-S2176 PolarHBondContact O-N 3.14Å; V2174-S2176 VanDerWaalsContact O-N 3.09Å; S2176-K2178 PolarHBondContact O-N 3.24Å; S2176-R2179 PolarHBondContact O-N 2.86Å
2177	S	49.7	Very low	52.4	Low	112 Å²	112	137.8 Å²	137.8	78%	0.783	73%	0.731	S	S	*	*	S	Bend	trans	-68.5	43.5	-171.5	-44.7	0	0	0	0	114.5	W2175 R2179 S2180	W2175-S2177 PolarHBondContact O-N 2.88Å; W2175-S2177 PolarHBondContact O-OG 2.85Å; S2177-R2179 VanDerWaalsContact C-N 3.34Å; S2177-S2180 PolarHBondContact O-OG 3.1Å; S2177-S2180 VanDerWaalsContact O-OG 3.13Å
2178	K	54.2	Low	53.4	Low	201.25 Å²	201.25	138.5 Å²	138.5	88%	0.875	73%	0.734	S	S	*	*			trans	-117	45.7	175	-67.6	-169.5	176.6	-177.3	0	113.1	S2176	S2176-K2178 PolarHBondContact O-N 3.24Å
2179	R	45.6	Very low	54.1	Low	215 Å²	215	138.6 Å²	138.6	81%	0.811	74%	0.736	S	S	*	*			trans	-173.2	82.9	161.5	-119.3	173.7	-125.8	-119.8	-1.6	113.5	S2176 S2177 S2181	S2176-R2179 PolarHBondContact O-N 2.86Å; S2177-R2179 VanDerWaalsContact C-N 3.34Å; R2179-S2181 VanDerWaalsContact C-N 3.26Å; R2179-S2181 PolarHBondContact O-N 3.21Å
2180	S	43.1	Very low	55.2	Low	106.25 Å²	106.25	136.8 Å²	136.8	74%	0.743	73%	0.731	S	S	*	*			trans	-57.1	78.7	171.7	41.8	0	0	0	0	114.4	S2177 L2182	S2177-S2180 PolarHBondContact O-OG 3.1Å; S2177-S2180 VanDerWaalsContact O-OG 3.13Å; S2180-L2182 VanDerWaalsContact C-N 3.27Å; S2180-L2182 PolarHBondContact O-N 3.34Å
2181	S	47.6	Very low	56.1	Low	84.75 Å²	84.75	130.2 Å²	130.2	59%	0.593	72%	0.717	S	S	*	*			trans	-135.7	94.7	160.1	51.1	0	0	0	0	110.3	R2179 N2183	R2179-S2181 VanDerWaalsContact C-N 3.26Å; R2179-S2181 PolarHBondContact O-N 3.21Å; S2181-N2183 VanDerWaalsContact C-N 3.25Å; S2181-N2183 PolarHBondContact O-N 3.07Å
2182	L	55.1	Low	57	Low	174.75 Å²	174.75	128.9 Å²	128.9	92%	0.915	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	11.1	-171.7	-77.7	109.6	0	0	0	116.5	S2180	S2180-L2182 VanDerWaalsContact C-N 3.27Å; S2180-L2182 PolarHBondContact O-N 3.34Å
2183	N	56.5	Low	58.2	Low	153.75 Å²	153.75	128 Å²	128	82%	0.822	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.2	11.2	-168.9	-38.1	33.4	0	0	0	113.9	S2181 S2185	S2181-N2183 VanDerWaalsContact C-N 3.25Å; S2181-N2183 PolarHBondContact O-N 3.07Å; N2183-S2185 PolarHBondContact O-N 3.14Å
2184	S	52.6	Low	58.7	Low	79 Å²	79	125.6 Å²	125.6	55%	0.552	70%	0.7	S	S	*	*			trans	-110.2	95.1	179.6	169.3	0	0	0	0	111.8
2185	S	58.5	Low	59.3	Low	100.25 Å²	100.25	124.8 Å²	124.8	70%	0.701	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-62.5	140.2	161.5	61.5	0	0	0	0	109.5	N2183	N2183-S2185 PolarHBondContact O-N 3.14Å
2186	P	63.1	Low	59.9	Low	84 Å²	84	120 Å²	120	55%	0.545	68%	0.682	S	S	.	*	P	Polyproline II helix	trans	-60.7	143.7	171.6	27.1	-34.3	0	0	0	109.7	W2175	W2175-P2186 HydrophobicContact CH2-CB 4.31Å; W2175-P2186 VanDerWaalsContact CH2-CD 3.46Å; W2175-P2186 HydrophobicContact CH2-CG 3.66Å; W2175-P2186 HydrophobicContact CZ2-CB 3.9Å; W2175-P2186 HydrophobicContact CZ2-CG 3.92Å; W2175-P2186 HydrophobicContact CZ3-CG 4.2Å
2187	P	64.9	Low	60.4	Low	104 Å²	104	120 Å²	120	68%	0.675	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-57.8	138.2	173.4	0.7	0.4	0	0	0	110.1	Y2189	P2187-Y2189 PolarHBondContact O-N 3.2Å
2188	P	66.9	Low	61.1	Low	108.25 Å²	108.25	120.3 Å²	120.3	70%	0.703	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-58.3	134.2	-178.7	23.5	-33.4	0	0	0	110.3	T2190	P2188-T2190 VanDerWaalsContact C-N 3.32Å; P2188-T2190 PolarHBondContact O-N 2.98Å
2189	Y	67.3	Low	61.6	Low	200.5 Å²	200.5	117.8 Å²	117.8	79%	0.786	66%	0.662	S	S	*	*			trans	-62.1	27	-177.4	179	-103	0	0	0	111.1	P2187 P2191 P2192	P2187-Y2189 PolarHBondContact O-N 3.2Å; Y2189-P2191 HydrophobicContact CE1-CB 4.26Å; Y2189-P2191 HydrophobicContact CE1-CG 4.4Å; Y2189-P2191 VanDerWaalsContact O-CD 3.28Å; Y2189-P2191 WeakPolarHBondContact O-CD 3.33Å; Y2189-P2192 VanDerWaalsContact OH-CD 3.31Å; Y2189-P2192 WeakPolarHBondContact OH-CD 3.2Å
2190	T	72.1	Confident	62.4	Low	108 Å²	108	116.1 Å²	116.1	66%	0.663	66%	0.663	S	S	*	*	S	Bend	trans	-77.5	116.5	173	-47.5	0	0	0	0	109.7	P2188	P2188-T2190 VanDerWaalsContact C-N 3.32Å; P2188-T2190 PolarHBondContact O-N 2.98Å
2191	P	67.8	Low	63.3	Low	89 Å²	89	113.3 Å²	113.3	58%	0.578	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-65	143	175.8	15.8	-18.4	0	0	0	110.6	Y2189	Y2189-P2191 HydrophobicContact CE1-CB 4.26Å; Y2189-P2191 HydrophobicContact CE1-CG 4.4Å; Y2189-P2191 VanDerWaalsContact O-CD 3.28Å; Y2189-P2191 WeakPolarHBondContact O-CD 3.33Å
2192	P	68.9	Low	63.8	Low	76.75 Å²	76.75	114.5 Å²	114.5	50%	0.498	66%	0.659	S	S	.	*	P	Polyproline II helix	trans	-57.1	143.4	176.7	-13.9	18.9	0	0	0	111.7	Y2189 M2194 R2199	Y2189-P2192 VanDerWaalsContact OH-CD 3.31Å; Y2189-P2192 WeakPolarHBondContact OH-CD 3.2Å; P2192-M2194 PolarHBondContact O-N 3.05Å; P2192-M2194 VanDerWaalsContact O-N 3.16Å; P2192-R2199 HydrophobicContact CB-CB 4.29Å; P2192-R2199 HydrophobicContact CB-CG 4.37Å; P2192-R2199 WeakPolarHBondContact O-CD 3.48Å; P2192-R2199 PolarHBondContact O-NE 2.69Å
2193	P	70.9	Confident	63.9	Low	95.25 Å²	95.25	107.8 Å²	107.8	62%	0.619	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-58.4	135.2	-177.4	22.9	-33.2	0	0	0	111.1	L2195 S2196 P2197 R2199	P2193-L2195 CarbonylContact O-C 3.6Å; P2193-L2195 PolarHBondContact O-N 3.22Å; P2193-S2196 WeakPolarHBondContact O-CB 3.4Å; P2193-S2196 PolarHBondContact O-N 3.31Å; P2193-P2197 HydrophobicContact CG-CG 4.08Å; P2193-R2199 WeakPolarHBondContact O-CD 3.48Å
2194	M	67.7	Low	64	Low	161.75 Å²	161.75	107.4 Å²	107.4	80%	0.797	63%	0.629	S	S	*	*	S	Bend	trans	-60.1	-13.9	-172.5	-75.8	171.2	56.5	0	0	114.9	L2169 P2192	L2169-M2194 HydrophobicContact CD1-CE 3.88Å; L2169-M2194 HydrophobicContact CD1-SD 4.18Å; L2169-M2194 HydrophobicContact CD2-CG 4.18Å; L2169-M2194 HydrophobicContact CD2-SD 3.86Å; P2192-M2194 PolarHBondContact O-N 3.05Å; P2192-M2194 VanDerWaalsContact O-N 3.16Å
2195	L	65.7	Low	64	Low	111 Å²	111	110 Å²	110	58%	0.581	63%	0.631	S	S	*	*	S	Bend	trans	-118.2	117.6	175.8	-61.2	175	0	0	0	110.2	P2193 P2197 F2205	P2193-L2195 CarbonylContact O-C 3.6Å; P2193-L2195 PolarHBondContact O-N 3.22Å; L2195-P2197 WeakPolarHBondContact O-CD 3.4Å; L2195-F2205 HydrophobicContact CD1-CD2 4.16Å; L2195-F2205 HydrophobicContact CD1-CE2 4.26Å; L2195-F2205 HydrophobicContact CD2-CD2 3.53Å; L2195-F2205 HydrophobicContact CD2-CE2 3.5Å; L2195-F2205 VanDerWaalsContact CD2-CE2 3.5Å; L2195-F2205 HydrophobicContact CD2-CG 4.4Å; L2195-F2205 HydrophobicContact CD2-CZ 4.34Å
2196	S	67.4	Low	63.5	Low	58.75 Å²	58.75	107.4 Å²	107.4	41%	0.411	61%	0.613	S	S	.	*			trans	-59.2	128.3	174.1	153.4	0	0	0	0	110.6	P2193 V2198 R2199	P2193-S2196 WeakPolarHBondContact O-CB 3.4Å; P2193-S2196 PolarHBondContact O-N 3.31Å; S2196-V2198 PolarHBondContact O-N 3.14Å; S2196-V2198 VanDerWaalsContact O-N 3.12Å; S2196-V2198 PolarHBondContact OG-N 3.01Å; S2196-R2199 WeakPolarHBondContact O-CB 3.29Å; S2196-R2199 PolarHBondContact O-N 2.92Å
2197	P	63.3	Low	62.9	Low	95.75 Å²	95.75	106.5 Å²	106.5	62%	0.622	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	-16.8	175.8	-26.4	35.4	0	0	0	114.5	P2193 L2195 R2199 S2209	P2193-P2197 HydrophobicContact CG-CG 4.08Å; L2195-P2197 WeakPolarHBondContact O-CD 3.4Å; P2197-R2199 VanDerWaalsContact C-N 3.35Å; P2197-R2199 PolarHBondContact O-N 2.92Å; P2197-S2209 PolarHBondContact O-OG 3.27Å
2198	V	64.1	Low	62.2	Low	119.25 Å²	119.25	107 Å²	107	72%	0.723	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	10.3	178	-167.5	0	0	0	0	111.3	S2196 Q2200	S2196-V2198 PolarHBondContact O-N 3.14Å; S2196-V2198 VanDerWaalsContact O-N 3.12Å; S2196-V2198 PolarHBondContact OG-N 3.01Å; V2198-Q2200 PolarHBondContact O-N 3.03Å
2199	R	64.3	Low	61.4	Low	147 Å²	147	105.4 Å²	105.4	56%	0.555	60%	0.596	S	S	*	*			trans	-85.1	107.5	-178.3	-156.5	176.5	-163.2	-99.8	2.1	111.2	P2192 P2193 S2196 P2197 G2201 S2206	P2192-R2199 HydrophobicContact CB-CB 4.29Å; P2192-R2199 HydrophobicContact CB-CG 4.37Å; P2192-R2199 WeakPolarHBondContact O-CD 3.48Å; P2192-R2199 PolarHBondContact O-NE 2.69Å; P2193-R2199 WeakPolarHBondContact O-CD 3.48Å; S2196-R2199 WeakPolarHBondContact O-CB 3.29Å; S2196-R2199 PolarHBondContact O-N 2.92Å; P2197-R2199 VanDerWaalsContact C-N 3.35Å; P2197-R2199 PolarHBondContact O-N 2.92Å; R2199-G2201 PolarHBondContact O-N 3.18Å; R2199-G2201 VanDerWaalsContact O-N 3.11Å; R2199-S2206 VanDerWaalsContact O-CB 3.27Å; R2199-S2206 WeakPolarHBondContact O-CB 3.43Å
2200	Q	63.2	Low	60.4	Low	180.5 Å²	180.5	105.5 Å²	105.5	84%	0.843	60%	0.595	S	S	*	*			trans	-65.7	91.2	173.3	-68.1	-123.7	-15.5	0	0	111.2	R2168 V2198	R2168-Q2200 PolarHBondContact NH1-O 3.46Å; V2198-Q2200 PolarHBondContact O-N 3.03Å
2201	G	61.5	Low	58.8	Low	46.6667 Å²	46.6667	109.7 Å²	109.7	48%	0.481	60%	0.599	S	S	.	*	S	Bend	trans	178.7	170.4	178.7	0	0	0	0	0	112	R2199 G2203 S2206	R2199-G2201 PolarHBondContact O-N 3.18Å; R2199-G2201 VanDerWaalsContact O-N 3.11Å; G2201-G2203 PolarHBondContact O-N 2.9Å; G2201-S2206 VanDerWaalsContact O-CB 3.31Å; G2201-S2206 WeakPolarHBondContact O-CB 3.34Å; G2201-S2206 PolarHBondContact O-OG 3.47Å
2202	S	59	Low	57.6	Low	110.667 Å²	110.667	110.6 Å²	110.6	77%	0.774	60%	0.603	S	S	*	*	S	Bend	trans	-84.1	52.6	-176.4	52.6	0	0	0	0	113.6
2203	G	55.3	Low	56.2	Low	34.6667 Å²	34.6667	112.5 Å²	112.5	36%	0.357	62%	0.615	S	S	.	*	S	Bend	trans	-95.3	153.6	174.7	0	0	0	0	0	111.4	G2201 F2205 S2206	G2201-G2203 PolarHBondContact O-N 2.9Å; G2203-F2205 PolarHBondContact O-N 2.82Å; G2203-F2205 VanDerWaalsContact O-N 3.11Å; G2203-S2206 PolarHBondContact N-OG 3.12Å; G2203-S2206 WeakPolarHBondContact O-CB 3.3Å; G2203-S2206 PolarHBondContact O-N 3.14Å; G2203-S2206 PolarHBondContact O-OG 3.09Å; G2203-S2206 VanDerWaalsContact O-OG 3.07Å
2204	L	59.7	Low	54.6	Low	144 Å²	144	113.3 Å²	113.3	75%	0.754	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-51.6	-27.4	-171.6	-78.3	164	0	0	0	115.3
2205	F	52.7	Low	53.1	Low	134.667 Å²	134.667	111.4 Å²	111.4	59%	0.591	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-96.2	-6.3	-178.7	-57.2	-76.6	0	0	0	114.4	L2195 G2203 S2207 L2208	L2195-F2205 HydrophobicContact CD1-CD2 4.16Å; L2195-F2205 HydrophobicContact CD1-CE2 4.26Å; L2195-F2205 HydrophobicContact CD2-CD2 3.53Å; L2195-F2205 HydrophobicContact CD2-CE2 3.5Å; L2195-F2205 VanDerWaalsContact CD2-CE2 3.5Å; L2195-F2205 HydrophobicContact CD2-CG 4.4Å; L2195-F2205 HydrophobicContact CD2-CZ 4.34Å; G2203-F2205 PolarHBondContact O-N 2.82Å; G2203-F2205 VanDerWaalsContact O-N 3.11Å; F2205-S2207 PolarHBondContact O-N 2.87Å; F2205-L2208 HydrophobicContact CB-CD1 4.35Å; F2205-L2208 HydrophobicContact CD1-CD1 4.04Å; F2205-L2208 PolarHBondContact O-N 3.33Å; F2205-L2208 VanDerWaalsContact O-N 3.11Å
2206	S	48.5	Very low	51.6	Low	45 Å²	45	112.9 Å²	112.9	32%	0.315	63%	0.625	S	S	.	*	G	3₁₀ helix	trans	-70.4	-16.3	-176.6	33.7	0	0	0	0	114.6	R2199 G2201 G2203 L2208 S2209	R2199-S2206 VanDerWaalsContact O-CB 3.27Å; R2199-S2206 WeakPolarHBondContact O-CB 3.43Å; G2201-S2206 VanDerWaalsContact O-CB 3.31Å; G2201-S2206 WeakPolarHBondContact O-CB 3.34Å; G2201-S2206 PolarHBondContact O-OG 3.47Å; G2203-S2206 PolarHBondContact N-OG 3.12Å; G2203-S2206 WeakPolarHBondContact O-CB 3.3Å; G2203-S2206 PolarHBondContact O-N 3.14Å; G2203-S2206 PolarHBondContact O-OG 3.09Å; G2203-S2206 VanDerWaalsContact O-OG 3.07Å; S2206-L2208 VanDerWaalsContact C-N 3.32Å; S2206-L2208 PolarHBondContact O-N 2.93Å; S2206-S2209 PolarHBondContact O-OG 2.91Å
2207	S	50.5	Low	50	Low	66 Å²	66	115.4 Å²	115.4	46%	0.462	64%	0.642	S	S	.	*	G	3₁₀ helix	trans	-86.4	-14.5	-175.8	-62.4	0	0	0	0	114.2	F2205 S2209 R2210	F2205-S2207 PolarHBondContact O-N 2.87Å; S2207-S2209 VanDerWaalsContact C-N 3.3Å; S2207-S2209 PolarHBondContact O-N 2.77Å; S2207-R2210 PolarHBondContact O-N 3.04Å; S2207-R2210 PolarHBondContact OG-NH2 3.45Å
2208	L	50	Low	48.6	Very low	113 Å²	113	118.1 Å²	118.1	59%	0.592	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-71.1	-18.7	-177.5	-78.7	136.5	0	0	0	113.5	F2205 S2206 R2210 W2211	F2205-L2208 HydrophobicContact CB-CD1 4.35Å; F2205-L2208 HydrophobicContact CD1-CD1 4.04Å; F2205-L2208 PolarHBondContact O-N 3.33Å; F2205-L2208 VanDerWaalsContact O-N 3.11Å; S2206-L2208 VanDerWaalsContact C-N 3.32Å; S2206-L2208 PolarHBondContact O-N 2.93Å; L2208-R2210 VanDerWaalsContact C-N 3.25Å; L2208-R2210 PolarHBondContact O-N 3.18Å; L2208-W2211 WeakPolarHBondContact O-CA 3.34Å; L2208-W2211 WeakPolarHBondContact O-CB 3.5Å; L2208-W2211 PolarHBondContact O-N 3.03Å
2209	S	49.9	Very low	47.1	Very low	74.6667 Å²	74.6667	118.1 Å²	118.1	52%	0.522	66%	0.656	S	S	.	*	G	3₁₀ helix	trans	-74	-1.2	179	-28.9	0	0	0	0	114.8	P2197 S2206 S2207 W2211	P2197-S2209 PolarHBondContact O-OG 3.27Å; S2206-S2209 PolarHBondContact O-OG 2.91Å; S2207-S2209 VanDerWaalsContact C-N 3.3Å; S2207-S2209 PolarHBondContact O-N 2.77Å; S2209-W2211 VanDerWaalsContact C-N 3.32Å
2210	R	46.1	Very low	45.5	Very low	203.333 Å²	203.333	114.3 Å²	114.3	77%	0.767	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-86.5	-6.7	173.6	-106.5	-174.1	-66.9	-104.8	0.8	114	S2207 L2208 V2212	S2207-R2210 PolarHBondContact O-N 3.04Å; S2207-R2210 PolarHBondContact OG-NH2 3.45Å; L2208-R2210 VanDerWaalsContact C-N 3.25Å; L2208-R2210 PolarHBondContact O-N 3.18Å; R2210-V2212 PolarHBondContact O-N 3Å
2211	W	39	Very low	44	Very low	196.667 Å²	196.667	109.5 Å²	109.5	75%	0.745	66%	0.661	S	S	*	*			trans	-99.5	44.7	177	-58.3	100.1	0	0	0	112.3	L2208 S2209 P2213	L2208-W2211 WeakPolarHBondContact O-CA 3.34Å; L2208-W2211 WeakPolarHBondContact O-CB 3.5Å; L2208-W2211 PolarHBondContact O-N 3.03Å; S2209-W2211 VanDerWaalsContact C-N 3.32Å; W2211-P2213 WeakPolarHBondContact O-CD 3.42Å
2212	V	42.3	Very low	42.7	Very low	107 Å²	107	110.7 Å²	110.7	65%	0.648	67%	0.673	S	S	*	*	S	Bend	trans	-79.3	119.2	156.7	178.1	0	0	0	0	106.4	R2210 T2214	R2210-V2212 PolarHBondContact O-N 3Å; V2212-T2214 PolarHBondContact O-N 3.14Å; V2212-T2214 VanDerWaalsContact O-N 3.14Å
2213	P	38.1	Very low	41.5	Very low	116 Å²	116	111.8 Å²	111.8	75%	0.753	68%	0.675	S	S	*	*			trans	-64.1	105.6	168.3	-2.6	11.3	0	0	0	107.9	W2211 P2215	W2211-P2213 WeakPolarHBondContact O-CD 3.42Å; P2213-P2215 WeakPolarHBondContact O-CD 3.31Å
2214	T	38.3	Very low	40.6	Very low	114 Å²	114	115.4 Å²	115.4	70%	0.699	70%	0.696	S	S	*	*			trans	-54	122.7	165.3	21.3	0	0	0	0	107	V2212 I2216	V2212-T2214 PolarHBondContact O-N 3.14Å; V2212-T2214 VanDerWaalsContact O-N 3.14Å; T2214-I2216 VanDerWaalsContact C-N 3.33Å; T2214-I2216 PolarHBondContact O-N 3.23Å
2215	P	35.3	Very low	39.5	Very low	120.333 Å²	120.333	114.6 Å²	114.6	78%	0.781	70%	0.696	S	S	*	*			trans	-62.9	108.3	177	25.4	-32.3	0	0	0	107.2	P2213 S2217	P2213-P2215 WeakPolarHBondContact O-CD 3.31Å; P2215-S2217 VanDerWaalsContact C-N 3.32Å; P2215-S2217 PolarHBondContact O-N 3.11Å; P2215-S2217 VanDerWaalsContact O-N 3.08Å
2216	I	34.8	Very low	38.6	Very low	144 Å²	144	115.9 Å²	115.9	74%	0.738	71%	0.706	S	S	*	*			trans	-63.9	106.4	175.4	-61	177.4	0	0	0	105.5	T2214 I2218	T2214-I2216 VanDerWaalsContact C-N 3.33Å; T2214-I2216 PolarHBondContact O-N 3.23Å; I2216-I2218 HydrophobicContact CB-CG1 4.32Å; I2216-I2218 HydrophobicContact CG2-CG1 3.87Å; I2216-I2218 PolarHBondContact O-N 3.24Å
2217	S	33.9	Very low	37.9	Very low	110 Å²	110	119.3 Å²	119.3	77%	0.769	73%	0.725	S	S	*	*			trans	-69.9	84.5	172.4	54.7	0	0	0	0	107.9	P2215 S2219	P2215-S2217 VanDerWaalsContact C-N 3.32Å; P2215-S2217 PolarHBondContact O-N 3.11Å; P2215-S2217 VanDerWaalsContact O-N 3.08Å; S2217-S2219 PolarHBondContact O-N 2.83Å; S2217-S2219 VanDerWaalsContact O-N 3.15Å
2218	I	33.7	Very low	37.1	Very low	151.667 Å²	151.667	121.1 Å²	121.1	78%	0.778	74%	0.737	S	S	*	*			trans	-62.2	103.3	176.7	-61.4	173.4	0	0	0	107.2	I2216 G2220	I2216-I2218 HydrophobicContact CB-CG1 4.32Å; I2216-I2218 HydrophobicContact CG2-CG1 3.87Å; I2216-I2218 PolarHBondContact O-N 3.24Å; I2218-G2220 VanDerWaalsContact C-N 3.33Å; I2218-G2220 PolarHBondContact O-N 3.11Å
2219	S	32.8	Very low	36.3	Very low	120.333 Å²	120.333	122.3 Å²	122.3	84%	0.841	75%	0.75	S	S	*	*			trans	-96.3	74.5	174.1	147.9	0	0	0	0	109.8	S2217	S2217-S2219 PolarHBondContact O-N 2.83Å; S2217-S2219 VanDerWaalsContact O-N 3.15Å
2220	G	31.5	Very low	35.6	Very low	67 Å²	67	122.5 Å²	122.5	69%	0.691	76%	0.764	S	S	*	*			trans	-101.9	129.7	168.9	0	0	0	0	0	109.9	I2218 G2222	I2218-G2220 VanDerWaalsContact C-N 3.33Å; I2218-G2220 PolarHBondContact O-N 3.11Å; G2220-G2222 PolarHBondContact O-N 3.2Å
2221	G	31.5	Very low	35.1	Very low	79 Å²	79	117.3 Å²	117.3	81%	0.814	76%	0.764	S	S	*	*			trans	144.3	120.9	-164	0	0	0	0	0	112.7	T2223	G2221-T2223 PolarHBondContact O-N 2.74Å
2222	G	33.6	Very low	34.9	Very low	72 Å²	72	119.1 Å²	119.1	74%	0.742	77%	0.77	S	S	*	*			trans	150.1	140.2	-173.3	0	0	0	0	0	112.5	G2220 S2224	G2220-G2222 PolarHBondContact O-N 3.2Å; G2222-S2224 PolarHBondContact O-N 2.97Å
2223	T	34.8	Very low	34.5	Very low	134.333 Å²	134.333	119 Å²	119	82%	0.824	78%	0.775	S	S	*	*			trans	-91	140.1	148.7	56.3	0	0	0	0	115	G2221	G2221-T2223 PolarHBondContact O-N 2.74Å
2224	S	35.4	Very low	34.4	Very low	111.333 Å²	111.333	120.3 Å²	120.3	78%	0.779	78%	0.78	S	S	*	*			trans	93.5	125.2	160.4	-71.4	0	0	0	0	117.3	G2222	G2222-S2224 PolarHBondContact O-N 2.97Å
2225	V	35.9	Very low	34.2	Very low	125.333 Å²	125.333	118.4 Å²	118.4	76%	0.76	78%	0.783	S	S	*	*			trans	166.5	135.3	158.6	167	0	0	0	0	111.8
2226	M	34.4	Very low	34	Very low	163 Å²	163	117.3 Å²	117.3	80%	0.803	78%	0.778	S	S	*	*			trans	76.8	120.2	159	-71.4	-179.3	136.1	0	0	120.6
2227	T	33.5	Very low	33.8	Very low	117 Å²	117	113.5 Å²	113.5	72%	0.718	78%	0.775	S	S	*	*				86.2	144.8	102.3	42	0	0	0	0	118.2
2228	S	33.9	Very low	33.8	Very low	102.667 Å²	102.667	114.2 Å²	114.2	72%	0.718	78%	0.775	S	S	*	*			trans	102.7	150.2	134.7	67.5	0	0	0	0	115.9
2229	T	34.3	Very low	33.6	Very low	138.667 Å²	138.667	114.3 Å²	114.3	85%	0.851	78%	0.776	S	S	*	*			cis	168.5	133.5	-21.8	21.7	0	0	0	0	113.8
2230	G	33.6	Very low	33.5	Very low	79 Å²	79	116.1 Å²	116.1	81%	0.814	77%	0.773	S	S	*	*			trans	93.5	139.8	149	0	0	0	0	0	118.5
2231	A	37.3	Very low	33.5	Very low	93 Å²	93	119.8 Å²	119.8	77%	0.769	78%	0.777	S	S	*	*			cis	171.2	154.1	12.8	0	0	0	0	0	115.8
2232	R	33.4	Very low	33.4	Very low	234.667 Å²	234.667	126.3 Å²	126.3	89%	0.886	78%	0.777	S	S	*	*			trans	60.7	141	145	-74.2	178.9	-179.1	-157.8	-0.6	114.5
2233	S	34.4	Very low	33.2	Very low	105.667 Å²	105.667	132.8 Å²	132.8	74%	0.739	78%	0.779	S	S	*	*				101.6	158.6	82.4	-122.3	0	0	0	0	115.3
2234	V	35.8	Very low	32.9	Very low	142.667 Å²	142.667	135.1 Å²	135.1	87%	0.865	78%	0.778	S	S	*	*			cis	-118.8	154.1	7.3	-100.5	0	0	0	0	113.3
2235	G	33.6	Very low	32.7	Very low	74.6667 Å²	74.6667	134.2 Å²	134.2	77%	0.77	77%	0.771	S	S	*	*			trans	159.4	110.8	163.5	0	0	0	0	0	114.4
2236	S	32.2	Very low	32.4	Very low	96.3333 Å²	96.3333	134 Å²	134	67%	0.674	77%	0.766	S	S	*	*			trans	-118.7	139.2	177.6	-150.1	0	0	0	0	111.2	Q1803 H1805	Q1803-S2236 WeakPolarHBondContact CG-O 3.33Å; Q1803-S2236 PolarHBondContact NE2-O 3.09Å; H1805-S2236 PolarHBondContact CD2-OG 2.97Å
2237	G	31.2	Very low	32.2	Very low	64.6667 Å²	64.6667	136.2 Å²	136.2	67%	0.667	77%	0.767	S	S	*	*			trans	171.6	99.1	168.9	0	0	0	0	0	115.3
2238	T	33.5	Very low	32.1	Very low	126 Å²	126	139.8 Å²	139.8	77%	0.773	77%	0.769	S	S	*	*			trans	-13.6	135.7	157.5	11.3	0	0	0	0	119.8	M2240	T2238-M2240 HydrophobicContact CG2-SD 4.24Å; T2238-M2240 PolarHBondContact O-N 3.43Å
2239	L	29.8	Very low	32	Very low	152.333 Å²	152.333	140.3 Å²	140.3	80%	0.798	77%	0.77	S	S	*	*			trans	122.1	115.5	147.3	-80.8	168.7	0	0	0	116.9	N2241	L2239-N2241 PolarHBondContact O-N 2.88Å
2240	M	30.8	Very low	31.7	Very low	158 Å²	158	138.4 Å²	138.4	78%	0.778	76%	0.762	S	S	*	*			trans	37.4	98.9	152.8	-85.6	147.6	-177.9	0	0	119.1	T2238 R2242	T2238-M2240 HydrophobicContact CG2-SD 4.24Å; T2238-M2240 PolarHBondContact O-N 3.43Å; M2240-R2242 VanDerWaalsContact C-N 3.3Å; M2240-R2242 PolarHBondContact O-N 3.26Å
2241	N	30.1	Very low	31.6	Very low	145.667 Å²	145.667	141.7 Å²	141.7	78%	0.779	76%	0.76	S	S	*	*			trans	28.3	105.6	141.1	-111.9	-17.7	0	0	0	117.8	L2239	L2239-N2241 PolarHBondContact O-N 2.88Å
2242	R	29.6	Very low	31.3	Very low	214.667 Å²	214.667	143.1 Å²	143.1	81%	0.81	76%	0.758	S	S	*	*			trans	169.1	130.5	138.5	-110.6	173.5	-105.9	-161.1	-1	116	M2240	M2240-R2242 VanDerWaalsContact C-N 3.3Å; M2240-R2242 PolarHBondContact O-N 3.26Å
2243	R	28.9	Very low	31.2	Very low	209.333 Å²	209.333	139.9 Å²	139.9	79%	0.79	75%	0.753	S	S	*	*			trans	-132.3	139.6	153.8	-67	-173.2	-178.8	177.9	-0.6	112.5
2244	F	30.4	Very low	31	Very low	183.333 Å²	183.333	142.3 Å²	142.3	80%	0.804	75%	0.752	S	S	*	*				-111.7	126.8	110.7	-84.6	-75.1	0	0	0	111.9
2245	S	30.3	Very low	30.7	Very low	90.6667 Å²	90.6667	140.9 Å²	140.9	63%	0.634	74%	0.74	S	S	*	*				121.6	120.5	129.4	-170.9	0	0	0	0	114
2246	N	29.1	Very low	30.7	Very low	121.333 Å²	121.333	143.6 Å²	143.6	65%	0.649	74%	0.737	S	S	*	*				80.6	139.1	114.3	-72.5	-2.7	0	0	0	114.1
2247	Y	31.3	Very low	30.6	Very low	209.333 Å²	209.333	143.7 Å²	143.7	82%	0.821	74%	0.737	S	S	*	*				-159.2	138.2	103.3	-98.2	-92.6	0	0	0	113.5
2248	Y	30	Very low	30.6	Very low	193.333 Å²	193.333	148.8 Å²	148.8	76%	0.758	74%	0.744	S	S	*	*			trans	-67.4	168.2	166.1	-100	-111.1	0	0	0	110.8	S2250	Y2248-S2250 PolarHBondContact O-N 3.46Å; Y2248-S2250 VanDerWaalsContact O-N 3.12Å
2249	P	32.4	Very low	30.5	Very low	113 Å²	113	148.4 Å²	148.4	73%	0.734	74%	0.742	S	S	*	*				-114.6	152.9	62.6	36.2	-24.7	0	0	0	114.9	I2251	P2249-I2251 VanDerWaalsContact C-N 3.32Å; P2249-I2251 PolarHBondContact O-N 3.16Å
2250	S	28.5	Very low	30.5	Very low	98.3333 Å²	98.3333	146.6 Å²	146.6	69%	0.688	74%	0.737	S	S	*	*			trans	-73.1	127.1	167.8	-50.4	0	0	0	0	111.2	Y2248 T2252	Y2248-S2250 PolarHBondContact O-N 3.46Å; Y2248-S2250 VanDerWaalsContact O-N 3.12Å; S2250-T2252 PolarHBondContact O-N 3.38Å; S2250-T2252 VanDerWaalsContact O-N 3.16Å
2251	I	32	Very low	30.5	Very low	149.667 Å²	149.667	144.8 Å²	144.8	77%	0.768	74%	0.735	S	S	*	*			trans	-114.5	133.8	159.3	-74	175.4	0	0	0	108	P2249 H2253	P2249-I2251 VanDerWaalsContact C-N 3.32Å; P2249-I2251 PolarHBondContact O-N 3.16Å; I2251-H2253 PolarHBondContact O-N 2.87Å
2252	T	29.3	Very low	30.4	Very low	121.667 Å²	121.667	145.3 Å²	145.3	75%	0.746	74%	0.735	S	S	*	*			trans	-101.5	131.1	174.3	47.3	0	0	0	0	109.7	S2250	S2250-T2252 PolarHBondContact O-N 3.38Å; S2250-T2252 VanDerWaalsContact O-N 3.16Å
2253	H	31.6	Very low	30.4	Very low	166.667 Å²	166.667	140.3 Å²	140.3	77%	0.772	73%	0.732	S	S	*	*			trans	-141.1	126.3	153.3	-90.9	-91	0	0	0	110	I2251	I2251-H2253 PolarHBondContact O-N 2.87Å
2254	H	30.9	Very low	30.6	Very low	156 Å²	156	134.1 Å²	134.1	72%	0.722	73%	0.725	S	S	*	*				49.8	156.3	118.9	-90.1	-73.2	0	0	0	112.9
2255	N	30.3	Very low	30.6	Very low	114 Å²	114	132.2 Å²	132.2	61%	0.61	73%	0.729	S	S	*	*			cis	162.8	150.6	-34.2	-108.8	48.8	0	0	0	110.5
2256	D	31.9	Very low	30.7	Very low	130.667 Å²	130.667	131.4 Å²	131.4	70%	0.699	74%	0.735	S	S	*	*			trans	89.1	159.8	138	-65.3	-34.1	0	0	0	116.5
2257	S	30.9	Very low	30.8	Very low	98.3333 Å²	98.3333	131.8 Å²	131.8	69%	0.688	75%	0.747	S	S	*	*			trans	83.5	136.9	179.1	101.2	0	0	0	0	114.5
2258	E	31.7	Very low	30.9	Very low	172 Å²	172	124.8 Å²	124.8	80%	0.804	74%	0.738	S	S	*	*				89.6	161.1	77.6	-74	176	168.8	0	0	116.1
2259	T	31	Very low	31.1	Very low	118 Å²	118	122.3 Å²	122.3	72%	0.724	74%	0.743	S	S	*	*			trans	93.5	139.8	-177.5	13.5	0	0	0	0	116.3
2260	T	29.8	Very low	31.1	Very low	115 Å²	115	123.9 Å²	123.9	71%	0.706	75%	0.745	S	S	*	*			trans	100.1	134.4	132.3	-45	0	0	0	0	116
2261	T	31	Very low	31.2	Very low	120.333 Å²	120.333	127.5 Å²	127.5	74%	0.738	76%	0.756	S	S	*	*				98	134.8	103.5	-2.8	0	0	0	0	118.5
2262	M	28.2	Very low	31.1	Very low	155 Å²	155	123.8 Å²	123.8	76%	0.764	76%	0.755	S	S	*	*				102.2	140.3	103.1	-75.9	-69.5	-95.9	0	0	117.9
2263	C	29.4	Very low	31.3	Very low	111.333 Å²	111.333	121.4 Å²	121.4	75%	0.752	75%	0.754	S	S	*	*			trans	68.3	151.6	145.4	-69.9	0	0	0	0	118.9
2264	A	32.4	Very low	31.3	Very low	78.6667 Å²	78.6667	121 Å²	121	65%	0.65	75%	0.752	S	S	*	*			cis	-164.2	164.9	-10.6	0	0	0	0	0	110
2265	T	31.6	Very low	31.2	Very low	142.667 Å²	142.667	120.5 Å²	120.5	88%	0.875	75%	0.754	S	S	*	*				56.1	134.5	129.1	43.2	0	0	0	0	117.4
2266	G	32.1	Very low	31.3	Very low	74.6667 Å²	74.6667	122.5 Å²	122.5	77%	0.77	76%	0.758	S	S	*	*			trans	139.4	129	148.2	0	0	0	0	0	113.7
2267	S	31.4	Very low	31.1	Very low	128.333 Å²	128.333	125.5 Å²	125.5	90%	0.897	76%	0.76	S	S	*	*				91.9	132.2	60.2	-162.8	0	0	0	0	114.9
2268	G	32	Very low	31	Very low	62.3333 Å²	62.3333	130.6 Å²	130.6	64%	0.643	76%	0.764	S	S	*	*			trans	107.8	147.3	155	0	0	0	0	0	114.5
2269	V	34.8	Very low	30.9	Very low	141.667 Å²	141.667	130 Å²	130	86%	0.859	76%	0.76	S	S	*	*			cis	-158.6	148.9	2.7	-103.6	0	0	0	0	110.6
2270	N	31.5	Very low	30.9	Very low	146.333 Å²	146.333	128.4 Å²	128.4	78%	0.783	76%	0.76	S	S	*	*			trans	-27.4	142.6	152.1	-64.8	-55.1	0	0	0	115.5
2271	L	32.1	Very low	30.9	Very low	174 Å²	174	128.4 Å²	128.4	91%	0.911	76%	0.764	S	S	*	*				-177.5	153.4	99.5	-90.7	153.3	0	0	0	107
2272	G	29.9	Very low	30.9	Very low	72.3333 Å²	72.3333	127.6 Å²	127.6	75%	0.746	76%	0.763	S	S	*	*			cis	141.1	117.3	5.4	0	0	0	0	0	110
2273	G	32.8	Very low	31	Very low	70.3333 Å²	70.3333	125.7 Å²	125.7	73%	0.725	77%	0.765	S	S	*	*			trans	143.9	93.3	179.3	0	0	0	0	0	111.4
2274	Q	30.9	Very low	31.2	Very low	158 Å²	158	124.2 Å²	124.2	74%	0.738	77%	0.769	S	S	*	*				66.5	112.3	74.8	-65.6	-109.2	47.7	0	0	113.4
2275	L	30	Very low	31.2	Very low	146 Å²	146	124.8 Å²	124.8	76%	0.764	77%	0.774	S	S	*	*				90.3	144.2	115.9	-65.7	169.2	0	0	0	117.3
2276	K	31.3	Very low	31.2	Very low	156 Å²	156	129.2 Å²	129.2	68%	0.678	77%	0.774	S	S	*	*			cis	146.1	127.1	29.9	-173.4	172.8	-170.4	170.1	0	113.6
2277	R	27.8	Very low	31.3	Very low	195 Å²	195	129.9 Å²	129.9	74%	0.736	77%	0.768	S	S	*	*			trans	45.2	138.3	160.7	-64.4	170.8	179.4	177.7	-0.8	115.1
2278	R	29.1	Very low	31.3	Very low	205.333 Å²	205.333	130.3 Å²	130.3	78%	0.775	76%	0.76	S	S	*	*				171	148.5	101	-96.1	171.5	179.8	-176.3	-2.6	113
2279	H	28.9	Very low	31.2	Very low	157.667 Å²	157.667	132.8 Å²	132.8	73%	0.73	76%	0.763	S	S	*	*			trans	56.2	141.7	161.8	-56.3	-68.3	0	0	0	112.8
2280	A	31.5	Very low	31.1	Very low	86.3333 Å²	86.3333	130.9 Å²	130.9	71%	0.713	76%	0.756	S	S	*	*			cis	-177.2	144.6	47.7	0	0	0	0	0	109.3
2281	S	29.3	Very low	30.9	Very low	113.667 Å²	113.667	131.7 Å²	131.7	80%	0.795	76%	0.755	S	S	*	*				50.8	139.4	125.1	-50	0	0	0	0	115.8
2282	S	32	Very low	30.7	Very low	103 Å²	103	130.1 Å²	130.1	72%	0.72	75%	0.745	S	S	*	*			cis	175.7	147.6	42.9	48.4	0	0	0	0	115.2
2283	S	31	Very low	30.6	Very low	116 Å²	116	131.6 Å²	131.6	81%	0.811	74%	0.744	S	S	*	*				73.3	114.9	110.1	68.3	0	0	0	0	119.2
2284	G	32.1	Very low	30.4	Very low	80.6667 Å²	80.6667	134.3 Å²	134.3	83%	0.832	75%	0.747	S	S	*	*			trans	137	117.8	159.3	0	0	0	0	0	115
2285	A	33.6	Very low	30.4	Very low	90.3333 Å²	90.3333	131.4 Å²	131.4	75%	0.747	74%	0.744	S	S	*	*			cis	-128.5	157.5	-16.7	0	0	0	0	0	109.7
2286	R	30.4	Very low	30.3	Very low	234.333 Å²	234.333	130.9 Å²	130.9	88%	0.884	74%	0.742	S	S	*	*			trans	65.3	148.2	144.6	-58	173	70	-173.9	2.3	113.4
2287	S	34.1	Very low	30.3	Very low	90.3333 Å²	90.3333	131.7 Å²	131.7	63%	0.632	75%	0.749	S	S	*	*			cis	-158.1	160.6	-5.1	-73	0	0	0	0	108.5
2288	N	31.3	Very low	30.3	Very low	137.667 Å²	137.667	126.9 Å²	126.9	74%	0.736	75%	0.745	S	S	*	*				155.1	138.5	60.1	-87.6	25.7	0	0	0	110.8
2289	T	30.6	Very low	30.3	Very low	114.667 Å²	114.667	124.4 Å²	124.4	70%	0.703	75%	0.745	S	S	*	*				4.2	138.4	85.7	54.7	0	0	0	0	114.9
2290	S	32.9	Very low	30.2	Very low	101 Å²	101	121.2 Å²	121.2	71%	0.706	74%	0.741	S	S	*	*				171.6	131	90.2	62.6	0	0	0	0	112.6
2291	E	28.1	Very low	30.1	Very low	163.667 Å²	163.667	122.7 Å²	122.7	77%	0.765	74%	0.741	S	S	*	*			trans	-158.9	157.5	137	-115.3	164.6	-157.2	0	0	115.7
2292	I	27.3	Very low	30.2	Very low	139.667 Å²	139.667	123.1 Å²	123.1	72%	0.716	74%	0.738	S	S	*	*			trans	62	103.5	150.5	-64.5	160.2	0	0	0	118.5
2293	S	27.7	Very low	30	Very low	103.333 Å²	103.333	125 Å²	125	72%	0.723	74%	0.74	S	S	*	*				100.4	141.7	109.3	-85.3	0	0	0	0	117.9
2294	T	28.9	Very low	30	Very low	126.667 Å²	126.667	124.3 Å²	124.3	78%	0.777	74%	0.735	S	S	*	*			trans	51.6	134.5	153.2	57.2	0	0	0	0	120.1
2295	S	29.8	Very low	30	Very low	97.3333 Å²	97.3333	125 Å²	125	68%	0.681	73%	0.728	S	S	*	*			cis	164.8	155.7	17.8	56.9	0	0	0	0	114.9
2296	N	28.7	Very low	29.9	Very low	136 Å²	136	127.1 Å²	127.1	73%	0.727	73%	0.726	S	S	*	*			trans	34.9	133	149.4	-60.4	-25.8	0	0	0	119.5
2297	Q	31.3	Very low	30	Very low	174 Å²	174	122.3 Å²	122.3	81%	0.813	72%	0.718	S	S	*	*				106.8	143.1	127.1	-78.3	164.8	70.6	0	0	117.8
2298	S	28.6	Very low	29.7	Very low	93.3333 Å²	93.3333	125.6 Å²	125.6	65%	0.653	73%	0.727	S	S	*	*				-174.9	146.7	123.7	55.7	0	0	0	0	115.5
2299	I	28.1	Very low	29.5	Very low	152.667 Å²	152.667	123.8 Å²	123.8	78%	0.783	73%	0.725	S	S	*	*			trans	98.9	123.2	131.8	-77.3	162.5	0	0	0	116.7
2300	S	27.7	Very low	29.4	Very low	90.6667 Å²	90.6667	124.9 Å²	124.9	63%	0.634	73%	0.732	S	S	*	*			trans	86.4	172	136.9	74.4	0	0	0	0	119
2301	T	28.7	Very low	29.3	Very low	116.667 Å²	116.667	123.3 Å²	123.3	72%	0.716	73%	0.731	S	S	*	*				99.3	138.3	116.7	24.8	0	0	0	0	117.9
2302	V	30.3	Very low	30	Very low	123 Å²	123	121.1 Å²	121.1	75%	0.745	73%	0.731	S	S	*	*				76	143.8	99	-150.5	0	0	0	0	117.9
2303	D	28.8	Very low	30.2	Very low	142.333 Å²	142.333	120.3 Å²	120.3	76%	0.761	73%	0.733	S	S	*	*			trans	67.1	152.5	153.6	-68	-47.3	0	0	0	120.4
2304	S	32	Very low	30.3	Very low	101.667 Å²	101.667	122.7 Å²	122.7	71%	0.711	74%	0.737	S	S	*	*				102.7	120.1	95.4	-83.2	0	0	0	0	116.8
2305	S	30.3	Very low	30.3	Very low	95.3333 Å²	95.3333	120.7 Å²	120.7	67%	0.667	73%	0.734	S	S	*	*				98.2	152.6	89.7	65.6	0	0	0	0	117.9
2306	N	33.4	Very low	30.5	Very low	134 Å²	134	123.3 Å²	123.3	72%	0.717	74%	0.741	S	S	*	*			trans	102.4	119.4	150	-78.5	-50.2	0	0	0	117.8
2307	N	30.6	Very low	30.5	Very low	133.667 Å²	133.667	120.6 Å²	120.6	72%	0.715	74%	0.737	S	S	*	*				67.8	133.4	107.3	-70.8	-34.6	0	0	0	117.8
2308	I	28.2	Very low	30.6	Very low	161 Å²	161	122.6 Å²	122.6	83%	0.826	74%	0.738	S	S	*	*				104.4	136.4	82.2	-66	166	0	0	0	113.4
2309	S	27.6	Very low	30.6	Very low	99 Å²	99	124.2 Å²	124.2	69%	0.692	74%	0.74	S	S	*	*			trans	-170.7	174.4	141.5	-156.2	0	0	0	0	114
2310	T	29.4	Very low	30.7	Very low	138.667 Å²	138.667	123.5 Å²	123.5	85%	0.851	74%	0.738	S	S	*	*			trans	85.2	165.4	143.4	66.3	0	0	0	0	114.6
2311	G	30	Very low	30.6	Very low	65.6667 Å²	65.6667	123.5 Å²	123.5	68%	0.677	74%	0.738	S	S	*	*			cis	-179.2	171.7	3.6	0	0	0	0	0	111.2
2312	P	42.5	Very low	30.8	Very low	119.333 Å²	119.333	128 Å²	128	78%	0.775	74%	0.743	S	S	*	*			trans	-114.3	165.7	-163.1	40.8	-32.7	0	0	0	115.9
2313	T	30.9	Very low	30.7	Very low	123 Å²	123	128.4 Å²	128.4	76%	0.755	74%	0.741	S	S	*	*			trans	-172.7	145.7	145.6	36.3	0	0	0	0	110.4
2314	N	29.5	Very low	30.9	Very low	152 Å²	152	128.5 Å²	128.5	81%	0.813	74%	0.741	S	S	*	*				88.9	144	64.4	-73.8	-5.9	0	0	0	114.2
2315	A	29.8	Very low	30.7	Very low	85.6667 Å²	85.6667	131 Å²	131	71%	0.708	75%	0.747	S	S	*	*			cis	176	177.9	-9	0	0	0	0	0	111.5
2316	D	34.2	Very low	30.6	Very low	152.333 Å²	152.333	130.5 Å²	130.5	82%	0.815	75%	0.749	S	S	*	*			cis	-168.4	164.7	36.7	-97.5	-25.3	0	0	0	115.8
2317	A	29.2	Very low	30.4	Very low	78.6667 Å²	78.6667	131.3 Å²	131.3	65%	0.65	75%	0.753	S	S	*	*			trans	-69.2	161	173.1	0	0	0	0	0	114.7
2318	Y	32	Very low	30.4	Very low	215.333 Å²	215.333	131.8 Å²	131.8	84%	0.844	76%	0.761	S	S	*	*				-153.5	153.7	106.7	-102.5	-92.3	0	0	0	112.6
2319	N	28.7	Very low	30.5	Very low	128 Å²	128	127.5 Å²	127.5	68%	0.684	76%	0.756	S	S	*	*			trans	-86.4	161.9	-157.4	-87.9	-34.2	0	0	0	114
2320	N	30.2	Very low	30.6	Very low	138.333 Å²	138.333	127.4 Å²	127.4	74%	0.74	76%	0.756	S	S	*	*			trans	81.7	122.6	156.4	-54.3	-23	0	0	0	116.6
2321	S	26.4	Very low	30.7	Very low	90.6667 Å²	90.6667	128.3 Å²	128.3	63%	0.634	75%	0.754	S	S	*	*				71.1	109.8	79	-160.6	0	0	0	0	114.4
2322	Y	32.1	Very low	30.9	Very low	209.667 Å²	209.667	131 Å²	131	82%	0.822	76%	0.757	S	S	*	*				-163.3	125.9	112.1	-88.9	-72.7	0	0	0	111.5
2323	D	28.6	Very low	30.3	Very low	132.333 Å²	132.333	131.6 Å²	131.6	71%	0.708	75%	0.754	S	S	*	*			trans	-29.8	148.7	151.1	-64.7	-61.5	0	0	0	116.8
2324	N	32.5	Very low	30.3	Very low	143.333 Å²	143.333	132.6 Å²	132.6	77%	0.766	75%	0.754	S	S	*	*				162	120.5	129	-94.8	-63.7	0	0	0	116.5
2325	N	27.4	Very low	30.3	Very low	155.333 Å²	155.333	135.5 Å²	135.5	83%	0.831	76%	0.755	S	S	*	*			trans	-14.2	155.6	150.6	-84.8	-52.3	0	0	0	119.4
2326	A	30.1	Very low	30.3	Very low	84.6667 Å²	84.6667	138.5 Å²	138.5	70%	0.7	76%	0.756	S	S	*	*			trans	108.4	106	153.2	0	0	0	0	0	117.4
2327	N	28.9	Very low	30.1	Very low	150.333 Å²	150.333	141.8 Å²	141.8	80%	0.804	76%	0.757	S	S	*	*				85.8	127.6	107.2	-76.5	-33.7	0	0	0	120.3
2328	T	29.6	Very low	30.1	Very low	145 Å²	145	144.1 Å²	144.1	89%	0.89	76%	0.759	S	S	*	*			trans	50.3	133.4	149.9	56.3	0	0	0	0	116.7
2329	G	30.3	Very low	30.1	Very low	70.3333 Å²	70.3333	140.1 Å²	140.1	73%	0.725	75%	0.751	S	S	*	*			trans	157.7	131.5	-177.4	0	0	0	0	0	113.4	I2331	G2329-I2331 PolarHBondContact O-N 3Å
2330	S	30.3	Very low	30.3	Very low	97.6667 Å²	97.6667	141.7 Å²	141.7	68%	0.683	76%	0.76	S	S	*	*			trans	93.6	134.9	-162.9	-176.8	0	0	0	0	113.4	T2332 D2333	S2330-T2332 PolarHBondContact OG-N 3.49Å; S2330-D2333 PolarHBondContact OG-OD2 3.35Å
2331	I	31.7	Very low	30.2	Very low	156.667 Å²	156.667	145.3 Å²	145.3	80%	0.803	76%	0.763	S	S	*	*			trans	85.3	66.4	163.2	-45.7	176.1	0	0	0	113.2	G2329	G2329-I2331 PolarHBondContact O-N 3Å
2332	T	33.5	Very low	30.5	Very low	123.333 Å²	123.333	145.7 Å²	145.7	76%	0.757	76%	0.763	S	S	*	*			trans	-144.6	19.2	134.1	17	0	0	0	0	114.1	S2330 L2334	S2330-T2332 PolarHBondContact OG-N 3.49Å; T2332-L2334 VanDerWaalsContact C-N 3.34Å; T2332-L2334 PolarHBondContact O-N 3.17Å
2333	D	29.9	Very low	30.4	Very low	130 Å²	130	142.2 Å²	142.2	70%	0.695	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	78.4	-161.6	-99.6	-35.9	0	0	0	113.7	S2330 R2337	S2330-D2333 PolarHBondContact OG-OD2 3.35Å; D2333-R2337 IonicContact OD1-NH1 3.18Å
2334	L	30.6	Very low	30.4	Very low	145.667 Å²	145.667	139.9 Å²	139.9	76%	0.763	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	30.2	172.5	-79.5	174.6	0	0	0	115.9	T2332	T2332-L2334 VanDerWaalsContact C-N 3.34Å; T2332-L2334 PolarHBondContact O-N 3.17Å
2335	Y	30.1	Very low	30.1	Very low	211.333 Å²	211.333	142 Å²	142	83%	0.829	76%	0.755	S	S	*	*	S	Bend	trans	-129.1	116.3	168.7	-88.3	-93.1	0	0	0	111.2
2336	M	30.6	Very low	30.3	Very low	150 Å²	150	140.6 Å²	140.6	74%	0.739	75%	0.752	S	S	*	*			trans	70.8	35.6	152.7	-58.3	-60.3	-105.2	0	0	116.4	L2339	M2336-L2339 HydrophobicContact CE-CD1 4.28Å; M2336-L2339 HydrophobicContact SD-CD1 4.43Å
2337	R	29.4	Very low	30.3	Very low	220.667 Å²	220.667	147.9 Å²	147.9	83%	0.833	76%	0.761	S	S	*	*			trans	-97	89.1	142.4	-89.1	-174.2	161.5	145.6	-6.1	114.1	D2333	D2333-R2337 IonicContact OD1-NH1 3.18Å
2338	D	29.9	Very low	30.4	Very low	128.333 Å²	128.333	150.7 Å²	150.7	69%	0.686	76%	0.761	S	S	*	*			trans	168	35.5	152.8	-105	-18.7	0	0	0	116.7	N2340 R2341	D2338-N2340 PolarHBondContact O-N 3.33Å; D2338-R2341 PolarHBondContact O-N 3.31Å
2339	L	32.2	Very low	30.6	Very low	130.667 Å²	130.667	153.1 Å²	153.1	68%	0.684	75%	0.754	S	S	*	*			trans	-69.8	54.7	164.6	-68.6	172.5	0	0	0	117.5	P2146 M2336 R2341	P2146-L2339 HydrophobicContact CB-CD1 4.36Å; P2146-L2339 HydrophobicContact CG-CD1 4Å; M2336-L2339 HydrophobicContact CE-CD1 4.28Å; M2336-L2339 HydrophobicContact SD-CD1 4.43Å; L2339-R2341 PolarHBondContact O-N 3.27Å
2340	N	31.7	Very low	30.6	Very low	161.333 Å²	161.333	161.7 Å²	161.7	86%	0.863	76%	0.764	S	S	*	*			trans	-148.8	50	165.3	-85.9	-28.8	0	0	0	116.2	D2338	D2338-N2340 PolarHBondContact O-N 3.33Å
2341	R	28.9	Very low	30.9	Very low	214.667 Å²	214.667	164 Å²	164	81%	0.81	76%	0.764	S	S	*	*	S	Bend	trans	-75.3	135.8	150.1	-144.4	-178.6	-179.9	-160.3	2.1	112.7	D2338 L2339 I2343	D2338-R2341 PolarHBondContact O-N 3.31Å; L2339-R2341 PolarHBondContact O-N 3.27Å; R2341-I2343 PolarHBondContact O-N 3.06Å; R2341-I2343 VanDerWaalsContact O-N 3.09Å
2342	P	31.1	Very low	31	Very low	97.6667 Å²	97.6667	163.6 Å²	163.6	63%	0.634	76%	0.759	S	S	*	*			trans	-86.4	141	177.2	26.1	-22.8	0	0	0	111	A2344	P2342-A2344 PolarHBondContact O-N 2.91Å; P2342-A2344 VanDerWaalsContact O-N 3.08Å
2343	I	30.8	Very low	31	Very low	137 Å²	137	166 Å²	166	70%	0.703	77%	0.766	S	S	*	*			trans	-31.6	121.7	172.7	-58.7	175.6	0	0	0	110.3	R2341 Y2345	R2341-I2343 PolarHBondContact O-N 3.06Å; R2341-I2343 VanDerWaalsContact O-N 3.09Å; I2343-Y2345 HydrophobicContact CG2-CD2 4.35Å; I2343-Y2345 HydrophobicContact CG2-CE2 4.39Å; I2343-Y2345 PolarHBondContact O-N 3.14Å
2344	A	27.9	Very low	31.2	Very low	83.3333 Å²	83.3333	163.7 Å²	163.7	69%	0.689	76%	0.757	S	S	*	*			trans	-98.1	113.4	-154.6	0	0	0	0	0	108.9	P2342 T2346	P2342-A2344 PolarHBondContact O-N 2.91Å; P2342-A2344 VanDerWaalsContact O-N 3.08Å; A2344-T2346 PolarHBondContact O-N 2.99Å
2345	Y	27.8	Very low	31.4	Very low	188.333 Å²	188.333	162.8 Å²	162.8	74%	0.739	76%	0.76	S	S	*	*			trans	-18.7	121.9	176.5	-73.5	-88.7	0	0	0	111.4	I2343 R2347	I2343-Y2345 HydrophobicContact CG2-CD2 4.35Å; I2343-Y2345 HydrophobicContact CG2-CE2 4.39Å; I2343-Y2345 PolarHBondContact O-N 3.14Å; Y2345-R2347 VanDerWaalsContact C-N 3.3Å; Y2345-R2347 PolarHBondContact O-N 3.14Å
2346	T	31.3	Very low	31.7	Very low	125 Å²	125	160.5 Å²	160.5	77%	0.767	75%	0.754	S	S	*	*			trans	-87.4	123.2	174.2	29.2	0	0	0	0	109.9	A2344 R2348	A2344-T2346 PolarHBondContact O-N 2.99Å; T2346-R2348 PolarHBondContact O-N 3.34Å
2347	R	29.9	Very low	31.9	Very low	237.667 Å²	237.667	158.3 Å²	158.3	90%	0.897	75%	0.754	S	S	*	*			trans	-69.6	93.6	-177	-136	-179.6	-173.6	-169.5	2.8	111.1	Y2345 R2349	Y2345-R2347 VanDerWaalsContact C-N 3.3Å; Y2345-R2347 PolarHBondContact O-N 3.14Å; R2347-R2349 PolarHBondContact O-N 2.73Å
2348	R	31.5	Very low	32.1	Very low	211 Å²	211	151.9 Å²	151.9	80%	0.796	75%	0.748	S	S	*	*			trans	-127.4	124	169.4	-80.7	178.8	-177.7	-169.6	1.2	107.6	T2346 R2350	T2346-R2348 PolarHBondContact O-N 3.34Å; R2348-R2350 PolarHBondContact O-N 2.96Å
2349	R	32.8	Very low	32.4	Very low	194 Å²	194	150.8 Å²	150.8	73%	0.732	75%	0.748	S	S	*	*			trans	-72.3	98.1	165.2	-65	-178	176.4	178.2	0.1	111.6	R2347 Q2351	R2347-R2349 PolarHBondContact O-N 2.73Å; R2349-Q2351 HydrophobicContact CB-CG 4.42Å; R2349-Q2351 HydrophobicContact CG-CG 4.47Å; R2349-Q2351 PolarHBondContact O-N 3.33Å
2350	R	31.2	Very low	32.5	Very low	251.667 Å²	251.667	149.4 Å²	149.4	95%	0.95	74%	0.744	S	S	*	*			trans	-93	83.4	140.1	-109	-172.9	-178.2	-155.6	-0.2	105.8	R2348 Q2352	R2348-R2350 PolarHBondContact O-N 2.96Å; R2350-Q2352 VanDerWaalsContact C-N 3.3Å; R2350-Q2352 PolarHBondContact O-N 3.48Å
2351	Q	35.5	Very low	32.6	Very low	145 Å²	145	147.5 Å²	147.5	68%	0.678	73%	0.734	S	S	*	*			trans	-75.5	119.4	170.5	-74.5	-178.6	-31.2	0	0	107.1	R2349 L2353	R2349-Q2351 HydrophobicContact CB-CG 4.42Å; R2349-Q2351 HydrophobicContact CG-CG 4.47Å; R2349-Q2351 PolarHBondContact O-N 3.33Å; Q2351-L2353 PolarHBondContact O-N 3.14Å
2352	Q	34.7	Very low	32.9	Very low	149.333 Å²	149.333	143.2 Å²	143.2	70%	0.698	73%	0.725	S	S	*	*			trans	-37.3	101.7	168.9	-66.5	177.4	11.3	0	0	110.6	R2350 T2354	R2350-Q2352 VanDerWaalsContact C-N 3.3Å; R2350-Q2352 PolarHBondContact O-N 3.48Å; Q2352-T2354 HydrophobicContact CB-CG2 4.07Å; Q2352-T2354 PolarHBondContact O-N 2.97Å
2353	L	32.6	Very low	33.1	Very low	174.333 Å²	174.333	145.6 Å²	145.6	91%	0.913	73%	0.732	S	S	*	*			trans	-83.5	81.6	150.4	-72.3	172.6	0	0	0	107.5	Q2351	Q2351-L2353 PolarHBondContact O-N 3.14Å
2354	T	35	Very low	33.2	Very low	81 Å²	81	144.9 Å²	144.9	50%	0.497	73%	0.73	S	S	.	*			trans	-76.4	136.9	159.9	43.8	0	0	0	0	107.2	Q2352 K2356	Q2352-T2354 HydrophobicContact CB-CG2 4.07Å; Q2352-T2354 PolarHBondContact O-N 2.97Å; T2354-K2356 VanDerWaalsContact C-N 3.29Å; T2354-K2356 PolarHBondContact O-N 3.38Å; T2354-K2356 VanDerWaalsContact O-N 3.14Å; T2354-K2356 WeakPolarHBondContact OG1-CD 3.41Å
2355	P	33.5	Very low	33.2	Very low	126.333 Å²	126.333	145.8 Å²	145.8	82%	0.82	73%	0.73	S	S	*	*			trans	-62.3	109.9	169.2	27.6	-33.4	0	0	0	108.6	S2357	P2355-S2357 VanDerWaalsContact C-N 3.33Å; P2355-S2357 PolarHBondContact O-N 3.31Å
2356	K	36.9	Very low	33.4	Very low	163 Å²	163	143.5 Å²	143.5	71%	0.709	73%	0.73	S	S	*	*			trans	-105.5	94.1	179.6	-88.1	-168.2	175.1	-173.4	0	110.7	T2354	T2354-K2356 VanDerWaalsContact C-N 3.29Å; T2354-K2356 PolarHBondContact O-N 3.38Å; T2354-K2356 VanDerWaalsContact O-N 3.14Å; T2354-K2356 WeakPolarHBondContact OG1-CD 3.41Å
2357	S	34.8	Very low	33.3	Very low	104.333 Å²	104.333	143.5 Å²	143.5	73%	0.73	73%	0.73	S	S	*	*			trans	82.5	79.6	164.1	53.3	0	0	0	0	115.3	P2355 P2359	P2355-S2357 VanDerWaalsContact C-N 3.33Å; P2355-S2357 PolarHBondContact O-N 3.31Å; S2357-P2359 WeakPolarHBondContact O-CD 3.38Å
2358	A	34.4	Very low	33.4	Very low	86.6667 Å²	86.6667	138.7 Å²	138.7	72%	0.716	73%	0.728	S	S	*	*			trans	-80.7	129.7	148.7	0	0	0	0	0	108.7	V2360	A2358-V2360 PolarHBondContact O-N 3.01Å
2359	P	35.8	Very low	33.3	Very low	104.333 Å²	104.333	137.8 Å²	137.8	68%	0.677	73%	0.729	S	S	*	*			trans	-69.8	113.9	173.1	28.8	-32.5	0	0	0	109.3	S2357 L2361	S2357-P2359 WeakPolarHBondContact O-CD 3.38Å; P2359-L2361 PolarHBondContact O-N 3.14Å; P2359-L2361 VanDerWaalsContact O-N 3.12Å
2360	V	35.2	Very low	33.3	Very low	101 Å²	101	136 Å²	136	61%	0.612	73%	0.734	S	S	*	*			trans	-70.1	104.2	165.4	173.9	0	0	0	0	107.3	A2358 I2362	A2358-V2360 PolarHBondContact O-N 3.01Å; V2360-I2362 HydrophobicContact CG1-CG1 4Å; V2360-I2362 PolarHBondContact O-N 3.09Å; V2360-I2362 VanDerWaalsContact O-N 3.15Å
2361	L	34.1	Very low	33.3	Very low	122.333 Å²	122.333	128.9 Å²	128.9	64%	0.64	72%	0.723	S	S	*	*			trans	-71.2	96.4	165.2	-67.3	177.1	0	0	0	107.6	P2359 L2363	P2359-L2361 PolarHBondContact O-N 3.14Å; P2359-L2361 VanDerWaalsContact O-N 3.12Å; L2361-L2363 VanDerWaalsContact C-N 3.32Å; L2361-L2363 HydrophobicContact CB-CD1 4.38Å; L2361-L2363 PolarHBondContact O-N 3.12Å; L2361-L2363 VanDerWaalsContact O-N 3.09Å
2362	I	34	Very low	33.2	Very low	123.333 Å²	123.333	125.9 Å²	125.9	63%	0.632	72%	0.723	S	S	*	*			trans	-70.7	107.9	163.8	-56.2	179.4	0	0	0	106	V2360 D2364	V2360-I2362 HydrophobicContact CG1-CG1 4Å; V2360-I2362 PolarHBondContact O-N 3.09Å; V2360-I2362 VanDerWaalsContact O-N 3.15Å; I2362-D2364 VanDerWaalsContact C-N 3.27Å; I2362-D2364 HydrophobicContact CG2-CB 4.41Å; I2362-D2364 WeakPolarHBondContact CG2-OD1 3.35Å; I2362-D2364 PolarHBondContact O-N 3.14Å
2363	L	34.8	Very low	33	Very low	149 Å²	149	125.7 Å²	125.7	78%	0.78	73%	0.727	S	S	*	*			trans	-74.2	87.4	166	-79.6	136.8	0	0	0	107.9	L2361 C2365	L2361-L2363 VanDerWaalsContact C-N 3.32Å; L2361-L2363 HydrophobicContact CB-CD1 4.38Å; L2361-L2363 PolarHBondContact O-N 3.12Å; L2361-L2363 VanDerWaalsContact O-N 3.09Å; L2363-C2365 VanDerWaalsContact C-N 3.26Å; L2363-C2365 PolarHBondContact O-N 3.17Å
2364	D	33.2	Very low	33.1	Very low	122 Å²	122	126 Å²	126	65%	0.652	72%	0.724	S	S	*	*			trans	-69.2	76.5	170.9	-83.2	-37	0	0	0	109.7	I2362 N2366	I2362-D2364 VanDerWaalsContact C-N 3.27Å; I2362-D2364 HydrophobicContact CG2-CB 4.41Å; I2362-D2364 WeakPolarHBondContact CG2-OD1 3.35Å; I2362-D2364 PolarHBondContact O-N 3.14Å; D2364-N2366 VanDerWaalsContact C-N 3.34Å; D2364-N2366 PolarHBondContact O-N 3.19Å
2365	C	28.3	Very low	32.9	Very low	103 Å²	103	127.2 Å²	127.2	70%	0.696	74%	0.735	S	S	*	*			trans	-69.6	71.8	175.2	-38.5	0	0	0	0	110.9	L2363 T2367	L2363-C2365 VanDerWaalsContact C-N 3.26Å; L2363-C2365 PolarHBondContact O-N 3.17Å; C2365-T2367 VanDerWaalsContact C-N 3.25Å; C2365-T2367 PolarHBondContact O-N 2.98Å; C2365-T2367 PolarHBondContact O-OG1 2.9Å
2366	N	31.1	Very low	32.9	Very low	138.333 Å²	138.333	129.9 Å²	129.9	74%	0.74	73%	0.734	S	S	*	*			trans	-72.3	83.7	178.4	-78.6	-57.6	0	0	0	111.7	D2364 T2368	D2364-N2366 VanDerWaalsContact C-N 3.34Å; D2364-N2366 PolarHBondContact O-N 3.19Å; N2366-T2368 PolarHBondContact O-N 2.9Å
2367	T	29.5	Very low	32.8	Very low	125.333 Å²	125.333	128 Å²	128	77%	0.769	73%	0.732	S	S	*	*			trans	-81.7	105.8	169.1	44.9	0	0	0	0	109.5	C2365 K2369	C2365-T2367 VanDerWaalsContact C-N 3.25Å; C2365-T2367 PolarHBondContact O-N 2.98Å; C2365-T2367 PolarHBondContact O-OG1 2.9Å; T2367-K2369 PolarHBondContact O-N 3.27Å
2368	T	31.8	Very low	32.8	Very low	137 Å²	137	129.7 Å²	129.7	84%	0.84	73%	0.732	S	S	*	*			trans	-91.4	114.4	170.2	38.1	0	0	0	0	109.5	N2366 D2370	N2366-T2368 PolarHBondContact O-N 2.9Å; T2368-D2370 VanDerWaalsContact C-N 3.25Å; T2368-D2370 PolarHBondContact O-N 2.97Å
2369	K	30.6	Very low	32.8	Very low	192.333 Å²	192.333	132.4 Å²	132.4	84%	0.836	73%	0.73	S	S	*	*			trans	-86.6	103.8	177.9	-66.5	179.1	178.8	178.8	0	110.2	T2367	T2367-K2369 PolarHBondContact O-N 3.27Å
2370	D	32.8	Very low	32.7	Very low	155.667 Å²	155.667	132.8 Å²	132.8	83%	0.832	73%	0.726	S	S	*	*			trans	-136.9	132.5	144.6	-92.9	-43.3	0	0	0	108.6	T2368	T2368-D2370 VanDerWaalsContact C-N 3.25Å; T2368-D2370 PolarHBondContact O-N 2.97Å
2371	S	31.5	Very low	32.7	Very low	102.667 Å²	102.667	135.1 Å²	135.1	72%	0.718	74%	0.735	S	S	*	*			cis	-173.5	140	19.4	-78.4	0	0	0	0	112.1
2372	A	33.4	Very low	32.6	Very low	82.6667 Å²	82.6667	136.3 Å²	136.3	68%	0.683	74%	0.738	S	S	*	*			trans	112.9	154.1	141.4	0	0	0	0	0	116.1
2373	N	30.4	Very low	32.5	Very low	145.333 Å²	145.333	137.7 Å²	137.7	78%	0.777	75%	0.746	S	S	*	*			trans	100.6	145.2	161.8	-68.8	-24.8	0	0	0	114.9
2374	Q	33	Very low	32.4	Very low	180 Å²	180	135.8 Å²	135.8	84%	0.841	74%	0.742	S	S	*	*				174.8	105.5	111.4	-97.4	165	64	0	0	111.5
2375	S	31.3	Very low	32.2	Very low	106 Å²	106	137.3 Å²	137.3	74%	0.741	75%	0.749	S	S	*	*				114.5	123.9	89.2	-53.9	0	0	0	0	112.1
2376	K	34.4	Very low	32.5	Very low	183.667 Å²	183.667	140.7 Å²	140.7	80%	0.799	76%	0.755	S	S	*	*			trans	102.1	128.2	132.9	-75.2	-178.4	174.1	-168.1	0	113.1
2377	D	34.3	Very low	32.4	Very low	124 Å²	124	139.1 Å²	139.1	66%	0.663	76%	0.755	S	S	*	*			cis	179.6	145.1	12.7	-78.8	-29.8	0	0	0	109.6
2378	L	35.5	Very low	32.5	Very low	138.333 Å²	138.333	141.7 Å²	141.7	72%	0.724	76%	0.758	S	S	*	*				95.9	128.9	120.7	-51.8	178.9	0	0	0	116.6
2379	Q	34.1	Very low	32.5	Very low	145 Å²	145	143.2 Å²	143.2	68%	0.678	76%	0.756	S	S	*	*				111.6	136.3	76.2	-82.5	177.4	-67.8	0	0	116
2380	D	34.1	Very low	32.6	Very low	112.333 Å²	112.333	142 Å²	142	60%	0.601	75%	0.753	S	S	*	*				84.9	148.3	105.1	-62	-19.3	0	0	0	119
2381	N	33.9	Very low	32.5	Very low	148.667 Å²	148.667	143 Å²	143	80%	0.795	75%	0.752	S	S	*	*			trans	115.1	121.9	154.2	-63.6	-72.4	0	0	0	115
2382	E	33.3	Very low	32.6	Very low	148.333 Å²	148.333	145.7 Å²	145.7	69%	0.693	75%	0.754	S	S	*	*				95.3	137.4	110.3	-75.6	-127.4	119.5	0	0	118.2	I2852	E2382-I2852 HydrophobicContact CB-CD1 4.23Å; E2382-I2852 HydrophobicContact CG-CD1 3.21Å
2383	L	31.6	Very low	32.4	Very low	153 Å²	153	150.8 Å²	150.8	80%	0.801	76%	0.763	S	S	*	*			trans	108.9	156.5	138.9	-70.1	154.5	0	0	0	116.4
2384	P	32.3	Very low	32.5	Very low	107.333 Å²	107.333	153.6 Å²	153.6	70%	0.697	77%	0.769	S	S	*	*				-136.8	-169.7	-119	40.3	-21.3	0	0	0	115.2
2385	L	29.8	Very low	32.5	Very low	155 Å²	155	149.1 Å²	149.1	81%	0.812	76%	0.758	S	S	*	*			trans	80.6	143.8	171.2	-83.5	89.3	0	0	0	115.7
2386	Q	33	Very low	32.7	Very low	173.333 Å²	173.333	151.4 Å²	151.4	81%	0.81	76%	0.761	S	S	*	*				-172.6	133.9	106.8	-154.7	139.2	12.3	0	0	115.3
2387	S	29.1	Very low	33	Very low	105.667 Å²	105.667	148.1 Å²	148.1	74%	0.739	76%	0.757	S	S	*	*			trans	-50	141.1	169.8	57.8	0	0	0	0	117.2
2388	Q	32.7	Very low	33.3	Very low	179.333 Å²	179.333	147.7 Å²	147.7	84%	0.838	76%	0.755	S	S	*	*			trans	-138	145.1	146.5	-143.8	173.7	48.9	0	0	110.6
2389	Q	31.2	Very low	33.7	Very low	168.667 Å²	168.667	144.1 Å²	144.1	79%	0.788	74%	0.739	S	S	*	*			trans	-90.2	130.4	-174.3	-64.7	173.6	-7.5	0	0	111.3
2390	Q	33.1	Very low	34.3	Very low	166.333 Å²	166.333	140.3 Å²	140.3	78%	0.777	73%	0.725	S	S	*	*			trans	-123.7	125.3	145	-78.1	-166.3	7.5	0	0	109.1	Q2392	Q2390-Q2392 PolarHBondContact O-N 3.03Å
2391	Q	29.5	Very low	34.6	Very low	176.667 Å²	176.667	137.2 Å²	137.2	83%	0.826	71%	0.706	S	S	*	*			trans	-82.6	112.9	171.9	-66.4	173.2	-0.4	0	0	108.6	Q2393	Q2391-Q2393 PolarHBondContact O-N 3.38Å
2392	Q	34.5	Very low	35	Very low	160.667 Å²	160.667	132.2 Å²	132.2	75%	0.751	69%	0.691	S	S	*	*			trans	-108.1	135.2	161	-69.9	-168.2	5.1	0	0	108.5	Q2390 F2394	Q2390-Q2392 PolarHBondContact O-N 3.03Å; Q2392-F2394 PolarHBondContact O-N 3.25Å; Q2392-F2394 VanDerWaalsContact O-N 3.1Å
2393	Q	29.6	Very low	35.7	Very low	188.333 Å²	188.333	126 Å²	126	88%	0.88	66%	0.661	S	S	*	*			trans	-75.6	112	-169.3	-66.3	164.2	-55.2	0	0	110.4	Q2391 S2395	Q2391-Q2393 PolarHBondContact O-N 3.38Å; Q2393-S2395 PolarHBondContact O-N 3.41Å
2394	F	32.1	Very low	36.6	Very low	205.667 Å²	205.667	122.3 Å²	122.3	90%	0.902	64%	0.642	S	S	*	*			trans	-85.2	92.6	155.9	-79	-81.6	0	0	0	108.1	Q2392 N2396	Q2392-F2394 PolarHBondContact O-N 3.25Å; Q2392-F2394 VanDerWaalsContact O-N 3.1Å; F2394-N2396 PolarHBondContact O-N 2.94Å
2395	S	33.6	Very low	37.7	Very low	85.6667 Å²	85.6667	122.4 Å²	122.4	60%	0.599	64%	0.636	S	S	*	*			trans	-70.1	140.1	175.7	53.6	0	0	0	0	110.6	Q2393 T2397	Q2393-S2395 PolarHBondContact O-N 3.41Å; S2395-T2397 PolarHBondContact O-N 3.02Å
2396	N	35.7	Very low	39.1	Very low	153 Å²	153	117.9 Å²	117.9	82%	0.818	61%	0.611	S	S	*	*			trans	-16.4	103	177.1	-54.2	-14.8	0	0	0	112.7	F2394 D2398	F2394-N2396 PolarHBondContact O-N 2.94Å; N2396-D2398 VanDerWaalsContact C-N 3.33Å; N2396-D2398 PolarHBondContact O-N 3.3Å
2397	T	39.7	Very low	40.6	Very low	115 Å²	115	111.7 Å²	111.7	71%	0.706	59%	0.585	S	S	*	*			trans	-96.8	99.5	170.3	53.4	0	0	0	0	109.6	S2395 T2399	S2395-T2397 PolarHBondContact O-N 3.02Å; T2397-T2399 PolarHBondContact O-N 3.27Å
2398	D	40.3	Very low	42.2	Very low	115.333 Å²	115.333	110.9 Å²	110.9	62%	0.617	57%	0.571	S	S	*	*			trans	-36.9	102	169.3	-70.8	-41.5	0	0	0	112.4	N2396	N2396-D2398 VanDerWaalsContact C-N 3.33Å; N2396-D2398 PolarHBondContact O-N 3.3Å
2399	T	43.5	Very low	44	Very low	63.3333 Å²	63.3333	107.7 Å²	107.7	39%	0.389	55%	0.551	S	S	.	*			trans	-68.9	151.9	156.2	57	0	0	0	0	108.4	T2397 F2401 G2402 Y2403	T2397-T2399 PolarHBondContact O-N 3.27Å; T2399-F2401 PolarHBondContact O-N 2.98Å; T2399-G2402 PolarHBondContact O-N 3.16Å; T2399-Y2403 VanDerWaalsContact CB-O 3.22Å; T2399-Y2403 WeakPolarHBondContact CB-O 3.38Å; T2399-Y2403 WeakPolarHBondContact CG2-O 3.32Å; T2399-Y2403 PolarHBondContact N-O 2.87Å; T2399-Y2403 VanDerWaalsContact OG1-C 3.26Å; T2399-Y2403 PolarHBondContact OG1-N 2.9Å; T2399-Y2403 PolarHBondContact OG1-O 3.08Å
2400	V	46.6	Very low	45.7	Very low	65 Å²	65	106.5 Å²	106.5	39%	0.394	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-6	-166.5	151.5	0	0	0	0	115.3	N2600	V2400-N2600 HydrophobicContact CB-CB 4.49Å; V2400-N2600 HydrophobicContact CG2-CB 3.75Å
2401	F	42.3	Very low	47.2	Very low	46.5 Å²	46.5	102.5 Å²	102.5	20%	0.204	52%	0.52	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.2	15.1	173	-63.3	-73.7	0	0	0	114.4	T2399 Y2403 F2685 V2688	T2399-F2401 PolarHBondContact O-N 2.98Å; F2401-Y2403 HydrophobicContact CB-CD2 3.77Å; F2401-Y2403 HydrophobicContact CB-CE2 3.75Å; F2401-Y2403 WeakPolarHBondContact O-CD2 3.35Å; F2401-Y2403 VanDerWaalsContact O-CE2 3.26Å; F2401-Y2403 WeakPolarHBondContact O-CE2 3.45Å; F2401-Y2403 PolarHBondContact O-N 3.48Å; F2401-Y2403 VanDerWaalsContact O-N 3.16Å; F2401-F2685 HydrophobicContact CD1-CE2 4.12Å; F2401-F2685 HydrophobicContact CE1-CD2 4.17Å; F2401-F2685 HydrophobicContact CE1-CE2 4.11Å; F2401-V2688 HydrophobicContact CE1-CG1 4.04Å; F2401-V2688 HydrophobicContact CZ-CG1 3.79Å
2402	G	41.4	Very low	49.1	Very low	45 Å²	45	97.2 Å²	97.2	46%	0.464	51%	0.506	S	S	.	.	S	Bend	trans	75.1	14.8	-176.8	0	0	0	0	0	114.5	T2399	T2399-G2402 PolarHBondContact O-N 3.16Å
2403	Y	48.2	Very low	51.1	Low	17 Å²	17	94.5 Å²	94.5	7%	0.067	49%	0.494	C	S	.	.			trans	-126.8	146.6	-176.7	-58.7	-65.6	0	0	0	110.2	T2399 F2401 T2407 M2408 F2411 T2646 I2649	T2399-Y2403 VanDerWaalsContact CB-O 3.22Å; T2399-Y2403 WeakPolarHBondContact CB-O 3.38Å; T2399-Y2403 WeakPolarHBondContact CG2-O 3.32Å; T2399-Y2403 PolarHBondContact N-O 2.87Å; T2399-Y2403 VanDerWaalsContact OG1-C 3.26Å; T2399-Y2403 PolarHBondContact OG1-N 2.9Å; T2399-Y2403 PolarHBondContact OG1-O 3.08Å; F2401-Y2403 HydrophobicContact CB-CD2 3.77Å; F2401-Y2403 HydrophobicContact CB-CE2 3.75Å; F2401-Y2403 WeakPolarHBondContact O-CD2 3.35Å; F2401-Y2403 VanDerWaalsContact O-CE2 3.26Å; F2401-Y2403 WeakPolarHBondContact O-CE2 3.45Å; F2401-Y2403 PolarHBondContact O-N 3.48Å; F2401-Y2403 VanDerWaalsContact O-N 3.16Å; Y2403-T2407 HydrophobicContact CD1-CG2 3.54Å; Y2403-T2407 VanDerWaalsContact CD1-CG2 3.41Å; Y2403-T2407 HydrophobicContact CE1-CG2 4.18Å; Y2403-T2407 HydrophobicContact CG-CG2 3.94Å; Y2403-M2408 HydrophobicContact CD2-CG 3.95Å; Y2403-M2408 HydrophobicContact CD2-SD 3.49Å; Y2403-M2408 WeakPolarHBondContact CD2-SD 3.41Å; Y2403-M2408 HydrophobicContact CE2-SD 4.05Å; Y2403-M2408 HydrophobicContact CG-CG 4.29Å; Y2403-M2408 HydrophobicContact CG-SD 4.42Å; Y2403-F2411 HydrophobicContact CD1-CE2 4.04Å; Y2403-F2411 HydrophobicContact CD2-CE2 4.29Å; Y2403-F2411 AromaticContact CE1-CE2 3.49Å; Y2403-F2411 HydrophobicContact CE1-CE2 3.93Å; Y2403-F2411 VanDerWaalsContact CE1-CE2 3.49Å; Y2403-F2411 HydrophobicContact CE1-CZ 4.05Å; Y2403-F2411 HydrophobicContact CE2-CD2 4.3Å; Y2403-F2411 AromaticContact CE2-CE2 3.74Å; Y2403-F2411 HydrophobicContact CE2-CE2 3.74Å; Y2403-F2411 HydrophobicContact CE2-CZ 4.46Å; Y2403-F2411 HydrophobicContact CG-CE2 4.41Å; Y2403-F2411 AromaticContact CZ-CE2 3.28Å; Y2403-F2411 AromaticContact CZ-CZ 3.73Å; Y2403-F2411 WeakPolarHBondContact OH-CE2 3.38Å; Y2403-F2411 VanDerWaalsContact OH-CZ 3.29Å; Y2403-F2411 WeakPolarHBondContact OH-CZ 3.43Å; Y2403-T2646 WeakPolarHBondContact CE1-OG1 3.02Å; Y2403-T2646 WeakPolarHBondContact OH-CA 3.49Å; Y2403-T2646 VanDerWaalsContact OH-CB 3.23Å; Y2403-T2646 WeakPolarHBondContact OH-CB 3.38Å; Y2403-T2646 VanDerWaalsContact OH-CG2 3.26Å; Y2403-T2646 WeakPolarHBondContact OH-CG2 3.5Å; Y2403-T2646 PolarHBondContact OH-OG1 2.74Å; Y2403-I2649 HydrophobicContact CD2-CD1 4.36Å; Y2403-I2649 HydrophobicContact CE2-CD1 3.73Å
2404	D	49.9	Very low	53.1	Low	76 Å²	76	87.9 Å²	87.9	41%	0.406	47%	0.471	S	S	.	.			trans	-79	165.5	161.1	63	-10	0	0	0	111.5	E2406 T2407 M2408	D2404-E2406 PolarHBondContact O-N 3.38Å; D2404-E2406 VanDerWaalsContact O-N 3.13Å; D2404-E2406 WeakPolarHBondContact OD2-CB 3.31Å; D2404-T2407 PolarHBondContact O-N 3.31Å; D2404-T2407 VanDerWaalsContact O-N 3.13Å; D2404-T2407 WeakPolarHBondContact OD1-CB 3.3Å; D2404-T2407 PolarHBondContact OD1-N 3.15Å; D2404-T2407 PolarHBondContact OD1-OG1 3.16Å; D2404-M2408 PolarHBondContact O-N 2.82Å; D2404-M2408 VanDerWaalsContact O-N 3.1Å
2405	D	55.1	Low	54.8	Low	108.5 Å²	108.5	80.9 Å²	80.9	58%	0.58	44%	0.443	S	S	*	.	H	α-helix	trans	-57.8	-24	175.8	-96.5	1.4	0	0	0	112.3	R2409	D2405-R2409 VanDerWaalsContact O-CB 3.26Å; D2405-R2409 WeakPolarHBondContact O-CB 3.45Å; D2405-R2409 VanDerWaalsContact O-CZ 3.3Å; D2405-R2409 PolarHBondContact O-N 3.02Å; D2405-R2409 PolarHBondContact O-NH2 3.47Å; D2405-R2409 VanDerWaalsContact O-NH2 3.12Å
2406	E	59	Low	56.7	Low	61.5 Å²	61.5	82 Å²	82	29%	0.287	44%	0.439	S	S	.	.	H	α-helix	trans	-75.6	-47.9	175.4	-179.5	66.4	179	0	0	111.7	D2404 M2408 R2409 R2410	D2404-E2406 PolarHBondContact O-N 3.38Å; D2404-E2406 VanDerWaalsContact O-N 3.13Å; D2404-E2406 WeakPolarHBondContact OD2-CB 3.31Å; E2406-M2408 VanDerWaalsContact C-N 3.29Å; E2406-M2408 PolarHBondContact O-N 3.12Å; E2406-R2409 CarbonylContact O-C 3.47Å; E2406-R2409 WeakPolarHBondContact O-CA 3.38Å; E2406-R2409 VanDerWaalsContact O-CB 3.28Å; E2406-R2409 WeakPolarHBondContact O-CB 3.38Å; E2406-R2409 PolarHBondContact O-N 3.18Å; E2406-R2409 IonicContact OE2-CZ 3.15Å; E2406-R2409 IonicContact OE2-NE 3.76Å; E2406-R2409 IonicContact OE2-NH1 2.71Å; E2406-R2409 PolarHBondContact OE2-NH1 3.36Å; E2406-R2410 HydrophobicContact CG-CG 4.35Å; E2406-R2410 WeakPolarHBondContact O-CG 3.44Å; E2406-R2410 PolarHBondContact O-N 3.26Å; E2406-R2410 IonicContact OE1-CZ 3.11Å; E2406-R2410 IonicContact OE1-NE 3.4Å; E2406-R2410 PolarHBondContact OE1-NE 3.45Å; E2406-R2410 IonicContact OE1-NH2 3.24Å; E2406-R2410 PolarHBondContact OE1-NH2 2.73Å
2407	T	66.4	Low	58.7	Low	42.5 Å²	42.5	77.5 Å²	77.5	26%	0.261	42%	0.423	S	S	.	.	H	α-helix	trans	-63.3	-39.5	179.1	-59.7	0	0	0	0	111.6	Y2403 D2404 R2409 R2410 F2411	Y2403-T2407 HydrophobicContact CD1-CG2 3.54Å; Y2403-T2407 VanDerWaalsContact CD1-CG2 3.41Å; Y2403-T2407 HydrophobicContact CE1-CG2 4.18Å; Y2403-T2407 HydrophobicContact CG-CG2 3.94Å; D2404-T2407 PolarHBondContact O-N 3.31Å; D2404-T2407 VanDerWaalsContact O-N 3.13Å; D2404-T2407 WeakPolarHBondContact OD1-CB 3.3Å; D2404-T2407 PolarHBondContact OD1-N 3.15Å; D2404-T2407 PolarHBondContact OD1-OG1 3.16Å; T2407-R2409 VanDerWaalsContact C-N 3.33Å; T2407-R2409 PolarHBondContact O-N 3.22Å; T2407-R2410 WeakPolarHBondContact O-CB 3.37Å; T2407-R2410 PolarHBondContact O-N 3.22Å; T2407-F2411 HydrophobicContact CG2-CD2 3.87Å; T2407-F2411 HydrophobicContact CG2-CE2 3.62Å; T2407-F2411 VanDerWaalsContact O-CD2 3.25Å; T2407-F2411 WeakPolarHBondContact O-CD2 3.49Å; T2407-F2411 PolarHBondContact O-N 3.36Å
2408	M	61.7	Low	60.3	Low	89.5 Å²	89.5	76.5 Å²	76.5	44%	0.441	41%	0.407	S	S	.	.	H	α-helix	trans	-63.4	-33.1	172.7	-78.2	-62.3	-62.6	0	0	113	Y2403 D2404 E2406 A2412	Y2403-M2408 HydrophobicContact CD2-CG 3.95Å; Y2403-M2408 HydrophobicContact CD2-SD 3.49Å; Y2403-M2408 WeakPolarHBondContact CD2-SD 3.41Å; Y2403-M2408 HydrophobicContact CE2-SD 4.05Å; Y2403-M2408 HydrophobicContact CG-CG 4.29Å; Y2403-M2408 HydrophobicContact CG-SD 4.42Å; D2404-M2408 PolarHBondContact O-N 2.82Å; D2404-M2408 VanDerWaalsContact O-N 3.1Å; E2406-M2408 VanDerWaalsContact C-N 3.29Å; E2406-M2408 PolarHBondContact O-N 3.12Å; M2408-A2412 PolarHBondContact O-N 2.98Å
2409	R	69.8	Low	61.8	Low	111.5 Å²	111.5	75.4 Å²	75.4	42%	0.421	39%	0.394	S	S	.	.	H	α-helix	trans	-69.1	-47.5	172.7	176.9	-176.6	-55.4	114.1	16.5	111.5	D2405 E2406 T2407 F2411 A2412 E2413	D2405-R2409 VanDerWaalsContact O-CB 3.26Å; D2405-R2409 WeakPolarHBondContact O-CB 3.45Å; D2405-R2409 VanDerWaalsContact O-CZ 3.3Å; D2405-R2409 PolarHBondContact O-N 3.02Å; D2405-R2409 PolarHBondContact O-NH2 3.47Å; D2405-R2409 VanDerWaalsContact O-NH2 3.12Å; E2406-R2409 CarbonylContact O-C 3.47Å; E2406-R2409 WeakPolarHBondContact O-CA 3.38Å; E2406-R2409 VanDerWaalsContact O-CB 3.28Å; E2406-R2409 WeakPolarHBondContact O-CB 3.38Å; E2406-R2409 PolarHBondContact O-N 3.18Å; E2406-R2409 IonicContact OE2-CZ 3.15Å; E2406-R2409 IonicContact OE2-NE 3.76Å; E2406-R2409 IonicContact OE2-NH1 2.71Å; E2406-R2409 PolarHBondContact OE2-NH1 3.36Å; T2407-R2409 VanDerWaalsContact C-N 3.33Å; T2407-R2409 PolarHBondContact O-N 3.22Å; R2409-F2411 VanDerWaalsContact C-N 3.29Å; R2409-F2411 PolarHBondContact O-N 3.2Å; R2409-A2412 WeakPolarHBondContact O-CB 3.27Å; R2409-A2412 PolarHBondContact O-N 3.02Å; R2409-E2413 VanDerWaalsContact CG-OE1 3.3Å; R2409-E2413 WeakPolarHBondContact CG-OE1 3.29Å; R2409-E2413 WeakPolarHBondContact O-CG 3.45Å; R2409-E2413 PolarHBondContact O-N 2.76Å
2410	R	68.3	Low	63.6	Low	144.5 Å²	144.5	76.8 Å²	76.8	55%	0.545	40%	0.398	S	S	.	.	H	α-helix	trans	-56.7	-40.8	176	-61.4	-81.4	-177.8	89.4	10.1	111.8	E2406 T2407 E2413 A2414	E2406-R2410 HydrophobicContact CG-CG 4.35Å; E2406-R2410 WeakPolarHBondContact O-CG 3.44Å; E2406-R2410 PolarHBondContact O-N 3.26Å; E2406-R2410 IonicContact OE1-CZ 3.11Å; E2406-R2410 IonicContact OE1-NE 3.4Å; E2406-R2410 PolarHBondContact OE1-NE 3.45Å; E2406-R2410 IonicContact OE1-NH2 3.24Å; E2406-R2410 PolarHBondContact OE1-NH2 2.73Å; T2407-R2410 WeakPolarHBondContact O-CB 3.37Å; T2407-R2410 PolarHBondContact O-N 3.22Å; R2410-E2413 PolarHBondContact O-N 3.29Å; R2410-A2414 VanDerWaalsContact O-CB 3.28Å; R2410-A2414 WeakPolarHBondContact O-CB 3.32Å; R2410-A2414 PolarHBondContact O-N 2.89Å
2411	F	64.4	Low	65.1	Low	81 Å²	81	76.8 Å²	76.8	36%	0.355	40%	0.401	S	S	.	.	H	α-helix	trans	-65	-39.8	174.8	-83.6	-61.3	0	0	0	113.4	Y2403 T2407 R2409 A2414 D2415 F2821	Y2403-F2411 HydrophobicContact CD1-CE2 4.04Å; Y2403-F2411 HydrophobicContact CD2-CE2 4.29Å; Y2403-F2411 AromaticContact CE1-CE2 3.49Å; Y2403-F2411 HydrophobicContact CE1-CE2 3.93Å; Y2403-F2411 VanDerWaalsContact CE1-CE2 3.49Å; Y2403-F2411 HydrophobicContact CE1-CZ 4.05Å; Y2403-F2411 HydrophobicContact CE2-CD2 4.3Å; Y2403-F2411 AromaticContact CE2-CE2 3.74Å; Y2403-F2411 HydrophobicContact CE2-CE2 3.74Å; Y2403-F2411 HydrophobicContact CE2-CZ 4.46Å; Y2403-F2411 HydrophobicContact CG-CE2 4.41Å; Y2403-F2411 AromaticContact CZ-CE2 3.28Å; Y2403-F2411 AromaticContact CZ-CZ 3.73Å; Y2403-F2411 WeakPolarHBondContact OH-CE2 3.38Å; Y2403-F2411 VanDerWaalsContact OH-CZ 3.29Å; Y2403-F2411 WeakPolarHBondContact OH-CZ 3.43Å; T2407-F2411 HydrophobicContact CG2-CD2 3.87Å; T2407-F2411 HydrophobicContact CG2-CE2 3.62Å; T2407-F2411 VanDerWaalsContact O-CD2 3.25Å; T2407-F2411 WeakPolarHBondContact O-CD2 3.49Å; T2407-F2411 PolarHBondContact O-N 3.36Å; R2409-F2411 VanDerWaalsContact C-N 3.29Å; R2409-F2411 PolarHBondContact O-N 3.2Å; F2411-A2414 PolarHBondContact O-N 2.89Å; F2411-D2415 PolarHBondContact O-N 3.22Å; F2411-F2821 HydrophobicContact CE1-CZ 4.11Å; F2411-F2821 HydrophobicContact CZ-CE1 4.48Å; F2411-F2821 AromaticContact CZ-CZ 3.71Å; F2411-F2821 HydrophobicContact CZ-CZ 3.71Å
2412	A	68.7	Low	66.6	Low	65 Å²	65	77.9 Å²	77.9	54%	0.537	41%	0.406	S	S	.	.	H	α-helix	trans	-67.2	-42.4	176.6	0	0	0	0	0	111.7	M2408 R2409 A2414 D2415 E2416	M2408-A2412 PolarHBondContact O-N 2.98Å; R2409-A2412 WeakPolarHBondContact O-CB 3.27Å; R2409-A2412 PolarHBondContact O-N 3.02Å; A2412-A2414 VanDerWaalsContact C-N 3.29Å; A2412-A2414 PolarHBondContact O-N 3.37Å; A2412-D2415 PolarHBondContact O-N 3.17Å; A2412-E2416 WeakPolarHBondContact O-CB 3.35Å; A2412-E2416 PolarHBondContact O-N 3.25Å
2413	E	76	Confident	68.3	Low	105.5 Å²	105.5	80.8 Å²	80.8	49%	0.493	41%	0.408	S	S	.	.	H	α-helix	trans	-63.7	-38	175	-70.2	170.5	-179.7	0	0	111.9	R2409 R2410 E2416 A2417	R2409-E2413 VanDerWaalsContact CG-OE1 3.3Å; R2409-E2413 WeakPolarHBondContact CG-OE1 3.29Å; R2409-E2413 WeakPolarHBondContact O-CG 3.45Å; R2409-E2413 PolarHBondContact O-N 2.76Å; R2410-E2413 PolarHBondContact O-N 3.29Å; E2413-E2416 PolarHBondContact O-N 2.96Å; E2413-A2417 WeakPolarHBondContact O-CB 3.35Å; E2413-A2417 PolarHBondContact O-N 2.9Å
2414	A	71.9	Confident	69.8	Low	49.5 Å²	49.5	86.5 Å²	86.5	41%	0.409	43%	0.433	S	S	.	.	H	α-helix	trans	-67	-43.2	176.2	0	0	0	0	0	113.3	R2410 F2411 A2412 A2417 Y2418	R2410-A2414 VanDerWaalsContact O-CB 3.28Å; R2410-A2414 WeakPolarHBondContact O-CB 3.32Å; R2410-A2414 PolarHBondContact O-N 2.89Å; F2411-A2414 PolarHBondContact O-N 2.89Å; A2412-A2414 VanDerWaalsContact C-N 3.29Å; A2412-A2414 PolarHBondContact O-N 3.37Å; A2414-A2417 PolarHBondContact O-N 2.8Å; A2414-Y2418 VanDerWaalsContact O-CB 3.27Å; A2414-Y2418 WeakPolarHBondContact O-CB 3.35Å; A2414-Y2418 PolarHBondContact O-N 3.14Å; A2414-Y2418 VanDerWaalsContact O-N 3.08Å
2415	D	68.2	Low	71	Confident	58 Å²	58	88.4 Å²	88.4	31%	0.31	44%	0.439	S	S	.	.	H	α-helix	trans	-67.8	-37.1	173.7	-172.2	65	0	0	0	111.4	F2411 A2412 Y2418 R2419	F2411-D2415 PolarHBondContact O-N 3.22Å; A2412-D2415 PolarHBondContact O-N 3.17Å; D2415-Y2418 CarbonylContact O-C 3.56Å; D2415-Y2418 PolarHBondContact O-N 3.31Å; D2415-R2419 WeakPolarHBondContact O-CB 3.47Å; D2415-R2419 WeakPolarHBondContact O-CG 3.17Å; D2415-R2419 PolarHBondContact O-N 3.29Å; D2415-R2419 VanDerWaalsContact OD2-CD 3.29Å; D2415-R2419 WeakPolarHBondContact OD2-CD 3.29Å; D2415-R2419 IonicContact OD2-NH1 2.94Å
2416	E	73.8	Confident	71.8	Confident	109.5 Å²	109.5	88.1 Å²	88.1	51%	0.512	43%	0.434	S	S	.	.	H	α-helix	trans	-61.3	-47.4	173.1	179.3	134.3	-120.3	0	0	111.6	A2412 E2413 Y2418 R2419 L2420	A2412-E2416 WeakPolarHBondContact O-CB 3.35Å; A2412-E2416 PolarHBondContact O-N 3.25Å; E2413-E2416 PolarHBondContact O-N 2.96Å; E2416-Y2418 PolarHBondContact O-N 3.12Å; E2416-R2419 WeakPolarHBondContact O-CB 3.35Å; E2416-R2419 PolarHBondContact O-N 3.36Å; E2416-R2419 IonicContact OE1-CZ 3.21Å; E2416-R2419 IonicContact OE1-NE 2.94Å; E2416-R2419 PolarHBondContact OE1-NE 2.86Å; E2416-R2419 IonicContact OE1-NH2 2.65Å; E2416-R2419 PolarHBondContact OE1-NH2 3.24Å; E2416-L2420 HydrophobicContact CG-CD1 4.09Å; E2416-L2420 HydrophobicContact CG-CG 4.31Å; E2416-L2420 WeakPolarHBondContact O-CB 3.1Å; E2416-L2420 VanDerWaalsContact O-CG 3.27Å; E2416-L2420 WeakPolarHBondContact O-CG 3.34Å; E2416-L2420 PolarHBondContact O-N 3.18Å
2417	A	76.7	Confident	72.5	Confident	58 Å²	58	90.4 Å²	90.4	48%	0.479	45%	0.445	S	S	.	.	H	α-helix	trans	-59.4	-43.2	176.5	0	0	0	0	0	111.9	E2413 A2414 R2419 L2420 S2421	E2413-A2417 WeakPolarHBondContact O-CB 3.35Å; E2413-A2417 PolarHBondContact O-N 2.9Å; A2414-A2417 PolarHBondContact O-N 2.8Å; A2417-R2419 VanDerWaalsContact C-N 3.33Å; A2417-R2419 PolarHBondContact O-N 2.94Å; A2417-L2420 PolarHBondContact O-N 3.27Å; A2417-L2420 VanDerWaalsContact O-N 3.17Å; A2417-S2421 PolarHBondContact O-N 3.11Å; A2417-S2421 PolarHBondContact O-OG 2.9Å
2418	Y	74.7	Confident	72.9	Confident	94 Å²	94	92.1 Å²	92.1	37%	0.369	45%	0.452	S	S	.	.	H	α-helix	trans	-67.2	-33.8	175.4	-179.1	-109.2	0	0	0	113.1	A2414 D2415 E2416 L2420 S2421 K2422 Y2813	A2414-Y2418 VanDerWaalsContact O-CB 3.27Å; A2414-Y2418 WeakPolarHBondContact O-CB 3.35Å; A2414-Y2418 PolarHBondContact O-N 3.14Å; A2414-Y2418 VanDerWaalsContact O-N 3.08Å; D2415-Y2418 CarbonylContact O-C 3.56Å; D2415-Y2418 PolarHBondContact O-N 3.31Å; E2416-Y2418 PolarHBondContact O-N 3.12Å; Y2418-L2420 VanDerWaalsContact C-N 3.3Å; Y2418-L2420 PolarHBondContact O-N 2.87Å; Y2418-S2421 PolarHBondContact O-N 2.81Å; Y2418-S2421 PolarHBondContact O-OG 3.27Å; Y2418-K2422 HydrophobicContact CE1-CD 4.13Å; Y2418-K2422 VanDerWaalsContact O-CB 3.32Å; Y2418-K2422 WeakPolarHBondContact O-CB 3.31Å; Y2418-K2422 PolarHBondContact O-N 2.93Å; Y2418-K2422 PolarHBondContact OH-NZ 3.44Å; Y2418-Y2813 HydrophobicContact CD2-CE2 4.4Å; Y2418-Y2813 HydrophobicContact CE2-CD2 4.32Å; Y2418-Y2813 AromaticContact CE2-CE2 3.99Å; Y2418-Y2813 HydrophobicContact CE2-CE2 3.99Å
2419	R	72.2	Confident	73.4	Confident	92.5 Å²	92.5	91.6 Å²	91.6	35%	0.349	45%	0.452	S	S	.	.	H	α-helix	trans	-67.4	-38.7	172.1	-121.3	-175	72.1	87	-5.6	111.3	D2415 E2416 A2417 K2422 Q2423	D2415-R2419 WeakPolarHBondContact O-CB 3.47Å; D2415-R2419 WeakPolarHBondContact O-CG 3.17Å; D2415-R2419 PolarHBondContact O-N 3.29Å; D2415-R2419 VanDerWaalsContact OD2-CD 3.29Å; D2415-R2419 WeakPolarHBondContact OD2-CD 3.29Å; D2415-R2419 IonicContact OD2-NH1 2.94Å; E2416-R2419 WeakPolarHBondContact O-CB 3.35Å; E2416-R2419 PolarHBondContact O-N 3.36Å; E2416-R2419 IonicContact OE1-CZ 3.21Å; E2416-R2419 IonicContact OE1-NE 2.94Å; E2416-R2419 PolarHBondContact OE1-NE 2.86Å; E2416-R2419 IonicContact OE1-NH2 2.65Å; E2416-R2419 PolarHBondContact OE1-NH2 3.24Å; A2417-R2419 VanDerWaalsContact C-N 3.33Å; A2417-R2419 PolarHBondContact O-N 2.94Å; R2419-K2422 PolarHBondContact O-N 3.27Å; R2419-Q2423 VanDerWaalsContact O-CB 3.27Å; R2419-Q2423 WeakPolarHBondContact O-CB 3.32Å; R2419-Q2423 PolarHBondContact O-N 2.92Å; R2419-Q2423 VanDerWaalsContact O-N 3.14Å
2420	L	80.3	Confident	73.3	Confident	91.5 Å²	91.5	93.9 Å²	93.9	48%	0.479	46%	0.46	S	S	.	.	H	α-helix	trans	-69.9	-45.4	177.4	-71.1	170.5	0	0	0	112.1	E2416 A2417 Y2418 K2422 Q2423 K2424	E2416-L2420 HydrophobicContact CG-CD1 4.09Å; E2416-L2420 HydrophobicContact CG-CG 4.31Å; E2416-L2420 WeakPolarHBondContact O-CB 3.1Å; E2416-L2420 VanDerWaalsContact O-CG 3.27Å; E2416-L2420 WeakPolarHBondContact O-CG 3.34Å; E2416-L2420 PolarHBondContact O-N 3.18Å; A2417-L2420 PolarHBondContact O-N 3.27Å; A2417-L2420 VanDerWaalsContact O-N 3.17Å; Y2418-L2420 VanDerWaalsContact C-N 3.3Å; Y2418-L2420 PolarHBondContact O-N 2.87Å; L2420-K2422 VanDerWaalsContact C-N 3.31Å; L2420-K2422 PolarHBondContact O-N 2.89Å; L2420-Q2423 WeakPolarHBondContact O-CB 3.42Å; L2420-Q2423 PolarHBondContact O-N 3.27Å; L2420-Q2423 VanDerWaalsContact O-N 3.12Å; L2420-K2424 PolarHBondContact O-N 3.01Å
2421	S	77.3	Confident	73.3	Confident	66 Å²	66	92.9 Å²	92.9	46%	0.462	46%	0.46	S	S	.	.	H	α-helix	trans	-61.1	-43.5	177	70.1	0	0	0	0	111.7	A2417 Y2418 Q2423 K2424 Q2425	A2417-S2421 PolarHBondContact O-N 3.11Å; A2417-S2421 PolarHBondContact O-OG 2.9Å; Y2418-S2421 PolarHBondContact O-N 2.81Å; Y2418-S2421 PolarHBondContact O-OG 3.27Å; S2421-Q2423 VanDerWaalsContact C-N 3.3Å; S2421-Q2423 PolarHBondContact O-N 2.8Å; S2421-K2424 WeakPolarHBondContact O-CB 3.37Å; S2421-K2424 PolarHBondContact O-N 3.25Å; S2421-K2424 VanDerWaalsContact O-N 3.15Å; S2421-Q2425 WeakPolarHBondContact O-CB 3.25Å; S2421-Q2425 PolarHBondContact O-N 3.14Å
2422	K	75.4	Confident	73.4	Confident	69 Å²	69	94.2 Å²	94.2	30%	0.3	47%	0.469	S	S	.	.	H	α-helix	trans	-67.8	-30.7	175.4	-165.9	164.8	-166.8	155.1	0	113.2	Y2418 R2419 L2420 H2426	Y2418-K2422 HydrophobicContact CE1-CD 4.13Å; Y2418-K2422 VanDerWaalsContact O-CB 3.32Å; Y2418-K2422 WeakPolarHBondContact O-CB 3.31Å; Y2418-K2422 PolarHBondContact O-N 2.93Å; Y2418-K2422 PolarHBondContact OH-NZ 3.44Å; R2419-K2422 PolarHBondContact O-N 3.27Å; L2420-K2422 VanDerWaalsContact C-N 3.31Å; L2420-K2422 PolarHBondContact O-N 2.89Å; K2422-H2426 WeakPolarHBondContact O-CB 3.37Å; K2422-H2426 PolarHBondContact O-CD2 2.93Å; K2422-H2426 PolarHBondContact O-N 2.97Å; K2422-H2426 VanDerWaalsContact O-N 3.08Å
2423	Q	76.4	Confident	73	Confident	107 Å²	107	99 Å²	99	50%	0.5	47%	0.473	S	S	.	.	H	α-helix	trans	-67.7	-42.6	172.1	179.8	168	-42.7	0	0	111.4	R2419 L2420 S2421 H2426 Q2427	R2419-Q2423 VanDerWaalsContact O-CB 3.27Å; R2419-Q2423 WeakPolarHBondContact O-CB 3.32Å; R2419-Q2423 PolarHBondContact O-N 2.92Å; R2419-Q2423 VanDerWaalsContact O-N 3.14Å; L2420-Q2423 WeakPolarHBondContact O-CB 3.42Å; L2420-Q2423 PolarHBondContact O-N 3.27Å; L2420-Q2423 VanDerWaalsContact O-N 3.12Å; S2421-Q2423 VanDerWaalsContact C-N 3.3Å; S2421-Q2423 PolarHBondContact O-N 2.8Å; Q2423-H2426 PolarHBondContact O-N 3.16Å; Q2423-Q2427 PolarHBondContact O-N 3.36Å; Q2423-Q2427 VanDerWaalsContact O-N 3.12Å
2424	K	79.3	Confident	72.4	Confident	137 Å²	137	101.4 Å²	101.4	60%	0.596	48%	0.477	S	S	*	.	H	α-helix	trans	-60	-52.3	173.6	-172.8	-177.5	174.7	-174.7	0	110.9	L2420 S2421 H2426 Q2427 D2428	L2420-K2424 PolarHBondContact O-N 3.01Å; S2421-K2424 WeakPolarHBondContact O-CB 3.37Å; S2421-K2424 PolarHBondContact O-N 3.25Å; S2421-K2424 VanDerWaalsContact O-N 3.15Å; K2424-H2426 PolarHBondContact O-N 3.25Å; K2424-H2426 VanDerWaalsContact O-N 3.13Å; K2424-Q2427 CarbonylContact O-C 3.59Å; K2424-Q2427 WeakPolarHBondContact O-CA 3.34Å; K2424-Q2427 WeakPolarHBondContact O-CB 3.31Å; K2424-Q2427 PolarHBondContact O-N 2.9Å; K2424-D2428 VanDerWaalsContact O-CG 3.29Å; K2424-D2428 PolarHBondContact O-N 2.71Å
2425	Q	74.5	Confident	72.2	Confident	115.5 Å²	115.5	105.7 Å²	105.7	54%	0.54	48%	0.483	S	S	.	.	H	α-helix	trans	-56.1	-34.1	176.1	-161.8	-168.1	43.1	0	0	113	S2421 N2429	S2421-Q2425 WeakPolarHBondContact O-CB 3.25Å; S2421-Q2425 PolarHBondContact O-N 3.14Å; Q2425-N2429 VanDerWaalsContact O-CB 3.31Å; Q2425-N2429 WeakPolarHBondContact O-CB 3.39Å; Q2425-N2429 PolarHBondContact O-N 3.1Å; Q2425-N2429 VanDerWaalsContact O-N 3.07Å; Q2425-N2429 PolarHBondContact O-ND2 3.18Å
2426	H	73.6	Confident	72	Confident	101 Å²	101	109.4 Å²	109.4	47%	0.468	49%	0.492	S	S	.	.	H	α-helix	trans	-79.5	-11.8	173.8	-88.9	-46	0	0	0	115.2	K2422 Q2423 K2424 R2430	K2422-H2426 WeakPolarHBondContact O-CB 3.37Å; K2422-H2426 PolarHBondContact O-CD2 2.93Å; K2422-H2426 PolarHBondContact O-N 2.97Å; K2422-H2426 VanDerWaalsContact O-N 3.08Å; Q2423-H2426 PolarHBondContact O-N 3.16Å; K2424-H2426 PolarHBondContact O-N 3.25Å; K2424-H2426 VanDerWaalsContact O-N 3.13Å; H2426-R2430 PolarHBondContact O-NE 2.97Å; H2426-R2430 PolarHBondContact O-NH2 2.83Å; H2426-R2430 VanDerWaalsContact O-NH2 3.15Å
2427	Q	72	Confident	71.8	Confident	109.5 Å²	109.5	108.2 Å²	108.2	51%	0.512	49%	0.49	S	S	.	.	H	α-helix	trans	-87	-46.7	166.6	-71.4	-179.5	-10	0	0	110.1	Q2423 K2424 N2429 R2430 F2431	Q2423-Q2427 PolarHBondContact O-N 3.36Å; Q2423-Q2427 VanDerWaalsContact O-N 3.12Å; K2424-Q2427 CarbonylContact O-C 3.59Å; K2424-Q2427 WeakPolarHBondContact O-CA 3.34Å; K2424-Q2427 WeakPolarHBondContact O-CB 3.31Å; K2424-Q2427 PolarHBondContact O-N 2.9Å; Q2427-N2429 PolarHBondContact O-N 3.11Å; Q2427-R2430 CarbonylContact O-C 3.59Å; Q2427-R2430 WeakPolarHBondContact O-CA 3.33Å; Q2427-R2430 WeakPolarHBondContact O-CB 3.31Å; Q2427-R2430 PolarHBondContact O-N 2.91Å; Q2427-F2431 PolarHBondContact O-N 2.84Å
2428	D	75.2	Confident	71.4	Confident	79.5 Å²	79.5	109.8 Å²	109.8	43%	0.425	49%	0.493	S	S	.	.	H	α-helix	trans	-60.2	-46.3	179.6	-57.5	-29.4	0	0	0	111.4	K2424 R2430 F2431 M2432	K2424-D2428 VanDerWaalsContact O-CG 3.29Å; K2424-D2428 PolarHBondContact O-N 2.71Å; D2428-R2430 PolarHBondContact O-N 2.84Å; D2428-F2431 WeakPolarHBondContact O-CA 3.2Å; D2428-F2431 WeakPolarHBondContact O-CB 3.39Å; D2428-F2431 PolarHBondContact O-N 3.42Å; D2428-M2432 PolarHBondContact O-N 3.21Å
2429	N	73.2	Confident	71.2	Confident	79.5 Å²	79.5	109.7 Å²	109.7	43%	0.425	50%	0.497	S	S	.	.	H	α-helix	trans	-62.1	-25.4	172.4	-85.2	-71.2	0	0	0	113.7	Q2425 Q2427 R2433	Q2425-N2429 VanDerWaalsContact O-CB 3.31Å; Q2425-N2429 WeakPolarHBondContact O-CB 3.39Å; Q2425-N2429 PolarHBondContact O-N 3.1Å; Q2425-N2429 VanDerWaalsContact O-N 3.07Å; Q2425-N2429 PolarHBondContact O-ND2 3.18Å; Q2427-N2429 PolarHBondContact O-N 3.11Å; N2429-R2433 WeakPolarHBondContact O-CB 3.32Å; N2429-R2433 VanDerWaalsContact O-CG 3.31Å; N2429-R2433 WeakPolarHBondContact O-CG 3.39Å; N2429-R2433 PolarHBondContact O-N 3.18Å; N2429-R2433 VanDerWaalsContact O-N 3.11Å
2430	R	68.1	Low	71	Confident	158.5 Å²	158.5	109.7 Å²	109.7	60%	0.598	50%	0.502	S	S	*	.	H	α-helix	trans	-85.5	-14.8	173.5	-105.1	-173.5	-67.2	-179.2	-3	113.4	H2426 Q2427 D2428 R2434	H2426-R2430 PolarHBondContact O-NE 2.97Å; H2426-R2430 PolarHBondContact O-NH2 2.83Å; H2426-R2430 VanDerWaalsContact O-NH2 3.15Å; Q2427-R2430 CarbonylContact O-C 3.59Å; Q2427-R2430 WeakPolarHBondContact O-CA 3.33Å; Q2427-R2430 WeakPolarHBondContact O-CB 3.31Å; Q2427-R2430 PolarHBondContact O-N 2.91Å; D2428-R2430 PolarHBondContact O-N 2.84Å; R2430-R2434 WeakPolarHBondContact O-CG 3.47Å; R2430-R2434 PolarHBondContact O-NE 3.08Å; R2430-R2434 PolarHBondContact O-NH2 2.88Å
2431	F	67.8	Low	70.1	Confident	124.5 Å²	124.5	109.9 Å²	109.9	55%	0.546	50%	0.504	S	S	.	.	H	α-helix	trans	-81.8	-51.6	167.6	-168.1	-97.4	0	0	0	109.5	Q2427 D2428 R2433 R2434 R2435	Q2427-F2431 PolarHBondContact O-N 2.84Å; D2428-F2431 WeakPolarHBondContact O-CA 3.2Å; D2428-F2431 WeakPolarHBondContact O-CB 3.39Å; D2428-F2431 PolarHBondContact O-N 3.42Å; F2431-R2433 VanDerWaalsContact C-N 3.32Å; F2431-R2433 PolarHBondContact O-N 2.91Å; F2431-R2434 PolarHBondContact O-N 3.14Å; F2431-R2434 VanDerWaalsContact O-N 3.14Å; F2431-R2435 WeakPolarHBondContact O-CB 3.37Å; F2431-R2435 PolarHBondContact O-N 3.03Å
2432	M	65.8	Low	69.4	Low	108 Å²	108	109.2 Å²	109.2	53%	0.532	50%	0.502	S	S	.	.	H	α-helix	trans	-59.3	-36.8	177.7	-73.4	-61.7	-147.6	0	0	114.3	D2428 R2436	D2428-M2432 PolarHBondContact O-N 3.21Å; M2432-R2436 PolarHBondContact O-N 2.98Å; M2432-R2436 PolarHBondContact O-NE 3.21Å
2433	R	61.5	Low	68.7	Low	165 Å²	165	108.5 Å²	108.5	62%	0.623	51%	0.506	S	S	*	.	H	α-helix	trans	-64.6	-54.1	171.7	-78.3	-177.8	-176.6	-126	0.7	111.6	N2429 F2431 R2435 R2436 D2437	N2429-R2433 WeakPolarHBondContact O-CB 3.32Å; N2429-R2433 VanDerWaalsContact O-CG 3.31Å; N2429-R2433 WeakPolarHBondContact O-CG 3.39Å; N2429-R2433 PolarHBondContact O-N 3.18Å; N2429-R2433 VanDerWaalsContact O-N 3.11Å; F2431-R2433 VanDerWaalsContact C-N 3.32Å; F2431-R2433 PolarHBondContact O-N 2.91Å; R2433-R2435 PolarHBondContact O-N 2.76Å; R2433-R2435 VanDerWaalsContact O-N 3.17Å; R2433-R2436 CarbonylContact O-C 3.48Å; R2433-R2436 PolarHBondContact O-N 3.01Å; R2433-R2436 VanDerWaalsContact O-N 3.07Å; R2433-D2437 VanDerWaalsContact C-OD2 3.31Å; R2433-D2437 PolarHBondContact O-N 3.07Å; R2433-D2437 VanDerWaalsContact O-OD2 3.11Å
2434	R	62.4	Low	67.8	Low	155.5 Å²	155.5	106.9 Å²	106.9	59%	0.587	50%	0.501	S	S	*	.	H	α-helix	trans	-56.9	-34.8	179.1	-80.1	-175.8	-69.3	161.4	1.3	113.2	R2430 F2431 D2437 T2438	R2430-R2434 WeakPolarHBondContact O-CG 3.47Å; R2430-R2434 PolarHBondContact O-NE 3.08Å; R2430-R2434 PolarHBondContact O-NH2 2.88Å; F2431-R2434 PolarHBondContact O-N 3.14Å; F2431-R2434 VanDerWaalsContact O-N 3.14Å; R2434-D2437 WeakPolarHBondContact CA-OD2 3.28Å; R2434-D2437 PolarHBondContact N-OD2 3Å; R2434-D2437 PolarHBondContact O-N 2.89Å; R2434-T2438 PolarHBondContact O-N 3.03Å; R2434-T2438 VanDerWaalsContact O-N 3.07Å; R2434-T2438 PolarHBondContact O-OG1 3.14Å; R2434-T2438 VanDerWaalsContact O-OG1 3.04Å
2435	R	66.8	Low	66.5	Low	140.5 Å²	140.5	105.3 Å²	105.3	53%	0.53	50%	0.499	S	S	.	.	H	α-helix	trans	-64	-49.8	175.2	-168.6	175.1	-178.3	148.8	6.2	111.6	F2431 R2433 D2437 T2438 E2439	F2431-R2435 WeakPolarHBondContact O-CB 3.37Å; F2431-R2435 PolarHBondContact O-N 3.03Å; R2433-R2435 PolarHBondContact O-N 2.76Å; R2433-R2435 VanDerWaalsContact O-N 3.17Å; R2435-D2437 VanDerWaalsContact C-N 3.34Å; R2435-D2437 PolarHBondContact O-N 2.94Å; R2435-T2438 WeakPolarHBondContact CA-OG1 3.25Å; R2435-T2438 PolarHBondContact O-N 2.92Å; R2435-T2438 VanDerWaalsContact O-N 3.13Å; R2435-T2438 PolarHBondContact O-OG1 3.02Å; R2435-E2439 WeakPolarHBondContact CG-OE1 3.33Å; R2435-E2439 IonicContact CZ-OE1 3.75Å; R2435-E2439 IonicContact NE-OE1 3.1Å; R2435-E2439 PolarHBondContact NE-OE1 3.09Å; R2435-E2439 IonicContact NH2-OE1 3.74Å; R2435-E2439 WeakPolarHBondContact O-CB 3.46Å; R2435-E2439 VanDerWaalsContact O-CG 3.27Å; R2435-E2439 WeakPolarHBondContact O-CG 3.47Å; R2435-E2439 PolarHBondContact O-N 3Å
2436	R	65.8	Low	65.6	Low	135 Å²	135	106.8 Å²	106.8	51%	0.509	51%	0.506	S	S	.	.	H	α-helix	trans	-62.9	-38.2	172.6	-85.9	-179.8	-82.5	136.2	-15.3	113.3	M2432 R2433 T2438 E2439 I2440	M2432-R2436 PolarHBondContact O-N 2.98Å; M2432-R2436 PolarHBondContact O-NE 3.21Å; R2433-R2436 CarbonylContact O-C 3.48Å; R2433-R2436 PolarHBondContact O-N 3.01Å; R2433-R2436 VanDerWaalsContact O-N 3.07Å; R2436-T2438 VanDerWaalsContact C-N 3.29Å; R2436-T2438 PolarHBondContact O-N 2.98Å; R2436-E2439 PolarHBondContact O-N 3.35Å; R2436-I2440 WeakPolarHBondContact O-CB 3.34Å; R2436-I2440 WeakPolarHBondContact O-CD1 3.41Å; R2436-I2440 VanDerWaalsContact O-CG1 3.25Å; R2436-I2440 WeakPolarHBondContact O-CG1 3.35Å; R2436-I2440 PolarHBondContact O-N 3.14Å
2437	D	68.1	Low	64.6	Low	85.5 Å²	85.5	106.5 Å²	106.5	46%	0.457	51%	0.507	S	S	.	.	H	α-helix	trans	-62.4	-34.9	176.1	-56.9	-35.3	0	0	0	111.1	R2433 R2434 R2435 N2441	R2433-D2437 VanDerWaalsContact C-OD2 3.31Å; R2433-D2437 PolarHBondContact O-N 3.07Å; R2433-D2437 VanDerWaalsContact O-OD2 3.11Å; R2434-D2437 WeakPolarHBondContact CA-OD2 3.28Å; R2434-D2437 PolarHBondContact N-OD2 3Å; R2434-D2437 PolarHBondContact O-N 2.89Å; R2435-D2437 VanDerWaalsContact C-N 3.34Å; R2435-D2437 PolarHBondContact O-N 2.94Å; D2437-N2441 VanDerWaalsContact O-CG 3.26Å; D2437-N2441 PolarHBondContact O-N 3.16Å; D2437-N2441 PolarHBondContact O-ND2 2.83Å; D2437-N2441 VanDerWaalsContact O-ND2 3.16Å
2438	T	69.4	Low	63.5	Low	90.5 Å²	90.5	106.5 Å²	106.5	56%	0.555	51%	0.51	S	S	*	.	H	α-helix	trans	-76.7	-37.6	173.6	42.2	0	0	0	0	113.3	R2434 R2435 R2436 N2441 A2442	R2434-T2438 PolarHBondContact O-N 3.03Å; R2434-T2438 VanDerWaalsContact O-N 3.07Å; R2434-T2438 PolarHBondContact O-OG1 3.14Å; R2434-T2438 VanDerWaalsContact O-OG1 3.04Å; R2435-T2438 WeakPolarHBondContact CA-OG1 3.25Å; R2435-T2438 PolarHBondContact O-N 2.92Å; R2435-T2438 VanDerWaalsContact O-N 3.13Å; R2435-T2438 PolarHBondContact O-OG1 3.02Å; R2436-T2438 VanDerWaalsContact C-N 3.29Å; R2436-T2438 PolarHBondContact O-N 2.98Å; T2438-N2441 PolarHBondContact O-N 2.91Å; T2438-A2442 VanDerWaalsContact O-CB 3.32Å; T2438-A2442 WeakPolarHBondContact O-CB 3.43Å; T2438-A2442 PolarHBondContact O-N 2.83Å
2439	E	70.5	Confident	62.1	Low	93.5 Å²	93.5	110.6 Å²	110.6	44%	0.437	53%	0.526	S	S	.	.	H	α-helix	trans	-66.5	-39.1	177.2	-71.5	157.5	175.6	0	0	111.5	R2435 R2436 A2442 S2443	R2435-E2439 WeakPolarHBondContact CG-OE1 3.33Å; R2435-E2439 IonicContact CZ-OE1 3.75Å; R2435-E2439 IonicContact NE-OE1 3.1Å; R2435-E2439 PolarHBondContact NE-OE1 3.09Å; R2435-E2439 IonicContact NH2-OE1 3.74Å; R2435-E2439 WeakPolarHBondContact O-CB 3.46Å; R2435-E2439 VanDerWaalsContact O-CG 3.27Å; R2435-E2439 WeakPolarHBondContact O-CG 3.47Å; R2435-E2439 PolarHBondContact O-N 3Å; R2436-E2439 PolarHBondContact O-N 3.35Å; E2439-A2442 PolarHBondContact O-N 3.07Å; E2439-S2443 WeakPolarHBondContact O-CB 3.44Å; E2439-S2443 PolarHBondContact O-N 3.01Å; E2439-S2443 PolarHBondContact O-OG 3.41Å
2440	I	67.9	Low	60.9	Low	91.5 Å²	91.5	114.7 Å²	114.7	47%	0.469	54%	0.543	S	S	.	.	H	α-helix	trans	-67.1	-43.5	175.2	-69	165.4	0	0	0	111.3	R2436 S2443 N2444	R2436-I2440 WeakPolarHBondContact O-CB 3.34Å; R2436-I2440 WeakPolarHBondContact O-CD1 3.41Å; R2436-I2440 VanDerWaalsContact O-CG1 3.25Å; R2436-I2440 WeakPolarHBondContact O-CG1 3.35Å; R2436-I2440 PolarHBondContact O-N 3.14Å; I2440-S2443 WeakPolarHBondContact CA-OG 3.15Å; I2440-S2443 PolarHBondContact O-N 2.75Å; I2440-S2443 PolarHBondContact O-OG 2.81Å; I2440-N2444 PolarHBondContact O-N 2.94Å; I2440-N2444 PolarHBondContact O-ND2 3.17Å
2441	N	61.9	Low	59.8	Low	95.5 Å²	95.5	113.3 Å²	113.3	51%	0.511	55%	0.546	S	S	.	.	H	α-helix	trans	-66.2	-43.1	177.7	-71.5	-29.5	0	0	0	111.7	D2437 T2438 S2443 N2444 D2445	D2437-N2441 VanDerWaalsContact O-CG 3.26Å; D2437-N2441 PolarHBondContact O-N 3.16Å; D2437-N2441 PolarHBondContact O-ND2 2.83Å; D2437-N2441 VanDerWaalsContact O-ND2 3.16Å; T2438-N2441 PolarHBondContact O-N 2.91Å; N2441-S2443 VanDerWaalsContact C-N 3.3Å; N2441-S2443 PolarHBondContact O-N 2.87Å; N2441-N2444 PolarHBondContact O-N 3.28Å; N2441-D2445 PolarHBondContact O-N 3.32Å
2442	A	62.9	Low	58.5	Low	52 Å²	52	114.2 Å²	114.2	43%	0.43	56%	0.555	S	S	.	*	H	α-helix	trans	-62.6	-30.6	177.2	0	0	0	0	0	113.5	T2438 E2439 Q2446	T2438-A2442 VanDerWaalsContact O-CB 3.32Å; T2438-A2442 WeakPolarHBondContact O-CB 3.43Å; T2438-A2442 PolarHBondContact O-N 2.83Å; E2439-A2442 PolarHBondContact O-N 3.07Å; A2442-Q2446 WeakPolarHBondContact O-CG 3.15Å; A2442-Q2446 PolarHBondContact O-N 3.08Å; A2442-Q2446 PolarHBondContact O-NE2 3.24Å
2443	S	60.4	Low	57.1	Low	53 Å²	53	115 Å²	115	37%	0.371	57%	0.566	S	S	.	*	H	α-helix	trans	-78.7	-37.5	174.3	53.2	0	0	0	0	112.6	E2439 I2440 N2441 D2445 Q2446 I2447	E2439-S2443 WeakPolarHBondContact O-CB 3.44Å; E2439-S2443 PolarHBondContact O-N 3.01Å; E2439-S2443 PolarHBondContact O-OG 3.41Å; I2440-S2443 WeakPolarHBondContact CA-OG 3.15Å; I2440-S2443 PolarHBondContact O-N 2.75Å; I2440-S2443 PolarHBondContact O-OG 2.81Å; N2441-S2443 VanDerWaalsContact C-N 3.3Å; N2441-S2443 PolarHBondContact O-N 2.87Å; S2443-D2445 PolarHBondContact O-N 3Å; S2443-Q2446 PolarHBondContact O-N 2.8Å; S2443-I2447 WeakPolarHBondContact O-CD1 3.19Å; S2443-I2447 VanDerWaalsContact O-CG1 3.26Å; S2443-I2447 WeakPolarHBondContact O-CG1 3.42Å; S2443-I2447 PolarHBondContact O-N 3.02Å; S2443-I2447 VanDerWaalsContact O-N 3.09Å
2444	N	56.2	Low	55.9	Low	74.5 Å²	74.5	113.5 Å²	113.5	40%	0.398	58%	0.575	S	S	.	*	H	α-helix	trans	-64.7	-37.8	174.3	-76.7	-32.3	0	0	0	112.9	I2440 N2441 Q2446 I2447 N2448	I2440-N2444 PolarHBondContact O-N 2.94Å; I2440-N2444 PolarHBondContact O-ND2 3.17Å; N2441-N2444 PolarHBondContact O-N 3.28Å; N2444-Q2446 VanDerWaalsContact C-N 3.31Å; N2444-Q2446 PolarHBondContact O-N 3.11Å; N2444-I2447 PolarHBondContact O-N 3.02Å; N2444-N2448 WeakPolarHBondContact O-CB 3.32Å; N2444-N2448 PolarHBondContact O-N 3.06Å; N2444-N2448 PolarHBondContact O-ND2 3.31Å; N2444-N2448 VanDerWaalsContact O-ND2 3.13Å
2445	D	53.5	Low	54.5	Low	104 Å²	104	111.1 Å²	111.1	56%	0.556	58%	0.582	S	S	*	*	H	α-helix	trans	-66.5	-32.9	176.2	-73.1	-24.7	0	0	0	112.2	N2441 S2443 H2449	N2441-D2445 PolarHBondContact O-N 3.32Å; S2443-D2445 PolarHBondContact O-N 3Å; D2445-H2449 PolarHBondContact O-N 2.98Å
2446	Q	54.4	Low	53	Low	145.5 Å²	145.5	110.3 Å²	110.3	68%	0.68	60%	0.596	S	S	*	*	H	α-helix	trans	-70.3	-41.3	172.6	-70.7	176.9	31.7	0	0	112.2	A2442 S2443 N2444 N2448 H2449 H2450	A2442-Q2446 WeakPolarHBondContact O-CG 3.15Å; A2442-Q2446 PolarHBondContact O-N 3.08Å; A2442-Q2446 PolarHBondContact O-NE2 3.24Å; S2443-Q2446 PolarHBondContact O-N 2.8Å; N2444-Q2446 VanDerWaalsContact C-N 3.31Å; N2444-Q2446 PolarHBondContact O-N 3.11Å; Q2446-N2448 VanDerWaalsContact C-N 3.32Å; Q2446-N2448 PolarHBondContact O-N 3.21Å; Q2446-H2449 PolarHBondContact O-N 3.03Å; Q2446-H2449 VanDerWaalsContact O-N 3.15Å; Q2446-H2450 PolarHBondContact O-N 3.08Å
2447	I	53.5	Low	51.8	Low	96 Å²	96	110.2 Å²	110.2	49%	0.492	61%	0.61	S	S	.	*	H	α-helix	trans	-63.4	-43.3	177.1	-68.5	164.2	0	0	0	110.9	S2443 N2444 H2449 H2450 I2451	S2443-I2447 WeakPolarHBondContact O-CD1 3.19Å; S2443-I2447 VanDerWaalsContact O-CG1 3.26Å; S2443-I2447 WeakPolarHBondContact O-CG1 3.42Å; S2443-I2447 PolarHBondContact O-N 3.02Å; S2443-I2447 VanDerWaalsContact O-N 3.09Å; N2444-I2447 PolarHBondContact O-N 3.02Å; I2447-H2449 VanDerWaalsContact C-N 3.28Å; I2447-H2449 PolarHBondContact O-N 3Å; I2447-H2450 PolarHBondContact O-N 2.99Å; I2447-H2450 VanDerWaalsContact O-N 3.15Å; I2447-I2451 HydrophobicContact CG2-CD1 4.08Å; I2447-I2451 WeakPolarHBondContact O-CD1 3.43Å; I2447-I2451 WeakPolarHBondContact O-CG1 3.28Å
2448	N	48.3	Very low	50.2	Low	108.5 Å²	108.5	113 Å²	113	58%	0.58	63%	0.625	S	S	*	*	H	α-helix	trans	-64.4	-29.8	177.8	-74.9	-39	0	0	0	113.2	N2444 Q2446 H2450	N2444-N2448 WeakPolarHBondContact O-CB 3.32Å; N2444-N2448 PolarHBondContact O-N 3.06Å; N2444-N2448 PolarHBondContact O-ND2 3.31Å; N2444-N2448 VanDerWaalsContact O-ND2 3.13Å; Q2446-N2448 VanDerWaalsContact C-N 3.32Å; Q2446-N2448 PolarHBondContact O-N 3.21Å; N2448-H2450 VanDerWaalsContact C-N 3.31Å; N2448-H2450 PolarHBondContact O-N 2.86Å
2449	H	46.5	Very low	48.8	Very low	165.5 Å²	165.5	116 Å²	116	77%	0.766	64%	0.638	S	S	*	*	H	α-helix	trans	-79.6	-17.2	178.5	-100.5	-72.9	0	0	0	114.6	D2445 Q2446 I2447	D2445-H2449 PolarHBondContact O-N 2.98Å; Q2446-H2449 PolarHBondContact O-N 3.03Å; Q2446-H2449 VanDerWaalsContact O-N 3.15Å; I2447-H2449 VanDerWaalsContact C-N 3.28Å; I2447-H2449 PolarHBondContact O-N 3Å
2450	H	47.9	Very low	47.5	Very low	166.5 Å²	166.5	117.9 Å²	117.9	77%	0.771	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	-0.9	-173.7	-144.2	-51.6	0	0	0	114.7	Q2446 I2447 N2448	Q2446-H2450 PolarHBondContact O-N 3.08Å; I2447-H2450 PolarHBondContact O-N 2.99Å; I2447-H2450 VanDerWaalsContact O-N 3.15Å; N2448-H2450 VanDerWaalsContact C-N 3.31Å; N2448-H2450 PolarHBondContact O-N 2.86Å
2451	I	43.8	Very low	46.1	Very low	129.5 Å²	129.5	119.7 Å²	119.7	66%	0.664	66%	0.661	S	S	*	*	S	Bend	trans	-96.5	-1.1	-173	-67.9	170.1	0	0	0	112.9	I2447	I2447-I2451 HydrophobicContact CG2-CD1 4.08Å; I2447-I2451 WeakPolarHBondContact O-CD1 3.43Å; I2447-I2451 WeakPolarHBondContact O-CG1 3.28Å
2452	I	40.2	Very low	44.9	Very low	143.5 Å²	143.5	122.1 Å²	122.1	74%	0.736	67%	0.674	S	S	*	*	S	Bend	trans	-117.3	93.4	-179	-48.8	179.9	0	0	0	111.3
2453	T	37.1	Very low	43.5	Very low	123.5 Å²	123.5	126.4 Å²	126.4	76%	0.758	69%	0.69	S	S	*	*	S	Bend	trans	148.4	144.9	174.6	-36.5	0	0	0	0	112.7
2454	T	36.7	Very low	42.4	Very low	133.5 Å²	133.5	129.8 Å²	129.8	82%	0.819	71%	0.713	S	S	*	*			trans	154.2	164.6	-169.3	58.6	0	0	0	0	115.8
2455	S	33.1	Very low	41.3	Very low	105 Å²	105	133.1 Å²	133.1	73%	0.734	73%	0.731	S	S	*	*			trans	155.4	130.9	-179.6	51.1	0	0	0	0	114.5
2456	P	36.1	Very low	40.5	Very low	125 Å²	125	135.9 Å²	135.9	81%	0.812	75%	0.746	S	S	*	*			trans	-82.1	148.9	169.9	34.5	-33.6	0	0	0	112
2457	T	38.9	Very low	39.5	Very low	132 Å²	132	133.9 Å²	133.9	81%	0.81	75%	0.748	S	S	*	*			trans	-140.1	148.9	156.2	49.4	0	0	0	0	107.6
2458	D	35	Very low	38.6	Very low	145.5 Å²	145.5	136.9 Å²	136.9	78%	0.778	76%	0.764	S	S	*	*			trans	-79.1	175.9	-167.5	-48.5	-92.6	0	0	0	113.7
2459	D	41.1	Very low	37.8	Very low	153.5 Å²	153.5	139.1 Å²	139.1	82%	0.821	78%	0.775	S	S	*	*			trans	131.2	128.7	141.7	-71.2	-23.6	0	0	0	117.4
2460	D	41.7	Very low	36.9	Very low	133 Å²	133	138.5 Å²	138.5	71%	0.711	78%	0.777	S	S	*	*			trans	58.7	107.7	142.6	-86.5	-34.7	0	0	0	124.4
2461	N	39	Very low	36.3	Very low	129 Å²	129	138.7 Å²	138.7	69%	0.69	78%	0.776	S	S	*	*				58	138	112.1	-91.9	-55.2	0	0	0	121.5
2462	N	37.2	Very low	35.5	Very low	146.5 Å²	146.5	136.1 Å²	136.1	78%	0.783	77%	0.766	S	S	*	*			trans	122.7	124.3	130.4	-81.4	-58.6	0	0	0	117.5
2463	N	32.6	Very low	35.1	Very low	142 Å²	142	135 Å²	135	76%	0.759	76%	0.761	S	S	*	*			trans	-32.4	140.5	155.4	-71.5	-40.3	0	0	0	115.9
2464	S	37.2	Very low	34.8	Very low	123 Å²	123	136.9 Å²	136.9	86%	0.86	76%	0.761	S	S	*	*			trans	-144.5	129.7	139.1	-77.6	0	0	0	0	108.8
2465	N	33.4	Very low	34.5	Very low	145 Å²	145	134.9 Å²	134.9	78%	0.775	75%	0.753	S	S	*	*			trans	-81.1	142.3	-177.6	-53.2	-70.7	0	0	0	110.2
2466	D	36.7	Very low	34.3	Very low	162.5 Å²	162.5	138.5 Å²	138.5	87%	0.869	76%	0.756	S	S	*	*			trans	-142.1	133.5	146.2	-126.8	-30.8	0	0	0	109.7
2467	S	33.6	Very low	34	Very low	103.5 Å²	103.5	138.8 Å²	138.8	72%	0.724	76%	0.755	S	S	*	*			trans	-129.1	89.7	-160.2	55	0	0	0	0	113.4
2468	I	34.8	Very low	33.5	Very low	158.5 Å²	158.5	140.8 Å²	140.8	81%	0.813	75%	0.753	S	S	*	*			trans	-134.9	107	163.8	-66	139.7	0	0	0	106.8
2469	L	31.1	Very low	33.5	Very low	156 Å²	156	137.1 Å²	137.1	82%	0.817	74%	0.743	S	S	*	*			cis	138.1	118.9	36.4	-179.5	72	0	0	0	109	K2471	L2469-K2471 PolarHBondContact O-N 3.28Å
2470	N	28.1	Very low	33.2	Very low	151.5 Å²	151.5	136.8 Å²	136.8	81%	0.81	74%	0.741	S	S	*	*			trans	-62.7	130.6	174.9	-67.5	-30.3	0	0	0	111.1	T2472	N2470-T2472 HydrophobicContact CB-CG2 4.2Å
2471	K	34	Very low	33	Very low	172 Å²	172	137.7 Å²	137.7	75%	0.748	74%	0.741	S	S	*	*			trans	-122.8	121	144.7	-154.8	162.1	-171.8	175.3	0	109.5	L2055 L2469	L2055-K2471 HydrophobicContact CD2-CD 4.29Å; L2055-K2471 VanDerWaalsContact CD2-NZ 3.25Å; L2469-K2471 PolarHBondContact O-N 3.28Å
2472	T	28.9	Very low	32.9	Very low	74.5 Å²	74.5	139.1 Å²	139.1	46%	0.457	74%	0.743	S	S	.	*			trans	-81.4	168.9	179.6	44	0	0	0	0	111.5	H2056 N2470	H2056-T2472 PolarHBondContact CD2-O 3.44Å; H2056-T2472 PolarHBondContact CE1-OG1 3.24Å; H2056-T2472 PolarHBondContact NE2-OG1 3.49Å; N2470-T2472 HydrophobicContact CB-CG2 4.2Å
2473	D	30.5	Very low	33	Very low	119 Å²	119	139.7 Å²	139.7	64%	0.636	75%	0.746	S	S	*	*			trans	147.5	122.4	158.8	-64.3	-49.2	0	0	0	111.4	S2054 H2056	S2054-D2473 WeakPolarHBondContact CB-OD2 3.45Å; S2054-D2473 PolarHBondContact OG-OD2 3.36Å; H2056-D2473 IonicContact CD2-OD1 3.7Å
2474	H	31.2	Very low	33.3	Very low	163.5 Å²	163.5	138.9 Å²	138.9	76%	0.757	74%	0.741	S	S	*	*				-121.3	139	97.1	-80.8	-85.6	0	0	0	112.2
2475	S	29.8	Very low	33.3	Very low	92.5 Å²	92.5	138.3 Å²	138.3	65%	0.647	73%	0.728	S	S	*	*			trans	-102.6	141.2	156.8	115.6	0	0	0	0	110.2
2476	F	28.4	Very low	33.3	Very low	180 Å²	180	140.4 Å²	140.4	79%	0.789	73%	0.73	S	S	*	*			cis	-141.5	112.6	44.1	-132.3	-100.2	0	0	0	110.7	F2478	F2476-F2478 HydrophobicContact CD1-CB 3.99Å; F2476-F2478 WeakPolarHBondContact CD1-O 3.47Å; F2476-F2478 HydrophobicContact CE1-CB 4.14Å; F2476-F2478 HydrophobicContact CE1-CD1 4.17Å
2477	T	31.3	Very low	33.4	Very low	131.5 Å²	131.5	139.6 Å²	139.6	81%	0.807	73%	0.726	S	S	*	*			trans	-97.9	127.7	154.7	46.5	0	0	0	0	110.1
2478	F	28.6	Very low	33.4	Very low	175 Å²	175	142.5 Å²	142.5	77%	0.768	73%	0.726	S	S	*	*			trans	142.2	95.9	-177.6	-159.3	-95.3	0	0	0	110.7	F2476	F2476-F2478 HydrophobicContact CD1-CB 3.99Å; F2476-F2478 WeakPolarHBondContact CD1-O 3.47Å; F2476-F2478 HydrophobicContact CE1-CB 4.14Å; F2476-F2478 HydrophobicContact CE1-CD1 4.17Å
2479	A	33.9	Very low	33.5	Very low	67.5 Å²	67.5	142 Å²	142	56%	0.558	72%	0.72	S	S	*	*	S	Bend		-158.9	-131.1	88.4	0	0	0	0	0	110.1	E2481	A2479-E2481 HydrophobicContact CB-CB 4.3Å; A2479-E2481 PolarHBondContact O-N 2.92Å
2480	D	35.7	Very low	33.7	Very low	146 Å²	146	143.1 Å²	143.1	78%	0.781	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn		-17.7	19.9	-72.6	-76.7	-12.7	0	0	0	114.6
2481	E	37.9	Very low	34.2	Very low	153 Å²	153	144.7 Å²	144.7	72%	0.715	72%	0.723	S	S	*	*	H	α-helix	trans	-130.9	-27.2	168.9	-83.6	-178.5	165.1	0	0	113.7	A2479 L2483 L2484 N2485	A2479-E2481 HydrophobicContact CB-CB 4.3Å; A2479-E2481 PolarHBondContact O-N 2.92Å; E2481-L2483 VanDerWaalsContact C-N 3.33Å; E2481-L2483 PolarHBondContact O-N 2.73Å; E2481-L2484 PolarHBondContact O-N 2.81Å; E2481-N2485 PolarHBondContact O-N 3.28Å
2482	Q	36.2	Very low	34.2	Very low	158 Å²	158	141.5 Å²	141.5	74%	0.738	72%	0.718	S	S	*	*	H	α-helix	trans	-89.9	-12.5	-174.2	-66	-154.8	38.8	0	0	116
2483	L	38.8	Very low	34.3	Very low	159.5 Å²	159.5	146.6 Å²	146.6	84%	0.835	73%	0.734	S	S	*	*	H	α-helix	trans	-87	-10.3	167.4	-81.9	169.7	0	0	0	113	E2481	E2481-L2483 VanDerWaalsContact C-N 3.33Å; E2481-L2483 PolarHBondContact O-N 2.73Å
2484	L	39.6	Very low	34.4	Very low	125.5 Å²	125.5	145.3 Å²	145.3	66%	0.657	74%	0.74	S	S	*	*	H	α-helix	trans	-93.1	1.7	172.8	-72.5	172.3	0	0	0	112.7	E2481 F2488	E2481-L2484 PolarHBondContact O-N 2.81Å; L2484-F2488 PolarHBondContact O-N 3.15Å
2485	N	37.3	Very low	34.3	Very low	109.5 Å²	109.5	143.2 Å²	143.2	59%	0.586	74%	0.739	S	S	*	*	H	α-helix	trans	-98	-12.6	178.1	-89	-5.4	0	0	0	114.2	E2481 F2488 E2489	E2481-N2485 PolarHBondContact O-N 3.28Å; N2485-F2488 PolarHBondContact O-N 2.95Å; N2485-F2488 VanDerWaalsContact O-N 3.11Å; N2485-E2489 PolarHBondContact O-N 2.92Å
2486	F	33.6	Very low	34.3	Very low	189 Å²	189	146.1 Å²	146.1	83%	0.829	75%	0.747	S	S	*	*	H	α-helix	trans	-85.9	-22.9	174.2	-135	-89.9	0	0	0	113	F2488	F2486-F2488 PolarHBondContact O-N 3.35Å
2487	D	37.5	Very low	34.3	Very low	146 Å²	146	146.6 Å²	146.6	78%	0.781	75%	0.745	S	S	*	*	H	α-helix	trans	-82.3	-4.8	171.6	-92.7	-28.7	0	0	0	112.9
2488	F	34.2	Very low	34.4	Very low	163.5 Å²	163.5	145 Å²	145	72%	0.717	74%	0.739	S	S	*	*	H	α-helix	trans	-103.6	-16.6	-176.2	-145.1	-94.8	0	0	0	114	L2484 N2485 F2486 M2490 K2491	L2484-F2488 PolarHBondContact O-N 3.15Å; N2485-F2488 PolarHBondContact O-N 2.95Å; N2485-F2488 VanDerWaalsContact O-N 3.11Å; F2486-F2488 PolarHBondContact O-N 3.35Å; F2488-M2490 PolarHBondContact O-N 3.44Å; F2488-K2491 WeakPolarHBondContact O-CB 3.42Å; F2488-K2491 PolarHBondContact O-N 2.84Å; F2488-K2491 VanDerWaalsContact O-N 3.13Å
2489	E	36.9	Very low	34.3	Very low	149 Å²	149	144.4 Å²	144.4	70%	0.696	74%	0.739	S	S	*	*	H	α-helix	trans	-98.2	9.9	-179.5	-151	-174.4	154.9	0	0	114.2	N2485 K2491 T2492 K2493	N2485-E2489 PolarHBondContact O-N 2.92Å; E2489-K2491 PolarHBondContact O-N 3.33Å; E2489-T2492 PolarHBondContact O-OG1 2.89Å; E2489-K2493 IonicContact OE1-NZ 2.66Å; E2489-K2493 PolarHBondContact OE1-NZ 3.02Å
2490	M	36.1	Very low	34.2	Very low	178.5 Å²	178.5	146.8 Å²	146.8	88%	0.879	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	9.4	168.5	-151.1	-179.3	-173.8	0	0	113.4	F2488	F2488-M2490 PolarHBondContact O-N 3.44Å
2491	K	37.7	Very low	33.9	Very low	185.5 Å²	185.5	145.5 Å²	145.5	81%	0.807	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.5	17	-172.4	-149.6	164.9	-176.2	173.7	0	115.3	F2488 E2489	F2488-K2491 WeakPolarHBondContact O-CB 3.42Å; F2488-K2491 PolarHBondContact O-N 2.84Å; F2488-K2491 VanDerWaalsContact O-N 3.13Å; E2489-K2491 PolarHBondContact O-N 3.33Å
2492	T	33.7	Very low	33.6	Very low	104.5 Å²	104.5	145.8 Å²	145.8	64%	0.641	75%	0.747	S	S	*	*	S	Bend	trans	-120.2	18.2	179.3	51.1	0	0	0	0	113.6	E2489	E2489-T2492 PolarHBondContact O-OG1 2.89Å
2493	K	32.4	Very low	33.4	Very low	183 Å²	183	145 Å²	145	80%	0.796	74%	0.744	S	S	*	*	S	Bend	trans	-127.8	37.6	176.2	-69.9	179.3	179	168.9	0	112.9	E2489	E2489-K2493 IonicContact OE1-NZ 2.66Å; E2489-K2493 PolarHBondContact OE1-NZ 3.02Å
2494	A	32.1	Very low	33.1	Very low	91.5 Å²	91.5	144.2 Å²	144.2	76%	0.756	73%	0.734	S	S	*	*	S	Bend	trans	-150.6	53.4	179.7	0	0	0	0	0	112.9
2495	T	29.5	Very low	32.8	Very low	119 Å²	119	142.9 Å²	142.9	73%	0.73	73%	0.728	S	S	*	*			trans	-138.9	130.9	170.6	42	0	0	0	0	109.6
2496	N	29.1	Very low	32.5	Very low	153.5 Å²	153.5	141.6 Å²	141.6	82%	0.821	73%	0.727	S	S	*	*			trans	119.5	69.7	169.5	-73.7	-9.2	0	0	0	112.2
2497	Y	28.8	Very low	32.3	Very low	189.5 Å²	189.5	138.2 Å²	138.2	74%	0.743	72%	0.718	S	S	*	*			trans	-142.6	123.1	137.2	-98.1	-69.7	0	0	0	108.9	E1619 Q1620	E1619-Y2497 WeakPolarHBondContact OE1-CD2 3.46Å; E1619-Y2497 VanDerWaalsContact OE1-CE1 3.23Å; E1619-Y2497 WeakPolarHBondContact OE1-CE1 3.41Å; E1619-Y2497 WeakPolarHBondContact OE1-CE2 3.34Å; E1619-Y2497 PolarHBondContact OE1-OH 2.74Å; E1619-Y2497 WeakPolarHBondContact OE2-CE1 3.09Å; E1619-Y2497 PolarHBondContact OE2-OH 3.06Å; E1619-Y2497 VanDerWaalsContact OE2-OH 3.09Å; Q1620-Y2497 VanDerWaalsContact NE2-CD2 3.3Å
2498	S	32	Very low	32.3	Very low	99 Å²	99	138 Å²	138	69%	0.692	72%	0.721	S	S	*	*			trans	-121.7	115.5	-173.5	52.2	0	0	0	0	110.7	T2500	S2498-T2500 PolarHBondContact O-N 2.73Å; S2498-T2500 VanDerWaalsContact O-N 3.12Å
2499	E	27.9	Very low	32.3	Very low	161 Å²	161	138.3 Å²	138.3	75%	0.752	73%	0.725	S	S	*	*			trans	-20.2	100.1	153.8	-169.7	167.3	-144.9	0	0	113.8	T2501	E2499-T2501 PolarHBondContact O-N 2.98Å
2500	T	32	Very low	32.4	Very low	119.5 Å²	119.5	138.8 Å²	138.8	73%	0.733	73%	0.732	S	S	*	*			trans	-109.9	99.5	173.6	-61.2	0	0	0	0	111.7	S2498 M2502	S2498-T2500 PolarHBondContact O-N 2.73Å; S2498-T2500 VanDerWaalsContact O-N 3.12Å; T2500-M2502 HydrophobicContact CG2-CG 3.73Å
2501	T	29.3	Very low	32.3	Very low	117.5 Å²	117.5	137 Å²	137	72%	0.721	73%	0.725	S	S	*	*			trans	-89.8	111.8	166.6	-60.6	0	0	0	0	109.9	E2499 Q2503	E2499-T2501 PolarHBondContact O-N 2.98Å; T2501-Q2503 PolarHBondContact O-N 2.89Å
2502	M	31.6	Very low	32.4	Very low	159 Å²	159	134 Å²	134	78%	0.783	73%	0.728	S	S	*	*			trans	-106.7	137.5	165.6	-83.8	-69.1	-72.1	0	0	110.1	T2500 F2504	T2500-M2502 HydrophobicContact CG2-CG 3.73Å; M2502-F2504 HydrophobicContact CE-CD2 3.78Å; M2502-F2504 HydrophobicContact CE-CE2 3.75Å; M2502-F2504 HydrophobicContact SD-CD2 4.26Å; M2502-F2504 HydrophobicContact SD-CE2 3.87Å
2503	Q	31.1	Very low	32.4	Very low	143 Å²	143	137.5 Å²	137.5	67%	0.668	74%	0.737	S	S	*	*			trans	-137.3	133.5	-169.9	-171.8	173.2	0.1	0	0	111.7	T2501	T2501-Q2503 PolarHBondContact O-N 2.89Å
2504	F	31.7	Very low	32.7	Very low	141.5 Å²	141.5	136.6 Å²	136.6	62%	0.621	74%	0.735	S	S	*	*			trans	173	132.8	163.6	-70.6	-74.3	0	0	0	114.9	M2502	M2502-F2504 HydrophobicContact CE-CD2 3.78Å; M2502-F2504 HydrophobicContact CE-CE2 3.75Å; M2502-F2504 HydrophobicContact SD-CD2 4.26Å; M2502-F2504 HydrophobicContact SD-CE2 3.87Å
2505	N	34.5	Very low	33	Very low	99 Å²	99	140.3 Å²	140.3	53%	0.529	74%	0.737	S	S	.	*			trans	-12.1	157.6	154.1	-70.3	14.7	0	0	0	115.7	Q2767	N2505-Q2767 PolarHBondContact ND2-NE2 3.12Å; N2505-Q2767 PolarHBondContact ND2-OE1 3.34Å; N2505-Q2767 PolarHBondContact OD1-NE2 3.36Å
2506	S	30	Very low	33.4	Very low	82 Å²	82	142.1 Å²	142.1	57%	0.573	74%	0.739	S	S	*	*				-111.5	165	72.6	49.4	0	0	0	0	111.1
2507	D	30.3	Very low	34.1	Very low	117.5 Å²	117.5	143.5 Å²	143.5	63%	0.628	74%	0.741	S	S	*	*				-52.8	148.5	82.7	-42.2	-47.9	0	0	0	116.3	Q2768	D2507-Q2768 PolarHBondContact OD2-NE2 3.22Å
2508	V	37.2	Very low	34.5	Very low	142 Å²	142	141.4 Å²	141.4	86%	0.861	74%	0.742	S	S	*	*			trans	-165.4	135.8	132.6	141.2	0	0	0	0	107.9
2509	E	33.9	Very low	35.2	Very low	170 Å²	170	145.5 Å²	145.5	79%	0.794	75%	0.751	S	S	*	*			trans	-81.9	161.3	179.2	-59.5	152.8	134.7	0	0	111.6
2510	L	39.9	Very low	36.1	Very low	159 Å²	159	147.5 Å²	147.5	83%	0.832	76%	0.76	S	S	*	*				176.7	128	127	-96.3	164.2	0	0	0	112.6
2511	D	32.4	Very low	37	Very low	140.5 Å²	140.5	147.4 Å²	147.4	75%	0.751	76%	0.759	S	S	*	*			trans	-28.2	136.2	165.1	-46	-47.8	0	0	0	117.7
2512	S	41.1	Very low	38.1	Very low	123.5 Å²	123.5	149.6 Å²	149.6	86%	0.864	77%	0.766	S	S	*	*			trans	-157.8	107.4	137.8	-1.3	0	0	0	0	110.1
2513	E	32.3	Very low	38.9	Very low	178 Å²	178	149 Å²	149	83%	0.832	77%	0.766	S	S	*	*			trans	-71.9	157.5	172.8	-55.5	166.8	138.3	0	0	111.3
2514	H	39.3	Very low	40	Very low	163.5 Å²	163.5	149.5 Å²	149.5	76%	0.757	77%	0.774	S	S	*	*			trans	177.7	113.9	137.4	-98.9	61	0	0	0	109.4
2515	E	38	Very low	40.9	Very low	168 Å²	168	150.8 Å²	150.8	79%	0.785	78%	0.782	S	S	*	*				63	135.7	102.9	-63.4	-170.4	167	0	0	117
2516	M	39.1	Very low	41.5	Very low	157 Å²	157	149.4 Å²	149.4	77%	0.773	79%	0.79	S	S	*	*				-121.3	-179.6	-89.6	-53.4	-176.5	-62.9	0	0	109
2517	E	43.6	Very low	42.6	Very low	183.5 Å²	183.5	150.6 Å²	150.6	86%	0.857	79%	0.794	S	S	*	*				-144	143.3	79.9	-110	178.8	-132.9	0	0	107.9
2518	D	37.9	Very low	43.8	Very low	146 Å²	146	150.4 Å²	150.4	78%	0.781	80%	0.799	S	S	*	*			trans	-83.1	135	-168.5	-47.8	-82.8	0	0	0	114.1
2519	E	46.5	Very low	44.8	Very low	185.5 Å²	185.5	148.1 Å²	148.1	87%	0.867	79%	0.785	S	S	*	*			trans	-127.8	128.9	152.2	-80	-161.1	162.5	0	0	110.2	V2521	E2519-V2521 PolarHBondContact O-N 3.07Å
2520	E	45.4	Very low	45.8	Very low	203 Å²	203	143.3 Å²	143.3	95%	0.949	77%	0.77	S	S	*	*			trans	-72.8	108.6	-176.7	-62	176.2	140.8	0	0	110.8
2521	V	51.4	Low	47.2	Very low	117 Å²	117	143.6 Å²	143.6	71%	0.709	77%	0.771	S	S	*	*			trans	-102.9	122.7	168	179.7	0	0	0	0	108.7	E2519 D2523	E2519-V2521 PolarHBondContact O-N 3.07Å; V2521-D2523 PolarHBondContact O-N 3.13Å
2522	D	53.5	Low	49.4	Very low	163 Å²	163	142.8 Å²	142.8	87%	0.872	77%	0.766	S	S	*	*			trans	-67.2	83	173.1	-72.5	-62.5	0	0	0	110.9	D2524	D2522-D2524 VanDerWaalsContact C-N 3.31Å; D2522-D2524 PolarHBondContact O-N 3.38Å
2523	D	48	Very low	51.4	Low	146 Å²	146	143 Å²	143	78%	0.781	76%	0.764	S	S	*	*			trans	-67.4	89	165.6	-86.7	-41.6	0	0	0	109.3	V2521 E2525	V2521-D2523 PolarHBondContact O-N 3.13Å; D2523-E2525 VanDerWaalsContact C-N 3.28Å; D2523-E2525 PolarHBondContact O-N 3.11Å
2524	D	53.9	Low	53.7	Low	155 Å²	155	139.2 Å²	139.2	83%	0.829	75%	0.746	S	S	*	*			trans	-66.9	80	170.2	-169.5	11.9	0	0	0	109.2	D2522 G2526	D2522-D2524 VanDerWaalsContact C-N 3.31Å; D2522-D2524 PolarHBondContact O-N 3.38Å; D2524-G2526 VanDerWaalsContact C-N 3.34Å; D2524-G2526 PolarHBondContact O-N 3.12Å
2525	E	49.7	Very low	56	Low	168.5 Å²	168.5	137.7 Å²	137.7	79%	0.787	74%	0.742	S	S	*	*			trans	-62	93.5	-163.1	-166.8	-170.5	175.3	0	0	112	D2523 V2527	D2523-E2525 VanDerWaalsContact C-N 3.28Å; D2523-E2525 PolarHBondContact O-N 3.11Å; E2525-V2527 VanDerWaalsContact C-N 3.34Å; E2525-V2527 WeakPolarHBondContact O-CG2 3.42Å; E2525-V2527 PolarHBondContact O-N 3.08Å
2526	G	48.8	Very low	58.4	Low	68.5 Å²	68.5	132.3 Å²	132.3	71%	0.706	72%	0.719	S	S	*	*			trans	0.9	53	166.8	0	0	0	0	0	115.9	D2524 P2528	D2524-G2526 VanDerWaalsContact C-N 3.34Å; D2524-G2526 PolarHBondContact O-N 3.12Å; G2526-P2528 VanDerWaalsContact O-CD 3.27Å; G2526-P2528 WeakPolarHBondContact O-CD 3.38Å; G2526-P2528 VanDerWaalsContact O-N 3.08Å
2527	V	52.1	Low	60.8	Low	107 Å²	107	130.4 Å²	130.4	65%	0.648	72%	0.716	S	S	*	*			trans	-49.4	112.8	-170.7	179.6	0	0	0	0	110.8	E2525 T2529	E2525-V2527 VanDerWaalsContact C-N 3.34Å; E2525-V2527 WeakPolarHBondContact O-CG2 3.42Å; E2525-V2527 PolarHBondContact O-N 3.08Å; V2527-T2529 PolarHBondContact O-N 3.01Å
2528	P	56.5	Low	62.9	Low	114.5 Å²	114.5	123.1 Å²	123.1	74%	0.744	69%	0.689	S	S	*	*			trans	-59.9	111.1	-175.6	-27	35.7	0	0	0	110.9	G2526 S2530	G2526-P2528 VanDerWaalsContact O-CD 3.27Å; G2526-P2528 WeakPolarHBondContact O-CD 3.38Å; G2526-P2528 VanDerWaalsContact O-N 3.08Å; P2528-S2530 PolarHBondContact O-N 3.09Å
2529	T	56.3	Low	65.4	Low	93.5 Å²	93.5	125.3 Å²	125.3	57%	0.574	70%	0.695	S	S	*	*			trans	-67.4	89.2	-167.6	16.5	0	0	0	0	111.1	V2527 H2534 N2536 Y2541	V2527-T2529 PolarHBondContact O-N 3.01Å; T2529-H2534 PolarHBondContact O-CE1 2.82Å; T2529-H2534 PolarHBondContact O-ND1 3.23Å; T2529-N2536 WeakPolarHBondContact CG2-ND2 3.39Å; T2529-Y2541 HydrophobicContact CG2-CE1 4.29Å; T2529-Y2541 WeakPolarHBondContact CG2-OH 3.3Å
2530	S	55.1	Low	67.4	Low	68.5 Å²	68.5	120.8 Å²	120.8	48%	0.479	69%	0.689	S	S	.	*			trans	4.7	149.3	-168.7	82	0	0	0	0	114.7	P2528 I2532 H2534	P2528-S2530 PolarHBondContact O-N 3.09Å; S2530-I2532 CarbonylContact O-C 3.54Å; S2530-I2532 PolarHBondContact O-N 3.3Å; S2530-I2532 VanDerWaalsContact O-O 3.1Å; S2530-I2532 PolarHBondContact OG-N 3.4Å; S2530-I2532 PolarHBondContact OG-O 3.33Å; S2530-H2534 PolarHBondContact OG-CE1 3.4Å; S2530-H2534 VanDerWaalsContact OG-CE1 3.29Å; S2530-H2534 PolarHBondContact OG-ND1 3.13Å
2531	I	70.9	Confident	69.6	Low	165 Å²	165	116.8 Å²	116.8	85%	0.846	67%	0.666	S	S	*	*	S	Bend	trans	-63.6	-10.9	176.8	-62.8	166.3	0	0	0	111.8
2532	I	77.5	Confident	71.6	Confident	125 Å²	125	115.7 Å²	115.7	64%	0.641	65%	0.653	S	S	*	*	S	Bend	trans	-85.9	123	177.8	-57	175.2	0	0	0	109	S2530 H2534	S2530-I2532 CarbonylContact O-C 3.54Å; S2530-I2532 PolarHBondContact O-N 3.3Å; S2530-I2532 VanDerWaalsContact O-O 3.1Å; S2530-I2532 PolarHBondContact OG-N 3.4Å; S2530-I2532 PolarHBondContact OG-O 3.33Å; I2532-H2534 PolarHBondContact O-N 2.7Å; I2532-H2534 PolarHBondContact O-ND1 3.14Å
2533	P	83.1	Confident	73.4	Confident	126 Å²	126	111.4 Å²	111.4	82%	0.818	64%	0.64	S	S	*	*			trans	-67.5	106.3	179.1	27.5	-34.2	0	0	0	110.8
2534	H	80.9	Confident	75.4	Confident	98.5 Å²	98.5	113.5 Å²	113.5	46%	0.456	65%	0.645	S	S	.	*			trans	-117.5	-179.4	177.4	64.7	-71.4	0	0	0	110.3	T2529 S2530 I2532 N2536	T2529-H2534 PolarHBondContact O-CE1 2.82Å; T2529-H2534 PolarHBondContact O-ND1 3.23Å; S2530-H2534 PolarHBondContact OG-CE1 3.4Å; S2530-H2534 VanDerWaalsContact OG-CE1 3.29Å; S2530-H2534 PolarHBondContact OG-ND1 3.13Å; I2532-H2534 PolarHBondContact O-N 2.7Å; I2532-H2534 PolarHBondContact O-ND1 3.14Å; H2534-N2536 PolarHBondContact NE2-OD1 2.82Å
2535	I	88.1	Confident	77.1	Confident	133 Å²	133	113.2 Å²	113.2	68%	0.682	64%	0.642	S	S	*	*			trans	-102.7	119.8	173	-59.6	175.9	0	0	0	107
2536	N	88.4	Confident	79	Confident	55 Å²	55	110.7 Å²	110.7	29%	0.294	64%	0.64	S	S	.	*			trans	-70.1	144.6	179.2	-54	8.8	0	0	0	110.4	T2529 H2534 Y2541	T2529-N2536 WeakPolarHBondContact CG2-ND2 3.39Å; H2534-N2536 PolarHBondContact NE2-OD1 2.82Å; N2536-Y2541 HydrophobicContact CB-CD1 3.6Å; N2536-Y2541 HydrophobicContact CB-CD2 3.65Å; N2536-Y2541 HydrophobicContact CB-CE1 3.71Å; N2536-Y2541 HydrophobicContact CB-CE2 3.77Å; N2536-Y2541 HydrophobicContact CB-CG 3.55Å; N2536-Y2541 VanDerWaalsContact ND2-CE1 3.29Å; N2536-Y2541 WeakPolarHBondContact ND2-CE1 3.27Å; N2536-Y2541 VanDerWaalsContact ND2-CZ 3.3Å; N2536-Y2541 PolarHBondContact ND2-OH 3.3Å
2537	V	89.8	Confident	80.8	Confident	116.5 Å²	116.5	114.8 Å²	114.8	71%	0.706	65%	0.646	S	S	*	*			trans	-137.5	132.4	179.4	179.3	0	0	0	0	108.6
2538	G	87.9	Confident	82.3	Confident	30 Å²	30	117.7 Å²	117.7	31%	0.309	65%	0.65	S	S	.	*	S	Bend	trans	150.1	164.7	-174.3	0	0	0	0	0	110.8	A2540 Y2541 Q2542	G2538-A2540 PolarHBondContact O-N 3.28Å; G2538-A2540 VanDerWaalsContact O-N 3.12Å; G2538-Y2541 PolarHBondContact O-N 3.05Å; G2538-Q2542 PolarHBondContact O-N 2.89Å; G2538-Q2542 PolarHBondContact O-OE1 3.26Å
2539	H	89.4	Confident	83.3	Confident	192 Å²	192	117.2 Å²	117.2	89%	0.889	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-24.2	-176.7	-60	104.3	0	0	0	113.8	Y2541	H2539-Y2541 PolarHBondContact O-N 3.27Å
2540	A	88.8	Confident	83.7	Confident	90.5 Å²	90.5	120.6 Å²	120.6	75%	0.748	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-3.9	171.5	0	0	0	0	0	114.9	G2538	G2538-A2540 PolarHBondContact O-N 3.28Å; G2538-A2540 VanDerWaalsContact O-N 3.12Å
2541	Y	91.4	Very high	83.5	Confident	120 Å²	120	124 Å²	124	47%	0.471	67%	0.666	S	S	.	*	T	Hydrogen-bonded Turn	trans	-131.4	-28.8	-173.2	-55	-69.5	0	0	0	114.2	T2529 N2536 G2538 H2539	T2529-Y2541 HydrophobicContact CG2-CE1 4.29Å; T2529-Y2541 WeakPolarHBondContact CG2-OH 3.3Å; N2536-Y2541 HydrophobicContact CB-CD1 3.6Å; N2536-Y2541 HydrophobicContact CB-CD2 3.65Å; N2536-Y2541 HydrophobicContact CB-CE1 3.71Å; N2536-Y2541 HydrophobicContact CB-CE2 3.77Å; N2536-Y2541 HydrophobicContact CB-CG 3.55Å; N2536-Y2541 VanDerWaalsContact ND2-CE1 3.29Å; N2536-Y2541 WeakPolarHBondContact ND2-CE1 3.27Å; N2536-Y2541 VanDerWaalsContact ND2-CZ 3.3Å; N2536-Y2541 PolarHBondContact ND2-OH 3.3Å; G2538-Y2541 PolarHBondContact O-N 3.05Å; H2539-Y2541 PolarHBondContact O-N 3.27Å
2542	Q	92.3	Very high	82.5	Confident	94.5 Å²	94.5	121.6 Å²	121.6	44%	0.442	66%	0.659	S	S	.	*	S	Bend	trans	-85.1	141	169.1	-87.5	65.9	51.3	0	0	109.9	G2538	G2538-Q2542 PolarHBondContact O-N 2.89Å; G2538-Q2542 PolarHBondContact O-OE1 3.26Å
2543	A	92.1	Very high	80.7	Confident	71.5 Å²	71.5	119.6 Å²	119.6	59%	0.591	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-74.9	140.1	166.2	0	0	0	0	0	109.9
2544	E	90.5	Very high	79	Confident	190 Å²	190	117.9 Å²	117.9	89%	0.888	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-59.1	134.6	160.3	-172.7	170.9	-158.2	0	0	108.8
2545	I	89.3	Confident	77.2	Confident	150 Å²	150	118.6 Å²	118.6	77%	0.769	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-100.5	115.9	-175.4	-58.6	177.6	0	0	0	107.5
2546	P	89.2	Confident	75.2	Confident	114.5 Å²	114.5	120.6 Å²	120.6	74%	0.744	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-59.6	143	177.3	-24.4	34.5	0	0	0	112.2
2547	D	86.4	Confident	73.1	Confident	155.5 Å²	155.5	122.7 Å²	122.7	83%	0.832	68%	0.676	S	S	*	*			trans	-59	147.8	178.2	-82	-47.1	0	0	0	112.8	C2549	D2547-C2549 PolarHBondContact O-N 3.33Å
2548	F	85	Confident	70.9	Confident	168.5 Å²	168.5	122.5 Å²	122.5	74%	0.739	67%	0.671	S	S	*	*			trans	-79.9	88.8	-178.8	179.2	-110	0	0	0	111.6	Q2550	F2548-Q2550 HydrophobicContact CD1-CB 4.09Å; F2548-Q2550 HydrophobicContact CE1-CB 3.65Å; F2548-Q2550 HydrophobicContact CE1-CG 3.7Å; F2548-Q2550 HydrophobicContact CZ-CB 4.35Å; F2548-Q2550 HydrophobicContact CZ-CG 4.26Å; F2548-Q2550 PolarHBondContact O-N 3.09Å
2549	C	77.2	Confident	69	Low	102.5 Å²	102.5	131 Å²	131	69%	0.693	70%	0.699	S	S	*	*			trans	-66	99.9	169.3	-60.5	0	0	0	0	110.5	D2547 E2551	D2547-C2549 PolarHBondContact O-N 3.33Å; C2549-E2551 VanDerWaalsContact C-N 3.32Å; C2549-E2551 PolarHBondContact O-N 3.12Å
2550	Q	64	Low	67.1	Low	165 Å²	165	126.2 Å²	126.2	77%	0.771	68%	0.678	S	S	*	*			trans	-75.5	-17.3	-173.8	-170.5	160.5	-6.8	0	0	114.2	F2548	F2548-Q2550 HydrophobicContact CD1-CB 4.09Å; F2548-Q2550 HydrophobicContact CE1-CB 3.65Å; F2548-Q2550 HydrophobicContact CE1-CG 3.7Å; F2548-Q2550 HydrophobicContact CZ-CB 4.35Å; F2548-Q2550 HydrophobicContact CZ-CG 4.26Å; F2548-Q2550 PolarHBondContact O-N 3.09Å
2551	E	51.5	Low	65.3	Low	140.5 Å²	140.5	125.4 Å²	125.4	66%	0.657	67%	0.667	S	S	*	*			trans	-124.4	131.1	168.5	-67	-168	151.9	0	0	110.7	C2549 T2553	C2549-E2551 VanDerWaalsContact C-N 3.32Å; C2549-E2551 PolarHBondContact O-N 3.12Å; E2551-T2553 VanDerWaalsContact C-N 3.29Å; E2551-T2553 HydrophobicContact CB-CG2 4.32Å; E2551-T2553 WeakPolarHBondContact CB-OG1 3.17Å; E2551-T2553 PolarHBondContact O-N 2.7Å; E2551-T2553 WeakPolarHBondContact OE2-CG2 3.4Å; E2551-T2553 PolarHBondContact OE2-OG1 2.91Å; E2551-T2553 VanDerWaalsContact OE2-OG1 3.08Å
2552	V	50.4	Low	63.7	Low	114 Å²	114	123.5 Å²	123.5	69%	0.691	67%	0.669	S	S	*	*			trans	-90.7	70.1	155.5	-173.8	0	0	0	0	107.2	S2554	V2552-S2554 PolarHBondContact O-N 3.05Å
2553	T	39.9	Very low	62.3	Low	83.5 Å²	83.5	123.8 Å²	123.8	51%	0.512	68%	0.682	S	S	.	*			trans	-66.8	81.8	169.3	14.7	0	0	0	0	109.8	E2551 T2555	E2551-T2553 VanDerWaalsContact C-N 3.29Å; E2551-T2553 HydrophobicContact CB-CG2 4.32Å; E2551-T2553 WeakPolarHBondContact CB-OG1 3.17Å; E2551-T2553 PolarHBondContact O-N 2.7Å; E2551-T2553 WeakPolarHBondContact OE2-CG2 3.4Å; E2551-T2553 PolarHBondContact OE2-OG1 2.91Å; E2551-T2553 VanDerWaalsContact OE2-OG1 3.08Å; T2553-T2555 PolarHBondContact O-N 3.29Å; T2553-T2555 PolarHBondContact O-OG1 3.02Å
2554	S	45.7	Very low	61.4	Low	90.5 Å²	90.5	126.5 Å²	126.5	63%	0.633	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-8.7	9.2	-175.9	58.3	0	0	0	0	117.9	V2552 N2558	V2552-S2554 PolarHBondContact O-N 3.05Å; S2554-N2558 PolarHBondContact O-ND2 3.48Å
2555	T	43.7	Very low	60.8	Low	113 Å²	113	125.7 Å²	125.7	69%	0.693	67%	0.669	S	S	*	*	S	Bend	trans	-106.4	-22.5	-165.1	45	0	0	0	0	115.8	T2553	T2553-T2555 PolarHBondContact O-N 3.29Å; T2553-T2555 PolarHBondContact O-OG1 3.02Å
2556	E	46.5	Very low	60.6	Low	175.5 Å²	175.5	125.5 Å²	125.5	82%	0.82	66%	0.664	S	S	*	*	S	Bend	trans	-120.2	-22.7	-169.2	-60.1	-165.3	166.2	0	0	115.5
2557	T	43.7	Very low	60.3	Low	98 Å²	98	124.9 Å²	124.9	60%	0.601	65%	0.653	S	S	*	*	S	Bend	trans	-88.5	-4.7	-177.1	49.2	0	0	0	0	115.3	K2559	T2557-K2559 PolarHBondContact O-N 3.02Å
2558	N	42.9	Very low	60.3	Low	113 Å²	113	122.4 Å²	122.4	60%	0.604	64%	0.639	S	S	*	*			trans	-106.2	36.6	-167.1	-73.9	-38.8	0	0	0	115.1	S2554	S2554-N2558 PolarHBondContact O-ND2 3.48Å
2559	K	48.2	Very low	60.3	Low	207.5 Å²	207.5	117.7 Å²	117.7	90%	0.902	62%	0.621	S	S	*	*	S	Bend	trans	-90.8	-14.5	173.4	-81.1	-174	178.5	174	0	114.9	T2557	T2557-K2559 PolarHBondContact O-N 3.02Å
2560	E	49.9	Very low	60.8	Low	92.5 Å²	92.5	117.4 Å²	117.4	43%	0.432	61%	0.606	S	S	.	*	S	Bend	trans	-106.4	114.1	166.3	-62.4	-160.8	112	0	0	107.9	K2564 W2565	E2560-K2564 HydrophobicContact CB-CD 4.4Å; E2560-K2564 HydrophobicContact CG-CD 4.45Å; E2560-K2564 VanDerWaalsContact OE1-CD 3.31Å; E2560-K2564 WeakPolarHBondContact OE1-CD 3.33Å; E2560-K2564 WeakPolarHBondContact OE1-CE 3.16Å; E2560-K2564 IonicContact OE1-NZ 2.92Å; E2560-K2564 PolarHBondContact OE1-NZ 2.93Å; E2560-K2564 IonicContact OE2-NZ 2.74Å; E2560-K2564 PolarHBondContact OE2-NZ 2.85Å; E2560-W2565 HydrophobicContact CB-CH2 3.44Å; E2560-W2565 VanDerWaalsContact CB-CH2 3.48Å; E2560-W2565 HydrophobicContact CB-CZ2 4.14Å; E2560-W2565 HydrophobicContact CB-CZ3 3.95Å; E2560-W2565 HydrophobicContact CG-CH2 4.27Å; E2560-W2565 WeakPolarHBondContact OE2-CH2 3.25Å; E2560-W2565 VanDerWaalsContact OE2-CZ2 3.26Å; E2560-W2565 WeakPolarHBondContact OE2-CZ2 3.42Å
2561	S	50.6	Low	61.9	Low	74 Å²	74	114.7 Å²	114.7	52%	0.517	59%	0.589	S	S	.	*			trans	-62.1	139.6	177.9	54.4	0	0	0	0	110.5	S2563 K2564	S2561-S2563 PolarHBondContact O-N 3.13Å; S2561-K2564 WeakPolarHBondContact O-CB 3.37Å; S2561-K2564 PolarHBondContact O-N 2.76Å
2562	P	57.9	Low	63.5	Low	79.5 Å²	79.5	110.5 Å²	110.5	52%	0.516	57%	0.574	S	S	.	*	G	3₁₀ helix	trans	-52.3	-29.6	-179.2	-5.4	2	0	0	0	114.1	K2564 W2565 E2566	P2562-K2564 PolarHBondContact O-N 3.24Å; P2562-W2565 PolarHBondContact O-N 3.08Å; P2562-W2565 VanDerWaalsContact O-N 3.08Å; P2562-E2566 HydrophobicContact CB-CG 4.48Å; P2562-E2566 WeakPolarHBondContact O-CG 3.2Å; P2562-E2566 PolarHBondContact O-N 2.83Å
2563	S	63.9	Low	65.2	Low	101 Å²	101	108.6 Å²	108.6	71%	0.706	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-51.2	-10.5	169.7	-169.4	0	0	0	0	116.2	S2561	S2561-S2563 PolarHBondContact O-N 3.13Å
2564	K	72.9	Confident	67.3	Low	127.5 Å²	127.5	108.6 Å²	108.6	55%	0.554	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-76.7	-31.1	174.5	-176.4	177.6	175.4	-175.6	0	113	E2560 S2561 P2562	E2560-K2564 HydrophobicContact CB-CD 4.4Å; E2560-K2564 HydrophobicContact CG-CD 4.45Å; E2560-K2564 VanDerWaalsContact OE1-CD 3.31Å; E2560-K2564 WeakPolarHBondContact OE1-CD 3.33Å; E2560-K2564 WeakPolarHBondContact OE1-CE 3.16Å; E2560-K2564 IonicContact OE1-NZ 2.92Å; E2560-K2564 PolarHBondContact OE1-NZ 2.93Å; E2560-K2564 IonicContact OE2-NZ 2.74Å; E2560-K2564 PolarHBondContact OE2-NZ 2.85Å; S2561-K2564 WeakPolarHBondContact O-CB 3.37Å; S2561-K2564 PolarHBondContact O-N 2.76Å; P2562-K2564 PolarHBondContact O-N 3.24Å
2565	W	77.6	Confident	69.1	Low	174.5 Å²	174.5	105.2 Å²	105.2	66%	0.661	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.7	-23.1	-173	-55.1	-78.9	0	0	0	114	E2560 P2562	E2560-W2565 HydrophobicContact CB-CH2 3.44Å; E2560-W2565 VanDerWaalsContact CB-CH2 3.48Å; E2560-W2565 HydrophobicContact CB-CZ2 4.14Å; E2560-W2565 HydrophobicContact CB-CZ3 3.95Å; E2560-W2565 HydrophobicContact CG-CH2 4.27Å; E2560-W2565 WeakPolarHBondContact OE2-CH2 3.25Å; E2560-W2565 VanDerWaalsContact OE2-CZ2 3.26Å; E2560-W2565 WeakPolarHBondContact OE2-CZ2 3.42Å; P2562-W2565 PolarHBondContact O-N 3.08Å; P2562-W2565 VanDerWaalsContact O-N 3.08Å
2566	E	85.6	Confident	70.8	Confident	144.5 Å²	144.5	105.3 Å²	105.3	68%	0.675	53%	0.533	S	S	*	.			trans	-137.3	151.7	-176.6	55.9	175.8	-157.7	0	0	112.5	P2562	P2562-E2566 HydrophobicContact CB-CG 4.48Å; P2562-E2566 WeakPolarHBondContact O-CG 3.2Å; P2562-E2566 PolarHBondContact O-N 2.83Å
2567	M	81.9	Confident	72.3	Confident	102 Å²	102	103.1 Å²	103.1	50%	0.502	52%	0.523	S	S	.	.			trans	-128.3	130	178.6	-175.4	-173.9	-69.5	0	0	108.9	L2569 Y2634	M2567-L2569 HydrophobicContact CG-CD2 4.07Å; M2567-L2569 PolarHBondContact O-N 2.68Å; M2567-L2569 VanDerWaalsContact O-N 3.13Å; M2567-L2569 HydrophobicContact SD-CD2 3.85Å; M2567-Y2634 HydrophobicContact CE-CG 4.37Å; M2567-Y2634 HydrophobicContact SD-CD2 3.9Å; M2567-Y2634 HydrophobicContact SD-CG 4.28Å
2568	L	86.4	Confident	73.8	Confident	103 Å²	103	108.7 Å²	108.7	54%	0.539	53%	0.534	S	S	.	.			trans	-81	95.5	-176.7	-176.8	64.1	0	0	0	111.1	W2570 C2613	L2568-W2570 VanDerWaalsContact CD1-O 3.32Å; L2568-W2570 WeakPolarHBondContact CD1-O 3.25Å; L2568-C2613 PolarHBondContact O-SG 3.29Å
2569	L	85.8	Confident	75.8	Confident	70.5 Å²	70.5	106.1 Å²	106.1	37%	0.369	52%	0.52	S	S	.	.			trans	-85	-19.2	-178.4	-56.4	-180	0	0	0	114.3	M2567 H2610 C2613	M2567-L2569 HydrophobicContact CG-CD2 4.07Å; M2567-L2569 PolarHBondContact O-N 2.68Å; M2567-L2569 VanDerWaalsContact O-N 3.13Å; M2567-L2569 HydrophobicContact SD-CD2 3.85Å; L2569-H2610 VanDerWaalsContact CD2-CE1 3.41Å; L2569-H2610 WeakPolarHBondContact CD2-CE1 3.16Å; L2569-H2610 WeakPolarHBondContact O-CA 3.34Å; L2569-C2613 VanDerWaalsContact O-CB 3.32Å; L2569-C2613 WeakPolarHBondContact O-CB 3.48Å
2570	W	88	Confident	77.6	Confident	95.5 Å²	95.5	100.6 Å²	100.6	36%	0.362	51%	0.506	S	S	.	.			trans	-155.5	140.2	178.3	176.6	-108.8	0	0	0	111.2	L2568 L2575 F2609 L2612	L2568-W2570 VanDerWaalsContact CD1-O 3.32Å; L2568-W2570 WeakPolarHBondContact CD1-O 3.25Å; W2570-L2575 HydrophobicContact CH2-CD1 4.02Å; W2570-F2609 HydrophobicContact CD2-CB 4.49Å; W2570-F2609 HydrophobicContact CD2-CD1 4.47Å; W2570-F2609 HydrophobicContact CE3-CB 3.82Å; W2570-F2609 AromaticContact CE3-CD1 3.86Å; W2570-F2609 HydrophobicContact CE3-CD1 3.86Å; W2570-F2609 HydrophobicContact CE3-CG 4.19Å; W2570-F2609 AromaticContact CH2-CD1 3.9Å; W2570-F2609 HydrophobicContact CH2-CD1 3.9Å; W2570-F2609 HydrophobicContact CH2-CE1 4.28Å; W2570-F2609 HydrophobicContact CZ3-CB 4.26Å; W2570-F2609 AromaticContact CZ3-CD1 3.55Å; W2570-F2609 HydrophobicContact CZ3-CD1 3.55Å; W2570-F2609 HydrophobicContact CZ3-CE1 4.37Å; W2570-F2609 HydrophobicContact CZ3-CG 4.31Å; W2570-L2612 HydrophobicContact CH2-CD1 4.46Å; W2570-L2612 HydrophobicContact CZ3-CB 3.95Å; W2570-L2612 HydrophobicContact CZ3-CD1 3.97Å
2571	Y	87.4	Confident	79.4	Confident	108.5 Å²	108.5	103.2 Å²	103.2	43%	0.425	52%	0.516	S	S	.	.			trans	-137.3	110.5	175.1	-175.4	-110.5	0	0	0	110.1	A2573 Y2574	Y2571-A2573 VanDerWaalsContact C-N 3.32Å; Y2571-A2573 HydrophobicContact CD1-CB 4.3Å; Y2571-A2573 HydrophobicContact CE1-CB 3.67Å; Y2571-A2573 PolarHBondContact O-N 2.9Å; Y2571-Y2574 AromaticContact CD1-CD1 3.73Å; Y2571-Y2574 HydrophobicContact CD1-CD1 3.73Å; Y2571-Y2574 AromaticContact CD1-CD2 3.97Å; Y2571-Y2574 HydrophobicContact CD1-CD2 3.97Å; Y2571-Y2574 AromaticContact CD1-CE1 3.75Å; Y2571-Y2574 HydrophobicContact CD1-CE1 3.75Å; Y2571-Y2574 HydrophobicContact CD1-CE2 4.01Å; Y2571-Y2574 AromaticContact CD1-CG 3.82Å; Y2571-Y2574 HydrophobicContact CD1-CG 3.82Å; Y2571-Y2574 AromaticContact CD1-CZ 3.88Å; Y2571-Y2574 HydrophobicContact CE1-CD1 4.29Å; Y2571-Y2574 HydrophobicContact CE1-CE1 4.24Å; Y2571-Y2574 HydrophobicContact CG-CD2 4.37Å; Y2571-Y2574 HydrophobicContact CG-CE2 4.27Å; Y2571-Y2574 PolarHBondContact O-N 3.03Å
2572	P	85.3	Confident	81.1	Confident	52.5 Å²	52.5	101.9 Å²	101.9	34%	0.341	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-58.4	-37.8	-172.4	-27.2	34.1	0	0	0	114.5	F1678 Y2574 L2575	F1678-P2572 HydrophobicContact CE1-CG 4.25Å; P2572-Y2574 PolarHBondContact O-N 2.92Å; P2572-Y2574 VanDerWaalsContact O-N 3.11Å; P2572-L2575 PolarHBondContact O-N 3.08Å; P2572-L2575 VanDerWaalsContact O-N 3.09Å
2573	A	85.6	Confident	82.5	Confident	74 Å²	74	101.4 Å²	101.4	61%	0.612	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-78.6	17.5	-175.8	0	0	0	0	0	114.5	Y2571	Y2571-A2573 VanDerWaalsContact C-N 3.32Å; Y2571-A2573 HydrophobicContact CD1-CB 4.3Å; Y2571-A2573 HydrophobicContact CE1-CB 3.67Å; Y2571-A2573 PolarHBondContact O-N 2.9Å
2574	Y	83.6	Confident	83.7	Confident	83.5 Å²	83.5	103.4 Å²	103.4	33%	0.327	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-85.8	-11.8	160.5	-71.3	-32.2	0	0	0	113.2	Y2571 P2572 K2616	Y2571-Y2574 AromaticContact CD1-CD1 3.73Å; Y2571-Y2574 HydrophobicContact CD1-CD1 3.73Å; Y2571-Y2574 AromaticContact CD1-CD2 3.97Å; Y2571-Y2574 HydrophobicContact CD1-CD2 3.97Å; Y2571-Y2574 AromaticContact CD1-CE1 3.75Å; Y2571-Y2574 HydrophobicContact CD1-CE1 3.75Å; Y2571-Y2574 HydrophobicContact CD1-CE2 4.01Å; Y2571-Y2574 AromaticContact CD1-CG 3.82Å; Y2571-Y2574 HydrophobicContact CD1-CG 3.82Å; Y2571-Y2574 AromaticContact CD1-CZ 3.88Å; Y2571-Y2574 HydrophobicContact CE1-CD1 4.29Å; Y2571-Y2574 HydrophobicContact CE1-CE1 4.24Å; Y2571-Y2574 HydrophobicContact CG-CD2 4.37Å; Y2571-Y2574 HydrophobicContact CG-CE2 4.27Å; Y2571-Y2574 PolarHBondContact O-N 3.03Å; P2572-Y2574 PolarHBondContact O-N 2.92Å; P2572-Y2574 VanDerWaalsContact O-N 3.11Å; Y2574-K2616 HydrophobicContact CD1-CB 4.18Å; Y2574-K2616 HydrophobicContact CE1-CB 4.01Å; Y2574-K2616 HydrophobicContact CE1-CG 4.29Å; Y2574-K2616 HydrophobicContact CE2-CB 4.41Å; Y2574-K2616 HydrophobicContact CG-CB 4.49Å
2575	L	82.5	Confident	84.5	Confident	20 Å²	20	99.7 Å²	99.7	11%	0.105	48%	0.483	C	S	.	.	S	Bend	trans	-128.9	126.2	174.5	-63.4	176.3	0	0	0	109.6	W2570 P2572 E2577 L2586	W2570-L2575 HydrophobicContact CH2-CD1 4.02Å; P2572-L2575 PolarHBondContact O-N 3.08Å; P2572-L2575 VanDerWaalsContact O-N 3.09Å; L2575-E2577 PolarHBondContact O-N 3.05Å; L2575-L2586 HydrophobicContact CD1-CB 4.47Å; L2575-L2586 HydrophobicContact CD1-CD1 4.1Å; L2575-L2586 HydrophobicContact CD1-CD2 3.94Å; L2575-L2586 HydrophobicContact CD1-CG 4.41Å
2576	D	80.1	Confident	85	Confident	115 Å²	115	93 Å²	93	62%	0.615	46%	0.46	S	S	*	.			trans	-69.9	102.8	174.4	-77.9	-48.6	0	0	0	110.3	Y2578 D2579 N2582	D2576-Y2578 PolarHBondContact O-N 3.08Å; D2576-D2579 HydrophobicContact CB-CB 4.47Å; D2576-D2579 PolarHBondContact O-N 2.92Å; D2576-N2582 PolarHBondContact N-ND2 3.24Å
2577	E	77.3	Confident	85.2	Confident	129.5 Å²	129.5	89.1 Å²	89.1	61%	0.605	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-5.7	175.2	-63.9	-172.7	171	0	0	114.1	L2575	L2575-E2577 PolarHBondContact O-N 3.05Å
2578	Y	76.9	Confident	85.6	Confident	215.5 Å²	215.5	89 Å²	89	85%	0.845	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	-13	178.6	-58.5	-77.9	0	0	0	113.8	D2576 P2580	D2576-Y2578 PolarHBondContact O-N 3.08Å; Y2578-P2580 WeakPolarHBondContact O-CD 3.36Å
2579	D	84.7	Confident	85.7	Confident	57.5 Å²	57.5	84.2 Å²	84.2	31%	0.307	42%	0.42	S	S	.	.			trans	-89.6	115.7	172.2	-172.7	-8.8	0	0	0	109.9	D2576 K2581 N2582 I2583	D2576-D2579 HydrophobicContact CB-CB 4.47Å; D2576-D2579 PolarHBondContact O-N 2.92Å; D2579-K2581 PolarHBondContact O-N 3.12Å; D2579-K2581 VanDerWaalsContact O-N 3.16Å; D2579-K2581 VanDerWaalsContact OD1-CB 3.32Å; D2579-K2581 WeakPolarHBondContact OD1-CB 3.44Å; D2579-K2581 WeakPolarHBondContact OD1-CG 3.46Å; D2579-K2581 PolarHBondContact OD1-N 3.28Å; D2579-N2582 HydrophobicContact CB-CB 4.36Å; D2579-N2582 PolarHBondContact O-N 3.22Å; D2579-I2583 PolarHBondContact O-N 3.1Å
2580	P	86.4	Confident	85.8	Confident	92.5 Å²	92.5	82.1 Å²	82.1	60%	0.601	41%	0.41	S	S	*	.	H	α-helix	trans	-57.7	-27.7	175.2	25	-35	0	0	0	113.1	Y2578 I2583 E2584	Y2578-P2580 WeakPolarHBondContact O-CD 3.36Å; P2580-I2583 PolarHBondContact O-N 3.19Å; P2580-E2584 WeakPolarHBondContact O-CB 3.43Å; P2580-E2584 PolarHBondContact O-N 3.35Å
2581	K	87.3	Confident	85.8	Confident	147 Å²	147	84.4 Å²	84.4	64%	0.639	42%	0.422	S	S	*	.	H	α-helix	trans	-65.8	-42.5	177.7	-62.8	178.9	177.2	-176.4	0	112.2	D2579 I2583 E2584 S2585	D2579-K2581 PolarHBondContact O-N 3.12Å; D2579-K2581 VanDerWaalsContact O-N 3.16Å; D2579-K2581 VanDerWaalsContact OD1-CB 3.32Å; D2579-K2581 WeakPolarHBondContact OD1-CB 3.44Å; D2579-K2581 WeakPolarHBondContact OD1-CG 3.46Å; D2579-K2581 PolarHBondContact OD1-N 3.28Å; K2581-I2583 VanDerWaalsContact C-N 3.27Å; K2581-I2583 PolarHBondContact O-N 2.82Å; K2581-E2584 PolarHBondContact O-N 2.94Å; K2581-S2585 VanDerWaalsContact O-CB 3.27Å; K2581-S2585 WeakPolarHBondContact O-CB 3.41Å; K2581-S2585 PolarHBondContact O-N 2.97Å; K2581-S2585 PolarHBondContact O-OG 3.45Å
2582	N	86	Confident	85.8	Confident	45.5 Å²	45.5	81.4 Å²	81.4	24%	0.243	41%	0.413	C	S	.	.	H	α-helix	trans	-64.3	-40.2	176.9	-72.5	-22.1	0	0	0	110.8	D2576 D2579 L2586	D2576-N2582 PolarHBondContact N-ND2 3.24Å; D2579-N2582 HydrophobicContact CB-CB 4.36Å; D2579-N2582 PolarHBondContact O-N 3.22Å; N2582-L2586 WeakPolarHBondContact O-CB 3.27Å; N2582-L2586 PolarHBondContact O-N 3.01Å
2583	I	87	Confident	85.8	Confident	69.5 Å²	69.5	78.9 Å²	78.9	36%	0.356	40%	0.397	S	S	.	.	H	α-helix	trans	-65	-44.6	175.6	-62.3	167.4	0	0	0	111	D2579 P2580 K2581 N2587	D2579-I2583 PolarHBondContact O-N 3.1Å; P2580-I2583 PolarHBondContact O-N 3.19Å; K2581-I2583 VanDerWaalsContact C-N 3.27Å; K2581-I2583 PolarHBondContact O-N 2.82Å; I2583-N2587 WeakPolarHBondContact CG2-ND2 3.25Å; I2583-N2587 WeakPolarHBondContact O-CB 3.28Å; I2583-N2587 VanDerWaalsContact O-CG 3.32Å; I2583-N2587 PolarHBondContact O-N 3.07Å; I2583-N2587 PolarHBondContact O-ND2 3.04Å
2584	E	89.7	Confident	85.7	Confident	144 Å²	144	78.2 Å²	78.2	67%	0.673	39%	0.387	S	S	*	.	H	α-helix	trans	-66	-46.9	178.9	-177.6	162.1	-145.1	0	0	111.9	P2580 K2581 L2586 N2587 L2588	P2580-E2584 WeakPolarHBondContact O-CB 3.43Å; P2580-E2584 PolarHBondContact O-N 3.35Å; K2581-E2584 PolarHBondContact O-N 2.94Å; E2584-L2586 VanDerWaalsContact C-N 3.35Å; E2584-L2586 PolarHBondContact O-N 3.34Å; E2584-N2587 CarbonylContact O-C 3.5Å; E2584-N2587 WeakPolarHBondContact O-CB 3.26Å; E2584-N2587 PolarHBondContact O-N 3.12Å; E2584-N2587 VanDerWaalsContact O-N 3.16Å; E2584-L2588 WeakPolarHBondContact O-CB 3.38Å; E2584-L2588 PolarHBondContact O-N 3.23Å
2585	S	89.3	Confident	85.7	Confident	48.5 Å²	48.5	75.8 Å²	75.8	34%	0.339	38%	0.382	S	S	.	.	H	α-helix	trans	-60.3	-42.3	175.6	-62.8	0	0	0	0	112.1	K2581 L2588 L2589	K2581-S2585 VanDerWaalsContact O-CB 3.27Å; K2581-S2585 WeakPolarHBondContact O-CB 3.41Å; K2581-S2585 PolarHBondContact O-N 2.97Å; K2581-S2585 PolarHBondContact O-OG 3.45Å; S2585-L2588 PolarHBondContact O-N 3.08Å; S2585-L2589 VanDerWaalsContact O-CB 3.31Å; S2585-L2589 WeakPolarHBondContact O-CB 3.42Å; S2585-L2589 PolarHBondContact O-N 3.02Å
2586	L	89	Confident	85.6	Confident	33.5 Å²	33.5	80.1 Å²	80.1	18%	0.175	41%	0.411	C	S	.	.	H	α-helix	trans	-62.6	-44.5	174	-179.8	62.7	0	0	0	111.6	L2575 N2582 E2584 L2588 L2589 T2590 F2609 L2612	L2575-L2586 HydrophobicContact CD1-CB 4.47Å; L2575-L2586 HydrophobicContact CD1-CD1 4.1Å; L2575-L2586 HydrophobicContact CD1-CD2 3.94Å; L2575-L2586 HydrophobicContact CD1-CG 4.41Å; N2582-L2586 WeakPolarHBondContact O-CB 3.27Å; N2582-L2586 PolarHBondContact O-N 3.01Å; E2584-L2586 VanDerWaalsContact C-N 3.35Å; E2584-L2586 PolarHBondContact O-N 3.34Å; L2586-L2588 VanDerWaalsContact C-N 3.3Å; L2586-L2588 PolarHBondContact O-N 2.92Å; L2586-L2589 PolarHBondContact O-N 2.84Å; L2586-T2590 VanDerWaalsContact O-CB 3.24Å; L2586-T2590 WeakPolarHBondContact O-CB 3.44Å; L2586-T2590 PolarHBondContact O-N 3.25Å; L2586-T2590 PolarHBondContact O-OG1 2.9Å; L2586-T2590 VanDerWaalsContact O-OG1 3.13Å; L2586-F2609 HydrophobicContact CD1-CE1 4.21Å; L2586-L2612 HydrophobicContact CD1-CD1 3.37Å
2587	N	88.7	Confident	85.5	Confident	63 Å²	63	78.1 Å²	78.1	34%	0.337	41%	0.411	S	S	.	.	H	α-helix	trans	-63.9	-36.6	176	-82.4	-67.6	0	0	0	112.3	I2583 E2584 K2591	I2583-N2587 WeakPolarHBondContact CG2-ND2 3.25Å; I2583-N2587 WeakPolarHBondContact O-CB 3.28Å; I2583-N2587 VanDerWaalsContact O-CG 3.32Å; I2583-N2587 PolarHBondContact O-N 3.07Å; I2583-N2587 PolarHBondContact O-ND2 3.04Å; E2584-N2587 CarbonylContact O-C 3.5Å; E2584-N2587 WeakPolarHBondContact O-CB 3.26Å; E2584-N2587 PolarHBondContact O-N 3.12Å; E2584-N2587 VanDerWaalsContact O-N 3.16Å; N2587-K2591 WeakPolarHBondContact O-CD 3.33Å; N2587-K2591 WeakPolarHBondContact O-CG 3.45Å; N2587-K2591 PolarHBondContact O-N 3.13Å; N2587-K2591 VanDerWaalsContact O-N 3.1Å
2588	L	90.3	Very high	85.4	Confident	99.5 Å²	99.5	72.1 Å²	72.1	52%	0.521	38%	0.383	S	S	.	.	H	α-helix	trans	-69.1	-48.4	176.1	-179.2	58.9	0	0	0	111.3	E2584 S2585 L2586 T2590 K2591 I2592	E2584-L2588 WeakPolarHBondContact O-CB 3.38Å; E2584-L2588 PolarHBondContact O-N 3.23Å; S2585-L2588 PolarHBondContact O-N 3.08Å; L2586-L2588 VanDerWaalsContact C-N 3.3Å; L2586-L2588 PolarHBondContact O-N 2.92Å; L2588-T2590 VanDerWaalsContact C-N 3.31Å; L2588-T2590 PolarHBondContact O-N 3.14Å; L2588-K2591 WeakPolarHBondContact O-CB 3.26Å; L2588-K2591 PolarHBondContact O-N 3.35Å; L2588-K2591 VanDerWaalsContact O-N 3.14Å; L2588-I2592 HydrophobicContact CD1-CD1 4.24Å; L2588-I2592 HydrophobicContact CD1-CG1 4.49Å; L2588-I2592 HydrophobicContact CG-CD1 4.04Å; L2588-I2592 WeakPolarHBondContact O-CG1 3.28Å; L2588-I2592 PolarHBondContact O-N 3.36Å
2589	L	89.2	Confident	84.9	Confident	3.5 Å²	3.5	67.6 Å²	67.6	2%	0.018	37%	0.365	C	S	.	.	H	α-helix	trans	-57.5	-43	175.2	-176.7	72.2	0	0	0	111.7	S2585 L2586 K2591 I2592 A2593 T2608 L2612 V2619 T2622 L2623 L2626	S2585-L2589 VanDerWaalsContact O-CB 3.31Å; S2585-L2589 WeakPolarHBondContact O-CB 3.42Å; S2585-L2589 PolarHBondContact O-N 3.02Å; L2586-L2589 PolarHBondContact O-N 2.84Å; L2589-K2591 PolarHBondContact O-N 2.99Å; L2589-I2592 PolarHBondContact O-N 3.05Å; L2589-A2593 WeakPolarHBondContact O-CB 3.23Å; L2589-A2593 PolarHBondContact O-N 3.2Å; L2589-T2608 HydrophobicContact CD2-CG2 3.86Å; L2589-T2608 HydrophobicContact CG-CG2 3.76Å; L2589-L2612 HydrophobicContact CD2-CD1 4Å; L2589-L2612 HydrophobicContact CD2-CD2 3.79Å; L2589-L2612 HydrophobicContact CD2-CG 3.96Å; L2589-V2619 HydrophobicContact CB-CG1 4.34Å; L2589-V2619 HydrophobicContact CD2-CG1 4.26Å; L2589-T2622 HydrophobicContact CD1-CG2 4.24Å; L2589-T2622 HydrophobicContact CD2-CG2 3.73Å; L2589-L2623 HydrophobicContact CD1-CB 3.99Å; L2589-L2623 HydrophobicContact CD1-CD1 4.21Å; L2589-L2626 HydrophobicContact CD1-CD2 3.97Å
2590	T	87.5	Confident	83.8	Confident	25.5 Å²	25.5	67.6 Å²	67.6	16%	0.156	37%	0.365	C	S	.	.	H	α-helix	trans	-63.5	-39.3	175	-63	0	0	0	0	112.2	L2586 L2588 I2592 A2593 C2594 M2605	L2586-T2590 VanDerWaalsContact O-CB 3.24Å; L2586-T2590 WeakPolarHBondContact O-CB 3.44Å; L2586-T2590 PolarHBondContact O-N 3.25Å; L2586-T2590 PolarHBondContact O-OG1 2.9Å; L2586-T2590 VanDerWaalsContact O-OG1 3.13Å; L2588-T2590 VanDerWaalsContact C-N 3.31Å; L2588-T2590 PolarHBondContact O-N 3.14Å; T2590-I2592 VanDerWaalsContact C-N 3.34Å; T2590-A2593 PolarHBondContact O-N 3.19Å; T2590-C2594 PolarHBondContact O-N 3.2Å; T2590-C2594 VanDerWaalsContact O-N 3.11Å; T2590-C2594 PolarHBondContact O-SG 2.82Å; T2590-M2605 HydrophobicContact CG2-CG 3.94Å; T2590-M2605 HydrophobicContact CG2-SD 3.61Å
2591	K	87.3	Confident	82.4	Confident	143.5 Å²	143.5	63.3 Å²	63.3	62%	0.624	34%	0.337	S	S	*	.	H	α-helix	trans	-65.2	-41.7	174.3	-72.3	162.4	-171.8	172.1	0	111.6	N2587 L2588 L2589 C2594 S2595	N2587-K2591 WeakPolarHBondContact O-CD 3.33Å; N2587-K2591 WeakPolarHBondContact O-CG 3.45Å; N2587-K2591 PolarHBondContact O-N 3.13Å; N2587-K2591 VanDerWaalsContact O-N 3.1Å; L2588-K2591 WeakPolarHBondContact O-CB 3.26Å; L2588-K2591 PolarHBondContact O-N 3.35Å; L2588-K2591 VanDerWaalsContact O-N 3.14Å; L2589-K2591 PolarHBondContact O-N 2.99Å; K2591-C2594 CarbonylContact O-C 3.58Å; K2591-C2594 PolarHBondContact O-N 3.02Å; K2591-C2594 VanDerWaalsContact O-N 3.15Å; K2591-S2595 PolarHBondContact O-N 3.16Å
2592	I	87.8	Confident	80.9	Confident	46.5 Å²	46.5	58.1 Å²	58.1	24%	0.238	33%	0.325	C	S	.	.	H	α-helix	trans	-63.8	-44.3	176.8	-66.5	165.1	0	0	0	110.3	L2588 L2589 T2590 C2594 S2595 V2598 L2623 L2626	L2588-I2592 HydrophobicContact CD1-CD1 4.24Å; L2588-I2592 HydrophobicContact CD1-CG1 4.49Å; L2588-I2592 HydrophobicContact CG-CD1 4.04Å; L2588-I2592 WeakPolarHBondContact O-CG1 3.28Å; L2588-I2592 PolarHBondContact O-N 3.36Å; L2589-I2592 PolarHBondContact O-N 3.05Å; T2590-I2592 VanDerWaalsContact C-N 3.34Å; I2592-C2594 VanDerWaalsContact C-N 3.31Å; I2592-C2594 PolarHBondContact O-N 3.33Å; I2592-S2595 VanDerWaalsContact O-CB 3.29Å; I2592-S2595 WeakPolarHBondContact O-CB 3.23Å; I2592-S2595 PolarHBondContact O-N 3.26Å; I2592-S2595 PolarHBondContact O-OG 3.18Å; I2592-V2598 HydrophobicContact CG2-CG2 4.04Å; I2592-V2598 VanDerWaalsContact O-CG2 3.29Å; I2592-V2598 WeakPolarHBondContact O-CG2 3.18Å; I2592-L2623 HydrophobicContact CD1-CD1 4.18Å; I2592-L2623 HydrophobicContact CG2-CD1 3.91Å; I2592-L2626 HydrophobicContact CG2-CD2 4.27Å
2593	A	85.8	Confident	79.8	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-65	-22	176.5	0	0	0	0	0	114.5	L2589 T2590 S2595 C2601 T2608 L2626	L2589-A2593 WeakPolarHBondContact O-CB 3.23Å; L2589-A2593 PolarHBondContact O-N 3.2Å; T2590-A2593 PolarHBondContact O-N 3.19Å; A2593-S2595 VanDerWaalsContact C-N 3.26Å; A2593-S2595 PolarHBondContact O-N 3.41Å; A2593-C2601 PolarHBondContact O-SG 3.21Å; A2593-T2608 HydrophobicContact CB-CG2 3.83Å; A2593-T2608 WeakPolarHBondContact CB-OG1 3.35Å; A2593-L2626 HydrophobicContact CB-CD1 3.95Å; A2593-L2626 HydrophobicContact CB-CD2 3.75Å; A2593-L2626 HydrophobicContact CB-CG 4.49Å
2594	C	83.2	Confident	79	Confident	60 Å²	60	58.2 Å²	58.2	41%	0.405	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	8.4	171.4	-60.9	0	0	0	0	112.8	T2590 K2591 I2592	T2590-C2594 PolarHBondContact O-N 3.2Å; T2590-C2594 VanDerWaalsContact O-N 3.11Å; T2590-C2594 PolarHBondContact O-SG 2.82Å; K2591-C2594 CarbonylContact O-C 3.58Å; K2591-C2594 PolarHBondContact O-N 3.02Å; K2591-C2594 VanDerWaalsContact O-N 3.15Å; I2592-C2594 VanDerWaalsContact C-N 3.31Å; I2592-C2594 PolarHBondContact O-N 3.33Å
2595	S	83.3	Confident	78.7	Confident	32 Å²	32	54.4 Å²	54.4	22%	0.224	31%	0.309	C	S	.	.	S	Bend	trans	-100.1	155.7	-178.3	81.3	0	0	0	0	112	K2591 I2592 A2593 A2597 V2598	K2591-S2595 PolarHBondContact O-N 3.16Å; I2592-S2595 VanDerWaalsContact O-CB 3.29Å; I2592-S2595 WeakPolarHBondContact O-CB 3.23Å; I2592-S2595 PolarHBondContact O-N 3.26Å; I2592-S2595 PolarHBondContact O-OG 3.18Å; A2593-S2595 VanDerWaalsContact C-N 3.26Å; A2593-S2595 PolarHBondContact O-N 3.41Å; S2595-A2597 PolarHBondContact O-N 2.91Å; S2595-A2597 WeakPolarHBondContact OG-CB 3.47Å; S2595-A2597 PolarHBondContact OG-N 3.21Å; S2595-V2598 PolarHBondContact O-N 3.26Å
2596	P	80.1	Confident	78.5	Confident	110 Å²	110	58.3 Å²	58.3	71%	0.714	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-11.2	175.6	-23.7	34.8	0	0	0	115.3	V2598	P2596-V2598 VanDerWaalsContact C-N 3.26Å; P2596-V2598 PolarHBondContact O-N 3.01Å
2597	A	77.8	Confident	78.3	Confident	73 Å²	73	56.8 Å²	56.8	60%	0.603	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-18	178.1	0	0	0	0	0	113.3	S2595	S2595-A2597 PolarHBondContact O-N 2.91Å; S2595-A2597 WeakPolarHBondContact OG-CB 3.47Å; S2595-A2597 PolarHBondContact OG-N 3.21Å
2598	V	76.3	Confident	78.3	Confident	5 Å²	5	53.8 Å²	53.8	3%	0.03	30%	0.298	C	S	.	.	S	Bend	trans	-101.2	109.5	177.3	-175.6	0	0	0	0	109.4	I2592 S2595 P2596 N2600 C2601 L2626 L2627	I2592-V2598 HydrophobicContact CG2-CG2 4.04Å; I2592-V2598 VanDerWaalsContact O-CG2 3.29Å; I2592-V2598 WeakPolarHBondContact O-CG2 3.18Å; S2595-V2598 PolarHBondContact O-N 3.26Å; P2596-V2598 VanDerWaalsContact C-N 3.26Å; P2596-V2598 PolarHBondContact O-N 3.01Å; V2598-N2600 PolarHBondContact O-N 3.24Å; V2598-C2601 HydrophobicContact CB-CB 4.2Å; V2598-C2601 HydrophobicContact CG1-CB 3.53Å; V2598-C2601 PolarHBondContact O-N 2.95Å; V2598-L2626 HydrophobicContact CG1-CD1 3.73Å; V2598-L2626 HydrophobicContact CG1-CG 3.87Å; V2598-L2626 WeakPolarHBondContact CG1-O 3.32Å; V2598-L2626 HydrophobicContact CG2-CD1 4.31Å; V2598-L2626 HydrophobicContact CG2-CD2 3.96Å; V2598-L2626 HydrophobicContact CG2-CG 3.8Å; V2598-L2627 HydrophobicContact CG2-CD2 4.39Å
2599	R	66.8	Low	78.2	Confident	120.5 Å²	120.5	51.8 Å²	51.8	46%	0.455	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	134.6	179.6	-70.3	-157.9	-75.2	-159.6	-4.7	110.9	C2601 D2629	R2599-C2601 PolarHBondContact O-N 2.87Å; R2599-D2629 IonicContact CZ-OD1 2.66Å; R2599-D2629 IonicContact CZ-OD2 3.98Å; R2599-D2629 IonicContact NE-OD1 2.75Å; R2599-D2629 PolarHBondContact NE-OD1 3.06Å; R2599-D2629 IonicContact NE-OD2 2.99Å; R2599-D2629 IonicContact NH2-OD1 3.53Å; R2599-D2629 PolarHBondContact NH2-OD1 3.15Å; R2599-D2629 IonicContact NH2-OD2 2.99Å; R2599-D2629 PolarHBondContact NH2-OD2 2.66Å
2600	N	61.3	Low	78.1	Confident	56.5 Å²	56.5	51.6 Å²	51.6	30%	0.302	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	6.4	178.5	-56.9	47.6	0	0	0	116.8	V2400 V2598 L2631	V2400-N2600 HydrophobicContact CB-CB 4.49Å; V2400-N2600 HydrophobicContact CG2-CB 3.75Å; V2598-N2600 PolarHBondContact O-N 3.24Å; N2600-L2631 HydrophobicContact CB-CD1 3.28Å; N2600-L2631 HydrophobicContact CB-CG 4.04Å; N2600-L2631 WeakPolarHBondContact O-CD1 3.36Å
2601	C	55.8	Low	78.2	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.014	28%	0.277	C	S	.	.			trans	-127.3	68.8	-177.6	-170.1	0	0	0	0	113.9	A2593 V2598 R2599	A2593-C2601 PolarHBondContact O-SG 3.21Å; V2598-C2601 HydrophobicContact CB-CB 4.2Å; V2598-C2601 HydrophobicContact CG1-CB 3.53Å; V2598-C2601 PolarHBondContact O-N 2.95Å; R2599-C2601 PolarHBondContact O-N 2.87Å
2602	G	56.6	Low	78.3	Confident	38 Å²	38	43.8 Å²	43.8	39%	0.392	25%	0.248	S	C	.	.	S	Bend	trans	-76	-22.5	175	0	0	0	0	0	115.1
2603	L	62.5	Low	78.5	Confident	100 Å²	100	42 Å²	42	52%	0.524	24%	0.24	S	C	.	.	S	Bend	trans	-143.2	-5.1	-169.6	-67.3	174.2	0	0	0	114.9	M2605 E2640	L2603-M2605 PolarHBondContact O-N 3.16Å; L2603-M2605 VanDerWaalsContact O-N 3.08Å; L2603-E2640 WeakPolarHBondContact CD1-OE2 3.17Å
2604	N	71.3	Confident	78.6	Confident	18 Å²	18	45.9 Å²	45.9	10%	0.096	26%	0.256	C	S	.	.			trans	-91.9	61.1	-164	-68.1	-32.4	0	0	0	113.8	E2606 Y2607 A2639	N2604-E2606 PolarHBondContact O-N 3.25Å; N2604-Y2607 WeakPolarHBondContact O-CB 3.46Å; N2604-Y2607 PolarHBondContact O-N 3.35Å; N2604-A2639 VanDerWaalsContact CG-O 3.27Å; N2604-A2639 PolarHBondContact ND2-O 3.22Å; N2604-A2639 PolarHBondContact OD1-O 2.96Å; N2604-A2639 VanDerWaalsContact OD1-O 3.13Å
2605	M	82.6	Confident	79	Confident	64 Å²	64	46.1 Å²	46.1	32%	0.315	25%	0.249	S	C	.	.	H	α-helix	trans	-52.5	-25.2	174.5	-176.6	176.7	61.1	0	0	113.8	T2590 L2603 Y2607 T2608 F2609	T2590-M2605 HydrophobicContact CG2-CG 3.94Å; T2590-M2605 HydrophobicContact CG2-SD 3.61Å; L2603-M2605 PolarHBondContact O-N 3.16Å; L2603-M2605 VanDerWaalsContact O-N 3.08Å; M2605-Y2607 VanDerWaalsContact C-N 3.34Å; M2605-T2608 WeakPolarHBondContact O-CB 3.34Å; M2605-T2608 PolarHBondContact O-N 2.83Å; M2605-T2608 PolarHBondContact O-OG1 2.99Å; M2605-F2609 HydrophobicContact CE-CE2 4.08Å; M2605-F2609 HydrophobicContact CG-CD2 4.12Å; M2605-F2609 HydrophobicContact CG-CE2 3.53Å; M2605-F2609 HydrophobicContact CG-CZ 4.03Å; M2605-F2609 VanDerWaalsContact O-CD2 3.26Å; M2605-F2609 WeakPolarHBondContact O-CD2 3.5Å; M2605-F2609 PolarHBondContact O-N 3.22Å; M2605-F2609 HydrophobicContact SD-CE2 3.92Å; M2605-F2609 HydrophobicContact SD-CZ 4.13Å
2606	E	84.3	Confident	79.3	Confident	130 Å²	130	51.8 Å²	51.8	61%	0.607	27%	0.27	S	S	*	.	H	α-helix	trans	-66.7	-30.1	175.1	-58.4	-176.6	166.3	0	0	113.5	N2604 H2610 Y2638	N2604-E2606 PolarHBondContact O-N 3.25Å; E2606-H2610 PolarHBondContact O-N 3.35Å; E2606-Y2638 HydrophobicContact CB-CD1 4.13Å; E2606-Y2638 HydrophobicContact CB-CE1 3.66Å; E2606-Y2638 PolarHBondContact O-OH 3.17Å
2607	Y	85.7	Confident	79.7	Confident	3 Å²	3	47.1 Å²	47.1	1%	0.012	24%	0.241	C	C	.	.	H	α-helix	trans	-67	-42.9	173.4	173.7	-111.5	0	0	0	110.4	N2604 M2605 F2609 H2610 L2611 L2626 T2630 L2631 V2633 Y2638	N2604-Y2607 WeakPolarHBondContact O-CB 3.46Å; N2604-Y2607 PolarHBondContact O-N 3.35Å; M2605-Y2607 VanDerWaalsContact C-N 3.34Å; Y2607-F2609 PolarHBondContact O-N 2.9Å; Y2607-H2610 PolarHBondContact O-N 3.09Å; Y2607-L2611 HydrophobicContact CD1-CD1 4.09Å; Y2607-L2611 HydrophobicContact CE1-CD1 3.54Å; Y2607-L2611 HydrophobicContact CE1-CG 4.2Å; Y2607-L2611 HydrophobicContact CE2-CD1 4.36Å; Y2607-L2611 HydrophobicContact CE2-CD2 4.17Å; Y2607-L2611 HydrophobicContact CE2-CG 4.22Å; Y2607-L2611 WeakPolarHBondContact O-CG 3.41Å; Y2607-L2611 PolarHBondContact O-N 3.16Å; Y2607-L2626 HydrophobicContact CD1-CD1 3.92Å; Y2607-L2626 HydrophobicContact CE1-CD1 3.87Å; Y2607-T2630 PolarHBondContact OH-O 3.04Å; Y2607-L2631 HydrophobicContact CD1-CD2 4.09Å; Y2607-L2631 HydrophobicContact CE1-CD2 3.57Å; Y2607-L2631 HydrophobicContact CE2-CB 4.48Å; Y2607-L2631 HydrophobicContact CE2-CD2 4.16Å; Y2607-L2631 WeakPolarHBondContact CE2-O 3.2Å; Y2607-V2633 HydrophobicContact CD2-CG2 4Å; Y2607-V2633 HydrophobicContact CE2-CG2 3.59Å; Y2607-Y2638 AromaticContact CD2-CD2 3.68Å; Y2607-Y2638 HydrophobicContact CD2-CD2 3.68Å; Y2607-Y2638 AromaticContact CD2-CE2 3.74Å; Y2607-Y2638 HydrophobicContact CD2-CE2 3.74Å; Y2607-Y2638 HydrophobicContact CG-CD2 4.29Å; Y2607-Y2638 HydrophobicContact CG-CE2 4.43Å
2608	T	87.6	Confident	80.2	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.7	-44.2	176.2	-35.4	0	0	0	0	112.4	L2589 A2593 M2605 H2610 L2611 L2612	L2589-T2608 HydrophobicContact CD2-CG2 3.86Å; L2589-T2608 HydrophobicContact CG-CG2 3.76Å; A2593-T2608 HydrophobicContact CB-CG2 3.83Å; A2593-T2608 WeakPolarHBondContact CB-OG1 3.35Å; M2605-T2608 WeakPolarHBondContact O-CB 3.34Å; M2605-T2608 PolarHBondContact O-N 2.83Å; M2605-T2608 PolarHBondContact O-OG1 2.99Å; T2608-H2610 VanDerWaalsContact C-N 3.35Å; T2608-L2611 PolarHBondContact O-N 2.83Å; T2608-L2612 WeakPolarHBondContact O-CG 3.31Å; T2608-L2612 PolarHBondContact O-N 3.44Å
2609	F	88.4	Confident	80.9	Confident	56 Å²	56	48.3 Å²	48.3	25%	0.246	24%	0.239	C	C	.	.	H	α-helix	trans	-66.5	-35.2	177.3	-68.9	-50.5	0	0	0	112.7	W2570 L2586 M2605 Y2607 L2612 C2613	W2570-F2609 HydrophobicContact CD2-CB 4.49Å; W2570-F2609 HydrophobicContact CD2-CD1 4.47Å; W2570-F2609 HydrophobicContact CE3-CB 3.82Å; W2570-F2609 AromaticContact CE3-CD1 3.86Å; W2570-F2609 HydrophobicContact CE3-CD1 3.86Å; W2570-F2609 HydrophobicContact CE3-CG 4.19Å; W2570-F2609 AromaticContact CH2-CD1 3.9Å; W2570-F2609 HydrophobicContact CH2-CD1 3.9Å; W2570-F2609 HydrophobicContact CH2-CE1 4.28Å; W2570-F2609 HydrophobicContact CZ3-CB 4.26Å; W2570-F2609 AromaticContact CZ3-CD1 3.55Å; W2570-F2609 HydrophobicContact CZ3-CD1 3.55Å; W2570-F2609 HydrophobicContact CZ3-CE1 4.37Å; W2570-F2609 HydrophobicContact CZ3-CG 4.31Å; L2586-F2609 HydrophobicContact CD1-CE1 4.21Å; M2605-F2609 HydrophobicContact CE-CE2 4.08Å; M2605-F2609 HydrophobicContact CG-CD2 4.12Å; M2605-F2609 HydrophobicContact CG-CE2 3.53Å; M2605-F2609 HydrophobicContact CG-CZ 4.03Å; M2605-F2609 VanDerWaalsContact O-CD2 3.26Å; M2605-F2609 WeakPolarHBondContact O-CD2 3.5Å; M2605-F2609 PolarHBondContact O-N 3.22Å; M2605-F2609 HydrophobicContact SD-CE2 3.92Å; M2605-F2609 HydrophobicContact SD-CZ 4.13Å; Y2607-F2609 PolarHBondContact O-N 2.9Å; F2609-L2612 HydrophobicContact CD1-CD1 4.16Å; F2609-L2612 PolarHBondContact O-N 3.47Å; F2609-C2613 PolarHBondContact O-N 2.73Å
2610	H	88.5	Confident	82	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-72.6	-37.6	175.6	-172.1	-174.2	0	0	0	112.3	L2569 E2606 Y2607 T2608 C2613 K2614 V2633 Y2634 Y2638	L2569-H2610 VanDerWaalsContact CD2-CE1 3.41Å; L2569-H2610 WeakPolarHBondContact CD2-CE1 3.16Å; L2569-H2610 WeakPolarHBondContact O-CA 3.34Å; E2606-H2610 PolarHBondContact O-N 3.35Å; Y2607-H2610 PolarHBondContact O-N 3.09Å; T2608-H2610 VanDerWaalsContact C-N 3.35Å; H2610-C2613 WeakPolarHBondContact O-CB 3.06Å; H2610-C2613 PolarHBondContact O-N 2.81Å; H2610-K2614 WeakPolarHBondContact O-CB 3.13Å; H2610-K2614 PolarHBondContact O-N 2.87Å; H2610-V2633 WeakPolarHBondContact CE1-CG1 3.41Å; H2610-Y2634 AromaticContact CE1-CD2 3.86Å; H2610-Y2634 AromaticContact NE2-CD2 3.4Å; H2610-Y2634 WeakPolarHBondContact NE2-CD2 3.24Å; H2610-Y2634 AromaticContact NE2-CE2 3.61Å; H2610-Y2638 WeakPolarHBondContact CB-OH 3.35Å; H2610-Y2638 AromaticContact ND1-CE2 3.98Å; H2610-Y2638 AromaticContact ND1-CZ 3.88Å; H2610-Y2638 PolarHBondContact ND1-OH 3.02Å
2611	L	89.4	Confident	83.4	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-61.3	-45.7	169.4	-67	-176.2	0	0	0	111.3	Y2607 T2608 C2613 K2614 Y2615 T2622 A2625 L2626 V2633	Y2607-L2611 HydrophobicContact CD1-CD1 4.09Å; Y2607-L2611 HydrophobicContact CE1-CD1 3.54Å; Y2607-L2611 HydrophobicContact CE1-CG 4.2Å; Y2607-L2611 HydrophobicContact CE2-CD1 4.36Å; Y2607-L2611 HydrophobicContact CE2-CD2 4.17Å; Y2607-L2611 HydrophobicContact CE2-CG 4.22Å; Y2607-L2611 WeakPolarHBondContact O-CG 3.41Å; Y2607-L2611 PolarHBondContact O-N 3.16Å; T2608-L2611 PolarHBondContact O-N 2.83Å; L2611-C2613 VanDerWaalsContact C-N 3.27Å; L2611-C2613 PolarHBondContact O-N 3.01Å; L2611-K2614 WeakPolarHBondContact O-CB 3.37Å; L2611-K2614 PolarHBondContact O-N 3.13Å; L2611-K2614 VanDerWaalsContact O-N 3.16Å; L2611-Y2615 HydrophobicContact CB-CD2 4.43Å; L2611-Y2615 HydrophobicContact CD2-CE2 4.25Å; L2611-Y2615 WeakPolarHBondContact O-CD2 3.35Å; L2611-Y2615 PolarHBondContact O-N 2.75Å; L2611-T2622 HydrophobicContact CB-CG2 3.59Å; L2611-T2622 HydrophobicContact CD1-CG2 4.29Å; L2611-A2625 HydrophobicContact CD1-CB 4.11Å; L2611-A2625 HydrophobicContact CD2-CB 4.29Å; L2611-L2626 HydrophobicContact CD1-CB 4.05Å; L2611-L2626 HydrophobicContact CD1-CD1 4.48Å; L2611-V2633 HydrophobicContact CD2-CG2 4.04Å
2612	L	89.8	Confident	85	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-56.9	-39.5	173.6	-78	167.3	0	0	0	112.3	W2570 L2586 L2589 T2608 F2609 Y2615 K2616 G2617 V2619 T2622	W2570-L2612 HydrophobicContact CH2-CD1 4.46Å; W2570-L2612 HydrophobicContact CZ3-CB 3.95Å; W2570-L2612 HydrophobicContact CZ3-CD1 3.97Å; L2586-L2612 HydrophobicContact CD1-CD1 3.37Å; L2589-L2612 HydrophobicContact CD2-CD1 4Å; L2589-L2612 HydrophobicContact CD2-CD2 3.79Å; L2589-L2612 HydrophobicContact CD2-CG 3.96Å; T2608-L2612 WeakPolarHBondContact O-CG 3.31Å; T2608-L2612 PolarHBondContact O-N 3.44Å; F2609-L2612 HydrophobicContact CD1-CD1 4.16Å; F2609-L2612 PolarHBondContact O-N 3.47Å; L2612-Y2615 CarbonylContact O-C 3.52Å; L2612-K2616 PolarHBondContact O-N 3.19Å; L2612-G2617 PolarHBondContact O-N 3.3Å; L2612-V2619 HydrophobicContact CD2-CG2 4.33Å; L2612-T2622 HydrophobicContact CD2-CG2 4.3Å; L2612-T2622 HydrophobicContact CG-CG2 4.11Å
2613	C	90.7	Very high	86.6	Confident	10 Å²	10	52.4 Å²	52.4	7%	0.068	25%	0.254	C	S	.	.	H	α-helix	trans	-65.8	-47.2	175.5	-161.5	0	0	0	0	111.7	L2568 L2569 F2609 H2610 L2611 Y2615 K2616	L2568-C2613 PolarHBondContact O-SG 3.29Å; L2569-C2613 VanDerWaalsContact O-CB 3.32Å; L2569-C2613 WeakPolarHBondContact O-CB 3.48Å; F2609-C2613 PolarHBondContact O-N 2.73Å; H2610-C2613 WeakPolarHBondContact O-CB 3.06Å; H2610-C2613 PolarHBondContact O-N 2.81Å; L2611-C2613 VanDerWaalsContact C-N 3.27Å; L2611-C2613 PolarHBondContact O-N 3.01Å; C2613-Y2615 VanDerWaalsContact C-N 3.31Å; C2613-Y2615 PolarHBondContact O-N 2.99Å; C2613-K2616 PolarHBondContact O-N 3.13Å; C2613-K2616 VanDerWaalsContact O-N 3.09Å
2614	K	89.3	Confident	87.8	Confident	80 Å²	80	52 Å²	52	35%	0.348	25%	0.249	S	C	.	.	H	α-helix	trans	-58.8	-39.4	177	176.2	178.6	179.3	-175.9	0	112.6	H2610 L2611 V2633	H2610-K2614 WeakPolarHBondContact O-CB 3.13Å; H2610-K2614 PolarHBondContact O-N 2.87Å; L2611-K2614 WeakPolarHBondContact O-CB 3.37Å; L2611-K2614 PolarHBondContact O-N 3.13Å; L2611-K2614 VanDerWaalsContact O-N 3.16Å; K2614-V2633 HydrophobicContact CD-CG1 3.89Å
2615	Y	91.1	Very high	88.6	Confident	66 Å²	66	51.5 Å²	51.5	26%	0.259	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	16.9	177.2	-61.1	-68.7	0	0	0	113.5	L2611 L2612 C2613 G2617 D2618 M2621 A2625	L2611-Y2615 HydrophobicContact CB-CD2 4.43Å; L2611-Y2615 HydrophobicContact CD2-CE2 4.25Å; L2611-Y2615 WeakPolarHBondContact O-CD2 3.35Å; L2611-Y2615 PolarHBondContact O-N 2.75Å; L2612-Y2615 CarbonylContact O-C 3.52Å; C2613-Y2615 VanDerWaalsContact C-N 3.31Å; C2613-Y2615 PolarHBondContact O-N 2.99Å; Y2615-G2617 PolarHBondContact O-N 2.79Å; Y2615-G2617 VanDerWaalsContact O-N 3.13Å; Y2615-D2618 VanDerWaalsContact O-CB 3.28Å; Y2615-D2618 WeakPolarHBondContact O-CB 3.26Å; Y2615-D2618 PolarHBondContact O-N 2.84Å; Y2615-M2621 HydrophobicContact CD1-CB 3.91Å; Y2615-M2621 HydrophobicContact CD1-CE 4.29Å; Y2615-M2621 HydrophobicContact CE1-CB 4.47Å; Y2615-M2621 HydrophobicContact CE1-CE 4.04Å; Y2615-M2621 HydrophobicContact CG-CB 4.01Å; Y2615-A2625 HydrophobicContact CD2-CB 4.36Å; Y2615-A2625 HydrophobicContact CE2-CB 3.42Å; Y2615-A2625 VanDerWaalsContact CE2-CB 3.42Å
2616	K	89.7	Confident	88.8	Confident	150 Å²	150	48.5 Å²	48.5	65%	0.652	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	32.9	171.6	-54.3	177.6	-177	174	0	115	Y2574 L2612 C2613	Y2574-K2616 HydrophobicContact CD1-CB 4.18Å; Y2574-K2616 HydrophobicContact CE1-CB 4.01Å; Y2574-K2616 HydrophobicContact CE1-CG 4.29Å; Y2574-K2616 HydrophobicContact CE2-CB 4.41Å; Y2574-K2616 HydrophobicContact CG-CB 4.49Å; L2612-K2616 PolarHBondContact O-N 3.19Å; C2613-K2616 PolarHBondContact O-N 3.13Å; C2613-K2616 VanDerWaalsContact O-N 3.09Å
2617	G	87.5	Confident	88.8	Confident	12 Å²	12	46.9 Å²	46.9	12%	0.124	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.6	-6.2	-178.6	0	0	0	0	0	115.5	L2612 Y2615 V2619	L2612-G2617 PolarHBondContact O-N 3.3Å; Y2615-G2617 PolarHBondContact O-N 2.79Å; Y2615-G2617 VanDerWaalsContact O-N 3.13Å; G2617-V2619 PolarHBondContact O-N 3.23Å; G2617-V2619 VanDerWaalsContact O-N 3.13Å
2618	D	89.1	Confident	88.5	Confident	69 Å²	69	53.2 Å²	53.2	37%	0.369	25%	0.251	S	S	.	.			trans	-66.5	111	176.8	-175.3	-24.6	0	0	0	111.2	Y2615 E2620 M2621 T2622	Y2615-D2618 VanDerWaalsContact O-CB 3.28Å; Y2615-D2618 WeakPolarHBondContact O-CB 3.26Å; Y2615-D2618 PolarHBondContact O-N 2.84Å; D2618-E2620 PolarHBondContact OD1-N 3.11Å; D2618-M2621 HydrophobicContact CB-CB 4.16Å; D2618-M2621 PolarHBondContact OD1-N 3.36Å; D2618-M2621 WeakPolarHBondContact OD2-CG 3.49Å; D2618-T2622 VanDerWaalsContact O-CB 3.23Å; D2618-T2622 WeakPolarHBondContact O-CB 3.23Å; D2618-T2622 PolarHBondContact O-N 3.48Å; D2618-T2622 VanDerWaalsContact O-N 3.12Å; D2618-T2622 PolarHBondContact O-OG1 3.04Å
2619	V	89.9	Confident	87.4	Confident	34 Å²	34	57.6 Å²	57.6	21%	0.206	28%	0.275	C	S	.	.	H	α-helix	trans	-74.1	-33.3	-178.6	176.2	0	0	0	0	111.9	L2589 L2612 G2617 L2623	L2589-V2619 HydrophobicContact CB-CG1 4.34Å; L2589-V2619 HydrophobicContact CD2-CG1 4.26Å; L2612-V2619 HydrophobicContact CD2-CG2 4.33Å; G2617-V2619 PolarHBondContact O-N 3.23Å; G2617-V2619 VanDerWaalsContact O-N 3.13Å; V2619-L2623 WeakPolarHBondContact O-CB 3.07Å; V2619-L2623 PolarHBondContact O-N 3.24Å
2620	E	90	Very high	86.4	Confident	164 Å²	164	59.5 Å²	59.5	77%	0.766	29%	0.291	S	S	*	.	H	α-helix	trans	-76.5	-46.7	-176.6	-65.3	-175.3	-172.8	0	0	110.6	D2618 T2622 L2623 H2624	D2618-E2620 PolarHBondContact OD1-N 3.11Å; E2620-T2622 VanDerWaalsContact C-N 3.27Å; E2620-T2622 PolarHBondContact O-N 3.44Å; E2620-L2623 PolarHBondContact O-N 3.43Å; E2620-H2624 WeakPolarHBondContact O-CB 3.21Å; E2620-H2624 PolarHBondContact O-N 3.48Å
2621	M	90.5	Very high	85.5	Confident	85 Å²	85	60.4 Å²	60.4	42%	0.419	30%	0.296	S	S	.	.	H	α-helix	trans	-63.5	-34.7	171.8	-73.4	-69	-74.5	0	0	111.8	Y2615 D2618 A2625	Y2615-M2621 HydrophobicContact CD1-CB 3.91Å; Y2615-M2621 HydrophobicContact CD1-CE 4.29Å; Y2615-M2621 HydrophobicContact CE1-CB 4.47Å; Y2615-M2621 HydrophobicContact CE1-CE 4.04Å; Y2615-M2621 HydrophobicContact CG-CB 4.01Å; D2618-M2621 HydrophobicContact CB-CB 4.16Å; D2618-M2621 PolarHBondContact OD1-N 3.36Å; D2618-M2621 WeakPolarHBondContact OD2-CG 3.49Å; M2621-A2625 VanDerWaalsContact O-CB 3.27Å; M2621-A2625 WeakPolarHBondContact O-CB 3.38Å; M2621-A2625 PolarHBondContact O-N 3.15Å
2622	T	90.6	Very high	84.7	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-66.1	-44.7	171.8	-62.9	0	0	0	0	112.1	L2589 L2611 L2612 D2618 E2620 H2624 A2625 L2626	L2589-T2622 HydrophobicContact CD1-CG2 4.24Å; L2589-T2622 HydrophobicContact CD2-CG2 3.73Å; L2611-T2622 HydrophobicContact CB-CG2 3.59Å; L2611-T2622 HydrophobicContact CD1-CG2 4.29Å; L2612-T2622 HydrophobicContact CD2-CG2 4.3Å; L2612-T2622 HydrophobicContact CG-CG2 4.11Å; D2618-T2622 VanDerWaalsContact O-CB 3.23Å; D2618-T2622 WeakPolarHBondContact O-CB 3.23Å; D2618-T2622 PolarHBondContact O-N 3.48Å; D2618-T2622 VanDerWaalsContact O-N 3.12Å; D2618-T2622 PolarHBondContact O-OG1 3.04Å; E2620-T2622 VanDerWaalsContact C-N 3.27Å; E2620-T2622 PolarHBondContact O-N 3.44Å; T2622-H2624 PolarHBondContact O-N 3.04Å; T2622-A2625 PolarHBondContact O-N 3.07Å; T2622-L2626 WeakPolarHBondContact O-CB 3.31Å; T2622-L2626 PolarHBondContact O-N 3.1Å
2623	L	89.4	Confident	83.9	Confident	55 Å²	55	64 Å²	64	29%	0.288	32%	0.317	S	S	.	.	H	α-helix	trans	-62	-43.3	177.6	178.1	59.8	0	0	0	111.5	L2589 I2592 V2619 E2620 L2626 L2627	L2589-L2623 HydrophobicContact CD1-CB 3.99Å; L2589-L2623 HydrophobicContact CD1-CD1 4.21Å; I2592-L2623 HydrophobicContact CD1-CD1 4.18Å; I2592-L2623 HydrophobicContact CG2-CD1 3.91Å; V2619-L2623 WeakPolarHBondContact O-CB 3.07Å; V2619-L2623 PolarHBondContact O-N 3.24Å; E2620-L2623 PolarHBondContact O-N 3.43Å; L2623-L2626 HydrophobicContact CD1-CD2 4.39Å; L2623-L2626 WeakPolarHBondContact O-CB 3.11Å; L2623-L2626 PolarHBondContact O-N 3.26Å; L2623-L2627 HydrophobicContact CD1-CD1 4.02Å; L2623-L2627 HydrophobicContact CD1-CG 4.26Å; L2623-L2627 HydrophobicContact CG-CD1 4.14Å; L2623-L2627 WeakPolarHBondContact O-CB 3.47Å; L2623-L2627 VanDerWaalsContact O-CG 3.32Å; L2623-L2627 WeakPolarHBondContact O-CG 3.26Å; L2623-L2627 PolarHBondContact O-N 3.23Å
2624	H	88.5	Confident	83	Confident	92 Å²	92	69.9 Å²	69.9	43%	0.426	34%	0.339	S	S	.	.	H	α-helix	trans	-66.3	-34.8	175.8	174.6	-148.9	0	0	0	112.6	E2620 T2622 R2628	E2620-H2624 WeakPolarHBondContact O-CB 3.21Å; E2620-H2624 PolarHBondContact O-N 3.48Å; T2622-H2624 PolarHBondContact O-N 3.04Å; H2624-R2628 PolarHBondContact CE1-NH2 2.86Å; H2624-R2628 PolarHBondContact NE2-NE 3.05Å; H2624-R2628 VanDerWaalsContact NE2-NE 3.18Å; H2624-R2628 PolarHBondContact NE2-NH2 2.95Å; H2624-R2628 WeakPolarHBondContact O-CG 3.44Å
2625	A	87.9	Confident	82.3	Confident	7 Å²	7	73.2 Å²	73.2	6%	0.058	36%	0.361	C	S	.	.	H	α-helix	trans	-72.8	-35.7	173.2	0	0	0	0	0	113	L2611 Y2615 M2621 T2622 L2627 R2628	L2611-A2625 HydrophobicContact CD1-CB 4.11Å; L2611-A2625 HydrophobicContact CD2-CB 4.29Å; Y2615-A2625 HydrophobicContact CD2-CB 4.36Å; Y2615-A2625 HydrophobicContact CE2-CB 3.42Å; Y2615-A2625 VanDerWaalsContact CE2-CB 3.42Å; M2621-A2625 VanDerWaalsContact O-CB 3.27Å; M2621-A2625 WeakPolarHBondContact O-CB 3.38Å; M2621-A2625 PolarHBondContact O-N 3.15Å; T2622-A2625 PolarHBondContact O-N 3.07Å; A2625-L2627 VanDerWaalsContact C-N 3.34Å; A2625-R2628 PolarHBondContact O-N 3.4Å
2626	L	86.6	Confident	81.8	Confident	1 Å²	1	75.2 Å²	75.2	1%	0.005	37%	0.369	C	S	.	.	H	α-helix	trans	-65.7	-36.3	175.7	179.2	71.6	0	0	0	111.5	L2589 I2592 A2593 V2598 Y2607 L2611 T2622 L2623 R2628	L2589-L2626 HydrophobicContact CD1-CD2 3.97Å; I2592-L2626 HydrophobicContact CG2-CD2 4.27Å; A2593-L2626 HydrophobicContact CB-CD1 3.95Å; A2593-L2626 HydrophobicContact CB-CD2 3.75Å; A2593-L2626 HydrophobicContact CB-CG 4.49Å; V2598-L2626 HydrophobicContact CG1-CD1 3.73Å; V2598-L2626 HydrophobicContact CG1-CG 3.87Å; V2598-L2626 WeakPolarHBondContact CG1-O 3.32Å; V2598-L2626 HydrophobicContact CG2-CD1 4.31Å; V2598-L2626 HydrophobicContact CG2-CD2 3.96Å; V2598-L2626 HydrophobicContact CG2-CG 3.8Å; Y2607-L2626 HydrophobicContact CD1-CD1 3.92Å; Y2607-L2626 HydrophobicContact CE1-CD1 3.87Å; L2611-L2626 HydrophobicContact CD1-CB 4.05Å; L2611-L2626 HydrophobicContact CD1-CD1 4.48Å; T2622-L2626 WeakPolarHBondContact O-CB 3.31Å; T2622-L2626 PolarHBondContact O-N 3.1Å; L2623-L2626 HydrophobicContact CD1-CD2 4.39Å; L2623-L2626 WeakPolarHBondContact O-CB 3.11Å; L2623-L2626 PolarHBondContact O-N 3.26Å; L2626-R2628 PolarHBondContact O-N 3.39Å
2627	L	84.6	Confident	81.3	Confident	96 Å²	96	71.3 Å²	71.3	50%	0.503	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	7.3	175.4	-66.6	171.1	0	0	0	113.8	V2598 L2623 A2625	V2598-L2627 HydrophobicContact CG2-CD2 4.39Å; L2623-L2627 HydrophobicContact CD1-CD1 4.02Å; L2623-L2627 HydrophobicContact CD1-CG 4.26Å; L2623-L2627 HydrophobicContact CG-CD1 4.14Å; L2623-L2627 WeakPolarHBondContact O-CB 3.47Å; L2623-L2627 VanDerWaalsContact O-CG 3.32Å; L2623-L2627 WeakPolarHBondContact O-CG 3.26Å; L2623-L2627 PolarHBondContact O-N 3.23Å; A2625-L2627 VanDerWaalsContact C-N 3.34Å
2628	R	79.8	Confident	80.9	Confident	136 Å²	136	71.1 Å²	71.1	51%	0.513	35%	0.353	S	S	.	.	S	Bend	trans	-104.6	147.4	170.5	-70.1	167.8	176.4	-147.5	-7.6	110	H2624 A2625 L2626 T2630	H2624-R2628 PolarHBondContact CE1-NH2 2.86Å; H2624-R2628 PolarHBondContact NE2-NE 3.05Å; H2624-R2628 VanDerWaalsContact NE2-NE 3.18Å; H2624-R2628 PolarHBondContact NE2-NH2 2.95Å; H2624-R2628 WeakPolarHBondContact O-CG 3.44Å; A2625-R2628 PolarHBondContact O-N 3.4Å; L2626-R2628 PolarHBondContact O-N 3.39Å; R2628-T2630 PolarHBondContact O-N 3.21Å
2629	D	63.9	Low	80.3	Confident	92 Å²	92	69.9 Å²	69.9	49%	0.492	35%	0.353	S	S	.	.	S	Bend	trans	-70.6	-5.2	-170.9	-48.8	-37.1	0	0	0	114.7	R2599 L2631	R2599-D2629 IonicContact CZ-OD1 2.66Å; R2599-D2629 IonicContact CZ-OD2 3.98Å; R2599-D2629 IonicContact NE-OD1 2.75Å; R2599-D2629 PolarHBondContact NE-OD1 3.06Å; R2599-D2629 IonicContact NE-OD2 2.99Å; R2599-D2629 IonicContact NH2-OD1 3.53Å; R2599-D2629 PolarHBondContact NH2-OD1 3.15Å; R2599-D2629 IonicContact NH2-OD2 2.99Å; R2599-D2629 PolarHBondContact NH2-OD2 2.66Å; D2629-L2631 PolarHBondContact O-N 3.03Å
2630	T	67.3	Low	79.4	Confident	96 Å²	96	69.9 Å²	69.9	59%	0.589	35%	0.35	S	S	*	.			trans	-82.2	80.1	-173.8	54.9	0	0	0	0	111.9	Y2607 R2628 V2632	Y2607-T2630 PolarHBondContact OH-O 3.04Å; R2628-T2630 PolarHBondContact O-N 3.21Å; T2630-V2632 PolarHBondContact O-N 3.06Å; T2630-V2632 VanDerWaalsContact O-N 3.14Å
2631	L	69.6	Low	78.5	Confident	20 Å²	20	62.8 Å²	62.8	11%	0.105	32%	0.318	C	S	.	.			trans	-69	-0.1	175.8	-68.1	-163.4	0	0	0	115.7	N2600 Y2607 D2629 T2641	N2600-L2631 HydrophobicContact CB-CD1 3.28Å; N2600-L2631 HydrophobicContact CB-CG 4.04Å; N2600-L2631 WeakPolarHBondContact O-CD1 3.36Å; Y2607-L2631 HydrophobicContact CD1-CD2 4.09Å; Y2607-L2631 HydrophobicContact CE1-CD2 3.57Å; Y2607-L2631 HydrophobicContact CE2-CB 4.48Å; Y2607-L2631 HydrophobicContact CE2-CD2 4.16Å; Y2607-L2631 WeakPolarHBondContact CE2-O 3.2Å; D2629-L2631 PolarHBondContact O-N 3.03Å; L2631-T2641 HydrophobicContact CD1-CG2 3.49Å; L2631-T2641 VanDerWaalsContact CD1-CG2 3.49Å
2632	V	72.9	Confident	77.9	Confident	76 Å²	76	60.9 Å²	60.9	46%	0.461	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	130.5	-179.3	-172.6	0	0	0	0	110.1	T2630 V2637	T2630-V2632 PolarHBondContact O-N 3.06Å; T2630-V2632 VanDerWaalsContact O-N 3.14Å; V2632-V2637 HydrophobicContact CG2-CG2 4.31Å
2633	V	72.8	Confident	77.4	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.012	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	113.6	177.2	-165.1	0	0	0	0	109.1	Y2607 H2610 L2611 K2614 D2635 Y2636	Y2607-V2633 HydrophobicContact CD2-CG2 4Å; Y2607-V2633 HydrophobicContact CE2-CG2 3.59Å; H2610-V2633 WeakPolarHBondContact CE1-CG1 3.41Å; L2611-V2633 HydrophobicContact CD2-CG2 4.04Å; K2614-V2633 HydrophobicContact CD-CG1 3.89Å; V2633-D2635 VanDerWaalsContact C-N 3.32Å; V2633-D2635 PolarHBondContact O-N 3.1Å; V2633-Y2636 PolarHBondContact N-O 2.98Å; V2633-Y2636 VanDerWaalsContact O-CB 3.29Å; V2633-Y2636 WeakPolarHBondContact O-CB 3.49Å; V2633-Y2636 PolarHBondContact O-N 3.37Å; V2633-Y2636 VanDerWaalsContact O-N 3.07Å
2634	Y	71.6	Confident	77.3	Confident	134 Å²	134	61 Å²	61	53%	0.525	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.3	53.2	-173.1	-47.7	-63.9	0	0	0	111.9	M2567 H2610 Y2636	M2567-Y2634 HydrophobicContact CE-CG 4.37Å; M2567-Y2634 HydrophobicContact SD-CD2 3.9Å; M2567-Y2634 HydrophobicContact SD-CG 4.28Å; H2610-Y2634 AromaticContact CE1-CD2 3.86Å; H2610-Y2634 AromaticContact NE2-CD2 3.4Å; H2610-Y2634 WeakPolarHBondContact NE2-CD2 3.24Å; H2610-Y2634 AromaticContact NE2-CE2 3.61Å; Y2634-Y2636 PolarHBondContact O-N 3.37Å
2635	D	75.4	Confident	77.4	Confident	151 Å²	151	60.2 Å²	60.2	81%	0.807	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	-1	-177.6	-48	-35.4	0	0	0	116.2	V2633 V2637	V2633-D2635 VanDerWaalsContact C-N 3.32Å; V2633-D2635 PolarHBondContact O-N 3.1Å; D2635-V2637 PolarHBondContact O-N 2.86Å
2636	Y	79.3	Confident	77.4	Confident	107 Å²	107	62.7 Å²	62.7	42%	0.42	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	117.9	174.5	-168	-89.6	0	0	0	111.1	V2633 Y2634 Y2638	V2633-Y2636 PolarHBondContact N-O 2.98Å; V2633-Y2636 VanDerWaalsContact O-CB 3.29Å; V2633-Y2636 WeakPolarHBondContact O-CB 3.49Å; V2633-Y2636 PolarHBondContact O-N 3.37Å; V2633-Y2636 VanDerWaalsContact O-N 3.07Å; Y2634-Y2636 PolarHBondContact O-N 3.37Å; Y2636-Y2638 HydrophobicContact CD1-CD1 4.29Å; Y2636-Y2638 AromaticContact CD1-CD2 3.76Å; Y2636-Y2638 HydrophobicContact CD1-CD2 3.76Å; Y2636-Y2638 HydrophobicContact CD1-CE1 4.09Å; Y2636-Y2638 AromaticContact CD1-CE2 3.55Å; Y2636-Y2638 HydrophobicContact CD1-CE2 3.55Å; Y2636-Y2638 HydrophobicContact CD1-CG 4.11Å; Y2636-Y2638 AromaticContact CD1-CZ 3.7Å; Y2636-Y2638 AromaticContact CE1-CD1 3.75Å; Y2636-Y2638 HydrophobicContact CE1-CD1 3.75Å; Y2636-Y2638 HydrophobicContact CE1-CD2 4.06Å; Y2636-Y2638 AromaticContact CE1-CE1 3.68Å; Y2636-Y2638 HydrophobicContact CE1-CE1 3.68Å; Y2636-Y2638 AromaticContact CE1-CE2 4Å; Y2636-Y2638 HydrophobicContact CE1-CE2 4Å; Y2636-Y2638 AromaticContact CE1-CG 3.92Å; Y2636-Y2638 HydrophobicContact CE1-CG 3.92Å; Y2636-Y2638 AromaticContact CE1-CZ 3.78Å
2637	V	79	Confident	77.7	Confident	69 Å²	69	66.5 Å²	66.5	42%	0.418	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	112.2	173.4	-178	0	0	0	0	109.2	V2632 D2635	V2632-V2637 HydrophobicContact CG2-CG2 4.31Å; D2635-V2637 PolarHBondContact O-N 2.86Å
2638	Y	79.5	Confident	78.1	Confident	7 Å²	7	62.5 Å²	62.5	3%	0.027	33%	0.332	C	S	.	.			trans	-61.3	157.5	179.5	-80.5	-87	0	0	0	113.4	E2606 Y2607 H2610 Y2636 T2641	E2606-Y2638 HydrophobicContact CB-CD1 4.13Å; E2606-Y2638 HydrophobicContact CB-CE1 3.66Å; E2606-Y2638 PolarHBondContact O-OH 3.17Å; Y2607-Y2638 AromaticContact CD2-CD2 3.68Å; Y2607-Y2638 HydrophobicContact CD2-CD2 3.68Å; Y2607-Y2638 AromaticContact CD2-CE2 3.74Å; Y2607-Y2638 HydrophobicContact CD2-CE2 3.74Å; Y2607-Y2638 HydrophobicContact CG-CD2 4.29Å; Y2607-Y2638 HydrophobicContact CG-CE2 4.43Å; H2610-Y2638 WeakPolarHBondContact CB-OH 3.35Å; H2610-Y2638 AromaticContact ND1-CE2 3.98Å; H2610-Y2638 AromaticContact ND1-CZ 3.88Å; H2610-Y2638 PolarHBondContact ND1-OH 3.02Å; Y2636-Y2638 HydrophobicContact CD1-CD1 4.29Å; Y2636-Y2638 AromaticContact CD1-CD2 3.76Å; Y2636-Y2638 HydrophobicContact CD1-CD2 3.76Å; Y2636-Y2638 HydrophobicContact CD1-CE1 4.09Å; Y2636-Y2638 AromaticContact CD1-CE2 3.55Å; Y2636-Y2638 HydrophobicContact CD1-CE2 3.55Å; Y2636-Y2638 HydrophobicContact CD1-CG 4.11Å; Y2636-Y2638 AromaticContact CD1-CZ 3.7Å; Y2636-Y2638 AromaticContact CE1-CD1 3.75Å; Y2636-Y2638 HydrophobicContact CE1-CD1 3.75Å; Y2636-Y2638 HydrophobicContact CE1-CD2 4.06Å; Y2636-Y2638 AromaticContact CE1-CE1 3.68Å; Y2636-Y2638 HydrophobicContact CE1-CE1 3.68Å; Y2636-Y2638 AromaticContact CE1-CE2 4Å; Y2636-Y2638 HydrophobicContact CE1-CE2 4Å; Y2636-Y2638 AromaticContact CE1-CG 3.92Å; Y2636-Y2638 HydrophobicContact CE1-CG 3.92Å; Y2636-Y2638 AromaticContact CE1-CZ 3.78Å; Y2638-T2641 VanDerWaalsContact O-CG2 3.26Å; Y2638-T2641 WeakPolarHBondContact O-CG2 3.25Å; Y2638-T2641 PolarHBondContact O-OG1 3.03Å
2639	A	76.4	Confident	78.6	Confident	44 Å²	44	56.7 Å²	56.7	36%	0.364	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	156.3	176	0	0	0	0	0	111.9	N2604 T2641 E2684	N2604-A2639 VanDerWaalsContact CG-O 3.27Å; N2604-A2639 PolarHBondContact ND2-O 3.22Å; N2604-A2639 PolarHBondContact OD1-O 2.96Å; N2604-A2639 VanDerWaalsContact OD1-O 3.13Å; A2639-T2641 WeakPolarHBondContact O-CG2 3.48Å; A2639-T2641 PolarHBondContact O-N 2.9Å; A2639-E2684 WeakPolarHBondContact CA-OE1 3.45Å; A2639-E2684 WeakPolarHBondContact CB-OE1 3.25Å
2640	E	70.9	Confident	79.9	Confident	33 Å²	33	54.9 Å²	54.9	15%	0.154	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.9	16.4	174.9	-50.5	-173.9	-164.6	0	0	114.5	L2603 E2684 V2688 R2691	L2603-E2640 WeakPolarHBondContact CD1-OE2 3.17Å; E2640-E2684 PolarHBondContact N-OE1 3.1Å; E2640-V2688 HydrophobicContact CG-CG2 3.74Å; E2640-R2691 VanDerWaalsContact CD-NH1 3.3Å; E2640-R2691 IonicContact OE1-CZ 2.6Å; E2640-R2691 VanDerWaalsContact OE1-CZ 3.26Å; E2640-R2691 IonicContact OE1-NH1 3.14Å; E2640-R2691 PolarHBondContact OE1-NH1 2.88Å; E2640-R2691 IonicContact OE1-NH2 3.94Å; E2640-R2691 PolarHBondContact OE1-NH2 2.86Å; E2640-R2691 IonicContact OE2-CZ 2.73Å; E2640-R2691 IonicContact OE2-NH1 3.91Å; E2640-R2691 PolarHBondContact OE2-NH1 3.29Å; E2640-R2691 IonicContact OE2-NH2 3.6Å
2641	T	71.8	Confident	81.1	Confident	15 Å²	15	55 Å²	55	9%	0.092	29%	0.293	C	S	.	.			trans	-90.8	-18.4	-178.8	56.7	0	0	0	0	114.7	L2631 Y2638 A2639 A2643	L2631-T2641 HydrophobicContact CD1-CG2 3.49Å; L2631-T2641 VanDerWaalsContact CD1-CG2 3.49Å; Y2638-T2641 VanDerWaalsContact O-CG2 3.26Å; Y2638-T2641 WeakPolarHBondContact O-CG2 3.25Å; Y2638-T2641 PolarHBondContact O-OG1 3.03Å; A2639-T2641 WeakPolarHBondContact O-CG2 3.48Å; A2639-T2641 PolarHBondContact O-N 2.9Å; T2641-A2643 PolarHBondContact O-N 3.27Å
2642	T	77.6	Confident	82.2	Confident	45 Å²	45	54 Å²	54	28%	0.276	29%	0.288	S	S	.	.	S	Bend	trans	-68.4	118.6	178.7	60.6	0	0	0	0	109.6	W2644 A2681	T2642-W2644 PolarHBondContact OG1-NE1 3.01Å; T2642-A2681 HydrophobicContact CG2-CB 4.48Å
2643	A	80.4	Confident	83	Confident	54 Å²	54	52.9 Å²	52.9	45%	0.446	28%	0.277	S	S	.	.			trans	-61.9	141.9	169.6	0	0	0	0	0	110.7	T2641 K2677	T2641-A2643 PolarHBondContact O-N 3.27Å; A2643-K2677 VanDerWaalsContact O-CE 3.22Å; A2643-K2677 WeakPolarHBondContact O-CE 3.47Å; A2643-K2677 PolarHBondContact O-NZ 2.85Å
2644	W	87.7	Confident	83.8	Confident	5 Å²	5	57.6 Å²	57.6	2%	0.019	30%	0.299	C	S	.	.			trans	-123.4	122.9	173.9	-78.7	78.9	0	0	0	109.1	T2642 E2648 I2649 F2652 L2670 K2677 A2681 F2685	T2642-W2644 PolarHBondContact OG1-NE1 3.01Å; W2644-E2648 WeakPolarHBondContact CA-OE2 3.35Å; W2644-E2648 HydrophobicContact CE3-CB 3.73Å; W2644-E2648 HydrophobicContact CZ3-CB 4.16Å; W2644-I2649 HydrophobicContact CB-CD1 3.97Å; W2644-I2649 HydrophobicContact CB-CG1 3.85Å; W2644-I2649 HydrophobicContact CE3-CG1 4.35Å; W2644-F2652 HydrophobicContact CH2-CD2 4.1Å; W2644-F2652 HydrophobicContact CH2-CG 4.5Å; W2644-F2652 HydrophobicContact CZ3-CB 3.94Å; W2644-F2652 HydrophobicContact CZ3-CD2 4.21Å; W2644-F2652 HydrophobicContact CZ3-CG 4.18Å; W2644-L2670 HydrophobicContact CH2-CD1 4.3Å; W2644-L2670 HydrophobicContact CZ3-CD1 4.32Å; W2644-K2677 HydrophobicContact CD2-CD 4.28Å; W2644-K2677 VanDerWaalsContact CE2-CE 3.45Å; W2644-K2677 HydrophobicContact CE3-CD 4.48Å; W2644-K2677 HydrophobicContact CH2-CB 4.12Å; W2644-K2677 HydrophobicContact CH2-CD 3.89Å; W2644-K2677 HydrophobicContact CH2-CG 3.83Å; W2644-K2677 HydrophobicContact CZ2-CD 3.65Å; W2644-K2677 HydrophobicContact CZ2-CG 4.15Å; W2644-K2677 HydrophobicContact CZ3-CD 4.29Å; W2644-K2677 HydrophobicContact CZ3-CG 4.04Å; W2644-A2681 HydrophobicContact CZ2-CB 4.1Å; W2644-A2681 WeakPolarHBondContact CZ2-O 3.41Å; W2644-F2685 AromaticContact CD1-CD2 3.9Å; W2644-F2685 HydrophobicContact CD2-CB 4.25Å; W2644-F2685 AromaticContact CD2-CD1 3.95Å; W2644-F2685 HydrophobicContact CD2-CD1 3.95Å; W2644-F2685 HydrophobicContact CD2-CD2 4.03Å; W2644-F2685 HydrophobicContact CD2-CE1 4.35Å; W2644-F2685 HydrophobicContact CD2-CE2 4.42Å; W2644-F2685 AromaticContact CD2-CG 3.8Å; W2644-F2685 HydrophobicContact CD2-CG 3.8Å; W2644-F2685 VanDerWaalsContact CE2-CB 3.49Å; W2644-F2685 AromaticContact CE2-CG 3.58Å; W2644-F2685 AromaticContact CE3-CD1 3.89Å; W2644-F2685 HydrophobicContact CE3-CD1 3.89Å; W2644-F2685 HydrophobicContact CE3-CE1 4.12Å; W2644-F2685 HydrophobicContact CE3-CG 4.23Å; W2644-F2685 HydrophobicContact CG-CD2 4.01Å; W2644-F2685 HydrophobicContact CG-CE2 4.22Å; W2644-F2685 HydrophobicContact CG-CG 4.28Å; W2644-F2685 HydrophobicContact CH2-CB 4.13Å; W2644-F2685 HydrophobicContact CH2-CD1 4.05Å; W2644-F2685 HydrophobicContact CH2-CG 4.3Å; W2644-F2685 HydrophobicContact CZ2-CB 3.44Å; W2644-F2685 VanDerWaalsContact CZ2-CB 3.44Å; W2644-F2685 HydrophobicContact CZ2-CD1 4.09Å; W2644-F2685 AromaticContact CZ2-CG 3.86Å; W2644-F2685 HydrophobicContact CZ2-CG 3.86Å; W2644-F2685 AromaticContact CZ3-CD1 3.95Å; W2644-F2685 HydrophobicContact CZ3-CD1 3.95Å; W2644-F2685 HydrophobicContact CZ3-CE1 4.44Å; W2644-F2685 HydrophobicContact CZ3-CG 4.47Å; W2644-F2685 AromaticContact NE1-CD2 3.94Å; W2644-F2685 AromaticContact NE1-CG 3.88Å
2645	T	89.6	Confident	84.8	Confident	75 Å²	75	51.4 Å²	51.4	46%	0.46	28%	0.276	S	S	.	.			trans	-80	164.6	176.9	74.3	0	0	0	0	111.7	E2647 E2648 I2649	T2645-E2647 VanDerWaalsContact C-N 3.31Å; T2645-E2647 PolarHBondContact O-N 2.82Å; T2645-E2648 PolarHBondContact N-OE2 2.68Å; T2645-E2648 PolarHBondContact O-N 3.25Å; T2645-E2648 WeakPolarHBondContact OG1-CG 3.46Å; T2645-E2648 PolarHBondContact OG1-N 3.43Å; T2645-I2649 VanDerWaalsContact O-CG1 3.3Å; T2645-I2649 WeakPolarHBondContact O-CG1 3.31Å; T2645-I2649 PolarHBondContact O-N 3.42Å
2646	T	88.6	Confident	85.5	Confident	58 Å²	58	44.8 Å²	44.8	36%	0.356	24%	0.241	S	C	.	.	H	α-helix	trans	-49.3	-50.9	172.9	-60.7	0	0	0	0	112.9	Y2403 I2649 V2650	Y2403-T2646 WeakPolarHBondContact CE1-OG1 3.02Å; Y2403-T2646 WeakPolarHBondContact OH-CA 3.49Å; Y2403-T2646 VanDerWaalsContact OH-CB 3.23Å; Y2403-T2646 WeakPolarHBondContact OH-CB 3.38Å; Y2403-T2646 VanDerWaalsContact OH-CG2 3.26Å; Y2403-T2646 WeakPolarHBondContact OH-CG2 3.5Å; Y2403-T2646 PolarHBondContact OH-OG1 2.74Å; T2646-I2649 PolarHBondContact O-N 3.28Å; T2646-V2650 WeakPolarHBondContact O-CG2 3.48Å; T2646-V2650 PolarHBondContact O-N 2.85Å
2647	E	92.1	Very high	85.9	Confident	81 Å²	81	40.8 Å²	40.8	38%	0.379	23%	0.23	S	C	.	.	H	α-helix	trans	-65.9	-41.6	-178.9	176.9	64.2	164.6	0	0	111.5	T2645 I2649 V2650 R2651 M2675	T2645-E2647 VanDerWaalsContact C-N 3.31Å; T2645-E2647 PolarHBondContact O-N 2.82Å; E2647-I2649 VanDerWaalsContact C-N 3.3Å; E2647-I2649 PolarHBondContact O-N 2.7Å; E2647-V2650 PolarHBondContact O-N 3.21Å; E2647-R2651 HydrophobicContact CG-CG 4.11Å; E2647-R2651 VanDerWaalsContact O-CB 3.26Å; E2647-R2651 WeakPolarHBondContact O-CB 3.3Å; E2647-R2651 WeakPolarHBondContact O-CG 3.07Å; E2647-R2651 PolarHBondContact O-N 3.19Å; E2647-R2651 IonicContact OE1-CZ 3.26Å; E2647-R2651 IonicContact OE1-NE 2.78Å; E2647-R2651 PolarHBondContact OE1-NE 2.87Å; E2647-R2651 IonicContact OE1-NH2 2.79Å; E2647-R2651 PolarHBondContact OE1-NH2 3.34Å; E2647-R2651 IonicContact OE2-NE 2.64Å; E2647-M2675 HydrophobicContact CG-SD 4.21Å
2648	E	93.2	Very high	86.3	Confident	12 Å²	12	42.5 Å²	42.5	6%	0.056	23%	0.234	C	C	.	.	H	α-helix	trans	-60.2	-39.4	175.4	-72.3	177.7	138.7	0	0	112.5	W2644 T2645 F2652 M2675 K2677	W2644-E2648 WeakPolarHBondContact CA-OE2 3.35Å; W2644-E2648 HydrophobicContact CE3-CB 3.73Å; W2644-E2648 HydrophobicContact CZ3-CB 4.16Å; T2645-E2648 PolarHBondContact N-OE2 2.68Å; T2645-E2648 PolarHBondContact O-N 3.25Å; T2645-E2648 WeakPolarHBondContact OG1-CG 3.46Å; T2645-E2648 PolarHBondContact OG1-N 3.43Å; E2648-F2652 WeakPolarHBondContact O-CB 3.32Å; E2648-F2652 PolarHBondContact O-N 3Å; E2648-M2675 HydrophobicContact CB-SD 4.13Å; E2648-M2675 HydrophobicContact CG-CB 3.92Å; E2648-M2675 HydrophobicContact CG-CG 3.53Å; E2648-M2675 HydrophobicContact CG-SD 3.48Å; E2648-M2675 WeakPolarHBondContact CG-SD 3.25Å; E2648-K2677 WeakPolarHBondContact OE1-CE 3.11Å; E2648-K2677 WeakPolarHBondContact OE1-CG 3.31Å; E2648-K2677 IonicContact OE1-NZ 2.71Å; E2648-K2677 PolarHBondContact OE1-NZ 3.06Å; E2648-K2677 VanDerWaalsContact OE2-CE 3.3Å; E2648-K2677 WeakPolarHBondContact OE2-CE 3.4Å; E2648-K2677 IonicContact OE2-NZ 2.71Å; E2648-K2677 PolarHBondContact OE2-NZ 3.35Å
2649	I	91.5	Very high	86.7	Confident	15 Å²	15	45.4 Å²	45.4	8%	0.077	25%	0.248	C	C	.	.	H	α-helix	trans	-69.6	-42.5	178.2	-65.5	170.1	0	0	0	110.7	Y2403 W2644 T2645 T2646 E2647 Q2653 F2685	Y2403-I2649 HydrophobicContact CD2-CD1 4.36Å; Y2403-I2649 HydrophobicContact CE2-CD1 3.73Å; W2644-I2649 HydrophobicContact CB-CD1 3.97Å; W2644-I2649 HydrophobicContact CB-CG1 3.85Å; W2644-I2649 HydrophobicContact CE3-CG1 4.35Å; T2645-I2649 VanDerWaalsContact O-CG1 3.3Å; T2645-I2649 WeakPolarHBondContact O-CG1 3.31Å; T2645-I2649 PolarHBondContact O-N 3.42Å; T2646-I2649 PolarHBondContact O-N 3.28Å; E2647-I2649 VanDerWaalsContact C-N 3.3Å; E2647-I2649 PolarHBondContact O-N 2.7Å; I2649-Q2653 VanDerWaalsContact O-CG 3.31Å; I2649-Q2653 WeakPolarHBondContact O-CG 3.33Å; I2649-Q2653 PolarHBondContact O-N 3.48Å; I2649-F2685 HydrophobicContact CB-CZ 4.46Å; I2649-F2685 HydrophobicContact CD1-CZ 4.2Å; I2649-F2685 HydrophobicContact CG1-CE1 4.15Å; I2649-F2685 HydrophobicContact CG1-CE2 4.47Å; I2649-F2685 HydrophobicContact CG1-CZ 3.72Å; I2649-F2685 HydrophobicContact CG2-CE1 4.45Å; I2649-F2685 HydrophobicContact CG2-CZ 4.17Å
2650	V	91.6	Very high	87.2	Confident	54 Å²	54	43.9 Å²	43.9	33%	0.327	24%	0.237	S	C	.	.	H	α-helix	trans	-63.2	-49.8	176.3	169.4	0	0	0	0	110.7	T2646 E2647 F2652 Q2653 Q2654	T2646-V2650 WeakPolarHBondContact O-CG2 3.48Å; T2646-V2650 PolarHBondContact O-N 2.85Å; E2647-V2650 PolarHBondContact O-N 3.21Å; V2650-F2652 PolarHBondContact O-N 2.94Å; V2650-Q2653 WeakPolarHBondContact O-CB 3.3Å; V2650-Q2653 PolarHBondContact O-N 3.15Å; V2650-Q2653 VanDerWaalsContact O-N 3.15Å; V2650-Q2654 WeakPolarHBondContact O-CG 3.43Å; V2650-Q2654 PolarHBondContact O-N 3.18Å
2651	R	91.7	Very high	88.1	Confident	97 Å²	97	49.6 Å²	49.6	37%	0.366	26%	0.257	S	S	.	.	H	α-helix	trans	-63.5	-40	178.8	-67.3	-82	-176	150	12.3	112.2	E2647 Q2653 Q2654 G2655 L2670 M2675	E2647-R2651 HydrophobicContact CG-CG 4.11Å; E2647-R2651 VanDerWaalsContact O-CB 3.26Å; E2647-R2651 WeakPolarHBondContact O-CB 3.3Å; E2647-R2651 WeakPolarHBondContact O-CG 3.07Å; E2647-R2651 PolarHBondContact O-N 3.19Å; E2647-R2651 IonicContact OE1-CZ 3.26Å; E2647-R2651 IonicContact OE1-NE 2.78Å; E2647-R2651 PolarHBondContact OE1-NE 2.87Å; E2647-R2651 IonicContact OE1-NH2 2.79Å; E2647-R2651 PolarHBondContact OE1-NH2 3.34Å; E2647-R2651 IonicContact OE2-NE 2.64Å; R2651-Q2653 PolarHBondContact O-N 2.93Å; R2651-Q2654 WeakPolarHBondContact O-CB 3.48Å; R2651-Q2654 PolarHBondContact O-N 2.96Å; R2651-G2655 PolarHBondContact O-N 3.11Å; R2651-L2670 HydrophobicContact CB-CD2 3.62Å; R2651-M2675 HydrophobicContact CB-CE 3.96Å; R2651-M2675 HydrophobicContact CB-SD 4.13Å; R2651-M2675 HydrophobicContact CG-CE 3.67Å; R2651-M2675 HydrophobicContact CG-SD 4.04Å
2652	F	93.3	Very high	89.1	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-41.7	172.6	174.1	-96.7	0	0	0	111.9	W2644 E2648 V2650 Q2654 G2655 L2656 V2666 L2670 C2682 F2685	W2644-F2652 HydrophobicContact CH2-CD2 4.1Å; W2644-F2652 HydrophobicContact CH2-CG 4.5Å; W2644-F2652 HydrophobicContact CZ3-CB 3.94Å; W2644-F2652 HydrophobicContact CZ3-CD2 4.21Å; W2644-F2652 HydrophobicContact CZ3-CG 4.18Å; E2648-F2652 WeakPolarHBondContact O-CB 3.32Å; E2648-F2652 PolarHBondContact O-N 3Å; V2650-F2652 PolarHBondContact O-N 2.94Å; F2652-Q2654 VanDerWaalsContact C-N 3.35Å; F2652-Q2654 PolarHBondContact O-N 3.06Å; F2652-G2655 PolarHBondContact O-N 3.14Å; F2652-L2656 HydrophobicContact CD1-CD1 3.93Å; F2652-L2656 HydrophobicContact CD1-CG 4.18Å; F2652-L2656 HydrophobicContact CE1-CD1 3.34Å; F2652-L2656 HydrophobicContact CE1-CD2 4.43Å; F2652-L2656 HydrophobicContact CE1-CG 3.86Å; F2652-L2656 HydrophobicContact CE2-CD2 4.39Å; F2652-L2656 HydrophobicContact CE2-CG 4.42Å; F2652-L2656 HydrophobicContact CZ-CD1 3.78Å; F2652-L2656 HydrophobicContact CZ-CD2 4.08Å; F2652-L2656 HydrophobicContact CZ-CG 3.99Å; F2652-L2656 WeakPolarHBondContact O-CB 3.37Å; F2652-L2656 WeakPolarHBondContact O-CG 3.46Å; F2652-L2656 PolarHBondContact O-N 3.3Å; F2652-V2666 HydrophobicContact CD2-CG1 3.79Å; F2652-V2666 HydrophobicContact CE2-CG1 4.25Å; F2652-L2670 HydrophobicContact CB-CD1 4.38Å; F2652-L2670 HydrophobicContact CD2-CD1 4.31Å; F2652-C2682 HydrophobicContact CE2-CB 4.18Å; F2652-C2682 WeakPolarHBondContact CE2-O 3.3Å; F2652-F2685 AromaticContact CD1-CD1 3.52Å; F2652-F2685 HydrophobicContact CD1-CD1 3.52Å; F2652-F2685 AromaticContact CD1-CE1 3.49Å; F2652-F2685 HydrophobicContact CD1-CE1 3.49Å; F2652-F2685 VanDerWaalsContact CD1-CE1 3.49Å; F2652-F2685 HydrophobicContact CD2-CD1 4.3Å; F2652-F2685 AromaticContact CE1-CD1 3.41Å; F2652-F2685 HydrophobicContact CE1-CD1 3.41Å; F2652-F2685 VanDerWaalsContact CE1-CD1 3.41Å; F2652-F2685 AromaticContact CE1-CE1 3.67Å; F2652-F2685 HydrophobicContact CE1-CE1 3.67Å; F2652-F2685 HydrophobicContact CE2-CD1 4.23Å; F2652-F2685 AromaticContact CG-CD1 3.96Å; F2652-F2685 HydrophobicContact CG-CD1 3.96Å; F2652-F2685 HydrophobicContact CG-CE1 4.15Å; F2652-F2685 AromaticContact CZ-CD1 3.79Å; F2652-F2685 HydrophobicContact CZ-CD1 3.79Å; F2652-F2685 HydrophobicContact CZ-CE1 4.49Å
2653	Q	89.7	Confident	89.9	Confident	52 Å²	52	52.1 Å²	52.1	24%	0.243	27%	0.267	C	S	.	.	H	α-helix	trans	-65.4	-35.6	174.4	-73.3	-176.9	47	0	0	112.8	I2649 V2650 R2651 L2656 A2657 Y2701	I2649-Q2653 VanDerWaalsContact O-CG 3.31Å; I2649-Q2653 WeakPolarHBondContact O-CG 3.33Å; I2649-Q2653 PolarHBondContact O-N 3.48Å; V2650-Q2653 WeakPolarHBondContact O-CB 3.3Å; V2650-Q2653 PolarHBondContact O-N 3.15Å; V2650-Q2653 VanDerWaalsContact O-N 3.15Å; R2651-Q2653 PolarHBondContact O-N 2.93Å; Q2653-L2656 PolarHBondContact O-N 3.06Å; Q2653-A2657 PolarHBondContact O-N 2.77Å; Q2653-Y2701 HydrophobicContact CB-CE1 4.5Å; Q2653-Y2701 HydrophobicContact CG-CE1 4.4Å; Q2653-Y2701 PolarHBondContact OE1-OH 3.42Å
2654	Q	89.6	Confident	90.6	Very high	101 Å²	101	56.2 Å²	56.2	47%	0.472	28%	0.276	S	S	.	.	H	α-helix	trans	-63.3	-47.8	171.5	-66.9	169.8	6.3	0	0	110.9	V2650 R2651 F2652 L2656 A2657 M2658	V2650-Q2654 WeakPolarHBondContact O-CG 3.43Å; V2650-Q2654 PolarHBondContact O-N 3.18Å; R2651-Q2654 WeakPolarHBondContact O-CB 3.48Å; R2651-Q2654 PolarHBondContact O-N 2.96Å; F2652-Q2654 VanDerWaalsContact C-N 3.35Å; F2652-Q2654 PolarHBondContact O-N 3.06Å; Q2654-L2656 PolarHBondContact O-N 3.22Å; Q2654-A2657 WeakPolarHBondContact O-CA 3.37Å; Q2654-A2657 VanDerWaalsContact O-CB 3.32Å; Q2654-A2657 WeakPolarHBondContact O-CB 3.44Å; Q2654-A2657 PolarHBondContact O-N 3.08Å; Q2654-M2658 WeakPolarHBondContact O-CG 3.29Å; Q2654-M2658 PolarHBondContact O-N 3.43Å
2655	G	91.8	Very high	90.9	Very high	4 Å²	4	59 Å²	59	4%	0.041	29%	0.289	C	S	.	.	H	α-helix	trans	-59.5	-41.2	174.2	0	0	0	0	0	113.2	R2651 F2652 A2657 M2658 H2659 G2660 V2666	R2651-G2655 PolarHBondContact O-N 3.11Å; F2652-G2655 PolarHBondContact O-N 3.14Å; G2655-A2657 PolarHBondContact O-N 2.64Å; G2655-M2658 PolarHBondContact O-N 2.84Å; G2655-H2659 PolarHBondContact O-N 3.08Å; G2655-G2660 PolarHBondContact O-N 3.19Å; G2655-G2660 VanDerWaalsContact O-N 3.16Å; G2655-V2666 VanDerWaalsContact C-CG2 3.49Å; G2655-V2666 WeakPolarHBondContact O-CG2 3.36Å
2656	L	90.5	Very high	91.1	Very high	13 Å²	13	55.4 Å²	55.4	7%	0.068	27%	0.268	C	S	.	.	H	α-helix	trans	-65.1	-22.9	171	-70.5	-172	0	0	0	113.2	F2652 Q2653 Q2654 G2660 F2663 Y2686 W2689	F2652-L2656 HydrophobicContact CD1-CD1 3.93Å; F2652-L2656 HydrophobicContact CD1-CG 4.18Å; F2652-L2656 HydrophobicContact CE1-CD1 3.34Å; F2652-L2656 HydrophobicContact CE1-CD2 4.43Å; F2652-L2656 HydrophobicContact CE1-CG 3.86Å; F2652-L2656 HydrophobicContact CE2-CD2 4.39Å; F2652-L2656 HydrophobicContact CE2-CG 4.42Å; F2652-L2656 HydrophobicContact CZ-CD1 3.78Å; F2652-L2656 HydrophobicContact CZ-CD2 4.08Å; F2652-L2656 HydrophobicContact CZ-CG 3.99Å; F2652-L2656 WeakPolarHBondContact O-CB 3.37Å; F2652-L2656 WeakPolarHBondContact O-CG 3.46Å; F2652-L2656 PolarHBondContact O-N 3.3Å; Q2653-L2656 PolarHBondContact O-N 3.06Å; Q2654-L2656 PolarHBondContact O-N 3.22Å; L2656-G2660 WeakPolarHBondContact CD2-O 3.18Å; L2656-G2660 VanDerWaalsContact O-CA 3.25Å; L2656-G2660 WeakPolarHBondContact O-CA 3.37Å; L2656-F2663 HydrophobicContact CD2-CE1 4.16Å; L2656-Y2686 HydrophobicContact CD1-CD2 4.34Å; L2656-Y2686 HydrophobicContact CD2-CD2 4.25Å; L2656-W2689 HydrophobicContact CD1-CD2 4.38Å; L2656-W2689 HydrophobicContact CD1-CE3 4.19Å; L2656-W2689 HydrophobicContact CD1-CH2 4.35Å; L2656-W2689 HydrophobicContact CD1-CZ3 4.17Å
2657	A	86.8	Confident	91.4	Very high	22 Å²	22	52.8 Å²	52.8	18%	0.182	25%	0.252	C	S	.	.	H	α-helix	trans	-79.8	-40.3	174.1	0	0	0	0	0	111.9	Q2653 Q2654 G2655 A2705	Q2653-A2657 PolarHBondContact O-N 2.77Å; Q2654-A2657 WeakPolarHBondContact O-CA 3.37Å; Q2654-A2657 VanDerWaalsContact O-CB 3.32Å; Q2654-A2657 WeakPolarHBondContact O-CB 3.44Å; Q2654-A2657 PolarHBondContact O-N 3.08Å; G2655-A2657 PolarHBondContact O-N 2.64Å; A2657-A2705 VanDerWaalsContact O-CA 3.28Å; A2657-A2705 WeakPolarHBondContact O-CA 3.31Å; A2657-A2705 WeakPolarHBondContact O-CB 3.47Å
2658	M	87.9	Confident	91.5	Very high	105 Å²	105	55.2 Å²	55.2	52%	0.517	26%	0.261	S	S	.	.	H	α-helix	trans	-79.4	-70.9	179.4	-58.9	-60.5	-82	0	0	111.2	Q2654 G2655 R2709	Q2654-M2658 WeakPolarHBondContact O-CG 3.29Å; Q2654-M2658 PolarHBondContact O-N 3.43Å; G2655-M2658 PolarHBondContact O-N 2.84Å; M2658-R2709 VanDerWaalsContact O-CG 3.32Å; M2658-R2709 WeakPolarHBondContact O-CG 3.26Å; M2658-R2709 PolarHBondContact O-NE 2.95Å; M2658-R2709 VanDerWaalsContact O-NE 3.09Å
2659	H	89	Confident	91.5	Very high	68 Å²	68	57 Å²	57	32%	0.315	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-19.6	-170.8	-52.1	-70.9	0	0	0	112.6	G2655 R2661 D2662 Q2665 V2666 D2669 R2709	G2655-H2659 PolarHBondContact O-N 3.08Å; H2659-R2661 PolarHBondContact O-N 3.33Å; H2659-D2662 HydrophobicContact CB-CB 4.41Å; H2659-Q2665 HydrophobicContact CB-CB 4.12Å; H2659-Q2665 HydrophobicContact CB-CG 4.17Å; H2659-Q2665 VanDerWaalsContact CG-CG 3.45Å; H2659-Q2665 WeakPolarHBondContact ND1-CG 3.43Å; H2659-V2666 HydrophobicContact CB-CG2 4.11Å; H2659-D2669 IonicContact CD2-OD2 2.65Å; H2659-D2669 PolarHBondContact CD2-OD2 2.93Å; H2659-D2669 IonicContact CG-OD2 3.13Å; H2659-D2669 IonicContact NE2-OD2 3.66Å; H2659-R2709 PolarHBondContact O-NH2 3.4Å
2660	G	86.8	Confident	91.5	Very high	12 Å²	12	56.3 Å²	56.3	12%	0.124	27%	0.268	C	S	.	.	S	Bend	trans	84.5	-78.4	161.3	0	0	0	0	0	115.7	G2655 L2656	G2655-G2660 PolarHBondContact O-N 3.19Å; G2655-G2660 VanDerWaalsContact O-N 3.16Å; L2656-G2660 WeakPolarHBondContact CD2-O 3.18Å; L2656-G2660 VanDerWaalsContact O-CA 3.25Å; L2656-G2660 WeakPolarHBondContact O-CA 3.37Å
2661	R	88.8	Confident	91.6	Very high	153 Å²	153	58.7 Å²	58.7	58%	0.577	28%	0.275	S	S	*	.	S	Bend	trans	-140	22.7	174.7	-65.1	-165.1	-52.3	-76.8	-4.2	111.7	H2659 F2663 Y2686	H2659-R2661 PolarHBondContact O-N 3.33Å; R2661-F2663 HydrophobicContact CB-CE2 4.09Å; R2661-F2663 HydrophobicContact CB-CZ 4.13Å; R2661-F2663 HydrophobicContact CG-CZ 4.27Å; R2661-F2663 WeakPolarHBondContact O-CD2 3.44Å; R2661-F2663 PolarHBondContact O-N 3.15Å; R2661-Y2686 VanDerWaalsContact CD-OH 3.3Å; R2661-Y2686 WeakPolarHBondContact CD-OH 3.41Å; R2661-Y2686 HydrophobicContact CG-CE2 4.44Å
2662	D	92.6	Very high	91.6	Very high	83 Å²	83	58.3 Å²	58.3	44%	0.444	29%	0.292	S	S	.	.			trans	-87	93.2	163.9	-169.8	-32.6	0	0	0	107	H2659 H2664 Q2665 V2666	H2659-D2662 HydrophobicContact CB-CB 4.41Å; D2662-H2664 PolarHBondContact O-N 2.99Å; D2662-H2664 PolarHBondContact OD1-N 3.11Å; D2662-H2664 VanDerWaalsContact OD1-N 3.15Å; D2662-Q2665 HydrophobicContact CB-CB 4.47Å; D2662-Q2665 PolarHBondContact O-N 3.39Å; D2662-Q2665 PolarHBondContact OD1-N 3.41Å; D2662-Q2665 VanDerWaalsContact OD1-N 3.11Å; D2662-V2666 WeakPolarHBondContact O-CG2 3.3Å; D2662-V2666 PolarHBondContact O-N 3.35Å; D2662-V2666 VanDerWaalsContact O-N 3.11Å
2663	F	94.2	Very high	91.4	Very high	30 Å²	30	60 Å²	60	13%	0.132	31%	0.307	C	S	.	.	H	α-helix	trans	-75.9	-12.9	-176.2	-58.6	-73.3	0	0	0	112.6	L2656 R2661 S2667 V2679 C2682 V2683 Y2686	L2656-F2663 HydrophobicContact CD2-CE1 4.16Å; R2661-F2663 HydrophobicContact CB-CE2 4.09Å; R2661-F2663 HydrophobicContact CB-CZ 4.13Å; R2661-F2663 HydrophobicContact CG-CZ 4.27Å; R2661-F2663 WeakPolarHBondContact O-CD2 3.44Å; R2661-F2663 PolarHBondContact O-N 3.15Å; F2663-S2667 WeakPolarHBondContact O-CB 3.22Å; F2663-S2667 PolarHBondContact O-N 3.03Å; F2663-S2667 VanDerWaalsContact O-N 3.08Å; F2663-V2679 HydrophobicContact CB-CG1 3.94Å; F2663-C2682 HydrophobicContact CD1-CB 4.35Å; F2663-V2683 HydrophobicContact CB-CG2 3.83Å; F2663-V2683 HydrophobicContact CD1-CG2 4.26Å; F2663-V2683 HydrophobicContact CD2-CG2 3.6Å; F2663-V2683 HydrophobicContact CE2-CG2 4.2Å; F2663-V2683 HydrophobicContact CG-CG2 3.62Å; F2663-Y2686 HydrophobicContact CE1-CD1 4.26Å; F2663-Y2686 HydrophobicContact CE1-CD2 4.1Å; F2663-Y2686 AromaticContact CE1-CG 3.75Å; F2663-Y2686 HydrophobicContact CE1-CG 3.75Å; F2663-Y2686 AromaticContact CZ-CD1 3.66Å; F2663-Y2686 HydrophobicContact CZ-CD1 3.66Å; F2663-Y2686 HydrophobicContact CZ-CD2 4.03Å; F2663-Y2686 HydrophobicContact CZ-CE1 4.12Å; F2663-Y2686 HydrophobicContact CZ-CE2 4.47Å; F2663-Y2686 AromaticContact CZ-CG 3.6Å; F2663-Y2686 HydrophobicContact CZ-CG 3.6Å
2664	H	95.6	Very high	91.3	Very high	140 Å²	140	61 Å²	61	65%	0.648	33%	0.33	S	S	*	.	H	α-helix	trans	-72.4	-48.3	171.3	-68.5	-91.8	0	0	0	109.9	D2662 S2667 K2668	D2662-H2664 PolarHBondContact O-N 2.99Å; D2662-H2664 PolarHBondContact OD1-N 3.11Å; D2662-H2664 VanDerWaalsContact OD1-N 3.15Å; H2664-S2667 PolarHBondContact O-N 3.17Å; H2664-K2668 WeakPolarHBondContact O-CB 3.41Å; H2664-K2668 PolarHBondContact O-N 2.83Å
2665	Q	93.5	Very high	91.3	Very high	63 Å²	63	57 Å²	57	29%	0.294	31%	0.312	S	S	.	.	H	α-helix	trans	-66.7	-44.5	176.3	-169.5	57.4	47.8	0	0	111.8	H2659 D2662 S2667 K2668 D2669	H2659-Q2665 HydrophobicContact CB-CB 4.12Å; H2659-Q2665 HydrophobicContact CB-CG 4.17Å; H2659-Q2665 VanDerWaalsContact CG-CG 3.45Å; H2659-Q2665 WeakPolarHBondContact ND1-CG 3.43Å; D2662-Q2665 HydrophobicContact CB-CB 4.47Å; D2662-Q2665 PolarHBondContact O-N 3.39Å; D2662-Q2665 PolarHBondContact OD1-N 3.41Å; D2662-Q2665 VanDerWaalsContact OD1-N 3.11Å; Q2665-S2667 VanDerWaalsContact C-N 3.3Å; Q2665-S2667 PolarHBondContact O-N 3.32Å; Q2665-K2668 CarbonylContact O-C 3.54Å; Q2665-K2668 WeakPolarHBondContact O-CA 3.31Å; Q2665-K2668 WeakPolarHBondContact O-CB 3.34Å; Q2665-K2668 PolarHBondContact O-N 3.32Å; Q2665-D2669 PolarHBondContact NE2-OD1 3.21Å; Q2665-D2669 PolarHBondContact O-N 2.83Å; Q2665-D2669 VanDerWaalsContact O-OD2 3.1Å
2666	V	94.1	Very high	91.1	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-59.8	-38.2	176.9	175.8	0	0	0	0	112.5	F2652 G2655 H2659 D2662 D2669 L2670	F2652-V2666 HydrophobicContact CD2-CG1 3.79Å; F2652-V2666 HydrophobicContact CE2-CG1 4.25Å; G2655-V2666 VanDerWaalsContact C-CG2 3.49Å; G2655-V2666 WeakPolarHBondContact O-CG2 3.36Å; H2659-V2666 HydrophobicContact CB-CG2 4.11Å; D2662-V2666 WeakPolarHBondContact O-CG2 3.3Å; D2662-V2666 PolarHBondContact O-N 3.35Å; D2662-V2666 VanDerWaalsContact O-N 3.11Å; V2666-D2669 WeakPolarHBondContact CA-OD2 3.49Å; V2666-D2669 PolarHBondContact O-N 2.89Å; V2666-L2670 HydrophobicContact CG1-CD1 4.23Å; V2666-L2670 WeakPolarHBondContact O-CG 3.39Å; V2666-L2670 PolarHBondContact O-N 3.12Å; V2666-L2670 VanDerWaalsContact O-N 3.13Å
2667	S	94.8	Very high	91.1	Very high	3 Å²	3	63.5 Å²	63.5	2%	0.021	35%	0.345	C	S	.	.	H	α-helix	trans	-68.4	-36.3	174.5	-175.2	0	0	0	0	111.8	F2663 H2664 Q2665 Q2671 K2677 T2678 V2679	F2663-S2667 WeakPolarHBondContact O-CB 3.22Å; F2663-S2667 PolarHBondContact O-N 3.03Å; F2663-S2667 VanDerWaalsContact O-N 3.08Å; H2664-S2667 PolarHBondContact O-N 3.17Å; Q2665-S2667 VanDerWaalsContact C-N 3.3Å; Q2665-S2667 PolarHBondContact O-N 3.32Å; S2667-Q2671 WeakPolarHBondContact O-CB 3.39Å; S2667-Q2671 VanDerWaalsContact O-CG 3.24Å; S2667-Q2671 WeakPolarHBondContact O-CG 3.47Å; S2667-Q2671 PolarHBondContact O-N 3.2Å; S2667-Q2671 PolarHBondContact OG-NE2 2.88Å; S2667-K2677 PolarHBondContact OG-O 3.47Å; S2667-T2678 VanDerWaalsContact OG-C 3.29Å; S2667-V2679 PolarHBondContact OG-N 3.02Å
2668	K	93.8	Very high	91.4	Very high	132 Å²	132	66 Å²	66	57%	0.574	36%	0.358	S	S	*	.	H	α-helix	trans	-67.3	-38.2	173.7	-172.8	176.5	179.9	179.4	0	112.5	H2664 Q2665 Q2671 A2672	H2664-K2668 WeakPolarHBondContact O-CB 3.41Å; H2664-K2668 PolarHBondContact O-N 2.83Å; Q2665-K2668 CarbonylContact O-C 3.54Å; Q2665-K2668 WeakPolarHBondContact O-CA 3.31Å; Q2665-K2668 WeakPolarHBondContact O-CB 3.34Å; Q2665-K2668 PolarHBondContact O-N 3.32Å; K2668-Q2671 PolarHBondContact O-N 2.89Å; K2668-A2672 VanDerWaalsContact O-CB 3.25Å; K2668-A2672 WeakPolarHBondContact O-CB 3.34Å; K2668-A2672 PolarHBondContact O-N 3.39Å
2669	D	93.2	Very high	91.7	Very high	49 Å²	49	63.1 Å²	63.1	26%	0.262	35%	0.346	S	S	.	.	H	α-helix	trans	-64.9	-43.4	176.4	-54.5	-35.4	0	0	0	111	H2659 Q2665 V2666 A2672 A2673	H2659-D2669 IonicContact CD2-OD2 2.65Å; H2659-D2669 PolarHBondContact CD2-OD2 2.93Å; H2659-D2669 IonicContact CG-OD2 3.13Å; H2659-D2669 IonicContact NE2-OD2 3.66Å; Q2665-D2669 PolarHBondContact NE2-OD1 3.21Å; Q2665-D2669 PolarHBondContact O-N 2.83Å; Q2665-D2669 VanDerWaalsContact O-OD2 3.1Å; V2666-D2669 WeakPolarHBondContact CA-OD2 3.49Å; V2666-D2669 PolarHBondContact O-N 2.89Å; D2669-A2672 PolarHBondContact O-N 2.84Å; D2669-A2673 PolarHBondContact O-N 2.79Å; D2669-A2673 VanDerWaalsContact O-N 3.09Å
2670	L	93.4	Very high	91.9	Very high	2 Å²	2	65.9 Å²	65.9	1%	0.01	36%	0.358	C	S	.	.	H	α-helix	trans	-61.6	-47.4	174.4	-74.5	163.9	0	0	0	111.1	W2644 R2651 F2652 V2666 A2672 A2673 G2674 M2675 K2677	W2644-L2670 HydrophobicContact CH2-CD1 4.3Å; W2644-L2670 HydrophobicContact CZ3-CD1 4.32Å; R2651-L2670 HydrophobicContact CB-CD2 3.62Å; F2652-L2670 HydrophobicContact CB-CD1 4.38Å; F2652-L2670 HydrophobicContact CD2-CD1 4.31Å; V2666-L2670 HydrophobicContact CG1-CD1 4.23Å; V2666-L2670 WeakPolarHBondContact O-CG 3.39Å; V2666-L2670 PolarHBondContact O-N 3.12Å; V2666-L2670 VanDerWaalsContact O-N 3.13Å; L2670-A2672 PolarHBondContact O-N 3Å; L2670-A2673 CarbonylContact O-C 3.58Å; L2670-A2673 PolarHBondContact O-N 2.78Å; L2670-A2673 VanDerWaalsContact O-N 3.17Å; L2670-G2674 PolarHBondContact O-N 3.07Å; L2670-M2675 CarbonylContact C-O 3.58Å; L2670-M2675 HydrophobicContact CB-CB 4.3Å; L2670-M2675 HydrophobicContact CD2-CB 4.42Å; L2670-M2675 HydrophobicContact CD2-CE 4.04Å; L2670-M2675 HydrophobicContact CD2-SD 3.75Å; L2670-M2675 WeakPolarHBondContact O-CB 3.24Å; L2670-M2675 PolarHBondContact O-N 3.36Å; L2670-K2677 HydrophobicContact CD1-CB 4.07Å
2671	Q	93.5	Very high	92.1	Very high	103 Å²	103	65.6 Å²	65.6	48%	0.481	35%	0.354	S	S	.	.	H	α-helix	trans	-64.7	-39	177.9	-72.1	163.5	24.2	0	0	112.5	S2667 K2668 A2673 G2674 M2675 K2677	S2667-Q2671 WeakPolarHBondContact O-CB 3.39Å; S2667-Q2671 VanDerWaalsContact O-CG 3.24Å; S2667-Q2671 WeakPolarHBondContact O-CG 3.47Å; S2667-Q2671 PolarHBondContact O-N 3.2Å; S2667-Q2671 PolarHBondContact OG-NE2 2.88Å; K2668-Q2671 PolarHBondContact O-N 2.89Å; Q2671-A2673 PolarHBondContact O-N 2.73Å; Q2671-G2674 PolarHBondContact O-N 3.29Å; Q2671-M2675 WeakPolarHBondContact CA-O 3.45Å; Q2671-M2675 PolarHBondContact N-O 3.44Å; Q2671-K2677 PolarHBondContact NE2-O 2.86Å
2672	A	90.4	Very high	92.3	Very high	89 Å²	89	58.3 Å²	58.3	74%	0.736	33%	0.326	S	S	*	.	H	α-helix	trans	-65.5	-26.2	175.2	0	0	0	0	0	113	K2668 D2669 L2670	K2668-A2672 VanDerWaalsContact O-CB 3.25Å; K2668-A2672 WeakPolarHBondContact O-CB 3.34Å; K2668-A2672 PolarHBondContact O-N 3.39Å; D2669-A2672 PolarHBondContact O-N 2.84Å; L2670-A2672 PolarHBondContact O-N 3Å
2673	A	89.9	Confident	92.3	Very high	37 Å²	37	56.8 Å²	56.8	31%	0.306	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	20.4	171.8	0	0	0	0	0	113.2	D2669 L2670 Q2671 M2675	D2669-A2673 PolarHBondContact O-N 2.79Å; D2669-A2673 VanDerWaalsContact O-N 3.09Å; L2670-A2673 CarbonylContact O-C 3.58Å; L2670-A2673 PolarHBondContact O-N 2.78Å; L2670-A2673 VanDerWaalsContact O-N 3.17Å; Q2671-A2673 PolarHBondContact O-N 2.73Å; A2673-M2675 HydrophobicContact CB-CE 3.29Å; A2673-M2675 VanDerWaalsContact O-CE 3.31Å; A2673-M2675 WeakPolarHBondContact O-CE 3.45Å
2674	G	87.4	Confident	92.1	Very high	71 Å²	71	56.9 Å²	56.9	73%	0.732	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.2	1.1	170.5	0	0	0	0	0	116.3	L2670 Q2671	L2670-G2674 PolarHBondContact O-N 3.07Å; Q2671-G2674 PolarHBondContact O-N 3.29Å
2675	M	88.8	Confident	91.9	Very high	19 Å²	19	50.8 Å²	50.8	9%	0.094	29%	0.292	C	S	.	.			trans	-97.8	119.6	-176.3	-65.1	155.4	-83.1	0	0	111.3	E2647 E2648 R2651 L2670 Q2671 A2673 K2677	E2647-M2675 HydrophobicContact CG-SD 4.21Å; E2648-M2675 HydrophobicContact CB-SD 4.13Å; E2648-M2675 HydrophobicContact CG-CB 3.92Å; E2648-M2675 HydrophobicContact CG-CG 3.53Å; E2648-M2675 HydrophobicContact CG-SD 3.48Å; E2648-M2675 WeakPolarHBondContact CG-SD 3.25Å; R2651-M2675 HydrophobicContact CB-CE 3.96Å; R2651-M2675 HydrophobicContact CB-SD 4.13Å; R2651-M2675 HydrophobicContact CG-CE 3.67Å; R2651-M2675 HydrophobicContact CG-SD 4.04Å; L2670-M2675 CarbonylContact C-O 3.58Å; L2670-M2675 HydrophobicContact CB-CB 4.3Å; L2670-M2675 HydrophobicContact CD2-CB 4.42Å; L2670-M2675 HydrophobicContact CD2-CE 4.04Å; L2670-M2675 HydrophobicContact CD2-SD 3.75Å; L2670-M2675 WeakPolarHBondContact O-CB 3.24Å; L2670-M2675 PolarHBondContact O-N 3.36Å; Q2671-M2675 WeakPolarHBondContact CA-O 3.45Å; Q2671-M2675 PolarHBondContact N-O 3.44Å; A2673-M2675 HydrophobicContact CB-CE 3.29Å; A2673-M2675 VanDerWaalsContact O-CE 3.31Å; A2673-M2675 WeakPolarHBondContact O-CE 3.45Å; M2675-K2677 PolarHBondContact O-N 2.93Å
2676	N	87.3	Confident	91.8	Very high	134 Å²	134	48.7 Å²	48.7	72%	0.717	28%	0.282	S	S	*	.			trans	-76.3	30	-172.4	66.5	1.8	0	0	0	115.2	T2678	N2676-T2678 PolarHBondContact O-N 3.31Å
2677	K	91.4	Very high	91.6	Very high	19 Å²	19	54.8 Å²	54.8	8%	0.083	31%	0.306	C	S	.	.			trans	-76.6	121.4	-177.8	-69.8	-66.9	-169.2	-81.3	0	111.8	A2643 W2644 E2648 S2667 L2670 Q2671 M2675 A2681	A2643-K2677 VanDerWaalsContact O-CE 3.22Å; A2643-K2677 WeakPolarHBondContact O-CE 3.47Å; A2643-K2677 PolarHBondContact O-NZ 2.85Å; W2644-K2677 HydrophobicContact CD2-CD 4.28Å; W2644-K2677 VanDerWaalsContact CE2-CE 3.45Å; W2644-K2677 HydrophobicContact CE3-CD 4.48Å; W2644-K2677 HydrophobicContact CH2-CB 4.12Å; W2644-K2677 HydrophobicContact CH2-CD 3.89Å; W2644-K2677 HydrophobicContact CH2-CG 3.83Å; W2644-K2677 HydrophobicContact CZ2-CD 3.65Å; W2644-K2677 HydrophobicContact CZ2-CG 4.15Å; W2644-K2677 HydrophobicContact CZ3-CD 4.29Å; W2644-K2677 HydrophobicContact CZ3-CG 4.04Å; E2648-K2677 WeakPolarHBondContact OE1-CE 3.11Å; E2648-K2677 WeakPolarHBondContact OE1-CG 3.31Å; E2648-K2677 IonicContact OE1-NZ 2.71Å; E2648-K2677 PolarHBondContact OE1-NZ 3.06Å; E2648-K2677 VanDerWaalsContact OE2-CE 3.3Å; E2648-K2677 WeakPolarHBondContact OE2-CE 3.4Å; E2648-K2677 IonicContact OE2-NZ 2.71Å; E2648-K2677 PolarHBondContact OE2-NZ 3.35Å; S2667-K2677 PolarHBondContact OG-O 3.47Å; L2670-K2677 HydrophobicContact CD1-CB 4.07Å; Q2671-K2677 PolarHBondContact NE2-O 2.86Å; M2675-K2677 PolarHBondContact O-N 2.93Å; K2677-A2681 HydrophobicContact CD-CB 4.18Å
2678	T	92.6	Very high	91.1	Very high	74 Å²	74	54.9 Å²	54.9	45%	0.454	31%	0.306	S	S	.	.			trans	-79.5	163.7	179	65.4	0	0	0	0	112.4	S2667 N2676 K2680 A2681 C2682	S2667-T2678 VanDerWaalsContact OG-C 3.29Å; N2676-T2678 PolarHBondContact O-N 3.31Å; T2678-K2680 PolarHBondContact O-N 3.19Å; T2678-A2681 PolarHBondContact O-N 3.19Å; T2678-A2681 VanDerWaalsContact O-N 3.14Å; T2678-A2681 PolarHBondContact OG1-N 2.76Å; T2678-C2682 PolarHBondContact O-N 3.21Å; T2678-C2682 PolarHBondContact O-SG 2.82Å
2679	V	94.2	Very high	90.8	Very high	45 Å²	45	49.3 Å²	49.3	27%	0.273	28%	0.282	S	S	.	.	H	α-helix	trans	-58.6	-35.9	174.1	-175.3	0	0	0	0	111.5	F2663 S2667 C2682 V2683	F2663-V2679 HydrophobicContact CB-CG1 3.94Å; S2667-V2679 PolarHBondContact OG-N 3.02Å; V2679-C2682 PolarHBondContact O-N 3.3Å; V2679-V2683 HydrophobicContact CG1-CG2 4.37Å; V2679-V2683 VanDerWaalsContact O-CG2 3.31Å; V2679-V2683 WeakPolarHBondContact O-CG2 3.35Å; V2679-V2683 PolarHBondContact O-N 3.26Å
2680	K	92.8	Very high	90.4	Very high	126 Å²	126	50.7 Å²	50.7	55%	0.548	29%	0.285	S	S	.	.	H	α-helix	trans	-55.5	-57.6	172.1	-179.5	-165.9	169.3	-169	0	110.1	T2678 C2682 V2683 E2684	T2678-K2680 PolarHBondContact O-N 3.19Å; K2680-C2682 VanDerWaalsContact C-N 3.3Å; K2680-C2682 PolarHBondContact O-N 2.69Å; K2680-V2683 PolarHBondContact O-N 3.02Å; K2680-E2684 VanDerWaalsContact O-CB 3.25Å; K2680-E2684 WeakPolarHBondContact O-CB 3.19Å; K2680-E2684 PolarHBondContact O-N 3.16Å
2681	A	91.1	Very high	89.9	Confident	5 Å²	5	56.8 Å²	56.8	4%	0.041	31%	0.308	C	S	.	.	H	α-helix	trans	-59.3	-39.9	-178.9	0	0	0	0	0	111.9	T2642 W2644 K2677 T2678 E2684 F2685	T2642-A2681 HydrophobicContact CG2-CB 4.48Å; W2644-A2681 HydrophobicContact CZ2-CB 4.1Å; W2644-A2681 WeakPolarHBondContact CZ2-O 3.41Å; K2677-A2681 HydrophobicContact CD-CB 4.18Å; T2678-A2681 PolarHBondContact O-N 3.19Å; T2678-A2681 VanDerWaalsContact O-N 3.14Å; T2678-A2681 PolarHBondContact OG1-N 2.76Å; A2681-E2684 PolarHBondContact O-N 2.97Å; A2681-F2685 VanDerWaalsContact O-CB 3.3Å; A2681-F2685 WeakPolarHBondContact O-CB 3.31Å; A2681-F2685 PolarHBondContact O-N 2.69Å
2682	C	93.3	Very high	88.9	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-64.4	-40.9	177.7	-64.7	0	0	0	0	112.9	F2652 F2663 T2678 V2679 K2680 Y2686	F2652-C2682 HydrophobicContact CE2-CB 4.18Å; F2652-C2682 WeakPolarHBondContact CE2-O 3.3Å; F2663-C2682 HydrophobicContact CD1-CB 4.35Å; T2678-C2682 PolarHBondContact O-N 3.21Å; T2678-C2682 PolarHBondContact O-SG 2.82Å; V2679-C2682 PolarHBondContact O-N 3.3Å; K2680-C2682 VanDerWaalsContact C-N 3.3Å; K2680-C2682 PolarHBondContact O-N 2.69Å; C2682-Y2686 VanDerWaalsContact O-CB 3.29Å; C2682-Y2686 WeakPolarHBondContact O-CB 3.13Å; C2682-Y2686 PolarHBondContact O-N 2.92Å
2683	V	93.5	Very high	88.4	Confident	51 Å²	51	54.4 Å²	54.4	31%	0.309	28%	0.284	S	S	.	.	H	α-helix	trans	-68.8	-41.5	176.3	170.4	0	0	0	0	111	F2663 V2679 K2680 Y2686 Y2687	F2663-V2683 HydrophobicContact CB-CG2 3.83Å; F2663-V2683 HydrophobicContact CD1-CG2 4.26Å; F2663-V2683 HydrophobicContact CD2-CG2 3.6Å; F2663-V2683 HydrophobicContact CE2-CG2 4.2Å; F2663-V2683 HydrophobicContact CG-CG2 3.62Å; V2679-V2683 HydrophobicContact CG1-CG2 4.37Å; V2679-V2683 VanDerWaalsContact O-CG2 3.31Å; V2679-V2683 WeakPolarHBondContact O-CG2 3.35Å; V2679-V2683 PolarHBondContact O-N 3.26Å; K2680-V2683 PolarHBondContact O-N 3.02Å; V2683-Y2686 WeakPolarHBondContact O-CB 3.47Å; V2683-Y2686 PolarHBondContact O-N 3Å; V2683-Y2687 HydrophobicContact CG1-CD2 4.27Å; V2683-Y2687 HydrophobicContact CG1-CE2 3.98Å; V2683-Y2687 WeakPolarHBondContact O-CD2 3.39Å; V2683-Y2687 PolarHBondContact O-N 2.79Å
2684	E	90	Very high	87.7	Confident	32 Å²	32	55.6 Å²	55.6	15%	0.15	29%	0.288	C	S	.	.	H	α-helix	trans	-62	-56.1	177.6	177	160.5	-152.6	0	0	111.5	A2639 E2640 K2680 A2681 Y2686 Y2687 V2688	A2639-E2684 WeakPolarHBondContact CA-OE1 3.45Å; A2639-E2684 WeakPolarHBondContact CB-OE1 3.25Å; E2640-E2684 PolarHBondContact N-OE1 3.1Å; K2680-E2684 VanDerWaalsContact O-CB 3.25Å; K2680-E2684 WeakPolarHBondContact O-CB 3.19Å; K2680-E2684 PolarHBondContact O-N 3.16Å; A2681-E2684 PolarHBondContact O-N 2.97Å; E2684-Y2686 VanDerWaalsContact C-N 3.29Å; E2684-Y2686 PolarHBondContact O-N 3.13Å; E2684-Y2687 PolarHBondContact O-N 3.46Å; E2684-V2688 PolarHBondContact O-N 3.12Å
2685	F	90.3	Very high	87.2	Confident	12 Å²	12	57.5 Å²	57.5	5%	0.053	29%	0.287	C	S	.	.	H	α-helix	trans	-60.5	-35.4	176.2	-174.7	-115.1	0	0	0	112.5	F2401 W2644 I2649 F2652 A2681 Y2687 V2688 W2689	F2401-F2685 HydrophobicContact CD1-CE2 4.12Å; F2401-F2685 HydrophobicContact CE1-CD2 4.17Å; F2401-F2685 HydrophobicContact CE1-CE2 4.11Å; W2644-F2685 AromaticContact CD1-CD2 3.9Å; W2644-F2685 HydrophobicContact CD2-CB 4.25Å; W2644-F2685 AromaticContact CD2-CD1 3.95Å; W2644-F2685 HydrophobicContact CD2-CD1 3.95Å; W2644-F2685 HydrophobicContact CD2-CD2 4.03Å; W2644-F2685 HydrophobicContact CD2-CE1 4.35Å; W2644-F2685 HydrophobicContact CD2-CE2 4.42Å; W2644-F2685 AromaticContact CD2-CG 3.8Å; W2644-F2685 HydrophobicContact CD2-CG 3.8Å; W2644-F2685 VanDerWaalsContact CE2-CB 3.49Å; W2644-F2685 AromaticContact CE2-CG 3.58Å; W2644-F2685 AromaticContact CE3-CD1 3.89Å; W2644-F2685 HydrophobicContact CE3-CD1 3.89Å; W2644-F2685 HydrophobicContact CE3-CE1 4.12Å; W2644-F2685 HydrophobicContact CE3-CG 4.23Å; W2644-F2685 HydrophobicContact CG-CD2 4.01Å; W2644-F2685 HydrophobicContact CG-CE2 4.22Å; W2644-F2685 HydrophobicContact CG-CG 4.28Å; W2644-F2685 HydrophobicContact CH2-CB 4.13Å; W2644-F2685 HydrophobicContact CH2-CD1 4.05Å; W2644-F2685 HydrophobicContact CH2-CG 4.3Å; W2644-F2685 HydrophobicContact CZ2-CB 3.44Å; W2644-F2685 VanDerWaalsContact CZ2-CB 3.44Å; W2644-F2685 HydrophobicContact CZ2-CD1 4.09Å; W2644-F2685 AromaticContact CZ2-CG 3.86Å; W2644-F2685 HydrophobicContact CZ2-CG 3.86Å; W2644-F2685 AromaticContact CZ3-CD1 3.95Å; W2644-F2685 HydrophobicContact CZ3-CD1 3.95Å; W2644-F2685 HydrophobicContact CZ3-CE1 4.44Å; W2644-F2685 HydrophobicContact CZ3-CG 4.47Å; W2644-F2685 AromaticContact NE1-CD2 3.94Å; W2644-F2685 AromaticContact NE1-CG 3.88Å; I2649-F2685 HydrophobicContact CB-CZ 4.46Å; I2649-F2685 HydrophobicContact CD1-CZ 4.2Å; I2649-F2685 HydrophobicContact CG1-CE1 4.15Å; I2649-F2685 HydrophobicContact CG1-CE2 4.47Å; I2649-F2685 HydrophobicContact CG1-CZ 3.72Å; I2649-F2685 HydrophobicContact CG2-CE1 4.45Å; I2649-F2685 HydrophobicContact CG2-CZ 4.17Å; F2652-F2685 AromaticContact CD1-CD1 3.52Å; F2652-F2685 HydrophobicContact CD1-CD1 3.52Å; F2652-F2685 AromaticContact CD1-CE1 3.49Å; F2652-F2685 HydrophobicContact CD1-CE1 3.49Å; F2652-F2685 VanDerWaalsContact CD1-CE1 3.49Å; F2652-F2685 HydrophobicContact CD2-CD1 4.3Å; F2652-F2685 AromaticContact CE1-CD1 3.41Å; F2652-F2685 HydrophobicContact CE1-CD1 3.41Å; F2652-F2685 VanDerWaalsContact CE1-CD1 3.41Å; F2652-F2685 AromaticContact CE1-CE1 3.67Å; F2652-F2685 HydrophobicContact CE1-CE1 3.67Å; F2652-F2685 HydrophobicContact CE2-CD1 4.23Å; F2652-F2685 AromaticContact CG-CD1 3.96Å; F2652-F2685 HydrophobicContact CG-CD1 3.96Å; F2652-F2685 HydrophobicContact CG-CE1 4.15Å; F2652-F2685 AromaticContact CZ-CD1 3.79Å; F2652-F2685 HydrophobicContact CZ-CD1 3.79Å; F2652-F2685 HydrophobicContact CZ-CE1 4.49Å; A2681-F2685 VanDerWaalsContact O-CB 3.3Å; A2681-F2685 WeakPolarHBondContact O-CB 3.31Å; A2681-F2685 PolarHBondContact O-N 2.69Å; F2685-Y2687 PolarHBondContact O-N 2.91Å; F2685-V2688 PolarHBondContact O-N 2.78Å; F2685-V2688 VanDerWaalsContact O-N 3.13Å; F2685-W2689 HydrophobicContact CE1-CB 4.46Å; F2685-W2689 HydrophobicContact CZ-CB 4.48Å; F2685-W2689 VanDerWaalsContact O-CB 3.24Å; F2685-W2689 WeakPolarHBondContact O-CB 3.49Å; F2685-W2689 PolarHBondContact O-N 2.89Å
2686	Y	91.5	Very high	86.3	Confident	19 Å²	19	60.4 Å²	60.4	8%	0.075	31%	0.31	C	S	.	.	H	α-helix	trans	-55.9	-35.5	171.5	170.2	-104.8	0	0	0	113	L2656 R2661 F2663 C2682 V2683 E2684 W2689 K2690	L2656-Y2686 HydrophobicContact CD1-CD2 4.34Å; L2656-Y2686 HydrophobicContact CD2-CD2 4.25Å; R2661-Y2686 VanDerWaalsContact CD-OH 3.3Å; R2661-Y2686 WeakPolarHBondContact CD-OH 3.41Å; R2661-Y2686 HydrophobicContact CG-CE2 4.44Å; F2663-Y2686 HydrophobicContact CE1-CD1 4.26Å; F2663-Y2686 HydrophobicContact CE1-CD2 4.1Å; F2663-Y2686 AromaticContact CE1-CG 3.75Å; F2663-Y2686 HydrophobicContact CE1-CG 3.75Å; F2663-Y2686 AromaticContact CZ-CD1 3.66Å; F2663-Y2686 HydrophobicContact CZ-CD1 3.66Å; F2663-Y2686 HydrophobicContact CZ-CD2 4.03Å; F2663-Y2686 HydrophobicContact CZ-CE1 4.12Å; F2663-Y2686 HydrophobicContact CZ-CE2 4.47Å; F2663-Y2686 AromaticContact CZ-CG 3.6Å; F2663-Y2686 HydrophobicContact CZ-CG 3.6Å; C2682-Y2686 VanDerWaalsContact O-CB 3.29Å; C2682-Y2686 WeakPolarHBondContact O-CB 3.13Å; C2682-Y2686 PolarHBondContact O-N 2.92Å; V2683-Y2686 WeakPolarHBondContact O-CB 3.47Å; V2683-Y2686 PolarHBondContact O-N 3Å; E2684-Y2686 VanDerWaalsContact C-N 3.29Å; E2684-Y2686 PolarHBondContact O-N 3.13Å; Y2686-W2689 HydrophobicContact CD2-CE3 4.21Å; Y2686-W2689 HydrophobicContact CD2-CZ3 4.4Å; Y2686-W2689 HydrophobicContact CE2-CE3 4.42Å; Y2686-W2689 HydrophobicContact CE2-CZ3 4.21Å; Y2686-K2690 HydrophobicContact CE1-CD 4.03Å; Y2686-K2690 HydrophobicContact CE2-CD 4.34Å; Y2686-K2690 WeakPolarHBondContact O-CB 3.39Å; Y2686-K2690 PolarHBondContact O-N 3.21Å; Y2686-K2690 VanDerWaalsContact O-N 3.13Å
2687	Y	89.6	Confident	85.7	Confident	128 Å²	128	56.6 Å²	56.6	50%	0.502	29%	0.289	S	S	.	.	H	α-helix	trans	-79.3	-31.1	176.9	-76.2	-72.1	0	0	0	113.3	V2683 E2684 F2685 K2690 R2691	V2683-Y2687 HydrophobicContact CG1-CD2 4.27Å; V2683-Y2687 HydrophobicContact CG1-CE2 3.98Å; V2683-Y2687 WeakPolarHBondContact O-CD2 3.39Å; V2683-Y2687 PolarHBondContact O-N 2.79Å; E2684-Y2687 PolarHBondContact O-N 3.46Å; F2685-Y2687 PolarHBondContact O-N 2.91Å; Y2687-K2690 VanDerWaalsContact CE1-NZ 3.35Å; Y2687-R2691 PolarHBondContact O-N 3.42Å
2688	V	85	Confident	85	Confident	5 Å²	5	55.9 Å²	55.9	3%	0.03	29%	0.286	C	S	.	.	H	α-helix	trans	-68.8	-54.1	171.6	-178.3	0	0	0	0	110.9	F2401 E2640 E2684 F2685 K2690 R2691 M2692	F2401-V2688 HydrophobicContact CE1-CG1 4.04Å; F2401-V2688 HydrophobicContact CZ-CG1 3.79Å; E2640-V2688 HydrophobicContact CG-CG2 3.74Å; E2684-V2688 PolarHBondContact O-N 3.12Å; F2685-V2688 PolarHBondContact O-N 2.78Å; F2685-V2688 VanDerWaalsContact O-N 3.13Å; V2688-K2690 VanDerWaalsContact C-N 3.27Å; V2688-K2690 PolarHBondContact O-N 3.3Å; V2688-R2691 WeakPolarHBondContact O-CA 3.29Å; V2688-R2691 WeakPolarHBondContact O-CB 3.36Å; V2688-R2691 PolarHBondContact O-N 3.47Å; V2688-M2692 HydrophobicContact CG1-CE 4.3Å; V2688-M2692 PolarHBondContact O-N 2.73Å
2689	W	86.6	Confident	84.4	Confident	16 Å²	16	58.7 Å²	58.7	6%	0.061	29%	0.292	C	S	.	.	H	α-helix	trans	-49.7	-47.8	173.2	174.4	84.5	0	0	0	111.6	L2656 F2685 Y2686 R2691 M2692 N2693 V2698 Y2701	L2656-W2689 HydrophobicContact CD1-CD2 4.38Å; L2656-W2689 HydrophobicContact CD1-CE3 4.19Å; L2656-W2689 HydrophobicContact CD1-CH2 4.35Å; L2656-W2689 HydrophobicContact CD1-CZ3 4.17Å; F2685-W2689 HydrophobicContact CE1-CB 4.46Å; F2685-W2689 HydrophobicContact CZ-CB 4.48Å; F2685-W2689 VanDerWaalsContact O-CB 3.24Å; F2685-W2689 WeakPolarHBondContact O-CB 3.49Å; F2685-W2689 PolarHBondContact O-N 2.89Å; Y2686-W2689 HydrophobicContact CD2-CE3 4.21Å; Y2686-W2689 HydrophobicContact CD2-CZ3 4.4Å; Y2686-W2689 HydrophobicContact CE2-CE3 4.42Å; Y2686-W2689 HydrophobicContact CE2-CZ3 4.21Å; W2689-R2691 PolarHBondContact O-N 3.05Å; W2689-M2692 PolarHBondContact O-N 2.91Å; W2689-M2692 VanDerWaalsContact O-N 3.17Å; W2689-N2693 PolarHBondContact NE1-OD1 3.02Å; W2689-N2693 VanDerWaalsContact NE1-OD1 3.07Å; W2689-N2693 PolarHBondContact O-N 3.31Å; W2689-N2693 PolarHBondContact O-OD1 3.47Å; W2689-N2693 VanDerWaalsContact O-OD1 3.04Å; W2689-V2698 HydrophobicContact CH2-CG1 4.22Å; W2689-V2698 HydrophobicContact CH2-CG2 4.32Å; W2689-V2698 HydrophobicContact CZ3-CG1 3.94Å; W2689-V2698 HydrophobicContact CZ3-CG2 4.25Å; W2689-Y2701 HydrophobicContact CH2-CD1 4.37Å; W2689-Y2701 HydrophobicContact CH2-CD2 4.27Å; W2689-Y2701 AromaticContact CH2-CG 3.98Å; W2689-Y2701 HydrophobicContact CH2-CG 3.98Å; W2689-Y2701 AromaticContact CZ2-CD1 3.92Å; W2689-Y2701 HydrophobicContact CZ2-CD1 3.92Å; W2689-Y2701 AromaticContact CZ2-CD2 3.81Å; W2689-Y2701 HydrophobicContact CZ2-CD2 3.81Å; W2689-Y2701 HydrophobicContact CZ2-CE1 4.13Å; W2689-Y2701 HydrophobicContact CZ2-CE2 4.05Å; W2689-Y2701 AromaticContact CZ2-CG 3.75Å; W2689-Y2701 HydrophobicContact CZ2-CG 3.75Å
2690	K	86.1	Confident	83.6	Confident	77 Å²	77	60.7 Å²	60.7	34%	0.335	30%	0.295	S	S	.	.	H	α-helix	trans	-69.9	-10	176.7	176.7	165.7	149	-87.1	0	114.9	Y2686 Y2687 V2688 V2698	Y2686-K2690 HydrophobicContact CE1-CD 4.03Å; Y2686-K2690 HydrophobicContact CE2-CD 4.34Å; Y2686-K2690 WeakPolarHBondContact O-CB 3.39Å; Y2686-K2690 PolarHBondContact O-N 3.21Å; Y2686-K2690 VanDerWaalsContact O-N 3.13Å; Y2687-K2690 VanDerWaalsContact CE1-NZ 3.35Å; V2688-K2690 VanDerWaalsContact C-N 3.27Å; V2688-K2690 PolarHBondContact O-N 3.3Å; K2690-V2698 HydrophobicContact CD-CG1 4.42Å; K2690-V2698 HydrophobicContact CG-CG1 4.32Å
2691	R	81.9	Confident	82.6	Confident	131 Å²	131	56.6 Å²	56.6	49%	0.494	28%	0.276	S	S	.	.	H	α-helix	trans	-86.8	-41	169.9	-172.3	-167.4	-61.3	151.6	2.9	110.6	E2640 Y2687 V2688 W2689	E2640-R2691 VanDerWaalsContact CD-NH1 3.3Å; E2640-R2691 IonicContact OE1-CZ 2.6Å; E2640-R2691 VanDerWaalsContact OE1-CZ 3.26Å; E2640-R2691 IonicContact OE1-NH1 3.14Å; E2640-R2691 PolarHBondContact OE1-NH1 2.88Å; E2640-R2691 IonicContact OE1-NH2 3.94Å; E2640-R2691 PolarHBondContact OE1-NH2 2.86Å; E2640-R2691 IonicContact OE2-CZ 2.73Å; E2640-R2691 IonicContact OE2-NH1 3.91Å; E2640-R2691 PolarHBondContact OE2-NH1 3.29Å; E2640-R2691 IonicContact OE2-NH2 3.6Å; Y2687-R2691 PolarHBondContact O-N 3.42Å; V2688-R2691 WeakPolarHBondContact O-CA 3.29Å; V2688-R2691 WeakPolarHBondContact O-CB 3.36Å; V2688-R2691 PolarHBondContact O-N 3.47Å; W2689-R2691 PolarHBondContact O-N 3.05Å
2692	M	74	Confident	81.9	Confident	101 Å²	101	61 Å²	61	50%	0.498	29%	0.292	S	S	.	.	H	α-helix	trans	-75.6	-48	-179.3	-53.7	-42.9	-161	0	0	112.3	V2688 W2689	V2688-M2692 HydrophobicContact CG1-CE 4.3Å; V2688-M2692 PolarHBondContact O-N 2.73Å; W2689-M2692 PolarHBondContact O-N 2.91Å; W2689-M2692 VanDerWaalsContact O-N 3.17Å
2693	N	79.1	Confident	81	Confident	40 Å²	40	64.1 Å²	64.1	21%	0.214	31%	0.307	C	S	.	.	S	Bend	trans	-71.9	139.9	178.7	-68.1	94.8	0	0	0	112	W2689 D2697 V2698	W2689-N2693 PolarHBondContact NE1-OD1 3.02Å; W2689-N2693 VanDerWaalsContact NE1-OD1 3.07Å; W2689-N2693 PolarHBondContact O-N 3.31Å; W2689-N2693 PolarHBondContact O-OD1 3.47Å; W2689-N2693 VanDerWaalsContact O-OD1 3.04Å; N2693-D2697 HydrophobicContact CB-CB 4.43Å; N2693-V2698 HydrophobicContact CB-CG2 3.68Å
2694	T	74.1	Confident	80.1	Confident	62 Å²	62	66 Å²	66	38%	0.38	31%	0.308	S	S	.	.			trans	-69.1	158.9	-177.3	84.1	0	0	0	0	111.5	S2696 D2697 V2698	T2694-S2696 PolarHBondContact O-N 3.23Å; T2694-S2696 VanDerWaalsContact OG1-CB 3.3Å; T2694-S2696 WeakPolarHBondContact OG1-CB 3.04Å; T2694-S2696 PolarHBondContact OG1-N 3.35Å; T2694-S2696 PolarHBondContact OG1-OG 3.34Å; T2694-D2697 WeakPolarHBondContact CA-OD2 3.48Å; T2694-D2697 WeakPolarHBondContact CB-OD2 3.26Å; T2694-D2697 VanDerWaalsContact CG2-OD2 3.28Å; T2694-D2697 WeakPolarHBondContact CG2-OD2 3.46Å; T2694-D2697 PolarHBondContact N-OD2 3.02Å; T2694-D2697 PolarHBondContact O-N 2.8Å; T2694-D2697 PolarHBondContact OG1-OD1 3.01Å; T2694-D2697 PolarHBondContact OG1-OD2 3.39Å; T2694-V2698 WeakPolarHBondContact O-CG2 3.33Å; T2694-V2698 PolarHBondContact O-N 3.5Å
2695	P	77.2	Confident	79.1	Confident	112 Å²	112	64.9 Å²	64.9	73%	0.727	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-19.5	175	-26.1	35.9	0	0	0	114.4	K2699	P2695-K2699 WeakPolarHBondContact O-CB 3.48Å; P2695-K2699 PolarHBondContact O-N 3.34Å
2696	S	69.7	Low	78.1	Confident	80 Å²	80	70.1 Å²	70.1	56%	0.559	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-50.3	171.8	-20.2	0	0	0	0	110.4	T2694 K2699 W2700	T2694-S2696 PolarHBondContact O-N 3.23Å; T2694-S2696 VanDerWaalsContact OG1-CB 3.3Å; T2694-S2696 WeakPolarHBondContact OG1-CB 3.04Å; T2694-S2696 PolarHBondContact OG1-N 3.35Å; T2694-S2696 PolarHBondContact OG1-OG 3.34Å; S2696-K2699 CarbonylContact O-C 3.38Å; S2696-K2699 WeakPolarHBondContact O-CA 3.34Å; S2696-K2699 WeakPolarHBondContact O-CB 3.1Å; S2696-K2699 PolarHBondContact O-N 2.97Å; S2696-W2700 PolarHBondContact O-N 3.42Å
2697	D	76.3	Confident	77.1	Confident	53 Å²	53	77.9 Å²	77.9	28%	0.283	35%	0.353	S	S	.	.	H	α-helix	trans	-77.2	-47	-169.8	-31	-36.9	0	0	0	108.5	N2693 T2694 K2699 W2700 Y2701	N2693-D2697 HydrophobicContact CB-CB 4.43Å; T2694-D2697 WeakPolarHBondContact CA-OD2 3.48Å; T2694-D2697 WeakPolarHBondContact CB-OD2 3.26Å; T2694-D2697 VanDerWaalsContact CG2-OD2 3.28Å; T2694-D2697 WeakPolarHBondContact CG2-OD2 3.46Å; T2694-D2697 PolarHBondContact N-OD2 3.02Å; T2694-D2697 PolarHBondContact O-N 2.8Å; T2694-D2697 PolarHBondContact OG1-OD1 3.01Å; T2694-D2697 PolarHBondContact OG1-OD2 3.39Å; D2697-K2699 PolarHBondContact O-N 2.92Å; D2697-K2699 VanDerWaalsContact O-N 3.08Å; D2697-W2700 CarbonylContact O-C 3.53Å; D2697-W2700 WeakPolarHBondContact O-CA 3.29Å; D2697-W2700 WeakPolarHBondContact O-CB 3.32Å; D2697-W2700 PolarHBondContact O-N 3.24Å; D2697-Y2701 WeakPolarHBondContact O-CD2 3.49Å; D2697-Y2701 PolarHBondContact O-N 3.34Å
2698	V	76.9	Confident	75.8	Confident	5 Å²	5	77 Å²	77	3%	0.03	35%	0.353	C	S	.	.	H	α-helix	trans	-58.2	-30	171.5	-171.2	0	0	0	0	110.6	W2689 K2690 N2693 T2694 R2702	W2689-V2698 HydrophobicContact CH2-CG1 4.22Å; W2689-V2698 HydrophobicContact CH2-CG2 4.32Å; W2689-V2698 HydrophobicContact CZ3-CG1 3.94Å; W2689-V2698 HydrophobicContact CZ3-CG2 4.25Å; K2690-V2698 HydrophobicContact CD-CG1 4.42Å; K2690-V2698 HydrophobicContact CG-CG1 4.32Å; N2693-V2698 HydrophobicContact CB-CG2 3.68Å; T2694-V2698 WeakPolarHBondContact O-CG2 3.33Å; T2694-V2698 PolarHBondContact O-N 3.5Å; V2698-R2702 VanDerWaalsContact C-NH2 3.26Å; V2698-R2702 WeakPolarHBondContact O-CB 3.47Å; V2698-R2702 WeakPolarHBondContact O-CD 3.24Å; V2698-R2702 WeakPolarHBondContact O-CG 3.4Å; V2698-R2702 PolarHBondContact O-N 3.15Å; V2698-R2702 PolarHBondContact O-NE 2.83Å; V2698-R2702 PolarHBondContact O-NH2 3.2Å
2699	K	78.9	Confident	74.5	Confident	132 Å²	132	82.8 Å²	82.8	57%	0.574	37%	0.374	S	S	*	.	H	α-helix	trans	-73	-40.6	171.1	179.2	-168.4	171.5	-161.9	0	111.9	P2695 S2696 D2697 R2702 E2703	P2695-K2699 WeakPolarHBondContact O-CB 3.48Å; P2695-K2699 PolarHBondContact O-N 3.34Å; S2696-K2699 CarbonylContact O-C 3.38Å; S2696-K2699 WeakPolarHBondContact O-CA 3.34Å; S2696-K2699 WeakPolarHBondContact O-CB 3.1Å; S2696-K2699 PolarHBondContact O-N 2.97Å; D2697-K2699 PolarHBondContact O-N 2.92Å; D2697-K2699 VanDerWaalsContact O-N 3.08Å; K2699-R2702 VanDerWaalsContact N-NH2 3.14Å; K2699-R2702 CarbonylContact O-C 3.57Å; K2699-R2702 PolarHBondContact O-N 2.88Å; K2699-E2703 WeakPolarHBondContact O-CB 3.32Å; K2699-E2703 PolarHBondContact O-N 3.39Å
2700	W	76.7	Confident	72.6	Confident	88 Å²	88	86.7 Å²	86.7	33%	0.333	41%	0.405	S	S	.	.	H	α-helix	trans	-63.8	-48.9	175.9	178.1	99.4	0	0	0	111.9	S2696 D2697 R2702 E2703 R2704	S2696-W2700 PolarHBondContact O-N 3.42Å; D2697-W2700 CarbonylContact O-C 3.53Å; D2697-W2700 WeakPolarHBondContact O-CA 3.29Å; D2697-W2700 WeakPolarHBondContact O-CB 3.32Å; D2697-W2700 PolarHBondContact O-N 3.24Å; W2700-R2702 VanDerWaalsContact C-N 3.34Å; W2700-R2702 PolarHBondContact O-N 3.49Å; W2700-E2703 CarbonylContact O-C 3.58Å; W2700-E2703 WeakPolarHBondContact O-CA 3.33Å; W2700-E2703 WeakPolarHBondContact O-CB 3.5Å; W2700-E2703 PolarHBondContact O-N 3.35Å; W2700-R2704 VanDerWaalsContact CZ2-NH1 3.34Å; W2700-R2704 PolarHBondContact O-N 3.23Å
2701	Y	71.8	Confident	70.5	Confident	40 Å²	40	90.2 Å²	90.2	16%	0.157	43%	0.426	C	S	.	.	H	α-helix	trans	-55.5	-47.7	172.5	-86	-94.5	0	0	0	110.7	Q2653 W2689 D2697 E2703 R2704 A2705	Q2653-Y2701 HydrophobicContact CB-CE1 4.5Å; Q2653-Y2701 HydrophobicContact CG-CE1 4.4Å; Q2653-Y2701 PolarHBondContact OE1-OH 3.42Å; W2689-Y2701 HydrophobicContact CH2-CD1 4.37Å; W2689-Y2701 HydrophobicContact CH2-CD2 4.27Å; W2689-Y2701 AromaticContact CH2-CG 3.98Å; W2689-Y2701 HydrophobicContact CH2-CG 3.98Å; W2689-Y2701 AromaticContact CZ2-CD1 3.92Å; W2689-Y2701 HydrophobicContact CZ2-CD1 3.92Å; W2689-Y2701 AromaticContact CZ2-CD2 3.81Å; W2689-Y2701 HydrophobicContact CZ2-CD2 3.81Å; W2689-Y2701 HydrophobicContact CZ2-CE1 4.13Å; W2689-Y2701 HydrophobicContact CZ2-CE2 4.05Å; W2689-Y2701 AromaticContact CZ2-CG 3.75Å; W2689-Y2701 HydrophobicContact CZ2-CG 3.75Å; D2697-Y2701 WeakPolarHBondContact O-CD2 3.49Å; D2697-Y2701 PolarHBondContact O-N 3.34Å; Y2701-E2703 PolarHBondContact O-N 2.89Å; Y2701-E2703 VanDerWaalsContact O-N 3.17Å; Y2701-R2704 PolarHBondContact O-N 3.18Å; Y2701-A2705 WeakPolarHBondContact O-CB 3.19Å; Y2701-A2705 PolarHBondContact O-N 3.21Å
2702	R	76.8	Confident	68.7	Low	96 Å²	96	89.4 Å²	89.4	36%	0.362	44%	0.438	S	S	.	.	H	α-helix	trans	-63.7	-17.8	174.1	-74.7	175.9	-60.8	-150.9	-4.1	114.1	V2698 K2699 W2700 R2706	V2698-R2702 VanDerWaalsContact C-NH2 3.26Å; V2698-R2702 WeakPolarHBondContact O-CB 3.47Å; V2698-R2702 WeakPolarHBondContact O-CD 3.24Å; V2698-R2702 WeakPolarHBondContact O-CG 3.4Å; V2698-R2702 PolarHBondContact O-N 3.15Å; V2698-R2702 PolarHBondContact O-NE 2.83Å; V2698-R2702 PolarHBondContact O-NH2 3.2Å; K2699-R2702 VanDerWaalsContact N-NH2 3.14Å; K2699-R2702 CarbonylContact O-C 3.57Å; K2699-R2702 PolarHBondContact O-N 2.88Å; W2700-R2702 VanDerWaalsContact C-N 3.34Å; W2700-R2702 PolarHBondContact O-N 3.49Å; R2702-R2706 PolarHBondContact O-NE 2.86Å; R2702-R2706 PolarHBondContact O-NH2 3.17Å
2703	E	76	Confident	66.9	Low	67 Å²	67	95 Å²	95	31%	0.313	45%	0.454	S	S	.	.	H	α-helix	trans	-90.1	-39.5	174.3	-158.7	69.9	-128.5	0	0	110.9	K2699 W2700 Y2701 R2706 R2707	K2699-E2703 WeakPolarHBondContact O-CB 3.32Å; K2699-E2703 PolarHBondContact O-N 3.39Å; W2700-E2703 CarbonylContact O-C 3.58Å; W2700-E2703 WeakPolarHBondContact O-CA 3.33Å; W2700-E2703 WeakPolarHBondContact O-CB 3.5Å; W2700-E2703 PolarHBondContact O-N 3.35Å; Y2701-E2703 PolarHBondContact O-N 2.89Å; Y2701-E2703 VanDerWaalsContact O-N 3.17Å; E2703-R2706 CarbonylContact O-C 3.35Å; E2703-R2706 PolarHBondContact O-N 3.04Å; E2703-R2706 IonicContact OE1-CZ 3.39Å; E2703-R2706 IonicContact OE1-NH1 3.22Å; E2703-R2706 PolarHBondContact OE1-NH1 3Å; E2703-R2706 IonicContact OE1-NH2 3.6Å; E2703-R2706 IonicContact OE2-CZ 2.7Å; E2703-R2706 IonicContact OE2-NH1 3.88Å; E2703-R2706 PolarHBondContact OE2-NH1 3.18Å; E2703-R2706 IonicContact OE2-NH2 2.7Å; E2703-R2706 PolarHBondContact OE2-NH2 3.18Å; E2703-R2707 WeakPolarHBondContact O-CG 3.15Å; E2703-R2707 PolarHBondContact O-N 3.07Å
2704	R	73.3	Confident	64.7	Low	91 Å²	91	101.7 Å²	101.7	34%	0.343	49%	0.486	S	S	.	.	H	α-helix	trans	-63.3	-47.9	173.4	-171.2	172.6	-174.7	144.1	-5	111.1	W2700 Y2701 R2706 R2707 Q2708	W2700-R2704 VanDerWaalsContact CZ2-NH1 3.34Å; W2700-R2704 PolarHBondContact O-N 3.23Å; Y2701-R2704 PolarHBondContact O-N 3.18Å; R2704-R2706 PolarHBondContact O-N 3.29Å; R2704-R2707 CarbonylContact O-C 3.38Å; R2704-R2707 WeakPolarHBondContact O-CA 3.17Å; R2704-R2707 WeakPolarHBondContact O-CB 3.31Å; R2704-R2707 PolarHBondContact O-N 3.28Å; R2704-Q2708 HydrophobicContact CG-CG 4.03Å; R2704-Q2708 WeakPolarHBondContact O-CG 3.41Å; R2704-Q2708 PolarHBondContact O-N 2.69Å
2705	A	68.9	Low	62.9	Low	8 Å²	8	105 Å²	105	7%	0.066	50%	0.497	C	S	.	.	H	α-helix	trans	-59.4	-30.3	173.5	0	0	0	0	0	113	A2657 Y2701 R2707 R2709	A2657-A2705 VanDerWaalsContact O-CA 3.28Å; A2657-A2705 WeakPolarHBondContact O-CA 3.31Å; A2657-A2705 WeakPolarHBondContact O-CB 3.47Å; Y2701-A2705 WeakPolarHBondContact O-CB 3.19Å; Y2701-A2705 PolarHBondContact O-N 3.21Å; A2705-R2707 VanDerWaalsContact C-N 3.25Å; A2705-R2707 PolarHBondContact O-N 2.87Å; A2705-R2709 WeakPolarHBondContact O-CB 3.39Å; A2705-R2709 VanDerWaalsContact O-CG 3.25Å; A2705-R2709 WeakPolarHBondContact O-CG 3.46Å; A2705-R2709 PolarHBondContact O-N 3.21Å; A2705-R2709 VanDerWaalsContact O-N 3.1Å
2706	R	70.6	Confident	60.8	Low	122 Å²	122	104.9 Å²	104.9	46%	0.46	50%	0.496	S	S	.	.	H	α-helix	trans	-83.1	6.7	173.1	-81.6	-176.5	-68.8	108.3	3.4	114.5	R2702 E2703 R2704	R2702-R2706 PolarHBondContact O-NE 2.86Å; R2702-R2706 PolarHBondContact O-NH2 3.17Å; E2703-R2706 CarbonylContact O-C 3.35Å; E2703-R2706 PolarHBondContact O-N 3.04Å; E2703-R2706 IonicContact OE1-CZ 3.39Å; E2703-R2706 IonicContact OE1-NH1 3.22Å; E2703-R2706 PolarHBondContact OE1-NH1 3Å; E2703-R2706 IonicContact OE1-NH2 3.6Å; E2703-R2706 IonicContact OE2-CZ 2.7Å; E2703-R2706 IonicContact OE2-NH1 3.88Å; E2703-R2706 PolarHBondContact OE2-NH1 3.18Å; E2703-R2706 IonicContact OE2-NH2 2.7Å; E2703-R2706 PolarHBondContact OE2-NH2 3.18Å; R2704-R2706 PolarHBondContact O-N 3.29Å
2707	R	70.7	Confident	59.3	Low	181 Å²	181	107.4 Å²	107.4	68%	0.683	50%	0.502	S	S	*	.	H	α-helix	trans	-119.2	-36.4	171.3	-66.2	172.7	-175.8	-154.1	0.1	111.9	E2703 R2704 A2705 R2709	E2703-R2707 WeakPolarHBondContact O-CG 3.15Å; E2703-R2707 PolarHBondContact O-N 3.07Å; R2704-R2707 CarbonylContact O-C 3.38Å; R2704-R2707 WeakPolarHBondContact O-CA 3.17Å; R2704-R2707 WeakPolarHBondContact O-CB 3.31Å; R2704-R2707 PolarHBondContact O-N 3.28Å; A2705-R2707 VanDerWaalsContact C-N 3.25Å; A2705-R2707 PolarHBondContact O-N 2.87Å; R2707-R2709 CarbonylContact C-O 3.52Å; R2707-R2709 CarbonylContact O-C 3.52Å
2708	Q	61.3	Low	57.6	Low	110 Å²	110	110.6 Å²	110.6	51%	0.514	52%	0.518	S	S	.	.	H	α-helix	trans	-75.6	-28.7	175.6	-64.7	-57	89.6	0	0	112.4	R2704 S2710	R2704-Q2708 HydrophobicContact CG-CG 4.03Å; R2704-Q2708 WeakPolarHBondContact O-CG 3.41Å; R2704-Q2708 PolarHBondContact O-N 2.69Å; Q2708-S2710 PolarHBondContact O-N 2.91Å
2709	R	58.4	Low	55.5	Low	126 Å²	126	115.9 Å²	115.9	48%	0.475	55%	0.55	S	S	.	.	S	Bend	trans	-63.3	97.4	147.8	-67.9	178.4	-169.4	-171.3	1.3	107.5	M2658 H2659 A2705 R2707 L2711	M2658-R2709 VanDerWaalsContact O-CG 3.32Å; M2658-R2709 WeakPolarHBondContact O-CG 3.26Å; M2658-R2709 PolarHBondContact O-NE 2.95Å; M2658-R2709 VanDerWaalsContact O-NE 3.09Å; H2659-R2709 PolarHBondContact O-NH2 3.4Å; A2705-R2709 WeakPolarHBondContact O-CB 3.39Å; A2705-R2709 VanDerWaalsContact O-CG 3.25Å; A2705-R2709 WeakPolarHBondContact O-CG 3.46Å; A2705-R2709 PolarHBondContact O-N 3.21Å; A2705-R2709 VanDerWaalsContact O-N 3.1Å; R2707-R2709 CarbonylContact C-O 3.52Å; R2707-R2709 CarbonylContact O-C 3.52Å; R2709-L2711 PolarHBondContact O-N 3.42Å
2710	S	45.4	Very low	53.5	Low	99 Å²	99	117 Å²	117	69%	0.692	56%	0.557	S	S	*	*			trans	-43.1	140.3	155.7	48	0	0	0	0	108.6	Q2708	Q2708-S2710 PolarHBondContact O-N 2.91Å
2711	L	43.2	Very low	51.6	Low	150 Å²	150	120.6 Å²	120.6	79%	0.785	58%	0.578	S	S	*	*			trans	-52.4	146	157.9	-68	168.4	0	0	0	107	R2709 R2713	R2709-L2711 PolarHBondContact O-N 3.42Å; L2711-R2713 PolarHBondContact O-N 2.94Å
2712	P	43.1	Very low	49.8	Very low	115 Å²	115	123.8 Å²	123.8	75%	0.747	61%	0.606	S	S	*	*			trans	-48.1	118.7	161.7	-22	32.8	0	0	0	106.3	M2714	P2712-M2714 VanDerWaalsContact C-N 3.35Å; P2712-M2714 PolarHBondContact O-N 3.49Å
2713	R	36.3	Very low	47.6	Very low	218 Å²	218	124.3 Å²	124.3	82%	0.823	62%	0.615	S	S	*	*			trans	-56.8	110.4	172.2	-177.8	174.2	-178.9	160.3	-3.8	103.2	L2711 E2715	L2711-R2713 PolarHBondContact O-N 2.94Å; R2713-E2715 PolarHBondContact O-N 3.25Å
2714	M	33.1	Very low	45.4	Very low	180 Å²	180	126.2 Å²	126.2	89%	0.887	64%	0.636	S	S	*	*			trans	-68.5	89.1	166.1	-73.6	-143.9	71.6	0	0	104.1	P2712	P2712-M2714 VanDerWaalsContact C-N 3.35Å; P2712-M2714 PolarHBondContact O-N 3.49Å
2715	E	36.2	Very low	43.6	Very low	132 Å²	132	130.9 Å²	130.9	62%	0.617	66%	0.662	S	S	*	*			trans	-53.7	126.3	173.7	-168.9	159.3	-136.2	0	0	106.2	R2713 I2717	R2713-E2715 PolarHBondContact O-N 3.25Å; E2715-I2717 HydrophobicContact CB-CG1 4.04Å; E2715-I2717 HydrophobicContact CG-CD1 4.4Å; E2715-I2717 HydrophobicContact CG-CG1 3.77Å; E2715-I2717 PolarHBondContact O-N 3.14Å
2716	P	32.5	Very low	41.8	Very low	109 Å²	109	136.8 Å²	136.8	71%	0.708	69%	0.688	S	S	*	*			trans	-74.9	67.8	175.5	33.2	-34.1	0	0	0	107.5	I2718	P2716-I2718 PolarHBondContact O-N 2.81Å
2717	I	39	Very low	40	Very low	134 Å²	134	138.2 Å²	138.2	69%	0.687	70%	0.698	S	S	*	*			trans	-67.2	92.7	166.4	-58.7	-176.5	0	0	0	105	E2715	E2715-I2717 HydrophobicContact CB-CG1 4.04Å; E2715-I2717 HydrophobicContact CG-CD1 4.4Å; E2715-I2717 HydrophobicContact CG-CG1 3.77Å; E2715-I2717 PolarHBondContact O-N 3.14Å
2718	I	41.1	Very low	38.1	Very low	120 Å²	120	139 Å²	139	62%	0.615	71%	0.71	S	S	*	*			trans	-43.8	139	159.6	-65.7	162.3	0	0	0	107	P2716 E2720	P2716-I2718 PolarHBondContact O-N 2.81Å; I2718-E2720 HydrophobicContact CG2-CG 4.37Å; I2718-E2720 PolarHBondContact O-N 2.86Å
2719	T	31.4	Very low	36.8	Very low	115 Å²	115	137.2 Å²	137.2	71%	0.706	71%	0.713	S	S	*	*			trans	-70.7	76.8	171.6	48.3	0	0	0	0	109.4	E2721	T2719-E2721 PolarHBondContact O-N 2.91Å
2720	E	37.7	Very low	35.5	Very low	155 Å²	155	138.7 Å²	138.7	72%	0.724	72%	0.723	S	S	*	*			trans	-68.5	59.7	158.1	-67.4	-63	158.3	0	0	108.4	I2718	I2718-E2720 HydrophobicContact CG2-CG 4.37Å; I2718-E2720 PolarHBondContact O-N 2.86Å
2721	E	37.2	Very low	34.8	Very low	164 Å²	164	143.1 Å²	143.1	77%	0.766	73%	0.733	S	S	*	*			trans	-113.2	113.2	179.5	-172	169.5	-158.2	0	0	106.5	T2719	T2719-E2721 PolarHBondContact O-N 2.91Å
2722	S	33.1	Very low	34.3	Very low	108 Å²	108	144.7 Å²	144.7	76%	0.755	74%	0.737	S	S	*	*	S	Bend	trans	76.9	44.9	175.9	-153.8	0	0	0	0	118.6
2723	L	30.9	Very low	33.5	Very low	106 Å²	106	143.4 Å²	143.4	56%	0.555	73%	0.729	S	S	*	*	S	Bend	trans	-138	11.8	157.4	-92	-170.1	0	0	0	117.2
2724	S	30.8	Very low	33.2	Very low	107 Å²	107	140.2 Å²	140.2	75%	0.748	73%	0.728	S	S	*	*	S	Bend	trans	-99	4.4	174.9	61.2	0	0	0	0	115.4
2725	E	34.5	Very low	33	Very low	189 Å²	189	136.8 Å²	136.8	88%	0.883	73%	0.729	S	S	*	*	S	Bend	trans	-115.2	15.2	174.7	-68.7	-173.4	142.7	0	0	113
2726	Q	32.2	Very low	32.8	Very low	132 Å²	132	140.4 Å²	140.4	62%	0.617	74%	0.738	S	S	*	*	S	Bend	trans	-120.7	-4.2	178	-75	-168.1	0.2	0	0	115.4
2727	F	31.1	Very low	32.9	Very low	152 Å²	152	140.9 Å²	140.9	67%	0.667	74%	0.739	S	S	*	*	S	Bend	trans	-109.8	-6.8	-177.6	-86.5	-83.1	0	0	0	116.2	A2729	F2727-A2729 PolarHBondContact O-N 3.13Å
2728	E	32.3	Very low	32.7	Very low	199 Å²	199	140.1 Å²	140.1	93%	0.93	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	5.3	164.5	-65.8	-167.2	141.6	0	0	113.1
2729	A	32.7	Very low	32.2	Very low	71 Å²	71	140.9 Å²	140.9	59%	0.587	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.3	-1.8	-174.9	0	0	0	0	0	115.2	F2727	F2727-A2729 PolarHBondContact O-N 3.13Å
2730	F	31.1	Very low	32.4	Very low	158 Å²	158	142.1 Å²	142.1	69%	0.693	75%	0.746	S	S	*	*	S	Bend	trans	-129	-5.7	-175	-85.1	-77.3	0	0	0	116.9	Q2732	F2730-Q2732 PolarHBondContact O-N 2.68Å
2731	E	31.5	Very low	32.1	Very low	192 Å²	192	141.4 Å²	141.4	90%	0.897	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	45.7	165	-69.7	-153.1	128.3	0	0	112.6
2732	Q	31.9	Very low	31.9	Very low	183 Å²	183	138.8 Å²	138.8	86%	0.855	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.7	22.1	179.5	-151.2	80.9	103.7	0	0	114	F2730	F2730-Q2732 PolarHBondContact O-N 2.68Å
2733	C	27	Very low	31.8	Very low	88 Å²	88	139.2 Å²	139.2	60%	0.595	75%	0.745	S	S	*	*	S	Bend	trans	-146.1	133.6	162.8	62.7	0	0	0	0	115.2
2734	N	29.2	Very low	32.1	Very low	150 Å²	150	142.2 Å²	142.2	80%	0.802	76%	0.756	S	S	*	*			trans	64.6	58.4	148.5	-54.7	-15.8	0	0	0	119.7
2735	A	29.2	Very low	32.1	Very low	109 Å²	109	142.9 Å²	142.9	90%	0.901	76%	0.756	S	S	*	*			trans	-99.4	69.9	154.2	0	0	0	0	0	111.3
2736	Y	32.3	Very low	32.3	Very low	208 Å²	208	141.1 Å²	141.1	82%	0.816	75%	0.752	S	S	*	*			trans	-107.9	136.3	170.8	-97.3	-81	0	0	0	110.6
2737	T	34.5	Very low	32.4	Very low	118 Å²	118	141 Å²	141	72%	0.724	76%	0.755	S	S	*	*			trans	55.8	95.5	163.1	60.4	0	0	0	0	119.1
2738	T	34.4	Very low	32.7	Very low	118 Å²	118	140.3 Å²	140.3	72%	0.724	76%	0.759	S	S	*	*				41.1	127.6	118.9	52.9	0	0	0	0	121.8
2739	D	31.6	Very low	32.9	Very low	136 Å²	136	136.7 Å²	136.7	73%	0.727	75%	0.746	S	S	*	*			trans	103.2	137.9	132.1	-71	8.4	0	0	0	122.8
2740	M	35	Very low	33.1	Very low	141 Å²	141	139 Å²	139	70%	0.695	75%	0.748	S	S	*	*			trans	74.3	97.2	162.8	-56.5	-51.5	130.7	0	0	122.2
2741	N	32.2	Very low	33.4	Very low	141 Å²	141	137.5 Å²	137.5	75%	0.754	75%	0.747	S	S	*	*				33.6	119.6	120.3	-58.6	-29.9	0	0	0	120.7
2742	S	33.1	Very low	33.7	Very low	109 Å²	109	134 Å²	134	76%	0.762	74%	0.735	S	S	*	*				167	120.3	106.1	-71.4	0	0	0	0	115.9
2743	T	31.3	Very low	33.9	Very low	117 Å²	117	131.3 Å²	131.3	72%	0.718	73%	0.726	S	S	*	*			trans	23.4	153.7	142.9	63	0	0	0	0	125.1
2744	Q	36.4	Very low	34.1	Very low	169 Å²	169	134 Å²	134	79%	0.79	74%	0.735	S	S	*	*			trans	85.2	103.1	162.5	-68.7	164.3	80.9	0	0	115.9
2745	T	31	Very low	34.2	Very low	120 Å²	120	131.1 Å²	131.1	74%	0.736	73%	0.727	S	S	*	*				79.7	117.3	64.3	60.5	0	0	0	0	115.3
2746	L	37.7	Very low	34.3	Very low	153 Å²	153	135.6 Å²	135.6	80%	0.801	73%	0.726	S	S	*	*			trans	174.5	112.4	135.9	-94.5	160.7	0	0	0	114
2747	D	34.4	Very low	34.2	Very low	129 Å²	129	131.9 Å²	131.9	69%	0.69	72%	0.72	S	S	*	*			trans	48.7	151.7	136.9	-55.6	0.5	0	0	0	126.8
2748	N	37.2	Very low	34.1	Very low	138 Å²	138	132 Å²	132	74%	0.738	72%	0.721	S	S	*	*			trans	80.6	145.9	155.3	-65.3	-53	0	0	0	118.7
2749	N	37.2	Very low	34.2	Very low	123 Å²	123	131.5 Å²	131.5	66%	0.658	72%	0.719	S	S	*	*			cis	-159.2	159.3	2.4	-134.9	-32.3	0	0	0	116.3
2750	N	37.3	Very low	34	Very low	118 Å²	118	135 Å²	135	63%	0.631	72%	0.723	S	S	*	*			trans	49.4	108.7	145.3	-85.1	-39.5	0	0	0	125.5
2751	N	37.8	Very low	33.8	Very low	127 Å²	127	134.7 Å²	134.7	68%	0.679	73%	0.725	S	S	*	*				67.8	130.1	107	-88.2	-40.4	0	0	0	126.3
2752	N	37.5	Very low	33.7	Very low	120 Å²	120	134.9 Å²	134.9	64%	0.642	73%	0.725	S	S	*	*			trans	91.3	105.7	132.2	-72.6	-32.2	0	0	0	125.4
2753	N	35.1	Very low	33.5	Very low	126 Å²	126	140 Å²	140	67%	0.674	73%	0.728	S	S	*	*				84.2	115.4	120.1	-64.9	-30.4	0	0	0	125.6
2754	N	32.1	Very low	33.6	Very low	144 Å²	144	142.6 Å²	142.6	77%	0.77	73%	0.731	S	S	*	*				79.8	104.2	128.3	-70.5	-30.7	0	0	0	124.4
2755	S	31.1	Very low	33.4	Very low	90 Å²	90	142.8 Å²	142.8	63%	0.629	73%	0.73	S	S	*	*				64.2	126.4	118.7	168.3	0	0	0	0	122.2
2756	F	32.1	Very low	33.5	Very low	203 Å²	203	142.6 Å²	142.6	89%	0.89	72%	0.72	S	S	*	*				-161.1	-176.6	124.1	-113.7	-75	0	0	0	112.9
2757	N	29	Very low	33.3	Very low	130 Å²	130	140.1 Å²	140.1	70%	0.695	71%	0.705	S	S	*	*			trans	-128.7	135.6	-160.7	-97.9	-86.7	0	0	0	114.7
2758	V	32.8	Very low	33.4	Very low	121 Å²	121	139.6 Å²	139.6	73%	0.733	70%	0.698	S	S	*	*			trans	66.8	153	134.9	173.1	0	0	0	0	117.9
2759	P	37.4	Very low	33.2	Very low	106 Å²	106	138.2 Å²	138.2	69%	0.688	69%	0.687	S	S	*	*			cis	-127.2	175.4	3.8	24.3	-0	0	0	0	117.8
2760	Y	27	Very low	32.9	Very low	209 Å²	209	139.4 Å²	139.4	82%	0.82	70%	0.699	S	S	*	*			trans	-20.9	158.1	151.3	-48.8	-90.1	0	0	0	117.6
2761	N	29.5	Very low	32.4	Very low	135 Å²	135	139 Å²	139	72%	0.722	70%	0.701	S	S	*	*				179.3	172	50.8	-142.4	-29.4	0	0	0	114.3
2762	L	31.8	Very low	32.1	Very low	146 Å²	146	141.4 Å²	141.4	76%	0.764	71%	0.712	S	S	*	*			trans	68.9	154.8	170.4	-80.2	70.8	0	0	0	118.4
2763	R	29	Very low	31.5	Very low	217 Å²	217	140.5 Å²	140.5	82%	0.819	72%	0.715	S	S	*	*			cis	-170.8	157.1	-31.2	-164.4	167.3	-170.5	-168.9	-1.4	110.5
2764	H	33.4	Very low	31.4	Very low	171 Å²	171	141.2 Å²	141.2	79%	0.792	72%	0.724	S	S	*	*			trans	-33.8	150.4	171	-45.1	-82.4	0	0	0	115.8
2765	K	31.1	Very low	31.3	Very low	173 Å²	173	142.5 Å²	142.5	75%	0.752	73%	0.725	S	S	*	*				-163.9	173.6	59.8	-137.2	178.6	165.1	-144.9	0	108.2
2766	Q	32.7	Very low	31.3	Very low	115 Å²	115	143.8 Å²	143.8	54%	0.537	73%	0.731	S	S	.	*			cis	-159.2	159.4	19.3	-175.8	157.9	-55.9	0	0	109.9
2767	Q	33.8	Very low	31.5	Very low	101 Å²	101	140.2 Å²	140.2	47%	0.472	73%	0.728	S	S	.	*			trans	-82.2	159.1	179.6	-46.6	103.2	-78.8	0	0	114.1	N2505	N2505-Q2767 PolarHBondContact ND2-NE2 3.12Å; N2505-Q2767 PolarHBondContact ND2-OE1 3.34Å; N2505-Q2767 PolarHBondContact OD1-NE2 3.36Å
2768	Q	36.1	Very low	31.4	Very low	119 Å²	119	141.5 Å²	141.5	56%	0.556	74%	0.735	S	S	*	*				-151.7	174.9	129.4	-121.9	154.8	110.1	0	0	112.4	D2507	D2507-Q2768 PolarHBondContact OD2-NE2 3.22Å
2769	Q	33.9	Very low	31	Very low	109 Å²	109	140.6 Å²	140.6	51%	0.509	73%	0.734	S	S	.	*			trans	-137.8	150.3	-148.6	176.9	-179	-2.8	0	0	112.8
2770	T	30.9	Very low	30.6	Very low	148 Å²	148	144 Å²	144	91%	0.908	75%	0.745	S	S	*	*			trans	-154.6	154.1	156.8	-2.6	0	0	0	0	110.2
2771	T	26.1	Very low	30.6	Very low	110 Å²	110	138.6 Å²	138.6	68%	0.675	74%	0.738	S	S	*	*			trans	-139.4	131.1	-164	-43.3	0	0	0	0	111.1
2772	I	30.9	Very low	30.6	Very low	176 Å²	176	138.5 Å²	138.5	90%	0.903	74%	0.742	S	S	*	*			trans	-134.5	147.2	166.2	-63.5	-174.3	0	0	0	109.6
2773	S	26.6	Very low	30.5	Very low	101 Å²	101	137.9 Å²	137.9	71%	0.706	74%	0.739	S	S	*	*			trans	-102.1	158.7	-171.7	174.6	0	0	0	0	112.5
2774	V	32.8	Very low	30.4	Very low	141 Å²	141	134.9 Å²	134.9	86%	0.855	74%	0.737	S	S	*	*				-166.5	161.9	129.9	137.4	0	0	0	0	112
2775	Q	30.1	Very low	30.3	Very low	172 Å²	172	135.2 Å²	135.2	80%	0.804	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-86.2	159.4	-161.4	-59.1	159.9	-19.2	0	0	115.6
2776	P	29.6	Very low	30.3	Very low	116 Å²	116	130.6 Å²	130.6	75%	0.753	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-93.5	143.5	165.1	36	-32	0	0	0	113.3
2777	P	36.5	Very low	30.2	Very low	128 Å²	128	131.7 Å²	131.7	83%	0.831	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-92.1	158.3	172.8	35.6	-33.7	0	0	0	113.5
2778	L	26.4	Very low	30.3	Very low	158 Å²	158	135.8 Å²	135.8	83%	0.827	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-100.4	149.3	-179.1	-72.3	85.1	0	0	0	113.9
2779	S	26.1	Very low	29.9	Very low	102 Å²	102	137.9 Å²	137.9	71%	0.713	76%	0.763	S	S	*	*			trans	35.3	135.3	141.8	69.1	0	0	0	0	122.1
2780	L	28.9	Very low	29.9	Very low	178 Å²	178	140.9 Å²	140.9	93%	0.932	78%	0.782	S	S	*	*			trans	-144.6	167	139.3	-136.8	70.6	0	0	0	110.6
2781	S	26.4	Very low	29.7	Very low	94 Å²	94	138.6 Å²	138.6	66%	0.657	77%	0.768	S	S	*	*			trans	-133.6	-165.4	-163.8	62.5	0	0	0	0	113.3
2782	T	29.6	Very low	30.1	Very low	133 Å²	133	140 Å²	140	82%	0.816	78%	0.777	S	S	*	*			trans	81.9	152.3	173	82.6	0	0	0	0	115.1
2783	N	29.3	Very low	30	Very low	133 Å²	133	140.8 Å²	140.8	71%	0.711	77%	0.774	S	S	*	*			cis	-169.6	145.9	-7.2	141.9	-34	0	0	0	111.7
2784	M	26.6	Very low	30.5	Very low	154 Å²	154	142.3 Å²	142.3	76%	0.759	78%	0.778	S	S	*	*			trans	44.5	166.9	161.2	-46.8	-84.4	93.8	0	0	118.9
2785	K	31.9	Very low	30.5	Very low	178 Å²	178	140.7 Å²	140.7	77%	0.774	77%	0.769	S	S	*	*			cis	-170.6	152.5	26.8	-171.3	104.1	176.2	-179.5	0	111.5
2786	S	31.9	Very low	30.5	Very low	77 Å²	77	138.2 Å²	138.2	54%	0.538	77%	0.766	S	S	.	*			trans	55.1	124.3	145.6	56.9	0	0	0	0	123.9
2787	D	29.9	Very low	30.6	Very low	137 Å²	137	139.3 Å²	139.3	73%	0.733	77%	0.765	S	S	*	*				55.1	126.4	121.3	-42.6	-39.3	0	0	0	120.1
2788	H	35.2	Very low	30.4	Very low	187 Å²	187	140.6 Å²	140.6	87%	0.866	77%	0.765	S	S	*	*				-161.6	156.7	71.8	-98.7	-82.4	0	0	0	114.5
2789	Q	29.2	Very low	30.7	Very low	163 Å²	163	140.4 Å²	140.4	76%	0.762	76%	0.763	S	S	*	*			trans	-83.3	154	166.5	-60.5	177.4	41.9	0	0	112.2
2790	L	33.1	Very low	31	Very low	173 Å²	173	141.4 Å²	141.4	91%	0.906	77%	0.765	S	S	*	*			trans	-142.4	144.5	140.6	-153.5	71.5	0	0	0	110.5
2791	T	26.3	Very low	31	Very low	100 Å²	100	139.1 Å²	139.1	61%	0.613	76%	0.758	S	S	*	*			trans	-126.6	150.9	-176.1	81.6	0	0	0	0	110.7
2792	T	34.7	Very low	31.3	Very low	139 Å²	139	142.3 Å²	142.3	85%	0.853	77%	0.768	S	S	*	*			trans	-154.3	142.2	162.1	-1	0	0	0	0	110.3
2793	K	30	Very low	31.3	Very low	192 Å²	192	141.4 Å²	141.4	84%	0.835	76%	0.758	S	S	*	*			trans	-129.3	127.8	-178.3	-60.6	177.1	-178.8	178.5	0	110.1
2794	V	35.4	Very low	31.5	Very low	133 Å²	133	142.8 Å²	142.8	81%	0.806	77%	0.765	S	S	*	*			trans	-150.6	87.7	167.4	-177.4	0	0	0	0	106.7
2795	T	32.8	Very low	31.7	Very low	108 Å²	108	142 Å²	142	66%	0.663	76%	0.764	S	S	*	*				66.8	93.3	88	63.7	0	0	0	0	116.5
2796	T	31	Very low	31.6	Very low	119 Å²	119	138.8 Å²	138.8	73%	0.73	76%	0.764	S	S	*	*			trans	59.7	125.6	130.1	54.9	0	0	0	0	122.6
2797	N	31.5	Very low	31.6	Very low	139 Å²	139	142.4 Å²	142.4	74%	0.743	78%	0.777	S	S	*	*			trans	70.1	118.7	140.1	-54.1	1.9	0	0	0	119.5
2798	D	32.7	Very low	31.8	Very low	155 Å²	155	140.9 Å²	140.9	83%	0.829	78%	0.777	S	S	*	*				-174.4	177.5	98.5	-94.6	-19	0	0	0	111.9
2799	I	31.6	Very low	31.7	Very low	154 Å²	154	139.8 Å²	139.8	79%	0.79	78%	0.777	S	S	*	*			trans	81.3	97.9	160.4	-46	-164.1	0	0	0	119.1
2800	V	34	Very low	31.9	Very low	123 Å²	123	140.3 Å²	140.3	75%	0.745	78%	0.78	S	S	*	*			trans	70	114.9	142.1	-179.8	0	0	0	0	120
2801	V	27.9	Very low	31.9	Very low	131 Å²	131	139.1 Å²	139.1	79%	0.794	77%	0.774	S	S	*	*			trans	-85.7	133.9	156.1	174.6	0	0	0	0	109.7
2802	N	32.5	Very low	32.7	Very low	161 Å²	161	139.3 Å²	139.3	86%	0.861	78%	0.779	S	S	*	*			trans	-145.8	158	149.8	-109.1	-25.7	0	0	0	109.2
2803	N	29.7	Very low	32.8	Very low	113 Å²	113	138.7 Å²	138.7	60%	0.604	76%	0.763	S	S	*	*			trans	-132.7	106.2	-145.8	178.5	27.8	0	0	0	113.1	N2805	N2803-N2805 PolarHBondContact OD1-ND2 3.31Å
2804	D	33.2	Very low	33.4	Very low	163 Å²	163	134.8 Å²	134.8	87%	0.872	75%	0.751	S	S	*	*			trans	-123.8	105.6	169.8	-83.8	-55	0	0	0	109.8
2805	N	31.2	Very low	34	Very low	136 Å²	136	133.8 Å²	133.8	73%	0.727	74%	0.741	S	S	*	*			trans	-86.1	116.5	-178	-86.4	-57.8	0	0	0	111.9	N2803	N2803-N2805 PolarHBondContact OD1-ND2 3.31Å
2806	S	30	Very low	34.2	Very low	111 Å²	111	134.2 Å²	134.2	78%	0.776	73%	0.734	S	S	*	*			trans	-138.6	56.5	173	70.8	0	0	0	0	113.6	S2808	S2806-S2808 PolarHBondContact O-N 2.95Å
2807	N	32.6	Very low	34.9	Very low	153 Å²	153	132.2 Å²	132.2	82%	0.818	72%	0.717	S	S	*	*			trans	-72.6	116.4	171.4	-74.3	-11.1	0	0	0	110.6
2808	S	34.4	Very low	35.6	Very low	105 Å²	105	130.3 Å²	130.3	73%	0.734	71%	0.707	S	S	*	*			trans	-78.4	145.1	178.6	48.4	0	0	0	0	112.7	S2806 E2810	S2806-S2808 PolarHBondContact O-N 2.95Å; S2808-E2810 PolarHBondContact O-N 3.25Å
2809	L	31.1	Very low	36.1	Very low	165 Å²	165	128 Å²	128	86%	0.864	69%	0.694	S	S	*	*			trans	-73.5	94.4	-176.6	-75.3	75	0	0	0	113
2810	E	34.9	Very low	36.6	Very low	174 Å²	174	124.6 Å²	124.6	81%	0.813	68%	0.679	S	S	*	*			trans	-140.1	116.7	156.9	-101.4	158.4	-171.8	0	0	107.7	S2808	S2808-E2810 PolarHBondContact O-N 3.25Å
2811	N	33.5	Very low	36.9	Very low	148 Å²	148	123.3 Å²	123.3	79%	0.791	66%	0.664	S	S	*	*			trans	148.3	-8.6	173.9	-82.4	-4.2	0	0	0	113.7	Y2813	N2811-Y2813 VanDerWaalsContact C-N 3.28Å; N2811-Y2813 PolarHBondContact O-N 3.45Å
2812	S	41.3	Very low	37.4	Very low	103 Å²	103	122.4 Å²	122.4	72%	0.72	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	37.3	-169.8	-176.2	0	0	0	0	116.5
2813	Y	37.3	Very low	37.5	Very low	127 Å²	127	123.2 Å²	123.2	50%	0.498	65%	0.653	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110.8	-48.6	179.4	-166.6	-99.4	0	0	0	113.5	Y2418 N2811	Y2418-Y2813 HydrophobicContact CD2-CE2 4.4Å; Y2418-Y2813 HydrophobicContact CE2-CD2 4.32Å; Y2418-Y2813 AromaticContact CE2-CE2 3.99Å; Y2418-Y2813 HydrophobicContact CE2-CE2 3.99Å; N2811-Y2813 VanDerWaalsContact C-N 3.28Å; N2811-Y2813 PolarHBondContact O-N 3.45Å
2814	D	43.7	Very low	37.6	Very low	109 Å²	109	124 Å²	124	58%	0.583	66%	0.663	S	S	*	*	H	α-helix	trans	-79	-43.9	-172.3	-52.5	-66.1	0	0	0	111.6	F2816 M2817 D2818	D2814-F2816 PolarHBondContact O-N 2.93Å; D2814-M2817 PolarHBondContact O-N 3.16Å; D2814-D2818 PolarHBondContact O-N 2.88Å; D2814-D2818 VanDerWaalsContact O-N 3.13Å
2815	D	46.3	Very low	37.6	Very low	112 Å²	112	122 Å²	122	60%	0.599	66%	0.656	S	S	*	*	H	α-helix	trans	-48.9	-36.7	170.7	-73.5	-6.7	0	0	0	113	D2818 I2819	D2815-D2818 PolarHBondContact O-N 2.9Å; D2815-I2819 WeakPolarHBondContact O-CB 3.27Å; D2815-I2819 WeakPolarHBondContact O-CD1 3.49Å; D2815-I2819 WeakPolarHBondContact O-CG1 3.23Å; D2815-I2819 PolarHBondContact O-N 2.91Å
2816	F	38.8	Very low	37.7	Very low	118 Å²	118	121.3 Å²	121.3	52%	0.518	66%	0.662	S	S	.	*	H	α-helix	trans	-73.5	-29.7	-178.8	-173.4	-96.7	0	0	0	112.6	D2814 V2820	D2814-F2816 PolarHBondContact O-N 2.93Å; F2816-V2820 HydrophobicContact CD1-CG2 4.43Å; F2816-V2820 HydrophobicContact CE1-CG2 4.01Å; F2816-V2820 HydrophobicContact CZ-CG2 4.17Å; F2816-V2820 VanDerWaalsContact O-CG2 3.28Å; F2816-V2820 WeakPolarHBondContact O-CG2 3.39Å; F2816-V2820 PolarHBondContact O-N 3.39Å
2817	M	45.5	Very low	37.8	Very low	76 Å²	76	122 Å²	122	37%	0.374	67%	0.667	S	S	.	*	H	α-helix	trans	-71.5	-46.2	171.9	-68.1	-62.1	-158	0	0	110.4	D2814 I2819 V2820 F2821	D2814-M2817 PolarHBondContact O-N 3.16Å; M2817-I2819 VanDerWaalsContact C-N 3.29Å; M2817-I2819 PolarHBondContact O-N 3.02Å; M2817-V2820 PolarHBondContact O-N 3.01Å; M2817-F2821 VanDerWaalsContact O-CD2 3.24Å; M2817-F2821 WeakPolarHBondContact O-CD2 3.37Å; M2817-F2821 PolarHBondContact O-N 3.42Å; M2817-F2821 VanDerWaalsContact O-N 3.09Å
2818	D	45	Very low	37.8	Very low	100 Å²	100	117.8 Å²	117.8	54%	0.535	66%	0.66	S	S	.	*	H	α-helix	trans	-64.4	-33	-179.6	-74.6	-12.6	0	0	0	112.5	D2814 D2815 F2821 N2822	D2814-D2818 PolarHBondContact O-N 2.88Å; D2814-D2818 VanDerWaalsContact O-N 3.13Å; D2815-D2818 PolarHBondContact O-N 2.9Å; D2818-F2821 PolarHBondContact O-N 3.07Å; D2818-N2822 WeakPolarHBondContact O-CB 3.46Å; D2818-N2822 PolarHBondContact O-N 2.89Å; D2818-N2822 VanDerWaalsContact O-N 3.1Å; D2818-N2822 PolarHBondContact O-ND2 3.04Å
2819	I	43.9	Very low	37.8	Very low	107 Å²	107	119.1 Å²	119.1	55%	0.549	67%	0.669	S	S	.	*	H	α-helix	trans	-64.8	-40.4	170.6	-71.6	164.8	0	0	0	111.6	D2815 M2817 F2821	D2815-I2819 WeakPolarHBondContact O-CB 3.27Å; D2815-I2819 WeakPolarHBondContact O-CD1 3.49Å; D2815-I2819 WeakPolarHBondContact O-CG1 3.23Å; D2815-I2819 PolarHBondContact O-N 2.91Å; M2817-I2819 VanDerWaalsContact C-N 3.29Å; M2817-I2819 PolarHBondContact O-N 3.02Å; I2819-F2821 VanDerWaalsContact C-N 3.27Å; I2819-F2821 PolarHBondContact O-N 3.27Å
2820	V	42.4	Very low	37.7	Very low	81 Å²	81	118.3 Å²	118.3	49%	0.491	67%	0.665	S	S	.	*	H	α-helix	trans	-69.1	-23.3	179	168	0	0	0	0	112.7	F2816 M2817	F2816-V2820 HydrophobicContact CD1-CG2 4.43Å; F2816-V2820 HydrophobicContact CE1-CG2 4.01Å; F2816-V2820 HydrophobicContact CZ-CG2 4.17Å; F2816-V2820 VanDerWaalsContact O-CG2 3.28Å; F2816-V2820 WeakPolarHBondContact O-CG2 3.39Å; F2816-V2820 PolarHBondContact O-N 3.39Å; M2817-V2820 PolarHBondContact O-N 3.01Å
2821	F	40.6	Very low	37.7	Very low	96 Å²	96	115.9 Å²	115.9	42%	0.421	67%	0.665	S	S	.	*	H	α-helix	trans	-102	-12.7	-179.4	-72.6	-67.8	0	0	0	116	F2411 M2817 D2818 I2819	F2411-F2821 HydrophobicContact CE1-CZ 4.11Å; F2411-F2821 HydrophobicContact CZ-CE1 4.48Å; F2411-F2821 AromaticContact CZ-CZ 3.71Å; F2411-F2821 HydrophobicContact CZ-CZ 3.71Å; M2817-F2821 VanDerWaalsContact O-CD2 3.24Å; M2817-F2821 WeakPolarHBondContact O-CD2 3.37Å; M2817-F2821 PolarHBondContact O-N 3.42Å; M2817-F2821 VanDerWaalsContact O-N 3.09Å; D2818-F2821 PolarHBondContact O-N 3.07Å; I2819-F2821 VanDerWaalsContact C-N 3.27Å; I2819-F2821 PolarHBondContact O-N 3.27Å
2822	N	38.2	Very low	37.5	Very low	113 Å²	113	116.8 Å²	116.8	60%	0.604	66%	0.661	S	S	*	*	H	α-helix	trans	-98.4	-12.1	-177.5	-77.6	-67.2	0	0	0	116.3	D2818 T2824	D2818-N2822 WeakPolarHBondContact O-CB 3.46Å; D2818-N2822 PolarHBondContact O-N 2.89Å; D2818-N2822 VanDerWaalsContact O-N 3.1Å; D2818-N2822 PolarHBondContact O-ND2 3.04Å; N2822-T2824 PolarHBondContact O-N 3.11Å
2823	E	33.9	Very low	37.1	Very low	177 Å²	177	122.7 Å²	122.7	83%	0.827	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	57.3	177.5	-69.8	-159.1	150.4	0	0	113.8
2824	T	32.1	Very low	36.7	Very low	131 Å²	131	122.9 Å²	122.9	80%	0.804	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.9	10	168.5	48.3	0	0	0	0	114.7	N2822	N2822-T2824 PolarHBondContact O-N 3.11Å
2825	T	32.1	Very low	36.1	Very low	120 Å²	120	123.6 Å²	123.6	74%	0.736	69%	0.687	S	S	*	*	S	Bend	trans	-142.7	163.3	163.3	50.8	0	0	0	0	112.9
2826	S	34.9	Very low	35.5	Very low	121 Å²	121	124.3 Å²	124.3	85%	0.846	70%	0.696	S	S	*	*			trans	72.5	115.1	175.9	78.6	0	0	0	0	117.5
2827	S	32	Very low	35.2	Very low	125 Å²	125	124 Å²	124	87%	0.874	70%	0.704	S	S	*	*			trans	-86	136.7	158.4	54.2	0	0	0	0	110.2
2828	G	31.9	Very low	34.5	Very low	66 Å²	66	126.8 Å²	126.8	68%	0.68	73%	0.725	S	S	*	*			trans	141.6	108.8	148.5	0	0	0	0	0	119.2
2829	S	33.9	Very low	34	Very low	133 Å²	133	127.5 Å²	127.5	93%	0.93	73%	0.734	S	S	*	*			trans	72.5	150.2	149.3	75.4	0	0	0	0	119.9
2830	L	29.6	Very low	33.5	Very low	147 Å²	147	129.5 Å²	129.5	77%	0.77	75%	0.751	S	S	*	*			trans	-122.3	156.3	-175.2	-161.4	88.8	0	0	0	108.9	K2832	L2830-K2832 HydrophobicContact CD2-CG 4.39Å
2831	P	34.9	Very low	33	Very low	124 Å²	124	130.5 Å²	130.5	81%	0.805	76%	0.758	S	S	*	*				-145.2	123.5	123.1	32.9	-15.9	0	0	0	116.9
2832	K	30.1	Very low	32.6	Very low	167 Å²	167	132.5 Å²	132.5	73%	0.726	78%	0.777	S	S	*	*			trans	0.1	141.7	143.7	-52.3	167.3	-175.7	171.3	0	119.3	L2830	L2830-K2832 HydrophobicContact CD2-CG 4.39Å
2833	Y	31.3	Very low	32.3	Very low	226 Å²	226	132.5 Å²	132.5	89%	0.886	78%	0.781	S	S	*	*				-144.2	170.8	120.2	-103.7	-72.6	0	0	0	111
2834	N	28.7	Very low	32	Very low	131 Å²	131	131.6 Å²	131.6	70%	0.701	78%	0.78	S	S	*	*			trans	-90.9	165	-155.3	-51.6	-47.6	0	0	0	114.2
2835	T	32	Very low	32	Very low	124 Å²	124	130 Å²	130	76%	0.761	78%	0.78	S	S	*	*				-170	126.7	90.1	-72	0	0	0	0	112.8
2836	T	33.5	Very low	31.9	Very low	127 Å²	127	130.8 Å²	130.8	78%	0.779	79%	0.785	S	S	*	*			trans	40.3	134.7	142.7	-53	0	0	0	0	121
2837	T	32.2	Very low	31.8	Very low	112 Å²	112	132.1 Å²	132.1	69%	0.687	79%	0.788	S	S	*	*			cis	-170.2	137	-10.9	-85.1	0	0	0	0	105.5
2838	T	32.4	Very low	31.8	Very low	134 Å²	134	131.2 Å²	131.2	82%	0.822	78%	0.782	S	S	*	*				-169.8	144.6	85.7	-45.3	0	0	0	0	110.2
2839	T	33.1	Very low	31.8	Very low	115 Å²	115	134.9 Å²	134.9	71%	0.706	79%	0.791	S	S	*	*			trans	-104.6	157.7	-168.5	30.3	0	0	0	0	115.7	T2841	T2839-T2841 HydrophobicContact CG2-CG2 4.09Å
2840	T	34	Very low	31.7	Very low	150 Å²	150	132.9 Å²	132.9	92%	0.92	78%	0.783	S	S	*	*			trans	-148.4	143.8	141.5	-64.1	0	0	0	0	107.6
2841	T	31	Very low	32	Very low	102 Å²	102	129.3 Å²	129.3	63%	0.626	78%	0.775	S	S	*	*			trans	-142.4	137.6	-147.3	50.1	0	0	0	0	116.5	T2839	T2839-T2841 HydrophobicContact CG2-CG2 4.09Å
2842	V	32.6	Very low	31.8	Very low	138 Å²	138	127.5 Å²	127.5	84%	0.836	76%	0.758	S	S	*	*			trans	-152.5	100.2	150.2	-164.6	0	0	0	0	106.6
2843	V	32.2	Very low	32.1	Very low	113 Å²	113	124.3 Å²	124.3	69%	0.685	76%	0.756	S	S	*	*				55.7	99.8	85.9	-175.1	0	0	0	0	111.9
2844	I	27.7	Very low	32.2	Very low	158 Å²	158	117.1 Å²	117.1	81%	0.81	74%	0.739	S	S	*	*			cis	74.3	112.4	48.7	-53.2	173	0	0	0	114.6
2845	A	31.8	Very low	32.6	Very low	97 Å²	97	118.9 Å²	118.9	80%	0.802	74%	0.742	S	S	*	*			trans	-167.7	141.8	147	0	0	0	0	0	111.4
2846	T	29.9	Very low	32.7	Very low	136 Å²	136	117.4 Å²	117.4	83%	0.834	74%	0.738	S	S	*	*			trans	-148.7	133.9	177.6	50.5	0	0	0	0	111.5
2847	T	34.1	Very low	32.8	Very low	149 Å²	149	115.9 Å²	115.9	91%	0.914	73%	0.732	S	S	*	*			trans	-153.3	157.2	170.5	42.3	0	0	0	0	111.2
2848	S	31.8	Very low	32.9	Very low	106 Å²	106	112.5 Å²	112.5	74%	0.741	71%	0.713	S	S	*	*			trans	-127.9	-175.6	-165.5	-50	0	0	0	0	113.5
2849	T	31.8	Very low	32.7	Very low	143 Å²	143	111.1 Å²	111.1	88%	0.877	70%	0.695	S	S	*	*			trans	68	150.1	163	49.7	0	0	0	0	117.8
2850	A	32.2	Very low	32.6	Very low	92 Å²	92	111.2 Å²	111.2	76%	0.76	69%	0.688	S	S	*	*			cis	-143.6	-148.3	-8.8	0	0	0	0	0	111
2851	A	34	Very low	32.6	Very low	72 Å²	72	108.4 Å²	108.4	60%	0.595	67%	0.674	S	S	*	*			trans	-140.2	-166	-154.3	0	0	0	0	0	116.8
2852	I	32	Very low	32.6	Very low	86 Å²	86	108.8 Å²	108.8	44%	0.441	68%	0.681	S	S	.	*			trans	92.7	126.7	168.7	-66	139.3	0	0	0	115.8	E2382	E2382-I2852 HydrophobicContact CB-CD1 4.23Å; E2382-I2852 HydrophobicContact CG-CD1 3.21Å
2853	S	35	Very low	32.3	Very low	99 Å²	99	109.9 Å²	109.9	69%	0.692	68%	0.682	S	S	*	*			cis	93.5	141.2	27.4	-157.2	0	0	0	0	112.1
2854	S	34.3	Very low	32.2	Very low	75 Å²	75	109.7 Å²	109.7	52%	0.524	69%	0.685	S	S	.	*			cis	-168.2	-172.2	0.1	21.5	0	0	0	0	111.4
2855	H	36.6	Very low	32.4	Very low	168 Å²	168	107.4 Å²	107.4	78%	0.778	68%	0.683	S	S	*	*			trans	88	146.3	153.8	-55.1	-51.4	0	0	0	119.2
2856	S	35	Very low	32.4	Very low	94 Å²	94	107.2 Å²	107.2	66%	0.657	68%	0.676	S	S	*	*			cis	-171.3	138.9	-12.2	47.3	0	0	0	0	116.5
2857	S	34.7	Very low	32.4	Very low	94 Å²	94	108 Å²	108	66%	0.657	67%	0.674	S	S	*	*			trans	73.3	170.3	139.2	90.7	0	0	0	0	119.9
2858	S	34.1	Very low	32.3	Very low	41 Å²	41	104.5 Å²	104.5	29%	0.287	66%	0.656	S	S	.	*			cis	-159.9	138.7	-1.8	17.3	0	0	0	0	116.7	S2081 I2082 T2083	S2081-S2858 PolarHBondContact N-OG 3.24Å; I2082-S2858 CarbonylContact C-O 3.53Å; I2082-S2858 WeakPolarHBondContact CA-O 3.44Å; I2082-S2858 PolarHBondContact N-O 3.21Å; T2083-S2858 PolarHBondContact N-O 3.44Å
2859	F	29.5	Very low	32.3	Very low	105 Å²	105	105 Å²	105	46%	0.461	65%	0.654	S	S	.	*			trans	72.4	158	136.7	-66.1	-150.1	0	0	0	118.3	P2080 S2081 I2082 T2083	P2080-F2859 HydrophobicContact CB-CD1 4.44Å; P2080-F2859 HydrophobicContact CB-CE1 3.71Å; P2080-F2859 HydrophobicContact CB-CE2 4.12Å; P2080-F2859 HydrophobicContact CB-CZ 3.51Å; P2080-F2859 HydrophobicContact CG-CE1 3.76Å; P2080-F2859 HydrophobicContact CG-CZ 3.85Å; S2081-F2859 WeakPolarHBondContact OG-CD1 3.46Å; S2081-F2859 VanDerWaalsContact OG-CE1 3.32Å; S2081-F2859 WeakPolarHBondContact OG-CE1 3.45Å; I2082-F2859 HydrophobicContact CG1-CB 3.97Å; T2083-F2859 WeakPolarHBondContact CA-O 3.33Å; T2083-F2859 PolarHBondContact N-O 3.45Å
2860	H	31.3	Very low	32.1	Very low	117 Å²	117	105.2 Å²	105.2	54%	0.542	65%	0.649	S	S	.	*			cis	-163.2	160.1	4.1	-140	-130.1	0	0	0	113.6	I2082	I2082-H2860 HydrophobicContact CD1-CB 4.23Å; I2082-H2860 HydrophobicContact CG1-CB 3.85Å
2861	S	32.3	Very low	32	Very low	92 Å²	92	107.6 Å²	107.6	64%	0.643	64%	0.644	S	S	*	*			trans	42.2	154.1	144.8	59.1	0	0	0	0	123.1
2862	S	30.8	Very low	31.8	Very low	109 Å²	109	110.4 Å²	110.4	76%	0.762	65%	0.648	S	S	*	*			cis	-159.8	174	13.3	27.2	0	0	0	0	113.9
2863	L	26.9	Very low	31.7	Very low	162 Å²	162	112.2 Å²	112.2	85%	0.848	67%	0.668	S	S	*	*			trans	-63.4	155.7	-174.2	-52.8	66.8	0	0	0	116.7
2864	S	30.2	Very low	31.5	Very low	108 Å²	108	111.9 Å²	111.9	76%	0.755	67%	0.671	S	S	*	*				169.7	131.3	107.7	66.8	0	0	0	0	117.6
2865	S	31.4	Very low	31.2	Very low	110 Å²	110	116 Å²	116	77%	0.769	69%	0.687	S	S	*	*			trans	74.6	138.6	137.3	-57.1	0	0	0	0	126
2866	S	32.8	Very low	30.8	Very low	94 Å²	94	113 Å²	113	66%	0.657	69%	0.685	S	S	*	*			trans	75.3	94.9	139.9	49.7	0	0	0	0	125.2
2867	L	29.7	Very low	30.6	Very low	151 Å²	151	114.5 Å²	114.5	79%	0.791	69%	0.69	S	S	*	*				72.3	132	114.6	-133.9	75.8	0	0	0	124.1
2868	S	32.5	Very low	30.4	Very low	77 Å²	77	115.7 Å²	115.7	54%	0.538	69%	0.693	S	S	.	*			trans	85.7	152.8	151.2	92	0	0	0	0	118.9
2869	T	30.4	Very low	30.1	Very low	115 Å²	115	118.1 Å²	118.1	71%	0.706	71%	0.71	S	S	*	*			cis	-171.8	132.6	-20.3	-99.6	0	0	0	0	111.8
2870	I	28.9	Very low	30.3	Very low	148 Å²	148	119.3 Å²	119.3	76%	0.759	73%	0.726	S	S	*	*			trans	68	152.9	158.6	-77.7	172.2	0	0	0	117.1
2871	Q	30.2	Very low	30.4	Very low	142 Å²	142	118.9 Å²	118.9	66%	0.664	74%	0.737	S	S	*	*			cis	-138.7	153.8	8.6	-140	-17.6	-113.2	0	0	113
2872	I	29.5	Very low	30.3	Very low	132 Å²	132	120.4 Å²	120.4	68%	0.677	75%	0.746	S	S	*	*			trans	-55	143.6	-179.7	-63.6	158.8	0	0	0	116.9
2873	S	29.5	Very low	30.4	Very low	124 Å²	124	122.6 Å²	122.6	87%	0.867	75%	0.748	S	S	*	*			trans	-167.1	81.7	132.8	44.5	0	0	0	0	113.5
2874	A	30.2	Very low	30.6	Very low	91 Å²	91	119.8 Å²	119.8	75%	0.752	74%	0.742	S	S	*	*			trans	-100.6	121.6	-178.1	0	0	0	0	0	113.3
2875	N	28	Very low	30.6	Very low	161 Å²	161	119.7 Å²	119.7	86%	0.861	74%	0.737	S	S	*	*			trans	-165.2	144.7	168.8	-95.5	-48.3	0	0	0	108.6
2876	S	28.8	Very low	30.5	Very low	105 Å²	105	121 Å²	121	73%	0.734	74%	0.74	S	S	*	*			trans	68.7	146.5	-155.9	-149.5	0	0	0	0	110.5
2877	V	31.4	Very low	30.5	Very low	126 Å²	126	123.8 Å²	123.8	76%	0.764	75%	0.746	S	S	*	*			cis	-132.3	145.6	31.4	-145.8	0	0	0	0	106.7
2878	V	30.8	Very low	30.5	Very low	119 Å²	119	122 Å²	122	72%	0.721	74%	0.742	S	S	*	*				58.2	129.5	55.9	161.6	0	0	0	0	110.5
2879	S	28.2	Very low	30.4	Very low	92 Å²	92	125.1 Å²	125.1	64%	0.643	76%	0.758	S	S	*	*			cis	-166.8	-167.6	-4.7	-104.5	0	0	0	0	110.5
2880	T	33.4	Very low	30.3	Very low	130 Å²	130	124.9 Å²	124.9	80%	0.798	76%	0.756	S	S	*	*			trans	78.1	127.5	168.6	74.8	0	0	0	0	116.2
2881	S	31.8	Very low	30.5	Very low	109 Å²	109	126.5 Å²	126.5	76%	0.762	76%	0.763	S	S	*	*			cis	92.7	103.1	-2.4	96.7	0	0	0	0	120.2
2882	C	30.7	Very low	30.4	Very low	123 Å²	123	124.1 Å²	124.1	83%	0.831	76%	0.761	S	S	*	*			trans	-165.6	148.3	147.5	53.1	0	0	0	0	110.9
2883	L	32.5	Very low	30.6	Very low	156 Å²	156	123.8 Å²	123.8	82%	0.817	77%	0.766	S	S	*	*			cis	-162.3	166.4	-34.3	-125.1	170.9	0	0	0	110.4
2884	S	31.8	Very low	30.7	Very low	102 Å²	102	124 Å²	124	71%	0.713	76%	0.764	S	S	*	*			trans	87.8	145.6	158.1	-55.6	0	0	0	0	120.7
2885	T	30.2	Very low	30.7	Very low	107 Å²	107	125.7 Å²	125.7	66%	0.656	77%	0.765	S	S	*	*			cis	-160.1	131.6	-30	-80	0	0	0	0	106.8	I2887	T2885-I2887 HydrophobicContact CG2-CG1 4.3Å
2886	V	30	Very low	30.9	Very low	137 Å²	137	126.3 Å²	126.3	83%	0.83	77%	0.767	S	S	*	*			trans	-133.6	122.8	169.1	-179.2	0	0	0	0	109.5
2887	I	32.5	Very low	31	Very low	153 Å²	153	126.4 Å²	126.4	79%	0.785	77%	0.767	S	S	*	*			trans	-89.7	135	-179.9	-64.5	176.3	0	0	0	109.8	T2885	T2885-I2887 HydrophobicContact CG2-CG1 4.3Å
2888	T	28.7	Very low	31.2	Very low	114 Å²	114	125.3 Å²	125.3	70%	0.699	77%	0.765	S	S	*	*			trans	-105.2	132.2	-177.4	-43.7	0	0	0	0	110.9	T2890	T2888-T2890 HydrophobicContact CG2-CG2 4.19Å
2889	T	31.7	Very low	31.3	Very low	142 Å²	142	126 Å²	126	87%	0.871	77%	0.77	S	S	*	*			trans	-133.5	108.2	157.4	49.3	0	0	0	0	110
2890	T	28.1	Very low	31.7	Very low	109 Å²	109	129.7 Å²	129.7	67%	0.669	78%	0.782	S	S	*	*			trans	-92.3	156	170.9	46.1	0	0	0	0	110.7	T2888	T2888-T2890 HydrophobicContact CG2-CG2 4.19Å
2891	M	31.7	Very low	31.6	Very low	183 Å²	183	129.5 Å²	129.5	90%	0.901	78%	0.78	S	S	*	*			trans	-147.3	153.3	152.5	-89.3	-60.2	107.5	0	0	108.3
2892	S	29.7	Very low	31.8	Very low	91 Å²	91	130.5 Å²	130.5	64%	0.636	79%	0.787	S	S	*	*			trans	-147.2	141.7	-151.9	54.5	0	0	0	0	114.7
2893	T	31.9	Very low	31.9	Very low	126 Å²	126	130.1 Å²	130.1	77%	0.773	79%	0.786	S	S	*	*			trans	46.3	139.1	139.6	59.4	0	0	0	0	120
2894	P	33.3	Very low	32	Very low	128 Å²	128	130 Å²	130	83%	0.831	79%	0.791	S	S	*	*				-155.1	-173.6	65.2	41.2	-19.3	0	0	0	118.3
2895	T	30.3	Very low	31.7	Very low	126 Å²	126	129.6 Å²	129.6	77%	0.773	79%	0.789	S	S	*	*			trans	-108.6	159.9	-174.9	49.2	0	0	0	0	113.9
2896	I	31.9	Very low	31.7	Very low	174 Å²	174	132.1 Å²	132.1	89%	0.892	80%	0.797	S	S	*	*			trans	-134.9	154.2	162.3	-62.5	-176.8	0	0	0	110.1
2897	S	31.4	Very low	31.6	Very low	107 Å²	107	130.7 Å²	130.7	75%	0.748	79%	0.794	S	S	*	*			trans	-147.8	148.5	-172.6	-54.5	0	0	0	0	113.7
2898	S	34.5	Very low	31.7	Very low	103 Å²	103	129 Å²	129	72%	0.72	79%	0.786	S	S	*	*			trans	-176.7	110.7	162.6	52.2	0	0	0	0	110.1
2899	T	33.3	Very low	31.9	Very low	133 Å²	133	130.7 Å²	130.7	82%	0.816	80%	0.797	S	S	*	*				68.2	120.3	74.3	61.9	0	0	0	0	116.8
2900	L	35.9	Very low	32.4	Very low	170 Å²	170	131.3 Å²	131.3	89%	0.89	79%	0.787	S	S	*	*			trans	-169.6	162.9	132.7	-105.6	165.8	0	0	0	111.7
2901	T	31.9	Very low	33.6	Very low	126 Å²	126	134.4 Å²	134.4	77%	0.773	79%	0.794	S	S	*	*			trans	-134.5	153.5	-160.6	48.8	0	0	0	0	113.8
2902	S	36.9	Very low	35.4	Very low	130 Å²	130	128.5 Å²	128.5	91%	0.909	77%	0.771	S	S	*	*			trans	-170.8	152.1	148.5	-83.7	0	0	0	0	111.5
2903	S	31.2	Very low	38	Very low	115 Å²	115	129 Å²	129	80%	0.804	77%	0.765	S	S	*	*			trans	-132.9	132.2	-173.4	54.8	0	0	0	0	112.7
2904	V	35	Very low	40.7	Very low	153 Å²	153	126.4 Å²	126.4	93%	0.927	74%	0.742	S	S	*	*			trans	-140.5	149.7	166.9	-176.8	0	0	0	0	109.1
2905	S	26.6	Very low	43.3	Very low	95 Å²	95	124 Å²	124	66%	0.664	72%	0.724	S	S	*	*			trans	-105.7	153.8	-170.6	54.5	0	0	0	0	114.9
2906	L	30.3	Very low	46.3	Very low	159 Å²	159	118 Å²	118	83%	0.832	69%	0.688	S	S	*	*			trans	68.7	148.4	158.4	-95.2	70.3	0	0	0	119.8
2907	S	27.9	Very low	48.9	Very low	108 Å²	108	116.1 Å²	116.1	76%	0.755	68%	0.675	S	S	*	*			trans	74.7	162.4	163	-12.6	0	0	0	0	119.5
2908	D	33.3	Very low	51.4	Low	116 Å²	116	115.4 Å²	115.4	62%	0.62	66%	0.662	S	S	*	*			trans	65.9	111.9	169.8	-72.9	8.4	0	0	0	120.5	K2910	D2908-K2910 HydrophobicContact CB-CD 4.22Å; D2908-K2910 HydrophobicContact CB-CG 4.45Å; D2908-K2910 PolarHBondContact O-N 2.97Å; D2908-K2910 WeakPolarHBondContact OD2-CE 3.42Å; D2908-K2910 IonicContact OD2-NZ 4Å; D2908-K2910 PolarHBondContact OD2-NZ 3.03Å
2909	T	33.3	Very low	54.1	Low	150 Å²	150	113.1 Å²	113.1	92%	0.92	65%	0.645	S	S	*	*			trans	-64.2	96.5	160.7	48.2	0	0	0	0	111.5
2910	K	42.8	Very low	56.7	Low	155 Å²	155	112.8 Å²	112.8	67%	0.674	64%	0.639	S	S	*	*			trans	-118.1	135.9	173	-76.4	166.7	-174.9	150.6	0	111.7	D2908 S2912	D2908-K2910 HydrophobicContact CB-CD 4.22Å; D2908-K2910 HydrophobicContact CB-CG 4.45Å; D2908-K2910 PolarHBondContact O-N 2.97Å; D2908-K2910 WeakPolarHBondContact OD2-CE 3.42Å; D2908-K2910 IonicContact OD2-NZ 4Å; D2908-K2910 PolarHBondContact OD2-NZ 3.03Å; K2910-S2912 PolarHBondContact O-N 2.82Å; K2910-S2912 VanDerWaalsContact O-N 3.09Å
2911	H	53.6	Low	59.3	Low	174 Å²	174	110.9 Å²	110.9	81%	0.806	62%	0.623	S	S	*	*			trans	-66.3	108.4	-176.5	-63.4	-49.3	0	0	0	111	I2913	H2911-I2913 PolarHBondContact O-N 2.75Å
2912	S	67.5	Low	62	Low	60 Å²	60	108.4 Å²	108.4	42%	0.42	61%	0.611	S	S	.	*			trans	-69.8	114.9	175.7	22.4	0	0	0	0	110.2	K2910 Y2914	K2910-S2912 PolarHBondContact O-N 2.82Å; K2910-S2912 VanDerWaalsContact O-N 3.09Å; S2912-Y2914 WeakPolarHBondContact CB-OH 3.41Å; S2912-Y2914 WeakPolarHBondContact O-CD2 3.06Å; S2912-Y2914 WeakPolarHBondContact O-CE2 3.29Å; S2912-Y2914 PolarHBondContact OG-OH 3Å
2913	I	85.1	Confident	64.6	Low	100 Å²	100	103.7 Å²	103.7	51%	0.513	57%	0.574	S	S	.	*			trans	-86.1	113.9	174.4	-62.7	176.6	0	0	0	108.5	H2911 S2922	H2911-I2913 PolarHBondContact O-N 2.75Å; I2913-S2922 VanDerWaalsContact CG2-CB 3.45Å
2914	Y	88.2	Confident	67.2	Low	73 Å²	73	104.5 Å²	104.5	29%	0.286	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.8	109.1	179.8	-59	-83.3	0	0	0	110	S2912 F2923 I2926	S2912-Y2914 WeakPolarHBondContact CB-OH 3.41Å; S2912-Y2914 WeakPolarHBondContact O-CD2 3.06Å; S2912-Y2914 WeakPolarHBondContact O-CE2 3.29Å; S2912-Y2914 PolarHBondContact OG-OH 3Å; Y2914-F2923 WeakPolarHBondContact CB-O 3.48Å; Y2914-F2923 WeakPolarHBondContact CD2-O 3.45Å; Y2914-F2923 PolarHBondContact N-O 2.98Å; Y2914-F2923 WeakPolarHBondContact O-CD2 3.18Å; Y2914-F2923 PolarHBondContact O-N 2.83Å; Y2914-I2926 HydrophobicContact CD1-CD1 4.49Å; Y2914-I2926 HydrophobicContact CD1-CG1 3.73Å; Y2914-I2926 HydrophobicContact CD2-CG1 3.96Å; Y2914-I2926 HydrophobicContact CE1-CD1 3.73Å; Y2914-I2926 HydrophobicContact CE1-CG1 3.35Å; Y2914-I2926 HydrophobicContact CE2-CD1 4.49Å; Y2914-I2926 HydrophobicContact CE2-CG1 3.64Å; Y2914-I2926 HydrophobicContact CG-CG1 4.02Å
2915	T	89.2	Confident	69.8	Low	76 Å²	76	104.6 Å²	104.6	47%	0.466	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.4	144.3	178.8	47.9	0	0	0	0	112.9	K2921 R2929	T2915-K2921 CarbonylContact C-O 3.6Å; T2915-K2921 WeakPolarHBondContact CA-O 3.47Å; T2915-R2929 VanDerWaalsContact O-CZ 3.27Å; T2915-R2929 PolarHBondContact O-NE 3.13Å; T2915-R2929 PolarHBondContact O-NH2 2.86Å
2916	C	91.9	Very high	72.8	Confident	1 Å²	1	104.2 Å²	104.2	1%	0.007	54%	0.542	C	S	.	.			trans	-70.4	130.4	165.1	175	0	0	0	0	110	I2918 C2919 N2920 K2921 F2923 H2932 M2933 H2936	C2916-I2918 VanDerWaalsContact C-N 3.33Å; C2916-I2918 PolarHBondContact SG-N 2.86Å; C2916-I2918 VanDerWaalsContact SG-N 3.39Å; C2916-C2919 PolarHBondContact SG-N 3.09Å; C2916-N2920 WeakPolarHBondContact O-CA 3.12Å; C2916-N2920 PolarHBondContact O-N 3.19Å; C2916-N2920 PolarHBondContact O-OD1 3.29Å; C2916-K2921 HydrophobicContact CB-CB 4.37Å; C2916-K2921 WeakPolarHBondContact CB-O 3.3Å; C2916-K2921 PolarHBondContact N-O 3.38Å; C2916-F2923 HydrophobicContact CB-CE2 4.27Å; C2916-H2932 PolarHBondContact SG-NE2 2.87Å; C2916-M2933 HydrophobicContact CB-CE 4.17Å; C2916-M2933 WeakPolarHBondContact SG-CE 3.36Å; C2916-H2936 PolarHBondContact SG-NE2 3.39Å; C2916-H2936 VanDerWaalsContact SG-NE2 3.42Å
2917	H	86.8	Confident	75.5	Confident	134 Å²	134	105.6 Å²	105.6	62%	0.62	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-1.3	178.3	65.3	-91	0	0	0	114.1	M2933	H2917-M2933 PolarHBondContact CE1-SD 3.4Å; H2917-M2933 PolarHBondContact ND1-SD 3.09Å; H2917-M2933 VanDerWaalsContact ND1-SD 3.44Å
2918	I	84.7	Confident	78.5	Confident	92 Å²	92	103.3 Å²	103.3	47%	0.472	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-29	-175.1	-51.9	175.8	0	0	0	111.4	C2916 M2933 H2936	C2916-I2918 VanDerWaalsContact C-N 3.33Å; C2916-I2918 PolarHBondContact SG-N 2.86Å; C2916-I2918 VanDerWaalsContact SG-N 3.39Å; I2918-M2933 HydrophobicContact CD1-CE 3.97Å; I2918-M2933 HydrophobicContact CG1-CE 4.08Å; I2918-H2936 HydrophobicContact CD1-CB 3.53Å; I2918-H2936 HydrophobicContact CG2-CB 4.2Å; I2918-H2936 WeakPolarHBondContact CG2-ND1 3.26Å
2919	C	91.2	Very high	81.2	Confident	55 Å²	55	101.2 Å²	101.2	37%	0.372	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.6	25.2	175.7	79.9	0	0	0	0	113.8	C2916 K2921 H2932 H2936	C2916-C2919 PolarHBondContact SG-N 3.09Å; C2919-K2921 PolarHBondContact O-N 3.03Å; C2919-H2932 VanDerWaalsContact SG-CE1 3.58Å; C2919-H2932 PolarHBondContact SG-NE2 3.18Å; C2919-H2936 VanDerWaalsContact SG-CE1 3.51Å
2920	N	87.5	Confident	83.9	Confident	127 Å²	127	97.8 Å²	97.8	68%	0.679	49%	0.485	S	S	*	.			trans	57.4	0.1	167.9	-59.2	-13.5	0	0	0	118.6	C2916 S2922	C2916-N2920 WeakPolarHBondContact O-CA 3.12Å; C2916-N2920 PolarHBondContact O-N 3.19Å; C2916-N2920 PolarHBondContact O-OD1 3.29Å; N2920-S2922 PolarHBondContact O-N 3.11Å
2921	K	89.9	Confident	86.1	Confident	129 Å²	129	93.1 Å²	93.1	56%	0.561	48%	0.476	S	S	*	.			trans	-55.1	133	173.8	-76.7	-177.8	178.6	-72.7	0	111.9	T2915 C2916 C2919 F2923	T2915-K2921 CarbonylContact C-O 3.6Å; T2915-K2921 WeakPolarHBondContact CA-O 3.47Å; C2916-K2921 HydrophobicContact CB-CB 4.37Å; C2916-K2921 WeakPolarHBondContact CB-O 3.3Å; C2916-K2921 PolarHBondContact N-O 3.38Å; C2919-K2921 PolarHBondContact O-N 3.03Å; K2921-F2923 HydrophobicContact CB-CE2 3.74Å; K2921-F2923 HydrophobicContact CB-CZ 3.86Å; K2921-F2923 WeakPolarHBondContact O-CD2 3.37Å; K2921-F2923 VanDerWaalsContact O-CE2 3.24Å; K2921-F2923 WeakPolarHBondContact O-CE2 3.46Å
2922	S	89.5	Confident	87.9	Confident	74 Å²	74	86.2 Å²	86.2	52%	0.517	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	141.6	-178.9	40.8	0	0	0	0	112.2	I2913 N2920	I2913-S2922 VanDerWaalsContact CG2-CB 3.45Å; N2920-S2922 PolarHBondContact O-N 3.11Å
2923	F	90.8	Very high	88.9	Confident	32 Å²	32	84.6 Å²	84.6	14%	0.14	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	130.6	-178	-60.2	-85.6	0	0	0	111.5	Y2914 C2916 K2921 K2925 S2928 R2929 H2932	Y2914-F2923 WeakPolarHBondContact CB-O 3.48Å; Y2914-F2923 WeakPolarHBondContact CD2-O 3.45Å; Y2914-F2923 PolarHBondContact N-O 2.98Å; Y2914-F2923 WeakPolarHBondContact O-CD2 3.18Å; Y2914-F2923 PolarHBondContact O-N 2.83Å; C2916-F2923 HydrophobicContact CB-CE2 4.27Å; K2921-F2923 HydrophobicContact CB-CE2 3.74Å; K2921-F2923 HydrophobicContact CB-CZ 3.86Å; K2921-F2923 WeakPolarHBondContact O-CD2 3.37Å; K2921-F2923 VanDerWaalsContact O-CE2 3.24Å; K2921-F2923 WeakPolarHBondContact O-CE2 3.46Å; F2923-K2925 PolarHBondContact O-N 3.23Å; F2923-S2928 VanDerWaalsContact CD1-OG 3.32Å; F2923-S2928 WeakPolarHBondContact CD1-OG 3.28Å; F2923-R2929 HydrophobicContact CB-CB 4Å; F2923-R2929 HydrophobicContact CD2-CB 3.9Å; F2923-R2929 HydrophobicContact CD2-CG 3.96Å; F2923-R2929 HydrophobicContact CG-CB 4.09Å; F2923-H2932 HydrophobicContact CE1-CB 4Å; F2923-H2932 HydrophobicContact CE2-CB 3.96Å; F2923-H2932 AromaticContact CE2-CD2 3.4Å; F2923-H2932 VanDerWaalsContact CE2-CD2 3.4Å; F2923-H2932 WeakPolarHBondContact CE2-CD2 3.29Å; F2923-H2932 AromaticContact CE2-CG 3.83Å; F2923-H2932 HydrophobicContact CZ-CB 3.43Å; F2923-H2932 VanDerWaalsContact CZ-CB 3.43Å; F2923-H2932 AromaticContact CZ-CD2 3.42Å; F2923-H2932 VanDerWaalsContact CZ-CD2 3.42Å; F2923-H2932 WeakPolarHBondContact CZ-CD2 3.29Å; F2923-H2932 AromaticContact CZ-CG 3.38Å
2924	H	86.1	Confident	88.9	Confident	132 Å²	132	86.7 Å²	86.7	61%	0.611	44%	0.435	S	S	*	.	S	Bend	trans	-77.9	0.8	179	-65.8	90.9	0	0	0	114.5
2925	K	89.1	Confident	88.8	Confident	155 Å²	155	86.2 Å²	86.2	67%	0.674	44%	0.44	S	S	*	.	S	Bend	trans	-145.7	128.4	-178.1	-62.6	-179.1	-178	175	0	110.2	F2923 K2927 S2928 R2929	F2923-K2925 PolarHBondContact O-N 3.23Å; K2925-K2927 PolarHBondContact O-N 3.13Å; K2925-K2927 VanDerWaalsContact O-N 3.16Å; K2925-S2928 WeakPolarHBondContact O-CB 3.32Å; K2925-S2928 PolarHBondContact O-N 3.17Å; K2925-R2929 PolarHBondContact O-N 3.39Å
2926	I	89.5	Confident	88.4	Confident	86 Å²	86	83.9 Å²	83.9	44%	0.441	42%	0.424	S	S	.	.	H	α-helix	trans	-50.4	-42.3	177.8	-61.5	176.4	0	0	0	111.9	Y2914 S2928 R2929 N2930	Y2914-I2926 HydrophobicContact CD1-CD1 4.49Å; Y2914-I2926 HydrophobicContact CD1-CG1 3.73Å; Y2914-I2926 HydrophobicContact CD2-CG1 3.96Å; Y2914-I2926 HydrophobicContact CE1-CD1 3.73Å; Y2914-I2926 HydrophobicContact CE1-CG1 3.35Å; Y2914-I2926 HydrophobicContact CE2-CD1 4.49Å; Y2914-I2926 HydrophobicContact CE2-CG1 3.64Å; Y2914-I2926 HydrophobicContact CG-CG1 4.02Å; I2926-S2928 VanDerWaalsContact C-N 3.26Å; I2926-S2928 PolarHBondContact O-N 3.01Å; I2926-R2929 PolarHBondContact O-N 3.17Å; I2926-N2930 WeakPolarHBondContact O-CB 3.4Å; I2926-N2930 PolarHBondContact O-N 3.26Å; I2926-N2930 PolarHBondContact O-OD1 3.18Å
2927	K	87.7	Confident	87.3	Confident	188 Å²	188	87.5 Å²	87.5	82%	0.817	45%	0.449	S	S	*	.	H	α-helix	trans	-57.9	-36.4	178.7	-68.7	-176.1	178.1	179.4	0	112.8	K2925 A2931	K2925-K2927 PolarHBondContact O-N 3.13Å; K2925-K2927 VanDerWaalsContact O-N 3.16Å; K2927-A2931 WeakPolarHBondContact O-CB 3.36Å; K2927-A2931 PolarHBondContact O-N 2.79Å
2928	S	90.1	Very high	85.9	Confident	60 Å²	60	86 Å²	86	42%	0.42	45%	0.446	S	S	.	.	H	α-helix	trans	-74.8	-43.9	177.9	-167.3	0	0	0	0	111.4	F2923 K2925 I2926 N2930 A2931 H2932	F2923-S2928 VanDerWaalsContact CD1-OG 3.32Å; F2923-S2928 WeakPolarHBondContact CD1-OG 3.28Å; K2925-S2928 WeakPolarHBondContact O-CB 3.32Å; K2925-S2928 PolarHBondContact O-N 3.17Å; I2926-S2928 VanDerWaalsContact C-N 3.26Å; I2926-S2928 PolarHBondContact O-N 3.01Å; S2928-N2930 VanDerWaalsContact C-N 3.32Å; S2928-N2930 PolarHBondContact O-N 3.23Å; S2928-A2931 PolarHBondContact O-N 2.79Å; S2928-H2932 PolarHBondContact O-N 2.89Å
2929	R	91.6	Very high	84.6	Confident	72 Å²	72	88.9 Å²	88.9	27%	0.272	46%	0.455	S	S	.	.	H	α-helix	trans	-54.5	-47.9	171.2	-166.9	-122.5	-165.3	-174.5	5.6	111.3	T2915 F2923 K2925 I2926 H2932 M2933	T2915-R2929 VanDerWaalsContact O-CZ 3.27Å; T2915-R2929 PolarHBondContact O-NE 3.13Å; T2915-R2929 PolarHBondContact O-NH2 2.86Å; F2923-R2929 HydrophobicContact CB-CB 4Å; F2923-R2929 HydrophobicContact CD2-CB 3.9Å; F2923-R2929 HydrophobicContact CD2-CG 3.96Å; F2923-R2929 HydrophobicContact CG-CB 4.09Å; K2925-R2929 PolarHBondContact O-N 3.39Å; I2926-R2929 PolarHBondContact O-N 3.17Å; R2929-H2932 PolarHBondContact O-N 2.91Å; R2929-M2933 WeakPolarHBondContact O-CG 3.48Å; R2929-M2933 PolarHBondContact O-N 3.04Å
2930	N	88.5	Confident	82.6	Confident	78 Å²	78	93.6 Å²	93.6	42%	0.417	48%	0.476	S	S	.	.	H	α-helix	trans	-71.7	-30	-178.1	-70	5.4	0	0	0	113.2	I2926 S2928	I2926-N2930 WeakPolarHBondContact O-CB 3.4Å; I2926-N2930 PolarHBondContact O-N 3.26Å; I2926-N2930 PolarHBondContact O-OD1 3.18Å; S2928-N2930 VanDerWaalsContact C-N 3.32Å; S2928-N2930 PolarHBondContact O-N 3.23Å
2931	A	89.6	Confident	80.6	Confident	58 Å²	58	92.5 Å²	92.5	48%	0.479	47%	0.474	S	S	.	.	H	α-helix	trans	-64.4	-45.4	168.9	0	0	0	0	0	110.7	K2927 S2928 M2933 K2934	K2927-A2931 WeakPolarHBondContact O-CB 3.36Å; K2927-A2931 PolarHBondContact O-N 2.79Å; S2928-A2931 PolarHBondContact O-N 2.79Å; A2931-M2933 PolarHBondContact O-N 2.95Å; A2931-K2934 WeakPolarHBondContact O-CB 3.32Å; A2931-K2934 PolarHBondContact O-N 2.96Å
2932	H	92.1	Very high	78.1	Confident	28 Å²	28	92.8 Å²	92.8	13%	0.13	48%	0.482	C	S	.	.	H	α-helix	trans	-66	-34.6	176.2	173.7	61.9	0	0	0	113.6	C2916 C2919 F2923 S2928 R2929 K2934 T2935 H2936	C2916-H2932 PolarHBondContact SG-NE2 2.87Å; C2919-H2932 VanDerWaalsContact SG-CE1 3.58Å; C2919-H2932 PolarHBondContact SG-NE2 3.18Å; F2923-H2932 HydrophobicContact CE1-CB 4Å; F2923-H2932 HydrophobicContact CE2-CB 3.96Å; F2923-H2932 AromaticContact CE2-CD2 3.4Å; F2923-H2932 VanDerWaalsContact CE2-CD2 3.4Å; F2923-H2932 WeakPolarHBondContact CE2-CD2 3.29Å; F2923-H2932 AromaticContact CE2-CG 3.83Å; F2923-H2932 HydrophobicContact CZ-CB 3.43Å; F2923-H2932 VanDerWaalsContact CZ-CB 3.43Å; F2923-H2932 AromaticContact CZ-CD2 3.42Å; F2923-H2932 VanDerWaalsContact CZ-CD2 3.42Å; F2923-H2932 WeakPolarHBondContact CZ-CD2 3.29Å; F2923-H2932 AromaticContact CZ-CG 3.38Å; S2928-H2932 PolarHBondContact O-N 2.89Å; R2929-H2932 PolarHBondContact O-N 2.91Å; H2932-K2934 PolarHBondContact O-N 2.83Å; H2932-T2935 PolarHBondContact ND1-OG1 3.22Å; H2932-T2935 WeakPolarHBondContact O-CB 3.45Å; H2932-T2935 PolarHBondContact O-N 3.34Å; H2932-T2935 PolarHBondContact O-OG1 3.23Å; H2932-H2936 AromaticContact CD2-NE2 3.89Å; H2932-H2936 AromaticContact CE1-CE1 3.96Å; H2932-H2936 AromaticContact CE1-NE2 3.18Å; H2932-H2936 PolarHBondContact CE1-NE2 3.3Å; H2932-H2936 AromaticContact NE2-CD2 3.89Å; H2932-H2936 AromaticContact NE2-NE2 3.02Å; H2932-H2936 PolarHBondContact NE2-NE2 3.11Å
2933	M	87.3	Confident	75.6	Confident	27 Å²	27	96.3 Å²	96.3	13%	0.133	50%	0.495	C	S	.	.	H	α-helix	trans	-58.6	-32.5	176.3	-64.5	-89.5	68.7	0	0	112.5	C2916 H2917 I2918 R2929 A2931 T2935 H2936 S2937	C2916-M2933 HydrophobicContact CB-CE 4.17Å; C2916-M2933 WeakPolarHBondContact SG-CE 3.36Å; H2917-M2933 PolarHBondContact CE1-SD 3.4Å; H2917-M2933 PolarHBondContact ND1-SD 3.09Å; H2917-M2933 VanDerWaalsContact ND1-SD 3.44Å; I2918-M2933 HydrophobicContact CD1-CE 3.97Å; I2918-M2933 HydrophobicContact CG1-CE 4.08Å; R2929-M2933 WeakPolarHBondContact O-CG 3.48Å; R2929-M2933 PolarHBondContact O-N 3.04Å; A2931-M2933 PolarHBondContact O-N 2.95Å; M2933-T2935 VanDerWaalsContact C-N 3.34Å; M2933-T2935 PolarHBondContact O-N 2.6Å; M2933-H2936 PolarHBondContact O-N 3.34Å; M2933-S2937 PolarHBondContact O-OG 3.41Å
2934	K	85.3	Confident	73.1	Confident	143 Å²	143	103.7 Å²	103.7	62%	0.622	53%	0.53	S	S	*	.	H	α-helix	trans	-63.9	-37.2	174.7	-63.2	179.5	179.3	-171.6	0	112.4	A2931 H2932 H2936 S2937 D2938	A2931-K2934 WeakPolarHBondContact O-CB 3.32Å; A2931-K2934 PolarHBondContact O-N 2.96Å; H2932-K2934 PolarHBondContact O-N 2.83Å; K2934-H2936 PolarHBondContact O-N 2.94Å; K2934-S2937 WeakPolarHBondContact O-CA 3.43Å; K2934-S2937 VanDerWaalsContact O-CB 3.23Å; K2934-S2937 WeakPolarHBondContact O-CB 3.31Å; K2934-S2937 PolarHBondContact O-N 2.86Å; K2934-D2938 PolarHBondContact O-N 3Å; K2934-D2938 VanDerWaalsContact O-OD2 3.13Å
2935	T	85.7	Confident	71.1	Confident	64 Å²	64	103.3 Å²	103.3	39%	0.393	54%	0.542	S	S	.	.	H	α-helix	trans	-64.7	-7.9	179.1	70.4	0	0	0	0	115	H2932 M2933 K2939	H2932-T2935 PolarHBondContact ND1-OG1 3.22Å; H2932-T2935 WeakPolarHBondContact O-CB 3.45Å; H2932-T2935 PolarHBondContact O-N 3.34Å; H2932-T2935 PolarHBondContact O-OG1 3.23Å; M2933-T2935 VanDerWaalsContact C-N 3.34Å; M2933-T2935 PolarHBondContact O-N 2.6Å; T2935-K2939 WeakPolarHBondContact O-CE 3.36Å
2936	H	82.2	Confident	68.7	Low	26 Å²	26	104.9 Å²	104.9	12%	0.12	54%	0.544	C	S	.	.	H	α-helix	trans	-96.3	-27.5	167.7	-62.2	-74	0	0	0	112.8	C2916 I2918 C2919 H2932 M2933 K2934 D2938 K2939	C2916-H2936 PolarHBondContact SG-NE2 3.39Å; C2916-H2936 VanDerWaalsContact SG-NE2 3.42Å; I2918-H2936 HydrophobicContact CD1-CB 3.53Å; I2918-H2936 HydrophobicContact CG2-CB 4.2Å; I2918-H2936 WeakPolarHBondContact CG2-ND1 3.26Å; C2919-H2936 VanDerWaalsContact SG-CE1 3.51Å; H2932-H2936 AromaticContact CD2-NE2 3.89Å; H2932-H2936 AromaticContact CE1-CE1 3.96Å; H2932-H2936 AromaticContact CE1-NE2 3.18Å; H2932-H2936 PolarHBondContact CE1-NE2 3.3Å; H2932-H2936 AromaticContact NE2-CD2 3.89Å; H2932-H2936 AromaticContact NE2-NE2 3.02Å; H2932-H2936 PolarHBondContact NE2-NE2 3.11Å; M2933-H2936 PolarHBondContact O-N 3.34Å; K2934-H2936 PolarHBondContact O-N 2.94Å; H2936-D2938 VanDerWaalsContact C-N 3.3Å; H2936-D2938 PolarHBondContact O-N 3.03Å; H2936-K2939 PolarHBondContact O-N 3.32Å
2937	S	67.3	Low	66.6	Low	77 Å²	77	112.2 Å²	112.2	54%	0.538	57%	0.566	S	S	.	*	H	α-helix	trans	-63.6	-38.5	174.7	-50.3	0	0	0	0	111.2	M2933 K2934 K2939	M2933-S2937 PolarHBondContact O-OG 3.41Å; K2934-S2937 WeakPolarHBondContact O-CA 3.43Å; K2934-S2937 VanDerWaalsContact O-CB 3.23Å; K2934-S2937 WeakPolarHBondContact O-CB 3.31Å; K2934-S2937 PolarHBondContact O-N 2.86Å; S2937-K2939 PolarHBondContact O-N 2.84Å
2938	D	59.1	Low	64.7	Low	103 Å²	103	112 Å²	112	55%	0.551	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-11.6	-177.9	-54	-43.2	0	0	0	114	K2934 H2936	K2934-D2938 PolarHBondContact O-N 3Å; K2934-D2938 VanDerWaalsContact O-OD2 3.13Å; H2936-D2938 VanDerWaalsContact C-N 3.3Å; H2936-D2938 PolarHBondContact O-N 3.03Å
2939	K	56.1	Low	62.4	Low	152 Å²	152	118.9 Å²	118.9	66%	0.661	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-23.9	-175.5	-68.2	-174.3	178.2	-171.5	0	114.6	T2935 H2936 S2937	T2935-K2939 WeakPolarHBondContact O-CE 3.36Å; H2936-K2939 PolarHBondContact O-N 3.32Å; S2937-K2939 PolarHBondContact O-N 2.84Å
2940	N	49.7	Very low	60.1	Low	155 Å²	155	127.2 Å²	127.2	83%	0.829	63%	0.633	S	S	*	*	S	Bend	trans	-91.5	3.7	-173.4	-83.4	11.5	0	0	0	114.6
2941	T	44.9	Very low	58.7	Low	104 Å²	104	129.7 Å²	129.7	64%	0.638	64%	0.644	S	S	*	*	S	Bend	trans	-115.8	-6.4	-169.1	51.2	0	0	0	0	115.4
2942	N	38.9	Very low	57	Low	135 Å²	135	133.5 Å²	133.5	72%	0.722	65%	0.653	S	S	*	*	S	Bend	trans	-111	57.5	-172.4	-79.8	-44.8	0	0	0	113.6
2943	N	36.3	Very low	55.1	Low	148 Å²	148	139.3 Å²	139.3	79%	0.791	68%	0.682	S	S	*	*	S	Bend	trans	-153.1	157.3	160.6	-98	-44.2	0	0	0	112.8	S2945	N2943-S2945 PolarHBondContact O-N 3.31Å
2944	H	38.7	Very low	53.2	Low	187 Å²	187	145.9 Å²	145.9	87%	0.866	71%	0.714	S	S	*	*	S	Bend	trans	63.3	-50	175.4	-89.9	-74	0	0	0	121.4	R2946	H2944-R2946 PolarHBondContact O-N 3.29Å
2945	S	42.5	Very low	51.2	Low	124 Å²	124	146.1 Å²	146.1	87%	0.867	72%	0.72	S	S	*	*	S	Bend	trans	-89.6	21.3	-151.6	-56.2	0	0	0	0	118.8	N2943	N2943-S2945 PolarHBondContact O-N 3.31Å
2946	R	39.6	Very low	48.9	Very low	188 Å²	188	151.6 Å²	151.6	71%	0.709	74%	0.742	S	S	*	*	S	Bend	trans	-129.3	28.4	-172	-152.8	-178.9	165.3	-151.6	-12.8	115.9	H2944	H2944-R2946 PolarHBondContact O-N 3.29Å
2947	R	44.8	Very low	46.5	Very low	240 Å²	240	160.6 Å²	160.6	91%	0.906	79%	0.786	S	S	*	*	S	Bend	trans	-120.4	15.4	-174.2	-134.5	-178.7	-169	-169.2	2.6	115.8
2948	Q	49.2	Very low	44.9	Very low	183 Å²	183	167 Å²	167	86%	0.855	81%	0.805	S	S	*	*	S	Bend	trans	-126.6	3.6	-171.5	-90.6	-176.2	-28.3	0	0	116.5
2949	Y	40.9	Very low	43.7	Very low	204 Å²	204	172.3 Å²	172.3	80%	0.8	83%	0.826	S	S	*	*			trans	-138.4	108.9	169.4	-77.9	-86.9	0	0	0	109.5
2950	I	42.8	Very low	42.6	Very low	248 Å²	248	174.2 Å²	174.2	100%	1.272	84%	0.841	S	S	*	*			trans	-119.6	0	161.2	-69.5	-179.9	0	0	0	105.3

Retrieved 2,950 of 2,950 residues in 3098.3 ms (Link to these results)

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