A0A3Q0KKQ0_SCHMA Loading...

Putative homeobox protein otx

AlphaFold DB , UniProt , Accession A0A3Q0KKQ0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,144 aa.

						>A0A3Q0KKQ0_SCHMA|A0A3Q0KKQ0
MDNPVSIHTSNTQHQLMNPLFMNKIESLSPKSSLSQCAINNPSISHHFYTHNYSLFKTPNLSYSDQSNLNPSVINVSTDLTNSPETSTFSRNDVLDLKNIRNSNFCSESNLLSSSVASSSSFSSSSSVSSSSLSSSRSGTVTASNSTDELPSVQIPMLLSSSSFEINPGTTPTSITSITTVAGNSDNNNNSNYDLVESSNDMQNLYINTMSCQYNSNELINSHSSTPLHLVNYSNLINYSLNNEDYHQLGGYHQCHPQQHHENQPLEKSSLDDSKSINFSLNNLYWNTTSDESQLSCIDKVMENTKKALCPISTNITNTTNNTTEKLDQLIHQSIDLNHHKYNYTKLFHSSTNEFIEYKNKFKTNLIKQEFEMNSPSLSTLSSGSVSSTPSSSSSLSSLSTTTSTTSTLVETMSSILLKHEPDNFVYNLNQDKRIPIINSDHYPHITSWSNSDLSISSINNNNNDIKLETKDVHHDECDNHLDHDHNSNGNNNSNNNDRMESNNQLEQSKQLYENYPENKYSLNNNSPKPKYQIALSLTANIYPTINSNYGRLKQKNNTIWNNSNDNNNNNNGYHYTEYESRLKTTHTHLNLSTDHNTIHQQQLTMKQNEEMIVNTVNNEHLTYLNETIPIIQNHSNDLEFLPYFNGHHHHPHDHDHHSNHPHHEYYTQHMKLSPFLMSDYNNEYIHYRNNNNNNNNFSDDLRNHESSIIQMNKLNYSTNTTNDTTNTSVNNSNSSSNINRDLFDKYNHELYTNSDHNPYSIYTSNYSQISNYPFDVNNTTSSIHFSNTYFDKGNNDGNRNDSRDLISSITLPNSSQSNHLSAEVHDQSTDTDQHDTHYLHSHTHHHHDHPHSNVHTHPTLNQLPRQYNQHHHYQSLLSDFNSEYTNLFTNTMNYHSFNNELNDNYNNSLSPTLASSSSSSEVCSNNSNTTIPHKYSASNIHMMNSYDPMTFLQEMNLNRIHCNNHRHHCNNMNTTTSTTNMTTTTNNNSVSNNNNHNDNSGSKHTMNEPFNRQTTPYNLLEQSNNFLMAAAVVAAAAGSTPNDLNISTGNPVRRQRRERTTFTRHQLLMLEELYAKTRYPDVYIREELALKLRLPESRVQVWFKNRRAKGRNQQRQNSTVDNNNNNLIIKTNNVNVCQYENVK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.3	Very low	35.1	Very low	221 Å²	221	139 Å²	139	100%	1.089	78%	0.777	S	S	*	*				0	137.8	0	-74.1	-48.9	-161.4	0	0	108.5
2	D	41	Very low	35.1	Very low	144 Å²	144	136.4 Å²	136.4	77%	0.77	77%	0.768	S	S	*	*			trans	55.6	103.3	146.3	-45.5	-27.4	0	0	0	119.8
3	N	37.4	Very low	35	Very low	141 Å²	141	137.6 Å²	137.6	75%	0.754	76%	0.763	S	S	*	*			trans	-119.1	122.1	157.5	176.1	22.7	0	0	0	108
4	P	41	Very low	35.1	Very low	115 Å²	115	137.7 Å²	137.7	75%	0.747	76%	0.755	S	S	*	*			trans	-120.6	123.2	156.7	32.7	-20.9	0	0	0	110.7
5	V	34.1	Very low	35	Very low	105 Å²	105	140.5 Å²	140.5	64%	0.636	76%	0.761	S	S	*	*			cis	87.1	103.3	38.4	-178.9	0	0	0	0	114.2
6	S	32	Very low	34.8	Very low	104 Å²	104	140.6 Å²	140.6	73%	0.727	76%	0.759	S	S	*	*			trans	69.3	168.2	157	75.7	0	0	0	0	116.2
7	I	34.2	Very low	34.6	Very low	159 Å²	159	141.7 Å²	141.7	82%	0.815	76%	0.761	S	S	*	*			cis	-140.4	158.2	40.3	-69.3	174.2	0	0	0	112.9
8	H	30.7	Very low	34.4	Very low	172 Å²	172	141.4 Å²	141.4	80%	0.796	76%	0.759	S	S	*	*			trans	-73.9	164.1	177.4	-80.1	-90.2	0	0	0	116
9	T	33.7	Very low	34.7	Very low	131 Å²	131	139.1 Å²	139.1	80%	0.804	75%	0.752	S	S	*	*			trans	143.4	133.7	140.6	48.6	0	0	0	0	109.8
10	S	31.4	Very low	34.6	Very low	88 Å²	88	139.5 Å²	139.5	62%	0.615	75%	0.753	S	S	*	*			cis	116.7	137.1	12	67.1	0	0	0	0	112.4
11	N	31.1	Very low	34.6	Very low	149 Å²	149	141.6 Å²	141.6	80%	0.797	76%	0.756	S	S	*	*			trans	81.6	167.2	168.1	-55.7	-9.4	0	0	0	118.7
12	T	35.1	Very low	34.5	Very low	108 Å²	108	138 Å²	138	66%	0.663	74%	0.738	S	S	*	*				-160.6	148.9	-73.1	1.3	0	0	0	0	112
13	Q	34.5	Very low	34.1	Very low	152 Å²	152	137.4 Å²	137.4	71%	0.71	74%	0.735	S	S	*	*			trans	65.6	139.7	145.2	-80.9	176.4	-65.5	0	0	126.2
14	H	35.3	Very low	34	Very low	139 Å²	139	140 Å²	140	64%	0.644	74%	0.74	S	S	*	*			trans	54.6	134.7	146.4	-63.6	-57.5	0	0	0	121.2
15	Q	33.7	Very low	33.8	Very low	180 Å²	180	140.2 Å²	140.2	84%	0.841	73%	0.733	S	S	*	*				-151.4	144.3	59.6	-73.9	162.3	36.4	0	0	110.2
16	L	32.8	Very low	33.9	Very low	141 Å²	141	142.5 Å²	142.5	74%	0.738	74%	0.737	S	S	*	*				59	112.7	66.8	-81.5	175.2	0	0	0	115.9
17	M	30.6	Very low	33.9	Very low	160 Å²	160	142.7 Å²	142.7	79%	0.788	74%	0.738	S	S	*	*				177	113.5	126.5	-96.5	-62.2	172.3	0	0	114.7
18	N	32	Very low	33.8	Very low	137 Å²	137	143.6 Å²	143.6	73%	0.733	74%	0.744	S	S	*	*			trans	63.5	172.4	131.9	-92.6	-11.5	0	0	0	120.4
19	P	39.9	Very low	34	Very low	96 Å²	96	139.8 Å²	139.8	62%	0.623	74%	0.736	S	S	*	*				-138.8	-153.5	-86.7	37.5	-13.6	0	0	0	113.6
20	L	31.5	Very low	34.1	Very low	147 Å²	147	139.9 Å²	139.9	77%	0.77	74%	0.739	S	S	*	*			trans	117.2	159.6	154.4	-62.8	168.5	0	0	0	117.8
21	F	35.4	Very low	34.2	Very low	184 Å²	184	144.8 Å²	144.8	81%	0.807	75%	0.749	S	S	*	*			trans	74.1	133.7	175.9	-67	-95.3	0	0	0	118.6
22	M	36.2	Very low	34.2	Very low	146 Å²	146	142.2 Å²	142.2	72%	0.719	74%	0.743	S	S	*	*			cis	-166.3	147.7	-30.4	-117.7	-100.1	175.4	0	0	111.7
23	N	32.7	Very low	34	Very low	131 Å²	131	141.5 Å²	141.5	70%	0.701	74%	0.742	S	S	*	*			trans	0.1	126.8	160.5	-60.3	-10.3	0	0	0	120.6
24	K	36	Very low	34	Very low	197 Å²	197	142.1 Å²	142.1	86%	0.857	75%	0.75	S	S	*	*				177.3	150.6	121	-97.5	-169.7	174	-178.1	0	110.9
25	I	37.2	Very low	33.8	Very low	119 Å²	119	139.6 Å²	139.6	61%	0.61	75%	0.748	S	S	*	*			cis	-162.1	162.8	-35.6	-129.5	175.4	0	0	0	107.9
26	E	35.5	Very low	33.7	Very low	153 Å²	153	139.2 Å²	139.2	72%	0.715	75%	0.746	S	S	*	*			trans	17.9	109	165.8	-68.2	130.7	-145.2	0	0	119
27	S	32	Very low	33.6	Very low	108 Å²	108	137.7 Å²	137.7	76%	0.755	75%	0.746	S	S	*	*				60.9	115.4	74.5	80.6	0	0	0	0	116.2
28	L	33.2	Very low	33.6	Very low	178 Å²	178	134.3 Å²	134.3	93%	0.932	74%	0.743	S	S	*	*			trans	-155.4	145.8	147.8	-111	169.9	0	0	0	110.4
29	S	33.8	Very low	33.8	Very low	91 Å²	91	134.4 Å²	134.4	64%	0.636	74%	0.742	S	S	*	*			trans	-103.7	158.5	-165.6	50.2	0	0	0	0	113.8
30	P	35.3	Very low	33.5	Very low	133 Å²	133	136.5 Å²	136.5	86%	0.864	75%	0.748	S	S	*	*			trans	-76.5	133.5	-168.9	29.5	-35.9	0	0	0	114.3
31	K	34.7	Very low	33.2	Very low	192 Å²	192	136.3 Å²	136.3	84%	0.835	75%	0.748	S	S	*	*			trans	-154.5	153.4	168.4	-65.2	-177.4	-176.5	174.7	0	107.6
32	S	30	Very low	33.3	Very low	95 Å²	95	133.3 Å²	133.3	66%	0.664	75%	0.747	S	S	*	*			cis	-175.3	176	-22.5	54.3	0	0	0	0	107.4
33	S	31.3	Very low	32.9	Very low	93 Å²	93	130.7 Å²	130.7	65%	0.65	74%	0.743	S	S	*	*			trans	51.7	102.1	147.4	58.2	0	0	0	0	120.5
34	L	35.4	Very low	33.1	Very low	165 Å²	165	132 Å²	132	86%	0.864	75%	0.749	S	S	*	*			trans	-179.4	102.5	133.9	-96.3	153.4	0	0	0	106.8
35	S	31.1	Very low	32.9	Very low	86 Å²	86	127.4 Å²	127.4	60%	0.601	74%	0.741	S	S	*	*			cis	73.1	133	33.4	102.2	0	0	0	0	112.9
36	Q	31	Very low	32.4	Very low	172 Å²	172	129.3 Å²	129.3	80%	0.804	75%	0.747	S	S	*	*			cis	-165	-174.2	-5.1	-158	156.9	-39.9	0	0	109.5
37	C	30	Very low	32.3	Very low	109 Å²	109	130.7 Å²	130.7	74%	0.736	75%	0.753	S	S	*	*			trans	75.5	116.1	163.4	-59.3	0	0	0	0	115.3
38	A	32.4	Very low	32.1	Very low	89 Å²	89	133.4 Å²	133.4	74%	0.736	75%	0.752	S	S	*	*				91.9	160.6	81.8	0	0	0	0	0	111
39	I	35.4	Very low	31.9	Very low	139 Å²	139	135 Å²	135	71%	0.713	75%	0.747	S	S	*	*			cis	-153.3	150.4	12.8	-147.2	153.4	0	0	0	110.4
40	N	33.1	Very low	31.6	Very low	140 Å²	140	135.3 Å²	135.3	75%	0.749	75%	0.745	S	S	*	*			trans	57.4	130.8	158.2	-58.9	-12.5	0	0	0	123.1
41	N	25.9	Very low	31.4	Very low	142 Å²	142	135.4 Å²	135.4	76%	0.759	73%	0.734	S	S	*	*			trans	-58.4	151.8	148.2	-78	-35.4	0	0	0	110.7
42	P	36.8	Very low	30.9	Very low	121 Å²	121	132.9 Å²	132.9	79%	0.786	73%	0.729	S	S	*	*				-111.6	148.8	78.6	-8.2	28.3	0	0	0	112.2
43	S	29.3	Very low	30.9	Very low	92 Å²	92	137.4 Å²	137.4	64%	0.643	73%	0.733	S	S	*	*			cis	69.5	79.9	44.5	-50.4	0	0	0	0	114.3
44	I	35.4	Very low	30.6	Very low	159 Å²	159	136.9 Å²	136.9	82%	0.815	73%	0.73	S	S	*	*			trans	-169	92.8	149.2	-97.9	155	0	0	0	104.5
45	S	31.8	Very low	30.3	Very low	99 Å²	99	136.1 Å²	136.1	69%	0.692	73%	0.726	S	S	*	*				76	118.9	77.3	73.1	0	0	0	0	113.4
46	H	27	Very low	30.1	Very low	160 Å²	160	141.1 Å²	141.1	74%	0.741	74%	0.737	S	S	*	*			trans	-28.4	131.5	172.3	-65	-101.6	0	0	0	115.5	F48	H46-F48 AromaticContact ND1-CE2 3.87Å
47	H	33.4	Very low	30.1	Very low	182 Å²	182	141.9 Å²	141.9	84%	0.843	74%	0.738	S	S	*	*			trans	-136.8	120.6	131.1	-110.7	-74.4	0	0	0	110.1
48	F	27.1	Very low	30	Very low	164 Å²	164	140.7 Å²	140.7	72%	0.719	73%	0.727	S	S	*	*			trans	-66.6	137.4	165	-73.3	-105.8	0	0	0	108.5	H46	H46-F48 AromaticContact ND1-CE2 3.87Å
49	Y	30.5	Very low	30	Very low	211 Å²	211	143 Å²	143	83%	0.827	74%	0.735	S	S	*	*			trans	-135.5	125.6	154.9	-117.7	-84.8	0	0	0	110.2
50	T	26.3	Very low	29.7	Very low	99 Å²	99	142.2 Å²	142.2	61%	0.607	73%	0.732	S	S	*	*			trans	-101.6	116.6	-168.9	48.4	0	0	0	0	112
51	H	30.7	Very low	29.4	Very low	135 Å²	135	143.2 Å²	143.2	63%	0.625	74%	0.736	S	S	*	*			trans	-143.3	101.7	159.3	-69.7	-29.4	0	0	0	107.1	Y53	H51-Y53 HydrophobicContact CB-CD2 3.9Å; H51-Y53 HydrophobicContact CB-CE2 4.12Å; H51-Y53 AromaticContact CD2-CE2 3.73Å; H51-Y53 AromaticContact CE1-CE2 3.62Å; H51-Y53 AromaticContact CE1-CZ 3.9Å; H51-Y53 AromaticContact CG-CD2 3.86Å; H51-Y53 AromaticContact CG-CE2 3.55Å; H51-Y53 AromaticContact ND1-CD2 3.99Å; H51-Y53 AromaticContact ND1-CE2 3.47Å; H51-Y53 WeakPolarHBondContact ND1-CE2 3.4Å; H51-Y53 AromaticContact NE2-CE2 3.8Å
52	N	25.5	Very low	29.5	Very low	138 Å²	138	141.6 Å²	141.6	74%	0.738	74%	0.736	S	S	*	*			cis	48.9	52.6	8.8	-79.2	14.6	0	0	0	115.1	S54	N52-S54 VanDerWaalsContact C-N 3.3Å; N52-S54 PolarHBondContact O-N 2.81Å
53	Y	30.1	Very low	29.2	Very low	190 Å²	190	146 Å²	146	75%	0.745	74%	0.738	S	S	*	*			trans	-83.5	82.1	150.9	-89.3	-74.7	0	0	0	110.1	H51	H51-Y53 HydrophobicContact CB-CD2 3.9Å; H51-Y53 HydrophobicContact CB-CE2 4.12Å; H51-Y53 AromaticContact CD2-CE2 3.73Å; H51-Y53 AromaticContact CE1-CE2 3.62Å; H51-Y53 AromaticContact CE1-CZ 3.9Å; H51-Y53 AromaticContact CG-CD2 3.86Å; H51-Y53 AromaticContact CG-CE2 3.55Å; H51-Y53 AromaticContact ND1-CD2 3.99Å; H51-Y53 AromaticContact ND1-CE2 3.47Å; H51-Y53 WeakPolarHBondContact ND1-CE2 3.4Å; H51-Y53 AromaticContact NE2-CE2 3.8Å
54	S	25.6	Very low	29.1	Very low	83 Å²	83	145.6 Å²	145.6	58%	0.58	74%	0.735	S	S	*	*			trans	-62.1	169.5	148.9	-51.6	0	0	0	0	109.8	N52	N52-S54 VanDerWaalsContact C-N 3.3Å; N52-S54 PolarHBondContact O-N 2.81Å
55	L	27.8	Very low	29	Very low	148 Å²	148	145 Å²	145	78%	0.775	73%	0.734	S	S	*	*			trans	76.1	108.2	172.2	-61	129.7	0	0	0	114.8
56	F	26.6	Very low	28.9	Very low	191 Å²	191	148.6 Å²	148.6	84%	0.838	74%	0.74	S	S	*	*				65.4	100.2	83.2	-84.7	-82	0	0	0	112.9
57	K	31	Very low	29.3	Very low	189 Å²	189	146 Å²	146	82%	0.822	74%	0.739	S	S	*	*				-173.5	118.4	113.7	-101.2	166	-177.1	179	0	113.5
58	T	28.5	Very low	29.4	Very low	84 Å²	84	144 Å²	144	52%	0.515	74%	0.735	S	S	.	*			trans	16.2	122.6	135	55.4	0	0	0	0	118.7	N60	T58-N60 PolarHBondContact O-N 3.34Å
59	P	32.9	Very low	29.8	Very low	138 Å²	138	144 Å²	144	90%	0.896	74%	0.742	S	S	*	*			trans	-64.2	108.8	131	30.3	-29.3	0	0	0	107.3
60	N	29.4	Very low	29.7	Very low	122 Å²	122	141.2 Å²	141.2	65%	0.652	74%	0.741	S	S	*	*			trans	-78.5	159.9	177.8	-101	-21.9	0	0	0	111.4	T58	T58-N60 PolarHBondContact O-N 3.34Å
61	L	26.2	Very low	30.2	Very low	161 Å²	161	141.7 Å²	141.7	84%	0.843	75%	0.746	S	S	*	*			trans	-59	140.4	175.6	-64.1	81.3	0	0	0	112.3
62	S	28.7	Very low	30.2	Very low	107 Å²	107	140.3 Å²	140.3	75%	0.748	75%	0.751	S	S	*	*			trans	149.7	146.6	159.7	47.3	0	0	0	0	108.3
63	Y	28.7	Very low	30.7	Very low	214 Å²	214	139.5 Å²	139.5	84%	0.839	75%	0.751	S	S	*	*			cis	-143	126.8	-5.8	-138.6	-130.6	0	0	0	104.5
64	S	28	Very low	30.7	Very low	83 Å²	83	136.8 Å²	136.8	58%	0.58	75%	0.749	S	S	*	*				64.9	91.4	91.2	-54.9	0	0	0	0	115.4
65	D	32.8	Very low	31	Very low	148 Å²	148	139.9 Å²	139.9	79%	0.791	76%	0.758	S	S	*	*			trans	-134.6	109.8	141.7	-88.3	-41	0	0	0	106.7
66	Q	30.2	Very low	31.2	Very low	173 Å²	173	138.4 Å²	138.4	81%	0.808	76%	0.755	S	S	*	*				73.9	85	71.6	-71.4	-165.4	78.6	0	0	114.6
67	S	35.8	Very low	31.5	Very low	105 Å²	105	134.2 Å²	134.2	73%	0.734	75%	0.75	S	S	*	*				-162.9	119.4	126.6	49.7	0	0	0	0	114.1
68	N	34.2	Very low	31.8	Very low	142 Å²	142	131 Å²	131	76%	0.759	75%	0.746	S	S	*	*			trans	67.4	111.1	136.1	-59.4	-18.4	0	0	0	123.3
69	L	35.6	Very low	32	Very low	164 Å²	164	133.3 Å²	133.3	86%	0.859	76%	0.755	S	S	*	*				83.7	92.2	127.2	-60.7	172.6	0	0	0	121.3
70	N	29	Very low	32.1	Very low	151 Å²	151	133.8 Å²	133.8	81%	0.807	75%	0.749	S	S	*	*			trans	-59.9	172.6	133.4	-115.3	-26.5	0	0	0	110.8
71	P	36.1	Very low	32.3	Very low	109 Å²	109	132.5 Å²	132.5	71%	0.708	75%	0.746	S	S	*	*			cis	-143.9	-172.1	28.1	43.9	-23.9	0	0	0	117.2
72	S	31.2	Very low	32.6	Very low	106 Å²	106	132.1 Å²	132.1	74%	0.741	75%	0.745	S	S	*	*			trans	-84.6	136.5	173.6	55.2	0	0	0	0	115.5
73	V	35.5	Very low	32.8	Very low	121 Å²	121	132.2 Å²	132.2	73%	0.733	75%	0.746	S	S	*	*			trans	-149.5	108.2	165.4	-172.4	0	0	0	0	107.3
74	I	30.3	Very low	33.4	Very low	134 Å²	134	127.1 Å²	127.1	69%	0.687	74%	0.739	S	S	*	*				60.5	112	85.7	-55	169	0	0	0	115
75	N	33.2	Very low	33.9	Very low	147 Å²	147	131.4 Å²	131.4	79%	0.786	75%	0.75	S	S	*	*			trans	166.6	127.6	142.2	-83.4	-26.7	0	0	0	107.8
76	V	32.1	Very low	34	Very low	117 Å²	117	130.5 Å²	130.5	71%	0.709	75%	0.75	S	S	*	*			cis	96.5	130.9	31.1	175.5	0	0	0	0	112.9
77	S	32	Very low	34.2	Very low	104 Å²	104	126.9 Å²	126.9	73%	0.727	74%	0.744	S	S	*	*			trans	71.1	154.5	176.3	-63.4	0	0	0	0	115.9
78	T	36.9	Very low	33.9	Very low	122 Å²	122	127.7 Å²	127.7	75%	0.748	74%	0.744	S	S	*	*			cis	-173	153.3	-8.1	24.6	0	0	0	0	106.4
79	D	32.5	Very low	33.8	Very low	131 Å²	131	130 Å²	130	70%	0.701	75%	0.748	S	S	*	*			cis	-167.5	-155.2	-12.7	-153.2	86.9	0	0	0	107.9
80	L	36.5	Very low	33.5	Very low	148 Å²	148	125.8 Å²	125.8	78%	0.775	73%	0.732	S	S	*	*			trans	76.1	143.2	164.2	-52.2	178.6	0	0	0	118.1
81	T	33.7	Very low	33.5	Very low	96 Å²	96	128 Å²	128	59%	0.589	73%	0.729	S	S	*	*			cis	-180	142.4	-41.9	27.7	0	0	0	0	108.1
82	N	32.3	Very low	33.1	Very low	153 Å²	153	128.4 Å²	128.4	82%	0.818	73%	0.725	S	S	*	*			trans	66.3	146.3	166.1	-48.9	-26.2	0	0	0	115.8
83	S	33.3	Very low	33.3	Very low	108 Å²	108	129.7 Å²	129.7	76%	0.755	72%	0.724	S	S	*	*			cis	-145	144.5	22.6	-160.9	0	0	0	0	113.1
84	P	40.8	Very low	32.9	Very low	108 Å²	108	129.8 Å²	129.8	70%	0.701	73%	0.725	S	S	*	*			trans	-97.9	155.7	165.4	37.6	-31.5	0	0	0	111.9
85	E	37.8	Very low	33.2	Very low	172 Å²	172	130.8 Å²	130.8	80%	0.804	73%	0.731	S	S	*	*			trans	-164.7	127.4	156.1	-121.9	167	-142.9	0	0	113.9
86	T	35.2	Very low	33	Very low	130 Å²	130	128.9 Å²	128.9	80%	0.798	72%	0.72	S	S	*	*			trans	58.8	150	152.9	52.3	0	0	0	0	121.3
87	S	34.1	Very low	33.1	Very low	97 Å²	97	131.5 Å²	131.5	68%	0.678	73%	0.729	S	S	*	*			cis	-159.2	118.7	-13.4	45.5	0	0	0	0	112.6
88	T	29.3	Very low	33.1	Very low	122 Å²	122	133.2 Å²	133.2	75%	0.748	72%	0.724	S	S	*	*			trans	17.8	120.8	131.7	61.4	0	0	0	0	120.6
89	F	31.8	Very low	33	Very low	191 Å²	191	134.1 Å²	134.1	84%	0.838	72%	0.724	S	S	*	*				-174.3	137.7	109.7	-112.6	-122.7	0	0	0	108.5
90	S	30.7	Very low	33.1	Very low	74 Å²	74	133 Å²	133	52%	0.517	72%	0.717	S	S	.	*				63.7	138.8	70.8	-104.5	0	0	0	0	113.4
91	R	28.2	Very low	32.9	Very low	197 Å²	197	136 Å²	136	74%	0.743	72%	0.718	S	S	*	*			cis	-174.4	154.7	-7	-133.7	-169.7	171	110.7	-9.3	110
92	N	28.1	Very low	32.9	Very low	119 Å²	119	138 Å²	138	64%	0.636	73%	0.725	S	S	*	*			trans	56.8	-176.7	164.1	-39.1	-18.4	0	0	0	115.3
93	D	34.9	Very low	33.1	Very low	132 Å²	132	134.7 Å²	134.7	71%	0.706	71%	0.714	S	S	*	*			cis	-121.7	150.2	-12.1	-67.5	-78.3	0	0	0	106.5
94	V	27	Very low	33.1	Very low	124 Å²	124	136.3 Å²	136.3	75%	0.752	71%	0.714	S	S	*	*				59.7	141.5	55.2	-172.2	0	0	0	0	113.1
95	L	36.2	Very low	32.6	Very low	155 Å²	155	140.3 Å²	140.3	81%	0.812	72%	0.721	S	S	*	*			trans	87.4	107.9	-171.4	-53.1	172	0	0	0	113.2
96	D	29.6	Very low	32.3	Very low	106 Å²	106	137 Å²	137	57%	0.567	72%	0.716	S	S	*	*				77.5	105.1	63.7	-162.5	8.3	0	0	0	112.4	K98	D96-K98 IonicContact OD1-NZ 3.03Å; D96-K98 PolarHBondContact OD1-NZ 3.39Å; D96-K98 IonicContact OD2-NZ 2.68Å; D96-K98 PolarHBondContact OD2-NZ 3.38Å
97	L	35.3	Very low	32	Very low	173 Å²	173	135 Å²	135	91%	0.906	71%	0.707	S	S	*	*			trans	-156.6	130.5	132.5	-107.4	166.9	0	0	0	110.9
98	K	31.6	Very low	31.8	Very low	139 Å²	139	138.7 Å²	138.7	60%	0.604	71%	0.714	S	S	*	*			trans	-82.9	158.3	-177.5	-56.6	144.5	-175.3	80.2	0	110.4	D96	D96-K98 IonicContact OD1-NZ 3.03Å; D96-K98 PolarHBondContact OD1-NZ 3.39Å; D96-K98 IonicContact OD2-NZ 2.68Å; D96-K98 PolarHBondContact OD2-NZ 3.38Å
99	N	33.3	Very low	31.9	Very low	141 Å²	141	137.2 Å²	137.2	75%	0.754	71%	0.708	S	S	*	*			trans	141	144.3	140.6	-72.9	-20.9	0	0	0	113.1
100	I	35.2	Very low	31.9	Very low	109 Å²	109	134.8 Å²	134.8	56%	0.559	70%	0.704	S	S	*	*			cis	-161.7	134.1	-14.7	-120.8	164.4	0	0	0	108.6
101	R	33.1	Very low	32	Very low	210 Å²	210	138 Å²	138	79%	0.792	71%	0.714	S	S	*	*			trans	58.8	160.5	158.5	-64.6	178.5	-176	134.3	1.1	116.9
102	N	34.2	Very low	32.2	Very low	138 Å²	138	135.6 Å²	135.6	74%	0.738	72%	0.716	S	S	*	*			cis	-159.7	159.7	-11	-104.9	4.2	0	0	0	105.5
103	S	35.2	Very low	32.5	Very low	84 Å²	84	134.5 Å²	134.5	59%	0.587	72%	0.718	S	S	*	*			cis	-171.4	145.5	-6.4	45	0	0	0	0	110.9
104	N	34.6	Very low	32.5	Very low	141 Å²	141	133.3 Å²	133.3	75%	0.754	72%	0.72	S	S	*	*			trans	74.5	127.1	161.5	-52.1	-11.2	0	0	0	117
105	F	29.3	Very low	32.9	Very low	192 Å²	192	131.9 Å²	131.9	84%	0.842	72%	0.715	S	S	*	*				69.6	139.8	53.1	-78	-105.2	0	0	0	113.1
106	C	30.5	Very low	32.9	Very low	104 Å²	104	131.3 Å²	131.3	70%	0.703	72%	0.718	S	S	*	*			cis	-148.7	144.6	9.9	-151	0	0	0	0	106.6
107	S	29.2	Very low	33.2	Very low	88 Å²	88	130.2 Å²	130.2	62%	0.615	72%	0.723	S	S	*	*			cis	77.9	116.5	39.4	-53.4	0	0	0	0	116
108	E	30.8	Very low	33.2	Very low	174 Å²	174	127.1 Å²	127.1	81%	0.813	72%	0.716	S	S	*	*			trans	78.1	115.6	146.8	-64.3	178.6	116.2	0	0	123.2
109	S	31.2	Very low	33.6	Very low	91 Å²	91	125.9 Å²	125.9	64%	0.636	73%	0.725	S	S	*	*				44.5	121.6	113.2	-42.7	0	0	0	0	121
110	N	32	Very low	33.8	Very low	139 Å²	139	123.9 Å²	123.9	74%	0.743	72%	0.722	S	S	*	*				163	138.1	102.4	-86.7	-54.6	0	0	0	116
111	L	32.6	Very low	33.9	Very low	141 Å²	141	122.6 Å²	122.6	74%	0.738	72%	0.723	S	S	*	*			trans	53	127.2	135	-59	172.7	0	0	0	123.9
112	L	33	Very low	34.1	Very low	147 Å²	147	121.1 Å²	121.1	77%	0.77	72%	0.722	S	S	*	*			trans	71.5	118.9	131.8	-68.3	168.2	0	0	0	122.4
113	S	32.9	Very low	34.2	Very low	97 Å²	97	119 Å²	119	68%	0.678	72%	0.719	S	S	*	*				78.8	89.9	128.3	-60.9	0	0	0	0	122
114	S	35	Very low	34.4	Very low	107 Å²	107	119.6 Å²	119.6	75%	0.748	72%	0.723	S	S	*	*				91.6	145.8	117.7	86.3	0	0	0	0	121.3
115	S	35.1	Very low	34.6	Very low	94 Å²	94	117.8 Å²	117.8	66%	0.657	72%	0.721	S	S	*	*			trans	87.9	100.4	143.7	-52.7	0	0	0	0	121.2
116	V	36.6	Very low	34.9	Very low	143 Å²	143	113.8 Å²	113.8	87%	0.867	72%	0.717	S	S	*	*			trans	75.7	154.8	133	-52.8	0	0	0	0	123.2
117	A	35.9	Very low	35.3	Very low	83 Å²	83	113.1 Å²	113.1	69%	0.686	71%	0.714	S	S	*	*			trans	89.1	84	155.1	0	0	0	0	0	120.4
118	S	36	Very low	35.7	Very low	107 Å²	107	115.3 Å²	115.3	75%	0.748	72%	0.723	S	S	*	*				31.8	123.8	124.4	58.6	0	0	0	0	119.2
119	S	39.3	Very low	35.7	Very low	114 Å²	114	111.8 Å²	111.8	80%	0.797	72%	0.717	S	S	*	*				158.7	165.3	78.2	46.3	0	0	0	0	108.2
120	S	38.6	Very low	35.9	Very low	99 Å²	99	112.5 Å²	112.5	69%	0.692	72%	0.722	S	S	*	*			cis	-164.9	155.3	-2.2	41.4	0	0	0	0	110.1
121	S	36.4	Very low	36.1	Very low	82 Å²	82	111 Å²	111	57%	0.573	72%	0.723	S	S	*	*			trans	32.5	143.6	150.5	57	0	0	0	0	121.4
122	F	38.6	Very low	36.1	Very low	178 Å²	178	108.8 Å²	108.8	78%	0.781	72%	0.719	S	S	*	*				-157.8	136.3	52.5	-71.1	-87.6	0	0	0	107.9
123	S	36.2	Very low	36.2	Very low	95 Å²	95	109.4 Å²	109.4	66%	0.664	72%	0.723	S	S	*	*				60.2	139.8	68.9	83.5	0	0	0	0	114.1
124	S	38.2	Very low	36.2	Very low	96 Å²	96	109.1 Å²	109.1	67%	0.671	72%	0.72	S	S	*	*			cis	-161.3	172.9	32.7	-56.4	0	0	0	0	114
125	S	38.7	Very low	36.2	Very low	102 Å²	102	108.5 Å²	108.5	71%	0.713	72%	0.716	S	S	*	*			trans	56.9	122.3	150.9	46.6	0	0	0	0	119.8
126	S	36.3	Very low	36.3	Very low	109 Å²	109	109.5 Å²	109.5	76%	0.762	72%	0.723	S	S	*	*				72.1	150.9	57.7	91.3	0	0	0	0	113.4
127	S	37.8	Very low	36.1	Very low	90 Å²	90	113.6 Å²	113.6	63%	0.629	72%	0.723	S	S	*	*			cis	-171.8	168.2	17.1	19.4	0	0	0	0	111.2
128	V	38.3	Very low	36.1	Very low	133 Å²	133	115.1 Å²	115.1	81%	0.806	73%	0.729	S	S	*	*			trans	59	163.7	158.2	-68.2	0	0	0	0	120
129	S	32	Very low	36.1	Very low	100 Å²	100	113 Å²	113	70%	0.699	72%	0.724	S	S	*	*			cis	174	154.1	-45.7	-89.6	0	0	0	0	109.4
130	S	34.8	Very low	35.7	Very low	106 Å²	106	114.1 Å²	114.1	74%	0.741	73%	0.726	S	S	*	*			trans	73.8	150.5	150.9	73.8	0	0	0	0	121.4
131	S	35	Very low	35.5	Very low	108 Å²	108	112.1 Å²	112.1	76%	0.755	71%	0.709	S	S	*	*			trans	65.7	144.1	162.6	47.2	0	0	0	0	118.3
132	S	34.5	Very low	35.3	Very low	95 Å²	95	112.7 Å²	112.7	66%	0.664	71%	0.709	S	S	*	*			cis	-168.6	169.3	-7.1	43	0	0	0	0	111.6
133	L	33.8	Very low	35.2	Very low	160 Å²	160	106 Å²	106	84%	0.838	69%	0.687	S	S	*	*			trans	28.2	139.3	136.9	-59.2	167	0	0	0	119.5
134	S	33.7	Very low	35.1	Very low	90 Å²	90	103.7 Å²	103.7	63%	0.629	67%	0.671	S	S	*	*			cis	179	-179.6	-1.9	57.5	0	0	0	0	110.4
135	S	35.2	Very low	34.9	Very low	95 Å²	95	105.5 Å²	105.5	66%	0.664	67%	0.673	S	S	*	*			trans	73.3	118.4	145.1	-53.6	0	0	0	0	121.1
136	S	36.1	Very low	34.7	Very low	115 Å²	115	105.8 Å²	105.8	80%	0.804	68%	0.675	S	S	*	*			trans	67.9	156.5	138.6	54.9	0	0	0	0	121.1
137	R	33.2	Very low	34.7	Very low	229 Å²	229	106.5 Å²	106.5	86%	0.864	68%	0.675	S	S	*	*			cis	-174.6	129.6	-24.7	170.8	170	172.8	178.2	-3.4	109.5
138	S	35.8	Very low	34.5	Very low	115 Å²	115	110 Å²	110	80%	0.804	69%	0.687	S	S	*	*			trans	63.3	115.9	160.5	-59.9	0	0	0	0	121
139	G	35.8	Very low	34.2	Very low	62 Å²	62	112.5 Å²	112.5	64%	0.639	69%	0.69	S	S	*	*				116.1	110.9	119.7	0	0	0	0	0	121.3
140	T	31.3	Very low	34.5	Very low	137 Å²	137	114.9 Å²	114.9	84%	0.84	69%	0.694	S	S	*	*			trans	66.3	149.6	136.1	55.7	0	0	0	0	120.6
141	V	33.5	Very low	34.8	Very low	58 Å²	58	116 Å²	116	35%	0.352	70%	0.699	S	S	.	*			cis	-173.7	171.2	-8.3	130.3	0	0	0	0	110.9	I810 L812	V141-I810 HydrophobicContact CG2-CG2 4.16Å; V141-I810 VanDerWaalsContact CG2-O 3.29Å; V141-I810 WeakPolarHBondContact CG2-O 3.41Å; V141-L812 CarbonylContact C-O 3.39Å
142	T	33.1	Very low	34.5	Very low	93 Å²	93	115.3 Å²	115.3	57%	0.571	69%	0.694	S	S	*	*			trans	84.1	87.2	161.5	31.5	0	0	0	0	126	T811 L812 P813	T142-T811 WeakPolarHBondContact CA-OG1 3.47Å; T142-T811 PolarHBondContact N-OG1 3.43Å; T142-L812 CarbonylContact C-O 3.42Å; T142-L812 VanDerWaalsContact CA-O 3.24Å; T142-L812 WeakPolarHBondContact CA-O 3.47Å; T142-L812 PolarHBondContact N-O 2.84Å; T142-P813 WeakPolarHBondContact O-CA 3.38Å; T142-P813 VanDerWaalsContact O-CB 3.29Å; T142-P813 WeakPolarHBondContact O-CB 3.43Å
143	A	34.9	Very low	34.2	Very low	37 Å²	37	116.9 Å²	116.9	31%	0.306	70%	0.699	S	S	.	*			trans	46.9	139	142.2	0	0	0	0	0	122	L812 P813 N814	A143-L812 VanDerWaalsContact N-C 3.34Å; A143-L812 PolarHBondContact N-O 2.72Å; A143-P813 CarbonylContact O-C 3.05Å; A143-P813 VanDerWaalsContact O-CA 3.31Å; A143-P813 WeakPolarHBondContact O-CA 3.49Å; A143-N814 WeakPolarHBondContact O-CB 3.48Å; A143-N814 PolarHBondContact O-N 3.48Å; A143-N814 PolarHBondContact O-ND2 2.68Å
144	S	34	Very low	34	Very low	48 Å²	48	116.7 Å²	116.7	34%	0.336	69%	0.694	S	S	.	*			cis	-158.1	160.9	26.3	-36.9	0	0	0	0	111.4	N814	S144-N814 WeakPolarHBondContact CA-OD1 3.31Å; S144-N814 WeakPolarHBondContact CB-OD1 3.45Å; S144-N814 PolarHBondContact N-ND2 3.42Å; S144-N814 VanDerWaalsContact N-ND2 3.19Å; S144-N814 PolarHBondContact N-OD1 2.96Å; S144-N814 VanDerWaalsContact N-OD1 3.1Å; S144-N814 PolarHBondContact O-OD1 3.41Å; S144-N814 PolarHBondContact OG-ND2 3.31Å
145	N	35.1	Very low	34.1	Very low	134 Å²	134	120.4 Å²	120.4	72%	0.717	71%	0.705	S	S	*	*				68.4	108.7	90.5	-62.7	11.1	0	0	0	120.9
146	S	35.4	Very low	34	Very low	107 Å²	107	120.5 Å²	120.5	75%	0.748	70%	0.703	S	S	*	*			trans	-169	93	132.4	57.9	0	0	0	0	109.1
147	T	35.3	Very low	33.5	Very low	125 Å²	125	123.5 Å²	123.5	77%	0.767	71%	0.706	S	S	*	*				63.3	108.8	91.2	59.1	0	0	0	0	115.6
148	D	34.2	Very low	33.2	Very low	164 Å²	164	120.1 Å²	120.1	88%	0.877	70%	0.704	S	S	*	*				-151.2	149.7	128	-101.2	-30.4	0	0	0	111
149	E	31.3	Very low	32.8	Very low	185 Å²	185	121.9 Å²	121.9	86%	0.864	70%	0.704	S	S	*	*			trans	29.2	101	172.7	-55.2	-154.6	130.6	0	0	121.5
150	L	37.9	Very low	32.3	Very low	150 Å²	150	124.4 Å²	124.4	79%	0.785	71%	0.712	S	S	*	*			trans	-145.7	135	148.4	-95.4	179	0	0	0	110.7	S152	L150-S152 PolarHBondContact O-N 3.24Å
151	P	41.8	Very low	32.2	Very low	130 Å²	130	123.2 Å²	123.2	84%	0.844	71%	0.709	S	S	*	*			trans	-67.6	122.6	168.7	29.1	-32.9	0	0	0	109.7
152	S	29.6	Very low	32	Very low	93 Å²	93	125.9 Å²	125.9	65%	0.65	73%	0.73	S	S	*	*			trans	-127.2	166.2	-177.7	-65.2	0	0	0	0	110.7	L150	L150-S152 PolarHBondContact O-N 3.24Å
153	V	27.5	Very low	31.7	Very low	128 Å²	128	125.5 Å²	125.5	78%	0.776	73%	0.732	S	S	*	*			trans	74.7	133.7	172.3	-164.6	0	0	0	0	111.7
154	Q	28.3	Very low	31.3	Very low	156 Å²	156	132.4 Å²	132.4	73%	0.729	76%	0.755	S	S	*	*			cis	-145.9	150.8	18	-145	148.2	29	0	0	112.3
155	I	36.1	Very low	31.2	Very low	168 Å²	168	137.9 Å²	137.9	86%	0.862	78%	0.775	S	S	*	*			trans	-103.5	118.8	149.7	-63	174.4	0	0	0	106.8
156	P	33.1	Very low	30.8	Very low	96 Å²	96	137 Å²	137	62%	0.623	77%	0.769	S	S	*	*			trans	-120.5	99.6	168.3	33.4	-18.8	0	0	0	111.2
157	M	26.4	Very low	30.7	Very low	178 Å²	178	139.2 Å²	139.2	88%	0.877	77%	0.773	S	S	*	*			trans	-83.4	101.9	143	-169.5	-173.9	81.1	0	0	105.9
158	L	27	Very low	30.6	Very low	158 Å²	158	138.8 Å²	138.8	83%	0.827	77%	0.773	S	S	*	*			trans	179.4	164.2	157.5	-102.2	167.6	0	0	0	112.3
159	L	26.5	Very low	30.5	Very low	153 Å²	153	134.3 Å²	134.3	80%	0.801	77%	0.765	S	S	*	*			trans	-98.7	134.4	-177.4	-67.4	68.6	0	0	0	111.5
160	S	26.8	Very low	30.7	Very low	115 Å²	115	131.7 Å²	131.7	80%	0.804	76%	0.762	S	S	*	*			trans	-169.7	119.1	150.3	51.7	0	0	0	0	108.3
161	S	27.7	Very low	30.6	Very low	112 Å²	112	129.3 Å²	129.3	78%	0.783	75%	0.753	S	S	*	*			cis	83.6	95.1	43.4	-57.1	0	0	0	0	114.1
162	S	30.4	Very low	30.5	Very low	113 Å²	113	125.8 Å²	125.8	79%	0.79	73%	0.73	S	S	*	*			trans	-124.2	117.7	152.6	53.1	0	0	0	0	106.3
163	S	27.3	Very low	30.8	Very low	86 Å²	86	125.3 Å²	125.3	60%	0.601	72%	0.724	S	S	*	*				66.7	121.2	50.1	-47.6	0	0	0	0	110.9
164	F	26.7	Very low	31	Very low	181 Å²	181	123 Å²	123	79%	0.794	71%	0.713	S	S	*	*			cis	-124.8	-177.7	2.3	-66	-84.6	0	0	0	109.3	I166	F164-I166 HydrophobicContact CD1-CD1 4.21Å
165	E	30	Very low	31.2	Very low	163 Å²	163	122.7 Å²	122.7	76%	0.762	72%	0.715	S	S	*	*			cis	-122.8	172.7	13.3	-83.5	-165.6	96.8	0	0	111.6
166	I	28.4	Very low	31	Very low	115 Å²	115	120.3 Å²	120.3	59%	0.59	71%	0.708	S	S	*	*			cis	79.2	89.4	32.8	-47.6	173.5	0	0	0	115.2	F164	F164-I166 HydrophobicContact CD1-CD1 4.21Å
167	N	32.6	Very low	31.1	Very low	154 Å²	154	120 Å²	120	82%	0.824	71%	0.709	S	S	*	*				-162.7	141.4	122.2	-103.9	-62	0	0	0	111
168	P	34	Very low	31.4	Very low	117 Å²	117	119 Å²	119	76%	0.76	71%	0.705	S	S	*	*			trans	-117.2	167.9	-168.7	42.1	-33.8	0	0	0	116.3
169	G	31.8	Very low	31.7	Very low	69 Å²	69	116.3 Å²	116.3	71%	0.711	70%	0.695	S	S	*	*			trans	87.5	157	170.9	0	0	0	0	0	114.3
170	T	34.5	Very low	31.9	Very low	131 Å²	131	115.1 Å²	115.1	80%	0.804	70%	0.695	S	S	*	*			cis	-162.4	143.6	-3	38.1	0	0	0	0	107.1
171	T	35.7	Very low	32.2	Very low	99 Å²	99	115.9 Å²	115.9	61%	0.607	69%	0.694	S	S	*	*			cis	179.9	169	-18	14.1	0	0	0	0	106.3	S853 N854	T171-S853 VanDerWaalsContact CB-O 3.29Å; T171-S853 WeakPolarHBondContact CB-O 3.42Å; T171-N854 VanDerWaalsContact C-CA 3.42Å; T171-N854 CarbonylContact C-O 3.43Å
172	P	40.2	Very low	32.4	Very low	56 Å²	56	115.3 Å²	115.3	36%	0.364	70%	0.696	S	S	.	*			trans	-54.9	-161.5	-166.5	-1.3	0.3	0	0	0	131.5	S853 N854 V855	P172-S853 WeakPolarHBondContact CD-O 3.27Å; P172-S853 VanDerWaalsContact CG-C 3.45Å; P172-N854 WeakPolarHBondContact CA-O 3.42Å; P172-N854 HydrophobicContact CB-CB 3.74Å; P172-N854 WeakPolarHBondContact CB-O 3.41Å; P172-N854 WeakPolarHBondContact CD-O 3.44Å; P172-N854 HydrophobicContact CG-CB 3.93Å; P172-N854 WeakPolarHBondContact CG-O 3.22Å; P172-N854 WeakPolarHBondContact O-CB 3.4Å; P172-N854 VanDerWaalsContact O-CG 3.25Å; P172-N854 PolarHBondContact O-ND2 3Å; P172-V855 VanDerWaalsContact CA-N 3.34Å; P172-V855 WeakPolarHBondContact CB-O 3.45Å; P172-V855 VanDerWaalsContact CD-N 3.27Å
173	T	36.2	Very low	32.3	Very low	83 Å²	83	113.3 Å²	113.3	51%	0.509	69%	0.694	S	S	.	*			trans	89.2	141	140.3	139.6	0	0	0	0	120.7
174	S	32.3	Very low	32.5	Very low	80 Å²	80	117 Å²	117	56%	0.559	71%	0.707	S	S	*	*			cis	-175.5	168.8	2.3	53.5	0	0	0	0	116
175	I	31.9	Very low	32.6	Very low	150 Å²	150	113.6 Å²	113.6	77%	0.769	71%	0.706	S	S	*	*			trans	71.1	140.3	142.5	-77.3	160.1	0	0	0	117.7
176	T	32.4	Very low	32.8	Very low	117 Å²	117	112.8 Å²	112.8	72%	0.718	71%	0.706	S	S	*	*			cis	-157.2	170.1	-22.2	38.8	0	0	0	0	107.7
177	S	34.6	Very low	33	Very low	90 Å²	90	113 Å²	113	63%	0.629	71%	0.709	S	S	*	*				168.4	145.4	75.2	-75.3	0	0	0	0	113
178	I	31.8	Very low	32.9	Very low	156 Å²	156	111.2 Å²	111.2	80%	0.8	70%	0.699	S	S	*	*			trans	66.7	132	135.8	-67.6	171.1	0	0	0	118.6
179	T	33	Very low	32.8	Very low	102 Å²	102	111.2 Å²	111.2	63%	0.626	69%	0.693	S	S	*	*			cis	-171.4	131.4	-2.6	-103	0	0	0	0	113.7
180	T	31.4	Very low	32.6	Very low	128 Å²	128	114.5 Å²	114.5	79%	0.785	69%	0.694	S	S	*	*			trans	60.8	161.1	155.8	62.5	0	0	0	0	119.3
181	V	33.2	Very low	32.5	Very low	131 Å²	131	113.3 Å²	113.3	79%	0.794	69%	0.691	S	S	*	*			cis	-139.7	136.5	29.8	174.5	0	0	0	0	114.5
182	A	32.8	Very low	32.1	Very low	100 Å²	100	114.4 Å²	114.4	83%	0.826	69%	0.693	S	S	*	*			trans	42.9	109.7	155.7	0	0	0	0	0	121.5
183	G	26.9	Very low	31.4	Very low	72 Å²	72	120.7 Å²	120.7	74%	0.742	71%	0.711	S	S	*	*			trans	-143.2	135.8	141.2	0	0	0	0	0	109.7
184	N	31.8	Very low	31	Very low	164 Å²	164	122.9 Å²	122.9	88%	0.877	72%	0.72	S	S	*	*			trans	-162.1	123	162.9	-92.2	-24.4	0	0	0	105.5
185	S	29.5	Very low	30.7	Very low	109 Å²	109	127 Å²	127	76%	0.762	74%	0.735	S	S	*	*			cis	92.9	70.6	40.5	-172.5	0	0	0	0	113.1
186	D	33	Very low	30.4	Very low	145 Å²	145	126 Å²	126	78%	0.775	74%	0.735	S	S	*	*			trans	-147.8	144.6	163.9	-90.8	-40.3	0	0	0	105.9
187	N	32.6	Very low	30.2	Very low	121 Å²	121	129.4 Å²	129.4	65%	0.647	74%	0.743	S	S	*	*			cis	-165.1	166.4	-18	-138.4	-34.8	0	0	0	109.6
188	N	31.5	Very low	29.9	Very low	115 Å²	115	129.6 Å²	129.6	62%	0.615	74%	0.744	S	S	*	*			trans	59.7	117.8	149	-71.2	-38.7	0	0	0	123.6
189	N	31.8	Very low	29.8	Very low	117 Å²	117	126.6 Å²	126.6	63%	0.626	74%	0.737	S	S	*	*				82.6	113	117.3	-61.8	-18.3	0	0	0	124.1
190	N	27.3	Very low	29.6	Very low	138 Å²	138	127.7 Å²	127.7	74%	0.738	74%	0.739	S	S	*	*				75.1	160.8	120.8	-62.6	-19.9	0	0	0	121.7
191	S	32.4	Very low	29.5	Very low	107 Å²	107	127.6 Å²	127.6	75%	0.748	73%	0.734	S	S	*	*			trans	63.2	100.5	176.8	10	0	0	0	0	113.2
192	N	26.8	Very low	29.2	Very low	121 Å²	121	128.3 Å²	128.3	65%	0.647	73%	0.73	S	S	*	*			cis	57.1	129.3	26.7	-158.8	25	0	0	0	113.2
193	Y	27.1	Very low	29.2	Very low	188 Å²	188	130.6 Å²	130.6	74%	0.737	72%	0.724	S	S	*	*			trans	65.5	136.6	-166.9	-45.5	-74.4	0	0	0	113.6
194	D	27.3	Very low	29.4	Very low	129 Å²	129	133.2 Å²	133.2	69%	0.69	72%	0.721	S	S	*	*			cis	-150.1	173.9	-2.6	-126.8	-33.7	0	0	0	112.4	V196	D194-V196 PolarHBondContact O-N 3.38Å
195	L	25.9	Very low	29.3	Very low	167 Å²	167	130.1 Å²	130.1	87%	0.874	70%	0.704	S	S	*	*			trans	-64.5	94.1	-173.5	-69.6	96.5	0	0	0	114.2
196	V	24.8	Very low	29.1	Very low	128 Å²	128	133.6 Å²	133.6	78%	0.776	70%	0.701	S	S	*	*			trans	-140.3	101.4	160.2	-173.8	0	0	0	0	111.1	D194	D194-V196 PolarHBondContact O-N 3.38Å
197	E	28.3	Very low	29.1	Very low	189 Å²	189	131.6 Å²	131.6	88%	0.883	69%	0.69	S	S	*	*			trans	-147.2	86.9	132.4	-159.1	161.5	-126.5	0	0	110.3	S199	E197-S199 PolarHBondContact O-N 2.71Å
198	S	27.6	Very low	28.8	Very low	94 Å²	94	131.2 Å²	131.2	66%	0.657	69%	0.688	S	S	*	*			trans	-78.3	92.8	170.9	54.6	0	0	0	0	110.2
199	S	31.4	Very low	28.6	Very low	94 Å²	94	130.6 Å²	130.6	66%	0.657	69%	0.688	S	S	*	*			trans	-114.4	108	155.5	-176.9	0	0	0	0	106.5	E197	E197-S199 PolarHBondContact O-N 2.71Å
200	N	29	Very low	28.4	Very low	124 Å²	124	132.3 Å²	132.3	66%	0.663	70%	0.695	S	S	*	*			cis	55.6	81.9	22.7	-75.3	23.5	0	0	0	113.5
201	D	28.9	Very low	28.5	Very low	126 Å²	126	130.4 Å²	130.4	67%	0.674	69%	0.692	S	S	*	*			trans	61.2	64.4	138.9	-55.1	-47.5	0	0	0	119.3
202	M	26.5	Very low	28.1	Very low	146 Å²	146	128.8 Å²	128.8	72%	0.719	68%	0.68	S	S	*	*			trans	-157.8	113.6	138.4	-84.7	-133.4	-76.2	0	0	108.5	L205	M202-L205 HydrophobicContact SD-CB 4.16Å; M202-L205 HydrophobicContact SD-CD2 3.78Å
203	Q	32.1	Very low	28	Very low	149 Å²	149	129.8 Å²	129.8	70%	0.696	68%	0.681	S	S	*	*			cis	-120.3	89.8	39.9	-66.4	175.1	-14.4	0	0	114.9	L205	Q203-L205 PolarHBondContact O-N 3.3Å
204	N	32.3	Very low	27.9	Very low	127 Å²	127	130 Å²	130	68%	0.679	68%	0.681	S	S	*	*	S	Bend	trans	-77.6	40.7	132.8	-101.5	-42.2	0	0	0	110.1
205	L	28.2	Very low	27.8	Very low	99 Å²	99	130.3 Å²	130.3	52%	0.518	68%	0.683	S	S	.	*			trans	-153.9	27.1	-172.8	-143.9	73.3	0	0	0	116	M202 Q203	M202-L205 HydrophobicContact SD-CB 4.16Å; M202-L205 HydrophobicContact SD-CD2 3.78Å; Q203-L205 PolarHBondContact O-N 3.3Å
206	Y	26.5	Very low	27.9	Very low	181 Å²	181	127.3 Å²	127.3	71%	0.71	68%	0.676	S	S	*	*	S	Bend	trans	-151.2	93.2	161.9	-147.2	-93.7	0	0	0	109.5
207	I	32.3	Very low	27.9	Very low	104 Å²	104	126.2 Å²	126.2	53%	0.533	67%	0.666	S	S	.	*	S	Bend	cis	-127.8	108.5	10.9	-66.4	178.2	0	0	0	109.5	T209 M210	I207-T209 VanDerWaalsContact CG2-C 3.43Å; I207-T209 VanDerWaalsContact CG2-N 3.29Å; I207-M210 HydrophobicContact CG2-CB 4.32Å; I207-M210 VanDerWaalsContact CG2-N 3.3Å
208	N	26.1	Very low	27.8	Very low	112 Å²	112	124.7 Å²	124.7	60%	0.599	66%	0.659	S	S	*	*	S	Bend	trans	-96.4	34.1	159.3	-126.1	-11.7	0	0	0	109.9
209	T	27.6	Very low	27.9	Very low	102 Å²	102	127.6 Å²	127.6	63%	0.626	67%	0.666	S	S	*	*			trans	-141	24.4	-167.5	-17.7	0	0	0	0	113	I207	I207-T209 VanDerWaalsContact CG2-C 3.43Å; I207-T209 VanDerWaalsContact CG2-N 3.29Å
210	M	28.6	Very low	27.8	Very low	154 Å²	154	129 Å²	129	76%	0.759	67%	0.665	S	S	*	*			trans	-111.6	27.6	148.5	-103	-66	155.4	0	0	111.2	I207 C212	I207-M210 HydrophobicContact CG2-CB 4.32Å; I207-M210 VanDerWaalsContact CG2-N 3.3Å; M210-C212 PolarHBondContact O-N 3.45Å
211	S	29.2	Very low	27.7	Very low	97 Å²	97	129.8 Å²	129.8	68%	0.678	67%	0.669	S	S	*	*			trans	-69.9	64.2	151.2	-61.9	0	0	0	0	109.8
212	C	23.5	Very low	27.5	Very low	73 Å²	73	128 Å²	128	49%	0.493	67%	0.667	S	S	.	*			trans	-142.1	126.6	166.9	-90.8	0	0	0	0	110.5	M210	M210-C212 PolarHBondContact O-N 3.45Å
213	Q	24.1	Very low	27.7	Very low	143 Å²	143	128.8 Å²	128.8	67%	0.668	67%	0.668	S	S	*	*				30.5	120.3	121.9	-44.1	169	-10.5	0	0	115.4
214	Y	26.5	Very low	27.4	Very low	191 Å²	191	126.3 Å²	126.3	75%	0.749	67%	0.667	S	S	*	*			cis	-145.4	160.5	22.7	-71.3	-94.4	0	0	0	107.9
215	N	23.7	Very low	27.2	Very low	137 Å²	137	125.8 Å²	125.8	73%	0.733	67%	0.674	S	S	*	*			cis	61.5	35.6	22.2	-136.7	80.7	0	0	0	117.1
216	S	28.9	Very low	27.1	Very low	103 Å²	103	126.9 Å²	126.9	72%	0.72	68%	0.684	S	S	*	*			trans	-104.1	101.2	138.9	52.4	0	0	0	0	105.9
217	N	25.1	Very low	27.3	Very low	106 Å²	106	123.9 Å²	123.9	57%	0.567	69%	0.687	S	S	*	*				44.9	127.5	72.9	-77.1	22.5	0	0	0	113.1
218	E	26.6	Very low	27.1	Very low	157 Å²	157	126.3 Å²	126.3	73%	0.734	70%	0.7	S	S	*	*			trans	57.4	119.3	150.6	-63.1	151.7	150.3	0	0	115.4
219	L	29.6	Very low	27.2	Very low	154 Å²	154	128 Å²	128	81%	0.806	70%	0.704	S	S	*	*				-143.8	129.1	58.4	-72.7	165	0	0	0	109.4
220	I	28.1	Very low	27.3	Very low	124 Å²	124	130.8 Å²	130.8	64%	0.636	72%	0.715	S	S	*	*				75.5	128.2	75.7	-71.8	-175.2	0	0	0	113.3
221	N	27.3	Very low	27.3	Very low	140 Å²	140	127.8 Å²	127.8	75%	0.749	71%	0.705	S	S	*	*			trans	73	102.8	164.1	-68.7	-9.7	0	0	0	121.4
222	S	25.9	Very low	27.2	Very low	90 Å²	90	129 Å²	129	63%	0.629	70%	0.704	S	S	*	*				69.9	160	123.6	68.7	0	0	0	0	121.2
223	H	30.6	Very low	27.3	Very low	162 Å²	162	134.9 Å²	134.9	75%	0.75	72%	0.717	S	S	*	*			trans	64.7	99.6	176.8	-51.8	-66.1	0	0	0	114
224	S	24.7	Very low	27.6	Very low	97 Å²	97	132.2 Å²	132.2	68%	0.678	71%	0.714	S	S	*	*				67.6	140.7	76.6	75.9	0	0	0	0	114.3
225	S	28.1	Very low	27.5	Very low	116 Å²	116	130.1 Å²	130.1	81%	0.811	72%	0.716	S	S	*	*			trans	86.9	146.3	171.2	-53.3	0	0	0	0	117.8
226	T	26.1	Very low	27.6	Very low	121 Å²	121	131 Å²	131	74%	0.742	72%	0.72	S	S	*	*			trans	-64.7	138.5	179.4	48	0	0	0	0	114.4
227	P	31.3	Very low	27.7	Very low	119 Å²	119	132.8 Å²	132.8	77%	0.773	72%	0.72	S	S	*	*			trans	-99.8	81.1	159.1	34.8	-28.6	0	0	0	111.5	H229	P227-H229 VanDerWaalsContact C-N 3.29Å; P227-H229 PolarHBondContact O-N 2.94Å; P227-H229 VanDerWaalsContact O-N 3.15Å
228	L	27	Very low	27.6	Very low	154 Å²	154	135.7 Å²	135.7	81%	0.806	74%	0.735	S	S	*	*			trans	-79.4	81.6	160.9	-96.3	173	0	0	0	108.6	L230	L228-L230 PolarHBondContact O-N 3.03Å
229	H	30	Very low	27.7	Very low	148 Å²	148	138.5 Å²	138.5	69%	0.685	74%	0.741	S	S	*	*			trans	-91.7	73.8	-172.5	-136.7	-124.3	0	0	0	112.4	P227 V231	P227-H229 VanDerWaalsContact C-N 3.29Å; P227-H229 PolarHBondContact O-N 2.94Å; P227-H229 VanDerWaalsContact O-N 3.15Å; H229-V231 WeakPolarHBondContact CE1-CG2 3.47Å; H229-V231 WeakPolarHBondContact ND1-CG2 3.47Å; H229-V231 PolarHBondContact O-N 3.03Å; H229-V231 VanDerWaalsContact O-N 3.14Å
230	L	27.9	Very low	27.5	Very low	160 Å²	160	135.1 Å²	135.1	84%	0.838	73%	0.73	S	S	*	*			trans	-72.6	93.6	158.8	-91	74.1	0	0	0	108.2	L228 N232	L228-L230 PolarHBondContact O-N 3.03Å; L230-N232 PolarHBondContact O-N 2.87Å
231	V	29.4	Very low	27.6	Very low	92 Å²	92	137.6 Å²	137.6	56%	0.558	74%	0.744	S	S	*	*			trans	-82.2	102.9	167.5	174.9	0	0	0	0	109.2	H229 Y233	H229-V231 WeakPolarHBondContact CE1-CG2 3.47Å; H229-V231 WeakPolarHBondContact ND1-CG2 3.47Å; H229-V231 PolarHBondContact O-N 3.03Å; H229-V231 VanDerWaalsContact O-N 3.14Å; V231-Y233 PolarHBondContact O-N 3.28Å; V231-Y233 VanDerWaalsContact O-N 3.07Å
232	N	27.1	Very low	27.6	Very low	123 Å²	123	137 Å²	137	66%	0.658	74%	0.74	S	S	*	*			trans	-30.5	97.9	162.4	-172.6	23.9	0	0	0	115.3	L230 S234	L230-N232 PolarHBondContact O-N 2.87Å; N232-S234 PolarHBondContact OD1-N 3.47Å
233	Y	24.9	Very low	27.8	Very low	196 Å²	196	140.6 Å²	140.6	77%	0.769	75%	0.753	S	S	*	*				-102.6	135.2	126.9	-63.3	-99.5	0	0	0	105	V231	V231-Y233 PolarHBondContact O-N 3.28Å; V231-Y233 VanDerWaalsContact O-N 3.07Å
234	S	30.3	Very low	27.7	Very low	86 Å²	86	141.6 Å²	141.6	60%	0.601	76%	0.758	S	S	*	*			cis	-135.6	135.4	29.3	-57.8	0	0	0	0	113.5	N232	N232-S234 PolarHBondContact OD1-N 3.47Å
235	N	24.8	Very low	28	Very low	147 Å²	147	143.5 Å²	143.5	79%	0.786	76%	0.76	S	S	*	*			trans	-74.8	159.8	135.6	-81.9	-21.6	0	0	0	108
236	L	26.4	Very low	28.2	Very low	156 Å²	156	147.2 Å²	147.2	82%	0.817	76%	0.758	S	S	*	*			trans	75.4	111.7	-148.1	-50.4	168.1	0	0	0	109.2
237	I	30	Very low	28.5	Very low	140 Å²	140	148.8 Å²	148.8	72%	0.718	76%	0.756	S	S	*	*			cis	-127.9	121.6	17.3	-68.1	170	0	0	0	110.8	Y239	I237-Y239 HydrophobicContact CG2-CD2 3.64Å; I237-Y239 HydrophobicContact CG2-CG 4.39Å
238	N	24.3	Very low	28.5	Very low	168 Å²	168	150 Å²	150	90%	0.898	75%	0.752	S	S	*	*			trans	-86.2	107.6	153.5	-93.6	-13.6	0	0	0	107.5
239	Y	28.1	Very low	28.7	Very low	215 Å²	215	150.8 Å²	150.8	84%	0.843	76%	0.756	S	S	*	*			trans	-112.5	113.4	153.7	-107.5	-72.4	0	0	0	107.4	I237	I237-Y239 HydrophobicContact CG2-CD2 3.64Å; I237-Y239 HydrophobicContact CG2-CG 4.39Å
240	S	25.3	Very low	28.7	Very low	84 Å²	84	147.5 Å²	147.5	59%	0.587	76%	0.762	S	S	*	*			trans	-60.9	134.8	174.3	-177.3	0	0	0	0	109.6	N242	S240-N242 PolarHBondContact OG-OD1 3.31Å
241	L	30.9	Very low	28.8	Very low	176 Å²	176	143.1 Å²	143.1	92%	0.921	76%	0.756	S	S	*	*			trans	-104.5	117.9	144.6	-138	86.9	0	0	0	106.8
242	N	26	Very low	28.7	Very low	127 Å²	127	149 Å²	149	68%	0.679	77%	0.769	S	S	*	*			trans	-67.6	147	-174.9	-53.5	-23.3	0	0	0	110.6	S240	S240-N242 PolarHBondContact OG-OD1 3.31Å
243	N	31.5	Very low	29	Very low	166 Å²	166	151.2 Å²	151.2	89%	0.888	78%	0.775	S	S	*	*			trans	-167	93.3	147	-93.9	-23.6	0	0	0	107.9
244	E	27.1	Very low	29.3	Very low	183 Å²	183	150.5 Å²	150.5	86%	0.855	78%	0.779	S	S	*	*			trans	-74.4	137.5	154.7	-61.2	-171.8	124.4	0	0	107.8
245	D	31.9	Very low	29.2	Very low	137 Å²	137	152.6 Å²	152.6	73%	0.733	79%	0.792	S	S	*	*				173.1	166.7	122.5	-100.2	-30.9	0	0	0	113.1
246	Y	31.3	Very low	29.5	Very low	194 Å²	194	154 Å²	154	76%	0.761	79%	0.794	S	S	*	*			trans	72.8	86.8	171	-65.6	-75.8	0	0	0	119.1
247	H	33.3	Very low	29.8	Very low	153 Å²	153	152 Å²	152	71%	0.708	79%	0.79	S	S	*	*				36	153.2	115.9	-67.4	-86.1	0	0	0	121.5
248	Q	30.6	Very low	29.9	Very low	146 Å²	146	154 Å²	154	68%	0.682	80%	0.796	S	S	*	*			cis	176	157.6	-23.6	-156.1	169.7	19.4	0	0	106.6
249	L	32.5	Very low	30.1	Very low	170 Å²	170	154.5 Å²	154.5	89%	0.89	79%	0.793	S	S	*	*			trans	70.1	146.2	170.7	-44.1	171	0	0	0	116.6
250	G	28.7	Very low	30.4	Very low	78 Å²	78	152.2 Å²	152.2	80%	0.804	79%	0.79	S	S	*	*			cis	162	102	-14.3	0	0	0	0	0	116.2
251	G	31	Very low	30.6	Very low	69 Å²	69	156.2 Å²	156.2	71%	0.711	80%	0.799	S	S	*	*			trans	78.9	172.7	164.4	0	0	0	0	0	117.8
252	Y	27.7	Very low	30.6	Very low	214 Å²	214	155 Å²	155	84%	0.839	79%	0.788	S	S	*	*			cis	-168.2	162.3	-20.3	-120.3	-71.9	0	0	0	110.1
253	H	33.3	Very low	31	Very low	170 Å²	170	155.4 Å²	155.4	79%	0.787	79%	0.79	S	S	*	*			trans	74.9	90.8	161.7	-62.8	-59.5	0	0	0	124.1
254	Q	29.4	Very low	30.8	Very low	182 Å²	182	156.2 Å²	156.2	85%	0.85	79%	0.789	S	S	*	*			trans	-13.8	144.6	132.1	177.8	-179.8	10.2	0	0	121.9
255	C	29.2	Very low	31.1	Very low	129 Å²	129	152.1 Å²	152.1	87%	0.872	78%	0.778	S	S	*	*			trans	-164.8	163	143.9	-116.5	0	0	0	0	117.1
256	H	31.4	Very low	30.9	Very low	178 Å²	178	152.9 Å²	152.9	82%	0.824	78%	0.781	S	S	*	*			trans	-60.8	165.4	-162.6	-100.3	-96.6	0	0	0	123.3
257	P	32.5	Very low	31	Very low	112 Å²	112	150.8 Å²	150.8	73%	0.727	78%	0.779	S	S	*	*			trans	-119.7	164.8	167.4	42	-32	0	0	0	117.2
258	Q	31.8	Very low	30.9	Very low	184 Å²	184	151.1 Å²	151.1	86%	0.86	78%	0.778	S	S	*	*			trans	-149.3	128.4	167.7	-72.2	-178.7	-46.2	0	0	108.3
259	Q	28.8	Very low	30.7	Very low	177 Å²	177	149.2 Å²	149.2	83%	0.827	78%	0.781	S	S	*	*				86.5	146.1	70.1	-82.9	-160.8	-6.2	0	0	117.3
260	H	34.1	Very low	30.6	Very low	167 Å²	167	146.5 Å²	146.5	77%	0.773	78%	0.776	S	S	*	*			trans	110.9	113.7	-179.1	-67.5	-70.5	0	0	0	114.9
261	H	29.7	Very low	30.6	Very low	168 Å²	168	150.5 Å²	150.5	78%	0.778	78%	0.778	S	S	*	*				72.3	135.6	79.5	-82.6	-92.7	0	0	0	112.7
262	E	31.3	Very low	30.6	Very low	150 Å²	150	155.1 Å²	155.1	70%	0.701	79%	0.787	S	S	*	*			cis	-162.4	159.5	31.5	-124.2	179.2	124.5	0	0	115.1
263	N	33.3	Very low	30.5	Very low	136 Å²	136	152.4 Å²	152.4	73%	0.727	79%	0.787	S	S	*	*			trans	67.7	157.2	146.5	-58.6	-22.6	0	0	0	126.2
264	Q	27.8	Very low	30.3	Very low	184 Å²	184	149.5 Å²	149.5	86%	0.86	79%	0.786	S	S	*	*			trans	-120.4	-152.8	-180	-50.8	-179.3	-10.6	0	0	109.7
265	P	33.1	Very low	30.3	Very low	97 Å²	97	150.6 Å²	150.6	63%	0.63	79%	0.788	S	S	*	*			cis	-142.9	-178.9	-14.8	37.9	-16.3	0	0	0	118.4
266	L	28	Very low	30.3	Very low	152 Å²	152	149.3 Å²	149.3	80%	0.796	78%	0.78	S	S	*	*			trans	85.4	151.7	140	-90.9	164.3	0	0	0	124.9
267	E	33.5	Very low	30.1	Very low	151 Å²	151	147.3 Å²	147.3	71%	0.706	77%	0.774	S	S	*	*			trans	84.7	143.9	168.9	-53.5	-134.7	126.2	0	0	119.5
268	K	31.8	Very low	29.7	Very low	159 Å²	159	149.2 Å²	149.2	69%	0.691	78%	0.778	S	S	*	*			cis	-172.4	139.9	-36.2	-117.2	174.8	-160	156.1	0	110.9
269	S	26.1	Very low	29.5	Very low	107 Å²	107	148.9 Å²	148.9	75%	0.748	77%	0.774	S	S	*	*			trans	45.5	108.9	151	61.2	0	0	0	0	123.8
270	S	29.9	Very low	29.4	Very low	113 Å²	113	144.8 Å²	144.8	79%	0.79	77%	0.765	S	S	*	*				-175.7	108.1	123.1	57.7	0	0	0	0	109.3
271	L	29.1	Very low	29	Very low	162 Å²	162	144.7 Å²	144.7	85%	0.848	77%	0.769	S	S	*	*				56.8	97.7	93.8	-166.9	79.9	0	0	0	114.6
272	D	30.7	Very low	28.8	Very low	165 Å²	165	140.7 Å²	140.7	88%	0.882	75%	0.754	S	S	*	*			trans	-164.4	150.6	143.7	-118.4	-23.6	0	0	0	110.9
273	D	26.5	Very low	28.7	Very low	157 Å²	157	138.9 Å²	138.9	84%	0.84	75%	0.749	S	S	*	*			trans	-95.1	120.9	-171.3	-91.3	-56	0	0	0	113.9
274	S	29.1	Very low	28.4	Very low	110 Å²	110	138.1 Å²	138.1	77%	0.769	74%	0.744	S	S	*	*			trans	-159.9	108.3	159.3	47.6	0	0	0	0	113.8	S276	S274-S276 PolarHBondContact O-N 3.01Å
275	K	29.3	Very low	28.4	Very low	205 Å²	205	137.2 Å²	137.2	89%	0.891	73%	0.734	S	S	*	*			trans	-85.9	90.5	171.2	-76.7	-176.6	177.7	175.4	0	111.1	I277	K275-I277 PolarHBondContact O-N 2.98Å
276	S	27.6	Very low	28.2	Very low	101 Å²	101	139.3 Å²	139.3	71%	0.706	73%	0.729	S	S	*	*			trans	-75.9	106	172.4	48.1	0	0	0	0	111.6	S274 N278	S274-S276 PolarHBondContact O-N 3.01Å; S276-N278 PolarHBondContact O-N 3.36Å
277	I	27.5	Very low	28.1	Very low	136 Å²	136	138 Å²	138	70%	0.697	72%	0.723	S	S	*	*			trans	-87.8	102	176.5	-59.9	178.4	0	0	0	109.4	K275 F279	K275-I277 PolarHBondContact O-N 2.98Å; I277-F279 HydrophobicContact CG2-CD2 3.55Å; I277-F279 HydrophobicContact CG2-CE2 3.51Å
278	N	25.4	Very low	27.8	Very low	153 Å²	153	137.7 Å²	137.7	82%	0.818	73%	0.732	S	S	*	*			trans	-90.8	108.1	173.5	-90.1	-56.8	0	0	0	111.4	S276	S276-N278 PolarHBondContact O-N 3.36Å
279	F	26.6	Very low	27.7	Very low	176 Å²	176	134.9 Å²	134.9	77%	0.772	73%	0.728	S	S	*	*			trans	-104.5	108	168.6	-86.7	-68.6	0	0	0	111.5	I277 L281	I277-F279 HydrophobicContact CG2-CD2 3.55Å; I277-F279 HydrophobicContact CG2-CE2 3.51Å; F279-L281 PolarHBondContact O-N 3.45Å
280	S	26.4	Very low	28.2	Very low	92 Å²	92	133.1 Å²	133.1	64%	0.643	72%	0.716	S	S	*	*			trans	-82.6	111.5	175.6	-173.1	0	0	0	0	111.4	N282	S280-N282 PolarHBondContact O-N 3.13Å
281	L	26.4	Very low	28.3	Very low	164 Å²	164	132 Å²	132	86%	0.859	70%	0.701	S	S	*	*			trans	-71.5	34.1	-175.8	-85.4	163.1	0	0	0	115.2	F279	F279-L281 PolarHBondContact O-N 3.45Å
282	N	26.5	Very low	28.8	Very low	85 Å²	85	132.5 Å²	132.5	46%	0.455	70%	0.699	S	S	.	*			trans	-117.2	26.2	-159.4	-96.8	-62.9	0	0	0	117	S280 K554	S280-N282 PolarHBondContact O-N 3.13Å; N282-K554 WeakPolarHBondContact O-CE 3.18Å; N282-K554 PolarHBondContact OD1-NZ 3.3Å
283	N	27.2	Very low	29.4	Very low	111 Å²	111	126.9 Å²	126.9	59%	0.594	67%	0.673	S	S	*	*			trans	-138.9	45.3	-176	-96.4	-37.3	0	0	0	115.8	N558	N283-N558 VanDerWaalsContact CG-ND2 3.34Å; N283-N558 PolarHBondContact ND2-ND2 3.21Å; N283-N558 PolarHBondContact OD1-ND2 3.38Å
284	L	28.9	Very low	30	Very low	121 Å²	121	122.7 Å²	122.7	63%	0.634	65%	0.648	S	S	*	*			trans	-117.1	104.9	168.5	-89.5	157.3	0	0	0	111.1	W286	L284-W286 HydrophobicContact CD1-CZ2 4.33Å; L284-W286 HydrophobicContact CD2-CH2 4.45Å; L284-W286 HydrophobicContact CD2-CZ2 4.18Å
285	Y	26.5	Very low	30.5	Very low	164 Å²	164	122.4 Å²	122.4	64%	0.643	64%	0.637	S	S	*	*			trans	-101.4	107.4	175.2	-148.9	-83.8	0	0	0	108.4	N287	Y285-N287 PolarHBondContact O-N 2.68Å
286	W	29	Very low	31.1	Very low	141 Å²	141	115.4 Å²	115.4	53%	0.534	61%	0.614	S	S	.	*			trans	-84.9	99.4	-169.8	-66.9	98.4	0	0	0	112.2	L284 I298	L284-W286 HydrophobicContact CD1-CZ2 4.33Å; L284-W286 HydrophobicContact CD2-CH2 4.45Å; L284-W286 HydrophobicContact CD2-CZ2 4.18Å; W286-I298 HydrophobicContact CH2-CD1 4.46Å; W286-I298 HydrophobicContact CH2-CG1 4.19Å
287	N	26.6	Very low	31.6	Very low	124 Å²	124	114.1 Å²	114.1	66%	0.663	60%	0.604	S	S	*	*			trans	-81.6	128.7	169.2	-84	-10.1	0	0	0	111.1	Y285 T289	Y285-N287 PolarHBondContact O-N 2.68Å; N287-T289 PolarHBondContact O-N 3.14Å
288	T	26.9	Very low	32.3	Very low	146 Å²	146	110.2 Å²	110.2	90%	0.896	58%	0.584	S	S	*	*			trans	-85.3	71.1	-165.7	42.8	0	0	0	0	114
289	T	30.2	Very low	33.4	Very low	99 Å²	99	107 Å²	107	61%	0.607	57%	0.567	S	S	*	*			trans	-115.4	123.6	170.9	52.4	0	0	0	0	112.1	N287 D291	N287-T289 PolarHBondContact O-N 3.14Å; T289-D291 PolarHBondContact O-N 3.31Å
290	S	35.5	Very low	35.1	Very low	70 Å²	70	104.4 Å²	104.4	49%	0.49	56%	0.555	S	S	.	*			trans	-78.6	85.8	-175.2	63.2	0	0	0	0	111.7
291	D	33.4	Very low	36.2	Very low	89 Å²	89	103.7 Å²	103.7	48%	0.476	55%	0.547	S	S	.	.			trans	-127	130	177.7	-156.2	61.3	0	0	0	111.7	T289 S293 Q294	T289-D291 PolarHBondContact O-N 3.31Å; D291-S293 PolarHBondContact O-N 3.41Å; D291-S293 WeakPolarHBondContact OD2-CB 3.38Å; D291-S293 PolarHBondContact OD2-OG 3.44Å; D291-Q294 PolarHBondContact O-N 3.35Å; D291-Q294 VanDerWaalsContact O-N 3.09Å
292	E	39.6	Very low	37.1	Very low	174 Å²	174	101 Å²	101	81%	0.813	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-21.7	-168.5	-154.8	156.3	-149.2	0	0	112.2	Q294 L295	E292-Q294 PolarHBondContact O-N 3.11Å; E292-L295 PolarHBondContact O-N 3.07Å
293	S	42.9	Very low	38.4	Very low	47 Å²	47	101.6 Å²	101.6	33%	0.329	53%	0.531	S	S	.	.	H	α-helix	trans	-54.9	-34.3	170.3	62.2	0	0	0	0	113.7	D291 L295 S296 C297	D291-S293 PolarHBondContact O-N 3.41Å; D291-S293 WeakPolarHBondContact OD2-CB 3.38Å; D291-S293 PolarHBondContact OD2-OG 3.44Å; S293-L295 VanDerWaalsContact C-N 3.34Å; S293-L295 PolarHBondContact O-N 3.16Å; S293-S296 PolarHBondContact O-N 2.86Å; S293-C297 PolarHBondContact O-N 3.08Å
294	Q	38.9	Very low	39.5	Very low	69 Å²	69	101 Å²	101	32%	0.322	53%	0.528	S	S	.	.	H	α-helix	trans	-72.3	-24.1	-176.7	-65.5	-160.5	22.2	0	0	113.4	D291 E292 C297 I298	D291-Q294 PolarHBondContact O-N 3.35Å; D291-Q294 VanDerWaalsContact O-N 3.09Å; E292-Q294 PolarHBondContact O-N 3.11Å; Q294-C297 WeakPolarHBondContact O-CB 3.24Å; Q294-C297 PolarHBondContact O-N 3.27Å; Q294-I298 WeakPolarHBondContact O-CG1 3.46Å; Q294-I298 PolarHBondContact O-N 3.38Å
295	L	38.3	Very low	40.2	Very low	104 Å²	104	97.7 Å²	97.7	55%	0.545	51%	0.513	S	S	.	.	H	α-helix	trans	-67.6	-38	173.6	-81.9	80	0	0	0	111.2	E292 S293 C297 I298 D299	E292-L295 PolarHBondContact O-N 3.07Å; S293-L295 VanDerWaalsContact C-N 3.34Å; S293-L295 PolarHBondContact O-N 3.16Å; L295-C297 VanDerWaalsContact C-N 3.26Å; L295-C297 PolarHBondContact O-N 3.41Å; L295-I298 PolarHBondContact O-N 3.31Å; L295-I298 VanDerWaalsContact O-N 3.15Å; L295-D299 PolarHBondContact O-N 3.5Å
296	S	43.7	Very low	41.1	Very low	57 Å²	57	96 Å²	96	40%	0.399	51%	0.509	S	S	.	.	H	α-helix	trans	-64	-33	172.5	-173	0	0	0	0	112.2	S293 K300	S293-S296 PolarHBondContact O-N 2.86Å; S296-K300 WeakPolarHBondContact O-CB 3.38Å; S296-K300 VanDerWaalsContact O-CG 3.31Å; S296-K300 WeakPolarHBondContact O-CG 3.23Å; S296-K300 PolarHBondContact O-N 3.19Å
297	C	38.2	Very low	42.5	Very low	75 Å²	75	95.2 Å²	95.2	51%	0.507	51%	0.509	S	S	.	.	H	α-helix	trans	-69.3	-39.3	171.9	-65.3	0	0	0	0	112.2	S293 Q294 L295 K300 V301	S293-C297 PolarHBondContact O-N 3.08Å; Q294-C297 WeakPolarHBondContact O-CB 3.24Å; Q294-C297 PolarHBondContact O-N 3.27Å; L295-C297 VanDerWaalsContact C-N 3.26Å; L295-C297 PolarHBondContact O-N 3.41Å; C297-K300 PolarHBondContact O-N 3.05Å; C297-V301 WeakPolarHBondContact O-CB 3.45Å; C297-V301 VanDerWaalsContact O-CG2 3.23Å; C297-V301 WeakPolarHBondContact O-CG2 3.47Å; C297-V301 PolarHBondContact O-N 3.08Å
298	I	41.8	Very low	43.3	Very low	54 Å²	54	92.5 Å²	92.5	28%	0.277	50%	0.504	S	S	.	.	H	α-helix	trans	-64.4	-50	174.9	-69.4	164.4	0	0	0	110.5	W286 Q294 L295 K300 V301 M302	W286-I298 HydrophobicContact CH2-CD1 4.46Å; W286-I298 HydrophobicContact CH2-CG1 4.19Å; Q294-I298 WeakPolarHBondContact O-CG1 3.46Å; Q294-I298 PolarHBondContact O-N 3.38Å; L295-I298 PolarHBondContact O-N 3.31Å; L295-I298 VanDerWaalsContact O-N 3.15Å; I298-K300 VanDerWaalsContact C-N 3.32Å; I298-K300 PolarHBondContact O-N 2.94Å; I298-V301 PolarHBondContact O-N 2.75Å; I298-M302 HydrophobicContact CG2-CG 4.25Å; I298-M302 WeakPolarHBondContact O-CB 3.41Å; I298-M302 VanDerWaalsContact O-CG 3.27Å; I298-M302 WeakPolarHBondContact O-CG 3.45Å; I298-M302 PolarHBondContact O-N 3.08Å
299	D	48.4	Very low	43.7	Very low	85 Å²	85	91.9 Å²	91.9	46%	0.455	50%	0.495	S	S	.	.	H	α-helix	trans	-57.1	-44.9	176.9	-77.2	-36.9	0	0	0	110.5	L295 M302 E303 K341	L295-D299 PolarHBondContact O-N 3.5Å; D299-M302 PolarHBondContact O-N 3.1Å; D299-E303 VanDerWaalsContact O-CB 3.28Å; D299-E303 WeakPolarHBondContact O-CB 3.48Å; D299-E303 PolarHBondContact O-N 3.32Å; D299-K341 IonicContact OD1-NZ 2.81Å
300	K	61.2	Low	43.7	Very low	121 Å²	121	91.7 Å²	91.7	53%	0.526	50%	0.496	S	S	.	.	H	α-helix	trans	-66.3	-37.5	175.7	-77.6	171	178	164.2	0	114.2	S296 C297 I298 N304	S296-K300 WeakPolarHBondContact O-CB 3.38Å; S296-K300 VanDerWaalsContact O-CG 3.31Å; S296-K300 WeakPolarHBondContact O-CG 3.23Å; S296-K300 PolarHBondContact O-N 3.19Å; C297-K300 PolarHBondContact O-N 3.05Å; I298-K300 VanDerWaalsContact C-N 3.32Å; I298-K300 PolarHBondContact O-N 2.94Å; K300-N304 VanDerWaalsContact O-CB 3.24Å; K300-N304 WeakPolarHBondContact O-CB 3.47Å; K300-N304 PolarHBondContact O-N 3.32Å; K300-N304 PolarHBondContact O-ND2 2.95Å
301	V	50.5	Low	43.4	Very low	78 Å²	78	92.8 Å²	92.8	47%	0.473	50%	0.502	S	S	.	.	H	α-helix	trans	-68.4	-40.6	176.1	166.1	0	0	0	0	110.5	C297 I298 N304 T305	C297-V301 WeakPolarHBondContact O-CB 3.45Å; C297-V301 VanDerWaalsContact O-CG2 3.23Å; C297-V301 WeakPolarHBondContact O-CG2 3.47Å; C297-V301 PolarHBondContact O-N 3.08Å; I298-V301 PolarHBondContact O-N 2.75Å; V301-N304 PolarHBondContact O-N 2.99Å; V301-T305 PolarHBondContact O-N 3.28Å; V301-T305 PolarHBondContact O-OG1 2.81Å
302	M	44.1	Very low	43.3	Very low	107 Å²	107	96 Å²	96	53%	0.527	52%	0.518	S	S	.	.	H	α-helix	trans	-68.4	-36.9	175.3	-69.1	-64	-68.1	0	0	112.4	I298 D299 T305 K306	I298-M302 HydrophobicContact CG2-CG 4.25Å; I298-M302 WeakPolarHBondContact O-CB 3.41Å; I298-M302 VanDerWaalsContact O-CG 3.27Å; I298-M302 WeakPolarHBondContact O-CG 3.45Å; I298-M302 PolarHBondContact O-N 3.08Å; D299-M302 PolarHBondContact O-N 3.1Å; M302-T305 WeakPolarHBondContact CA-OG1 3.44Å; M302-T305 PolarHBondContact O-OG1 2.97Å; M302-T305 VanDerWaalsContact O-OG1 3.11Å; M302-K306 VanDerWaalsContact O-CB 3.31Å; M302-K306 WeakPolarHBondContact O-CB 3.42Å; M302-K306 PolarHBondContact O-N 3.3Å
303	E	54.7	Low	42.8	Very low	97 Å²	97	93.2 Å²	93.2	45%	0.453	52%	0.517	S	S	.	.	H	α-helix	trans	-68.1	-37.3	173	-162.2	-168.8	156.4	0	0	111.2	D299 K306 K307	D299-E303 VanDerWaalsContact O-CB 3.28Å; D299-E303 WeakPolarHBondContact O-CB 3.48Å; D299-E303 PolarHBondContact O-N 3.32Å; E303-K306 PolarHBondContact O-N 3.32Å; E303-K307 WeakPolarHBondContact O-CB 3.5Å; E303-K307 VanDerWaalsContact O-CG 3.28Å; E303-K307 WeakPolarHBondContact O-CG 3.31Å; E303-K307 PolarHBondContact O-N 3.47Å; E303-K307 VanDerWaalsContact OE1-CE 3.22Å; E303-K307 WeakPolarHBondContact OE1-CE 3.45Å; E303-K307 IonicContact OE1-NZ 2.88Å; E303-K307 PolarHBondContact OE1-NZ 3.36Å
304	N	50.9	Low	42.2	Very low	99 Å²	99	96 Å²	96	53%	0.529	53%	0.533	S	S	.	.	H	α-helix	trans	-71.6	-37.4	175.7	-74	-15.2	0	0	0	112.7	K300 V301 K307 A308	K300-N304 VanDerWaalsContact O-CB 3.24Å; K300-N304 WeakPolarHBondContact O-CB 3.47Å; K300-N304 PolarHBondContact O-N 3.32Å; K300-N304 PolarHBondContact O-ND2 2.95Å; V301-N304 PolarHBondContact O-N 2.99Å; N304-K307 PolarHBondContact O-N 3.36Å; N304-A308 WeakPolarHBondContact O-CB 3.45Å; N304-A308 PolarHBondContact O-N 2.91Å
305	T	42.7	Very low	41.8	Very low	51 Å²	51	100.5 Å²	100.5	31%	0.313	56%	0.559	S	S	.	*	H	α-helix	trans	-68.4	-36.8	170.1	48.3	0	0	0	0	111.5	V301 M302 K307 A308 L309	V301-T305 PolarHBondContact O-N 3.28Å; V301-T305 PolarHBondContact O-OG1 2.81Å; M302-T305 WeakPolarHBondContact CA-OG1 3.44Å; M302-T305 PolarHBondContact O-OG1 2.97Å; M302-T305 VanDerWaalsContact O-OG1 3.11Å; T305-K307 VanDerWaalsContact C-N 3.32Å; T305-K307 PolarHBondContact O-N 3.17Å; T305-A308 PolarHBondContact O-N 3.33Å; T305-A308 VanDerWaalsContact O-N 3.14Å; T305-L309 WeakPolarHBondContact O-CB 3.4Å; T305-L309 WeakPolarHBondContact O-CD1 3.36Å; T305-L309 VanDerWaalsContact O-CG 3.26Å; T305-L309 WeakPolarHBondContact O-CG 3.22Å; T305-L309 PolarHBondContact O-N 3.43Å
306	K	45.5	Very low	41.4	Very low	130 Å²	130	103.4 Å²	103.4	57%	0.565	57%	0.573	S	S	*	*	H	α-helix	trans	-60.1	-40.3	171.3	-169.4	174.4	-177.9	179.5	0	112	M302 E303 C310	M302-K306 VanDerWaalsContact O-CB 3.31Å; M302-K306 WeakPolarHBondContact O-CB 3.42Å; M302-K306 PolarHBondContact O-N 3.3Å; E303-K306 PolarHBondContact O-N 3.32Å; K306-C310 PolarHBondContact O-N 3.2Å
307	K	57.7	Low	40.6	Very low	123 Å²	123	106.4 Å²	106.4	54%	0.535	59%	0.589	S	S	.	*	H	α-helix	trans	-70.7	-28.5	173.5	-72.1	167.3	-174.7	169.5	0	113.6	E303 N304 T305	E303-K307 WeakPolarHBondContact O-CB 3.5Å; E303-K307 VanDerWaalsContact O-CG 3.28Å; E303-K307 WeakPolarHBondContact O-CG 3.31Å; E303-K307 PolarHBondContact O-N 3.47Å; E303-K307 VanDerWaalsContact OE1-CE 3.22Å; E303-K307 WeakPolarHBondContact OE1-CE 3.45Å; E303-K307 IonicContact OE1-NZ 2.88Å; E303-K307 PolarHBondContact OE1-NZ 3.36Å; N304-K307 PolarHBondContact O-N 3.36Å; T305-K307 VanDerWaalsContact C-N 3.32Å; T305-K307 PolarHBondContact O-N 3.17Å
308	A	43.7	Very low	40.2	Very low	67 Å²	67	109.6 Å²	109.6	55%	0.554	60%	0.601	S	S	*	*	H	α-helix	trans	-81.1	-25.8	175.7	0	0	0	0	0	113.5	N304 T305	N304-A308 WeakPolarHBondContact O-CB 3.45Å; N304-A308 PolarHBondContact O-N 2.91Å; T305-A308 PolarHBondContact O-N 3.33Å; T305-A308 VanDerWaalsContact O-N 3.14Å
309	L	35.7	Very low	39.6	Very low	134 Å²	134	112.8 Å²	112.8	70%	0.702	62%	0.623	S	S	*	*	H	α-helix	trans	-83.4	-17.7	178	-73.1	164.8	0	0	0	113.4	T305	T305-L309 WeakPolarHBondContact O-CB 3.4Å; T305-L309 WeakPolarHBondContact O-CD1 3.36Å; T305-L309 VanDerWaalsContact O-CG 3.26Å; T305-L309 WeakPolarHBondContact O-CG 3.22Å; T305-L309 PolarHBondContact O-N 3.43Å
310	C	30	Very low	38.9	Very low	94 Å²	94	113.6 Å²	113.6	64%	0.635	63%	0.631	S	S	*	*			trans	-103.8	81.8	169.4	-65.2	0	0	0	0	109.7	K306	K306-C310 PolarHBondContact O-N 3.2Å
311	P	30.2	Very low	37.6	Very low	94 Å²	94	115 Å²	115	61%	0.61	65%	0.645	S	S	*	*				-146.9	110.5	96.4	34.6	-16.7	0	0	0	114.5
312	I	30.9	Very low	37	Very low	157 Å²	157	118 Å²	118	81%	0.805	66%	0.658	S	S	*	*			trans	-123.5	-12.3	164.8	-64.3	180	0	0	0	111.2	T314	I312-T314 VanDerWaalsContact C-N 3.3Å; I312-T314 PolarHBondContact O-N 3.33Å; I312-T314 VanDerWaalsContact O-N 3.16Å
313	S	29.8	Very low	36.7	Very low	115 Å²	115	116.9 Å²	116.9	80%	0.804	66%	0.657	S	S	*	*	S	Bend	trans	-84.1	25.4	-173.7	48.2	0	0	0	0	115.8
314	T	29.7	Very low	36	Very low	106 Å²	106	116.6 Å²	116.6	65%	0.65	66%	0.662	S	S	*	*	S	Bend	trans	-142.3	75.7	177.3	55.8	0	0	0	0	112.5	I312	I312-T314 VanDerWaalsContact C-N 3.3Å; I312-T314 PolarHBondContact O-N 3.33Å; I312-T314 VanDerWaalsContact O-N 3.16Å
315	N	29.3	Very low	35.5	Very low	162 Å²	162	118.7 Å²	118.7	87%	0.866	67%	0.669	S	S	*	*			trans	-180	51.8	150.2	-94.8	-12.4	0	0	0	113.2
316	I	30.1	Very low	35.5	Very low	166 Å²	166	123.2 Å²	123.2	85%	0.851	68%	0.684	S	S	*	*			trans	-132.6	87.8	162.6	-53.7	-179.7	0	0	0	108.9
317	T	28	Very low	35.1	Very low	120 Å²	120	121.8 Å²	121.8	74%	0.736	68%	0.682	S	S	*	*			trans	-78.1	147.3	160.6	47.7	0	0	0	0	109.7
318	N	29.2	Very low	34.1	Very low	142 Å²	142	120.8 Å²	120.8	76%	0.759	68%	0.683	S	S	*	*	S	Bend	trans	71.6	78.3	172.5	-46.1	-32.3	0	0	0	116.2
319	T	29.9	Very low	34.3	Very low	121 Å²	121	123 Å²	123	74%	0.742	68%	0.681	S	S	*	*	S	Bend		175.2	150.7	108.2	32	0	0	0	0	113.8
320	T	33.1	Very low	34.4	Very low	101 Å²	101	120.9 Å²	120.9	62%	0.62	67%	0.671	S	S	*	*			trans	54.7	95.5	166.3	53.2	0	0	0	0	118.4	N322	T320-N322 PolarHBondContact O-N 3.49Å
321	N	34	Very low	34.7	Very low	151 Å²	151	120 Å²	120	81%	0.807	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	31.2	-176.6	-56.7	-2.6	0	0	0	116.2
322	N	38.3	Very low	35.3	Very low	142 Å²	142	122.8 Å²	122.8	76%	0.759	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120	5	-176.6	-76.1	-7.4	0	0	0	114.1	T320	T320-N322 PolarHBondContact O-N 3.49Å
323	T	37.8	Very low	35.8	Very low	83 Å²	83	123 Å²	123	51%	0.509	66%	0.661	S	S	.	*	S	Bend	trans	-107.3	-25.9	-174.9	50	0	0	0	0	113.8	K326 L327	T323-K326 PolarHBondContact O-N 3.07Å; T323-L327 PolarHBondContact O-N 3.14Å
324	T	39.1	Very low	36	Very low	90 Å²	90	121.8 Å²	121.8	55%	0.552	65%	0.653	S	S	*	*	H	α-helix	trans	-67.4	-45.6	-177.4	39.9	0	0	0	0	113.1	K326 L327 D328	T324-K326 VanDerWaalsContact C-N 3.26Å; T324-K326 PolarHBondContact O-N 3.13Å; T324-L327 WeakPolarHBondContact O-CA 3.26Å; T324-L327 WeakPolarHBondContact O-CB 3.26Å; T324-L327 PolarHBondContact O-N 3.29Å; T324-D328 PolarHBondContact O-N 3.2Å
325	E	40.1	Very low	36.4	Very low	143 Å²	143	120.7 Å²	120.7	67%	0.668	64%	0.642	S	S	*	*	H	α-helix	trans	-62.3	-33.6	178	-64.7	-172.2	148.8	0	0	112.5	L327 Q329	E325-L327 VanDerWaalsContact C-N 3.34Å; E325-Q329 WeakPolarHBondContact O-CB 3.28Å; E325-Q329 WeakPolarHBondContact O-CG 3.47Å; E325-Q329 PolarHBondContact O-N 3.4Å
326	K	42.7	Very low	36.6	Very low	146 Å²	146	117.2 Å²	117.2	64%	0.635	62%	0.623	S	S	*	*	H	α-helix	trans	-68.8	-32.5	172.3	-86.8	-172.5	171.5	-176.3	0	112.6	T323 T324 L330	T323-K326 PolarHBondContact O-N 3.07Å; T324-K326 VanDerWaalsContact C-N 3.26Å; T324-K326 PolarHBondContact O-N 3.13Å; K326-L330 WeakPolarHBondContact O-CB 3.37Å; K326-L330 WeakPolarHBondContact O-CD1 3.42Å; K326-L330 VanDerWaalsContact O-CG 3.23Å; K326-L330 WeakPolarHBondContact O-CG 3.48Å; K326-L330 PolarHBondContact O-N 3.11Å
327	L	37.9	Very low	37.1	Very low	100 Å²	100	114 Å²	114	52%	0.524	61%	0.607	S	S	.	*	H	α-helix	trans	-68.9	-45.3	175.6	-107.5	163.3	0	0	0	111.4	T323 T324 E325 Q329 L330 I331	T323-L327 PolarHBondContact O-N 3.14Å; T324-L327 WeakPolarHBondContact O-CA 3.26Å; T324-L327 WeakPolarHBondContact O-CB 3.26Å; T324-L327 PolarHBondContact O-N 3.29Å; E325-L327 VanDerWaalsContact C-N 3.34Å; L327-Q329 VanDerWaalsContact C-N 3.34Å; L327-Q329 PolarHBondContact O-N 3.24Å; L327-L330 PolarHBondContact O-N 2.94Å; L327-I331 WeakPolarHBondContact O-CB 3.49Å; L327-I331 VanDerWaalsContact O-CG1 3.26Å; L327-I331 WeakPolarHBondContact O-CG1 3.46Å; L327-I331 PolarHBondContact O-N 3.49Å
328	D	36.3	Very low	37.5	Very low	103 Å²	103	114.7 Å²	114.7	55%	0.551	61%	0.606	S	S	*	*	H	α-helix	trans	-64.1	-37.9	174.2	-81.7	-20.8	0	0	0	112.1	T324 I331 H332	T324-D328 PolarHBondContact O-N 3.2Å; D328-I331 PolarHBondContact O-N 3.33Å; D328-H332 PolarHBondContact O-CD2 3.1Å; D328-H332 PolarHBondContact O-N 3.45Å
329	Q	47.4	Very low	38	Very low	112 Å²	112	113.9 Å²	113.9	52%	0.523	60%	0.598	S	S	.	*	H	α-helix	trans	-63.2	-40.3	173	-73.5	170.9	23	0	0	112.4	E325 L327 H332 Q333	E325-Q329 WeakPolarHBondContact O-CB 3.28Å; E325-Q329 WeakPolarHBondContact O-CG 3.47Å; E325-Q329 PolarHBondContact O-N 3.4Å; L327-Q329 VanDerWaalsContact C-N 3.34Å; L327-Q329 PolarHBondContact O-N 3.24Å; Q329-H332 PolarHBondContact O-N 3.02Å; Q329-Q333 WeakPolarHBondContact O-CB 3.36Å; Q329-Q333 VanDerWaalsContact O-CG 3.31Å; Q329-Q333 WeakPolarHBondContact O-CG 3.45Å; Q329-Q333 PolarHBondContact O-N 3.32Å
330	L	38.1	Very low	38.6	Very low	91 Å²	91	111.2 Å²	111.2	48%	0.476	58%	0.577	S	S	.	*	H	α-helix	trans	-68.7	-36.1	175.2	-75.6	166	0	0	0	112.6	K326 L327 Q333 S334	K326-L330 WeakPolarHBondContact O-CB 3.37Å; K326-L330 WeakPolarHBondContact O-CD1 3.42Å; K326-L330 VanDerWaalsContact O-CG 3.23Å; K326-L330 WeakPolarHBondContact O-CG 3.48Å; K326-L330 PolarHBondContact O-N 3.11Å; L327-L330 PolarHBondContact O-N 2.94Å; L330-Q333 PolarHBondContact O-N 3.47Å; L330-S334 WeakPolarHBondContact O-CB 3.22Å; L330-S334 PolarHBondContact O-N 2.92Å; L330-S334 VanDerWaalsContact O-N 3.16Å; L330-S334 PolarHBondContact O-OG 3.48Å
331	I	37.9	Very low	39	Very low	75 Å²	75	112.7 Å²	112.7	39%	0.385	58%	0.575	S	S	.	*	H	α-helix	trans	-65.5	-43.7	173.9	-70.6	164.5	0	0	0	110	L327 D328 S334 I335	L327-I331 WeakPolarHBondContact O-CB 3.49Å; L327-I331 VanDerWaalsContact O-CG1 3.26Å; L327-I331 WeakPolarHBondContact O-CG1 3.46Å; L327-I331 PolarHBondContact O-N 3.49Å; D328-I331 PolarHBondContact O-N 3.33Å; I331-S334 PolarHBondContact O-N 3.05Å; I331-S334 PolarHBondContact O-OG 3.4Å; I331-S334 VanDerWaalsContact O-OG 3.13Å; I331-I335 HydrophobicContact CG2-CD1 3.77Å; I331-I335 VanDerWaalsContact O-CD1 3.27Å; I331-I335 WeakPolarHBondContact O-CD1 3.4Å; I331-I335 VanDerWaalsContact O-CG1 3.22Å; I331-I335 WeakPolarHBondContact O-CG1 3.23Å
332	H	41.7	Very low	39.1	Very low	153 Å²	153	112.7 Å²	112.7	71%	0.708	56%	0.564	S	S	*	*	H	α-helix	trans	-69.9	-33	176	-87.2	-81.5	0	0	0	113.8	D328 Q329 S334	D328-H332 PolarHBondContact O-CD2 3.1Å; D328-H332 PolarHBondContact O-N 3.45Å; Q329-H332 PolarHBondContact O-N 3.02Å; H332-S334 VanDerWaalsContact C-N 3.31Å; H332-S334 PolarHBondContact O-N 3.22Å
333	Q	41	Very low	39	Very low	161 Å²	161	109 Å²	109	75%	0.752	55%	0.545	S	S	*	.	H	α-helix	trans	-73.8	-17.3	175.8	-76.3	179.5	-4	0	0	114.2	Q329 L330	Q329-Q333 WeakPolarHBondContact O-CB 3.36Å; Q329-Q333 VanDerWaalsContact O-CG 3.31Å; Q329-Q333 WeakPolarHBondContact O-CG 3.45Å; Q329-Q333 PolarHBondContact O-N 3.32Å; L330-Q333 PolarHBondContact O-N 3.47Å
334	S	34.9	Very low	38.7	Very low	90 Å²	90	111 Å²	111	63%	0.629	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	3.6	179.7	50.3	0	0	0	0	114.3	L330 I331 H332	L330-S334 WeakPolarHBondContact O-CB 3.22Å; L330-S334 PolarHBondContact O-N 2.92Å; L330-S334 VanDerWaalsContact O-N 3.16Å; L330-S334 PolarHBondContact O-OG 3.48Å; I331-S334 PolarHBondContact O-N 3.05Å; I331-S334 PolarHBondContact O-OG 3.4Å; I331-S334 VanDerWaalsContact O-OG 3.13Å; H332-S334 VanDerWaalsContact C-N 3.31Å; H332-S334 PolarHBondContact O-N 3.22Å
335	I	37.1	Very low	38.6	Very low	83 Å²	83	110.9 Å²	110.9	43%	0.426	54%	0.543	S	S	.	.			trans	-116.6	39.1	-167.9	-71.2	176.9	0	0	0	113.5	I331 L337	I331-I335 HydrophobicContact CG2-CD1 3.77Å; I331-I335 VanDerWaalsContact O-CD1 3.27Å; I331-I335 WeakPolarHBondContact O-CD1 3.4Å; I331-I335 VanDerWaalsContact O-CG1 3.22Å; I331-I335 WeakPolarHBondContact O-CG1 3.23Å; I335-L337 HydrophobicContact CB-CD1 4.28Å; I335-L337 HydrophobicContact CG1-CD1 4.31Å; I335-L337 HydrophobicContact CG2-CD1 3.98Å; I335-L337 PolarHBondContact O-N 2.88Å
336	D	35	Very low	38.6	Very low	89 Å²	89	109.5 Å²	109.5	48%	0.476	54%	0.535	S	S	.	.			trans	-78.4	63.1	162.3	-168	1.2	0	0	0	111.8	N338 H339	D336-N338 PolarHBondContact O-N 3.03Å; D336-N338 PolarHBondContact OD1-N 2.66Å; D336-H339 PolarHBondContact O-N 3.36Å; D336-H339 PolarHBondContact OD1-N 2.85Å; D336-H339 IonicContact OD2-CG 2.57Å; D336-H339 IonicContact OD2-ND1 2.63Å; D336-H339 PolarHBondContact OD2-ND1 3.45Å
337	L	39.3	Very low	38.3	Very low	98 Å²	98	103.9 Å²	103.9	51%	0.513	51%	0.512	S	S	.	.	H	α-helix	trans	-66.4	-15.6	177.2	-93.9	87.3	0	0	0	113.1	I335 H340 K341	I335-L337 HydrophobicContact CB-CD1 4.28Å; I335-L337 HydrophobicContact CG1-CD1 4.31Å; I335-L337 HydrophobicContact CG2-CD1 3.98Å; I335-L337 PolarHBondContact O-N 2.88Å; L337-H340 PolarHBondContact O-N 2.81Å; L337-K341 PolarHBondContact O-N 3.24Å
338	N	36.5	Very low	38.2	Very low	134 Å²	134	105.3 Å²	105.3	72%	0.717	51%	0.514	S	S	*	.	H	α-helix	trans	-69.5	-39.6	178	-69.5	-35.3	0	0	0	111.1	D336 H340 K341	D336-N338 PolarHBondContact O-N 3.03Å; D336-N338 PolarHBondContact OD1-N 2.66Å; N338-H340 VanDerWaalsContact C-N 3.32Å; N338-H340 PolarHBondContact O-N 2.78Å; N338-K341 PolarHBondContact O-N 2.86Å
339	H	40.5	Very low	38.4	Very low	126 Å²	126	106.2 Å²	106.2	58%	0.583	51%	0.514	S	S	*	.	H	α-helix	trans	-63.7	-34.3	170.7	-105.6	99.9	0	0	0	113.4	D336 N343	D336-H339 PolarHBondContact O-N 3.36Å; D336-H339 PolarHBondContact OD1-N 2.85Å; D336-H339 IonicContact OD2-CG 2.57Å; D336-H339 IonicContact OD2-ND1 2.63Å; D336-H339 PolarHBondContact OD2-ND1 3.45Å; H339-N343 PolarHBondContact O-ND2 3.14Å
340	H	41.6	Very low	37.7	Very low	65 Å²	65	102.9 Å²	102.9	30%	0.301	50%	0.504	S	S	.	.	H	α-helix	trans	-71.7	-36.6	176	-93.9	-78.7	0	0	0	112.9	L337 N338 Y342 N343 Y344 Y358	L337-H340 PolarHBondContact O-N 2.81Å; N338-H340 VanDerWaalsContact C-N 3.32Å; N338-H340 PolarHBondContact O-N 2.78Å; H340-Y342 PolarHBondContact O-N 3.37Å; H340-N343 PolarHBondContact O-N 3.02Å; H340-N343 VanDerWaalsContact O-N 3.1Å; H340-Y344 HydrophobicContact CB-CD2 4.27Å; H340-Y344 HydrophobicContact CB-CE2 4.29Å; H340-Y344 AromaticContact ND1-CE2 3.72Å; H340-Y344 WeakPolarHBondContact O-CD2 3.38Å; H340-Y344 PolarHBondContact O-N 3.43Å; H340-Y358 PolarHBondContact CE1-OH 3Å
341	K	42.8	Very low	37.9	Very low	131 Å²	131	101.2 Å²	101.2	57%	0.57	50%	0.499	S	S	*	.	H	α-helix	trans	-57.1	-38	-180	-168.4	157.9	-175.4	152.3	0	112.3	D299 L337 N338 T345	D299-K341 IonicContact OD1-NZ 2.81Å; L337-K341 PolarHBondContact O-N 3.24Å; N338-K341 PolarHBondContact O-N 2.86Å; K341-T345 PolarHBondContact O-OG1 2.9Å
342	Y	35.1	Very low	38.2	Very low	152 Å²	152	102.7 Å²	102.7	60%	0.596	51%	0.512	S	S	*	.	H	α-helix	trans	-72.1	-37.3	176.7	-133.9	-82.9	0	0	0	113.5	H340 T345 K346	H340-Y342 PolarHBondContact O-N 3.37Å; Y342-T345 PolarHBondContact O-OG1 2.97Å; Y342-K346 PolarHBondContact O-N 2.78Å
343	N	35.6	Very low	38.1	Very low	65 Å²	65	99.6 Å²	99.6	35%	0.348	50%	0.501	S	S	.	.	H	α-helix	trans	-75.1	-38.8	-178.3	-79.3	-68.1	0	0	0	112.8	H339 H340 T345 K346 L347	H339-N343 PolarHBondContact O-ND2 3.14Å; H340-N343 PolarHBondContact O-N 3.02Å; H340-N343 VanDerWaalsContact O-N 3.1Å; N343-T345 VanDerWaalsContact C-N 3.35Å; N343-T345 PolarHBondContact O-N 3.02Å; N343-K346 WeakPolarHBondContact O-CB 3.35Å; N343-K346 PolarHBondContact O-N 3.44Å; N343-L347 PolarHBondContact O-N 3.25Å
344	Y	32	Very low	38.6	Very low	125 Å²	125	96.1 Å²	96.1	49%	0.49	49%	0.485	S	S	.	.	H	α-helix	trans	-60.4	-42.9	174.8	-86.3	-72.8	0	0	0	112	H340 K346 L347 F348	H340-Y344 HydrophobicContact CB-CD2 4.27Å; H340-Y344 HydrophobicContact CB-CE2 4.29Å; H340-Y344 AromaticContact ND1-CE2 3.72Å; H340-Y344 WeakPolarHBondContact O-CD2 3.38Å; H340-Y344 PolarHBondContact O-N 3.43Å; Y344-K346 PolarHBondContact O-N 2.87Å; Y344-L347 PolarHBondContact O-N 3.22Å; Y344-F348 VanDerWaalsContact O-CD2 3.32Å; Y344-F348 WeakPolarHBondContact O-CD2 3.29Å; Y344-F348 PolarHBondContact O-N 3.46Å
345	T	36.9	Very low	39	Very low	86 Å²	86	97 Å²	97	53%	0.528	48%	0.477	S	S	.	.	H	α-helix	trans	-62.6	-23.7	174.7	39.1	0	0	0	0	114	K341 Y342 N343	K341-T345 PolarHBondContact O-OG1 2.9Å; Y342-T345 PolarHBondContact O-OG1 2.97Å; N343-T345 VanDerWaalsContact C-N 3.35Å; N343-T345 PolarHBondContact O-N 3.02Å
346	K	41.3	Very low	39.6	Very low	114 Å²	114	97.2 Å²	97.2	50%	0.496	48%	0.478	S	S	.	.	H	α-helix	trans	-79.9	-43.8	177.1	-150.3	155.8	-172.9	151	0	111.2	Y342 N343 Y344 F348 H349 D1082	Y342-K346 PolarHBondContact O-N 2.78Å; N343-K346 WeakPolarHBondContact O-CB 3.35Å; N343-K346 PolarHBondContact O-N 3.44Å; Y344-K346 PolarHBondContact O-N 2.87Å; K346-F348 VanDerWaalsContact C-N 3.31Å; K346-F348 PolarHBondContact O-N 3.08Å; K346-H349 PolarHBondContact O-N 3.33Å; K346-D1082 IonicContact NZ-OD2 2.86Å; K346-D1082 PolarHBondContact NZ-OD2 3.24Å
347	L	34.8	Very low	40.7	Very low	29 Å²	29	98.2 Å²	98.2	15%	0.152	48%	0.48	C	S	.	.	H	α-helix	trans	-65	-27.5	178.1	-71.3	163	0	0	0	114.1	N343 Y344 H349 S350 Y358	N343-L347 PolarHBondContact O-N 3.25Å; Y344-L347 PolarHBondContact O-N 3.22Å; L347-H349 PolarHBondContact O-N 2.8Å; L347-H349 VanDerWaalsContact O-N 3.08Å; L347-S350 PolarHBondContact O-N 3.29Å; L347-Y358 HydrophobicContact CD1-CD1 3.55Å; L347-Y358 HydrophobicContact CD1-CD2 4.12Å; L347-Y358 HydrophobicContact CD1-CE1 3.72Å; L347-Y358 HydrophobicContact CD1-CE2 4.27Å; L347-Y358 HydrophobicContact CD1-CG 3.77Å; L347-Y358 HydrophobicContact CD2-CD2 4.35Å; L347-Y358 HydrophobicContact CD2-CG 4Å
348	F	36.9	Very low	41.2	Very low	129 Å²	129	96.7 Å²	96.7	57%	0.566	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-5	178.3	-96.1	-69	0	0	0	115.2	Y344 K346	Y344-F348 VanDerWaalsContact O-CD2 3.32Å; Y344-F348 WeakPolarHBondContact O-CD2 3.29Å; Y344-F348 PolarHBondContact O-N 3.46Å; K346-F348 VanDerWaalsContact C-N 3.31Å; K346-F348 PolarHBondContact O-N 3.08Å
349	H	39.4	Very low	42.1	Very low	122 Å²	122	96.5 Å²	96.5	57%	0.565	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.8	3.4	176.5	-70.5	-15.5	0	0	0	114.3	K346 L347 Y1080	K346-H349 PolarHBondContact O-N 3.33Å; L347-H349 PolarHBondContact O-N 2.8Å; L347-H349 VanDerWaalsContact O-N 3.08Å; H349-Y1080 AromaticContact CD2-CD2 3.89Å; H349-Y1080 AromaticContact CD2-CG 3.86Å; H349-Y1080 AromaticContact CE1-CD2 3.99Å; H349-Y1080 AromaticContact NE2-CD2 3.41Å; H349-Y1080 WeakPolarHBondContact NE2-CD2 3.44Å; H349-Y1080 AromaticContact NE2-CE2 3.93Å; H349-Y1080 AromaticContact NE2-CG 3.45Å
350	S	33.9	Very low	42.7	Very low	43 Å²	43	94.7 Å²	94.7	30%	0.301	46%	0.455	S	S	.	.	S	Bend	trans	-84.3	166.6	178.5	-78.5	0	0	0	0	113	L347 E354	L347-S350 PolarHBondContact O-N 3.29Å; S350-E354 VanDerWaalsContact CB-CD 3.46Å; S350-E354 WeakPolarHBondContact CB-OE2 3.39Å; S350-E354 PolarHBondContact OG-OE2 2.96Å
351	S	42.9	Very low	43.9	Very low	55 Å²	55	96.8 Å²	96.8	39%	0.385	46%	0.464	S	S	.	.			trans	-64.1	159.6	172	66.8	0	0	0	0	112.3	N353 E354 F355	S351-N353 PolarHBondContact O-N 3.35Å; S351-N353 VanDerWaalsContact O-N 3.14Å; S351-E354 VanDerWaalsContact CB-OE1 3.31Å; S351-E354 WeakPolarHBondContact CB-OE1 3.37Å; S351-E354 PolarHBondContact N-OE1 2.91Å; S351-E354 PolarHBondContact O-N 2.92Å; S351-E354 PolarHBondContact OG-N 3.45Å; S351-E354 PolarHBondContact OG-OE1 2.91Å; S351-F355 PolarHBondContact O-N 3.37Å
352	T	44.2	Very low	44.3	Very low	106 Å²	106	95.1 Å²	95.1	65%	0.65	46%	0.457	S	S	*	.	H	α-helix	trans	-55.9	-29.7	172.5	43.6	0	0	0	0	112.5	I356	T352-I356 WeakPolarHBondContact O-CD1 3.49Å; T352-I356 VanDerWaalsContact O-CG1 3.27Å; T352-I356 WeakPolarHBondContact O-CG1 3.47Å; T352-I356 PolarHBondContact O-N 2.62Å
353	N	39.2	Very low	45.2	Very low	88 Å²	88	94.1 Å²	94.1	47%	0.471	46%	0.455	S	S	.	.	H	α-helix	trans	-73.7	-42.5	-176.7	-63	3.7	0	0	0	111.3	S351 F355 I356 E357	S351-N353 PolarHBondContact O-N 3.35Å; S351-N353 VanDerWaalsContact O-N 3.14Å; N353-F355 VanDerWaalsContact C-N 3.33Å; N353-F355 PolarHBondContact O-N 3.33Å; N353-I356 PolarHBondContact O-N 2.86Å; N353-E357 PolarHBondContact O-N 2.89Å
354	E	50.1	Low	46.1	Very low	89 Å²	89	94.6 Å²	94.6	42%	0.416	46%	0.461	S	S	.	.	H	α-helix	trans	-63	-37.6	173.3	-72.2	158.7	-93.3	0	0	112.2	S350 S351 E357 Y358	S350-E354 VanDerWaalsContact CB-CD 3.46Å; S350-E354 WeakPolarHBondContact CB-OE2 3.39Å; S350-E354 PolarHBondContact OG-OE2 2.96Å; S351-E354 VanDerWaalsContact CB-OE1 3.31Å; S351-E354 WeakPolarHBondContact CB-OE1 3.37Å; S351-E354 PolarHBondContact N-OE1 2.91Å; S351-E354 PolarHBondContact O-N 2.92Å; S351-E354 PolarHBondContact OG-N 3.45Å; S351-E354 PolarHBondContact OG-OE1 2.91Å; E354-E357 PolarHBondContact O-N 2.82Å; E354-Y358 WeakPolarHBondContact O-CB 3.24Å; E354-Y358 PolarHBondContact O-N 3.17Å
355	F	45	Very low	46.8	Very low	108 Å²	108	93.1 Å²	93.1	47%	0.474	46%	0.461	S	S	.	.	H	α-helix	trans	-65.9	-38.3	174.2	-177.5	-97.5	0	0	0	111.9	S351 N353 K359	S351-F355 PolarHBondContact O-N 3.37Å; N353-F355 VanDerWaalsContact C-N 3.33Å; N353-F355 PolarHBondContact O-N 3.33Å; F355-K359 HydrophobicContact CE1-CD 4.48Å; F355-K359 WeakPolarHBondContact O-CB 3.34Å; F355-K359 PolarHBondContact O-N 3.27Å
356	I	49.4	Very low	47.4	Very low	88 Å²	88	92.6 Å²	92.6	45%	0.451	46%	0.455	S	S	.	.	H	α-helix	trans	-68.1	-42.9	174.2	-70	164.8	0	0	0	110.9	T352 N353 K359 N360	T352-I356 WeakPolarHBondContact O-CD1 3.49Å; T352-I356 VanDerWaalsContact O-CG1 3.27Å; T352-I356 WeakPolarHBondContact O-CG1 3.47Å; T352-I356 PolarHBondContact O-N 2.62Å; N353-I356 PolarHBondContact O-N 2.86Å; I356-K359 PolarHBondContact O-N 3.37Å; I356-N360 VanDerWaalsContact O-CB 3.31Å; I356-N360 WeakPolarHBondContact O-CB 3.28Å; I356-N360 PolarHBondContact O-N 3.5Å; I356-N360 PolarHBondContact O-ND2 3.34Å
357	E	57.7	Low	47.8	Very low	109 Å²	109	90.5 Å²	90.5	51%	0.509	45%	0.448	S	S	.	.	H	α-helix	trans	-61.4	-50.4	175.1	-163.9	-153.5	136	0	0	110.4	N353 E354 K359 N360 K361	N353-E357 PolarHBondContact O-N 2.89Å; E354-E357 PolarHBondContact O-N 2.82Å; E357-K359 VanDerWaalsContact C-N 3.33Å; E357-K359 PolarHBondContact O-N 2.93Å; E357-N360 CarbonylContact O-C 2.85Å; E357-N360 PolarHBondContact O-N 3.41Å; E357-N360 VanDerWaalsContact O-N 3.12Å; E357-K361 VanDerWaalsContact O-CB 3.22Å; E357-K361 WeakPolarHBondContact O-CB 3.46Å; E357-K361 PolarHBondContact O-N 2.89Å; E357-K361 IonicContact OE1-NZ 2.68Å; E357-K361 PolarHBondContact OE1-NZ 3.41Å
358	Y	48.8	Very low	48.6	Very low	67 Å²	67	95.2 Å²	95.2	26%	0.263	47%	0.468	S	S	.	.	H	α-helix	trans	-60	-42.6	178.4	-172.5	-88.8	0	0	0	111.8	H340 L347 E354 N360 K361 F362	H340-Y358 PolarHBondContact CE1-OH 3Å; L347-Y358 HydrophobicContact CD1-CD1 3.55Å; L347-Y358 HydrophobicContact CD1-CD2 4.12Å; L347-Y358 HydrophobicContact CD1-CE1 3.72Å; L347-Y358 HydrophobicContact CD1-CE2 4.27Å; L347-Y358 HydrophobicContact CD1-CG 3.77Å; L347-Y358 HydrophobicContact CD2-CD2 4.35Å; L347-Y358 HydrophobicContact CD2-CG 4Å; E354-Y358 WeakPolarHBondContact O-CB 3.24Å; E354-Y358 PolarHBondContact O-N 3.17Å; Y358-N360 VanDerWaalsContact C-N 3.35Å; Y358-N360 PolarHBondContact O-N 2.92Å; Y358-K361 PolarHBondContact O-N 3.41Å; Y358-F362 VanDerWaalsContact O-CB 3.23Å; Y358-F362 WeakPolarHBondContact O-CB 3.47Å; Y358-F362 PolarHBondContact O-N 3.13Å
359	K	56.3	Low	49.1	Very low	130 Å²	130	95.2 Å²	95.2	57%	0.565	47%	0.469	S	S	*	.	H	α-helix	trans	-61.4	-41.2	174.5	178.6	179.7	174.2	-175.1	0	112.1	F355 I356 E357 K363	F355-K359 HydrophobicContact CE1-CD 4.48Å; F355-K359 WeakPolarHBondContact O-CB 3.34Å; F355-K359 PolarHBondContact O-N 3.27Å; I356-K359 PolarHBondContact O-N 3.37Å; E357-K359 VanDerWaalsContact C-N 3.33Å; E357-K359 PolarHBondContact O-N 2.93Å; K359-K363 VanDerWaalsContact O-CB 3.28Å; K359-K363 WeakPolarHBondContact O-CB 3.31Å; K359-K363 PolarHBondContact O-N 3.34Å
360	N	54	Low	49.2	Very low	87 Å²	87	94.4 Å²	94.4	47%	0.465	47%	0.466	S	S	.	.	H	α-helix	trans	-71.8	-38.1	177.9	-71.9	-16.1	0	0	0	111.9	I356 E357 Y358 K363 T364	I356-N360 VanDerWaalsContact O-CB 3.31Å; I356-N360 WeakPolarHBondContact O-CB 3.28Å; I356-N360 PolarHBondContact O-N 3.5Å; I356-N360 PolarHBondContact O-ND2 3.34Å; E357-N360 CarbonylContact O-C 2.85Å; E357-N360 PolarHBondContact O-N 3.41Å; E357-N360 VanDerWaalsContact O-N 3.12Å; Y358-N360 VanDerWaalsContact C-N 3.35Å; Y358-N360 PolarHBondContact O-N 2.92Å; N360-K363 PolarHBondContact O-N 3.47Å; N360-T364 WeakPolarHBondContact O-CG2 3.35Å; N360-T364 PolarHBondContact O-N 3.21Å; N360-T364 PolarHBondContact O-OG1 3.11Å
361	K	65.5	Low	49.6	Very low	110 Å²	110	99.3 Å²	99.3	48%	0.478	48%	0.482	S	S	.	.	H	α-helix	trans	-69.2	-39.5	177	-157.7	173.4	-148.9	152.2	0	111.7	E357 Y358 T364 N365	E357-K361 VanDerWaalsContact O-CB 3.22Å; E357-K361 WeakPolarHBondContact O-CB 3.46Å; E357-K361 PolarHBondContact O-N 2.89Å; E357-K361 IonicContact OE1-NZ 2.68Å; E357-K361 PolarHBondContact OE1-NZ 3.41Å; Y358-K361 PolarHBondContact O-N 3.41Å; K361-T364 WeakPolarHBondContact CA-OG1 3.27Å; K361-T364 PolarHBondContact O-OG1 2.89Å; K361-N365 VanDerWaalsContact O-CB 3.29Å; K361-N365 WeakPolarHBondContact O-CB 3.34Å; K361-N365 PolarHBondContact O-N 3.44Å
362	F	51.9	Low	49.7	Very low	96 Å²	96	103.8 Å²	103.8	42%	0.421	50%	0.497	S	S	.	.	H	α-helix	trans	-63.4	-47.7	169.3	-175	-93.8	0	0	0	110.7	Y358 T364 N365 L366	Y358-F362 VanDerWaalsContact O-CB 3.23Å; Y358-F362 WeakPolarHBondContact O-CB 3.47Å; Y358-F362 PolarHBondContact O-N 3.13Å; F362-T364 PolarHBondContact O-N 3.34Å; F362-N365 PolarHBondContact O-N 2.76Å; F362-L366 HydrophobicContact CE1-CD1 4.12Å; F362-L366 HydrophobicContact CE1-CD2 4.4Å; F362-L366 HydrophobicContact CZ-CD1 4.04Å; F362-L366 WeakPolarHBondContact O-CB 3.49Å; F362-L366 PolarHBondContact O-N 3.16Å
363	K	53.6	Low	49.6	Very low	131 Å²	131	105.6 Å²	105.6	57%	0.57	50%	0.499	S	S	*	.	H	α-helix	trans	-63.6	-40	178.4	-170.2	-179.7	179.6	-172.7	0	112.8	K359 N360 L366 I367	K359-K363 VanDerWaalsContact O-CB 3.28Å; K359-K363 WeakPolarHBondContact O-CB 3.31Å; K359-K363 PolarHBondContact O-N 3.34Å; N360-K363 PolarHBondContact O-N 3.47Å; K363-L366 PolarHBondContact O-N 3.41Å; K363-I367 HydrophobicContact CG-CD1 3.95Å; K363-I367 WeakPolarHBondContact O-CB 3.31Å; K363-I367 VanDerWaalsContact O-CG1 3.25Å; K363-I367 WeakPolarHBondContact O-CG1 3.39Å; K363-I367 PolarHBondContact O-N 3.24Å
364	T	54.2	Low	49.6	Very low	75 Å²	75	107.6 Å²	107.6	46%	0.46	51%	0.51	S	S	.	.	H	α-helix	trans	-73.2	-31.9	176.5	50.6	0	0	0	0	112.6	N360 K361 F362 K368	N360-T364 WeakPolarHBondContact O-CG2 3.35Å; N360-T364 PolarHBondContact O-N 3.21Å; N360-T364 PolarHBondContact O-OG1 3.11Å; K361-T364 WeakPolarHBondContact CA-OG1 3.27Å; K361-T364 PolarHBondContact O-OG1 2.89Å; F362-T364 PolarHBondContact O-N 3.34Å; T364-K368 WeakPolarHBondContact O-CB 3.04Å; T364-K368 WeakPolarHBondContact O-CG 3.23Å; T364-K368 PolarHBondContact O-N 2.89Å
365	N	46.8	Very low	48.9	Very low	94 Å²	94	107.6 Å²	107.6	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-66.7	-42.5	169.6	-75.4	-6.5	0	0	0	111.7	K361 F362 K368 Q369	K361-N365 VanDerWaalsContact O-CB 3.29Å; K361-N365 WeakPolarHBondContact O-CB 3.34Å; K361-N365 PolarHBondContact O-N 3.44Å; F362-N365 PolarHBondContact O-N 2.76Å; N365-K368 PolarHBondContact O-N 3.44Å; N365-Q369 WeakPolarHBondContact O-CB 3.34Å; N365-Q369 PolarHBondContact O-N 3.13Å
366	L	49.5	Very low	48.6	Very low	75 Å²	75	107.8 Å²	107.8	39%	0.393	53%	0.532	S	S	.	.	H	α-helix	trans	-60.4	-48.7	175	-137.2	75.1	0	0	0	110.9	F362 K363 K368 Q369 E370	F362-L366 HydrophobicContact CE1-CD1 4.12Å; F362-L366 HydrophobicContact CE1-CD2 4.4Å; F362-L366 HydrophobicContact CZ-CD1 4.04Å; F362-L366 WeakPolarHBondContact O-CB 3.49Å; F362-L366 PolarHBondContact O-N 3.16Å; K363-L366 PolarHBondContact O-N 3.41Å; L366-K368 VanDerWaalsContact C-N 3.34Å; L366-K368 PolarHBondContact O-N 3.09Å; L366-Q369 PolarHBondContact O-N 3.49Å; L366-E370 WeakPolarHBondContact O-CB 3.23Å; L366-E370 WeakPolarHBondContact O-CG 3.35Å; L366-E370 PolarHBondContact O-N 3.17Å
367	I	48.8	Very low	47.7	Very low	69 Å²	69	109.3 Å²	109.3	35%	0.354	55%	0.551	S	S	.	*	H	α-helix	trans	-62.7	-38.2	177.2	-70.2	167.4	0	0	0	111.6	K363 E370 F371	K363-I367 HydrophobicContact CG-CD1 3.95Å; K363-I367 WeakPolarHBondContact O-CB 3.31Å; K363-I367 VanDerWaalsContact O-CG1 3.25Å; K363-I367 WeakPolarHBondContact O-CG1 3.39Å; K363-I367 PolarHBondContact O-N 3.24Å; I367-E370 PolarHBondContact O-N 3.17Å; I367-F371 HydrophobicContact CG2-CD2 3.92Å; I367-F371 HydrophobicContact CG2-CE2 4.18Å; I367-F371 WeakPolarHBondContact O-CB 3.35Å; I367-F371 WeakPolarHBondContact O-CD2 3.46Å; I367-F371 PolarHBondContact O-N 3.11Å
368	K	53.6	Low	46.4	Very low	129 Å²	129	111 Å²	111	56%	0.561	56%	0.562	S	S	*	*	H	α-helix	trans	-62	-47.2	172.8	-83.1	-178.1	173.1	-168.9	0	111.7	T364 N365 L366 E370 F371 E372	T364-K368 WeakPolarHBondContact O-CB 3.04Å; T364-K368 WeakPolarHBondContact O-CG 3.23Å; T364-K368 PolarHBondContact O-N 2.89Å; N365-K368 PolarHBondContact O-N 3.44Å; L366-K368 VanDerWaalsContact C-N 3.34Å; L366-K368 PolarHBondContact O-N 3.09Å; K368-E370 VanDerWaalsContact C-N 3.29Å; K368-E370 PolarHBondContact O-N 3.32Å; K368-F371 PolarHBondContact O-N 2.91Å; K368-F371 VanDerWaalsContact O-N 3.13Å; K368-E372 WeakPolarHBondContact O-CB 3.41Å; K368-E372 WeakPolarHBondContact O-CG 3.31Å; K368-E372 PolarHBondContact O-N 3.37Å
369	Q	46	Very low	45.6	Very low	128 Å²	128	113.1 Å²	113.1	60%	0.598	59%	0.587	S	S	*	*	H	α-helix	trans	-65.1	-34.5	179.8	-158.1	167	17.4	0	0	111.4	N365 L366 M373	N365-Q369 WeakPolarHBondContact O-CB 3.34Å; N365-Q369 PolarHBondContact O-N 3.13Å; L366-Q369 PolarHBondContact O-N 3.49Å; Q369-M373 VanDerWaalsContact O-CB 3.23Å; Q369-M373 WeakPolarHBondContact O-CB 3.43Å; Q369-M373 WeakPolarHBondContact O-CG 3.42Å; Q369-M373 PolarHBondContact O-N 2.94Å
370	E	42.4	Very low	44.4	Very low	106 Å²	106	112.8 Å²	112.8	50%	0.495	60%	0.596	S	S	.	*	H	α-helix	trans	-68.6	-37.9	170.7	-72.1	172.5	157.4	0	0	112.6	L366 I367 K368 N374	L366-E370 WeakPolarHBondContact O-CB 3.23Å; L366-E370 WeakPolarHBondContact O-CG 3.35Å; L366-E370 PolarHBondContact O-N 3.17Å; I367-E370 PolarHBondContact O-N 3.17Å; K368-E370 VanDerWaalsContact C-N 3.29Å; K368-E370 PolarHBondContact O-N 3.32Å; E370-N374 WeakPolarHBondContact O-CB 3.27Å; E370-N374 PolarHBondContact O-N 2.86Å; E370-N374 PolarHBondContact O-ND2 2.88Å
371	F	42.4	Very low	43.2	Very low	145 Å²	145	116.5 Å²	116.5	64%	0.636	62%	0.615	S	S	*	*	H	α-helix	trans	-74.4	-42	177.7	-98.7	-98.8	0	0	0	113.4	I367 K368 M373 N374 S375	I367-F371 HydrophobicContact CG2-CD2 3.92Å; I367-F371 HydrophobicContact CG2-CE2 4.18Å; I367-F371 WeakPolarHBondContact O-CB 3.35Å; I367-F371 WeakPolarHBondContact O-CD2 3.46Å; I367-F371 PolarHBondContact O-N 3.11Å; K368-F371 PolarHBondContact O-N 2.91Å; K368-F371 VanDerWaalsContact O-N 3.13Å; F371-M373 VanDerWaalsContact C-N 3.28Å; F371-M373 PolarHBondContact O-N 3.44Å; F371-N374 PolarHBondContact O-N 3.42Å; F371-S375 PolarHBondContact O-OG 2.85Å; F371-S375 VanDerWaalsContact O-OG 3.09Å
372	E	44.5	Very low	41.5	Very low	150 Å²	150	117.2 Å²	117.2	70%	0.701	63%	0.634	S	S	*	*	H	α-helix	trans	-65.7	-32.5	177.4	-72	175.2	168.1	0	0	111.4	K368	K368-E372 WeakPolarHBondContact O-CB 3.41Å; K368-E372 WeakPolarHBondContact O-CG 3.31Å; K368-E372 PolarHBondContact O-N 3.37Å
373	M	41.3	Very low	40.5	Very low	143 Å²	143	117.9 Å²	117.9	70%	0.704	65%	0.65	S	S	*	*	H	α-helix	trans	-85.4	-15.3	178.8	-66.2	-75.4	-77	0	0	114.8	Q369 F371	Q369-M373 VanDerWaalsContact O-CB 3.23Å; Q369-M373 WeakPolarHBondContact O-CB 3.43Å; Q369-M373 WeakPolarHBondContact O-CG 3.42Å; Q369-M373 PolarHBondContact O-N 2.94Å; F371-M373 VanDerWaalsContact C-N 3.28Å; F371-M373 PolarHBondContact O-N 3.44Å
374	N	40.5	Very low	39.5	Very low	130 Å²	130	115 Å²	115	70%	0.695	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	13.5	180	-76.1	-71.7	0	0	0	114.2	E370 F371 P376	E370-N374 WeakPolarHBondContact O-CB 3.27Å; E370-N374 PolarHBondContact O-N 2.86Å; E370-N374 PolarHBondContact O-ND2 2.88Å; F371-N374 PolarHBondContact O-N 3.42Å; N374-P376 WeakPolarHBondContact O-CD 3.39Å
375	S	35.2	Very low	38.3	Very low	90 Å²	90	116.9 Å²	116.9	63%	0.629	67%	0.674	S	S	*	*			trans	-83.8	113.4	175.1	-67.4	0	0	0	0	111.1	F371 S377	F371-S375 PolarHBondContact O-OG 2.85Å; F371-S375 VanDerWaalsContact O-OG 3.09Å; S375-S377 PolarHBondContact O-N 3.04Å
376	P	38.2	Very low	37.7	Very low	111 Å²	111	119.3 Å²	119.3	72%	0.721	69%	0.692	S	S	*	*			trans	-73.5	129.2	-173.8	28.8	-34.7	0	0	0	112.5	N374 L378	N374-P376 WeakPolarHBondContact O-CD 3.39Å; P376-L378 PolarHBondContact O-N 3.48Å
377	S	30	Very low	36.8	Very low	120 Å²	120	120.2 Å²	120.2	84%	0.839	71%	0.705	S	S	*	*			trans	-70.8	120.8	179.8	57.1	0	0	0	0	113	S375	S375-S377 PolarHBondContact O-N 3.04Å
378	L	31.4	Very low	36.2	Very low	144 Å²	144	121.1 Å²	121.1	75%	0.754	72%	0.717	S	S	*	*			trans	-127.9	152.8	167.9	-84.9	87.8	0	0	0	110.8	P376	P376-L378 PolarHBondContact O-N 3.48Å
379	S	32.1	Very low	35.4	Very low	113 Å²	113	121.7 Å²	121.7	79%	0.79	73%	0.732	S	S	*	*			trans	60.5	102.7	-169.5	68	0	0	0	0	112.8
380	T	30.1	Very low	35.2	Very low	123 Å²	123	121.5 Å²	121.5	76%	0.755	74%	0.741	S	S	*	*			cis	66.7	109.4	15	76.2	0	0	0	0	117.9
381	L	28.7	Very low	34.9	Very low	165 Å²	165	121.6 Å²	121.6	86%	0.864	75%	0.754	S	S	*	*			trans	69.4	89.1	143.4	-64.3	166.6	0	0	0	120
382	S	29.8	Very low	34.6	Very low	124 Å²	124	119.7 Å²	119.7	87%	0.867	76%	0.758	S	S	*	*			trans	-178.6	150.6	132.6	-81.6	0	0	0	0	109.6
383	S	32.2	Very low	34.1	Very low	110 Å²	110	117.1 Å²	117.1	77%	0.769	76%	0.757	S	S	*	*			cis	-152.1	152.4	-18.2	56	0	0	0	0	106.4
384	G	31.2	Very low	33.8	Very low	70 Å²	70	115.5 Å²	115.5	72%	0.722	76%	0.76	S	S	*	*				71.7	104.3	70.5	0	0	0	0	0	109.5
385	S	30	Very low	33.5	Very low	116 Å²	116	113.7 Å²	113.7	81%	0.811	76%	0.758	S	S	*	*			trans	-79.8	-167.9	179.8	51.4	0	0	0	0	112.2
386	V	33.3	Very low	33.5	Very low	145 Å²	145	117 Å²	117	88%	0.879	77%	0.767	S	S	*	*			trans	93.2	156.9	-179.9	-170.4	0	0	0	0	114
387	S	31.8	Very low	33.3	Very low	93 Å²	93	116 Å²	116	65%	0.65	76%	0.763	S	S	*	*			trans	-107.7	177.4	-151.6	58	0	0	0	0	115.3
388	S	35.8	Very low	33.6	Very low	89 Å²	89	115.6 Å²	115.6	62%	0.622	76%	0.76	S	S	*	*			trans	65.9	90.5	143.8	55.1	0	0	0	0	119.6
389	T	36.1	Very low	33.7	Very low	140 Å²	140	116.8 Å²	116.8	86%	0.859	77%	0.767	S	S	*	*				71.1	154.9	129.1	49.1	0	0	0	0	120.8
390	P	41.5	Very low	33.6	Very low	124 Å²	124	115.9 Å²	115.9	81%	0.805	76%	0.76	S	S	*	*			trans	-120	163	-156.7	41.7	-29.6	0	0	0	115.9
391	S	37.2	Very low	33.8	Very low	109 Å²	109	116.2 Å²	116.2	76%	0.762	76%	0.762	S	S	*	*			trans	-160.4	149.5	152.7	59.4	0	0	0	0	113.3
392	S	36	Very low	33.9	Very low	104 Å²	104	114 Å²	114	73%	0.727	76%	0.756	S	S	*	*			trans	17	146.9	146.9	57.3	0	0	0	0	121.9
393	S	33.8	Very low	34	Very low	97 Å²	97	114.6 Å²	114.6	68%	0.678	75%	0.754	S	S	*	*			cis	175.2	163.8	-8.4	51.6	0	0	0	0	109.8
394	S	36	Very low	34	Very low	109 Å²	109	114 Å²	114	76%	0.762	75%	0.75	S	S	*	*			trans	69.6	152.1	153.1	77.4	0	0	0	0	118.4
395	S	33.4	Very low	33.9	Very low	92 Å²	92	116.2 Å²	116.2	64%	0.643	75%	0.75	S	S	*	*			cis	-171.8	174.6	-21.9	50.6	0	0	0	0	110.6
396	L	35.5	Very low	33.8	Very low	158 Å²	158	117.1 Å²	117.1	83%	0.827	75%	0.751	S	S	*	*			trans	73.7	154.8	162.5	-55.6	172.6	0	0	0	118
397	S	34	Very low	33.6	Very low	91 Å²	91	115.7 Å²	115.7	64%	0.636	75%	0.747	S	S	*	*			cis	-178.5	171.6	-49.9	51	0	0	0	0	110.2
398	S	36.7	Very low	33.3	Very low	111 Å²	111	116.6 Å²	116.6	78%	0.776	75%	0.749	S	S	*	*			trans	80.8	145.8	170.1	86.3	0	0	0	0	115.8
399	L	32.4	Very low	32.9	Very low	170 Å²	170	119.7 Å²	119.7	89%	0.89	76%	0.758	S	S	*	*			cis	-142.1	164	-4.9	-162.2	55.3	0	0	0	111.6
400	S	30.7	Very low	32.5	Very low	94 Å²	94	120 Å²	120	66%	0.657	76%	0.759	S	S	*	*			trans	-126.1	144	-165.7	56.8	0	0	0	0	114.7
401	T	33.4	Very low	31.7	Very low	129 Å²	129	122.8 Å²	122.8	79%	0.791	76%	0.761	S	S	*	*			trans	-159.9	108.9	147	25.2	0	0	0	0	107.8
402	T	31.1	Very low	31.3	Very low	119 Å²	119	124.1 Å²	124.1	73%	0.73	77%	0.765	S	S	*	*				52.9	119.6	89.7	65.1	0	0	0	0	113
403	T	31.7	Very low	30.8	Very low	136 Å²	136	127.5 Å²	127.5	83%	0.834	77%	0.771	S	S	*	*			cis	-147.5	164.1	13.6	52.1	0	0	0	0	109.6
404	S	31.8	Very low	30.4	Very low	97 Å²	97	128.3 Å²	128.3	68%	0.678	78%	0.777	S	S	*	*			cis	-155.3	141.8	11.2	39.4	0	0	0	0	111.1
405	T	30.6	Very low	30	Very low	118 Å²	118	128.3 Å²	128.3	72%	0.724	78%	0.777	S	S	*	*			trans	37.1	98.6	151.2	54.7	0	0	0	0	118.6
406	T	27.5	Very low	29.7	Very low	135 Å²	135	132.1 Å²	132.1	83%	0.828	79%	0.788	S	S	*	*				63	131.4	89.5	60.5	0	0	0	0	115.4
407	S	28.4	Very low	29.2	Very low	115 Å²	115	131.8 Å²	131.8	80%	0.804	79%	0.787	S	S	*	*			cis	-139.7	148.6	3.8	-169.6	0	0	0	0	113.1
408	T	26.5	Very low	28.8	Very low	111 Å²	111	135.1 Å²	135.1	68%	0.681	80%	0.796	S	S	*	*			trans	-72.1	148	172.7	45.9	0	0	0	0	114.1
409	L	27.3	Very low	28.4	Very low	155 Å²	155	139.1 Å²	139.1	81%	0.812	80%	0.8	S	S	*	*	S	Bend	trans	70.7	147.7	148.5	-66.4	160.3	0	0	0	119.3
410	V	27.1	Very low	28.2	Very low	146 Å²	146	139.7 Å²	139.7	89%	0.885	80%	0.798	S	S	*	*			trans	76.3	24.4	171.4	-151.1	0	0	0	0	117.2
411	E	25.3	Very low	28	Very low	182 Å²	182	143.8 Å²	143.8	85%	0.85	81%	0.806	S	S	*	*			trans	-126.3	93.5	173.7	-67.2	-172.1	156.2	0	0	113
412	T	28.5	Very low	28.1	Very low	138 Å²	138	143.3 Å²	143.3	85%	0.847	81%	0.805	S	S	*	*	S	Bend	trans	-168.1	-2.7	159.1	0.1	0	0	0	0	116.4
413	M	25.5	Very low	27.9	Very low	175 Å²	175	144.4 Å²	144.4	86%	0.862	81%	0.807	S	S	*	*	S	Bend	trans	-120.9	19.9	-173.7	-64.8	-153.5	76.2	0	0	116.3
414	S	25.2	Very low	27.6	Very low	113 Å²	113	143.7 Å²	143.7	79%	0.79	80%	0.798	S	S	*	*	S	Bend	trans	-144.1	48.2	-176.4	-60.9	0	0	0	0	114.2
415	S	26.8	Very low	27.6	Very low	109 Å²	109	149.6 Å²	149.6	76%	0.762	81%	0.812	S	S	*	*			trans	-137.2	18.4	-169.2	-48.7	0	0	0	0	116.9
416	I	28.3	Very low	27.3	Very low	172 Å²	172	148.2 Å²	148.2	88%	0.882	80%	0.803	S	S	*	*	S	Bend	trans	-133.2	35.8	166.4	-36.8	-179.7	0	0	0	111.1
417	L	25	Very low	27.2	Very low	152 Å²	152	151 Å²	151	80%	0.796	80%	0.8	S	S	*	*	S	Bend	trans	-149.6	124.4	171.8	-103.2	169.1	0	0	0	110.5
418	L	25.2	Very low	27.2	Very low	161 Å²	161	152 Å²	152	84%	0.843	80%	0.796	S	S	*	*	S	Bend	trans	72.5	135.2	169.8	-68.7	150.7	0	0	0	119.2
419	K	27.3	Very low	27.2	Very low	195 Å²	195	152.4 Å²	152.4	85%	0.848	79%	0.793	S	S	*	*			trans	78	94	167.7	-58.5	-176.7	178.4	-177.3	0	119.4
420	H	28.8	Very low	27.1	Very low	182 Å²	182	151.1 Å²	151.1	84%	0.843	79%	0.787	S	S	*	*				-162.9	121.6	106.3	-125.7	-69.4	0	0	0	112
421	E	27.1	Very low	27.3	Very low	179 Å²	179	151.8 Å²	151.8	84%	0.836	78%	0.781	S	S	*	*			trans	-93.7	155.4	150.1	-74.8	-174.1	125.8	0	0	108.8
422	P	34.3	Very low	27.5	Very low	119 Å²	119	148.2 Å²	148.2	77%	0.773	77%	0.768	S	S	*	*			trans	-121.8	133.5	154.6	34.8	-23.4	0	0	0	111.9
423	D	27.1	Very low	27.5	Very low	143 Å²	143	150 Å²	150	77%	0.765	76%	0.764	S	S	*	*			trans	-63.6	154.5	-177.8	-75.9	-88.8	0	0	0	116.7
424	N	26.7	Very low	27.6	Very low	120 Å²	120	152.1 Å²	152.1	64%	0.642	76%	0.762	S	S	*	*			trans	47.1	114.3	141.9	-72.9	-64.8	0	0	0	120.6	V426	N424-V426 HydrophobicContact CB-CG2 4.46Å
425	F	30.4	Very low	27.6	Very low	222 Å²	222	152.5 Å²	152.5	97%	0.974	75%	0.754	S	S	*	*			trans	-128	139.5	134.2	-96.6	-86.9	0	0	0	109.9
426	V	24.3	Very low	27.5	Very low	89 Å²	89	153.3 Å²	153.3	54%	0.539	76%	0.756	S	S	.	*			trans	-131.4	165.6	-163.9	-179.1	0	0	0	0	110.4	N424	N424-V426 HydrophobicContact CB-CG2 4.46Å
427	Y	26.9	Very low	27.4	Very low	193 Å²	193	152.7 Å²	152.7	76%	0.757	75%	0.753	S	S	*	*			trans	80.9	137.9	177.8	-55.3	-79.1	0	0	0	115.1	L429	Y427-L429 HydrophobicContact CD1-CD1 3.95Å; Y427-L429 HydrophobicContact CE1-CD1 4.39Å
428	N	28.1	Very low	27.5	Very low	135 Å²	135	152.3 Å²	152.3	72%	0.722	75%	0.75	S	S	*	*			cis	-128.7	135.9	1.8	-85.9	-59.8	0	0	0	109.6
429	L	26	Very low	27.6	Very low	120 Å²	120	152.1 Å²	152.1	63%	0.628	75%	0.75	S	S	*	*				66.2	117.2	78	-90.9	129.7	0	0	0	115.7	Y427	Y427-L429 HydrophobicContact CD1-CD1 3.95Å; Y427-L429 HydrophobicContact CE1-CD1 4.39Å
430	N	26.1	Very low	27.8	Very low	129 Å²	129	148 Å²	148	69%	0.69	75%	0.746	S	S	*	*			trans	74	144.6	159.6	-56.8	-26.6	0	0	0	117.3
431	Q	29.4	Very low	27.7	Very low	160 Å²	160	145.1 Å²	145.1	75%	0.748	74%	0.737	S	S	*	*			cis	-155.4	154.3	9.6	-133.8	158.1	9.9	0	0	113.7
432	D	29.6	Very low	28.1	Very low	107 Å²	107	144.5 Å²	144.5	57%	0.572	73%	0.734	S	S	*	*			trans	29.7	114.5	158.2	-69.9	-49.7	0	0	0	122.4
433	K	29.4	Very low	27.8	Very low	176 Å²	176	148.4 Å²	148.4	77%	0.765	73%	0.734	S	S	*	*				68.7	112	80.1	-68.5	-171.8	-161.4	97.6	0	116.3
434	R	27.2	Very low	28.4	Very low	219 Å²	219	146.1 Å²	146.1	83%	0.826	73%	0.728	S	S	*	*				173.2	124.9	107.2	-93.1	178.3	-168	-95.7	1.7	114.8
435	I	25.7	Very low	28.5	Very low	121 Å²	121	148.8 Å²	148.8	62%	0.621	74%	0.736	S	S	*	*			trans	47.8	117.1	134.1	-51.3	168.1	0	0	0	119.2	I437	I435-I437 HydrophobicContact CG2-CG1 4.09Å
436	P	25	Very low	28.4	Very low	125 Å²	125	146.3 Å²	146.3	81%	0.812	73%	0.731	S	S	*	*			trans	-82.9	150	157.9	35.4	-32.5	0	0	0	111.8
437	I	26.3	Very low	28.5	Very low	160 Å²	160	147.5 Å²	147.5	82%	0.821	74%	0.738	S	S	*	*			trans	-126.7	142.9	167.5	-63.6	-176.6	0	0	0	109.1	I435	I435-I437 HydrophobicContact CG2-CG1 4.09Å
438	I	27.5	Very low	28.5	Very low	143 Å²	143	142.6 Å²	142.6	73%	0.733	73%	0.732	S	S	*	*			trans	-75	152.3	-174.3	-59.3	153.3	0	0	0	110.5
439	N	26.4	Very low	28.5	Very low	157 Å²	157	147.9 Å²	147.9	84%	0.84	74%	0.742	S	S	*	*			trans	-163.5	132.4	135.2	-98.6	-6.8	0	0	0	111.3
440	S	30.7	Very low	28.6	Very low	109 Å²	109	146.2 Å²	146.2	76%	0.762	74%	0.741	S	S	*	*			trans	-118.4	148.3	161.4	-59.4	0	0	0	0	106.4
441	D	27.6	Very low	28.7	Very low	121 Å²	121	147.6 Å²	147.6	65%	0.647	75%	0.748	S	S	*	*			trans	-159.3	160.7	168.1	-126.8	-31	0	0	0	116.2
442	H	34.6	Very low	28.7	Very low	167 Å²	167	144.4 Å²	144.4	77%	0.773	74%	0.743	S	S	*	*			trans	85.6	111.8	179.5	-53.8	81.4	0	0	0	116.9
443	Y	29.5	Very low	28.5	Very low	200 Å²	200	146.4 Å²	146.4	78%	0.784	75%	0.754	S	S	*	*			cis	95.8	152.3	37	-88	-129.6	0	0	0	114
444	P	39.5	Very low	28.6	Very low	96 Å²	96	145.7 Å²	145.7	62%	0.623	76%	0.758	S	S	*	*			cis	-143.3	176.4	-29.6	37.3	-20.4	0	0	0	115
445	H	27.8	Very low	28.7	Very low	175 Å²	175	139.5 Å²	139.5	81%	0.81	75%	0.748	S	S	*	*				-169.9	129.6	126.6	-116.6	-80.5	0	0	0	113
446	I	27.9	Very low	28.7	Very low	171 Å²	171	141.4 Å²	141.4	88%	0.877	76%	0.758	S	S	*	*			trans	157.8	154.2	150.8	-84.8	161.2	0	0	0	108.4
447	T	28.1	Very low	28.8	Very low	113 Å²	113	139.7 Å²	139.7	69%	0.693	75%	0.749	S	S	*	*			trans	-117.7	155.8	-147.8	52	0	0	0	0	116.9
448	S	25.6	Very low	28.9	Very low	90 Å²	90	136.5 Å²	136.5	63%	0.629	74%	0.741	S	S	*	*			trans	64.6	103.8	140.4	65.1	0	0	0	0	120.4
449	W	28.4	Very low	28.9	Very low	247 Å²	247	136.2 Å²	136.2	94%	0.936	74%	0.739	S	S	*	*				169.6	135.6	116.3	-82.1	-4.7	0	0	0	107.8
450	S	27.6	Very low	29.1	Very low	85 Å²	85	135.1 Å²	135.1	59%	0.594	73%	0.733	S	S	*	*			cis	161.8	137.7	-19.4	42.5	0	0	0	0	104.7
451	N	28.9	Very low	28.9	Very low	157 Å²	157	135.9 Å²	135.9	84%	0.84	73%	0.729	S	S	*	*			trans	74.9	142.3	174	-47.1	-19.3	0	0	0	115.8
452	S	28.6	Very low	29	Very low	93 Å²	93	135.7 Å²	135.7	65%	0.65	73%	0.728	S	S	*	*			cis	-168.6	143	-13.7	44.1	0	0	0	0	112.7
453	D	26.9	Very low	28.8	Very low	149 Å²	149	133.7 Å²	133.7	80%	0.797	72%	0.723	S	S	*	*			trans	70.8	159.1	148.3	-55.9	-25.4	0	0	0	123.2
454	L	31.6	Very low	28.8	Very low	161 Å²	161	129.7 Å²	129.7	84%	0.843	72%	0.715	S	S	*	*			trans	74.1	74.7	177.9	-52.9	178.9	0	0	0	116
455	S	28.1	Very low	28.3	Very low	90 Å²	90	130.6 Å²	130.6	63%	0.629	72%	0.715	S	S	*	*			cis	86.5	138	32.2	98.2	0	0	0	0	116.8
456	I	26.1	Very low	28.3	Very low	160 Å²	160	128.9 Å²	128.9	82%	0.821	71%	0.71	S	S	*	*			trans	71.1	129.9	154	-70.3	168.2	0	0	0	117
457	S	27.4	Very low	28.5	Very low	89 Å²	89	129.9 Å²	129.9	62%	0.622	71%	0.708	S	S	*	*			cis	-172.7	-178.5	-7.4	58.3	0	0	0	0	112.2
458	S	28.6	Very low	28.5	Very low	94 Å²	94	131.2 Å²	131.2	66%	0.657	71%	0.711	S	S	*	*			trans	88.8	144.6	140.1	-66.9	0	0	0	0	120.5
459	I	27.4	Very low	28.8	Very low	136 Å²	136	136.4 Å²	136.4	70%	0.697	73%	0.725	S	S	*	*			cis	-171	158.7	-32.4	-123.3	164.2	0	0	0	108.5
460	N	29.5	Very low	29	Very low	134 Å²	134	129.5 Å²	129.5	72%	0.717	71%	0.71	S	S	*	*			trans	65.5	163.6	165.2	-79.6	-12.9	0	0	0	118.7
461	N	28.1	Very low	29.1	Very low	125 Å²	125	134.7 Å²	134.7	67%	0.668	72%	0.722	S	S	*	*			cis	-179.5	175.8	-47	-121.7	-33.7	0	0	0	109.7
462	N	29.5	Very low	29.1	Very low	118 Å²	118	135.1 Å²	135.1	63%	0.631	72%	0.724	S	S	*	*			trans	72.4	110.9	146.3	-72.3	5.4	0	0	0	120.1
463	N	29.6	Very low	29.5	Very low	124 Å²	124	137 Å²	137	66%	0.663	73%	0.732	S	S	*	*				99	113.4	113.5	-68.9	11.7	0	0	0	120.8
464	N	30	Very low	30	Very low	116 Å²	116	137.5 Å²	137.5	62%	0.62	73%	0.729	S	S	*	*				96.2	119.6	117	-77	46.7	0	0	0	121.5
465	D	28.8	Very low	29.9	Very low	115 Å²	115	138.3 Å²	138.3	62%	0.615	73%	0.728	S	S	*	*				91.5	116.6	122.9	-67.8	-18.3	0	0	0	122
466	I	27.9	Very low	30.3	Very low	140 Å²	140	140.3 Å²	140.3	72%	0.718	73%	0.732	S	S	*	*				68.5	118.3	129	-59.8	169.8	0	0	0	114.8
467	K	31.9	Very low	30.7	Very low	192 Å²	192	141 Å²	141	84%	0.835	73%	0.731	S	S	*	*				-162.1	157.4	65.8	-151.7	161.3	-176.6	178.9	0	114.2
468	L	28.2	Very low	30.9	Very low	141 Å²	141	141.4 Å²	141.4	74%	0.738	73%	0.733	S	S	*	*			trans	-76.5	156.7	167.9	-54.1	82.6	0	0	0	111.3	T470	L468-T470 HydrophobicContact CD2-CG2 4.13Å
469	E	31.7	Very low	31.3	Very low	199 Å²	199	143.2 Å²	143.2	93%	0.93	74%	0.735	S	S	*	*				-141.9	151.9	123.2	-161	149.7	-138.2	0	0	109.7
470	T	32.3	Very low	31.7	Very low	101 Å²	101	142.6 Å²	142.6	62%	0.62	73%	0.734	S	S	*	*			trans	-123.6	149.9	-164.9	50.5	0	0	0	0	113.2	L468	L468-T470 HydrophobicContact CD2-CG2 4.13Å
471	K	30.2	Very low	32	Very low	195 Å²	195	143.7 Å²	143.7	85%	0.848	73%	0.734	S	S	*	*			trans	179.8	130	133	-97.2	148.6	-170.7	169.5	0	111.2
472	D	28.8	Very low	32.4	Very low	165 Å²	165	143.6 Å²	143.6	88%	0.882	73%	0.733	S	S	*	*				-159.2	178.9	121.8	-99.3	-28.4	0	0	0	109.1
473	V	37.5	Very low	32.8	Very low	134 Å²	134	144 Å²	144	81%	0.812	74%	0.735	S	S	*	*			trans	-100.9	152.2	-147.6	179.3	0	0	0	0	115.1
474	H	36.1	Very low	33.2	Very low	159 Å²	159	145.4 Å²	145.4	74%	0.736	74%	0.737	S	S	*	*			trans	-26.5	138.7	178.2	-84.4	-109.2	0	0	0	119.4	D476	H474-D476 IonicContact CE1-OD2 3.7Å; H474-D476 IonicContact CG-OD2 3.98Å; H474-D476 IonicContact ND1-OD2 2.91Å; H474-D476 PolarHBondContact ND1-OD2 3.06Å
475	H	29.8	Very low	33.6	Very low	177 Å²	177	145.3 Å²	145.3	82%	0.819	74%	0.737	S	S	*	*			trans	-90.1	149	135.3	-92.3	-77.4	0	0	0	109.6
476	D	37.5	Very low	34.1	Very low	133 Å²	133	147.7 Å²	147.7	71%	0.711	74%	0.744	S	S	*	*			trans	-164.5	108.7	150.5	-74	-61.5	0	0	0	104	H474	H474-D476 IonicContact CE1-OD2 3.7Å; H474-D476 IonicContact CG-OD2 3.98Å; H474-D476 IonicContact ND1-OD2 2.91Å; H474-D476 PolarHBondContact ND1-OD2 3.06Å
477	E	33.2	Very low	34.4	Very low	173 Å²	173	147.7 Å²	147.7	81%	0.808	75%	0.745	S	S	*	*				81.4	117.9	66.9	-88.1	-157.3	-170.8	0	0	117.5
478	C	32.3	Very low	34.6	Very low	99 Å²	99	142.3 Å²	142.3	67%	0.669	73%	0.732	S	S	*	*			trans	86.2	150	138.7	-63.7	0	0	0	0	124
479	D	38	Very low	34.9	Very low	131 Å²	131	143.2 Å²	143.2	70%	0.701	74%	0.737	S	S	*	*			trans	81.1	93.4	150	-67.6	-1.2	0	0	0	124.6
480	N	34.6	Very low	35	Very low	124 Å²	124	137.6 Å²	137.6	66%	0.663	73%	0.733	S	S	*	*				76.7	136.2	109.2	-68.1	-38.3	0	0	0	124.3
481	H	35.4	Very low	35.1	Very low	157 Å²	157	139.9 Å²	139.9	73%	0.727	74%	0.741	S	S	*	*			trans	93.4	121.1	131.5	-86.7	-35.3	0	0	0	123.7
482	L	36.6	Very low	35.4	Very low	122 Å²	122	137.2 Å²	137.2	64%	0.639	74%	0.736	S	S	*	*			trans	84.6	100.4	133.8	-59.9	166.5	0	0	0	121.3
483	D	37.7	Very low	35.5	Very low	127 Å²	127	136.7 Å²	136.7	68%	0.679	73%	0.733	S	S	*	*				75.4	150.6	112.1	-61.9	4.3	0	0	0	124.4
484	H	39.4	Very low	35.4	Very low	154 Å²	154	135.7 Å²	135.7	71%	0.713	73%	0.733	S	S	*	*			trans	73.5	93.4	156	-71.6	-58.5	0	0	0	121.2
485	D	37.7	Very low	35.2	Very low	113 Å²	113	135.5 Å²	135.5	60%	0.604	74%	0.737	S	S	*	*				77.6	135.5	109.9	-67.7	-7.6	0	0	0	123.6
486	H	39	Very low	35.4	Very low	166 Å²	166	133.8 Å²	133.8	77%	0.769	73%	0.734	S	S	*	*			trans	71.3	145.4	138.3	-72.9	-12.7	0	0	0	119.4
487	N	35.5	Very low	35.3	Very low	139 Å²	139	133.5 Å²	133.5	74%	0.743	73%	0.732	S	S	*	*			cis	-167.1	172.3	-15.2	-171.1	8.4	0	0	0	108.8
488	S	36.1	Very low	35.2	Very low	80 Å²	80	132.1 Å²	132.1	56%	0.559	73%	0.73	S	S	*	*			trans	77.2	100.4	148.6	-177.4	0	0	0	0	120.3
489	N	33.7	Very low	35.1	Very low	159 Å²	159	138.9 Å²	138.9	85%	0.85	74%	0.742	S	S	*	*				52.5	122.6	123.4	-53.3	-35.5	0	0	0	120.6
490	G	34.8	Very low	35	Very low	81 Å²	81	141.8 Å²	141.8	84%	0.835	75%	0.754	S	S	*	*			trans	-158.3	42.2	179.1	0	0	0	0	0	117
491	N	33.4	Very low	34.7	Very low	149 Å²	149	144.6 Å²	144.6	80%	0.797	76%	0.763	S	S	*	*			trans	4	144.8	163.3	-99.3	-3	0	0	0	122.1
492	N	36.2	Very low	34.5	Very low	140 Å²	140	141.9 Å²	141.9	75%	0.749	76%	0.762	S	S	*	*			trans	99.2	112.5	151.2	-54.9	-35.3	0	0	0	120.1
493	N	30.5	Very low	34.2	Very low	153 Å²	153	143.6 Å²	143.6	82%	0.818	77%	0.771	S	S	*	*			trans	-3.1	128.8	137	-56.2	-12.9	0	0	0	117.6
494	S	35.1	Very low	34	Very low	114 Å²	114	143.2 Å²	143.2	80%	0.797	77%	0.769	S	S	*	*				-174.9	148.2	104.2	-78.5	0	0	0	0	113.3
495	N	32.1	Very low	33.6	Very low	155 Å²	155	145.7 Å²	145.7	83%	0.829	78%	0.781	S	S	*	*			trans	-63	135.9	179.6	-56.8	-21.8	0	0	0	113
496	N	35.8	Very low	33.3	Very low	140 Å²	140	146.7 Å²	146.7	75%	0.749	79%	0.786	S	S	*	*			trans	-148.6	107.2	149.2	-83.9	-74.5	0	0	0	106.3
497	N	35.4	Very low	33.1	Very low	127 Å²	127	143.9 Å²	143.9	68%	0.679	77%	0.773	S	S	*	*				83.8	96.3	88.7	-71.2	-22.2	0	0	0	113.3
498	D	31	Very low	32.9	Very low	144 Å²	144	146.4 Å²	146.4	77%	0.77	78%	0.78	S	S	*	*			trans	41.6	137	135.9	-55.9	-17.5	0	0	0	122.4
499	R	29.8	Very low	32.6	Very low	241 Å²	241	146.6 Å²	146.6	91%	0.909	78%	0.782	S	S	*	*			trans	73.5	111.2	166.5	-50	159.7	90.9	146.3	7	113.4
500	M	34.9	Very low	32.5	Very low	193 Å²	193	146.2 Å²	146.2	95%	0.951	77%	0.772	S	S	*	*				-136.4	148.5	56.7	-78.4	-172.9	172.1	0	0	115.2
501	E	29.3	Very low	32.4	Very low	183 Å²	183	151.6 Å²	151.6	86%	0.855	78%	0.776	S	S	*	*			trans	-95.8	161	175.9	-172.2	173	-162.2	0	0	110
502	S	30.1	Very low	32.2	Very low	100 Å²	100	152.6 Å²	152.6	70%	0.699	78%	0.781	S	S	*	*	S	Bend	trans	73.5	158.8	-172.5	79.5	0	0	0	0	116.6
503	N	30.6	Very low	31.8	Very low	158 Å²	158	156.6 Å²	156.6	85%	0.845	79%	0.787	S	S	*	*	S	Bend	trans	74.3	38.6	175.3	-52.7	-34	0	0	0	119
504	N	32.9	Very low	31.7	Very low	119 Å²	119	158 Å²	158	64%	0.636	79%	0.788	S	S	*	*			trans	-144.6	34	156.2	-147.1	-7.3	0	0	0	115.3
505	Q	31.3	Very low	31.6	Very low	206 Å²	206	160 Å²	160	96%	0.963	79%	0.79	S	S	*	*	S	Bend	trans	-99.9	28.7	172.3	-70.4	-172.7	-7.7	0	0	112.7
506	L	31	Very low	31.4	Very low	133 Å²	133	163.1 Å²	163.1	70%	0.696	79%	0.792	S	S	*	*	S	Bend	trans	-131	-34.3	-176.4	-166	58.8	0	0	0	114	S509	L506-S509 PolarHBondContact O-OG 3.4Å
507	E	34.6	Very low	31.3	Very low	107 Å²	107	162.2 Å²	162.2	50%	0.5	79%	0.793	S	S	.	*	S	Bend	trans	-90.3	-1.8	-169.6	-130.3	60.7	-140.6	0	0	115.5	S509 K510	E507-S509 PolarHBondContact O-N 3.37Å; E507-K510 IonicContact OE1-NZ 2.94Å; E507-K510 PolarHBondContact OE1-NZ 2.85Å
508	Q	33	Very low	31	Very low	192 Å²	192	162.5 Å²	162.5	90%	0.897	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	18.5	170.1	-67	-170.2	-5	0	0	113.6
509	S	28.3	Very low	31.1	Very low	85 Å²	85	163.8 Å²	163.8	59%	0.594	80%	0.797	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	4.1	-170.1	57.2	0	0	0	0	114.9	L506 E507	L506-S509 PolarHBondContact O-OG 3.4Å; E507-S509 PolarHBondContact O-N 3.37Å
510	K	32.2	Very low	31	Very low	150 Å²	150	158.3 Å²	158.3	65%	0.652	78%	0.78	S	S	*	*	S	Bend	trans	-135.9	23.8	-162.3	-75.9	-177.7	-173.4	156	0	117.9	E507	E507-K510 IonicContact OE1-NZ 2.94Å; E507-K510 PolarHBondContact OE1-NZ 2.85Å
511	Q	32.6	Very low	30.8	Very low	194 Å²	194	160.6 Å²	160.6	91%	0.907	78%	0.78	S	S	*	*	S	Bend	trans	-129.2	38.7	174.4	-67.5	-168.4	-3.1	0	0	114
512	L	30.3	Very low	30.5	Very low	171 Å²	171	156.8 Å²	156.8	90%	0.895	77%	0.774	S	S	*	*			trans	-124.2	41.8	169.6	-73.9	175.8	0	0	0	111.7
513	Y	26.2	Very low	30.6	Very low	224 Å²	224	159.7 Å²	159.7	88%	0.878	78%	0.78	S	S	*	*			trans	-143.3	91.6	176.2	-107.2	-89.5	0	0	0	110.4
514	E	29.7	Very low	30.5	Very low	182 Å²	182	158.3 Å²	158.3	85%	0.85	77%	0.773	S	S	*	*			trans	179.3	165.3	138.8	-102.1	171.1	-162.3	0	0	110
515	N	32.1	Very low	30.2	Very low	155 Å²	155	159 Å²	159	83%	0.829	78%	0.776	S	S	*	*			trans	68.1	63.5	178.8	-57.9	-57.3	0	0	0	117.2
516	Y	28.8	Very low	30.1	Very low	222 Å²	222	157.1 Å²	157.1	87%	0.871	77%	0.773	S	S	*	*			trans	-122.7	123.4	149	-116.5	-79.4	0	0	0	108.6	E518	Y516-E518 PolarHBondContact O-N 3.19Å
517	P	34.2	Very low	30.1	Very low	120 Å²	120	154.4 Å²	154.4	78%	0.779	77%	0.766	S	S	*	*			trans	-74.5	123	164	30.2	-30.5	0	0	0	108.6
518	E	28.7	Very low	29.9	Very low	134 Å²	134	153.7 Å²	153.7	63%	0.626	77%	0.77	S	S	*	*			trans	-69.4	149.5	176	-64.5	-168.8	142.7	0	0	112	Y516 K520	Y516-E518 PolarHBondContact O-N 3.19Å; E518-K520 VanDerWaalsContact OE1-CE 3.28Å; E518-K520 WeakPolarHBondContact OE1-CE 3.31Å; E518-K520 IonicContact OE1-NZ 2.61Å; E518-K520 PolarHBondContact OE1-NZ 2.91Å; E518-K520 IonicContact OE2-NZ 2.62Å; E518-K520 PolarHBondContact OE2-NZ 3.27Å
519	N	33.3	Very low	30.2	Very low	170 Å²	170	153.3 Å²	153.3	91%	0.909	77%	0.765	S	S	*	*				-144.1	126.8	126.1	-122	-44.9	0	0	0	110.8
520	K	27.1	Very low	30.7	Very low	127 Å²	127	153.6 Å²	153.6	55%	0.552	77%	0.765	S	S	*	*			trans	-90	140.1	-173.4	-61.4	-177.7	171.2	89.5	0	110.3	E518	E518-K520 VanDerWaalsContact OE1-CE 3.28Å; E518-K520 WeakPolarHBondContact OE1-CE 3.31Å; E518-K520 IonicContact OE1-NZ 2.61Å; E518-K520 PolarHBondContact OE1-NZ 2.91Å; E518-K520 IonicContact OE2-NZ 2.62Å; E518-K520 PolarHBondContact OE2-NZ 3.27Å
521	Y	30.2	Very low	31	Very low	241 Å²	241	153.6 Å²	153.6	95%	0.945	77%	0.765	S	S	*	*				-155	119.2	127.3	-91.1	-62.7	0	0	0	109.7
522	S	23.6	Very low	31.2	Very low	103 Å²	103	149 Å²	149	72%	0.72	74%	0.74	S	S	*	*			trans	-100.3	151.2	-173.4	-49.3	0	0	0	0	111.8
523	L	31.4	Very low	31.6	Very low	161 Å²	161	147.9 Å²	147.9	84%	0.843	73%	0.731	S	S	*	*			trans	-160.7	124.3	133.9	-132.2	76.9	0	0	0	113.7
524	N	29.1	Very low	32.4	Very low	128 Å²	128	142.3 Å²	142.3	68%	0.684	72%	0.715	S	S	*	*			trans	42.6	98.2	154.5	-68.5	-17.5	0	0	0	122.9
525	N	27	Very low	32.9	Very low	133 Å²	133	135 Å²	135	71%	0.711	69%	0.685	S	S	*	*				48	105.5	107.3	-53.9	-15.3	0	0	0	120.6
526	N	28.5	Very low	33.4	Very low	167 Å²	167	132.7 Å²	132.7	89%	0.893	67%	0.673	S	S	*	*				179.3	170.7	112.8	-90.7	-19	0	0	0	113.5
527	S	31	Very low	33.9	Very low	77 Å²	77	124.8 Å²	124.8	54%	0.538	65%	0.65	S	S	.	*			trans	74.3	148.3	171.1	-115.5	0	0	0	0	119.5	E627	S527-E627 PolarHBondContact OG-OE2 3.45Å
528	P	31.6	Very low	34.2	Very low	92 Å²	92	123.4 Å²	123.4	60%	0.597	64%	0.635	S	S	*	*			trans	-102.1	133.9	-154	37.6	-34.1	0	0	0	116
529	K	37.7	Very low	35.2	Very low	183 Å²	183	120.4 Å²	120.4	80%	0.796	63%	0.626	S	S	*	*			trans	-95.5	-13.4	-173.7	-65.9	-178.5	178.7	176.7	0	120	K531	K529-K531 PolarHBondContact O-N 2.78Å
530	P	40.5	Very low	35.6	Very low	92 Å²	92	115.1 Å²	115.1	60%	0.597	61%	0.607	S	S	*	*	H	α-helix	trans	-77.2	-22.5	-172.2	29.8	-34.8	0	0	0	115.1
531	K	37.9	Very low	36.2	Very low	149 Å²	149	114.3 Å²	114.3	65%	0.648	61%	0.608	S	S	*	*	H	α-helix	trans	-74.1	-38.4	-177.9	-67	-175.3	177.7	-178.1	0	113.1	K529 Q533 I534 A535	K529-K531 PolarHBondContact O-N 2.78Å; K531-Q533 VanDerWaalsContact C-N 3.32Å; K531-Q533 PolarHBondContact O-N 3.47Å; K531-I534 PolarHBondContact O-N 2.89Å; K531-A535 PolarHBondContact O-N 2.98Å; K531-A535 VanDerWaalsContact O-N 3.12Å
532	Y	35.5	Very low	36.9	Very low	97 Å²	97	106.9 Å²	106.9	38%	0.38	58%	0.584	S	S	.	*	H	α-helix	trans	-59.2	-36.6	-177.3	-100.2	-86.9	0	0	0	113.7	I534 A535 L536 Y624	Y532-I534 VanDerWaalsContact C-N 3.32Å; Y532-I534 PolarHBondContact O-N 3.25Å; Y532-A535 PolarHBondContact O-N 3.3Å; Y532-L536 WeakPolarHBondContact O-CB 3.31Å; Y532-L536 PolarHBondContact O-N 2.88Å; Y532-Y624 HydrophobicContact CE2-CD2 4.42Å; Y532-Y624 HydrophobicContact CE2-CE2 4.19Å; Y532-Y624 WeakPolarHBondContact OH-CD2 3.41Å; Y532-Y624 WeakPolarHBondContact OH-CE2 3.45Å
533	Q	38.8	Very low	37.8	Very low	148 Å²	148	109.4 Å²	109.4	69%	0.692	58%	0.579	S	S	*	*	H	α-helix	trans	-68.5	-30.8	177.2	-73.8	-176.1	-19.8	0	0	112.9	K531 S537	K531-Q533 VanDerWaalsContact C-N 3.32Å; K531-Q533 PolarHBondContact O-N 3.47Å; Q533-S537 WeakPolarHBondContact O-CB 3.48Å; Q533-S537 PolarHBondContact O-N 2.93Å; Q533-S537 PolarHBondContact O-OG 3.46Å
534	I	42.7	Very low	38.4	Very low	107 Å²	107	105.1 Å²	105.1	55%	0.549	56%	0.56	S	S	.	*	H	α-helix	trans	-71.4	-46.2	174.5	-57.4	176.1	0	0	0	109.4	K531 Y532 L536 S537 L538	K531-I534 PolarHBondContact O-N 2.89Å; Y532-I534 VanDerWaalsContact C-N 3.32Å; Y532-I534 PolarHBondContact O-N 3.25Å; I534-L536 VanDerWaalsContact C-N 3.34Å; I534-L536 PolarHBondContact O-N 2.59Å; I534-S537 WeakPolarHBondContact CA-OG 3.22Å; I534-S537 PolarHBondContact O-N 2.95Å; I534-S537 PolarHBondContact O-OG 2.91Å; I534-S537 VanDerWaalsContact O-OG 3.07Å; I534-L538 HydrophobicContact CG2-CD1 3.93Å; I534-L538 HydrophobicContact CG2-CG 4.33Å; I534-L538 WeakPolarHBondContact O-CB 3.48Å; I534-L538 WeakPolarHBondContact O-CG 3.25Å; I534-L538 PolarHBondContact O-N 3.47Å
535	A	40.2	Very low	39.2	Very low	28 Å²	28	102.9 Å²	102.9	23%	0.231	55%	0.551	C	S	.	*	H	α-helix	trans	-58.6	-43	174.2	0	0	0	0	0	112.5	K531 Y532 T539	K531-A535 PolarHBondContact O-N 2.98Å; K531-A535 VanDerWaalsContact O-N 3.12Å; Y532-A535 PolarHBondContact O-N 3.3Å; A535-T539 WeakPolarHBondContact O-CB 3.43Å; A535-T539 WeakPolarHBondContact O-CG2 3.36Å; A535-T539 PolarHBondContact O-N 2.83Å; A535-T539 PolarHBondContact O-OG1 3.18Å
536	L	43.3	Very low	40.2	Very low	107 Å²	107	100.8 Å²	100.8	56%	0.56	54%	0.539	S	S	*	.	H	α-helix	trans	-64.5	-42.5	176.3	-87.3	158.2	0	0	0	113.1	Y532 I534 T539 A540	Y532-L536 WeakPolarHBondContact O-CB 3.31Å; Y532-L536 PolarHBondContact O-N 2.88Å; I534-L536 VanDerWaalsContact C-N 3.34Å; I534-L536 PolarHBondContact O-N 2.59Å; L536-T539 WeakPolarHBondContact CA-OG1 3.38Å; L536-T539 PolarHBondContact O-OG1 3.41Å; L536-A540 WeakPolarHBondContact O-CB 3.44Å; L536-A540 PolarHBondContact O-N 2.9Å
537	S	39.1	Very low	41.1	Very low	56 Å²	56	96.5 Å²	96.5	39%	0.392	52%	0.516	S	S	.	.	H	α-helix	trans	-71.6	-37.6	178.9	51.5	0	0	0	0	112.8	Q533 I534 N541	Q533-S537 WeakPolarHBondContact O-CB 3.48Å; Q533-S537 PolarHBondContact O-N 2.93Å; Q533-S537 PolarHBondContact O-OG 3.46Å; I534-S537 WeakPolarHBondContact CA-OG 3.22Å; I534-S537 PolarHBondContact O-N 2.95Å; I534-S537 PolarHBondContact O-OG 2.91Å; I534-S537 VanDerWaalsContact O-OG 3.07Å; S537-N541 WeakPolarHBondContact O-CB 3.4Å; S537-N541 PolarHBondContact O-N 3.3Å; S537-N541 VanDerWaalsContact O-N 3.07Å
538	L	41.9	Very low	41.9	Very low	91 Å²	91	95.7 Å²	95.7	48%	0.476	51%	0.511	S	S	.	.	I	π-helix	trans	-61.5	-48.2	172.2	-68.9	171	0	0	0	111.4	I534 I542	I534-L538 HydrophobicContact CG2-CD1 3.93Å; I534-L538 HydrophobicContact CG2-CG 4.33Å; I534-L538 WeakPolarHBondContact O-CB 3.48Å; I534-L538 WeakPolarHBondContact O-CG 3.25Å; I534-L538 PolarHBondContact O-N 3.47Å; L538-I542 HydrophobicContact CD2-CD1 3.62Å; L538-I542 WeakPolarHBondContact O-CB 3.42Å; L538-I542 PolarHBondContact O-N 2.89Å; L538-I542 VanDerWaalsContact O-N 3.08Å
539	T	48.5	Very low	42.5	Very low	71 Å²	71	95.4 Å²	95.4	44%	0.436	50%	0.504	S	S	.	.	I	π-helix	trans	-71	-37	-179.2	50.3	0	0	0	0	113.2	A535 L536 Y543	A535-T539 WeakPolarHBondContact O-CB 3.43Å; A535-T539 WeakPolarHBondContact O-CG2 3.36Å; A535-T539 PolarHBondContact O-N 2.83Å; A535-T539 PolarHBondContact O-OG1 3.18Å; L536-T539 WeakPolarHBondContact CA-OG1 3.38Å; L536-T539 PolarHBondContact O-OG1 3.41Å; T539-Y543 WeakPolarHBondContact O-CB 3.44Å
540	A	42.9	Very low	42.8	Very low	60 Å²	60	93.4 Å²	93.4	50%	0.496	49%	0.493	S	S	.	.	I	π-helix	trans	-71.3	-42.5	178.4	0	0	0	0	0	113.4	L536 P544	L536-A540 WeakPolarHBondContact O-CB 3.44Å; L536-A540 PolarHBondContact O-N 2.9Å; A540-P544 WeakPolarHBondContact O-CD 3.43Å; A540-P544 WeakPolarHBondContact O-CG 3.45Å
541	N	39.5	Very low	42.9	Very low	109 Å²	109	89.4 Å²	89.4	58%	0.583	47%	0.469	S	S	*	.	I	π-helix	trans	-100.7	-37.7	-168.3	-62.4	-27	0	0	0	113.7	S537 T545	S537-N541 WeakPolarHBondContact O-CB 3.4Å; S537-N541 PolarHBondContact O-N 3.3Å; S537-N541 VanDerWaalsContact O-N 3.07Å; N541-T545 PolarHBondContact O-OG1 3.42Å
542	I	44.9	Very low	43.4	Very low	85 Å²	85	90.4 Å²	90.4	44%	0.436	47%	0.468	S	S	.	.	I	π-helix	trans	-89.8	-42.9	-172.2	-55.6	-173.5	0	0	0	111.3	L538 T545 I546	L538-I542 HydrophobicContact CD2-CD1 3.62Å; L538-I542 WeakPolarHBondContact O-CB 3.42Å; L538-I542 PolarHBondContact O-N 2.89Å; L538-I542 VanDerWaalsContact O-N 3.08Å; I542-T545 WeakPolarHBondContact O-CB 3.41Å; I542-T545 PolarHBondContact O-N 2.89Å; I542-T545 VanDerWaalsContact O-N 3.13Å; I542-I546 HydrophobicContact CG2-CD1 3.57Å; I542-I546 HydrophobicContact CG2-CG1 3.97Å; I542-I546 PolarHBondContact O-N 2.83Å
543	Y	41.7	Very low	43.9	Very low	156 Å²	156	90.7 Å²	90.7	61%	0.612	48%	0.476	S	S	*	.	H	α-helix	trans	-59.8	-44.7	-176.2	-167.7	-99	0	0	0	113.9	T539 T545 N547	T539-Y543 WeakPolarHBondContact O-CB 3.44Å; Y543-T545 VanDerWaalsContact C-N 3.31Å; Y543-T545 PolarHBondContact O-N 3.44Å; Y543-N547 WeakPolarHBondContact O-CB 3.45Å; Y543-N547 PolarHBondContact O-N 3.33Å; Y543-N547 VanDerWaalsContact O-N 3.1Å
544	P	44.4	Very low	44.5	Very low	71 Å²	71	87.5 Å²	87.5	46%	0.461	46%	0.46	S	S	.	.	H	α-helix	trans	-65.2	-35.4	175.5	-20.9	34.8	0	0	0	112.5	A540 S548	A540-P544 WeakPolarHBondContact O-CD 3.43Å; A540-P544 WeakPolarHBondContact O-CG 3.45Å; P544-S548 WeakPolarHBondContact O-CB 3.37Å; P544-S548 PolarHBondContact O-N 3.15Å
545	T	46.5	Very low	44.9	Very low	81 Å²	81	88.2 Å²	88.2	50%	0.497	46%	0.461	S	S	.	.	H	α-helix	trans	-68.9	-45.4	-178.2	-57.1	0	0	0	0	111.6	N541 I542 Y543 N549	N541-T545 PolarHBondContact O-OG1 3.42Å; I542-T545 WeakPolarHBondContact O-CB 3.41Å; I542-T545 PolarHBondContact O-N 2.89Å; I542-T545 VanDerWaalsContact O-N 3.13Å; Y543-T545 VanDerWaalsContact C-N 3.31Å; Y543-T545 PolarHBondContact O-N 3.44Å; T545-N549 PolarHBondContact O-N 2.93Å; T545-N549 VanDerWaalsContact O-N 3.07Å; T545-N549 PolarHBondContact O-ND2 3.21Å
546	I	47.3	Very low	45.2	Very low	89 Å²	89	92.7 Å²	92.7	46%	0.456	48%	0.475	S	S	.	.	H	α-helix	trans	-62.6	-47.5	174.1	-67.5	179.2	0	0	0	110.4	I542 S548 N549 Y550	I542-I546 HydrophobicContact CG2-CD1 3.57Å; I542-I546 HydrophobicContact CG2-CG1 3.97Å; I542-I546 PolarHBondContact O-N 2.83Å; I546-S548 PolarHBondContact O-N 3.19Å; I546-N549 PolarHBondContact O-N 3.24Å; I546-Y550 WeakPolarHBondContact O-CB 3.19Å; I546-Y550 PolarHBondContact O-N 3.34Å
547	N	46.7	Very low	45.1	Very low	77 Å²	77	92.1 Å²	92.1	41%	0.412	47%	0.472	S	S	.	.	H	α-helix	trans	-65.4	-38.3	-177.7	-162.2	2.7	0	0	0	112.1	Y543 Y550 G551	Y543-N547 WeakPolarHBondContact O-CB 3.45Å; Y543-N547 PolarHBondContact O-N 3.33Å; Y543-N547 VanDerWaalsContact O-N 3.1Å; N547-Y550 PolarHBondContact O-N 3.41Å; N547-G551 PolarHBondContact O-N 3.15Å
548	S	48.7	Very low	45.3	Very low	60 Å²	60	91.1 Å²	91.1	42%	0.42	46%	0.463	S	S	.	.	H	α-helix	trans	-61.3	-45	172.4	-176.7	0	0	0	0	112.3	P544 I546 G551 R552	P544-S548 WeakPolarHBondContact O-CB 3.37Å; P544-S548 PolarHBondContact O-N 3.15Å; I546-S548 PolarHBondContact O-N 3.19Å; S548-G551 PolarHBondContact O-N 3.48Å; S548-R552 WeakPolarHBondContact O-CB 3.41Å; S548-R552 WeakPolarHBondContact O-CG 3.36Å; S548-R552 PolarHBondContact O-N 3.47Å
549	N	43.8	Very low	45.6	Very low	87 Å²	87	90.5 Å²	90.5	47%	0.465	46%	0.463	S	S	.	.	H	α-helix	trans	-66.9	-40.7	177	-75.5	-26.6	0	0	0	112.3	T545 I546 R552 L553	T545-N549 PolarHBondContact O-N 2.93Å; T545-N549 VanDerWaalsContact O-N 3.07Å; T545-N549 PolarHBondContact O-ND2 3.21Å; I546-N549 PolarHBondContact O-N 3.24Å; N549-R552 PolarHBondContact O-N 3.28Å; N549-L553 WeakPolarHBondContact O-CB 3.41Å; N549-L553 PolarHBondContact O-N 3.3Å
550	Y	43.5	Very low	45.3	Very low	140 Å²	140	90.1 Å²	90.1	55%	0.549	46%	0.458	S	S	.	.	H	α-helix	trans	-63.7	-43.3	174.6	-173.5	-95.2	0	0	0	112	I546 N547 L553 K554	I546-Y550 WeakPolarHBondContact O-CB 3.19Å; I546-Y550 PolarHBondContact O-N 3.34Å; N547-Y550 PolarHBondContact O-N 3.41Å; Y550-L553 PolarHBondContact O-N 3.33Å; Y550-K554 PolarHBondContact O-N 3.42Å
551	G	43.5	Very low	45.1	Very low	9 Å²	9	95.4 Å²	95.4	9%	0.093	47%	0.465	C	S	.	.	H	α-helix	trans	-60.2	-44.1	173.8	0	0	0	0	0	112.7	N547 S548 K554 Q555	N547-G551 PolarHBondContact O-N 3.15Å; S548-G551 PolarHBondContact O-N 3.48Å; G551-K554 PolarHBondContact O-N 3.09Å; G551-Q555 WeakPolarHBondContact O-CB 3.32Å; G551-Q555 WeakPolarHBondContact O-CG 3.28Å; G551-Q555 PolarHBondContact O-N 3.27Å
552	R	47.3	Very low	45	Very low	170 Å²	170	93.8 Å²	93.8	64%	0.642	46%	0.456	S	S	*	.	H	α-helix	trans	-62.9	-43.2	174.4	-76.1	175.5	172.3	-164.5	-2.6	112.4	S548 N549 Q555 K556	S548-R552 WeakPolarHBondContact O-CB 3.41Å; S548-R552 WeakPolarHBondContact O-CG 3.36Å; S548-R552 PolarHBondContact O-N 3.47Å; N549-R552 PolarHBondContact O-N 3.28Å; R552-Q555 PolarHBondContact O-N 3.23Å; R552-K556 VanDerWaalsContact O-CB 3.29Å; R552-K556 WeakPolarHBondContact O-CB 3.15Å; R552-K556 PolarHBondContact O-N 3.44Å
553	L	45.9	Very low	44.7	Very low	102 Å²	102	94.3 Å²	94.3	53%	0.534	46%	0.46	S	S	.	.	H	α-helix	trans	-59.2	-47.5	173.7	-93.3	155.1	0	0	0	111.6	N549 Y550 K556 N557	N549-L553 WeakPolarHBondContact O-CB 3.41Å; N549-L553 PolarHBondContact O-N 3.3Å; Y550-L553 PolarHBondContact O-N 3.33Å; L553-K556 PolarHBondContact O-N 2.88Å; L553-N557 WeakPolarHBondContact O-CB 3.41Å; L553-N557 PolarHBondContact O-N 3.36Å
554	K	53.2	Low	44.6	Very low	82 Å²	82	89.6 Å²	89.6	36%	0.357	45%	0.449	S	S	.	.	H	α-helix	trans	-64.1	-42.1	178.6	-169	167.6	-174.6	169.2	0	112.2	N282 Y550 G551 N558	N282-K554 WeakPolarHBondContact O-CE 3.18Å; N282-K554 PolarHBondContact OD1-NZ 3.3Å; Y550-K554 PolarHBondContact O-N 3.42Å; G551-K554 PolarHBondContact O-N 3.09Å; K554-N558 WeakPolarHBondContact O-CB 3.32Å; K554-N558 VanDerWaalsContact O-CG 3.29Å; K554-N558 PolarHBondContact O-N 2.88Å
555	Q	49.5	Very low	44.3	Very low	122 Å²	122	90.3 Å²	90.3	57%	0.57	45%	0.449	S	S	*	.	H	α-helix	trans	-63.3	-45.2	174.3	-76	-178.9	-5.8	0	0	112.3	G551 R552 N558 T559	G551-Q555 WeakPolarHBondContact O-CB 3.32Å; G551-Q555 WeakPolarHBondContact O-CG 3.28Å; G551-Q555 PolarHBondContact O-N 3.27Å; R552-Q555 PolarHBondContact O-N 3.23Å; Q555-N558 PolarHBondContact O-N 3.07Å; Q555-T559 PolarHBondContact O-N 3.31Å; Q555-T559 PolarHBondContact O-OG1 2.85Å
556	K	47.4	Very low	43.9	Very low	121 Å²	121	92.8 Å²	92.8	53%	0.526	46%	0.46	S	S	.	.	H	α-helix	trans	-67.7	-37.8	-177.6	-156.9	174.6	-172.5	-176.3	0	112.1	R552 L553 T559 I560	R552-K556 VanDerWaalsContact O-CB 3.29Å; R552-K556 WeakPolarHBondContact O-CB 3.15Å; R552-K556 PolarHBondContact O-N 3.44Å; L553-K556 PolarHBondContact O-N 2.88Å; K556-T559 PolarHBondContact O-OG1 2.9Å; K556-T559 VanDerWaalsContact O-OG1 3.11Å; K556-I560 WeakPolarHBondContact O-CD1 3.29Å; K556-I560 VanDerWaalsContact O-CG1 3.23Å; K556-I560 WeakPolarHBondContact O-CG1 3.23Å; K556-I560 PolarHBondContact O-N 3.22Å; K556-I560 VanDerWaalsContact O-N 3.13Å
557	N	41.7	Very low	43.4	Very low	95 Å²	95	94.8 Å²	94.8	51%	0.508	47%	0.471	S	S	.	.	H	α-helix	trans	-65.7	-42.4	171.7	-73.7	-2.3	0	0	0	111.6	L553 T559 I560 W561	L553-N557 WeakPolarHBondContact O-CB 3.41Å; L553-N557 PolarHBondContact O-N 3.36Å; N557-T559 PolarHBondContact O-N 3.1Å; N557-I560 PolarHBondContact O-N 3.31Å; N557-W561 WeakPolarHBondContact O-CB 3.36Å; N557-W561 PolarHBondContact O-N 2.94Å
558	N	42.7	Very low	42.8	Very low	36 Å²	36	97.3 Å²	97.3	19%	0.193	49%	0.485	C	S	.	.	H	α-helix	trans	-68.3	-32.9	179.4	-74	-1.3	0	0	0	113.2	N283 K554 Q555 W561 N562	N283-N558 VanDerWaalsContact CG-ND2 3.34Å; N283-N558 PolarHBondContact ND2-ND2 3.21Å; N283-N558 PolarHBondContact OD1-ND2 3.38Å; K554-N558 WeakPolarHBondContact O-CB 3.32Å; K554-N558 VanDerWaalsContact O-CG 3.29Å; K554-N558 PolarHBondContact O-N 2.88Å; Q555-N558 PolarHBondContact O-N 3.07Å; N558-W561 PolarHBondContact O-N 3.15Å; N558-N562 WeakPolarHBondContact O-CB 3.24Å; N558-N562 VanDerWaalsContact O-CG 3.28Å; N558-N562 PolarHBondContact O-N 3.42Å; N558-N562 PolarHBondContact O-OD1 2.96Å
559	T	47.2	Very low	42.3	Very low	77 Å²	77	101.5 Å²	101.5	47%	0.472	50%	0.503	S	S	.	.	H	α-helix	trans	-72.2	-34.3	172	49.8	0	0	0	0	112.8	Q555 K556 N557 N563	Q555-T559 PolarHBondContact O-N 3.31Å; Q555-T559 PolarHBondContact O-OG1 2.85Å; K556-T559 PolarHBondContact O-OG1 2.9Å; K556-T559 VanDerWaalsContact O-OG1 3.11Å; N557-T559 PolarHBondContact O-N 3.1Å; T559-N563 VanDerWaalsContact O-CB 3.24Å; T559-N563 WeakPolarHBondContact O-CB 3.13Å; T559-N563 PolarHBondContact O-N 2.9Å; T559-N563 VanDerWaalsContact O-N 3.1Å; T559-N563 PolarHBondContact O-ND2 3.47Å
560	I	43	Very low	41.9	Very low	64 Å²	64	104.2 Å²	104.2	33%	0.328	52%	0.517	S	S	.	.	H	α-helix	trans	-63.7	-41.8	171	-68.9	164.6	0	0	0	110.8	K556 N557 S564	K556-I560 WeakPolarHBondContact O-CD1 3.29Å; K556-I560 VanDerWaalsContact O-CG1 3.23Å; K556-I560 WeakPolarHBondContact O-CG1 3.23Å; K556-I560 PolarHBondContact O-N 3.22Å; K556-I560 VanDerWaalsContact O-N 3.13Å; N557-I560 PolarHBondContact O-N 3.31Å; I560-S564 WeakPolarHBondContact O-CB 3.38Å; I560-S564 PolarHBondContact O-N 3.42Å; I560-S564 PolarHBondContact O-OG 3.29Å
561	W	38	Very low	41.5	Very low	170 Å²	170	104.3 Å²	104.3	64%	0.644	53%	0.527	S	S	*	.	H	α-helix	trans	-69.5	-45.2	-179.1	-134.6	71.5	0	0	0	112.8	N557 N558 S564 N565	N557-W561 WeakPolarHBondContact O-CB 3.36Å; N557-W561 PolarHBondContact O-N 2.94Å; N558-W561 PolarHBondContact O-N 3.15Å; W561-S564 PolarHBondContact O-N 3.23Å; W561-N565 PolarHBondContact O-N 2.87Å; W561-N565 PolarHBondContact O-ND2 3.47Å
562	N	38.5	Very low	41.1	Very low	75 Å²	75	111 Å²	111	40%	0.401	56%	0.561	S	S	.	*	H	α-helix	trans	-67.1	-46.8	178.9	-69.5	5.3	0	0	0	111.7	N558 S564 N565 D566	N558-N562 WeakPolarHBondContact O-CB 3.24Å; N558-N562 VanDerWaalsContact O-CG 3.28Å; N558-N562 PolarHBondContact O-N 3.42Å; N558-N562 PolarHBondContact O-OD1 2.96Å; N562-S564 PolarHBondContact O-N 2.99Å; N562-S564 VanDerWaalsContact O-N 3.08Å; N562-N565 PolarHBondContact O-N 3.38Å; N562-D566 PolarHBondContact O-N 3.12Å
563	N	39.1	Very low	40.2	Very low	96 Å²	96	106.6 Å²	106.6	51%	0.513	57%	0.568	S	S	.	*	H	α-helix	trans	-63.5	-18.7	179.2	-68.4	-8.3	0	0	0	113.5	T559 N567	T559-N563 VanDerWaalsContact O-CB 3.24Å; T559-N563 WeakPolarHBondContact O-CB 3.13Å; T559-N563 PolarHBondContact O-N 2.9Å; T559-N563 VanDerWaalsContact O-N 3.1Å; T559-N563 PolarHBondContact O-ND2 3.47Å; N563-N567 PolarHBondContact O-ND2 3.02Å
564	S	38.4	Very low	39.6	Very low	57 Å²	57	112.4 Å²	112.4	40%	0.399	59%	0.585	S	S	.	*	H	α-helix	trans	-86.4	-21.6	173.9	-56.9	0	0	0	0	113.5	I560 W561 N562	I560-S564 WeakPolarHBondContact O-CB 3.38Å; I560-S564 PolarHBondContact O-N 3.42Å; I560-S564 PolarHBondContact O-OG 3.29Å; W561-S564 PolarHBondContact O-N 3.23Å; N562-S564 PolarHBondContact O-N 2.99Å; N562-S564 VanDerWaalsContact O-N 3.08Å
565	N	38.7	Very low	38.9	Very low	86 Å²	86	115.1 Å²	115.1	46%	0.46	60%	0.598	S	S	.	*	H	α-helix	trans	-93.7	-34.7	179.8	-76.8	-34	0	0	0	112.9	W561 N562 N567 N568	W561-N565 PolarHBondContact O-N 2.87Å; W561-N565 PolarHBondContact O-ND2 3.47Å; N562-N565 PolarHBondContact O-N 3.38Å; N565-N567 PolarHBondContact O-N 2.94Å; N565-N567 VanDerWaalsContact O-N 3.13Å; N565-N568 PolarHBondContact O-N 3.28Å
566	D	38	Very low	38.1	Very low	133 Å²	133	119.7 Å²	119.7	71%	0.711	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-1.2	-177.6	-69.8	-34.9	0	0	0	114.6	N562	N562-D566 PolarHBondContact O-N 3.12Å
567	N	36.9	Very low	38	Very low	131 Å²	131	119.4 Å²	119.4	70%	0.701	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107	2.1	179.2	-77.9	-65.5	0	0	0	114.8	N563 N565 N569	N563-N567 PolarHBondContact O-ND2 3.02Å; N565-N567 PolarHBondContact O-N 2.94Å; N565-N567 VanDerWaalsContact O-N 3.13Å; N567-N569 PolarHBondContact O-N 3.39Å
568	N	34.5	Very low	38	Very low	131 Å²	131	118.9 Å²	118.9	70%	0.701	62%	0.615	S	S	*	*			trans	-93.1	58.7	-179.3	-89.7	-41.5	0	0	0	113.5	N565	N565-N568 PolarHBondContact O-N 3.28Å
569	N	36.6	Very low	37.6	Very low	148 Å²	148	122.2 Å²	122.2	79%	0.791	63%	0.626	S	S	*	*	S	Bend	trans	-154.7	128.9	156.5	-97.4	-51.2	0	0	0	110.4	N567	N567-N569 PolarHBondContact O-N 3.39Å
570	N	36.1	Very low	37.5	Very low	143 Å²	143	123.6 Å²	123.6	77%	0.765	63%	0.626	S	S	*	*	S	Bend	trans	72.7	91.2	178.4	-55.4	-38.6	0	0	0	118.4
571	N	35.3	Very low	37.6	Very low	143 Å²	143	123.9 Å²	123.9	77%	0.765	63%	0.634	S	S	*	*			trans	72.6	139.7	139.4	-60.4	-22	0	0	0	122
572	N	34	Very low	37.8	Very low	150 Å²	150	123.4 Å²	123.4	80%	0.802	63%	0.632	S	S	*	*			trans	68.9	87.8	158	-57.4	-14.9	0	0	0	117.6	Y574	N572-Y574 PolarHBondContact O-N 2.86Å
573	G	29.7	Very low	37.9	Very low	77 Å²	77	123.2 Å²	123.2	79%	0.794	63%	0.631	S	S	*	*			trans	-77.3	111.4	175.2	0	0	0	0	0	114.4
574	Y	32.6	Very low	38.6	Very low	224 Å²	224	124.1 Å²	124.1	88%	0.878	63%	0.63	S	S	*	*			trans	-144.2	54.9	166	-88.3	-73.9	0	0	0	111.6	N572	N572-Y574 PolarHBondContact O-N 2.86Å
575	H	38.3	Very low	39	Very low	139 Å²	139	125.2 Å²	125.2	64%	0.644	64%	0.635	S	S	*	*			trans	-147.8	-5	178.2	-114.8	-59.6	0	0	0	118.6	T577 E578	H575-T577 PolarHBondContact O-N 2.81Å; H575-E578 IonicContact CE1-OE2 2.84Å; H575-E578 PolarHBondContact CE1-OE2 3.32Å; H575-E578 IonicContact ND1-OE2 3.36Å
576	Y	33.7	Very low	39.3	Very low	218 Å²	218	124.1 Å²	124.1	86%	0.855	63%	0.631	S	S	*	*	H	α-helix	trans	-67	-28.8	-171.2	-114.7	-90.9	0	0	0	115	E580	Y576-E580 PolarHBondContact O-N 3.48Å
577	T	44.3	Very low	39.5	Very low	115 Å²	115	121.7 Å²	121.7	71%	0.706	62%	0.615	S	S	*	*	H	α-helix	trans	-76	-33.3	-174.1	47	0	0	0	0	114	H575 S581	H575-T577 PolarHBondContact O-N 2.81Å; T577-S581 PolarHBondContact O-N 3.28Å; T577-S581 PolarHBondContact O-OG 3.49Å
578	E	41.6	Very low	39.9	Very low	83 Å²	83	120.5 Å²	120.5	39%	0.388	61%	0.613	S	S	.	*	H	α-helix	trans	-71	-36.1	175.6	-164.3	-167.4	161.1	0	0	111	H575 S581 R582	H575-E578 IonicContact CE1-OE2 2.84Å; H575-E578 PolarHBondContact CE1-OE2 3.32Å; H575-E578 IonicContact ND1-OE2 3.36Å; E578-S581 PolarHBondContact O-N 3.44Å; E578-R582 WeakPolarHBondContact O-CG 3.3Å; E578-R582 PolarHBondContact O-N 3.35Å; E578-R582 IonicContact OE1-CZ 2.71Å; E578-R582 VanDerWaalsContact OE1-CZ 3.3Å; E578-R582 IonicContact OE1-NE 3.77Å; E578-R582 PolarHBondContact OE1-NE 2.8Å; E578-R582 IonicContact OE1-NH2 2.74Å; E578-R582 PolarHBondContact OE1-NH2 2.95Å
579	Y	35.8	Very low	40.3	Very low	107 Å²	107	122 Å²	122	42%	0.42	62%	0.615	S	S	.	*	H	α-helix	trans	-63.1	-44.2	179.2	-143.1	-86.8	0	0	0	111.7	S581 R582 L583	Y579-S581 VanDerWaalsContact C-N 3.33Å; Y579-S581 PolarHBondContact O-N 2.8Å; Y579-R582 PolarHBondContact O-N 3.23Å; Y579-L583 HydrophobicContact CD1-CD1 3.97Å; Y579-L583 HydrophobicContact CD1-CG 4.44Å; Y579-L583 HydrophobicContact CE1-CD1 4.37Å; Y579-L583 WeakPolarHBondContact O-CG 3.41Å; Y579-L583 PolarHBondContact O-N 2.96Å
580	E	43.5	Very low	40.5	Very low	105 Å²	105	119.8 Å²	119.8	49%	0.491	60%	0.603	S	S	.	*	H	α-helix	trans	-64.6	-37.7	176.6	-142.9	-138.3	171.1	0	0	112.2	Y576 L583 K584	Y576-E580 PolarHBondContact O-N 3.48Å; E580-L583 PolarHBondContact O-N 2.9Å; E580-K584 VanDerWaalsContact CD-CE 3.49Å; E580-K584 WeakPolarHBondContact O-CG 3.47Å; E580-K584 PolarHBondContact O-N 3.19Å; E580-K584 VanDerWaalsContact O-N 3.14Å; E580-K584 WeakPolarHBondContact OE1-CE 3.33Å; E580-K584 IonicContact OE1-NZ 3.29Å; E580-K584 PolarHBondContact OE1-NZ 3.26Å; E580-K584 IonicContact OE2-NZ 3.16Å; E580-K584 PolarHBondContact OE2-NZ 3.14Å
581	S	45.4	Very low	40.7	Very low	70 Å²	70	120.7 Å²	120.7	49%	0.49	61%	0.608	S	S	.	*	H	α-helix	trans	-66.1	-40.6	176.9	-56.4	0	0	0	0	112.2	T577 E578 Y579 T585	T577-S581 PolarHBondContact O-N 3.28Å; T577-S581 PolarHBondContact O-OG 3.49Å; E578-S581 PolarHBondContact O-N 3.44Å; Y579-S581 VanDerWaalsContact C-N 3.33Å; Y579-S581 PolarHBondContact O-N 2.8Å; S581-T585 PolarHBondContact O-N 3.49Å; S581-T585 PolarHBondContact O-OG1 2.84Å
582	R	42.1	Very low	41.1	Very low	161 Å²	161	117.9 Å²	117.9	61%	0.608	59%	0.592	S	S	*	*	H	α-helix	trans	-68.5	-38.2	175.6	-74.9	177.5	174	-144.9	-0.7	112.6	E578 Y579 T585 T586	E578-R582 WeakPolarHBondContact O-CG 3.3Å; E578-R582 PolarHBondContact O-N 3.35Å; E578-R582 IonicContact OE1-CZ 2.71Å; E578-R582 VanDerWaalsContact OE1-CZ 3.3Å; E578-R582 IonicContact OE1-NE 3.77Å; E578-R582 PolarHBondContact OE1-NE 2.8Å; E578-R582 IonicContact OE1-NH2 2.74Å; E578-R582 PolarHBondContact OE1-NH2 2.95Å; Y579-R582 PolarHBondContact O-N 3.23Å; R582-T585 PolarHBondContact O-N 2.84Å; R582-T585 PolarHBondContact O-OG1 3.36Å; R582-T585 VanDerWaalsContact O-OG1 3.07Å; R582-T586 WeakPolarHBondContact O-CG2 3.24Å; R582-T586 PolarHBondContact O-N 2.9Å; R582-T586 VanDerWaalsContact O-N 3.11Å; R582-T586 PolarHBondContact O-OG1 3.34Å
583	L	41.7	Very low	41.4	Very low	71 Å²	71	113 Å²	113	37%	0.372	57%	0.57	S	S	.	*	H	α-helix	trans	-61.5	-46.6	175	-77.7	166.9	0	0	0	111.1	Y579 E580 T585 T586 H587	Y579-L583 HydrophobicContact CD1-CD1 3.97Å; Y579-L583 HydrophobicContact CD1-CG 4.44Å; Y579-L583 HydrophobicContact CE1-CD1 4.37Å; Y579-L583 WeakPolarHBondContact O-CG 3.41Å; Y579-L583 PolarHBondContact O-N 2.96Å; E580-L583 PolarHBondContact O-N 2.9Å; L583-T585 PolarHBondContact O-N 3.23Å; L583-T586 PolarHBondContact O-N 3.35Å; L583-T586 VanDerWaalsContact O-N 3.07Å; L583-T586 PolarHBondContact O-OG1 3.44Å; L583-H587 PolarHBondContact O-N 3.46Å; L583-H587 VanDerWaalsContact O-N 3.08Å
584	K	52.6	Low	42.3	Very low	114 Å²	114	114.6 Å²	114.6	50%	0.496	57%	0.565	S	S	.	*	H	α-helix	trans	-59	-43.1	179	-72.9	167.4	-176.9	171.4	0	112.7	E580 T586 H587 T588	E580-K584 VanDerWaalsContact CD-CE 3.49Å; E580-K584 WeakPolarHBondContact O-CG 3.47Å; E580-K584 PolarHBondContact O-N 3.19Å; E580-K584 VanDerWaalsContact O-N 3.14Å; E580-K584 WeakPolarHBondContact OE1-CE 3.33Å; E580-K584 IonicContact OE1-NZ 3.29Å; E580-K584 PolarHBondContact OE1-NZ 3.26Å; E580-K584 IonicContact OE2-NZ 3.16Å; E580-K584 PolarHBondContact OE2-NZ 3.14Å; K584-T586 PolarHBondContact O-N 2.9Å; K584-H587 PolarHBondContact O-N 2.91Å; K584-T588 PolarHBondContact O-N 3.27Å
585	T	48.6	Very low	43	Very low	81 Å²	81	106.9 Å²	106.9	50%	0.497	54%	0.538	S	S	.	.	H	α-helix	trans	-68.6	-29.2	174.2	41.3	0	0	0	0	113.7	S581 R582 L583 T588 H589	S581-T585 PolarHBondContact O-N 3.49Å; S581-T585 PolarHBondContact O-OG1 2.84Å; R582-T585 PolarHBondContact O-N 2.84Å; R582-T585 PolarHBondContact O-OG1 3.36Å; R582-T585 VanDerWaalsContact O-OG1 3.07Å; L583-T585 PolarHBondContact O-N 3.23Å; T585-T588 PolarHBondContact O-OG1 3Å; T585-H589 PolarHBondContact O-CD2 3.01Å
586	T	43.6	Very low	43.7	Very low	63 Å²	63	107.5 Å²	107.5	39%	0.387	54%	0.542	S	S	.	.	H	α-helix	trans	-75.9	-20.4	173.5	58.6	0	0	0	0	114.6	R582 L583 K584	R582-T586 WeakPolarHBondContact O-CG2 3.24Å; R582-T586 PolarHBondContact O-N 2.9Å; R582-T586 VanDerWaalsContact O-N 3.11Å; R582-T586 PolarHBondContact O-OG1 3.34Å; L583-T586 PolarHBondContact O-N 3.35Å; L583-T586 VanDerWaalsContact O-N 3.07Å; L583-T586 PolarHBondContact O-OG1 3.44Å; K584-T586 PolarHBondContact O-N 2.9Å
587	H	41.8	Very low	44.8	Very low	81 Å²	81	102.6 Å²	102.6	38%	0.375	53%	0.53	S	S	.	.	H	α-helix	trans	-78.7	-43.2	173	-82.3	-17.3	0	0	0	112.7	L583 K584 H589 L590 T594	L583-H587 PolarHBondContact O-N 3.46Å; L583-H587 VanDerWaalsContact O-N 3.08Å; K584-H587 PolarHBondContact O-N 2.91Å; H587-H589 VanDerWaalsContact C-N 3.27Å; H587-H589 PolarHBondContact O-N 2.6Å; H587-L590 PolarHBondContact O-N 3.5Å; H587-T594 VanDerWaalsContact CD2-CG2 3.41Å; H587-T594 WeakPolarHBondContact CD2-CG2 3.26Å
588	T	46	Very low	45.6	Very low	106 Å²	106	99.3 Å²	99.3	65%	0.65	51%	0.51	S	S	*	.	H	α-helix	trans	-62.7	-33.3	178.9	52.8	0	0	0	0	112.8	K584 T585 L590	K584-T588 PolarHBondContact O-N 3.27Å; T585-T588 PolarHBondContact O-OG1 3Å; T588-L590 VanDerWaalsContact C-N 3.27Å; T588-L590 PolarHBondContact O-N 3.19Å
589	H	42.6	Very low	46.2	Very low	163 Å²	163	98.5 Å²	98.5	76%	0.755	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-2.5	178.4	-91.2	-74	0	0	0	115.7	T585 H587	T585-H589 PolarHBondContact O-CD2 3.01Å; H587-H589 VanDerWaalsContact C-N 3.27Å; H587-H589 PolarHBondContact O-N 2.6Å
590	L	41.6	Very low	47.6	Very low	101 Å²	101	98 Å²	98	53%	0.529	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.1	3.1	-172.2	-69.5	175.6	0	0	0	115.2	H587 T588 L592	H587-L590 PolarHBondContact O-N 3.5Å; T588-L590 VanDerWaalsContact C-N 3.27Å; T588-L590 PolarHBondContact O-N 3.19Å; L590-L592 HydrophobicContact CB-CD1 3.76Å; L590-L592 HydrophobicContact CB-CG 3.84Å; L590-L592 HydrophobicContact CD1-CD1 3.87Å; L590-L592 HydrophobicContact CG-CD1 4.48Å; L590-L592 PolarHBondContact O-N 3.05Å; L590-L592 VanDerWaalsContact O-N 3.08Å
591	N	39.7	Very low	48.7	Very low	162 Å²	162	98.7 Å²	98.7	87%	0.866	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	29.8	-174	-79.7	-13.3	0	0	0	114	S593	N591-S593 PolarHBondContact O-N 2.82Å
592	L	43.4	Very low	49.5	Very low	84 Å²	84	100 Å²	100	44%	0.44	51%	0.51	S	S	.	.			trans	-82.8	111	178.7	-71.5	169.7	0	0	0	109.7	L590 T594	L590-L592 HydrophobicContact CB-CD1 3.76Å; L590-L592 HydrophobicContact CB-CG 3.84Å; L590-L592 HydrophobicContact CD1-CD1 3.87Å; L590-L592 HydrophobicContact CG-CD1 4.48Å; L590-L592 PolarHBondContact O-N 3.05Å; L590-L592 VanDerWaalsContact O-N 3.08Å; L592-T594 PolarHBondContact O-N 2.93Å
593	S	40.3	Very low	50.5	Low	49 Å²	49	98 Å²	98	34%	0.343	51%	0.508	S	S	.	.			trans	-63.3	130.4	171.1	-176.2	0	0	0	0	110.3	N591 D595 T598	N591-S593 PolarHBondContact O-N 2.82Å; S593-D595 VanDerWaalsContact C-N 3.29Å; S593-D595 PolarHBondContact OG-N 3.15Å; S593-T598 PolarHBondContact OG-OG1 3.13Å
594	T	48.5	Very low	51.8	Low	109 Å²	109	97.9 Å²	97.9	67%	0.669	51%	0.507	S	S	*	.			trans	-81.5	-6.7	173.7	47.8	0	0	0	0	113.2	H587 L592 H596	H587-T594 VanDerWaalsContact CD2-CG2 3.41Å; H587-T594 WeakPolarHBondContact CD2-CG2 3.26Å; L592-T594 PolarHBondContact O-N 2.93Å; T594-H596 PolarHBondContact O-N 3.41Å
595	D	48.7	Very low	52.2	Low	62 Å²	62	95.5 Å²	95.5	33%	0.332	50%	0.503	S	S	.	.			trans	-71.6	121.5	177	163	44.6	0	0	0	111	S593 N597 T598 I599	S593-D595 VanDerWaalsContact C-N 3.29Å; S593-D595 PolarHBondContact OG-N 3.15Å; D595-N597 PolarHBondContact O-N 3.44Å; D595-N597 WeakPolarHBondContact OD1-CB 3.49Å; D595-N597 PolarHBondContact OD1-N 3.23Å; D595-N597 PolarHBondContact OD1-ND2 3.34Å; D595-N597 WeakPolarHBondContact OD2-CB 3.35Å; D595-T598 WeakPolarHBondContact O-CB 3.49Å; D595-T598 PolarHBondContact O-N 3.21Å; D595-T598 VanDerWaalsContact O-N 3.1Å; D595-T598 WeakPolarHBondContact OD2-CB 3.23Å; D595-T598 PolarHBondContact OD2-N 2.93Å; D595-T598 PolarHBondContact OD2-OG1 3.46Å; D595-I599 PolarHBondContact O-N 3.31Å
596	H	52.4	Low	52.4	Low	153 Å²	153	95.9 Å²	95.9	71%	0.708	50%	0.5	S	S	*	.	H	α-helix	trans	-63.1	-24.9	-179.2	-155.9	-47.2	0	0	0	112.4	T594 H600	T594-H596 PolarHBondContact O-N 3.41Å; H596-H600 VanDerWaalsContact O-CB 3.31Å; H596-H600 WeakPolarHBondContact O-CB 3.34Å; H596-H600 PolarHBondContact O-N 3.06Å
597	N	57.2	Low	53.4	Low	114 Å²	114	98.1 Å²	98.1	61%	0.61	50%	0.504	S	S	*	.	H	α-helix	trans	-75	-41.4	173.4	-56.2	-75.3	0	0	0	111.6	D595 H600 Q601	D595-N597 PolarHBondContact O-N 3.44Å; D595-N597 WeakPolarHBondContact OD1-CB 3.49Å; D595-N597 PolarHBondContact OD1-N 3.23Å; D595-N597 PolarHBondContact OD1-ND2 3.34Å; D595-N597 WeakPolarHBondContact OD2-CB 3.35Å; N597-H600 PolarHBondContact O-N 3.2Å; N597-Q601 WeakPolarHBondContact O-CB 3.32Å; N597-Q601 WeakPolarHBondContact O-CG 3.47Å; N597-Q601 PolarHBondContact O-N 2.92Å
598	T	60.4	Low	54.4	Low	46 Å²	46	99.5 Å²	99.5	28%	0.282	51%	0.511	S	S	.	.	H	α-helix	trans	-60.6	-45	173.7	-58.7	0	0	0	0	110.9	S593 D595 H600 Q601 Q602	S593-T598 PolarHBondContact OG-OG1 3.13Å; D595-T598 WeakPolarHBondContact O-CB 3.49Å; D595-T598 PolarHBondContact O-N 3.21Å; D595-T598 VanDerWaalsContact O-N 3.1Å; D595-T598 WeakPolarHBondContact OD2-CB 3.23Å; D595-T598 PolarHBondContact OD2-N 2.93Å; D595-T598 PolarHBondContact OD2-OG1 3.46Å; T598-H600 PolarHBondContact O-N 3.37Å; T598-Q601 PolarHBondContact O-N 3.45Å; T598-Q602 WeakPolarHBondContact O-CG 3.46Å; T598-Q602 PolarHBondContact O-N 2.98Å
599	I	53.3	Low	54.7	Low	66 Å²	66	98.5 Å²	98.5	34%	0.338	50%	0.501	S	S	.	.	H	α-helix	trans	-62.9	-42.2	175.2	-64.5	171.8	0	0	0	110.7	D595 Q602 Q603	D595-I599 PolarHBondContact O-N 3.31Å; I599-Q602 PolarHBondContact O-N 2.88Å; I599-Q603 WeakPolarHBondContact O-CG 3.27Å; I599-Q603 PolarHBondContact O-N 3.41Å
600	H	66.5	Low	55.3	Low	96 Å²	96	96.6 Å²	96.6	44%	0.444	49%	0.493	S	S	.	.	H	α-helix	trans	-64.3	-41.4	176.5	-173.9	15.4	0	0	0	112.3	H596 N597 T598 Q603 L604	H596-H600 VanDerWaalsContact O-CB 3.31Å; H596-H600 WeakPolarHBondContact O-CB 3.34Å; H596-H600 PolarHBondContact O-N 3.06Å; N597-H600 PolarHBondContact O-N 3.2Å; T598-H600 PolarHBondContact O-N 3.37Å; H600-Q603 PolarHBondContact O-N 2.92Å; H600-L604 WeakPolarHBondContact O-CG 3.46Å; H600-L604 PolarHBondContact O-N 3.36Å
601	Q	67.1	Low	56.1	Low	120 Å²	120	96.1 Å²	96.1	56%	0.561	49%	0.488	S	S	*	.	H	α-helix	trans	-62.7	-41.5	174.5	-83.6	-75.1	24.4	0	0	112.5	N597 T598 Q603 L604 T605	N597-Q601 WeakPolarHBondContact O-CB 3.32Å; N597-Q601 WeakPolarHBondContact O-CG 3.47Å; N597-Q601 PolarHBondContact O-N 2.92Å; T598-Q601 PolarHBondContact O-N 3.45Å; Q601-Q603 VanDerWaalsContact C-N 3.35Å; Q601-L604 PolarHBondContact O-N 3.1Å; Q601-T605 PolarHBondContact O-N 3.24Å; Q601-T605 PolarHBondContact O-OG1 2.8Å
602	Q	60.5	Low	56.8	Low	98 Å²	98	93.8 Å²	93.8	46%	0.458	47%	0.473	S	S	.	.	H	α-helix	trans	-63.2	-40.6	174.2	-73.6	177.1	-0.4	0	0	111.6	T598 I599 T605 M606	T598-Q602 WeakPolarHBondContact O-CG 3.46Å; T598-Q602 PolarHBondContact O-N 2.98Å; I599-Q602 PolarHBondContact O-N 2.88Å; Q602-T605 WeakPolarHBondContact CA-OG1 3.43Å; Q602-T605 PolarHBondContact O-N 3.44Å; Q602-T605 PolarHBondContact O-OG1 3.39Å; Q602-M606 WeakPolarHBondContact O-CB 3.33Å; Q602-M606 VanDerWaalsContact O-CG 3.31Å; Q602-M606 WeakPolarHBondContact O-CG 3.31Å; Q602-M606 PolarHBondContact O-N 3.13Å
603	Q	63.2	Low	57.2	Low	119 Å²	119	94.4 Å²	94.4	56%	0.556	48%	0.476	S	S	*	.	H	α-helix	trans	-65	-37.9	173.6	-70	172	8.9	0	0	112.4	I599 H600 Q601 K607	I599-Q603 WeakPolarHBondContact O-CG 3.27Å; I599-Q603 PolarHBondContact O-N 3.41Å; H600-Q603 PolarHBondContact O-N 2.92Å; Q601-Q603 VanDerWaalsContact C-N 3.35Å; Q603-K607 WeakPolarHBondContact O-CB 3.43Å; Q603-K607 PolarHBondContact O-N 2.76Å
604	L	68.9	Low	57.7	Low	69 Å²	69	95.8 Å²	95.8	36%	0.361	48%	0.482	S	S	.	.	H	α-helix	trans	-66	-45.2	175.4	-74.7	166	0	0	0	111.9	H600 Q601 K607 Q608	H600-L604 WeakPolarHBondContact O-CG 3.46Å; H600-L604 PolarHBondContact O-N 3.36Å; Q601-L604 PolarHBondContact O-N 3.1Å; L604-K607 PolarHBondContact O-N 3.34Å; L604-Q608 WeakPolarHBondContact O-CB 3.31Å; L604-Q608 VanDerWaalsContact O-CG 3.31Å; L604-Q608 WeakPolarHBondContact O-CG 3.45Å; L604-Q608 PolarHBondContact O-N 3.38Å
605	T	62	Low	57.7	Low	64 Å²	64	95 Å²	95	39%	0.393	47%	0.474	S	S	.	.	H	α-helix	trans	-67.4	-37.9	176.2	28.3	0	0	0	0	112.3	Q601 Q602 Q608 N609	Q601-T605 PolarHBondContact O-N 3.24Å; Q601-T605 PolarHBondContact O-OG1 2.8Å; Q602-T605 WeakPolarHBondContact CA-OG1 3.43Å; Q602-T605 PolarHBondContact O-N 3.44Å; Q602-T605 PolarHBondContact O-OG1 3.39Å; T605-Q608 PolarHBondContact O-N 2.84Å; T605-N609 WeakPolarHBondContact O-CB 3.44Å; T605-N609 PolarHBondContact O-N 3.42Å; T605-N609 PolarHBondContact O-ND2 3.07Å
606	M	52.6	Low	57.8	Low	89 Å²	89	95.2 Å²	95.2	44%	0.438	48%	0.477	S	S	.	.	H	α-helix	trans	-58.9	-46.9	170.7	-76.7	-178	67.8	0	0	111.6	Q602 N609 E610	Q602-M606 WeakPolarHBondContact O-CB 3.33Å; Q602-M606 VanDerWaalsContact O-CG 3.31Å; Q602-M606 WeakPolarHBondContact O-CG 3.31Å; Q602-M606 PolarHBondContact O-N 3.13Å; M606-N609 PolarHBondContact O-N 2.92Å; M606-E610 PolarHBondContact O-N 3.37Å
607	K	63.7	Low	57.5	Low	109 Å²	109	90.8 Å²	90.8	47%	0.474	46%	0.461	S	S	.	.	H	α-helix	trans	-65.3	-39.2	178.9	-173.7	174	178.5	-68.5	0	112.7	Q603 L604 N609 E610 E611	Q603-K607 WeakPolarHBondContact O-CB 3.43Å; Q603-K607 PolarHBondContact O-N 2.76Å; L604-K607 PolarHBondContact O-N 3.34Å; K607-N609 VanDerWaalsContact C-N 3.34Å; K607-E610 PolarHBondContact O-N 2.78Å; K607-E611 IonicContact NZ-OE1 3.83Å; K607-E611 PolarHBondContact NZ-OE1 3.35Å; K607-E611 WeakPolarHBondContact O-CG 3.28Å; K607-E611 PolarHBondContact O-N 3.15Å
608	Q	62.9	Low	57	Low	111 Å²	111	88.7 Å²	88.7	52%	0.519	45%	0.45	S	S	.	.	H	α-helix	trans	-62.8	-39.7	172.9	-75.2	171.3	-22.5	0	0	111.8	L604 T605 E611 M612	L604-Q608 WeakPolarHBondContact O-CB 3.31Å; L604-Q608 VanDerWaalsContact O-CG 3.31Å; L604-Q608 WeakPolarHBondContact O-CG 3.45Å; L604-Q608 PolarHBondContact O-N 3.38Å; T605-Q608 PolarHBondContact O-N 2.84Å; Q608-E611 PolarHBondContact O-N 3.45Å; Q608-M612 VanDerWaalsContact O-CB 3.32Å; Q608-M612 WeakPolarHBondContact O-CB 3.22Å; Q608-M612 PolarHBondContact O-N 3.32Å
609	N	52.5	Low	56.2	Low	85 Å²	85	91.3 Å²	91.3	46%	0.455	46%	0.462	S	S	.	.	H	α-helix	trans	-68.5	-39.9	175.7	-70.1	-19.7	0	0	0	112.1	T605 M606 K607 M612 I613	T605-N609 WeakPolarHBondContact O-CB 3.44Å; T605-N609 PolarHBondContact O-N 3.42Å; T605-N609 PolarHBondContact O-ND2 3.07Å; M606-N609 PolarHBondContact O-N 2.92Å; K607-N609 VanDerWaalsContact C-N 3.34Å; N609-M612 PolarHBondContact O-N 3.19Å; N609-I613 WeakPolarHBondContact O-CB 3.19Å; N609-I613 WeakPolarHBondContact O-CD1 3.29Å; N609-I613 VanDerWaalsContact O-CG1 3.23Å; N609-I613 WeakPolarHBondContact O-CG1 3.28Å; N609-I613 PolarHBondContact O-N 3.46Å
610	E	56.5	Low	55.8	Low	122 Å²	122	90.4 Å²	90.4	57%	0.57	46%	0.456	S	S	*	.	H	α-helix	trans	-60.2	-47.3	172.1	-73.9	-175.6	154.1	0	0	111.5	M606 K607 M612 I613 V614	M606-E610 PolarHBondContact O-N 3.37Å; K607-E610 PolarHBondContact O-N 2.78Å; E610-M612 VanDerWaalsContact C-N 3.35Å; E610-M612 PolarHBondContact O-N 3.35Å; E610-I613 PolarHBondContact O-N 2.86Å; E610-V614 WeakPolarHBondContact O-CB 3.4Å; E610-V614 VanDerWaalsContact O-CG2 3.31Å; E610-V614 WeakPolarHBondContact O-CG2 3.32Å; E610-V614 PolarHBondContact O-N 3.34Å
611	E	58.5	Low	54.7	Low	92 Å²	92	91.3 Å²	91.3	43%	0.43	46%	0.46	S	S	.	.	H	α-helix	trans	-62.8	-39.4	176.8	-74.4	172.1	-174.5	0	0	112	K607 Q608 N615	K607-E611 IonicContact NZ-OE1 3.83Å; K607-E611 PolarHBondContact NZ-OE1 3.35Å; K607-E611 WeakPolarHBondContact O-CG 3.28Å; K607-E611 PolarHBondContact O-N 3.15Å; Q608-E611 PolarHBondContact O-N 3.45Å; E611-N615 VanDerWaalsContact O-CB 3.28Å; E611-N615 WeakPolarHBondContact O-CB 3.32Å; E611-N615 PolarHBondContact O-N 3.41Å; E611-N615 PolarHBondContact O-ND2 3.47Å; E611-N615 VanDerWaalsContact O-ND2 3.13Å
612	M	54.5	Low	53.3	Low	113 Å²	113	90.1 Å²	90.1	56%	0.557	46%	0.457	S	S	*	.	H	α-helix	trans	-65.5	-42.8	176.1	-164.4	-168.6	-47.1	0	0	112.3	Q608 N609 E610 N615 T616	Q608-M612 VanDerWaalsContact O-CB 3.32Å; Q608-M612 WeakPolarHBondContact O-CB 3.22Å; Q608-M612 PolarHBondContact O-N 3.32Å; N609-M612 PolarHBondContact O-N 3.19Å; E610-M612 VanDerWaalsContact C-N 3.35Å; E610-M612 PolarHBondContact O-N 3.35Å; M612-N615 PolarHBondContact O-N 2.84Å; M612-T616 WeakPolarHBondContact O-CB 3.32Å; M612-T616 PolarHBondContact O-N 3.07Å; M612-T616 PolarHBondContact O-OG1 3Å
613	I	51.7	Low	52.4	Low	96 Å²	96	89.3 Å²	89.3	49%	0.492	46%	0.459	S	S	.	.	H	α-helix	trans	-65.4	-46.8	176.9	-69.7	164.5	0	0	0	110.5	N609 E610 N615 T616 V617	N609-I613 WeakPolarHBondContact O-CB 3.19Å; N609-I613 WeakPolarHBondContact O-CD1 3.29Å; N609-I613 VanDerWaalsContact O-CG1 3.23Å; N609-I613 WeakPolarHBondContact O-CG1 3.28Å; N609-I613 PolarHBondContact O-N 3.46Å; E610-I613 PolarHBondContact O-N 2.86Å; I613-N615 VanDerWaalsContact C-N 3.34Å; I613-N615 PolarHBondContact O-N 3.08Å; I613-T616 PolarHBondContact O-N 2.85Å; I613-V617 HydrophobicContact CG2-CG2 4.42Å; I613-V617 WeakPolarHBondContact O-CG2 3.33Å; I613-V617 PolarHBondContact O-N 3.08Å
614	V	49.5	Very low	51	Low	78 Å²	78	90.1 Å²	90.1	47%	0.473	46%	0.458	S	S	.	.	H	α-helix	trans	-61.1	-42.6	177.2	169.5	0	0	0	0	111.2	E610 N618	E610-V614 WeakPolarHBondContact O-CB 3.4Å; E610-V614 VanDerWaalsContact O-CG2 3.31Å; E610-V614 WeakPolarHBondContact O-CG2 3.32Å; E610-V614 PolarHBondContact O-N 3.34Å; V614-N618 WeakPolarHBondContact CG1-ND2 3.24Å; V614-N618 VanDerWaalsContact O-CB 3.27Å; V614-N618 WeakPolarHBondContact O-CB 3.37Å; V614-N618 PolarHBondContact O-N 2.81Å; V614-N618 PolarHBondContact O-ND2 3.06Å
615	N	48.6	Very low	49.5	Very low	93 Å²	93	91.1 Å²	91.1	50%	0.497	46%	0.464	S	S	.	.	H	α-helix	trans	-66.1	-37.3	176.4	-72.6	-25	0	0	0	112.4	E611 M612 I613 N619	E611-N615 VanDerWaalsContact O-CB 3.28Å; E611-N615 WeakPolarHBondContact O-CB 3.32Å; E611-N615 PolarHBondContact O-N 3.41Å; E611-N615 PolarHBondContact O-ND2 3.47Å; E611-N615 VanDerWaalsContact O-ND2 3.13Å; M612-N615 PolarHBondContact O-N 2.84Å; I613-N615 VanDerWaalsContact C-N 3.34Å; I613-N615 PolarHBondContact O-N 3.08Å; N615-N619 VanDerWaalsContact O-CB 3.29Å; N615-N619 WeakPolarHBondContact O-CB 3.38Å; N615-N619 PolarHBondContact O-N 2.96Å; N615-N619 PolarHBondContact O-ND2 2.85Å
616	T	50.9	Low	48.2	Very low	66 Å²	66	94.1 Å²	94.1	41%	0.405	48%	0.477	S	S	.	.	H	α-helix	trans	-65.1	-51.6	175.8	-57.2	0	0	0	0	110.6	M612 I613 N618 N619 E620	M612-T616 WeakPolarHBondContact O-CB 3.32Å; M612-T616 PolarHBondContact O-N 3.07Å; M612-T616 PolarHBondContact O-OG1 3Å; I613-T616 PolarHBondContact O-N 2.85Å; T616-N618 PolarHBondContact O-N 2.93Å; T616-N619 PolarHBondContact O-N 3.08Å; T616-E620 WeakPolarHBondContact O-CG 3.21Å; T616-E620 PolarHBondContact O-N 3.07Å
617	V	46.9	Very low	47.5	Very low	60 Å²	60	96.5 Å²	96.5	36%	0.364	49%	0.487	S	S	.	.	H	α-helix	trans	-60.9	-43.2	179.4	171.6	0	0	0	0	111.5	I613 E620 H621	I613-V617 HydrophobicContact CG2-CG2 4.42Å; I613-V617 WeakPolarHBondContact O-CG2 3.33Å; I613-V617 PolarHBondContact O-N 3.08Å; V617-E620 PolarHBondContact O-N 3.39Å; V617-H621 WeakPolarHBondContact O-CB 3.38Å; V617-H621 PolarHBondContact O-N 2.8Å
618	N	46.2	Very low	46.1	Very low	70 Å²	70	95.5 Å²	95.5	37%	0.374	49%	0.49	S	S	.	.	H	α-helix	trans	-65	-41.8	177.8	-71.8	-18.6	0	0	0	112.1	V614 T616 H621 L622	V614-N618 WeakPolarHBondContact CG1-ND2 3.24Å; V614-N618 VanDerWaalsContact O-CB 3.27Å; V614-N618 WeakPolarHBondContact O-CB 3.37Å; V614-N618 PolarHBondContact O-N 2.81Å; V614-N618 PolarHBondContact O-ND2 3.06Å; T616-N618 PolarHBondContact O-N 2.93Å; N618-H621 PolarHBondContact O-N 3.35Å; N618-L622 WeakPolarHBondContact O-CB 3.43Å; N618-L622 VanDerWaalsContact O-CG 3.27Å; N618-L622 WeakPolarHBondContact O-CG 3.43Å; N618-L622 PolarHBondContact O-N 3.07Å
619	N	44.3	Very low	44.6	Very low	101 Å²	101	96.2 Å²	96.2	54%	0.54	50%	0.496	S	S	.	.	H	α-helix	trans	-67	-41	177.5	-74.2	-29.6	0	0	0	112	N615 T616 H621 L622 T623	N615-N619 VanDerWaalsContact O-CB 3.29Å; N615-N619 WeakPolarHBondContact O-CB 3.38Å; N615-N619 PolarHBondContact O-N 2.96Å; N615-N619 PolarHBondContact O-ND2 2.85Å; T616-N619 PolarHBondContact O-N 3.08Å; N619-H621 VanDerWaalsContact C-N 3.35Å; N619-L622 PolarHBondContact O-N 3.46Å; N619-T623 PolarHBondContact O-N 2.62Å; N619-T623 PolarHBondContact O-OG1 3.27Å
620	E	44.3	Very low	43.4	Very low	48 Å²	48	97.3 Å²	97.3	22%	0.224	51%	0.508	C	S	.	.	H	α-helix	trans	-67	-33.9	175.3	-70.7	-177	158.7	0	0	112.1	T616 V617 T623 Y624	T616-E620 WeakPolarHBondContact O-CG 3.21Å; T616-E620 PolarHBondContact O-N 3.07Å; V617-E620 PolarHBondContact O-N 3.39Å; E620-T623 PolarHBondContact O-OG1 3.14Å; E620-T623 VanDerWaalsContact O-OG1 3.13Å; E620-Y624 WeakPolarHBondContact O-CB 3.14Å; E620-Y624 PolarHBondContact O-N 2.86Å
621	H	42.5	Very low	42	Very low	114 Å²	114	99.1 Å²	99.1	53%	0.528	52%	0.52	S	S	.	.	H	α-helix	trans	-71.3	-35.8	173.7	-129.7	-72.5	0	0	0	112.8	V617 N618 N619 L625	V617-H621 WeakPolarHBondContact O-CB 3.38Å; V617-H621 PolarHBondContact O-N 2.8Å; N618-H621 PolarHBondContact O-N 3.35Å; N619-H621 VanDerWaalsContact C-N 3.35Å; H621-L625 WeakPolarHBondContact O-CB 3.46Å; H621-L625 WeakPolarHBondContact O-CD1 3.29Å; H621-L625 VanDerWaalsContact O-CG 3.3Å; H621-L625 WeakPolarHBondContact O-CG 3.27Å; H621-L625 PolarHBondContact O-N 2.91Å; H621-L625 VanDerWaalsContact O-N 3.1Å
622	L	39.5	Very low	40.6	Very low	95 Å²	95	102.5 Å²	102.5	50%	0.497	54%	0.539	S	S	.	.	H	α-helix	trans	-72.3	-37.8	178	-76.1	167.4	0	0	0	112.4	N618 N619 N626	N618-L622 WeakPolarHBondContact O-CB 3.43Å; N618-L622 VanDerWaalsContact O-CG 3.27Å; N618-L622 WeakPolarHBondContact O-CG 3.43Å; N618-L622 PolarHBondContact O-N 3.07Å; N619-L622 PolarHBondContact O-N 3.46Å; L622-N626 WeakPolarHBondContact O-CB 3.42Å; L622-N626 VanDerWaalsContact O-CG 3.24Å; L622-N626 PolarHBondContact O-N 3.29Å; L622-N626 VanDerWaalsContact O-N 3.08Å; L622-N626 PolarHBondContact O-ND2 3.46Å
623	T	40.6	Very low	39.2	Very low	81 Å²	81	105.7 Å²	105.7	50%	0.497	55%	0.553	S	S	.	*	H	α-helix	trans	-66.9	-42.1	172.9	51.5	0	0	0	0	111.4	N619 E620 L625 N626 E627	N619-T623 PolarHBondContact O-N 2.62Å; N619-T623 PolarHBondContact O-OG1 3.27Å; E620-T623 PolarHBondContact O-OG1 3.14Å; E620-T623 VanDerWaalsContact O-OG1 3.13Å; T623-L625 VanDerWaalsContact C-N 3.33Å; T623-L625 PolarHBondContact O-N 3.22Å; T623-N626 PolarHBondContact O-N 3.29Å; T623-E627 PolarHBondContact O-N 3.35Å
624	Y	34	Very low	37.9	Very low	136 Å²	136	108.7 Å²	108.7	53%	0.533	57%	0.57	S	S	.	*	H	α-helix	trans	-63.8	-36.1	178.1	-133.1	-94	0	0	0	113.3	Y532 E620 T628	Y532-Y624 HydrophobicContact CE2-CD2 4.42Å; Y532-Y624 HydrophobicContact CE2-CE2 4.19Å; Y532-Y624 WeakPolarHBondContact OH-CD2 3.41Å; Y532-Y624 WeakPolarHBondContact OH-CE2 3.45Å; E620-Y624 WeakPolarHBondContact O-CB 3.14Å; E620-Y624 PolarHBondContact O-N 2.86Å; Y624-T628 WeakPolarHBondContact O-CG2 3.38Å; Y624-T628 PolarHBondContact O-OG1 2.81Å
625	L	36.7	Very low	36.9	Very low	91 Å²	91	113.8 Å²	113.8	48%	0.476	59%	0.588	S	S	.	*	H	α-helix	trans	-72.7	-32.5	175.2	-75.1	168.1	0	0	0	112.7	H621 T623 I629	H621-L625 WeakPolarHBondContact O-CB 3.46Å; H621-L625 WeakPolarHBondContact O-CD1 3.29Å; H621-L625 VanDerWaalsContact O-CG 3.3Å; H621-L625 WeakPolarHBondContact O-CG 3.27Å; H621-L625 PolarHBondContact O-N 2.91Å; H621-L625 VanDerWaalsContact O-N 3.1Å; T623-L625 VanDerWaalsContact C-N 3.33Å; T623-L625 PolarHBondContact O-N 3.22Å; L625-I629 WeakPolarHBondContact O-CG1 3.45Å
626	N	35.2	Very low	35.8	Very low	126 Å²	126	114.4 Å²	114.4	67%	0.674	60%	0.6	S	S	*	*	H	α-helix	trans	-79.2	-27.1	178.1	-71.8	-20	0	0	0	113.4	L622 T623	L622-N626 WeakPolarHBondContact O-CB 3.42Å; L622-N626 VanDerWaalsContact O-CG 3.24Å; L622-N626 PolarHBondContact O-N 3.29Å; L622-N626 VanDerWaalsContact O-N 3.08Å; L622-N626 PolarHBondContact O-ND2 3.46Å; T623-N626 PolarHBondContact O-N 3.29Å
627	E	37.2	Very low	34.7	Very low	140 Å²	140	118.8 Å²	118.8	65%	0.654	62%	0.621	S	S	*	*	S	Bend	trans	-84.4	-3.9	176.6	-69.5	-167.4	161.4	0	0	114	S527 T623	S527-E627 PolarHBondContact OG-OE2 3.45Å; T623-E627 PolarHBondContact O-N 3.35Å
628	T	36.1	Very low	33.9	Very low	87 Å²	87	123.9 Å²	123.9	53%	0.534	65%	0.646	S	S	.	*	S	Bend	trans	-117.1	10.2	-172.4	52.6	0	0	0	0	116	Y624 P630	Y624-T628 WeakPolarHBondContact O-CG2 3.38Å; Y624-T628 PolarHBondContact O-OG1 2.81Å; T628-P630 VanDerWaalsContact O-CD 3.26Å; T628-P630 WeakPolarHBondContact O-CD 3.14Å
629	I	30.5	Very low	32.9	Very low	127 Å²	127	127.8 Å²	127.8	65%	0.651	67%	0.666	S	S	*	*			trans	-109.9	97.5	178.8	-59.1	173.9	0	0	0	111.9	L625 I631	L625-I629 WeakPolarHBondContact O-CG1 3.45Å; I629-I631 PolarHBondContact O-N 2.94Å
630	P	28	Very low	32.1	Very low	107 Å²	107	130.4 Å²	130.4	70%	0.695	68%	0.675	S	S	*	*			trans	-79.6	99.7	167.8	31.2	-32.7	0	0	0	111.6	T628 I632	T628-P630 VanDerWaalsContact O-CD 3.26Å; T628-P630 WeakPolarHBondContact O-CD 3.14Å; P630-I632 PolarHBondContact O-N 3.48Å
631	I	26.8	Very low	31.3	Very low	161 Å²	161	137 Å²	137	83%	0.826	70%	0.703	S	S	*	*	S	Bend	trans	45.5	74.1	145.2	-40.2	176.3	0	0	0	116.4	I629	I629-I631 PolarHBondContact O-N 2.94Å
632	I	27.9	Very low	30.7	Very low	163 Å²	163	139.1 Å²	139.1	84%	0.836	72%	0.718	S	S	*	*			trans	-134.8	54.6	155.4	-42.2	179.6	0	0	0	110.9	P630	P630-I632 PolarHBondContact O-N 3.48Å
633	Q	25.1	Very low	30.5	Very low	180 Å²	180	139.1 Å²	139.1	84%	0.841	72%	0.723	S	S	*	*			trans	-142.3	90.6	161.7	-82	-166.4	-32	0	0	109.4
634	N	26.1	Very low	29.9	Very low	158 Å²	158	144.8 Å²	144.8	85%	0.845	74%	0.737	S	S	*	*			trans	178.7	102.4	152.1	-95.7	-21.7	0	0	0	108.9
635	H	28.5	Very low	29.6	Very low	185 Å²	185	146.4 Å²	146.4	86%	0.856	75%	0.747	S	S	*	*			trans	174.9	92.7	143.4	-94.5	-61.1	0	0	0	107.5
636	S	25.5	Very low	29.2	Very low	106 Å²	106	149.1 Å²	149.1	74%	0.741	76%	0.762	S	S	*	*			trans	-143.4	141.5	166.8	-64.7	0	0	0	0	106.1
637	N	26.3	Very low	29	Very low	159 Å²	159	146.3 Å²	146.3	85%	0.85	76%	0.763	S	S	*	*			trans	69.5	84.6	-173.4	-40.9	-29.3	0	0	0	113.9
638	D	30.5	Very low	28.7	Very low	166 Å²	166	146.5 Å²	146.5	89%	0.888	76%	0.763	S	S	*	*			trans	-131.6	146.6	133.2	-98.1	-45	0	0	0	107.4
639	L	26.2	Very low	28.5	Very low	152 Å²	152	149 Å²	149	80%	0.796	77%	0.769	S	S	*	*			trans	-109.9	166.5	-171.2	-83.6	159.1	0	0	0	111.5
640	E	26.4	Very low	28.7	Very low	156 Å²	156	150.7 Å²	150.7	73%	0.729	77%	0.773	S	S	*	*			trans	79.7	141.9	145.1	-91	172.1	-146.8	0	0	122.2
641	F	28.4	Very low	29.1	Very low	186 Å²	186	152.9 Å²	152.9	82%	0.816	77%	0.774	S	S	*	*			trans	69.5	132.6	163.5	-69.6	-70.3	0	0	0	123.8
642	L	29.3	Very low	29.6	Very low	160 Å²	160	150.4 Å²	150.4	84%	0.838	77%	0.769	S	S	*	*			trans	-92.1	-154.9	170.8	-50.5	159.1	0	0	0	108.7
643	P	35	Very low	29.9	Very low	95 Å²	95	148.8 Å²	148.8	62%	0.617	76%	0.757	S	S	*	*			cis	-131.6	-156.5	-24.5	22.8	2.4	0	0	0	113.4
644	Y	27.4	Very low	30.4	Very low	199 Å²	199	145.3 Å²	145.3	78%	0.78	74%	0.744	S	S	*	*			trans	92.1	117.5	167.7	-59.1	-79.8	0	0	0	117.1
645	F	28	Very low	31	Very low	170 Å²	170	144.8 Å²	144.8	75%	0.746	74%	0.736	S	S	*	*				85.9	117.7	52.6	-92.8	-77.1	0	0	0	114.4
646	N	28.1	Very low	31.3	Very low	149 Å²	149	141.6 Å²	141.6	80%	0.797	73%	0.726	S	S	*	*				-176.6	164.3	114.5	-102	-31.4	0	0	0	114.7
647	G	32.1	Very low	31.8	Very low	66 Å²	66	142.8 Å²	142.8	68%	0.68	72%	0.72	S	S	*	*			trans	99.6	91.8	-174.1	0	0	0	0	0	111.6
648	H	30.8	Very low	32.1	Very low	144 Å²	144	142.4 Å²	142.4	67%	0.667	71%	0.712	S	S	*	*			cis	59.7	126.4	36.7	-71.6	46.3	0	0	0	112.1
649	H	31.3	Very low	32.2	Very low	141 Å²	141	139.2 Å²	139.2	65%	0.653	70%	0.703	S	S	*	*			cis	-159.6	171.6	17	-130.3	5.5	0	0	0	114.2
650	H	35.9	Very low	32.4	Very low	161 Å²	161	138.3 Å²	138.3	75%	0.745	70%	0.699	S	S	*	*			trans	77.1	94.4	161.8	-62.3	-53.4	0	0	0	123.2
651	H	34.9	Very low	32.6	Very low	153 Å²	153	137.5 Å²	137.5	71%	0.708	70%	0.695	S	S	*	*			trans	-29.2	167.2	131.3	-111.9	-27	0	0	0	116.9
652	P	37.2	Very low	33.1	Very low	110 Å²	110	134.3 Å²	134.3	71%	0.714	69%	0.693	S	S	*	*			cis	-139	146.4	49.2	44.1	-26.6	0	0	0	116.9
653	H	34.5	Very low	33.1	Very low	129 Å²	129	132.3 Å²	132.3	60%	0.597	68%	0.679	S	S	*	*				69.9	147	109.5	-74.1	-99.1	0	0	0	116.2
654	D	36.3	Very low	32.8	Very low	106 Å²	106	134.4 Å²	134.4	57%	0.567	68%	0.68	S	S	*	*			cis	-155.8	159.2	12.6	-125.2	-27.2	0	0	0	113.9
655	H	38.2	Very low	32.7	Very low	147 Å²	147	130.6 Å²	130.6	68%	0.681	67%	0.669	S	S	*	*			trans	57	147.7	155.9	-64.9	-53	0	0	0	119.9
656	D	36	Very low	32.6	Very low	119 Å²	119	131 Å²	131	64%	0.636	67%	0.667	S	S	*	*			cis	-174.2	166.4	-3.7	-113.5	10.1	0	0	0	108.8
657	H	35.4	Very low	32.5	Very low	131 Å²	131	133.7 Å²	133.7	61%	0.606	67%	0.668	S	S	*	*			cis	-164.5	129.7	-11.5	-144.6	69.8	0	0	0	109.3
658	H	32.4	Very low	32.4	Very low	151 Å²	151	135.6 Å²	135.6	70%	0.699	67%	0.666	S	S	*	*			trans	61.1	163	154.6	-69.4	-18.5	0	0	0	120.8
659	S	32.6	Very low	32.1	Very low	98 Å²	98	137.8 Å²	137.8	69%	0.685	68%	0.677	S	S	*	*			cis	-170.7	173.4	-13.9	47.9	0	0	0	0	109.6
660	N	30.7	Very low	31.9	Very low	133 Å²	133	139.1 Å²	139.1	71%	0.711	68%	0.683	S	S	*	*			cis	-166	140.8	-33	-89.1	-11.4	0	0	0	109.8
661	H	31.1	Very low	31.4	Very low	139 Å²	139	138.3 Å²	138.3	64%	0.644	68%	0.681	S	S	*	*			trans	64.7	167.9	158.3	-90.4	-49.8	0	0	0	119.7	H663	H661-H663 AromaticContact CD2-CD2 3.68Å; H661-H663 AromaticContact CD2-NE2 3.93Å; H661-H663 AromaticContact CE1-CD2 3.43Å; H661-H663 PolarHBondContact CE1-CD2 3.02Å; H661-H663 VanDerWaalsContact CE1-CD2 3.43Å; H661-H663 AromaticContact CE1-CG 3.9Å; H661-H663 AromaticContact CE1-NE2 3.66Å; H661-H663 AromaticContact CG-CD2 3.53Å; H661-H663 AromaticContact ND1-CD2 3.37Å; H661-H663 PolarHBondContact ND1-CD2 2.91Å; H661-H663 AromaticContact ND1-CG 3.78Å; H661-H663 PolarHBondContact ND1-N 3.27Å; H661-H663 AromaticContact NE2-CD2 3.65Å; H661-H663 AromaticContact NE2-NE2 3.58Å
662	P	37.2	Very low	31.1	Very low	119 Å²	119	139.2 Å²	139.2	77%	0.773	68%	0.683	S	S	*	*			cis	-85.6	162.3	14.3	-5.4	26.9	0	0	0	115.1
663	H	30.8	Very low	30.5	Very low	118 Å²	118	141.3 Å²	141.3	55%	0.546	69%	0.688	S	S	.	*			cis	75.8	117.8	39.9	-89	-63.2	0	0	0	113.3	H661	H661-H663 AromaticContact CD2-CD2 3.68Å; H661-H663 AromaticContact CD2-NE2 3.93Å; H661-H663 AromaticContact CE1-CD2 3.43Å; H661-H663 PolarHBondContact CE1-CD2 3.02Å; H661-H663 VanDerWaalsContact CE1-CD2 3.43Å; H661-H663 AromaticContact CE1-CG 3.9Å; H661-H663 AromaticContact CE1-NE2 3.66Å; H661-H663 AromaticContact CG-CD2 3.53Å; H661-H663 AromaticContact ND1-CD2 3.37Å; H661-H663 PolarHBondContact ND1-CD2 2.91Å; H661-H663 AromaticContact ND1-CG 3.78Å; H661-H663 PolarHBondContact ND1-N 3.27Å; H661-H663 AromaticContact NE2-CD2 3.65Å; H661-H663 AromaticContact NE2-NE2 3.58Å
664	H	27.3	Very low	30.2	Very low	140 Å²	140	139.7 Å²	139.7	65%	0.648	69%	0.691	S	S	*	*				66.5	139	91.6	-84.3	-123.9	0	0	0	113.7
665	E	25.9	Very low	29.8	Very low	118 Å²	118	140.9 Å²	140.9	55%	0.551	70%	0.704	S	S	*	*			cis	-164.8	-173.6	-5.7	-135.9	172.4	169	0	0	109.2
666	Y	25.4	Very low	29.4	Very low	178 Å²	178	142.3 Å²	142.3	70%	0.698	71%	0.709	S	S	*	*			trans	22.2	131.3	161.2	-56.8	-62.2	0	0	0	120
667	Y	26.5	Very low	29	Very low	206 Å²	206	142.5 Å²	142.5	81%	0.808	71%	0.709	S	S	*	*				-158.6	142.8	76	-119.6	-96.2	0	0	0	115.6
668	T	28.9	Very low	28.6	Very low	106 Å²	106	145 Å²	145	65%	0.65	72%	0.723	S	S	*	*			trans	40.1	104.4	158.9	45.7	0	0	0	0	119.8	H670	T668-H670 PolarHBondContact O-N 3.04Å
669	Q	26.1	Very low	28.3	Very low	191 Å²	191	143.6 Å²	143.6	89%	0.893	73%	0.73	S	S	*	*			trans	-59.9	122.9	139.2	-64.4	173.3	-14	0	0	109.3
670	H	25.6	Very low	28	Very low	168 Å²	168	145.5 Å²	145.5	78%	0.778	73%	0.733	S	S	*	*			trans	-168	138.9	152.5	-112.3	-73.8	0	0	0	112.1	T668	T668-H670 PolarHBondContact O-N 3.04Å
671	M	26.7	Very low	28	Very low	145 Å²	145	149.5 Å²	149.5	71%	0.714	74%	0.74	S	S	*	*			trans	69.8	113.7	163.2	-53.3	-155.9	-151.2	0	0	120.8
672	K	27.6	Very low	27.8	Very low	172 Å²	172	149.3 Å²	149.3	75%	0.748	74%	0.743	S	S	*	*				75.8	115.9	124	-68.8	177.2	-178.7	175.3	0	121.9
673	L	25.2	Very low	27.4	Very low	154 Å²	154	151.9 Å²	151.9	81%	0.806	75%	0.751	S	S	*	*				80.5	156.2	129.1	-63.6	169.1	0	0	0	120.5
674	S	27.5	Very low	27.2	Very low	95 Å²	95	155.4 Å²	155.4	66%	0.664	77%	0.767	S	S	*	*			trans	77.4	93.9	162	-54	0	0	0	0	118.9
675	P	28.1	Very low	27.2	Very low	130 Å²	130	159.2 Å²	159.2	84%	0.844	78%	0.777	S	S	*	*			trans	-75.4	138.8	151.8	33.3	-31.3	0	0	0	110
676	F	30.4	Very low	27.4	Very low	177 Å²	177	161 Å²	161	78%	0.776	79%	0.789	S	S	*	*			trans	-136.3	126.7	179.2	-124.7	-105.3	0	0	0	112
677	L	27.7	Very low	27.7	Very low	123 Å²	123	160.6 Å²	160.6	64%	0.644	79%	0.793	S	S	*	*			trans	25	125.2	154.7	-51.3	178.7	0	0	0	120
678	M	27.1	Very low	27.6	Very low	184 Å²	184	162 Å²	162	91%	0.906	80%	0.799	S	S	*	*				-170.8	86.4	113.4	-152.9	71.9	70	0	0	113.1
679	S	26.7	Very low	27.5	Very low	121 Å²	121	167.4 Å²	167.4	85%	0.846	81%	0.807	S	S	*	*			trans	-159.3	29.6	166.1	74.7	0	0	0	0	116.3
680	D	25.7	Very low	27.6	Very low	138 Å²	138	164.2 Å²	164.2	74%	0.738	80%	0.796	S	S	*	*			trans	-96.8	110.6	169.1	-72.9	-52.4	0	0	0	110
681	Y	30	Very low	27.7	Very low	218 Å²	218	162 Å²	162	86%	0.855	79%	0.79	S	S	*	*			trans	-164.6	140.1	152.2	-104.7	-68.6	0	0	0	111.1
682	N	27.9	Very low	27.8	Very low	135 Å²	135	162.5 Å²	162.5	72%	0.722	80%	0.796	S	S	*	*			trans	65.3	88.5	165.2	-55.3	-24.9	0	0	0	118.1
683	N	28.8	Very low	27.9	Very low	173 Å²	173	161.6 Å²	161.6	93%	0.925	80%	0.799	S	S	*	*				-165.4	49.3	124	-98.3	-31.8	0	0	0	113.7
684	E	26.7	Very low	28.2	Very low	191 Å²	191	161.5 Å²	161.5	89%	0.893	80%	0.799	S	S	*	*			trans	-103.2	98.7	159.5	-83.6	-156.7	129.6	0	0	110.3
685	Y	26.7	Very low	28.3	Very low	220 Å²	220	163.1 Å²	163.1	86%	0.863	80%	0.801	S	S	*	*			trans	-174.1	112.9	136.9	-127.8	-102.4	0	0	0	110.7
686	I	31.1	Very low	28.5	Very low	156 Å²	156	163.2 Å²	163.2	80%	0.8	79%	0.794	S	S	*	*	S	Bend	trans	-164.5	117.8	142.4	-106.7	157.4	0	0	0	110.1
687	H	29.8	Very low	28.4	Very low	170 Å²	170	161.7 Å²	161.7	79%	0.787	79%	0.794	S	S	*	*			trans	48.6	88.6	162.6	-69.6	-68.7	0	0	0	121.1
688	Y	25.7	Very low	28.5	Very low	234 Å²	234	165.7 Å²	165.7	92%	0.918	81%	0.806	S	S	*	*				-43.6	133.2	127.2	-95	-107.3	0	0	0	111.5
689	R	27.4	Very low	28.6	Very low	221 Å²	221	161.2 Å²	161.2	83%	0.834	79%	0.794	S	S	*	*				-170.4	123.6	124.2	-161.9	164.7	-164	167.1	6.2	113.3
690	N	27.6	Very low	28.6	Very low	123 Å²	123	162.8 Å²	162.8	66%	0.658	79%	0.793	S	S	*	*			trans	59.2	144.8	159.7	-69	32.5	0	0	0	118.8
691	N	28.2	Very low	28.8	Very low	122 Å²	122	163.4 Å²	163.4	65%	0.652	80%	0.796	S	S	*	*			cis	-150.5	143	-10.1	-123.9	15.7	0	0	0	110.9
692	N	28.2	Very low	28.9	Very low	155 Å²	155	161 Å²	161	83%	0.829	80%	0.797	S	S	*	*			trans	-68	142.4	151.6	-81.8	-28.5	0	0	0	108.4
693	N	29.8	Very low	28.9	Very low	154 Å²	154	162.3 Å²	162.3	82%	0.824	79%	0.792	S	S	*	*			trans	-140.9	72.1	166.2	-132.5	25.4	0	0	0	109
694	N	31.7	Very low	29.2	Very low	151 Å²	151	162.5 Å²	162.5	81%	0.807	79%	0.793	S	S	*	*			trans	-92.8	109	168.6	-106	-9.9	0	0	0	108.6
695	N	29	Very low	29.4	Very low	129 Å²	129	159.7 Å²	159.7	69%	0.69	78%	0.779	S	S	*	*			trans	38.6	125.9	141.8	-65	-20.6	0	0	0	120.7
696	N	31.8	Very low	29.6	Very low	132 Å²	132	155.2 Å²	155.2	71%	0.706	77%	0.766	S	S	*	*			trans	81.5	109.4	141.8	-54.9	-11.9	0	0	0	119
697	N	28.3	Very low	29.5	Very low	146 Å²	146	153.1 Å²	153.1	78%	0.781	77%	0.766	S	S	*	*				45.8	96.1	122.1	-50.8	-0.1	0	0	0	117.6
698	F	30	Very low	29.6	Very low	206 Å²	206	149.7 Å²	149.7	90%	0.904	76%	0.76	S	S	*	*				-142.8	158.2	116.1	-131.4	-89.8	0	0	0	111.2
699	S	29.5	Very low	29.9	Very low	91 Å²	91	143.2 Å²	143.2	64%	0.636	74%	0.741	S	S	*	*			trans	-55.9	150.6	-153.6	-48.4	0	0	0	0	118	D701	S699-D701 PolarHBondContact O-N 2.8Å
700	D	27.9	Very low	30.1	Very low	154 Å²	154	141.2 Å²	141.2	82%	0.824	75%	0.745	S	S	*	*			trans	-43.6	119.6	141.8	-48.7	-96.3	0	0	0	111.5
701	D	29.9	Very low	30.4	Very low	151 Å²	151	143.7 Å²	143.7	81%	0.807	75%	0.752	S	S	*	*			trans	-172.9	142	134.9	-111.4	-31.7	0	0	0	110	S699	S699-D701 PolarHBondContact O-N 2.8Å
702	L	30.9	Very low	30.4	Very low	166 Å²	166	144.7 Å²	144.7	87%	0.869	76%	0.755	S	S	*	*	S	Bend	trans	61.6	123.2	-173.4	-51.2	161.5	0	0	0	112.7
703	R	27.9	Very low	30.7	Very low	164 Å²	164	144.8 Å²	144.8	62%	0.619	76%	0.755	S	S	*	*			cis	-151.1	76.8	39.5	-169	178.4	-173.3	168.7	0.4	111.5	H705 E706	R703-H705 HydrophobicContact CG-CB 4.25Å; R703-H705 PolarHBondContact O-N 2.96Å; R703-E706 IonicContact CZ-OE1 2.8Å; R703-E706 IonicContact CZ-OE2 3.59Å; R703-E706 IonicContact NE-OE1 2.68Å; R703-E706 IonicContact NE-OE2 3.02Å; R703-E706 IonicContact NH2-OE1 3.73Å; R703-E706 PolarHBondContact NH2-OE1 3.33Å; R703-E706 IonicContact NH2-OE2 2.59Å; R703-E706 PolarHBondContact NH2-OE2 3.43Å
704	N	35.8	Very low	30.7	Very low	177 Å²	177	147.4 Å²	147.4	95%	0.947	76%	0.759	S	S	*	*	S	Bend	trans	-67.9	53.6	152.7	-94.6	-29.8	0	0	0	110.1
705	H	30.9	Very low	30.7	Very low	131 Å²	131	146.9 Å²	146.9	61%	0.606	76%	0.756	S	S	*	*			trans	-163.2	52.3	-172.9	-128.5	-72.4	0	0	0	113.9	R703	R703-H705 HydrophobicContact CG-CB 4.25Å; R703-H705 PolarHBondContact O-N 2.96Å
706	E	29.9	Very low	30.7	Very low	126 Å²	126	146.9 Å²	146.9	59%	0.589	76%	0.756	S	S	*	*			trans	-149.4	32.5	152.9	-143.7	139	-95.3	0	0	114.6	R703	R703-E706 IonicContact CZ-OE1 2.8Å; R703-E706 IonicContact CZ-OE2 3.59Å; R703-E706 IonicContact NE-OE1 2.68Å; R703-E706 IonicContact NE-OE2 3.02Å; R703-E706 IonicContact NH2-OE1 3.73Å; R703-E706 PolarHBondContact NH2-OE1 3.33Å; R703-E706 IonicContact NH2-OE2 2.59Å; R703-E706 PolarHBondContact NH2-OE2 3.43Å
707	S	30.1	Very low	30.7	Very low	113 Å²	113	152 Å²	152	79%	0.79	77%	0.767	S	S	*	*	S	Bend	trans	-90.9	121.8	144.1	-74	0	0	0	0	106.5
708	S	30.8	Very low	30.6	Very low	97 Å²	97	149.9 Å²	149.9	68%	0.678	76%	0.763	S	S	*	*	S	Bend	trans	87.4	157	-161.3	-41.7	0	0	0	0	114.3
709	I	31.6	Very low	30.7	Very low	99 Å²	99	145.5 Å²	145.5	51%	0.508	75%	0.754	S	S	.	*			trans	73.8	34.3	-178.8	-29	-177.9	0	0	0	116.2
710	I	31.7	Very low	30.7	Very low	179 Å²	179	148.1 Å²	148.1	92%	0.918	76%	0.761	S	S	*	*	S	Bend		-97.1	78.8	123.4	-60.5	-176.3	0	0	0	106.9
711	Q	34.8	Very low	30.9	Very low	174 Å²	174	146.1 Å²	146.1	81%	0.813	75%	0.754	S	S	*	*	S	Bend	trans	-155	-28.8	171.8	-152.1	173.2	17.5	0	0	113.1
712	M	27.9	Very low	31.1	Very low	143 Å²	143	144.2 Å²	144.2	70%	0.704	75%	0.748	S	S	*	*	S	Bend	trans	-137.8	103.6	175.7	-75.8	-178.7	-81.6	0	0	111.4
713	N	34.8	Very low	31.3	Very low	157 Å²	157	142.6 Å²	142.6	84%	0.84	74%	0.74	S	S	*	*			trans	-170.5	46	136.9	-94.4	-20.9	0	0	0	112.1	L715	N713-L715 PolarHBondContact O-N 3.14Å
714	K	30.1	Very low	31.6	Very low	209 Å²	209	140.8 Å²	140.8	91%	0.909	74%	0.743	S	S	*	*			trans	-82.6	86.5	149.8	-92.5	-169.9	173.3	-176.3	0	108
715	L	30.7	Very low	31.5	Very low	140 Å²	140	137.6 Å²	137.6	73%	0.733	73%	0.73	S	S	*	*			trans	-144.2	133.3	158.3	-82.7	-174.7	0	0	0	110.2	N713	N713-L715 PolarHBondContact O-N 3.14Å
716	N	28.9	Very low	31.7	Very low	129 Å²	129	136.5 Å²	136.5	69%	0.69	73%	0.733	S	S	*	*			trans	53.8	87.2	156.1	-52.3	-17.5	0	0	0	117.2
717	Y	31.4	Very low	31.6	Very low	240 Å²	240	137.3 Å²	137.3	94%	0.941	74%	0.741	S	S	*	*				-137.5	131.5	101.9	-98	-76.7	0	0	0	110.3
718	S	27.1	Very low	31.7	Very low	101 Å²	101	137.9 Å²	137.9	71%	0.706	74%	0.74	S	S	*	*			trans	-70.9	162.2	172.3	-49.3	0	0	0	0	109.5
719	T	31.6	Very low	31.5	Very low	114 Å²	114	138.1 Å²	138.1	70%	0.699	74%	0.742	S	S	*	*			cis	-158.4	165.1	42.2	52	0	0	0	0	112.1
720	N	29.2	Very low	31.7	Very low	147 Å²	147	139.5 Å²	139.5	79%	0.786	76%	0.755	S	S	*	*			trans	55.7	132.9	141.2	-64.2	1.7	0	0	0	120.1
721	T	32.8	Very low	31.6	Very low	112 Å²	112	137.4 Å²	137.4	69%	0.687	75%	0.745	S	S	*	*			cis	-152.2	146.5	12.6	46.2	0	0	0	0	113.5
722	T	33.8	Very low	31.3	Very low	111 Å²	111	136.4 Å²	136.4	68%	0.681	75%	0.745	S	S	*	*			trans	55.4	121.7	140.6	59	0	0	0	0	123.5
723	N	35.1	Very low	31.5	Very low	132 Å²	132	135.1 Å²	135.1	71%	0.706	75%	0.751	S	S	*	*			trans	71.4	143	132.8	-60	45.2	0	0	0	119.1
724	D	33.8	Very low	31.1	Very low	125 Å²	125	135.7 Å²	135.7	67%	0.668	75%	0.753	S	S	*	*			cis	-155.4	175.3	-5.2	-122.2	-37.2	0	0	0	114.8
725	T	34.7	Very low	31.1	Very low	111 Å²	111	130.8 Å²	130.8	68%	0.681	75%	0.746	S	S	*	*			trans	-37	159.2	167.8	53.7	0	0	0	0	117.5
726	T	34.5	Very low	31	Very low	108 Å²	108	129.7 Å²	129.7	66%	0.663	75%	0.75	S	S	*	*			cis	-174.1	165	3.6	20.9	0	0	0	0	110.1
727	N	28.2	Very low	31.2	Very low	143 Å²	143	128.6 Å²	128.6	77%	0.765	75%	0.752	S	S	*	*			trans	44.6	147.8	143.4	-56.6	-15.3	0	0	0	120.6
728	T	32	Very low	31	Very low	124 Å²	124	125 Å²	125	76%	0.761	75%	0.75	S	S	*	*			cis	-165.4	142	30.6	-14.6	0	0	0	0	107.2
729	S	27.5	Very low	31.3	Very low	103 Å²	103	126.9 Å²	126.9	72%	0.72	75%	0.75	S	S	*	*				58.5	158.4	101.5	-161.2	0	0	0	0	118.8
730	V	34.1	Very low	31.3	Very low	128 Å²	128	127.5 Å²	127.5	78%	0.776	75%	0.749	S	S	*	*			trans	77.5	144.6	175.4	-172.3	0	0	0	0	115
731	N	31.7	Very low	31.3	Very low	135 Å²	135	132 Å²	132	72%	0.722	76%	0.755	S	S	*	*			cis	-176.6	158.1	-47	-105.8	-17.4	0	0	0	107.9
732	N	27.8	Very low	31.1	Very low	152 Å²	152	133.4 Å²	133.4	81%	0.813	76%	0.758	S	S	*	*			trans	6.1	133.2	159.3	-60.5	-14.8	0	0	0	120.7
733	S	32.2	Very low	30.9	Very low	117 Å²	117	136.4 Å²	136.4	82%	0.818	77%	0.769	S	S	*	*				-162.9	151.1	115.4	37.3	0	0	0	0	112.8
734	N	25.3	Very low	30.7	Very low	168 Å²	168	139.1 Å²	139.1	90%	0.898	78%	0.775	S	S	*	*			trans	-100	130.6	174.5	-71.1	-38.9	0	0	0	110
735	S	31.4	Very low	30.4	Very low	106 Å²	106	140 Å²	140	74%	0.741	78%	0.78	S	S	*	*			trans	-163.1	116.2	156.1	52.8	0	0	0	0	109
736	S	28	Very low	30.2	Very low	118 Å²	118	143.3 Å²	143.3	83%	0.825	79%	0.785	S	S	*	*			cis	81.1	76.4	43.6	84.9	0	0	0	0	115
737	S	32.4	Very low	30	Very low	106 Å²	106	149 Å²	149	74%	0.741	80%	0.796	S	S	*	*			trans	-160.8	129.1	149	49.8	0	0	0	0	111.5
738	N	27.5	Very low	30.1	Very low	165 Å²	165	148.4 Å²	148.4	88%	0.882	79%	0.792	S	S	*	*			trans	-75.1	138.7	156.5	-63.2	-48.8	0	0	0	107.7
739	I	34	Very low	30	Very low	139 Å²	139	149.3 Å²	149.3	71%	0.713	79%	0.788	S	S	*	*			trans	-153.2	126.3	153.4	-96	133.2	0	0	0	107.6
740	N	31.9	Very low	30.1	Very low	128 Å²	128	151.2 Å²	151.2	68%	0.684	79%	0.785	S	S	*	*			trans	18.6	126.5	145.6	-43.3	-16.4	0	0	0	116	D742	N740-D742 PolarHBondContact O-N 3.04Å
741	R	27.7	Very low	30	Very low	242 Å²	242	152 Å²	152	91%	0.913	78%	0.784	S	S	*	*	S	Bend	cis	42.1	47	45.4	-147	-170.6	-153.4	-154.7	7.1	112.8
742	D	29.3	Very low	30	Very low	140 Å²	140	154.4 Å²	154.4	75%	0.749	79%	0.785	S	S	*	*			trans	-174.9	78.1	145.7	-87.7	-16.9	0	0	0	111	N740	N740-D742 PolarHBondContact O-N 3.04Å
743	L	30.2	Very low	30.2	Very low	175 Å²	175	152.1 Å²	152.1	92%	0.916	78%	0.776	S	S	*	*			trans	-139.2	53.4	155.7	-83.4	-178.1	0	0	0	108.5
744	F	29.7	Very low	30.1	Very low	189 Å²	189	153.1 Å²	153.1	83%	0.829	77%	0.772	S	S	*	*			trans	-82.5	144.2	161.8	-152.8	-99	0	0	0	107.1
745	D	28.4	Very low	30.4	Very low	143 Å²	143	149.6 Å²	149.6	77%	0.765	76%	0.761	S	S	*	*	S	Bend	trans	66.6	149.6	-167.7	-66.7	-37.6	0	0	0	118.4
746	K	31.2	Very low	30.4	Very low	180 Å²	180	151.8 Å²	151.8	78%	0.783	76%	0.764	S	S	*	*			trans	90.6	51.8	156.3	-147.6	172.9	-175.7	173.8	0	121
747	Y	30.3	Very low	30.6	Very low	228 Å²	228	155.3 Å²	155.3	89%	0.894	77%	0.767	S	S	*	*			trans	-152.4	111.1	135.2	-98.8	-80.8	0	0	0	106.2
748	N	29	Very low	30.5	Very low	130 Å²	130	156.5 Å²	156.5	70%	0.695	77%	0.765	S	S	*	*			cis	61.5	68.7	10.1	-88.4	13.1	0	0	0	115.5
749	H	30.9	Very low	30.6	Very low	144 Å²	144	154.2 Å²	154.2	67%	0.667	76%	0.759	S	S	*	*				-172.5	147.7	100.9	-109.8	-111.6	0	0	0	110.9
750	E	29.8	Very low	30.2	Very low	143 Å²	143	158.2 Å²	158.2	67%	0.668	77%	0.767	S	S	*	*			trans	37.2	133	145.1	-72.4	155.7	174	0	0	120.4
751	L	32.5	Very low	30	Very low	143 Å²	143	156.5 Å²	156.5	75%	0.749	77%	0.765	S	S	*	*			cis	-144.6	141.9	35.5	-69.4	164.7	0	0	0	113.5
752	Y	30.1	Very low	30.1	Very low	187 Å²	187	152.2 Å²	152.2	73%	0.733	76%	0.759	S	S	*	*			trans	29.7	130.6	139.3	-65.2	-97.6	0	0	0	121.2
753	T	32.9	Very low	30	Very low	104 Å²	104	156 Å²	156	64%	0.638	76%	0.764	S	S	*	*			cis	-164.9	146.3	-7.6	2.8	0	0	0	0	109.9
754	N	29.7	Very low	29.9	Very low	138 Å²	138	153.3 Å²	153.3	74%	0.738	76%	0.755	S	S	*	*			trans	51.8	87.8	157.3	-51.5	-8.3	0	0	0	116.9
755	S	31.9	Very low	29.8	Very low	93 Å²	93	149.8 Å²	149.8	65%	0.65	75%	0.754	S	S	*	*				55.6	91.9	80.3	80.8	0	0	0	0	113.5
756	D	30.5	Very low	29.8	Very low	152 Å²	152	150.2 Å²	150.2	81%	0.813	76%	0.756	S	S	*	*				77.7	113.1	86.7	-72.2	-46	0	0	0	114.1
757	H	32.4	Very low	29.7	Very low	192 Å²	192	150.2 Å²	150.2	89%	0.889	75%	0.753	S	S	*	*			trans	-146.5	135.3	150.5	-111.7	59.9	0	0	0	111.5
758	N	31.2	Very low	29.4	Very low	131 Å²	131	145.4 Å²	145.4	70%	0.701	75%	0.752	S	S	*	*			trans	-82.8	133.4	-172.1	-176.4	-1.4	0	0	0	110.8	Y760	N758-Y760 PolarHBondContact O-N 3.2Å
759	P	28.2	Very low	29.5	Very low	117 Å²	117	145.8 Å²	145.8	76%	0.76	75%	0.75	S	S	*	*	S	Bend	trans	-76.1	58.3	-171.1	31.9	-39.3	0	0	0	115.1
760	Y	27.5	Very low	29.3	Very low	224 Å²	224	145.4 Å²	145.4	88%	0.878	75%	0.751	S	S	*	*			trans	-139.4	46.4	167	-94.4	-72.7	0	0	0	112.3	N758	N758-Y760 PolarHBondContact O-N 3.2Å
761	S	27.3	Very low	29.2	Very low	92 Å²	92	143.1 Å²	143.1	64%	0.643	75%	0.751	S	S	*	*			trans	-151.2	101.9	168.2	-173.1	0	0	0	0	111.7
762	I	29.4	Very low	29	Very low	152 Å²	152	144.2 Å²	144.2	78%	0.779	76%	0.758	S	S	*	*			trans	-140.3	143.2	164.2	-56.5	-176.9	0	0	0	106.7
763	Y	27.7	Very low	28.8	Very low	218 Å²	218	143.7 Å²	143.7	86%	0.855	76%	0.756	S	S	*	*	S	Bend	trans	76.1	51.1	-174.6	-64.4	-72.7	0	0	0	118
764	T	27.6	Very low	28.7	Very low	120 Å²	120	144.9 Å²	144.9	74%	0.736	77%	0.765	S	S	*	*	S	Bend		-131.7	150.5	125.1	45.9	0	0	0	0	110.9
765	S	27	Very low	28.7	Very low	115 Å²	115	144.8 Å²	144.8	80%	0.804	76%	0.759	S	S	*	*			trans	49.8	102.4	167.4	52.5	0	0	0	0	118.2
766	N	27.7	Very low	28.6	Very low	151 Å²	151	148.2 Å²	148.2	81%	0.807	77%	0.77	S	S	*	*			trans	-141.3	153.5	143.9	-137.8	-18.4	0	0	0	109.3
767	Y	29.1	Very low	28.7	Very low	181 Å²	181	144.6 Å²	144.6	71%	0.71	75%	0.753	S	S	*	*			trans	60.8	78.9	-175.2	-77.4	-85.4	0	0	0	118	Q769	Y767-Q769 HydrophobicContact CD1-CB 4.27Å; Y767-Q769 HydrophobicContact CD1-CG 4.34Å; Y767-Q769 HydrophobicContact CE1-CG 4.42Å
768	S	24.9	Very low	28.7	Very low	127 Å²	127	142.5 Å²	142.5	89%	0.888	75%	0.748	S	S	*	*			trans	-95.2	103.4	135.7	-59.3	0	0	0	0	108.8
769	Q	30.5	Very low	28.6	Very low	137 Å²	137	141.8 Å²	141.8	64%	0.64	74%	0.744	S	S	*	*			trans	-143.6	132.2	165	-81.1	-165.1	-22.4	0	0	110.9	Y767	Y767-Q769 HydrophobicContact CD1-CB 4.27Å; Y767-Q769 HydrophobicContact CD1-CG 4.34Å; Y767-Q769 HydrophobicContact CE1-CG 4.42Å
770	I	28.3	Very low	28.9	Very low	136 Å²	136	142 Å²	142	70%	0.697	74%	0.744	S	S	*	*			trans	52	83.4	144.5	-52.1	168.1	0	0	0	114.5
771	S	26.6	Very low	29	Very low	96 Å²	96	136.8 Å²	136.8	67%	0.671	74%	0.735	S	S	*	*				53.3	96.1	80.5	81.4	0	0	0	0	115
772	N	29.1	Very low	29.2	Very low	166 Å²	166	137.4 Å²	137.4	89%	0.888	74%	0.74	S	S	*	*				-159.1	151.9	129	-98.3	-24.4	0	0	0	111.6
773	Y	25.9	Very low	29.3	Very low	176 Å²	176	134.8 Å²	134.8	69%	0.69	74%	0.735	S	S	*	*			trans	-93.3	163.4	-175.6	-109.3	-132.5	0	0	0	109.9	F775	Y773-F775 HydrophobicContact CD1-CB 3.94Å; Y773-F775 AromaticContact CD1-CD2 3.91Å; Y773-F775 HydrophobicContact CD1-CD2 3.91Å; Y773-F775 HydrophobicContact CD1-CG 4.21Å; Y773-F775 HydrophobicContact CE1-CB 3.73Å; Y773-F775 HydrophobicContact CE1-CD1 4.41Å; Y773-F775 AromaticContact CE1-CD2 3.21Å; Y773-F775 HydrophobicContact CE1-CD2 3.21Å; Y773-F775 AromaticContact CE1-CE2 3.85Å; Y773-F775 HydrophobicContact CE1-CE2 3.85Å; Y773-F775 AromaticContact CE1-CG 3.55Å; Y773-F775 HydrophobicContact CE1-CG 3.55Å; Y773-F775 HydrophobicContact CE2-CD2 4.28Å; Y773-F775 HydrophobicContact CE2-CE2 4.39Å; Y773-F775 AromaticContact CZ-CD2 3.43Å; Y773-F775 VanDerWaalsContact CZ-CD2 3.43Å; Y773-F775 AromaticContact CZ-CE2 3.58Å; Y773-F775 VanDerWaalsContact OH-CE2 3.23Å; Y773-F775 WeakPolarHBondContact OH-CE2 3.36Å
774	P	30.8	Very low	29.3	Very low	128 Å²	128	131.2 Å²	131.2	83%	0.831	73%	0.729	S	S	*	*				-131	131.4	64.8	29.6	-11	0	0	0	115.9
775	F	28.7	Very low	29.5	Very low	136 Å²	136	133 Å²	133	60%	0.596	73%	0.729	S	S	*	*			trans	-65.4	155.3	139.8	-89.3	-136.6	0	0	0	109.2	Y773 V777	Y773-F775 HydrophobicContact CD1-CB 3.94Å; Y773-F775 AromaticContact CD1-CD2 3.91Å; Y773-F775 HydrophobicContact CD1-CD2 3.91Å; Y773-F775 HydrophobicContact CD1-CG 4.21Å; Y773-F775 HydrophobicContact CE1-CB 3.73Å; Y773-F775 HydrophobicContact CE1-CD1 4.41Å; Y773-F775 AromaticContact CE1-CD2 3.21Å; Y773-F775 HydrophobicContact CE1-CD2 3.21Å; Y773-F775 AromaticContact CE1-CE2 3.85Å; Y773-F775 HydrophobicContact CE1-CE2 3.85Å; Y773-F775 AromaticContact CE1-CG 3.55Å; Y773-F775 HydrophobicContact CE1-CG 3.55Å; Y773-F775 HydrophobicContact CE2-CD2 4.28Å; Y773-F775 HydrophobicContact CE2-CE2 4.39Å; Y773-F775 AromaticContact CZ-CD2 3.43Å; Y773-F775 VanDerWaalsContact CZ-CD2 3.43Å; Y773-F775 AromaticContact CZ-CE2 3.58Å; Y773-F775 VanDerWaalsContact OH-CE2 3.23Å; Y773-F775 WeakPolarHBondContact OH-CE2 3.36Å; F775-V777 HydrophobicContact CB-CG2 3.78Å; F775-V777 HydrophobicContact CD1-CG2 4.29Å
776	D	30.5	Very low	29.4	Very low	165 Å²	165	137.4 Å²	137.4	88%	0.882	73%	0.734	S	S	*	*			trans	-101.2	149.9	137.1	-138	-33.2	0	0	0	109
777	V	31.7	Very low	29.6	Very low	76 Å²	76	133.9 Å²	133.9	46%	0.461	72%	0.721	S	S	.	*			trans	-124.8	135.4	-153.9	173.7	0	0	0	0	113.1	F775	F775-V777 HydrophobicContact CB-CG2 3.78Å; F775-V777 HydrophobicContact CD1-CG2 4.29Å
778	N	33.1	Very low	29.4	Very low	148 Å²	148	132.8 Å²	132.8	79%	0.791	73%	0.727	S	S	*	*			trans	-162.4	106.2	135.8	-92.1	-51.2	0	0	0	108.4
779	N	28.5	Very low	29.8	Very low	116 Å²	116	133 Å²	133	62%	0.62	72%	0.724	S	S	*	*				66.7	120	85.4	-66.2	-36	0	0	0	111.2
780	T	34.8	Very low	29.6	Very low	122 Å²	122	135.7 Å²	135.7	75%	0.748	73%	0.729	S	S	*	*			cis	-141.5	136.9	33.4	37.6	0	0	0	0	111.6
781	T	29.6	Very low	29.8	Very low	114 Å²	114	139 Å²	139	70%	0.699	74%	0.739	S	S	*	*				50	136.9	80.8	67.1	0	0	0	0	114.9
782	S	31.5	Very low	30	Very low	106 Å²	106	140 Å²	140	74%	0.741	74%	0.737	S	S	*	*			cis	-177.1	160.2	-0.9	40.1	0	0	0	0	107.2
783	S	30.9	Very low	29.9	Very low	97 Å²	97	140.8 Å²	140.8	68%	0.678	73%	0.732	S	S	*	*			cis	-149.9	162.6	5.2	-102.3	0	0	0	0	107.8
784	I	29.3	Very low	30.2	Very low	142 Å²	142	136 Å²	136	73%	0.728	74%	0.737	S	S	*	*				68.3	103.3	53	-49.6	169.3	0	0	0	114.4
785	H	30.3	Very low	30.1	Very low	159 Å²	159	136.7 Å²	136.7	74%	0.736	73%	0.734	S	S	*	*				-170.1	123.2	114.8	-112.5	-84.3	0	0	0	112.2	S787	H785-S787 PolarHBondContact ND1-OG 3.4Å
786	F	25.8	Very low	30.3	Very low	206 Å²	206	136.6 Å²	136.6	90%	0.904	74%	0.739	S	S	*	*			trans	-124.1	127.8	156.6	-109.8	-81.6	0	0	0	106.3
787	S	31.4	Very low	30.3	Very low	77 Å²	77	136.1 Å²	136.1	54%	0.538	74%	0.737	S	S	.	*			trans	-150.4	99.9	-176.1	-57.6	0	0	0	0	110.1	H785 T789	H785-S787 PolarHBondContact ND1-OG 3.4Å; S787-T789 PolarHBondContact O-N 2.83Å
788	N	25.9	Very low	30.4	Very low	158 Å²	158	135.7 Å²	135.7	85%	0.845	75%	0.748	S	S	*	*			trans	-80.2	113.6	170.7	-78.1	-13.8	0	0	0	109.2
789	T	32.5	Very low	30.3	Very low	132 Å²	132	135 Å²	135	81%	0.81	74%	0.744	S	S	*	*			trans	-117.3	104.6	162.5	41.6	0	0	0	0	109.5	S787	S787-T789 PolarHBondContact O-N 2.83Å
790	Y	26.4	Very low	30.5	Very low	194 Å²	194	138.7 Å²	138.7	76%	0.761	75%	0.749	S	S	*	*			trans	-61.3	130.6	163.9	-115.4	-110.6	0	0	0	108.6	S1048	Y790-S1048 PolarHBondContact OH-OG 3.49Å
791	F	31.9	Very low	30.3	Very low	204 Å²	204	139.1 Å²	139.1	90%	0.895	75%	0.747	S	S	*	*			trans	-148.4	165.1	154.7	-115.4	-77.9	0	0	0	110.8
792	D	30.6	Very low	30.5	Very low	119 Å²	119	140 Å²	140	64%	0.636	75%	0.747	S	S	*	*			trans	-95.4	175.6	-144.8	-133.2	-50.6	0	0	0	116.3
793	K	28.8	Very low	30.5	Very low	181 Å²	181	139.1 Å²	139.1	79%	0.787	74%	0.741	S	S	*	*			trans	-45.7	143.5	-176.8	-58.6	152.9	-162.2	85.6	0	115.2
794	G	31.7	Very low	30.4	Very low	76 Å²	76	145 Å²	145	78%	0.784	75%	0.749	S	S	*	*			trans	-145.3	120	156.3	0	0	0	0	0	110.1
795	N	28.6	Very low	30.5	Very low	143 Å²	143	144.9 Å²	144.9	77%	0.765	75%	0.749	S	S	*	*			trans	-78.3	148.3	179.3	-59.4	-34.7	0	0	0	111
796	N	33	Very low	30.5	Very low	134 Å²	134	144.6 Å²	144.6	72%	0.717	75%	0.752	S	S	*	*				174.5	136.8	110.6	-84.6	-7.9	0	0	0	113.5
797	D	31.2	Very low	30.6	Very low	155 Å²	155	141.9 Å²	141.9	83%	0.829	75%	0.746	S	S	*	*			trans	48.5	129.1	138.3	-51	-34.4	0	0	0	123.3
798	G	33.5	Very low	30.5	Very low	67 Å²	67	143.2 Å²	143.2	69%	0.691	76%	0.755	S	S	*	*			trans	128.3	99.2	168.3	0	0	0	0	0	111.7
799	N	30.3	Very low	30.6	Very low	132 Å²	132	140.3 Å²	140.3	71%	0.706	75%	0.747	S	S	*	*				38.7	129.3	71.4	-67.7	-41.2	0	0	0	113.4
800	R	32.5	Very low	30.4	Very low	195 Å²	195	140.3 Å²	140.3	74%	0.736	74%	0.741	S	S	*	*			cis	-174	146.3	2.3	-114.9	166.8	-165.3	172.8	0.3	108.1
801	N	31.6	Very low	30.6	Very low	131 Å²	131	134.4 Å²	134.4	70%	0.701	73%	0.725	S	S	*	*			trans	57.8	168.2	140.7	-64.7	39.2	0	0	0	118.1
802	D	33.5	Very low	30.7	Very low	133 Å²	133	128.9 Å²	128.9	71%	0.711	70%	0.704	S	S	*	*			cis	-143.4	179.5	-15.7	-129.6	-43.7	0	0	0	111.8
803	S	30.2	Very low	31	Very low	87 Å²	87	128.2 Å²	128.2	61%	0.608	71%	0.707	S	S	*	*			trans	-65.3	141.6	178.9	-56.4	0	0	0	0	115.6
804	R	30.4	Very low	31.1	Very low	221 Å²	221	123.9 Å²	123.9	83%	0.834	69%	0.692	S	S	*	*			trans	62.5	160	134.6	-71.7	-176.1	175.3	129.8	-0.1	122
805	D	30.3	Very low	31.3	Very low	138 Å²	138	125.3 Å²	125.3	74%	0.738	69%	0.69	S	S	*	*			trans	84.3	137.2	155.2	-60	-23.6	0	0	0	121
806	L	30.9	Very low	31.4	Very low	154 Å²	154	123.2 Å²	123.2	81%	0.806	69%	0.686	S	S	*	*			trans	63.4	109.1	167.1	-56.6	168.1	0	0	0	116.8
807	I	28.3	Very low	31.6	Very low	149 Å²	149	125.6 Å²	125.6	76%	0.764	69%	0.693	S	S	*	*				71.5	114.6	66.3	-62.4	177.5	0	0	0	114.4
808	S	27.9	Very low	31.5	Very low	104 Å²	104	122.2 Å²	122.2	73%	0.727	68%	0.682	S	S	*	*			trans	87	141.7	155.2	78.2	0	0	0	0	122
809	S	29	Very low	31.5	Very low	98 Å²	98	125.6 Å²	125.6	69%	0.685	68%	0.684	S	S	*	*			trans	79.5	117.1	162.4	-44.5	0	0	0	0	117.4
810	I	28.8	Very low	31.7	Very low	131 Å²	131	126.8 Å²	126.8	67%	0.672	69%	0.685	S	S	*	*			cis	71.7	117.2	48.1	-56.9	169.3	0	0	0	110.3	V141	V141-I810 HydrophobicContact CG2-CG2 4.16Å; V141-I810 VanDerWaalsContact CG2-O 3.29Å; V141-I810 WeakPolarHBondContact CG2-O 3.41Å
811	T	29.5	Very low	31.8	Very low	71 Å²	71	124.4 Å²	124.4	44%	0.436	69%	0.686	S	S	.	*			cis	-162.4	-179.4	-0.6	17.4	0	0	0	0	110.3	T142	T142-T811 WeakPolarHBondContact CA-OG1 3.47Å; T142-T811 PolarHBondContact N-OG1 3.43Å
812	L	34.2	Very low	31.8	Very low	88 Å²	88	122.8 Å²	122.8	46%	0.461	69%	0.685	S	S	.	*			trans	-68.8	-166.5	-178	-47	88.5	0	0	0	115.9	V141 T142 A143	V141-L812 CarbonylContact C-O 3.39Å; T142-L812 CarbonylContact C-O 3.42Å; T142-L812 VanDerWaalsContact CA-O 3.24Å; T142-L812 WeakPolarHBondContact CA-O 3.47Å; T142-L812 PolarHBondContact N-O 2.84Å; A143-L812 VanDerWaalsContact N-C 3.34Å; A143-L812 PolarHBondContact N-O 2.72Å
813	P	36.7	Very low	32	Very low	105 Å²	105	120.3 Å²	120.3	68%	0.682	68%	0.683	S	S	*	*				-145.7	159.7	121.9	27.1	-5.7	0	0	0	119.3	T142 A143	T142-P813 WeakPolarHBondContact O-CA 3.38Å; T142-P813 VanDerWaalsContact O-CB 3.29Å; T142-P813 WeakPolarHBondContact O-CB 3.43Å; A143-P813 CarbonylContact O-C 3.05Å; A143-P813 VanDerWaalsContact O-CA 3.31Å; A143-P813 WeakPolarHBondContact O-CA 3.49Å
814	N	31.9	Very low	32.2	Very low	90 Å²	90	124.7 Å²	124.7	48%	0.481	69%	0.694	S	S	.	*			trans	-76.8	164.7	171	-76.3	-45.3	0	0	0	113.7	A143 S144	A143-N814 WeakPolarHBondContact O-CB 3.48Å; A143-N814 PolarHBondContact O-N 3.48Å; A143-N814 PolarHBondContact O-ND2 2.68Å; S144-N814 WeakPolarHBondContact CA-OD1 3.31Å; S144-N814 WeakPolarHBondContact CB-OD1 3.45Å; S144-N814 PolarHBondContact N-ND2 3.42Å; S144-N814 VanDerWaalsContact N-ND2 3.19Å; S144-N814 PolarHBondContact N-OD1 2.96Å; S144-N814 VanDerWaalsContact N-OD1 3.1Å; S144-N814 PolarHBondContact O-OD1 3.41Å; S144-N814 PolarHBondContact OG-ND2 3.31Å
815	S	34.1	Very low	32.6	Very low	106 Å²	106	119.1 Å²	119.1	74%	0.741	68%	0.684	S	S	*	*				159.3	159.1	102.4	66.3	0	0	0	0	116.9
816	S	31.4	Very low	33	Very low	98 Å²	98	119.9 Å²	119.9	69%	0.685	68%	0.683	S	S	*	*			trans	92.4	136	142.8	-55.7	0	0	0	0	121.6
817	Q	36.5	Very low	33.3	Very low	184 Å²	184	117.6 Å²	117.6	86%	0.86	67%	0.672	S	S	*	*			trans	73.9	151.7	160.1	-64.9	175.2	27.7	0	0	119.5
818	S	30.8	Very low	33.8	Very low	84 Å²	84	118.4 Å²	118.4	59%	0.587	67%	0.672	S	S	*	*				175.5	153.2	-50.3	48.3	0	0	0	0	111.9
819	N	32.8	Very low	34.2	Very low	139 Å²	139	117.8 Å²	117.8	74%	0.743	67%	0.668	S	S	*	*			trans	89.8	133.9	152.4	-56.6	-28.3	0	0	0	122.7
820	H	34.6	Very low	34.7	Very low	157 Å²	157	118.7 Å²	118.7	73%	0.727	67%	0.669	S	S	*	*			trans	89.7	120.7	132.1	-89.6	-48.4	0	0	0	124.5
821	L	33.6	Very low	35.2	Very low	145 Å²	145	118.6 Å²	118.6	76%	0.759	67%	0.67	S	S	*	*			trans	74	147.2	143.4	-53.5	165.8	0	0	0	118.1
822	S	33.3	Very low	35.9	Very low	97 Å²	97	120.4 Å²	120.4	68%	0.678	68%	0.681	S	S	*	*			cis	-169	158.5	-13.8	-104.2	0	0	0	0	111.8
823	A	37.1	Very low	36.2	Very low	81 Å²	81	122 Å²	122	67%	0.669	69%	0.69	S	S	*	*			trans	65.6	157	155.8	0	0	0	0	0	118.6
824	E	34.7	Very low	36.4	Very low	179 Å²	179	123.4 Å²	123.4	84%	0.836	69%	0.688	S	S	*	*			cis	-173.4	158.7	-18	-102.3	155	51.6	0	0	105.9
825	V	37.9	Very low	36.9	Very low	104 Å²	104	126.3 Å²	126.3	63%	0.63	70%	0.698	S	S	*	*			cis	-170.1	169.8	-10.8	62.2	0	0	0	0	109
826	H	39.2	Very low	37.1	Very low	153 Å²	153	126.9 Å²	126.9	71%	0.708	69%	0.693	S	S	*	*			trans	71.2	142.6	166.2	-68.6	-39.7	0	0	0	119.1
827	D	37.6	Very low	37.5	Very low	107 Å²	107	127 Å²	127	57%	0.572	69%	0.69	S	S	*	*			cis	-161.9	155.7	-12.8	-124.1	12.9	0	0	0	114.1
828	Q	38.5	Very low	37.4	Very low	166 Å²	166	126.1 Å²	126.1	78%	0.776	69%	0.685	S	S	*	*			trans	59.4	140.7	150.6	-66.2	173.5	55.8	0	0	119.9
829	S	36.2	Very low	37.6	Very low	91 Å²	91	131.6 Å²	131.6	64%	0.636	69%	0.694	S	S	*	*			cis	-171.3	145.5	-5.5	50.1	0	0	0	0	112.1
830	T	40.2	Very low	37.6	Very low	116 Å²	116	130.7 Å²	130.7	71%	0.712	69%	0.689	S	S	*	*			trans	55.9	141.6	144.4	56.8	0	0	0	0	120.7
831	D	39.4	Very low	37.6	Very low	130 Å²	130	130.9 Å²	130.9	70%	0.695	69%	0.69	S	S	*	*			cis	-167.1	154.4	4.1	-113.5	-15.8	0	0	0	112.9
832	T	42.8	Very low	37.4	Very low	109 Å²	109	127.9 Å²	127.9	67%	0.669	68%	0.681	S	S	*	*			trans	60.1	145.7	151.2	61.2	0	0	0	0	120.8
833	D	40.8	Very low	37.4	Very low	120 Å²	120	130.9 Å²	130.9	64%	0.642	68%	0.684	S	S	*	*			cis	-163.8	145.2	-10.5	-110.6	-20.4	0	0	0	112.9
834	Q	41.1	Very low	37.1	Very low	136 Å²	136	132.7 Å²	132.7	64%	0.636	69%	0.686	S	S	*	*			trans	61.9	116.3	134.4	-60.1	179.8	38.3	0	0	120.4
835	H	42.2	Very low	37	Very low	150 Å²	150	131.8 Å²	131.8	69%	0.694	68%	0.682	S	S	*	*				93	147.3	85.1	-75.7	-41	0	0	0	113.7
836	D	38.2	Very low	36.9	Very low	118 Å²	118	133.9 Å²	133.9	63%	0.631	68%	0.684	S	S	*	*			cis	-159.9	168.6	-10.3	-123.2	3.8	0	0	0	114.6
837	T	40.6	Very low	36.8	Very low	101 Å²	101	133 Å²	133	62%	0.62	68%	0.68	S	S	*	*			trans	19.4	116.8	149.7	62.3	0	0	0	0	120.1
838	H	35	Very low	36.7	Very low	165 Å²	165	134.4 Å²	134.4	76%	0.764	68%	0.683	S	S	*	*				87.3	151.2	71.3	-92.8	-84	0	0	0	116.3
839	Y	34.8	Very low	36.6	Very low	200 Å²	200	132.2 Å²	132.2	78%	0.784	68%	0.677	S	S	*	*			trans	69.6	154.9	171.9	-67.6	-89.7	0	0	0	118.4
840	L	33	Very low	36.7	Very low	119 Å²	119	136.2 Å²	136.2	62%	0.623	69%	0.685	S	S	*	*			cis	177.3	154.1	-45.6	-126.8	159.3	0	0	0	107.3
841	H	33.6	Very low	36.7	Very low	162 Å²	162	135 Å²	135	75%	0.75	68%	0.68	S	S	*	*			trans	68	159.9	178.1	-43.4	103.8	0	0	0	114.6
842	S	28.7	Very low	36.6	Very low	81 Å²	81	136.1 Å²	136.1	57%	0.566	68%	0.68	S	S	*	*			cis	-179.9	171.6	-36.5	63.7	0	0	0	0	106.3
843	H	33.6	Very low	36.3	Very low	161 Å²	161	133.5 Å²	133.5	75%	0.745	67%	0.666	S	S	*	*			trans	65.5	97.8	170.3	-66.8	85.4	0	0	0	114.8
844	T	30.3	Very low	36	Very low	118 Å²	118	130.9 Å²	130.9	72%	0.724	65%	0.652	S	S	*	*				77.2	144.4	78.8	59.6	0	0	0	0	115.6
845	H	34.1	Very low	35.8	Very low	160 Å²	160	128.9 Å²	128.9	74%	0.741	65%	0.649	S	S	*	*			trans	86.5	133.4	168.2	-85.5	28.3	0	0	0	119.1
846	H	34.7	Very low	35.5	Very low	148 Å²	148	129.6 Å²	129.6	69%	0.685	65%	0.652	S	S	*	*			trans	70.5	148.9	156	-63.9	3.5	0	0	0	116
847	H	37	Very low	35.3	Very low	135 Å²	135	127.5 Å²	127.5	63%	0.625	64%	0.644	S	S	*	*			cis	-152.5	165.7	-6.9	-131.6	-67.2	0	0	0	110.3
848	H	36.2	Very low	35	Very low	136 Å²	136	130.7 Å²	130.7	63%	0.63	65%	0.652	S	S	*	*			trans	69.7	127	147.1	-81.2	-57.9	0	0	0	122.1
849	D	36.1	Very low	34.9	Very low	121 Å²	121	128.2 Å²	128.2	65%	0.647	65%	0.65	S	S	*	*				88.6	88.6	125	-62.5	-2.4	0	0	0	122.7
850	H	38.1	Very low	34.7	Very low	174 Å²	174	124.9 Å²	124.9	81%	0.806	65%	0.651	S	S	*	*				81.6	152.9	109.7	-99.4	16	0	0	0	118.6
851	P	41	Very low	34.6	Very low	92 Å²	92	126 Å²	126	60%	0.597	66%	0.657	S	S	*	*				-141.1	-113.3	-114.8	40.5	-17.3	0	0	0	111.9
852	H	36.3	Very low	34.4	Very low	153 Å²	153	124.4 Å²	124.4	71%	0.708	65%	0.654	S	S	*	*			trans	66.2	77	-178.2	-72.2	-63.8	0	0	0	114.7
853	S	37.6	Very low	34.5	Very low	54 Å²	54	129.5 Å²	129.5	38%	0.378	67%	0.669	S	S	.	*				87.3	-177.3	73.8	68.6	0	0	0	0	110.5	T171 P172	T171-S853 VanDerWaalsContact CB-O 3.29Å; T171-S853 WeakPolarHBondContact CB-O 3.42Å; P172-S853 WeakPolarHBondContact CD-O 3.27Å; P172-S853 VanDerWaalsContact CG-C 3.45Å
854	N	33.3	Very low	34.2	Very low	64 Å²	64	129.5 Å²	129.5	34%	0.342	67%	0.673	S	S	.	*			trans	91.8	51.2	-170.7	-58	47	0	0	0	128.7	T171 P172 H856	T171-N854 VanDerWaalsContact C-CA 3.42Å; T171-N854 CarbonylContact C-O 3.43Å; P172-N854 WeakPolarHBondContact CA-O 3.42Å; P172-N854 HydrophobicContact CB-CB 3.74Å; P172-N854 WeakPolarHBondContact CB-O 3.41Å; P172-N854 WeakPolarHBondContact CD-O 3.44Å; P172-N854 HydrophobicContact CG-CB 3.93Å; P172-N854 WeakPolarHBondContact CG-O 3.22Å; P172-N854 WeakPolarHBondContact O-CB 3.4Å; P172-N854 VanDerWaalsContact O-CG 3.25Å; P172-N854 PolarHBondContact O-ND2 3Å; N854-H856 PolarHBondContact O-N 3.15Å
855	V	38	Very low	34.2	Very low	95 Å²	95	129.4 Å²	129.4	58%	0.576	68%	0.675	S	S	*	*			trans	-62	132.8	156.1	65.9	0	0	0	0	107.7	P172 T857	P172-V855 VanDerWaalsContact CA-N 3.34Å; P172-V855 WeakPolarHBondContact CB-O 3.45Å; P172-V855 VanDerWaalsContact CD-N 3.27Å; V855-T857 HydrophobicContact CG2-CG2 4.23Å
856	H	34.4	Very low	33.9	Very low	164 Å²	164	133.4 Å²	133.4	76%	0.759	68%	0.683	S	S	*	*				-133.6	102.1	119.1	-102	54.6	0	0	0	107.2	N854	N854-H856 PolarHBondContact O-N 3.15Å
857	T	34	Very low	33.7	Very low	75 Å²	75	135.5 Å²	135.5	46%	0.46	69%	0.693	S	S	.	*				80.4	135.7	89.8	57.9	0	0	0	0	111.3	V855	V855-T857 HydrophobicContact CG2-CG2 4.23Å
858	H	35.2	Very low	33.2	Very low	167 Å²	167	139.3 Å²	139.3	77%	0.773	70%	0.704	S	S	*	*			cis	-171.2	172.1	-4.2	-104.5	-48.2	0	0	0	106.4
859	P	33.2	Very low	32.7	Very low	114 Å²	114	139.8 Å²	139.8	74%	0.74	71%	0.711	S	S	*	*			cis	-122.6	175.7	-38.4	38.6	-24.8	0	0	0	111.4
860	T	31.2	Very low	32.4	Very low	129 Å²	129	143 Å²	143	79%	0.791	72%	0.722	S	S	*	*			trans	-124.6	147.7	-179.4	1.7	0	0	0	0	113.2
861	L	30.2	Very low	31.9	Very low	142 Å²	142	142.6 Å²	142.6	74%	0.743	72%	0.72	S	S	*	*			trans	58.8	130.4	147.5	-72.3	160	0	0	0	121.7
862	N	29.2	Very low	31.3	Very low	129 Å²	129	144.6 Å²	144.6	69%	0.69	72%	0.721	S	S	*	*			trans	46	123	136.3	-61	-2.7	0	0	0	121.1
863	Q	30.7	Very low	30.9	Very low	189 Å²	189	145.8 Å²	145.8	88%	0.883	73%	0.727	S	S	*	*				-163.6	171.8	105.6	-105.7	152.3	104.6	0	0	115.5
864	L	28.1	Very low	30.5	Very low	160 Å²	160	153.8 Å²	153.8	84%	0.838	75%	0.75	S	S	*	*			trans	-63.7	178.9	-179.7	-61.4	136.3	0	0	0	113.2
865	P	29.7	Very low	30.5	Very low	117 Å²	117	155.9 Å²	155.9	76%	0.76	76%	0.758	S	S	*	*			cis	-132.8	-157.7	3.4	43.2	-24.9	0	0	0	114
866	R	26.8	Very low	30.1	Very low	244 Å²	244	155.8 Å²	155.8	92%	0.921	76%	0.761	S	S	*	*			trans	-68.6	130.9	170.9	-70.8	-177.1	173.5	-160	-0.8	112.6
867	Q	30.6	Very low	30	Very low	191 Å²	191	154.3 Å²	154.3	89%	0.893	76%	0.758	S	S	*	*			trans	-138.8	168.9	151.1	-80.8	-160.4	-24.2	0	0	110.9
868	Y	26.5	Very low	30	Very low	216 Å²	216	156.3 Å²	156.3	85%	0.847	77%	0.766	S	S	*	*			trans	-100.4	162.8	-179.2	-114.4	-111.3	0	0	0	111.3
869	N	26.3	Very low	29.8	Very low	145 Å²	145	150.9 Å²	150.9	78%	0.775	75%	0.747	S	S	*	*			trans	79.8	163.9	175.4	-53.2	-34.4	0	0	0	116.7
870	Q	29.8	Very low	29.7	Very low	188 Å²	188	150.1 Å²	150.1	88%	0.879	74%	0.736	S	S	*	*			trans	66.9	103.4	-166.5	-52.8	-177.6	6.2	0	0	111.5
871	H	28.2	Very low	29.9	Very low	166 Å²	166	151.8 Å²	151.8	77%	0.769	73%	0.733	S	S	*	*			cis	67.4	131.6	33.5	-111.9	-94.3	0	0	0	113.7
872	H	28.5	Very low	30.1	Very low	135 Å²	135	149.7 Å²	149.7	63%	0.625	72%	0.722	S	S	*	*			trans	72.1	82.7	-174.7	-54.5	-79.9	0	0	0	118.5	Q875	H872-Q875 PolarHBondContact CE1-OE1 2.72Å; H872-Q875 PolarHBondContact ND1-OE1 3.23Å
873	H	27.9	Very low	30.3	Very low	177 Å²	177	146 Å²	146	82%	0.819	71%	0.707	S	S	*	*	S	Bend	trans	-157.9	36.2	135.8	-122.4	-60.2	0	0	0	116.9
874	Y	28.3	Very low	30.5	Very low	223 Å²	223	143.5 Å²	143.5	88%	0.875	70%	0.695	S	S	*	*	S	Bend	trans	-141.2	41.7	161	-110.3	-70.5	0	0	0	111.7
875	Q	33.6	Very low	30.8	Very low	108 Å²	108	145.2 Å²	145.2	51%	0.505	69%	0.692	S	S	.	*			trans	-118.9	-2.6	-177.3	-126.9	168.9	-3.6	0	0	113.5	H872 S879	H872-Q875 PolarHBondContact CE1-OE1 2.72Å; H872-Q875 PolarHBondContact ND1-OE1 3.23Å; Q875-S879 PolarHBondContact O-N 3.47Å
876	S	29.4	Very low	31.3	Very low	92 Å²	92	143.5 Å²	143.5	64%	0.643	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	18.4	-177.5	-162.7	0	0	0	0	114.4
877	L	31.9	Very low	31.7	Very low	133 Å²	133	136 Å²	136	70%	0.696	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.7	14	165.8	-75.7	175.5	0	0	0	111
878	L	34.3	Very low	32	Very low	117 Å²	117	133.1 Å²	133.1	61%	0.613	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129	-5.7	178.3	-122.6	72	0	0	0	112.1	N882	L878-N882 PolarHBondContact O-ND2 3.36Å
879	S	31.3	Very low	32.3	Very low	54 Å²	54	131 Å²	131	38%	0.378	64%	0.643	S	S	.	*	S	Bend	trans	-63.6	-47	165.2	40	0	0	0	0	111.4	Q875 F881 N882 S883	Q875-S879 PolarHBondContact O-N 3.47Å; S879-F881 VanDerWaalsContact C-N 3.3Å; S879-F881 PolarHBondContact O-N 3.26Å; S879-N882 PolarHBondContact O-N 3.26Å; S879-N882 VanDerWaalsContact O-N 3.09Å; S879-S883 PolarHBondContact O-N 3.35Å
880	D	31.6	Very low	32.8	Very low	97 Å²	97	127.8 Å²	127.8	52%	0.519	63%	0.629	S	S	.	*	H	α-helix	trans	-79.5	-18.1	-162.5	-45.5	-16.2	0	0	0	112.2	S883	D880-S883 PolarHBondContact O-OG 2.96Å
881	F	34.4	Very low	32.9	Very low	164 Å²	164	123.8 Å²	123.8	72%	0.719	61%	0.613	S	S	*	*	H	α-helix	trans	-89.6	-2.3	171.8	-88	-80.6	0	0	0	114.3	S879	S879-F881 VanDerWaalsContact C-N 3.3Å; S879-F881 PolarHBondContact O-N 3.26Å
882	N	34.7	Very low	33.2	Very low	98 Å²	98	121.1 Å²	121.1	52%	0.524	61%	0.609	S	S	.	*	H	α-helix	trans	-113.3	-15.4	178.4	-75.7	-75.6	0	0	0	113.6	L878 S879 T886	L878-N882 PolarHBondContact O-ND2 3.36Å; S879-N882 PolarHBondContact O-N 3.26Å; S879-N882 VanDerWaalsContact O-N 3.09Å; N882-T886 PolarHBondContact O-N 3.22Å; N882-T886 PolarHBondContact O-OG1 3.3Å
883	S	33	Very low	33.4	Very low	53 Å²	53	122.4 Å²	122.4	37%	0.371	62%	0.617	S	S	.	*	H	α-helix	trans	-72	-40	174.4	49.4	0	0	0	0	113.1	S879 D880 T886 N887	S879-S883 PolarHBondContact O-N 3.35Å; D880-S883 PolarHBondContact O-OG 2.96Å; S883-T886 PolarHBondContact O-OG1 2.9Å; S883-N887 WeakPolarHBondContact O-CB 3.41Å; S883-N887 PolarHBondContact O-N 3.39Å; S883-N887 VanDerWaalsContact O-N 3.08Å; S883-N887 PolarHBondContact O-ND2 3.07Å; S883-N887 VanDerWaalsContact O-ND2 3.13Å
884	E	36.1	Very low	33.5	Very low	136 Å²	136	120.9 Å²	120.9	64%	0.636	62%	0.615	S	S	*	*	H	α-helix	trans	-66.5	-44.2	176.9	-64.1	-168.8	134.9	0	0	112.2	T886 N887 L888	E884-T886 VanDerWaalsContact C-N 3.33Å; E884-T886 PolarHBondContact O-N 3.18Å; E884-N887 PolarHBondContact O-N 2.97Å; E884-L888 WeakPolarHBondContact O-CD1 3.35Å; E884-L888 PolarHBondContact O-N 2.89Å; E884-L888 VanDerWaalsContact O-N 3.08Å
885	Y	33.8	Very low	33.4	Very low	196 Å²	196	119.9 Å²	119.9	77%	0.769	61%	0.611	S	S	*	*	H	α-helix	trans	-71.1	-25.4	-178	-117.8	-89.6	0	0	0	113.9
886	T	40.6	Very low	33.2	Very low	80 Å²	80	123.8 Å²	123.8	49%	0.491	63%	0.629	S	S	.	*	H	α-helix	trans	-80.9	-38	172.4	43.9	0	0	0	0	111.8	N882 S883 E884 L888 F889 T890	N882-T886 PolarHBondContact O-N 3.22Å; N882-T886 PolarHBondContact O-OG1 3.3Å; S883-T886 PolarHBondContact O-OG1 2.9Å; E884-T886 VanDerWaalsContact C-N 3.33Å; E884-T886 PolarHBondContact O-N 3.18Å; T886-L888 PolarHBondContact O-N 2.74Å; T886-F889 PolarHBondContact O-N 2.84Å; T886-T890 PolarHBondContact O-N 3.41Å; T886-T890 VanDerWaalsContact O-N 3.09Å; T886-T890 PolarHBondContact O-OG1 2.97Å
887	N	34.8	Very low	33.1	Very low	87 Å²	87	124.9 Å²	124.9	47%	0.465	64%	0.636	S	S	.	*	H	α-helix	trans	-72.4	-20.4	178.2	-75.2	-35.2	0	0	0	114.4	S883 E884 F889 N891	S883-N887 WeakPolarHBondContact O-CB 3.41Å; S883-N887 PolarHBondContact O-N 3.39Å; S883-N887 VanDerWaalsContact O-N 3.08Å; S883-N887 PolarHBondContact O-ND2 3.07Å; S883-N887 VanDerWaalsContact O-ND2 3.13Å; E884-N887 PolarHBondContact O-N 2.97Å; N887-F889 VanDerWaalsContact C-N 3.32Å; N887-N891 WeakPolarHBondContact O-CB 3.45Å; N887-N891 PolarHBondContact O-N 2.65Å; N887-N891 PolarHBondContact O-ND2 2.93Å
888	L	36.3	Very low	32.9	Very low	130 Å²	130	127.4 Å²	127.4	68%	0.681	64%	0.642	S	S	*	*	H	α-helix	trans	-72	-25.8	165.5	-97.9	78.4	0	0	0	113.1	E884 T886 T892	E884-L888 WeakPolarHBondContact O-CD1 3.35Å; E884-L888 PolarHBondContact O-N 2.89Å; E884-L888 VanDerWaalsContact O-N 3.08Å; T886-L888 PolarHBondContact O-N 2.74Å; L888-T892 PolarHBondContact O-OG1 3.46Å
889	F	33.9	Very low	32.7	Very low	173 Å²	173	128.3 Å²	128.3	76%	0.759	65%	0.648	S	S	*	*	H	α-helix	trans	-92.5	-21.4	-175.4	-149.8	-95.7	0	0	0	113.5	T886 N887 T892	T886-F889 PolarHBondContact O-N 2.84Å; N887-F889 VanDerWaalsContact C-N 3.32Å; F889-T892 PolarHBondContact O-OG1 3.4Å
890	T	36.1	Very low	32.6	Very low	77 Å²	77	132.6 Å²	132.6	47%	0.472	67%	0.666	S	S	.	*	H	α-helix	trans	-89.8	-37.6	174.2	51.7	0	0	0	0	112.9	T886 T892 M893	T886-T890 PolarHBondContact O-N 3.41Å; T886-T890 VanDerWaalsContact O-N 3.09Å; T886-T890 PolarHBondContact O-OG1 2.97Å; T890-T892 VanDerWaalsContact C-N 3.27Å; T890-T892 PolarHBondContact O-N 3.12Å; T890-M893 PolarHBondContact O-N 2.91Å
891	N	31.5	Very low	32.4	Very low	103 Å²	103	136.8 Å²	136.8	55%	0.551	68%	0.683	S	S	*	*	G	3₁₀ helix	trans	-73.6	-15.8	-179.2	-71.4	-49.5	0	0	0	113.9	N887 M893	N887-N891 WeakPolarHBondContact O-CB 3.45Å; N887-N891 PolarHBondContact O-N 2.65Å; N887-N891 PolarHBondContact O-ND2 2.93Å; N891-M893 VanDerWaalsContact C-N 3.29Å
892	T	35.5	Very low	32.3	Very low	110 Å²	110	136 Å²	136	68%	0.675	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-82.3	-0.2	173.3	39.7	0	0	0	0	114.2	L888 F889 T890	L888-T892 PolarHBondContact O-OG1 3.46Å; F889-T892 PolarHBondContact O-OG1 3.4Å; T890-T892 VanDerWaalsContact C-N 3.27Å; T890-T892 PolarHBondContact O-N 3.12Å
893	M	32.3	Very low	32	Very low	163 Å²	163	137.4 Å²	137.4	80%	0.803	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-123.9	10.9	-177.7	-84.6	-72.3	176.6	0	0	114.5	T890 N891	T890-M893 PolarHBondContact O-N 2.91Å; N891-M893 VanDerWaalsContact C-N 3.29Å
894	N	30	Very low	32	Very low	144 Å²	144	140.4 Å²	140.4	77%	0.77	71%	0.705	S	S	*	*	S	Bend	trans	-132.6	19.4	-174.7	-117.4	-8.8	0	0	0	114.8
895	Y	26.2	Very low	31.7	Very low	203 Å²	203	139.5 Å²	139.5	80%	0.796	70%	0.704	S	S	*	*			trans	-131.2	77.8	-179.5	-103.8	-82.6	0	0	0	112.1
896	H	30.2	Very low	31.6	Very low	190 Å²	190	140 Å²	140	88%	0.88	71%	0.706	S	S	*	*			trans	-177.5	78.6	138.8	-103.4	66.3	0	0	0	110.3
897	S	26	Very low	31.1	Very low	114 Å²	114	141.5 Å²	141.5	80%	0.797	71%	0.711	S	S	*	*			trans	-143.3	66.3	167.8	176.1	0	0	0	0	109.7
898	F	28.4	Very low	31.1	Very low	187 Å²	187	144.6 Å²	144.6	82%	0.82	73%	0.728	S	S	*	*			trans	-159.6	151.8	161.9	-110.4	-73.5	0	0	0	110.7
899	N	30.7	Very low	31	Very low	136 Å²	136	143.5 Å²	143.5	73%	0.727	73%	0.731	S	S	*	*			trans	69.7	112.8	-178.8	-49.9	-19.3	0	0	0	112.7
900	N	28	Very low	30.9	Very low	144 Å²	144	142.9 Å²	142.9	77%	0.77	73%	0.734	S	S	*	*				56.4	129.3	51.4	-52.5	-16.1	0	0	0	110.7
901	E	27.3	Very low	30.6	Very low	184 Å²	184	144 Å²	144	86%	0.86	75%	0.745	S	S	*	*			cis	-140.7	-166.9	29.1	-65.6	-179.6	115.7	0	0	113.6
902	L	32.9	Very low	30.8	Very low	148 Å²	148	145 Å²	145	78%	0.775	76%	0.757	S	S	*	*			trans	85.8	98.7	166.7	-55	179.3	0	0	0	118.9
903	N	28.6	Very low	30.6	Very low	127 Å²	127	145.6 Å²	145.6	68%	0.679	76%	0.761	S	S	*	*				59.5	136.7	126.6	-66.6	45.5	0	0	0	120.5
904	D	32.4	Very low	30.5	Very low	117 Å²	117	145.6 Å²	145.6	63%	0.626	76%	0.764	S	S	*	*			cis	-153.1	144.7	3.5	-107.6	-41.6	0	0	0	112.4
905	N	29.5	Very low	30.6	Very low	116 Å²	116	143.3 Å²	143.3	62%	0.62	77%	0.765	S	S	*	*			trans	29.3	121.9	153.8	-50.8	-64.1	0	0	0	121.1
906	Y	32.5	Very low	30.8	Very low	208 Å²	208	138.5 Å²	138.5	82%	0.816	76%	0.761	S	S	*	*				-176.8	94.4	95.4	-110.5	-88.6	0	0	0	115
907	N	30.9	Very low	30.9	Very low	111 Å²	111	134.1 Å²	134.1	59%	0.594	75%	0.751	S	S	*	*			trans	54.2	130.7	134.8	-63.8	-40.6	0	0	0	124.9
908	N	33.2	Very low	31.2	Very low	152 Å²	152	134 Å²	134	81%	0.813	75%	0.75	S	S	*	*			trans	71.4	143.7	151.2	-54.1	-27.7	0	0	0	118.4
909	S	33.9	Very low	31.4	Very low	106 Å²	106	129.8 Å²	129.8	74%	0.741	74%	0.744	S	S	*	*			cis	-171.9	173.3	-15.4	60.2	0	0	0	0	107.7
910	L	33.7	Very low	31.6	Very low	160 Å²	160	128.4 Å²	128.4	84%	0.838	75%	0.745	S	S	*	*			cis	-154.3	-164.6	-1	-134.9	173.2	0	0	0	108.8
911	S	29.8	Very low	31.8	Very low	100 Å²	100	126 Å²	126	70%	0.699	74%	0.74	S	S	*	*			trans	-106.4	158.5	-164.5	-47.5	0	0	0	0	117
912	P	35.2	Very low	32	Very low	124 Å²	124	126.6 Å²	126.6	81%	0.805	74%	0.743	S	S	*	*			trans	-105.4	160.8	175.8	39.8	-34.3	0	0	0	115.2
913	T	31.6	Very low	31.9	Very low	123 Å²	123	126 Å²	126	76%	0.755	75%	0.745	S	S	*	*			trans	-150.3	112.5	-174.9	-50.2	0	0	0	0	116.6
914	L	28.8	Very low	31.9	Very low	164 Å²	164	125.4 Å²	125.4	86%	0.859	75%	0.75	S	S	*	*			trans	51.8	150	141.7	-56.9	172.6	0	0	0	126
915	A	32.6	Very low	31.8	Very low	96 Å²	96	124 Å²	124	79%	0.793	75%	0.748	S	S	*	*			trans	75.6	151.5	147.9	0	0	0	0	0	121.3
916	S	30.1	Very low	31.9	Very low	102 Å²	102	124.9 Å²	124.9	71%	0.713	75%	0.753	S	S	*	*			cis	-169.5	161.6	-24.6	58.5	0	0	0	0	113.9
917	S	31.8	Very low	31.7	Very low	97 Å²	97	121.7 Å²	121.7	68%	0.678	75%	0.75	S	S	*	*			trans	68.3	134.7	142.7	56.5	0	0	0	0	125.3
918	S	34.2	Very low	31.7	Very low	111 Å²	111	121 Å²	121	78%	0.776	75%	0.754	S	S	*	*			trans	68.5	153.3	142.9	56	0	0	0	0	122.1
919	S	32.1	Very low	31.5	Very low	99 Å²	99	120.5 Å²	120.5	69%	0.692	75%	0.751	S	S	*	*			cis	-173.6	173.7	-25.8	61.4	0	0	0	0	110.9
920	S	34.8	Very low	31.5	Very low	107 Å²	107	122 Å²	122	75%	0.748	76%	0.757	S	S	*	*			trans	72.4	159.5	156.8	-52	0	0	0	0	118.4
921	S	30.9	Very low	31.6	Very low	95 Å²	95	120.5 Å²	120.5	66%	0.664	75%	0.754	S	S	*	*			cis	171	135.1	-49.5	50.2	0	0	0	0	108.5
922	E	32.9	Very low	31.7	Very low	196 Å²	196	123.1 Å²	123.1	92%	0.916	76%	0.759	S	S	*	*			trans	168.3	166.4	137.3	-96.2	173.7	-170.4	0	0	113.8
923	V	30.6	Very low	31.7	Very low	136 Å²	136	122.5 Å²	122.5	82%	0.824	76%	0.755	S	S	*	*			trans	-135	139.9	-172.8	170.6	0	0	0	0	108.7
924	C	27.7	Very low	31.7	Very low	114 Å²	114	123.5 Å²	123.5	77%	0.77	75%	0.751	S	S	*	*			trans	-175.5	142.9	144.8	-108	0	0	0	0	117
925	S	31.2	Very low	31.8	Very low	86 Å²	86	123.3 Å²	123.3	60%	0.601	74%	0.743	S	S	*	*				77.1	115	129.9	-70.3	0	0	0	0	123.9
926	N	32.1	Very low	31.7	Very low	135 Å²	135	130.5 Å²	130.5	72%	0.722	75%	0.751	S	S	*	*				91.8	111.7	116.8	-63	-6.2	0	0	0	122.6
927	N	28.5	Very low	31.6	Very low	141 Å²	141	131 Å²	131	75%	0.754	76%	0.755	S	S	*	*				67.6	112.5	123.3	-74.9	-8.9	0	0	0	122.5
928	S	30.5	Very low	31.7	Very low	96 Å²	96	131 Å²	131	67%	0.671	76%	0.761	S	S	*	*				114.7	147.2	103.2	72.4	0	0	0	0	120.7
929	N	28.3	Very low	31.5	Very low	142 Å²	142	130.8 Å²	130.8	76%	0.759	76%	0.759	S	S	*	*			trans	65.5	107.8	152.1	-59.7	-23.8	0	0	0	120.1
930	T	34.7	Very low	31.4	Very low	138 Å²	138	133 Å²	133	85%	0.847	76%	0.763	S	S	*	*				170.6	156.7	121.1	37.5	0	0	0	0	110.1
931	T	35.2	Very low	31.3	Very low	128 Å²	128	135.1 Å²	135.1	79%	0.785	76%	0.764	S	S	*	*			cis	-160	148.9	-31.7	-80.6	0	0	0	0	107.5
932	I	31.2	Very low	31.3	Very low	156 Å²	156	139.4 Å²	139.4	80%	0.8	77%	0.774	S	S	*	*			trans	-108.8	147.1	179	34.6	165.6	0	0	0	111.5
933	P	35.8	Very low	31.2	Very low	111 Å²	111	138.5 Å²	138.5	72%	0.721	77%	0.771	S	S	*	*				-155	136.5	100.4	38.3	-18.7	0	0	0	118.8
934	H	32.3	Very low	31.4	Very low	144 Å²	144	140 Å²	140	67%	0.667	77%	0.772	S	S	*	*				71.2	126.5	128.4	-72.5	-17	0	0	0	126.2
935	K	29.6	Very low	31.4	Very low	159 Å²	159	141.3 Å²	141.3	69%	0.691	77%	0.771	S	S	*	*				55.8	121.7	122.1	-58.1	166.2	177.9	157	0	120.5
936	Y	31.6	Very low	31.4	Very low	247 Å²	247	142.5 Å²	142.5	97%	0.969	78%	0.779	S	S	*	*				-142.5	161.7	116.8	-104.3	-79	0	0	0	109.8
937	S	27.6	Very low	31.3	Very low	114 Å²	114	146.4 Å²	146.4	80%	0.797	79%	0.785	S	S	*	*			trans	-145.7	131	-175.2	176.5	0	0	0	0	110.9
938	A	34	Very low	31.6	Very low	97 Å²	97	146.2 Å²	146.2	80%	0.802	78%	0.784	S	S	*	*			trans	-165.6	122.7	158	0	0	0	0	0	112.2
939	S	30.2	Very low	31.7	Very low	106 Å²	106	148 Å²	148	74%	0.741	79%	0.794	S	S	*	*			trans	-27.1	138	163	-42.5	0	0	0	0	118.6
940	N	30.2	Very low	31.9	Very low	146 Å²	146	148.3 Å²	148.3	78%	0.781	79%	0.792	S	S	*	*				-171.5	118.5	119.9	-98.1	-25.1	0	0	0	114.9
941	I	31.3	Very low	32.2	Very low	150 Å²	150	147.2 Å²	147.2	77%	0.769	79%	0.786	S	S	*	*			trans	53	131.2	136.9	-52.2	175.7	0	0	0	120.5
942	H	30.9	Very low	32	Very low	185 Å²	185	150.4 Å²	150.4	86%	0.856	79%	0.789	S	S	*	*			trans	76.5	103.6	166.4	-113	53.5	0	0	0	118.6
943	M	31.2	Very low	32.1	Very low	177 Å²	177	148.7 Å²	148.7	87%	0.872	78%	0.781	S	S	*	*			trans	-142.4	104.5	161.5	-86.3	-171.9	160.5	0	0	110.3
944	M	34.5	Very low	32.1	Very low	168 Å²	168	150.2 Å²	150.2	83%	0.828	78%	0.778	S	S	*	*	S	Bend		-168.9	134.4	125.9	-112.4	-174.5	166.2	0	0	112.2
945	N	29.3	Very low	32.3	Very low	141 Å²	141	151.1 Å²	151.1	75%	0.754	78%	0.783	S	S	*	*	S	Bend	trans	64.9	45	156.6	-56.2	-9.9	0	0	0	119
946	S	29.8	Very low	32.4	Very low	111 Å²	111	151.2 Å²	151.2	78%	0.776	79%	0.788	S	S	*	*			trans	-127.1	115.8	140.3	-75.5	0	0	0	0	109.2
947	Y	31	Very low	32.4	Very low	218 Å²	218	144.8 Å²	144.8	86%	0.855	77%	0.77	S	S	*	*			trans	-141.6	109.4	171.6	-103.2	-78.6	0	0	0	108.2
948	D	35.3	Very low	32.5	Very low	137 Å²	137	146.5 Å²	146.5	73%	0.733	77%	0.769	S	S	*	*			trans	-78.2	135.8	-179.4	-75.5	-65	0	0	0	112.2	M950	D948-M950 HydrophobicContact CB-CB 4.48Å; D948-M950 PolarHBondContact O-N 3.25Å
949	P	32.6	Very low	32.3	Very low	133 Å²	133	148.8 Å²	148.8	86%	0.864	77%	0.768	S	S	*	*	S	Bend	trans	-80.3	57.8	167.9	35.3	-35	0	0	0	110.7
950	M	32.4	Very low	32.4	Very low	148 Å²	148	155.3 Å²	155.3	73%	0.729	78%	0.777	S	S	*	*			trans	-147.2	26	-173.7	-122.6	-56.9	-73.3	0	0	117.8	D948	D948-M950 HydrophobicContact CB-CB 4.48Å; D948-M950 PolarHBondContact O-N 3.25Å
951	T	39.5	Very low	32.4	Very low	116 Å²	116	154.9 Å²	154.9	71%	0.712	77%	0.773	S	S	*	*	S	Bend	trans	-153.2	50.5	165	7.4	0	0	0	0	115.4
952	F	32.6	Very low	32.5	Very low	194 Å²	194	154.3 Å²	154.3	85%	0.851	77%	0.767	S	S	*	*	S	Bend	trans	-158.5	105.2	162	-123.1	-91.3	0	0	0	105.8
953	L	33.2	Very low	32.4	Very low	120 Å²	120	152.3 Å²	152.3	63%	0.628	77%	0.772	S	S	*	*			cis	-110.6	106.9	29.4	-67.8	157.5	0	0	0	114.1
954	Q	35.6	Very low	32.4	Very low	143 Å²	143	148 Å²	148	67%	0.668	75%	0.753	S	S	*	*	S	Bend	trans	-87.9	22.5	153.6	-178.6	53.3	21.1	0	0	110.6
955	E	36	Very low	32.1	Very low	163 Å²	163	146.6 Å²	146.6	76%	0.762	75%	0.749	S	S	*	*	S	Bend	trans	-138.7	32.4	-174.7	-150.5	160.8	-138.3	0	0	113.8
956	M	32.2	Very low	32.3	Very low	161 Å²	161	147.9 Å²	147.9	79%	0.793	75%	0.75	S	S	*	*			trans	-125	39.6	150.5	-75.7	-161.2	178.8	0	0	110.7	L958	M956-L958 PolarHBondContact O-N 3.42Å
957	N	31.8	Very low	32.3	Very low	112 Å²	112	151.7 Å²	151.7	60%	0.599	75%	0.747	S	S	*	*			trans	-93.9	78.6	178.4	-167.2	-4.5	0	0	0	110.8
958	L	29.8	Very low	32.5	Very low	150 Å²	150	148.5 Å²	148.5	79%	0.785	74%	0.74	S	S	*	*	S	Bend	trans	-171.8	150.7	156.5	-100.6	165.1	0	0	0	108.4	M956	M956-L958 PolarHBondContact O-N 3.42Å
959	N	29.2	Very low	32.2	Very low	146 Å²	146	150.2 Å²	150.2	78%	0.781	74%	0.743	S	S	*	*	S	Bend	trans	75.9	36.5	172	-56.1	-20.1	0	0	0	120.4
960	R	31.7	Very low	32.1	Very low	242 Å²	242	148.9 Å²	148.9	91%	0.913	74%	0.735	S	S	*	*	S	Bend	trans	-150.6	39.7	135.2	-152.6	165.9	-76	-134.1	0.7	115.2
961	I	30.9	Very low	32.2	Very low	138 Å²	138	147.6 Å²	147.6	71%	0.708	73%	0.732	S	S	*	*	S	Bend	trans	-123.3	124	159.9	-62.1	178.6	0	0	0	106.4
962	H	32.8	Very low	31.6	Very low	137 Å²	137	149.3 Å²	149.3	63%	0.634	74%	0.736	S	S	*	*			trans	66.1	140.9	-168.4	-53.9	-18.2	0	0	0	112.6	N964	H962-N964 HydrophobicContact CB-CB 3.98Å; H962-N964 PolarHBondContact CE1-ND2 2.68Å; H962-N964 PolarHBondContact NE2-ND2 2.95Å; H962-N964 VanDerWaalsContact NE2-ND2 3.17Å
963	C	29.5	Very low	31.6	Very low	143 Å²	143	147.3 Å²	147.3	97%	0.966	73%	0.731	S	S	*	*			cis	-27.7	100.1	16.3	-53.6	0	0	0	0	117.7
964	N	30.6	Very low	31.4	Very low	87 Å²	87	149 Å²	149	47%	0.465	74%	0.741	S	S	.	*			trans	-94.2	164.4	160.9	-151.9	-17	0	0	0	108.9	H962 H966	H962-N964 HydrophobicContact CB-CB 3.98Å; H962-N964 PolarHBondContact CE1-ND2 2.68Å; H962-N964 PolarHBondContact NE2-ND2 2.95Å; H962-N964 VanDerWaalsContact NE2-ND2 3.17Å; N964-H966 PolarHBondContact O-N 3.39Å
965	N	28.1	Very low	31.3	Very low	139 Å²	139	147.2 Å²	147.2	74%	0.743	74%	0.74	S	S	*	*	S	Bend	trans	-42.9	113.5	162.3	-59.5	-85.9	0	0	0	112.4
966	H	34.2	Very low	30.9	Very low	168 Å²	168	145.1 Å²	145.1	78%	0.778	74%	0.739	S	S	*	*			trans	168.5	141.7	154.9	-97.8	38.1	0	0	0	106.5	N964	N964-H966 PolarHBondContact O-N 3.39Å
967	R	29.6	Very low	30.9	Very low	191 Å²	191	143.5 Å²	143.5	72%	0.721	74%	0.738	S	S	*	*			cis	-162.8	145.3	0.9	-150.4	174.7	-177.3	178	1.4	102.8
968	H	34.9	Very low	30.8	Very low	151 Å²	151	143.4 Å²	143.4	70%	0.699	75%	0.746	S	S	*	*			cis	-158.1	155.4	47.4	-69.2	-104.9	0	0	0	106.3
969	H	28.7	Very low	31	Very low	172 Å²	172	142 Å²	142	80%	0.796	74%	0.744	S	S	*	*			cis	77.1	53.9	26.8	-134.6	96.4	0	0	0	116.3
970	C	31.2	Very low	31.2	Very low	105 Å²	105	140.3 Å²	140.3	71%	0.709	74%	0.739	S	S	*	*			trans	-145.6	113.6	147.8	49.4	0	0	0	0	107.1
971	N	33.7	Very low	31.4	Very low	122 Å²	122	135 Å²	135	65%	0.652	73%	0.729	S	S	*	*				56.8	103.3	87.5	-56.1	-2.7	0	0	0	109.4
972	N	27.4	Very low	31.5	Very low	151 Å²	151	135.7 Å²	135.7	81%	0.807	73%	0.731	S	S	*	*				35.6	75.3	55.7	-165.5	12.3	0	0	0	112.6
973	M	33.1	Very low	31.6	Very low	152 Å²	152	134.2 Å²	134.2	75%	0.749	73%	0.732	S	S	*	*			trans	-146	117.5	161.7	-98.5	-64.3	171.1	0	0	109.7	T975	M973-T975 PolarHBondContact O-N 3.21Å
974	N	28.6	Very low	31.8	Very low	155 Å²	155	133 Å²	133	83%	0.829	72%	0.72	S	S	*	*			trans	-84.2	96.8	169	-76.3	-32.9	0	0	0	109.8
975	T	32.7	Very low	32.1	Very low	107 Å²	107	134.3 Å²	134.3	66%	0.656	73%	0.731	S	S	*	*			trans	-160	104.8	161	42	0	0	0	0	108.2	M973	M973-T975 PolarHBondContact O-N 3.21Å
976	T	28.1	Very low	32.6	Very low	118 Å²	118	133.1 Å²	133.1	72%	0.724	73%	0.729	S	S	*	*				64.1	138.7	82.1	62.9	0	0	0	0	115.5
977	T	31.5	Very low	32.8	Very low	128 Å²	128	130.8 Å²	130.8	79%	0.785	72%	0.722	S	S	*	*			trans	83	111.3	-176	70.4	0	0	0	0	114.1
978	S	30.5	Very low	33.4	Very low	110 Å²	110	127.4 Å²	127.4	77%	0.769	72%	0.719	S	S	*	*				80	133.8	78.6	-56.9	0	0	0	0	111.2
979	T	33.4	Very low	33.7	Very low	119 Å²	119	126.2 Å²	126.2	73%	0.73	72%	0.718	S	S	*	*			cis	-149.5	156.4	31.2	46.6	0	0	0	0	113.8
980	T	35	Very low	34	Very low	111 Å²	111	122.6 Å²	122.6	68%	0.681	71%	0.711	S	S	*	*			trans	49.8	121.5	145.6	56.8	0	0	0	0	119.3
981	N	34.8	Very low	34.4	Very low	131 Å²	131	123.3 Å²	123.3	70%	0.701	71%	0.712	S	S	*	*				-156.6	148.9	59.2	-92.3	-48	0	0	0	114.4
982	M	33.6	Very low	34.8	Very low	153 Å²	153	122 Å²	122	75%	0.754	71%	0.713	S	S	*	*			trans	35.5	130.1	136.6	-48.3	-51.3	-179.4	0	0	119.7
983	T	34.6	Very low	35.4	Very low	106 Å²	106	120.8 Å²	120.8	65%	0.65	71%	0.706	S	S	*	*			cis	-166.9	148.9	7.9	5.6	0	0	0	0	110.4
984	T	34.4	Very low	35.8	Very low	118 Å²	118	118.8 Å²	118.8	72%	0.724	70%	0.699	S	S	*	*			trans	53.3	134.4	150.2	57.2	0	0	0	0	119.5
985	T	35.4	Very low	36.4	Very low	114 Å²	114	117.3 Å²	117.3	70%	0.699	69%	0.691	S	S	*	*			cis	-166.7	144.8	14.9	-1.9	0	0	0	0	110.8
986	T	38.7	Very low	36.8	Very low	113 Å²	113	117.3 Å²	117.3	69%	0.693	69%	0.687	S	S	*	*			trans	36.4	140.4	141.6	55.7	0	0	0	0	121.3
987	N	39.1	Very low	37.4	Very low	120 Å²	120	118.8 Å²	118.8	64%	0.642	69%	0.685	S	S	*	*			cis	-168.8	153.3	26.8	-121	-2	0	0	0	112.5
988	N	41.8	Very low	37.8	Very low	120 Å²	120	118 Å²	118	64%	0.642	68%	0.676	S	S	*	*			trans	55.6	141.6	139.1	-59.1	-5.5	0	0	0	120.7
989	N	40.9	Very low	38.3	Very low	126 Å²	126	118.6 Å²	118.6	67%	0.674	67%	0.67	S	S	*	*			cis	-150.5	140.9	2.4	-96.8	-21.1	0	0	0	107.5
990	S	36.1	Very low	38.6	Very low	95 Å²	95	119.6 Å²	119.6	66%	0.664	67%	0.671	S	S	*	*				50.8	134.4	77.6	78.1	0	0	0	0	113.4
991	V	40	Very low	38.7	Very low	120 Å²	120	119.4 Å²	119.4	73%	0.727	68%	0.675	S	S	*	*			cis	-153	127.8	43.4	165.8	0	0	0	0	108.4
992	S	40.2	Very low	38.8	Very low	96 Å²	96	117.1 Å²	117.1	67%	0.671	68%	0.682	S	S	*	*				58.7	119.6	93.9	-113.9	0	0	0	0	114.6
993	N	40.3	Very low	38.9	Very low	124 Å²	124	115.2 Å²	115.2	66%	0.663	68%	0.684	S	S	*	*				148.5	161.3	89	-91.3	-6.2	0	0	0	107
994	N	42.2	Very low	39.1	Very low	111 Å²	111	119.4 Å²	119.4	59%	0.594	69%	0.693	S	S	*	*			cis	-169.9	157	-10	-110.4	-3.2	0	0	0	110.7
995	N	41.7	Very low	39.1	Very low	124 Å²	124	121.6 Å²	121.6	66%	0.663	70%	0.695	S	S	*	*			trans	66.8	155.2	142.2	-63.9	7.6	0	0	0	119.4
996	N	40.5	Very low	39	Very low	107 Å²	107	121.8 Å²	121.8	57%	0.572	70%	0.696	S	S	*	*			cis	-162	155.3	-4.8	-117.7	3.3	0	0	0	112
997	H	41.5	Very low	38.8	Very low	149 Å²	149	123.7 Å²	123.7	69%	0.69	70%	0.699	S	S	*	*			trans	58.3	152.5	146.9	-65.4	-40.2	0	0	0	120
998	N	39.9	Very low	38.5	Very low	110 Å²	110	125 Å²	125	59%	0.588	71%	0.705	S	S	*	*			cis	-155.4	160.9	-6	-121.1	9.3	0	0	0	112.5
999	D	40.6	Very low	37.8	Very low	123 Å²	123	126.4 Å²	126.4	66%	0.658	71%	0.708	S	S	*	*			trans	21.4	148.5	137.4	-44	-24.8	0	0	0	120.6
1000	N	38.8	Very low	37.6	Very low	140 Å²	140	126.4 Å²	126.4	75%	0.749	72%	0.715	S	S	*	*			cis	-163.8	158.2	27.4	-146.4	-24.6	0	0	0	115
1001	S	37.4	Very low	37.5	Very low	108 Å²	108	129.4 Å²	129.4	76%	0.755	72%	0.717	S	S	*	*			trans	41.5	116.7	150.4	64.5	0	0	0	0	122.2
1002	G	36.7	Very low	37.1	Very low	83 Å²	83	130 Å²	130	86%	0.856	72%	0.716	S	S	*	*			trans	-175.4	100.5	160.8	0	0	0	0	0	113.5
1003	S	35.6	Very low	36.8	Very low	112 Å²	112	136.1 Å²	136.1	78%	0.783	72%	0.724	S	S	*	*			trans	-104.1	128.9	-170.3	-180	0	0	0	0	114.4
1004	K	40.1	Very low	36.4	Very low	194 Å²	194	138.8 Å²	138.8	84%	0.843	73%	0.733	S	S	*	*			trans	-174.7	116.3	135.6	-101.8	155.2	-174	175.8	0	113.8
1005	H	33.9	Very low	36.1	Very low	165 Å²	165	139.2 Å²	139.2	76%	0.764	74%	0.74	S	S	*	*			trans	36.6	135.7	145.8	-79.4	-88.5	0	0	0	123.9
1006	T	33.8	Very low	36	Very low	118 Å²	118	137.3 Å²	137.3	72%	0.724	73%	0.733	S	S	*	*			trans	79.8	107.9	142.6	46.4	0	0	0	0	122
1007	M	33.9	Very low	36	Very low	153 Å²	153	138 Å²	138	75%	0.754	74%	0.743	S	S	*	*			trans	74.3	97.1	138.4	-56.9	-53.7	-157.9	0	0	120.9
1008	N	33.6	Very low	35.7	Very low	146 Å²	146	139.1 Å²	139.1	78%	0.781	74%	0.742	S	S	*	*				56.2	132.2	124.7	-56.1	-2.6	0	0	0	121.5
1009	E	26.9	Very low	36	Very low	150 Å²	150	138 Å²	138	70%	0.701	74%	0.736	S	S	*	*			trans	-55.7	166.7	155.1	-58.6	-178.3	106.3	0	0	112.6	F1011	E1009-F1011 WeakPolarHBondContact OE1-CE2 3.17Å; E1009-F1011 WeakPolarHBondContact OE2-CD2 3.49Å; E1009-F1011 WeakPolarHBondContact OE2-CE2 3.5Å
1010	P	35.1	Very low	36.2	Very low	127 Å²	127	138.4 Å²	138.4	83%	0.825	74%	0.738	S	S	*	*				-125.9	138.9	110	35.4	-32.4	0	0	0	114.6
1011	F	34.1	Very low	36.5	Very low	157 Å²	157	137.6 Å²	137.6	69%	0.689	73%	0.733	S	S	*	*			trans	-50.5	140.1	167.3	-99	-123.7	0	0	0	113.4	E1009	E1009-F1011 WeakPolarHBondContact OE1-CE2 3.17Å; E1009-F1011 WeakPolarHBondContact OE2-CD2 3.49Å; E1009-F1011 WeakPolarHBondContact OE2-CE2 3.5Å
1012	N	31.9	Very low	37	Very low	133 Å²	133	138.5 Å²	138.5	71%	0.711	73%	0.725	S	S	*	*			trans	19.5	107.7	133.8	-175.3	8.4	0	0	0	117.1
1013	R	33.6	Very low	37.6	Very low	224 Å²	224	140.2 Å²	140.2	85%	0.845	71%	0.711	S	S	*	*			trans	-132	118.3	152.2	-74.6	-168.7	-179.7	-115.9	-0.3	111	T1015	R1013-T1015 PolarHBondContact O-N 2.98Å
1014	Q	33.5	Very low	38.3	Very low	181 Å²	181	137.4 Å²	137.4	85%	0.846	69%	0.691	S	S	*	*			trans	-62.6	109.1	159.9	-66.1	170	-18.9	0	0	108.7
1015	T	35	Very low	39.2	Very low	120 Å²	120	132.4 Å²	132.4	74%	0.736	67%	0.673	S	S	*	*			trans	-88	113.5	172.3	45.1	0	0	0	0	109.5	R1013	R1013-T1015 PolarHBondContact O-N 2.98Å
1016	T	39.8	Very low	40.7	Very low	84 Å²	84	129.6 Å²	129.6	52%	0.515	66%	0.664	S	S	.	*			trans	-65.2	149.1	175.7	50.3	0	0	0	0	110.8	Y1018	T1016-Y1018 PolarHBondContact O-N 3.34Å
1017	P	40.1	Very low	42	Very low	121 Å²	121	131.2 Å²	131.2	79%	0.786	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	10	-177.1	29.3	-36.5	0	0	0	114.6
1018	Y	35.8	Very low	43.7	Very low	172 Å²	172	129.8 Å²	129.8	68%	0.675	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-16.3	-179.4	-79.2	-82	0	0	0	114.1	T1016	T1016-Y1018 PolarHBondContact O-N 3.34Å
1019	N	45.9	Very low	45.3	Very low	86 Å²	86	129.3 Å²	129.3	46%	0.46	65%	0.651	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85	-8.5	-173.3	-63.7	-16	0	0	0	114.7
1020	L	44.9	Very low	47.1	Very low	132 Å²	132	124.6 Å²	124.6	69%	0.691	64%	0.637	S	S	*	*	H	α-helix	trans	-75.2	-29.2	-176.9	-152.9	71.5	0	0	0	112.7	E1022 Q1023 S1024	L1020-E1022 VanDerWaalsContact C-N 3.3Å; L1020-E1022 PolarHBondContact O-N 3.43Å; L1020-Q1023 PolarHBondContact O-N 2.97Å; L1020-S1024 PolarHBondContact O-N 3.48Å
1021	L	45.1	Very low	48.6	Very low	123 Å²	123	121.3 Å²	121.3	64%	0.644	62%	0.621	S	S	*	*	H	α-helix	trans	-72.2	-24.3	178.8	-168.7	65.3	0	0	0	112.7	S1024 N1025	L1021-S1024 WeakPolarHBondContact CA-OG 3.3Å; L1021-S1024 PolarHBondContact O-OG 3.21Å; L1021-N1025 VanDerWaalsContact O-CG 3.25Å; L1021-N1025 PolarHBondContact O-N 3.17Å; L1021-N1025 PolarHBondContact O-ND2 3.03Å
1022	E	48.1	Very low	50.2	Low	128 Å²	128	116.8 Å²	116.8	60%	0.598	61%	0.612	S	S	*	*	H	α-helix	trans	-74.7	-36.5	175.9	-164.2	166.7	-133.9	0	0	111.2	L1020 N1025 N1026	L1020-E1022 VanDerWaalsContact C-N 3.3Å; L1020-E1022 PolarHBondContact O-N 3.43Å; E1022-N1025 PolarHBondContact O-N 3.45Å; E1022-N1026 PolarHBondContact O-N 3.23Å; E1022-N1026 VanDerWaalsContact O-N 3.15Å; E1022-N1026 PolarHBondContact O-ND2 3.48Å
1023	Q	49.4	Very low	52	Low	119 Å²	119	115 Å²	115	56%	0.556	61%	0.607	S	S	*	*	H	α-helix	trans	-66.6	-42	172.6	-70.3	-169.8	-3.8	0	0	112.6	L1020 N1025 N1026 F1027	L1020-Q1023 PolarHBondContact O-N 2.97Å; Q1023-N1025 VanDerWaalsContact C-N 3.28Å; Q1023-N1025 PolarHBondContact O-N 3.18Å; Q1023-N1026 PolarHBondContact O-N 3.14Å; Q1023-F1027 WeakPolarHBondContact O-CD2 3.46Å; Q1023-F1027 PolarHBondContact O-N 3.5Å
1024	S	50.2	Low	53.8	Low	53 Å²	53	109 Å²	109	37%	0.371	59%	0.594	S	S	.	*	H	α-helix	trans	-61.4	-36.8	177.7	54	0	0	0	0	112.6	L1020 L1021 L1028	L1020-S1024 PolarHBondContact O-N 3.48Å; L1021-S1024 WeakPolarHBondContact CA-OG 3.3Å; L1021-S1024 PolarHBondContact O-OG 3.21Å; S1024-L1028 WeakPolarHBondContact O-CB 3.48Å; S1024-L1028 PolarHBondContact O-N 2.95Å
1025	N	58.2	Low	55.4	Low	88 Å²	88	104 Å²	104	47%	0.471	58%	0.584	S	S	.	*	H	α-helix	trans	-68.1	-41.9	176.3	-67.5	-18	0	0	0	111.6	L1021 E1022 Q1023 L1028 M1029	L1021-N1025 VanDerWaalsContact O-CG 3.25Å; L1021-N1025 PolarHBondContact O-N 3.17Å; L1021-N1025 PolarHBondContact O-ND2 3.03Å; E1022-N1025 PolarHBondContact O-N 3.45Å; Q1023-N1025 VanDerWaalsContact C-N 3.28Å; Q1023-N1025 PolarHBondContact O-N 3.18Å; N1025-L1028 PolarHBondContact O-N 3.41Å; N1025-M1029 PolarHBondContact O-N 3.31Å
1026	N	65.1	Low	56.8	Low	107 Å²	107	102.3 Å²	102.3	57%	0.572	58%	0.582	S	S	*	*	H	α-helix	trans	-64.9	-39.3	176.3	-71.6	-29	0	0	0	112.5	E1022 Q1023 M1029 A1030	E1022-N1026 PolarHBondContact O-N 3.23Å; E1022-N1026 VanDerWaalsContact O-N 3.15Å; E1022-N1026 PolarHBondContact O-ND2 3.48Å; Q1023-N1026 PolarHBondContact O-N 3.14Å; N1026-M1029 PolarHBondContact O-N 3.43Å; N1026-A1030 WeakPolarHBondContact O-CB 3.4Å; N1026-A1030 PolarHBondContact O-N 3.03Å
1027	F	62.2	Low	57.9	Low	152 Å²	152	102.2 Å²	102.2	67%	0.667	59%	0.59	S	S	*	*	H	α-helix	trans	-66.2	-37.5	172.7	-90.4	-77.5	0	0	0	112.7	Q1023 A1030 A1031	Q1023-F1027 WeakPolarHBondContact O-CD2 3.46Å; Q1023-F1027 PolarHBondContact O-N 3.5Å; F1027-A1030 PolarHBondContact O-N 3.22Å; F1027-A1031 VanDerWaalsContact O-CB 3.26Å; F1027-A1031 WeakPolarHBondContact O-CB 3.46Å; F1027-A1031 PolarHBondContact O-N 3.48Å
1028	L	68.6	Low	58.8	Low	123 Å²	123	99.9 Å²	99.9	64%	0.644	58%	0.581	S	S	*	*	H	α-helix	trans	-66.1	-41.9	174.2	-108.2	164.5	0	0	0	112.3	S1024 N1025 A1031 A1032	S1024-L1028 WeakPolarHBondContact O-CB 3.48Å; S1024-L1028 PolarHBondContact O-N 2.95Å; N1025-L1028 PolarHBondContact O-N 3.41Å; L1028-A1031 PolarHBondContact O-N 3.19Å; L1028-A1032 VanDerWaalsContact O-CB 3.32Å; L1028-A1032 WeakPolarHBondContact O-CB 3.38Å; L1028-A1032 PolarHBondContact O-N 2.96Å
1029	M	68.3	Low	59.3	Low	136 Å²	136	94.2 Å²	94.2	67%	0.67	58%	0.575	S	S	*	*	H	α-helix	trans	-62.4	-45.9	173.3	-118.7	71.3	-175	0	0	111.3	N1025 N1026 A1032 V1033	N1025-M1029 PolarHBondContact O-N 3.31Å; N1026-M1029 PolarHBondContact O-N 3.43Å; M1029-A1032 PolarHBondContact O-N 3.11Å; M1029-V1033 WeakPolarHBondContact O-CB 3.48Å; M1029-V1033 WeakPolarHBondContact O-CG2 3.38Å; M1029-V1033 PolarHBondContact O-N 3.33Å
1030	A	64.7	Low	59.6	Low	50 Å²	50	95.6 Å²	95.6	41%	0.413	59%	0.591	S	S	.	*	H	α-helix	trans	-63.1	-43.7	177.9	0	0	0	0	0	112	N1026 F1027 V1033 V1034	N1026-A1030 WeakPolarHBondContact O-CB 3.4Å; N1026-A1030 PolarHBondContact O-N 3.03Å; F1027-A1030 PolarHBondContact O-N 3.22Å; A1030-V1033 PolarHBondContact O-N 3.09Å; A1030-V1034 WeakPolarHBondContact O-CB 3.38Å; A1030-V1034 VanDerWaalsContact O-CG2 3.3Å; A1030-V1034 WeakPolarHBondContact O-CG2 3.33Å; A1030-V1034 PolarHBondContact O-N 3.49Å
1031	A	67.5	Low	60	Low	59 Å²	59	96 Å²	96	49%	0.488	60%	0.599	S	S	.	*	H	α-helix	trans	-63.9	-39.9	175.9	0	0	0	0	0	112.1	F1027 L1028 V1034 A1035	F1027-A1031 VanDerWaalsContact O-CB 3.26Å; F1027-A1031 WeakPolarHBondContact O-CB 3.46Å; F1027-A1031 PolarHBondContact O-N 3.48Å; L1028-A1031 PolarHBondContact O-N 3.19Å; A1031-V1034 PolarHBondContact O-N 3.06Å; A1031-A1035 VanDerWaalsContact O-CB 3.24Å; A1031-A1035 WeakPolarHBondContact O-CB 3.45Å; A1031-A1035 PolarHBondContact O-N 3.47Å
1032	A	67.7	Low	59.9	Low	61 Å²	61	94.4 Å²	94.4	50%	0.504	60%	0.596	S	S	.	*	H	α-helix	trans	-66.3	-41	175.2	0	0	0	0	0	112.4	L1028 M1029 A1035 A1036	L1028-A1032 VanDerWaalsContact O-CB 3.32Å; L1028-A1032 WeakPolarHBondContact O-CB 3.38Å; L1028-A1032 PolarHBondContact O-N 2.96Å; M1029-A1032 PolarHBondContact O-N 3.11Å; A1032-A1035 PolarHBondContact O-N 3.37Å; A1032-A1036 WeakPolarHBondContact O-CB 3.3Å; A1032-A1036 PolarHBondContact O-N 3.46Å
1033	V	69.1	Low	59.9	Low	97 Å²	97	95.8 Å²	95.8	59%	0.588	61%	0.608	S	S	*	*	H	α-helix	trans	-67.4	-41.2	175.5	169.7	0	0	0	0	111.3	M1029 A1030 A1036 A1037	M1029-V1033 WeakPolarHBondContact O-CB 3.48Å; M1029-V1033 WeakPolarHBondContact O-CG2 3.38Å; M1029-V1033 PolarHBondContact O-N 3.33Å; A1030-V1033 PolarHBondContact O-N 3.09Å; V1033-A1036 PolarHBondContact O-N 2.75Å; V1033-A1037 VanDerWaalsContact O-CB 3.24Å; V1033-A1037 WeakPolarHBondContact O-CB 3.46Å; V1033-A1037 PolarHBondContact O-N 3.48Å
1034	V	70.4	Confident	60	Low	96 Å²	96	97.9 Å²	97.9	58%	0.582	62%	0.623	S	S	*	*	H	α-helix	trans	-67	-40.2	175.2	170.7	0	0	0	0	111.2	A1030 A1031 A1036 A1037 A1038	A1030-V1034 WeakPolarHBondContact O-CB 3.38Å; A1030-V1034 VanDerWaalsContact O-CG2 3.3Å; A1030-V1034 WeakPolarHBondContact O-CG2 3.33Å; A1030-V1034 PolarHBondContact O-N 3.49Å; A1031-V1034 PolarHBondContact O-N 3.06Å; V1034-A1036 VanDerWaalsContact C-N 3.31Å; V1034-A1036 PolarHBondContact O-N 3.25Å; V1034-A1037 PolarHBondContact O-N 3.07Å; V1034-A1038 WeakPolarHBondContact O-CB 3.44Å; V1034-A1038 PolarHBondContact O-N 3.03Å
1035	A	66.9	Low	59.8	Low	76 Å²	76	102 Å²	102	63%	0.628	64%	0.64	S	S	*	*	H	α-helix	trans	-65.7	-32	174.7	0	0	0	0	0	112.9	A1031 A1032	A1031-A1035 VanDerWaalsContact O-CB 3.24Å; A1031-A1035 WeakPolarHBondContact O-CB 3.45Å; A1031-A1035 PolarHBondContact O-N 3.47Å; A1032-A1035 PolarHBondContact O-N 3.37Å
1036	A	65.4	Low	59	Low	85 Å²	85	105.2 Å²	105.2	70%	0.702	66%	0.657	S	S	*	*	H	α-helix	trans	-76.2	-34.3	172.9	0	0	0	0	0	112.9	A1032 V1033 V1034	A1032-A1036 WeakPolarHBondContact O-CB 3.3Å; A1032-A1036 PolarHBondContact O-N 3.46Å; V1033-A1036 PolarHBondContact O-N 2.75Å; V1034-A1036 VanDerWaalsContact C-N 3.31Å; V1034-A1036 PolarHBondContact O-N 3.25Å
1037	A	63.5	Low	58.2	Low	83 Å²	83	107 Å²	107	69%	0.686	67%	0.665	S	S	*	*	H	α-helix	trans	-80.6	-28.9	179.2	0	0	0	0	0	113.3	V1033 V1034 G1039	V1033-A1037 VanDerWaalsContact O-CB 3.24Å; V1033-A1037 WeakPolarHBondContact O-CB 3.46Å; V1033-A1037 PolarHBondContact O-N 3.48Å; V1034-A1037 PolarHBondContact O-N 3.07Å; A1037-G1039 PolarHBondContact O-N 3.06Å; A1037-G1039 VanDerWaalsContact O-N 3.08Å
1038	A	57.8	Low	57.5	Low	72 Å²	72	102.8 Å²	102.8	60%	0.595	66%	0.655	S	S	*	*	S	Bend	trans	-80.6	32.5	175.8	0	0	0	0	0	113.1	V1034	V1034-A1038 WeakPolarHBondContact O-CB 3.44Å; V1034-A1038 PolarHBondContact O-N 3.03Å
1039	G	47	Very low	56.3	Low	52 Å²	52	103.9 Å²	103.9	54%	0.536	67%	0.667	S	S	.	*			trans	-60.8	156.9	168.3	0	0	0	0	0	111.6	A1037	A1037-G1039 PolarHBondContact O-N 3.06Å; A1037-G1039 VanDerWaalsContact O-N 3.08Å
1040	S	52	Low	55.2	Low	115 Å²	115	100 Å²	100	80%	0.804	66%	0.662	S	S	*	*			trans	82.8	57.2	177.1	-48.4	0	0	0	0	118
1041	T	52.3	Low	54.8	Low	141 Å²	141	104.8 Å²	104.8	87%	0.865	68%	0.68	S	S	*	*			trans	-119.3	82.5	135.5	56.8	0	0	0	0	110.3
1042	P	44.2	Very low	54.4	Low	89 Å²	89	107.2 Å²	107.2	58%	0.578	69%	0.691	S	S	*	*			trans	-81.9	117.6	176.9	32.2	-29.7	0	0	0	110	L1045	P1042-L1045 HydrophobicContact CB-CD1 4.21Å
1043	N	48	Very low	54.1	Low	158 Å²	158	110.6 Å²	110.6	85%	0.845	71%	0.705	S	S	*	*			trans	-156.1	-14	163.5	-106.5	-16.1	0	0	0	115.6	L1045	N1043-L1045 PolarHBondContact O-N 3.1Å
1044	D	50.6	Low	53.9	Low	163 Å²	163	116.8 Å²	116.8	87%	0.872	72%	0.718	S	S	*	*			trans	-80	52.7	166.9	-68.5	-50.2	0	0	0	112	N1046	D1044-N1046 PolarHBondContact O-N 3.38Å
1045	L	46.5	Very low	53.6	Low	140 Å²	140	123.8 Å²	123.8	73%	0.733	73%	0.734	S	S	*	*			trans	-100.6	69.1	-179.2	-75.1	175.3	0	0	0	112	P1042 N1043	P1042-L1045 HydrophobicContact CB-CD1 4.21Å; N1043-L1045 PolarHBondContact O-N 3.1Å
1046	N	41.5	Very low	54.1	Low	154 Å²	154	127.8 Å²	127.8	82%	0.824	74%	0.74	S	S	*	*			trans	-131.5	46	157.7	-162.2	8	0	0	0	111.7	D1044 S1048	D1044-N1046 PolarHBondContact O-N 3.38Å; N1046-S1048 PolarHBondContact O-N 2.77Å; N1046-S1048 VanDerWaalsContact O-N 3.16Å
1047	I	48.9	Very low	54.7	Low	144 Å²	144	134.5 Å²	134.5	74%	0.738	75%	0.747	S	S	*	*			trans	-76.6	96.5	164.9	-61.5	178.9	0	0	0	107
1048	S	46.3	Very low	55.5	Low	65 Å²	65	141.8 Å²	141.8	46%	0.455	76%	0.757	S	S	.	*			trans	-51.6	144.4	168.1	-177.1	0	0	0	0	110.1	Y790 N1046 G1050	Y790-S1048 PolarHBondContact OH-OG 3.49Å; N1046-S1048 PolarHBondContact O-N 2.77Å; N1046-S1048 VanDerWaalsContact O-N 3.16Å; S1048-G1050 PolarHBondContact O-N 3.28Å
1049	T	43.8	Very low	56.8	Low	146 Å²	146	145.3 Å²	145.3	90%	0.896	76%	0.761	S	S	*	*	S	Bend	trans	-60.5	93.6	-169.1	48.5	0	0	0	0	112.6
1050	G	46	Very low	58.8	Low	55 Å²	55	153.5 Å²	153.5	57%	0.567	78%	0.775	S	S	*	*			trans	-142.6	137.6	174.8	0	0	0	0	0	109.7	S1048	S1048-G1050 PolarHBondContact O-N 3.28Å
1051	N	56.3	Low	60.6	Low	149 Å²	149	149.9 Å²	149.9	80%	0.797	75%	0.749	S	S	*	*			trans	-51.6	139.7	-178.2	-79.3	-58.6	0	0	0	111.4	V1053	N1051-V1053 PolarHBondContact O-N 2.74Å
1052	P	58.8	Low	62.5	Low	110 Å²	110	149.2 Å²	149.2	71%	0.714	75%	0.745	S	S	*	*			trans	-57.1	113.5	172.5	24.8	-33.3	0	0	0	108.1	R1054	P1052-R1054 VanDerWaalsContact C-N 3.31Å; P1052-R1054 PolarHBondContact O-N 2.71Å
1053	V	60.3	Low	65	Low	133 Å²	133	147.6 Å²	147.6	81%	0.806	73%	0.729	S	S	*	*			trans	-66.9	92.7	-170.1	-178.7	0	0	0	0	108.6	N1051 R1055	N1051-V1053 PolarHBondContact O-N 2.74Å; V1053-R1055 PolarHBondContact O-N 2.92Å
1054	R	65.2	Low	67.3	Low	226 Å²	226	143.7 Å²	143.7	85%	0.853	71%	0.711	S	S	*	*			trans	-53.9	105.2	178	-64.2	-179.4	-178.7	178.7	-0.1	107.1	P1052 Q1056	P1052-R1054 VanDerWaalsContact C-N 3.31Å; P1052-R1054 PolarHBondContact O-N 2.71Å; R1054-Q1056 PolarHBondContact O-N 2.82Å
1055	R	64.4	Low	69.6	Low	244 Å²	244	146 Å²	146	92%	0.921	71%	0.707	S	S	*	*			trans	-46	104.2	-169.1	-65.1	178	-177.4	164.8	0.7	110	V1053 R1057	V1053-R1055 PolarHBondContact O-N 2.92Å; R1055-R1057 PolarHBondContact O-N 3.11Å
1056	Q	78.1	Confident	72	Confident	160 Å²	160	144.7 Å²	144.7	75%	0.748	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-55.1	118.8	-167.6	-170.9	74.4	12.5	0	0	109.2	R1054 R1058	R1054-Q1056 PolarHBondContact O-N 2.82Å; Q1056-R1058 PolarHBondContact O-N 3.26Å
1057	R	78.5	Confident	74.7	Confident	225 Å²	225	138.6 Å²	138.6	85%	0.849	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-61.8	116.1	177.3	-174.4	-178.8	-170.8	172	5.2	107.2	R1055 E1059	R1055-R1057 PolarHBondContact O-N 3.11Å; R1057-E1059 PolarHBondContact O-N 3.14Å
1058	R	79	Confident	77	Confident	237 Å²	237	134.8 Å²	134.8	89%	0.894	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-54.5	127.2	-179.8	-64.5	-178.7	-173.4	153.7	0.7	109.7	Q1056 R1060	Q1056-R1058 PolarHBondContact O-N 3.26Å; R1058-R1060 PolarHBondContact O-N 3.39Å
1059	E	86.1	Confident	79.4	Confident	145 Å²	145	136.7 Å²	136.7	68%	0.678	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-59.3	133.2	-177.1	-65.8	-54.3	150.4	0	0	112.2	R1057 T1061	R1057-E1059 PolarHBondContact O-N 3.14Å; E1059-T1061 PolarHBondContact O-N 3.17Å
1060	R	88.4	Confident	82	Confident	224 Å²	224	132.2 Å²	132.2	85%	0.845	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-70.6	129.6	-179.6	168	177.7	-88.1	-160.6	-4	109.2	R1058 T1062	R1058-R1060 PolarHBondContact O-N 3.39Å; R1060-T1062 PolarHBondContact O-N 3.1Å
1061	T	89.1	Confident	84.5	Confident	40 Å²	40	129.6 Å²	129.6	25%	0.245	59%	0.591	C	S	.	*	P	Polyproline II helix	trans	-58.4	120.7	167.5	-20.5	0	0	0	0	110	E1059 F1063 L1095 R1099	E1059-T1061 PolarHBondContact O-N 3.17Å; T1061-F1063 HydrophobicContact CG2-CD1 4.19Å; T1061-F1063 HydrophobicContact CG2-CE1 3.77Å; T1061-F1063 HydrophobicContact CG2-CE2 4.29Å; T1061-F1063 HydrophobicContact CG2-CZ 3.84Å; T1061-L1095 HydrophobicContact CG2-CD2 4.34Å; T1061-R1099 HydrophobicContact CG2-CG 4.4Å; T1061-R1099 WeakPolarHBondContact OG1-CD 3.34Å; T1061-R1099 PolarHBondContact OG1-NH1 2.82Å
1062	T	93.7	Very high	86.5	Confident	127 Å²	127	126.5 Å²	126.5	78%	0.779	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-84.1	143.4	151.6	47.8	0	0	0	0	108.1	R1060	R1060-T1062 PolarHBondContact O-N 3.1Å
1063	F	95.7	Very high	88.3	Confident	55 Å²	55	125.6 Å²	125.6	24%	0.241	56%	0.558	C	S	.	*			trans	-116.5	138.3	176	-61.1	-83.5	0	0	0	108.3	T1061 Q1067 L1068 L1071 L1095 W1103	T1061-F1063 HydrophobicContact CG2-CD1 4.19Å; T1061-F1063 HydrophobicContact CG2-CE1 3.77Å; T1061-F1063 HydrophobicContact CG2-CE2 4.29Å; T1061-F1063 HydrophobicContact CG2-CZ 3.84Å; F1063-Q1067 HydrophobicContact CB-CB 4.41Å; F1063-L1068 HydrophobicContact CB-CD1 4.45Å; F1063-L1068 HydrophobicContact CB-CD2 3.75Å; F1063-L1068 HydrophobicContact CB-CG 3.8Å; F1063-L1068 HydrophobicContact CD2-CD2 4.35Å; F1063-L1068 HydrophobicContact CG-CD2 4.21Å; F1063-L1071 HydrophobicContact CD1-CD1 4.1Å; F1063-L1071 HydrophobicContact CE1-CD1 4.28Å; F1063-L1095 HydrophobicContact CD1-CD1 3.87Å; F1063-L1095 HydrophobicContact CD1-CD2 4.21Å; F1063-L1095 HydrophobicContact CE1-CD1 3.9Å; F1063-L1095 HydrophobicContact CE1-CD2 4.24Å; F1063-W1103 AromaticContact CE2-CD1 3.79Å; F1063-W1103 HydrophobicContact CZ-CB 4.14Å; F1063-W1103 AromaticContact CZ-CD1 3.88Å; F1063-W1103 HydrophobicContact CZ-CG 4.39Å
1064	T	97.2	Very high	90.1	Very high	76 Å²	76	120.5 Å²	120.5	47%	0.466	53%	0.526	S	S	.	.			trans	-71.9	160.4	174.8	74.1	0	0	0	0	110.7	H1066 Q1067 L1068	T1064-H1066 PolarHBondContact O-N 3.4Å; T1064-Q1067 PolarHBondContact O-N 3.2Å; T1064-Q1067 VanDerWaalsContact O-N 3.14Å; T1064-Q1067 WeakPolarHBondContact OG1-CG 3.49Å; T1064-Q1067 PolarHBondContact OG1-N 3.28Å; T1064-L1068 PolarHBondContact O-N 2.98Å
1065	R	97	Very high	91.7	Very high	210 Å²	210	111 Å²	111	79%	0.792	49%	0.491	S	S	*	.	H	α-helix	trans	-56.1	-40.2	176.7	-173.5	177.4	178.4	-175.2	-1	112	L1068 L1069	R1065-L1068 PolarHBondContact O-N 2.94Å; R1065-L1069 HydrophobicContact CG-CD1 4.32Å; R1065-L1069 WeakPolarHBondContact O-CG 3.43Å; R1065-L1069 PolarHBondContact O-N 3.13Å
1066	H	97.4	Very high	93.2	Very high	114 Å²	114	103.6 Å²	103.6	53%	0.528	48%	0.481	S	S	.	.	H	α-helix	trans	-65.1	-44.6	175.9	174.4	65.5	0	0	0	112.3	T1064 L1068 L1069 M1070	T1064-H1066 PolarHBondContact O-N 3.4Å; H1066-L1068 VanDerWaalsContact C-N 3.32Å; H1066-L1068 PolarHBondContact O-N 2.89Å; H1066-L1069 PolarHBondContact O-N 3.41Å; H1066-M1070 WeakPolarHBondContact O-CG 3.46Å; H1066-M1070 PolarHBondContact O-N 3.08Å; H1066-M1070 VanDerWaalsContact O-N 3.1Å
1067	Q	97.9	Very high	94.1	Very high	26 Å²	26	103.2 Å²	103.2	12%	0.121	48%	0.477	C	S	.	.	H	α-helix	trans	-59.3	-43.2	175.1	-72.1	171.1	-22.9	0	0	111.8	F1063 T1064 L1071 L1093 L1095	F1063-Q1067 HydrophobicContact CB-CB 4.41Å; T1064-Q1067 PolarHBondContact O-N 3.2Å; T1064-Q1067 VanDerWaalsContact O-N 3.14Å; T1064-Q1067 WeakPolarHBondContact OG1-CG 3.49Å; T1064-Q1067 PolarHBondContact OG1-N 3.28Å; Q1067-L1071 WeakPolarHBondContact O-CB 2.97Å; Q1067-L1071 VanDerWaalsContact O-CD1 3.31Å; Q1067-L1071 WeakPolarHBondContact O-CD1 3.49Å; Q1067-L1071 WeakPolarHBondContact O-CG 3.19Å; Q1067-L1071 PolarHBondContact O-N 2.81Å; Q1067-L1093 HydrophobicContact CB-CD1 4.23Å; Q1067-L1093 HydrophobicContact CB-CD2 4.43Å; Q1067-L1093 HydrophobicContact CG-CB 4.14Å; Q1067-L1093 HydrophobicContact CG-CD1 4.39Å; Q1067-L1093 HydrophobicContact CG-CD2 4.08Å; Q1067-L1093 HydrophobicContact CG-CG 4.44Å; Q1067-L1093 PolarHBondContact NE2-O 3.3Å; Q1067-L1095 HydrophobicContact CB-CD1 4.47Å; Q1067-L1095 HydrophobicContact CG-CD1 4.3Å
1068	L	97.9	Very high	95	Very high	63 Å²	63	94.6 Å²	94.6	33%	0.33	45%	0.449	S	S	.	.	H	α-helix	trans	-63.7	-44.1	177.1	-70.6	174.1	0	0	0	112.4	F1063 T1064 R1065 H1066 M1070 L1071 E1072	F1063-L1068 HydrophobicContact CB-CD1 4.45Å; F1063-L1068 HydrophobicContact CB-CD2 3.75Å; F1063-L1068 HydrophobicContact CB-CG 3.8Å; F1063-L1068 HydrophobicContact CD2-CD2 4.35Å; F1063-L1068 HydrophobicContact CG-CD2 4.21Å; T1064-L1068 PolarHBondContact O-N 2.98Å; R1065-L1068 PolarHBondContact O-N 2.94Å; H1066-L1068 VanDerWaalsContact C-N 3.32Å; H1066-L1068 PolarHBondContact O-N 2.89Å; L1068-M1070 PolarHBondContact O-N 3.07Å; L1068-L1071 PolarHBondContact O-N 3.36Å; L1068-E1072 WeakPolarHBondContact O-CB 3.42Å; L1068-E1072 WeakPolarHBondContact O-CG 3.4Å; L1068-E1072 PolarHBondContact O-N 2.81Å
1069	L	97.7	Very high	95.8	Very high	105 Å²	105	90.8 Å²	90.8	55%	0.55	44%	0.435	S	S	.	.	H	α-helix	trans	-58.6	-48.8	177.4	-73.5	168.1	0	0	0	111.8	R1065 H1066 L1071 E1072 E1073	R1065-L1069 HydrophobicContact CG-CD1 4.32Å; R1065-L1069 WeakPolarHBondContact O-CG 3.43Å; R1065-L1069 PolarHBondContact O-N 3.13Å; H1066-L1069 PolarHBondContact O-N 3.41Å; L1069-L1071 PolarHBondContact O-N 2.88Å; L1069-E1072 PolarHBondContact O-N 3.16Å; L1069-E1073 WeakPolarHBondContact O-CB 3.34Å; L1069-E1073 PolarHBondContact O-N 3.11Å
1070	M	97.7	Very high	96.4	Very high	52 Å²	52	88.4 Å²	88.4	26%	0.256	42%	0.421	S	S	.	.	H	α-helix	trans	-65	-36.8	178.3	-65.9	-69.4	-62.3	0	0	112.8	H1066 L1068 L1074 L1089 L1093	H1066-M1070 WeakPolarHBondContact O-CG 3.46Å; H1066-M1070 PolarHBondContact O-N 3.08Å; H1066-M1070 VanDerWaalsContact O-N 3.1Å; L1068-M1070 PolarHBondContact O-N 3.07Å; M1070-L1074 PolarHBondContact O-N 2.94Å; M1070-L1089 HydrophobicContact CB-CD1 4.18Å; M1070-L1089 HydrophobicContact CE-CD1 4.39Å; M1070-L1093 HydrophobicContact CB-CD1 4.17Å; M1070-L1093 HydrophobicContact CB-CD2 3.81Å; M1070-L1093 HydrophobicContact CB-CG 4.44Å; M1070-L1093 HydrophobicContact CG-CD2 3.89Å
1071	L	98.5	Very high	96.8	Very high	0 Å²	0	78 Å²	78	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-66.3	-39.5	174.1	-76.8	161.9	0	0	0	111.8	F1063 Q1067 L1068 L1069 Y1075 L1089 L1093 L1095 V1100 W1103 F1104	F1063-L1071 HydrophobicContact CD1-CD1 4.1Å; F1063-L1071 HydrophobicContact CE1-CD1 4.28Å; Q1067-L1071 WeakPolarHBondContact O-CB 2.97Å; Q1067-L1071 VanDerWaalsContact O-CD1 3.31Å; Q1067-L1071 WeakPolarHBondContact O-CD1 3.49Å; Q1067-L1071 WeakPolarHBondContact O-CG 3.19Å; Q1067-L1071 PolarHBondContact O-N 2.81Å; L1068-L1071 PolarHBondContact O-N 3.36Å; L1069-L1071 PolarHBondContact O-N 2.88Å; L1071-Y1075 VanDerWaalsContact O-CB 3.3Å; L1071-Y1075 WeakPolarHBondContact O-CB 3.49Å; L1071-Y1075 PolarHBondContact O-N 3.1Å; L1071-L1089 HydrophobicContact CD2-CD2 3.69Å; L1071-L1089 HydrophobicContact CG-CD2 4.31Å; L1071-L1093 HydrophobicContact CD1-CD1 4.23Å; L1071-L1093 HydrophobicContact CD2-CD1 4.31Å; L1071-L1093 HydrophobicContact CG-CD1 3.79Å; L1071-L1095 HydrophobicContact CD1-CD1 4.44Å; L1071-V1100 HydrophobicContact CD2-CG1 4.02Å; L1071-W1103 VanDerWaalsContact C-CH2 3.5Å; L1071-W1103 HydrophobicContact CB-CD2 3.95Å; L1071-W1103 HydrophobicContact CB-CE3 3.96Å; L1071-W1103 HydrophobicContact CB-CH2 3.74Å; L1071-W1103 HydrophobicContact CB-CZ2 3.69Å; L1071-W1103 HydrophobicContact CB-CZ3 3.87Å; L1071-W1103 HydrophobicContact CD1-CD2 4.02Å; L1071-W1103 HydrophobicContact CD1-CG 3.95Å; L1071-W1103 HydrophobicContact CD2-CD2 4.01Å; L1071-W1103 HydrophobicContact CD2-CE3 3.86Å; L1071-W1103 HydrophobicContact CD2-CG 4.32Å; L1071-W1103 HydrophobicContact CD2-CZ3 4.41Å; L1071-W1103 HydrophobicContact CG-CD2 4.22Å; L1071-W1103 HydrophobicContact CG-CE3 4.37Å; L1071-W1103 WeakPolarHBondContact O-CH2 3.24Å; L1071-W1103 WeakPolarHBondContact O-CZ3 3.29Å; L1071-F1104 HydrophobicContact CD2-CD2 4.43Å; L1071-F1104 HydrophobicContact CD2-CE2 3.94Å
1072	E	98	Very high	97.2	Very high	84 Å²	84	78 Å²	78	39%	0.393	38%	0.381	S	S	.	.	H	α-helix	trans	-76.6	-33.4	177.8	-68.4	-158.8	117.9	0	0	113.1	L1068 L1069 Y1075 A1076 W1103 R1107	L1068-E1072 WeakPolarHBondContact O-CB 3.42Å; L1068-E1072 WeakPolarHBondContact O-CG 3.4Å; L1068-E1072 PolarHBondContact O-N 2.81Å; L1069-E1072 PolarHBondContact O-N 3.16Å; E1072-Y1075 PolarHBondContact O-N 3.5Å; E1072-A1076 PolarHBondContact O-N 2.93Å; E1072-W1103 HydrophobicContact CG-CH2 3.75Å; E1072-W1103 HydrophobicContact CG-CZ2 3.62Å; E1072-R1107 IonicContact OE1-CZ 3.69Å; E1072-R1107 VanDerWaalsContact OE1-CZ 3.29Å; E1072-R1107 IonicContact OE1-NE 3.45Å; E1072-R1107 PolarHBondContact OE1-NE 3.25Å; E1072-R1107 IonicContact OE1-NH2 2.71Å; E1072-R1107 PolarHBondContact OE1-NH2 3.49Å
1073	E	97.7	Very high	97.4	Very high	92 Å²	92	73.8 Å²	73.8	43%	0.43	36%	0.355	S	S	.	.	H	α-helix	trans	-61.4	-48.5	170.4	-168.8	-153.8	135.4	0	0	111	L1069 Y1075 A1076 K1077	L1069-E1073 WeakPolarHBondContact O-CB 3.34Å; L1069-E1073 PolarHBondContact O-N 3.11Å; E1073-Y1075 VanDerWaalsContact C-N 3.3Å; E1073-Y1075 PolarHBondContact O-N 3.25Å; E1073-A1076 PolarHBondContact O-N 2.91Å; E1073-K1077 PolarHBondContact O-N 3.44Å; E1073-K1077 VanDerWaalsContact O-N 3.1Å; E1073-K1077 WeakPolarHBondContact OE1-CE 3.47Å; E1073-K1077 IonicContact OE1-NZ 3.81Å; E1073-K1077 PolarHBondContact OE1-NZ 2.82Å
1074	L	97.5	Very high	97.4	Very high	25 Å²	25	79.1 Å²	79.1	13%	0.131	37%	0.374	C	S	.	.	H	α-helix	trans	-64.7	-36.1	174.3	-176.2	65.1	0	0	0	111.3	M1070 A1076 K1077 T1078 P1081 I1085 L1089 F1104	M1070-L1074 PolarHBondContact O-N 2.94Å; L1074-A1076 VanDerWaalsContact C-N 3.31Å; L1074-A1076 PolarHBondContact O-N 3.28Å; L1074-K1077 PolarHBondContact O-N 3.32Å; L1074-T1078 HydrophobicContact CD1-CG2 4Å; L1074-T1078 HydrophobicContact CG-CG2 4.42Å; L1074-T1078 CarbonylContact O-C 3.09Å; L1074-T1078 PolarHBondContact O-N 3.14Å; L1074-P1081 HydrophobicContact CD2-CB 4.12Å; L1074-P1081 HydrophobicContact CD2-CG 4.31Å; L1074-I1085 HydrophobicContact CD1-CG2 3.81Å; L1074-I1085 HydrophobicContact CD2-CG2 3.84Å; L1074-I1085 HydrophobicContact CG-CG2 4.47Å; L1074-L1089 HydrophobicContact CB-CD2 4.21Å; L1074-L1089 HydrophobicContact CD2-CB 4.36Å; L1074-L1089 HydrophobicContact CD2-CD2 3.58Å; L1074-F1104 HydrophobicContact CB-CZ 4.1Å; L1074-F1104 HydrophobicContact CD2-CE2 4.13Å; L1074-F1104 HydrophobicContact CD2-CZ 3.78Å; L1074-F1104 HydrophobicContact CG-CZ 3.88Å
1075	Y	97.8	Very high	97.4	Very high	28 Å²	28	78.6 Å²	78.6	11%	0.11	37%	0.368	C	S	.	.	H	α-helix	trans	-65.1	-32.5	176.3	-173.4	-93	0	0	0	113.5	L1071 E1072 E1073 T1078 R1079 W1103 F1104 R1107 R1108	L1071-Y1075 VanDerWaalsContact O-CB 3.3Å; L1071-Y1075 WeakPolarHBondContact O-CB 3.49Å; L1071-Y1075 PolarHBondContact O-N 3.1Å; E1072-Y1075 PolarHBondContact O-N 3.5Å; E1073-Y1075 VanDerWaalsContact C-N 3.3Å; E1073-Y1075 PolarHBondContact O-N 3.25Å; Y1075-T1078 WeakPolarHBondContact CA-O 3.41Å; Y1075-T1078 CarbonylContact O-C 3.58Å; Y1075-R1079 HydrophobicContact CD1-CG 4.38Å; Y1075-R1079 HydrophobicContact CD2-CG 4.44Å; Y1075-R1079 HydrophobicContact CE1-CG 3.94Å; Y1075-R1079 HydrophobicContact CE2-CB 4.1Å; Y1075-R1079 HydrophobicContact CE2-CG 4.01Å; Y1075-W1103 HydrophobicContact CD2-CZ3 4.15Å; Y1075-W1103 HydrophobicContact CG-CH2 4.37Å; Y1075-W1103 HydrophobicContact CG-CZ3 4.34Å; Y1075-F1104 AromaticContact CD2-CD1 3.81Å; Y1075-F1104 HydrophobicContact CD2-CD1 3.81Å; Y1075-F1104 AromaticContact CD2-CE1 3.76Å; Y1075-F1104 HydrophobicContact CD2-CE1 3.76Å; Y1075-F1104 HydrophobicContact CG-CE1 4.36Å; Y1075-R1107 HydrophobicContact CD1-CG 3.92Å; Y1075-R1107 HydrophobicContact CD2-CB 3.99Å; Y1075-R1107 HydrophobicContact CD2-CG 3.58Å; Y1075-R1107 HydrophobicContact CE1-CG 3.87Å; Y1075-R1107 HydrophobicContact CE2-CB 3.81Å; Y1075-R1107 HydrophobicContact CE2-CG 3.52Å; Y1075-R1107 HydrophobicContact CG-CG 3.79Å; Y1075-R1108 HydrophobicContact CE2-CG 3.83Å
1076	A	97.1	Very high	97.5	Very high	87 Å²	87	70.3 Å²	70.3	72%	0.719	34%	0.337	S	S	*	.	H	α-helix	trans	-69	-42.2	172.3	0	0	0	0	0	111.5	E1072 E1073 L1074	E1072-A1076 PolarHBondContact O-N 2.93Å; E1073-A1076 PolarHBondContact O-N 2.91Å; L1074-A1076 VanDerWaalsContact C-N 3.31Å; L1074-A1076 PolarHBondContact O-N 3.28Å
1077	K	96.6	Very high	97.5	Very high	153 Å²	153	68.8 Å²	68.8	67%	0.665	33%	0.33	S	S	*	.	H	α-helix	trans	-67.4	-44	175.7	-70.9	171.6	172.7	175.4	0	112.7	E1073 L1074	E1073-K1077 PolarHBondContact O-N 3.44Å; E1073-K1077 VanDerWaalsContact O-N 3.1Å; E1073-K1077 WeakPolarHBondContact OE1-CE 3.47Å; E1073-K1077 IonicContact OE1-NZ 3.81Å; E1073-K1077 PolarHBondContact OE1-NZ 2.82Å; L1074-K1077 PolarHBondContact O-N 3.32Å
1078	T	96.7	Very high	97.5	Very high	43 Å²	43	72.2 Å²	72.2	26%	0.264	35%	0.346	S	S	.	.			trans	-150.5	127.2	172.8	174.8	0	0	0	0	112.1	L1074 Y1075 Y1080 P1081	L1074-T1078 HydrophobicContact CD1-CG2 4Å; L1074-T1078 HydrophobicContact CG-CG2 4.42Å; L1074-T1078 CarbonylContact O-C 3.09Å; L1074-T1078 PolarHBondContact O-N 3.14Å; Y1075-T1078 WeakPolarHBondContact CA-O 3.41Å; Y1075-T1078 CarbonylContact O-C 3.58Å; T1078-Y1080 PolarHBondContact O-N 3.16Å; T1078-Y1080 VanDerWaalsContact OG1-C 3.29Å; T1078-Y1080 PolarHBondContact OG1-N 3.34Å; T1078-Y1080 VanDerWaalsContact OG1-N 3.1Å; T1078-Y1080 PolarHBondContact OG1-O 2.83Å; T1078-P1081 HydrophobicContact CG2-CB 3.89Å
1079	R	96.5	Very high	97.5	Very high	157 Å²	157	69.7 Å²	69.7	59%	0.592	33%	0.333	S	S	*	.	S	Bend	trans	-75.4	-11.9	173.3	-63.7	-177.2	-71.9	169.7	-2.8	112.7	Y1075 R1108	Y1075-R1079 HydrophobicContact CD1-CG 4.38Å; Y1075-R1079 HydrophobicContact CD2-CG 4.44Å; Y1075-R1079 HydrophobicContact CE1-CG 3.94Å; Y1075-R1079 HydrophobicContact CE2-CB 4.1Å; Y1075-R1079 HydrophobicContact CE2-CG 4.01Å; R1079-R1108 WeakPolarHBondContact O-CD 3.5Å; R1079-R1108 PolarHBondContact O-NH1 3.43Å
1080	Y	97.9	Very high	97.5	Very high	95 Å²	95	65 Å²	65	37%	0.373	31%	0.309	S	S	.	.	S	Bend	trans	-137.2	67.2	-175.6	-63.5	-86.3	0	0	0	111.2	H349 T1078 R1108	H349-Y1080 AromaticContact CD2-CD2 3.89Å; H349-Y1080 AromaticContact CD2-CG 3.86Å; H349-Y1080 AromaticContact CE1-CD2 3.99Å; H349-Y1080 AromaticContact NE2-CD2 3.41Å; H349-Y1080 WeakPolarHBondContact NE2-CD2 3.44Å; H349-Y1080 AromaticContact NE2-CE2 3.93Å; H349-Y1080 AromaticContact NE2-CG 3.45Å; T1078-Y1080 PolarHBondContact O-N 3.16Å; T1078-Y1080 VanDerWaalsContact OG1-C 3.29Å; T1078-Y1080 PolarHBondContact OG1-N 3.34Å; T1078-Y1080 VanDerWaalsContact OG1-N 3.1Å; T1078-Y1080 PolarHBondContact OG1-O 2.83Å; Y1080-R1108 VanDerWaalsContact CE1-NE 3.32Å; Y1080-R1108 VanDerWaalsContact CZ-CD 3.42Å
1081	P	97.3	Very high	97.5	Very high	7 Å²	7	69.3 Å²	69.3	5%	0.045	33%	0.332	C	S	.	.			trans	-66.4	137.4	178.3	25.7	-34.1	0	0	0	112.7	L1074 T1078 I1085 R1086 F1104	L1074-P1081 HydrophobicContact CD2-CB 4.12Å; L1074-P1081 HydrophobicContact CD2-CG 4.31Å; T1078-P1081 HydrophobicContact CG2-CB 3.89Å; P1081-I1085 HydrophobicContact CB-CB 4.11Å; P1081-I1085 HydrophobicContact CB-CG2 4.01Å; P1081-R1086 HydrophobicContact CB-CG 3.72Å; P1081-R1086 HydrophobicContact CG-CG 3.57Å; P1081-R1086 PolarHBondContact O-NH1 2.96Å; P1081-F1104 HydrophobicContact CG-CD1 3.7Å; P1081-F1104 HydrophobicContact CG-CD2 4.12Å; P1081-F1104 HydrophobicContact CG-CE1 3.55Å; P1081-F1104 HydrophobicContact CG-CE2 3.99Å; P1081-F1104 HydrophobicContact CG-CG 4.01Å; P1081-F1104 HydrophobicContact CG-CZ 3.73Å
1082	D	97.4	Very high	97.4	Very high	39 Å²	39	75.3 Å²	75.3	21%	0.209	36%	0.358	C	S	.	.			trans	-64.8	164.3	174.2	-159.5	-5.5	0	0	0	111.8	K346 Y1084 I1085 R1086	K346-D1082 IonicContact NZ-OD2 2.86Å; K346-D1082 PolarHBondContact NZ-OD2 3.24Å; D1082-Y1084 PolarHBondContact O-N 3.01Å; D1082-I1085 HydrophobicContact CB-CD1 4.11Å; D1082-I1085 HydrophobicContact CB-CG1 4.27Å; D1082-I1085 PolarHBondContact O-N 2.96Å; D1082-I1085 VanDerWaalsContact O-N 3.17Å; D1082-R1086 VanDerWaalsContact C-NH1 3.34Å; D1082-R1086 WeakPolarHBondContact O-CG 3.34Å; D1082-R1086 PolarHBondContact O-N 3.44Å; D1082-R1086 VanDerWaalsContact O-N 3.14Å
1083	V	97.1	Very high	97.4	Very high	38 Å²	38	71.6 Å²	71.6	23%	0.23	34%	0.341	C	S	.	.	H	α-helix	trans	-54	-51.8	-174.6	62.6	0	0	0	0	112.6	I1085 R1086 E1087	V1083-I1085 VanDerWaalsContact C-N 3.3Å; V1083-I1085 PolarHBondContact O-N 3.07Å; V1083-R1086 PolarHBondContact O-N 3.1Å; V1083-R1086 VanDerWaalsContact O-N 3.11Å; V1083-E1087 HydrophobicContact CG2-CG 4.31Å; V1083-E1087 WeakPolarHBondContact O-CG 3.5Å; V1083-E1087 PolarHBondContact O-N 3.44Å
1084	Y	97.6	Very high	97.3	Very high	168 Å²	168	78.4 Å²	78.4	66%	0.659	36%	0.363	S	S	*	.	H	α-helix	trans	-57.9	-38.8	179.1	-55.8	-67.9	0	0	0	113.4	D1082 E1087 E1088	D1082-Y1084 PolarHBondContact O-N 3.01Å; Y1084-E1087 PolarHBondContact O-N 2.9Å; Y1084-E1088 WeakPolarHBondContact O-CB 3.3Å; Y1084-E1088 PolarHBondContact O-N 3.28Å
1085	I	97.1	Very high	97.3	Very high	64 Å²	64	78.1 Å²	78.1	33%	0.328	36%	0.361	S	S	.	.	H	α-helix	trans	-68.8	-38.1	-179.3	-53.4	177.2	0	0	0	110.3	L1074 P1081 D1082 V1083 L1089	L1074-I1085 HydrophobicContact CD1-CG2 3.81Å; L1074-I1085 HydrophobicContact CD2-CG2 3.84Å; L1074-I1085 HydrophobicContact CG-CG2 4.47Å; P1081-I1085 HydrophobicContact CB-CB 4.11Å; P1081-I1085 HydrophobicContact CB-CG2 4.01Å; D1082-I1085 HydrophobicContact CB-CD1 4.11Å; D1082-I1085 HydrophobicContact CB-CG1 4.27Å; D1082-I1085 PolarHBondContact O-N 2.96Å; D1082-I1085 VanDerWaalsContact O-N 3.17Å; V1083-I1085 VanDerWaalsContact C-N 3.3Å; V1083-I1085 PolarHBondContact O-N 3.07Å; I1085-L1089 WeakPolarHBondContact O-CB 3.31Å; I1085-L1089 PolarHBondContact O-N 2.77Å; I1085-L1089 VanDerWaalsContact O-N 3.14Å
1086	R	97.9	Very high	97.2	Very high	37 Å²	37	80.2 Å²	80.2	14%	0.14	38%	0.378	C	S	.	.	H	α-helix	trans	-74.2	-37.5	177.4	-55.9	-173.3	-46.6	-85.5	-8.7	111.6	P1081 D1082 V1083 L1089 A1090 E1097 V1100	P1081-R1086 HydrophobicContact CB-CG 3.72Å; P1081-R1086 HydrophobicContact CG-CG 3.57Å; P1081-R1086 PolarHBondContact O-NH1 2.96Å; D1082-R1086 VanDerWaalsContact C-NH1 3.34Å; D1082-R1086 WeakPolarHBondContact O-CG 3.34Å; D1082-R1086 PolarHBondContact O-N 3.44Å; D1082-R1086 VanDerWaalsContact O-N 3.14Å; V1083-R1086 PolarHBondContact O-N 3.1Å; V1083-R1086 VanDerWaalsContact O-N 3.11Å; R1086-L1089 PolarHBondContact O-N 3.34Å; R1086-A1090 WeakPolarHBondContact O-CB 3.21Å; R1086-A1090 PolarHBondContact O-N 3.14Å; R1086-E1097 WeakPolarHBondContact CB-OE2 3.35Å; R1086-E1097 IonicContact CZ-OE1 2.74Å; R1086-E1097 IonicContact NE-OE1 2.67Å; R1086-E1097 PolarHBondContact NE-OE1 3.23Å; R1086-E1097 IonicContact NE-OE2 3.52Å; R1086-E1097 IonicContact NH2-OE1 2.88Å; R1086-E1097 PolarHBondContact NH2-OE1 3.42Å; R1086-V1100 HydrophobicContact CB-CG1 3.99Å; R1086-V1100 HydrophobicContact CG-CG1 4.35Å
1087	E	98.3	Very high	97.2	Very high	81 Å²	81	77.9 Å²	77.9	38%	0.379	35%	0.353	S	S	.	.	H	α-helix	trans	-63.4	-44.1	173.6	-72.8	173.5	162.7	0	0	112.3	V1083 Y1084 L1089 A1090 L1091 E1097	V1083-E1087 HydrophobicContact CG2-CG 4.31Å; V1083-E1087 WeakPolarHBondContact O-CG 3.5Å; V1083-E1087 PolarHBondContact O-N 3.44Å; Y1084-E1087 PolarHBondContact O-N 2.9Å; E1087-L1089 VanDerWaalsContact C-N 3.34Å; E1087-L1089 PolarHBondContact O-N 2.99Å; E1087-A1090 WeakPolarHBondContact O-CB 3.31Å; E1087-A1090 PolarHBondContact O-N 3.35Å; E1087-L1091 WeakPolarHBondContact O-CG 3.39Å; E1087-L1091 PolarHBondContact O-N 2.69Å; E1087-E1097 HydrophobicContact CG-CB 4.32Å; E1087-E1097 HydrophobicContact CG-CG 4.08Å
1088	E	97.8	Very high	97.2	Very high	98 Å²	98	74 Å²	74	46%	0.458	34%	0.344	S	S	.	.	H	α-helix	trans	-59.5	-44.7	173.7	-168.9	-162.7	171.7	0	0	111.3	Y1084 K1092	Y1084-E1088 WeakPolarHBondContact O-CB 3.3Å; Y1084-E1088 PolarHBondContact O-N 3.28Å; E1088-K1092 HydrophobicContact CG-CD 4.41Å; E1088-K1092 WeakPolarHBondContact O-CG 3.27Å; E1088-K1092 PolarHBondContact O-N 2.88Å; E1088-K1092 VanDerWaalsContact OE1-CE 3.28Å; E1088-K1092 WeakPolarHBondContact OE1-CE 3.28Å; E1088-K1092 IonicContact OE1-NZ 3.3Å; E1088-K1092 PolarHBondContact OE1-NZ 3.4Å
1089	L	97.7	Very high	97.2	Very high	11 Å²	11	76.2 Å²	76.2	6%	0.058	35%	0.348	C	S	.	.	H	α-helix	trans	-67.4	-37.5	175.7	-173.5	65	0	0	0	112.1	M1070 L1071 L1074 I1085 R1086 E1087 K1092 L1093 V1100 F1104	M1070-L1089 HydrophobicContact CB-CD1 4.18Å; M1070-L1089 HydrophobicContact CE-CD1 4.39Å; L1071-L1089 HydrophobicContact CD2-CD2 3.69Å; L1071-L1089 HydrophobicContact CG-CD2 4.31Å; L1074-L1089 HydrophobicContact CB-CD2 4.21Å; L1074-L1089 HydrophobicContact CD2-CB 4.36Å; L1074-L1089 HydrophobicContact CD2-CD2 3.58Å; I1085-L1089 WeakPolarHBondContact O-CB 3.31Å; I1085-L1089 PolarHBondContact O-N 2.77Å; I1085-L1089 VanDerWaalsContact O-N 3.14Å; R1086-L1089 PolarHBondContact O-N 3.34Å; E1087-L1089 VanDerWaalsContact C-N 3.34Å; E1087-L1089 PolarHBondContact O-N 2.99Å; L1089-K1092 PolarHBondContact O-N 3.21Å; L1089-L1093 HydrophobicContact CD1-CD1 3.82Å; L1089-L1093 HydrophobicContact CD1-CG 3.85Å; L1089-L1093 HydrophobicContact CD2-CD1 4.25Å; L1089-L1093 HydrophobicContact CG-CD1 3.81Å; L1089-L1093 HydrophobicContact CG-CG 4.12Å; L1089-L1093 VanDerWaalsContact O-CB 3.27Å; L1089-L1093 WeakPolarHBondContact O-CB 3.4Å; L1089-L1093 VanDerWaalsContact O-CG 3.31Å; L1089-L1093 WeakPolarHBondContact O-CG 3.34Å; L1089-L1093 PolarHBondContact O-N 3.28Å; L1089-V1100 HydrophobicContact CD2-CG1 4.33Å; L1089-F1104 HydrophobicContact CD2-CE2 4.41Å
1090	A	97.8	Very high	97.3	Very high	6 Å²	6	68.7 Å²	68.7	5%	0.05	32%	0.32	C	S	.	.	H	α-helix	trans	-60.4	-45.4	177.4	0	0	0	0	0	111.1	R1086 E1087 L1093 R1094 L1095 E1097 V1100	R1086-A1090 WeakPolarHBondContact O-CB 3.21Å; R1086-A1090 PolarHBondContact O-N 3.14Å; E1087-A1090 WeakPolarHBondContact O-CB 3.31Å; E1087-A1090 PolarHBondContact O-N 3.35Å; A1090-L1093 PolarHBondContact O-N 3.48Å; A1090-R1094 PolarHBondContact O-N 3.04Å; A1090-L1095 CarbonylContact C-O 3.58Å; A1090-L1095 VanDerWaalsContact CB-O 3.3Å; A1090-L1095 WeakPolarHBondContact CB-O 3.26Å; A1090-L1095 PolarHBondContact O-N 2.75Å; A1090-L1095 VanDerWaalsContact O-O 3.08Å; A1090-E1097 HydrophobicContact CB-CB 4.2Å; A1090-V1100 HydrophobicContact CB-CG2 3.93Å
1091	L	97.4	Very high	97.3	Very high	142 Å²	142	67.5 Å²	67.5	74%	0.743	32%	0.317	S	S	*	.	H	α-helix	trans	-61.1	-52.8	172.7	-69.6	170.9	0	0	0	111.7	E1087 L1093 R1094	E1087-L1091 WeakPolarHBondContact O-CG 3.39Å; E1087-L1091 PolarHBondContact O-N 2.69Å; L1091-L1093 PolarHBondContact O-N 3.09Å; L1091-R1094 PolarHBondContact O-N 2.81Å; L1091-R1094 VanDerWaalsContact O-N 3.16Å
1092	K	97.1	Very high	97.3	Very high	126 Å²	126	70.5 Å²	70.5	55%	0.548	34%	0.335	S	S	.	.	H	α-helix	trans	-55.6	-37.6	178.4	-75.2	172.3	177.7	174.8	0	112.7	E1088 L1089	E1088-K1092 HydrophobicContact CG-CD 4.41Å; E1088-K1092 WeakPolarHBondContact O-CG 3.27Å; E1088-K1092 PolarHBondContact O-N 2.88Å; E1088-K1092 VanDerWaalsContact OE1-CE 3.28Å; E1088-K1092 WeakPolarHBondContact OE1-CE 3.28Å; E1088-K1092 IonicContact OE1-NZ 3.3Å; E1088-K1092 PolarHBondContact OE1-NZ 3.4Å; L1089-K1092 PolarHBondContact O-N 3.21Å
1093	L	96.7	Very high	97.3	Very high	6 Å²	6	69.8 Å²	69.8	3%	0.031	33%	0.33	C	S	.	.	H	α-helix	trans	-92.1	-3.7	-177.2	-66.8	-169.7	0	0	0	115.1	Q1067 M1070 L1071 L1089 A1090 L1091 L1095	Q1067-L1093 HydrophobicContact CB-CD1 4.23Å; Q1067-L1093 HydrophobicContact CB-CD2 4.43Å; Q1067-L1093 HydrophobicContact CG-CB 4.14Å; Q1067-L1093 HydrophobicContact CG-CD1 4.39Å; Q1067-L1093 HydrophobicContact CG-CD2 4.08Å; Q1067-L1093 HydrophobicContact CG-CG 4.44Å; Q1067-L1093 PolarHBondContact NE2-O 3.3Å; M1070-L1093 HydrophobicContact CB-CD1 4.17Å; M1070-L1093 HydrophobicContact CB-CD2 3.81Å; M1070-L1093 HydrophobicContact CB-CG 4.44Å; M1070-L1093 HydrophobicContact CG-CD2 3.89Å; L1071-L1093 HydrophobicContact CD1-CD1 4.23Å; L1071-L1093 HydrophobicContact CD2-CD1 4.31Å; L1071-L1093 HydrophobicContact CG-CD1 3.79Å; L1089-L1093 HydrophobicContact CD1-CD1 3.82Å; L1089-L1093 HydrophobicContact CD1-CG 3.85Å; L1089-L1093 HydrophobicContact CD2-CD1 4.25Å; L1089-L1093 HydrophobicContact CG-CD1 3.81Å; L1089-L1093 HydrophobicContact CG-CG 4.12Å; L1089-L1093 VanDerWaalsContact O-CB 3.27Å; L1089-L1093 WeakPolarHBondContact O-CB 3.4Å; L1089-L1093 VanDerWaalsContact O-CG 3.31Å; L1089-L1093 WeakPolarHBondContact O-CG 3.34Å; L1089-L1093 PolarHBondContact O-N 3.28Å; A1090-L1093 PolarHBondContact O-N 3.48Å; L1091-L1093 PolarHBondContact O-N 3.09Å; L1093-L1095 HydrophobicContact CB-CB 4.44Å; L1093-L1095 HydrophobicContact CB-CD1 3.79Å; L1093-L1095 HydrophobicContact CB-CG 4.01Å; L1093-L1095 HydrophobicContact CD1-CD1 4.03Å; L1093-L1095 PolarHBondContact O-N 2.85Å
1094	R	96.9	Very high	97.3	Very high	235 Å²	235	68 Å²	68	89%	0.887	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	42.8	-171.7	-55.3	-178.1	-178.3	179.7	-0.1	112.2	A1090 L1091	A1090-R1094 PolarHBondContact O-N 3.04Å; L1091-R1094 PolarHBondContact O-N 2.81Å; L1091-R1094 VanDerWaalsContact O-N 3.16Å
1095	L	96	Very high	97.3	Very high	19 Å²	19	65.2 Å²	65.2	10%	0.099	31%	0.31	C	S	.	.			trans	-115.9	148.6	176.9	-68.7	170.7	0	0	0	109.4	T1061 F1063 Q1067 L1071 A1090 L1093 V1100	T1061-L1095 HydrophobicContact CG2-CD2 4.34Å; F1063-L1095 HydrophobicContact CD1-CD1 3.87Å; F1063-L1095 HydrophobicContact CD1-CD2 4.21Å; F1063-L1095 HydrophobicContact CE1-CD1 3.9Å; F1063-L1095 HydrophobicContact CE1-CD2 4.24Å; Q1067-L1095 HydrophobicContact CB-CD1 4.47Å; Q1067-L1095 HydrophobicContact CG-CD1 4.3Å; L1071-L1095 HydrophobicContact CD1-CD1 4.44Å; A1090-L1095 CarbonylContact C-O 3.58Å; A1090-L1095 VanDerWaalsContact CB-O 3.3Å; A1090-L1095 WeakPolarHBondContact CB-O 3.26Å; A1090-L1095 PolarHBondContact O-N 2.75Å; A1090-L1095 VanDerWaalsContact O-O 3.08Å; L1093-L1095 HydrophobicContact CB-CB 4.44Å; L1093-L1095 HydrophobicContact CB-CD1 3.79Å; L1093-L1095 HydrophobicContact CB-CG 4.01Å; L1093-L1095 HydrophobicContact CD1-CD1 4.03Å; L1093-L1095 PolarHBondContact O-N 2.85Å; L1095-V1100 HydrophobicContact CB-CG2 4.28Å; L1095-V1100 HydrophobicContact CD1-CG2 4.47Å
1096	P	96.7	Very high	97.3	Very high	72 Å²	72	67.1 Å²	67.1	47%	0.468	32%	0.321	S	S	.	.			trans	-65.3	140.1	166	-17.6	29.7	0	0	0	110.9	S1098 R1099 V1100	P1096-S1098 PolarHBondContact O-N 3.02Å; P1096-S1098 VanDerWaalsContact O-N 3.16Å; P1096-R1099 HydrophobicContact CB-CG 4.11Å; P1096-R1099 HydrophobicContact CG-CG 3.97Å; P1096-R1099 WeakPolarHBondContact O-CA 3.46Å; P1096-R1099 WeakPolarHBondContact O-CB 3.36Å; P1096-R1099 PolarHBondContact O-N 2.75Å; P1096-V1100 PolarHBondContact O-N 3.07Å
1097	E	97.9	Very high	97.3	Very high	39 Å²	39	68.2 Å²	68.2	18%	0.182	33%	0.325	C	S	.	.	H	α-helix	trans	-49.7	-41.7	176	156.7	49.7	-162.1	0	0	112.3	R1086 E1087 A1090 R1099 V1100 Q1101	R1086-E1097 WeakPolarHBondContact CB-OE2 3.35Å; R1086-E1097 IonicContact CZ-OE1 2.74Å; R1086-E1097 IonicContact NE-OE1 2.67Å; R1086-E1097 PolarHBondContact NE-OE1 3.23Å; R1086-E1097 IonicContact NE-OE2 3.52Å; R1086-E1097 IonicContact NH2-OE1 2.88Å; R1086-E1097 PolarHBondContact NH2-OE1 3.42Å; E1087-E1097 HydrophobicContact CG-CB 4.32Å; E1087-E1097 HydrophobicContact CG-CG 4.08Å; A1090-E1097 HydrophobicContact CB-CB 4.2Å; E1097-R1099 PolarHBondContact O-N 3.21Å; E1097-R1099 VanDerWaalsContact O-N 3.14Å; E1097-V1100 WeakPolarHBondContact O-CA 3.32Å; E1097-V1100 WeakPolarHBondContact O-CB 3.34Å; E1097-V1100 PolarHBondContact O-N 3.5Å; E1097-Q1101 PolarHBondContact O-N 2.88Å
1098	S	96.8	Very high	97.2	Very high	70 Å²	70	66.9 Å²	66.9	49%	0.49	32%	0.317	S	S	.	.	H	α-helix	trans	-58.6	-28.8	175.5	61.2	0	0	0	0	114.1	P1096 V1102	P1096-S1098 PolarHBondContact O-N 3.02Å; P1096-S1098 VanDerWaalsContact O-N 3.16Å; S1098-V1102 WeakPolarHBondContact O-CB 3.28Å; S1098-V1102 VanDerWaalsContact O-CG2 3.22Å; S1098-V1102 WeakPolarHBondContact O-CG2 3.23Å; S1098-V1102 PolarHBondContact O-N 3.49Å; S1098-V1102 VanDerWaalsContact O-N 3.1Å
1099	R	96.4	Very high	97.2	Very high	90 Å²	90	64 Å²	64	34%	0.34	31%	0.31	S	S	.	.	H	α-helix	trans	-76.2	-36.7	174.1	-55.9	-57.2	-176.5	92.2	0.5	111.6	T1061 P1096 E1097 W1103	T1061-R1099 HydrophobicContact CG2-CG 4.4Å; T1061-R1099 WeakPolarHBondContact OG1-CD 3.34Å; T1061-R1099 PolarHBondContact OG1-NH1 2.82Å; P1096-R1099 HydrophobicContact CB-CG 4.11Å; P1096-R1099 HydrophobicContact CG-CG 3.97Å; P1096-R1099 WeakPolarHBondContact O-CA 3.46Å; P1096-R1099 WeakPolarHBondContact O-CB 3.36Å; P1096-R1099 PolarHBondContact O-N 2.75Å; E1097-R1099 PolarHBondContact O-N 3.21Å; E1097-R1099 VanDerWaalsContact O-N 3.14Å; R1099-W1103 WeakPolarHBondContact O-CB 3.29Å; R1099-W1103 PolarHBondContact O-N 3Å
1100	V	97.8	Very high	97	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-63.9	-50.8	172	179.1	0	0	0	0	109.9	L1071 R1086 L1089 A1090 L1095 P1096 E1097 V1102 W1103 F1104	L1071-V1100 HydrophobicContact CD2-CG1 4.02Å; R1086-V1100 HydrophobicContact CB-CG1 3.99Å; R1086-V1100 HydrophobicContact CG-CG1 4.35Å; L1089-V1100 HydrophobicContact CD2-CG1 4.33Å; A1090-V1100 HydrophobicContact CB-CG2 3.93Å; L1095-V1100 HydrophobicContact CB-CG2 4.28Å; L1095-V1100 HydrophobicContact CD1-CG2 4.47Å; P1096-V1100 PolarHBondContact O-N 3.07Å; E1097-V1100 WeakPolarHBondContact O-CA 3.32Å; E1097-V1100 WeakPolarHBondContact O-CB 3.34Å; E1097-V1100 PolarHBondContact O-N 3.5Å; V1100-V1102 VanDerWaalsContact C-N 3.33Å; V1100-V1102 PolarHBondContact O-N 3.3Å; V1100-W1103 WeakPolarHBondContact O-CB 3.38Å; V1100-W1103 PolarHBondContact O-N 3.46Å; V1100-W1103 VanDerWaalsContact O-N 3.11Å; V1100-F1104 HydrophobicContact CG1-CD2 3.85Å; V1100-F1104 HydrophobicContact CG1-CE2 3.94Å; V1100-F1104 WeakPolarHBondContact O-CD2 3.39Å; V1100-F1104 PolarHBondContact O-N 2.83Å
1101	Q	97.4	Very high	96.6	Very high	69 Å²	69	70.2 Å²	70.2	32%	0.322	34%	0.342	S	S	.	.	H	α-helix	trans	-56.2	-43.6	177.3	-163.2	-154.7	80.3	0	0	112.6	E1097 F1104 K1105	E1097-Q1101 PolarHBondContact O-N 2.88Å; Q1101-F1104 PolarHBondContact O-N 3.25Å; Q1101-K1105 WeakPolarHBondContact O-CG 3.31Å; Q1101-K1105 PolarHBondContact O-N 3.4Å
1102	V	97.1	Very high	96.3	Very high	70 Å²	70	69.8 Å²	69.8	42%	0.424	33%	0.33	S	S	.	.	H	α-helix	trans	-68.1	-39.3	176.3	167.2	0	0	0	0	111.9	S1098 V1100 F1104 K1105 N1106	S1098-V1102 WeakPolarHBondContact O-CB 3.28Å; S1098-V1102 VanDerWaalsContact O-CG2 3.22Å; S1098-V1102 WeakPolarHBondContact O-CG2 3.23Å; S1098-V1102 PolarHBondContact O-N 3.49Å; S1098-V1102 VanDerWaalsContact O-N 3.1Å; V1100-V1102 VanDerWaalsContact C-N 3.33Å; V1100-V1102 PolarHBondContact O-N 3.3Å; V1102-F1104 PolarHBondContact O-N 2.94Å; V1102-K1105 PolarHBondContact O-N 3.01Å; V1102-N1106 WeakPolarHBondContact O-CB 3.2Å; V1102-N1106 VanDerWaalsContact O-CG 3.24Å; V1102-N1106 PolarHBondContact O-N 2.88Å; V1102-N1106 PolarHBondContact O-ND2 2.63Å
1103	W	97.9	Very high	95.7	Very high	24 Å²	24	68.2 Å²	68.2	9%	0.091	33%	0.328	C	S	.	.	H	α-helix	trans	-59.6	-46.4	173.9	-176.1	101.8	0	0	0	111	F1063 L1071 E1072 Y1075 R1099 V1100 K1105 N1106 R1107	F1063-W1103 AromaticContact CE2-CD1 3.79Å; F1063-W1103 HydrophobicContact CZ-CB 4.14Å; F1063-W1103 AromaticContact CZ-CD1 3.88Å; F1063-W1103 HydrophobicContact CZ-CG 4.39Å; L1071-W1103 VanDerWaalsContact C-CH2 3.5Å; L1071-W1103 HydrophobicContact CB-CD2 3.95Å; L1071-W1103 HydrophobicContact CB-CE3 3.96Å; L1071-W1103 HydrophobicContact CB-CH2 3.74Å; L1071-W1103 HydrophobicContact CB-CZ2 3.69Å; L1071-W1103 HydrophobicContact CB-CZ3 3.87Å; L1071-W1103 HydrophobicContact CD1-CD2 4.02Å; L1071-W1103 HydrophobicContact CD1-CG 3.95Å; L1071-W1103 HydrophobicContact CD2-CD2 4.01Å; L1071-W1103 HydrophobicContact CD2-CE3 3.86Å; L1071-W1103 HydrophobicContact CD2-CG 4.32Å; L1071-W1103 HydrophobicContact CD2-CZ3 4.41Å; L1071-W1103 HydrophobicContact CG-CD2 4.22Å; L1071-W1103 HydrophobicContact CG-CE3 4.37Å; L1071-W1103 WeakPolarHBondContact O-CH2 3.24Å; L1071-W1103 WeakPolarHBondContact O-CZ3 3.29Å; E1072-W1103 HydrophobicContact CG-CH2 3.75Å; E1072-W1103 HydrophobicContact CG-CZ2 3.62Å; Y1075-W1103 HydrophobicContact CD2-CZ3 4.15Å; Y1075-W1103 HydrophobicContact CG-CH2 4.37Å; Y1075-W1103 HydrophobicContact CG-CZ3 4.34Å; R1099-W1103 WeakPolarHBondContact O-CB 3.29Å; R1099-W1103 PolarHBondContact O-N 3Å; V1100-W1103 WeakPolarHBondContact O-CB 3.38Å; V1100-W1103 PolarHBondContact O-N 3.46Å; V1100-W1103 VanDerWaalsContact O-N 3.11Å; W1103-K1105 PolarHBondContact O-N 3.45Å; W1103-N1106 PolarHBondContact O-N 3.35Å; W1103-R1107 HydrophobicContact CD2-CB 4.5Å; W1103-R1107 HydrophobicContact CE3-CB 4.15Å; W1103-R1107 HydrophobicContact CH2-CB 3.93Å; W1103-R1107 HydrophobicContact CH2-CG 3.62Å; W1103-R1107 HydrophobicContact CZ2-CB 4.31Å; W1103-R1107 HydrophobicContact CZ2-CG 4.12Å; W1103-R1107 HydrophobicContact CZ3-CB 3.85Å; W1103-R1107 HydrophobicContact CZ3-CG 3.97Å; W1103-R1107 WeakPolarHBondContact O-CB 3.48Å; W1103-R1107 PolarHBondContact O-N 3.03Å
1104	F	98.2	Very high	95.1	Very high	2 Å²	2	72.1 Å²	72.1	1%	0.009	35%	0.346	C	S	.	.	H	α-helix	trans	-62.6	-41.8	177.4	-91.3	-87.3	0	0	0	112.8	L1071 L1074 Y1075 P1081 L1089 V1100 Q1101 V1102 N1106 R1107 R1108	L1071-F1104 HydrophobicContact CD2-CD2 4.43Å; L1071-F1104 HydrophobicContact CD2-CE2 3.94Å; L1074-F1104 HydrophobicContact CB-CZ 4.1Å; L1074-F1104 HydrophobicContact CD2-CE2 4.13Å; L1074-F1104 HydrophobicContact CD2-CZ 3.78Å; L1074-F1104 HydrophobicContact CG-CZ 3.88Å; Y1075-F1104 AromaticContact CD2-CD1 3.81Å; Y1075-F1104 HydrophobicContact CD2-CD1 3.81Å; Y1075-F1104 AromaticContact CD2-CE1 3.76Å; Y1075-F1104 HydrophobicContact CD2-CE1 3.76Å; Y1075-F1104 HydrophobicContact CG-CE1 4.36Å; P1081-F1104 HydrophobicContact CG-CD1 3.7Å; P1081-F1104 HydrophobicContact CG-CD2 4.12Å; P1081-F1104 HydrophobicContact CG-CE1 3.55Å; P1081-F1104 HydrophobicContact CG-CE2 3.99Å; P1081-F1104 HydrophobicContact CG-CG 4.01Å; P1081-F1104 HydrophobicContact CG-CZ 3.73Å; L1089-F1104 HydrophobicContact CD2-CE2 4.41Å; V1100-F1104 HydrophobicContact CG1-CD2 3.85Å; V1100-F1104 HydrophobicContact CG1-CE2 3.94Å; V1100-F1104 WeakPolarHBondContact O-CD2 3.39Å; V1100-F1104 PolarHBondContact O-N 2.83Å; Q1101-F1104 PolarHBondContact O-N 3.25Å; V1102-F1104 PolarHBondContact O-N 2.94Å; F1104-N1106 PolarHBondContact O-N 3.46Å; F1104-R1107 PolarHBondContact O-N 2.57Å; F1104-R1108 WeakPolarHBondContact O-CG 3.45Å; F1104-R1108 PolarHBondContact O-N 3.21Å
1105	K	97.2	Very high	94.3	Very high	108 Å²	108	67.9 Å²	67.9	47%	0.47	34%	0.336	S	S	.	.	H	α-helix	trans	-57.9	-46.6	172.4	-77.3	172.2	172.3	170.1	0	111.4	Q1101 V1102 W1103 A1109	Q1101-K1105 WeakPolarHBondContact O-CG 3.31Å; Q1101-K1105 PolarHBondContact O-N 3.4Å; V1102-K1105 PolarHBondContact O-N 3.01Å; W1103-K1105 PolarHBondContact O-N 3.45Å; K1105-A1109 PolarHBondContact O-N 3.21Å
1106	N	97.4	Very high	93.5	Very high	104 Å²	104	75.5 Å²	75.5	56%	0.556	36%	0.364	S	S	*	.	H	α-helix	trans	-67.7	-39.4	179.1	-68.7	-19.2	0	0	0	112.8	V1102 W1103 F1104 A1109 K1110	V1102-N1106 WeakPolarHBondContact O-CB 3.2Å; V1102-N1106 VanDerWaalsContact O-CG 3.24Å; V1102-N1106 PolarHBondContact O-N 2.88Å; V1102-N1106 PolarHBondContact O-ND2 2.63Å; W1103-N1106 PolarHBondContact O-N 3.35Å; F1104-N1106 PolarHBondContact O-N 3.46Å; N1106-A1109 PolarHBondContact O-N 3.37Å; N1106-K1110 PolarHBondContact O-N 3.2Å
1107	R	97.4	Very high	92.5	Very high	60 Å²	60	78.1 Å²	78.1	23%	0.226	37%	0.37	C	S	.	.	H	α-helix	trans	-65.8	-39.6	178.9	-168.8	65.8	176.7	80.8	-6	111.9	E1072 Y1075 W1103 F1104 G1111	E1072-R1107 IonicContact OE1-CZ 3.69Å; E1072-R1107 VanDerWaalsContact OE1-CZ 3.29Å; E1072-R1107 IonicContact OE1-NE 3.45Å; E1072-R1107 PolarHBondContact OE1-NE 3.25Å; E1072-R1107 IonicContact OE1-NH2 2.71Å; E1072-R1107 PolarHBondContact OE1-NH2 3.49Å; Y1075-R1107 HydrophobicContact CD1-CG 3.92Å; Y1075-R1107 HydrophobicContact CD2-CB 3.99Å; Y1075-R1107 HydrophobicContact CD2-CG 3.58Å; Y1075-R1107 HydrophobicContact CE1-CG 3.87Å; Y1075-R1107 HydrophobicContact CE2-CB 3.81Å; Y1075-R1107 HydrophobicContact CE2-CG 3.52Å; Y1075-R1107 HydrophobicContact CG-CG 3.79Å; W1103-R1107 HydrophobicContact CD2-CB 4.5Å; W1103-R1107 HydrophobicContact CE3-CB 4.15Å; W1103-R1107 HydrophobicContact CH2-CB 3.93Å; W1103-R1107 HydrophobicContact CH2-CG 3.62Å; W1103-R1107 HydrophobicContact CZ2-CB 4.31Å; W1103-R1107 HydrophobicContact CZ2-CG 4.12Å; W1103-R1107 HydrophobicContact CZ3-CB 3.85Å; W1103-R1107 HydrophobicContact CZ3-CG 3.97Å; W1103-R1107 WeakPolarHBondContact O-CB 3.48Å; W1103-R1107 PolarHBondContact O-N 3.03Å; F1104-R1107 PolarHBondContact O-N 2.57Å; R1107-G1111 PolarHBondContact O-N 2.8Å; R1107-G1111 VanDerWaalsContact O-N 3.09Å
1108	R	96.9	Very high	91.3	Very high	54 Å²	54	81.5 Å²	81.5	20%	0.204	39%	0.389	C	S	.	.	H	α-helix	trans	-63.7	-43.1	170.5	-71.5	-166.3	-65.7	-92.9	6	112.3	Y1075 R1079 Y1080 F1104 K1110 G1111 R1112	Y1075-R1108 HydrophobicContact CE2-CG 3.83Å; R1079-R1108 WeakPolarHBondContact O-CD 3.5Å; R1079-R1108 PolarHBondContact O-NH1 3.43Å; Y1080-R1108 VanDerWaalsContact CE1-NE 3.32Å; Y1080-R1108 VanDerWaalsContact CZ-CD 3.42Å; F1104-R1108 WeakPolarHBondContact O-CG 3.45Å; F1104-R1108 PolarHBondContact O-N 3.21Å; R1108-K1110 PolarHBondContact O-N 2.76Å; R1108-G1111 PolarHBondContact O-N 3.33Å; R1108-R1112 PolarHBondContact O-N 3.4Å
1109	A	95.9	Very high	89.9	Confident	38 Å²	38	81 Å²	81	31%	0.314	39%	0.385	S	S	.	.	H	α-helix	trans	-60.4	-45.3	176.8	0	0	0	0	0	112.1	K1105 N1106 G1111 R1112 N1113	K1105-A1109 PolarHBondContact O-N 3.21Å; N1106-A1109 PolarHBondContact O-N 3.37Å; A1109-G1111 VanDerWaalsContact C-N 3.33Å; A1109-G1111 PolarHBondContact O-N 3.08Å; A1109-R1112 PolarHBondContact O-N 3.33Å; A1109-N1113 PolarHBondContact O-N 3.08Å; A1109-N1113 VanDerWaalsContact O-N 3.17Å; A1109-N1113 PolarHBondContact O-OD1 3.42Å
1110	K	93.4	Very high	88.2	Confident	125 Å²	125	80.6 Å²	80.6	54%	0.543	39%	0.393	S	S	.	.	H	α-helix	trans	-58.2	-44.1	173.7	-172.5	178.1	178.1	-176.6	0	111.7	N1106 R1108 R1112 N1113 Q1114	N1106-K1110 PolarHBondContact O-N 3.2Å; R1108-K1110 PolarHBondContact O-N 2.76Å; K1110-R1112 PolarHBondContact O-N 3.44Å; K1110-N1113 PolarHBondContact O-N 3.19Å; K1110-Q1114 WeakPolarHBondContact O-CG 3.41Å; K1110-Q1114 PolarHBondContact O-N 3.27Å
1111	G	91.3	Very high	86.4	Confident	22 Å²	22	84.6 Å²	84.6	23%	0.227	42%	0.417	C	S	.	.	H	α-helix	trans	-60	-43.6	177.2	0	0	0	0	0	113.9	R1107 R1108 A1109 N1113 Q1114 Q1115	R1107-G1111 PolarHBondContact O-N 2.8Å; R1107-G1111 VanDerWaalsContact O-N 3.09Å; R1108-G1111 PolarHBondContact O-N 3.33Å; A1109-G1111 VanDerWaalsContact C-N 3.33Å; A1109-G1111 PolarHBondContact O-N 3.08Å; G1111-N1113 VanDerWaalsContact C-N 3.3Å; G1111-N1113 PolarHBondContact O-N 2.86Å; G1111-Q1114 PolarHBondContact O-N 2.95Å; G1111-Q1115 PolarHBondContact O-N 3.28Å; G1111-Q1115 VanDerWaalsContact O-N 3.11Å
1112	R	90.9	Very high	84.4	Confident	132 Å²	132	85.9 Å²	85.9	50%	0.498	43%	0.426	S	S	.	.	H	α-helix	trans	-63.3	-35.3	175.7	-67	-165.6	-62.3	-167	2.9	112.4	R1108 A1109 K1110 R1116	R1108-R1112 PolarHBondContact O-N 3.4Å; A1109-R1112 PolarHBondContact O-N 3.33Å; K1110-R1112 PolarHBondContact O-N 3.44Å; R1112-R1116 WeakPolarHBondContact O-CG 3.46Å; R1112-R1116 PolarHBondContact O-N 3.14Å
1113	N	83.3	Confident	82.3	Confident	94 Å²	94	87 Å²	87	50%	0.503	43%	0.43	S	S	.	.	H	α-helix	trans	-70.3	-40.3	177.3	-69.5	3.6	0	0	0	112	A1109 K1110 G1111 R1116 Q1117	A1109-N1113 PolarHBondContact O-N 3.08Å; A1109-N1113 VanDerWaalsContact O-N 3.17Å; A1109-N1113 PolarHBondContact O-OD1 3.42Å; K1110-N1113 PolarHBondContact O-N 3.19Å; G1111-N1113 VanDerWaalsContact C-N 3.3Å; G1111-N1113 PolarHBondContact O-N 2.86Å; N1113-R1116 PolarHBondContact O-N 3.3Å; N1113-Q1117 WeakPolarHBondContact O-CG 3.44Å; N1113-Q1117 PolarHBondContact O-N 3.16Å
1114	Q	84	Confident	80.2	Confident	87 Å²	87	91.4 Å²	91.4	41%	0.407	46%	0.455	S	S	.	.	H	α-helix	trans	-61.8	-44.3	175.9	-69.5	174.1	-66.6	0	0	111.5	K1110 G1111 R1116 Q1117 N1118	K1110-Q1114 WeakPolarHBondContact O-CG 3.41Å; K1110-Q1114 PolarHBondContact O-N 3.27Å; G1111-Q1114 PolarHBondContact O-N 2.95Å; Q1114-R1116 VanDerWaalsContact C-N 3.3Å; Q1114-R1116 PolarHBondContact O-N 2.84Å; Q1114-Q1117 PolarHBondContact O-N 3.22Å; Q1114-N1118 PolarHBondContact O-N 3.41Å; Q1114-N1118 VanDerWaalsContact O-N 3.14Å; Q1114-N1118 PolarHBondContact O-OD1 3.01Å
1115	Q	80.5	Confident	78.1	Confident	146 Å²	146	96.3 Å²	96.3	68%	0.682	48%	0.482	S	S	*	.	H	α-helix	trans	-60.6	-38.4	176	-169.4	176.4	8	0	0	112.6	G1111 S1119	G1111-Q1115 PolarHBondContact O-N 3.28Å; G1111-Q1115 VanDerWaalsContact O-N 3.11Å; Q1115-S1119 PolarHBondContact O-N 3.13Å
1116	R	79.5	Confident	75.8	Confident	180 Å²	180	95.2 Å²	95.2	68%	0.679	48%	0.481	S	S	*	.	H	α-helix	trans	-67	-43.1	175	-73.9	178.2	175.7	-168.2	-2.5	112.4	R1112 N1113 Q1114 N1118 S1119 T1120	R1112-R1116 WeakPolarHBondContact O-CG 3.46Å; R1112-R1116 PolarHBondContact O-N 3.14Å; N1113-R1116 PolarHBondContact O-N 3.3Å; Q1114-R1116 VanDerWaalsContact C-N 3.3Å; Q1114-R1116 PolarHBondContact O-N 2.84Å; R1116-N1118 PolarHBondContact O-N 3.2Å; R1116-S1119 PolarHBondContact O-N 3.1Å; R1116-S1119 PolarHBondContact O-OG 2.82Å; R1116-T1120 PolarHBondContact O-N 3.09Å; R1116-T1120 PolarHBondContact O-OG1 3.26Å
1117	Q	76.1	Confident	73.5	Confident	127 Å²	127	93.8 Å²	93.8	59%	0.593	47%	0.473	S	S	*	.	H	α-helix	trans	-60.3	-44.6	179.7	-76.3	174.9	-37.7	0	0	111.9	N1113 Q1114 S1119 T1120 V1121	N1113-Q1117 WeakPolarHBondContact O-CG 3.44Å; N1113-Q1117 PolarHBondContact O-N 3.16Å; Q1114-Q1117 PolarHBondContact O-N 3.22Å; Q1117-S1119 PolarHBondContact O-N 3.19Å; Q1117-T1120 PolarHBondContact O-N 3.33Å; Q1117-T1120 VanDerWaalsContact O-N 3.15Å; Q1117-T1120 PolarHBondContact O-OG1 3.48Å; Q1117-V1121 PolarHBondContact O-N 2.74Å
1118	N	73	Confident	71.2	Confident	110 Å²	110	96.9 Å²	96.9	59%	0.588	49%	0.494	S	S	*	.	H	α-helix	trans	-57.6	-50.2	175.3	-67	22.4	0	0	0	111	Q1114 R1116 T1120 V1121	Q1114-N1118 PolarHBondContact O-N 3.41Å; Q1114-N1118 VanDerWaalsContact O-N 3.14Å; Q1114-N1118 PolarHBondContact O-OD1 3.01Å; R1116-N1118 PolarHBondContact O-N 3.2Å; N1118-T1120 PolarHBondContact O-N 3.33Å; N1118-V1121 PolarHBondContact O-N 2.88Å
1119	S	65.7	Low	68.9	Low	59 Å²	59	98.9 Å²	98.9	41%	0.413	51%	0.507	S	S	.	.	H	α-helix	trans	-61.7	-14.9	179.5	67	0	0	0	0	115.4	Q1115 R1116 Q1117 N1123	Q1115-S1119 PolarHBondContact O-N 3.13Å; R1116-S1119 PolarHBondContact O-N 3.1Å; R1116-S1119 PolarHBondContact O-OG 2.82Å; Q1117-S1119 PolarHBondContact O-N 3.19Å; S1119-N1123 PolarHBondContact O-ND2 3.02Å
1120	T	61.5	Low	66.7	Low	81 Å²	81	102.1 Å²	102.1	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-89.7	-20.9	173.1	49	0	0	0	0	114.3	R1116 Q1117 N1118	R1116-T1120 PolarHBondContact O-N 3.09Å; R1116-T1120 PolarHBondContact O-OG1 3.26Å; Q1117-T1120 PolarHBondContact O-N 3.33Å; Q1117-T1120 VanDerWaalsContact O-N 3.15Å; Q1117-T1120 PolarHBondContact O-OG1 3.48Å; N1118-T1120 PolarHBondContact O-N 3.33Å
1121	V	59.5	Low	64.6	Low	84 Å²	84	103.7 Å²	103.7	51%	0.509	53%	0.525	S	S	.	.	H	α-helix	trans	-74.7	-48.2	177.1	178.2	0	0	0	0	110.2	Q1117 N1118 N1123 N1124 N1125	Q1117-V1121 PolarHBondContact O-N 2.74Å; N1118-V1121 PolarHBondContact O-N 2.88Å; V1121-N1123 PolarHBondContact O-N 3.21Å; V1121-N1124 PolarHBondContact O-N 3.37Å; V1121-N1125 PolarHBondContact O-N 2.93Å
1122	D	56.5	Low	62.6	Low	97 Å²	97	107.1 Å²	107.1	52%	0.519	54%	0.542	S	S	.	.	H	α-helix	trans	-58.8	-34.3	-178.9	-52.6	-35.9	0	0	0	112.3	N1126	D1122-N1126 PolarHBondContact O-N 2.67Å; D1122-N1126 PolarHBondContact O-ND2 2.61Å
1123	N	53.4	Low	60.2	Low	92 Å²	92	106.7 Å²	106.7	49%	0.492	55%	0.549	S	S	.	.	H	α-helix	trans	-73.4	-29.5	178	-84.8	-70.5	0	0	0	113.5	S1119 V1121 N1127	S1119-N1123 PolarHBondContact O-ND2 3.02Å; V1121-N1123 PolarHBondContact O-N 3.21Å; N1123-N1127 VanDerWaalsContact O-CB 3.29Å; N1123-N1127 WeakPolarHBondContact O-CB 2.8Å; N1123-N1127 PolarHBondContact O-N 2.91Å; N1123-N1127 PolarHBondContact O-ND2 2.86Å
1124	N	53.4	Low	58.2	Low	117 Å²	117	109.7 Å²	109.7	63%	0.626	57%	0.565	S	S	*	*	H	α-helix	trans	-76.9	-37.2	-179.2	-79.5	-16.2	0	0	0	112.5	V1121 L1128	V1121-N1124 PolarHBondContact O-N 3.37Å; N1124-L1128 PolarHBondContact O-N 3.49Å
1125	N	52.9	Low	56.3	Low	106 Å²	106	111.5 Å²	111.5	57%	0.567	58%	0.582	S	S	*	*	H	α-helix	trans	-68.9	-45.4	177.4	-69.6	-7.2	0	0	0	111.5	V1121 N1127 L1128 I1129	V1121-N1125 PolarHBondContact O-N 2.93Å; N1125-N1127 VanDerWaalsContact C-N 3.34Å; N1125-N1127 PolarHBondContact O-N 3.31Å; N1125-L1128 PolarHBondContact O-N 3.21Å; N1125-L1128 VanDerWaalsContact O-N 3.14Å; N1125-I1129 PolarHBondContact O-N 2.93Å
1126	N	49.6	Very low	54.1	Low	84 Å²	84	111.5 Å²	111.5	45%	0.449	59%	0.587	S	S	.	*	H	α-helix	trans	-64	-36.5	177.6	-73.7	-49.5	0	0	0	112.8	D1122 L1128 I1130	D1122-N1126 PolarHBondContact O-N 2.67Å; D1122-N1126 PolarHBondContact O-ND2 2.61Å; N1126-L1128 VanDerWaalsContact C-N 3.25Å; N1126-L1128 PolarHBondContact O-N 2.94Å; N1126-I1130 WeakPolarHBondContact O-CG1 2.84Å; N1126-I1130 PolarHBondContact O-N 2.97Å
1127	N	49	Very low	52	Low	75 Å²	75	109.1 Å²	109.1	40%	0.401	59%	0.592	S	S	.	*	H	α-helix	trans	-75	-6.6	176	-82.4	-66.5	0	0	0	114.7	N1123 N1125 K1131	N1123-N1127 VanDerWaalsContact O-CB 3.29Å; N1123-N1127 WeakPolarHBondContact O-CB 2.8Å; N1123-N1127 PolarHBondContact O-N 2.91Å; N1123-N1127 PolarHBondContact O-ND2 2.86Å; N1125-N1127 VanDerWaalsContact C-N 3.34Å; N1125-N1127 PolarHBondContact O-N 3.31Å; N1127-K1131 WeakPolarHBondContact O-CD 3.29Å; N1127-K1131 VanDerWaalsContact O-CE 3.32Å; N1127-K1131 WeakPolarHBondContact O-CE 2.99Å; N1127-K1131 VanDerWaalsContact O-CG 3.28Å; N1127-K1131 WeakPolarHBondContact O-CG 3.18Å
1128	L	48.6	Very low	49.8	Very low	125 Å²	125	108.8 Å²	108.8	65%	0.654	60%	0.602	S	S	*	*	H	α-helix	trans	-87.3	-45.2	172	-153	72.1	0	0	0	110.8	N1124 N1125 N1126 I1130 K1131	N1124-L1128 PolarHBondContact O-N 3.49Å; N1125-L1128 PolarHBondContact O-N 3.21Å; N1125-L1128 VanDerWaalsContact O-N 3.14Å; N1126-L1128 VanDerWaalsContact C-N 3.25Å; N1126-L1128 PolarHBondContact O-N 2.94Å; L1128-I1130 PolarHBondContact O-N 3.02Å; L1128-K1131 PolarHBondContact O-N 3.1Å; L1128-K1131 VanDerWaalsContact O-N 3.15Å
1129	I	50	Low	48.2	Very low	96 Å²	96	112.2 Å²	112.2	49%	0.492	62%	0.615	S	S	.	*	H	α-helix	trans	-64.8	-37.5	-179.5	-61.7	170.3	0	0	0	111.9	N1125 K1131 T1132	N1125-I1129 PolarHBondContact O-N 2.93Å; I1129-K1131 PolarHBondContact O-N 3.19Å; I1129-T1132 PolarHBondContact O-OG1 2.78Å; I1129-T1132 VanDerWaalsContact O-OG1 3.07Å
1130	I	49	Very low	46.6	Very low	106 Å²	106	119.7 Å²	119.7	54%	0.544	64%	0.635	S	S	.	*	H	α-helix	trans	-68.6	-24.6	177.7	-65.9	169.3	0	0	0	111.8	N1126 L1128	N1126-I1130 WeakPolarHBondContact O-CG1 2.84Å; N1126-I1130 PolarHBondContact O-N 2.97Å; L1128-I1130 PolarHBondContact O-N 3.02Å
1131	K	48.9	Very low	45.4	Very low	157 Å²	157	124.4 Å²	124.4	68%	0.683	65%	0.652	S	S	*	*	H	α-helix	trans	-83.8	-14.4	-177.5	-71.5	177.7	-171.8	174.5	0	114.4	N1127 L1128 I1129	N1127-K1131 WeakPolarHBondContact O-CD 3.29Å; N1127-K1131 VanDerWaalsContact O-CE 3.32Å; N1127-K1131 WeakPolarHBondContact O-CE 2.99Å; N1127-K1131 VanDerWaalsContact O-CG 3.28Å; N1127-K1131 WeakPolarHBondContact O-CG 3.18Å; L1128-K1131 PolarHBondContact O-N 3.1Å; L1128-K1131 VanDerWaalsContact O-N 3.15Å; I1129-K1131 PolarHBondContact O-N 3.19Å
1132	T	48.6	Very low	44.2	Very low	94 Å²	94	127.7 Å²	127.7	58%	0.577	67%	0.667	S	S	*	*	H	α-helix	trans	-91.9	-14.6	-180	51.7	0	0	0	0	114.1	I1129	I1129-T1132 PolarHBondContact O-OG1 2.78Å; I1129-T1132 VanDerWaalsContact O-OG1 3.07Å
1133	N	42.4	Very low	43.4	Very low	123 Å²	123	129.6 Å²	129.6	66%	0.658	68%	0.681	S	S	*	*	S	Bend	trans	-103.7	-1.7	-168.6	-68	7.3	0	0	0	115	V1135	N1133-V1135 VanDerWaalsContact C-N 3.34Å; N1133-V1135 PolarHBondContact O-N 3Å
1134	N	40.3	Very low	42.1	Very low	157 Å²	157	138 Å²	138	84%	0.84	71%	0.713	S	S	*	*			trans	-88.4	68.6	172.9	-91.2	-3.2	0	0	0	111.7
1135	V	43.2	Very low	41.5	Very low	125 Å²	125	139 Å²	139	76%	0.758	72%	0.718	S	S	*	*			trans	-99.2	135.7	162.6	178.5	0	0	0	0	108.4	N1133 V1137	N1133-V1135 VanDerWaalsContact C-N 3.34Å; N1133-V1135 PolarHBondContact O-N 3Å; V1135-V1137 PolarHBondContact O-N 3.43Å
1136	N	35.5	Very low	40.9	Very low	147 Å²	147	140.7 Å²	140.7	79%	0.786	73%	0.725	S	S	*	*			trans	-55.8	123.6	-166.4	-64.9	-60.2	0	0	0	114.9
1137	V	35.7	Very low	40.5	Very low	130 Å²	130	143.9 Å²	143.9	79%	0.788	74%	0.741	S	S	*	*			trans	-128.4	79.7	146.2	-173.7	0	0	0	0	108.7	V1135	V1135-V1137 PolarHBondContact O-N 3.43Å
1138	C	30.1	Very low	40	Very low	119 Å²	119	147.9 Å²	147.9	80%	0.804	76%	0.761	S	S	*	*			trans	-101.7	92.6	164.9	-73.4	0	0	0	0	108.4
1139	Q	39.4	Very low	39.4	Very low	182 Å²	182	149.4 Å²	149.4	85%	0.85	77%	0.767	S	S	*	*			trans	-113.8	120.7	165.6	-76.8	-173.5	-36.8	0	0	109.4
1140	Y	30.4	Very low	38.7	Very low	217 Å²	217	152.9 Å²	152.9	85%	0.851	79%	0.786	S	S	*	*			trans	-69.8	140.1	165.7	-94	-115.5	0	0	0	109.2
1141	E	36.7	Very low	38	Very low	179 Å²	179	156.3 Å²	156.3	84%	0.836	80%	0.803	S	S	*	*			trans	-156.7	87	135.6	-120.4	168.5	-150.6	0	0	111.4	V1143	E1141-V1143 HydrophobicContact CG-CG2 4.48Å
1142	N	33.9	Very low	37.1	Very low	154 Å²	154	156.2 Å²	156.2	82%	0.824	81%	0.812	S	S	*	*			trans	-82.7	107.1	154.7	-91.5	-37.7	0	0	0	106.9	K1144	N1142-K1144 PolarHBondContact O-N 2.9Å; N1142-K1144 VanDerWaalsContact O-N 3.08Å
1143	V	40.5	Very low	36.2	Very low	136 Å²	136	161.4 Å²	161.4	82%	0.824	83%	0.832	S	S	*	*			trans	-79.8	90.1	173.4	-180	0	0	0	0	109.5	E1141	E1141-V1143 HydrophobicContact CG-CG2 4.48Å
1144	K	26.1	Very low	35.6	Very low	268 Å²	268	164.9 Å²	164.9	100%	1.165	85%	0.848	S	S	*	*			trans	-155.4	0	153.7	-161.1	176.6	-176	-178.3	0	111.9	N1142	N1142-K1144 PolarHBondContact O-N 2.9Å; N1142-K1144 VanDerWaalsContact O-N 3.08Å

Retrieved 1,144 of 1,144 residues in 1237.8 ms (Link to these results)

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