A0A5K4F0W4_SCHMA Loading...

Lim homeobox protein

AlphaFold DB , UniProt , Accession A0A5K4F0W4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,302 aa.

						>A0A5K4F0W4_SCHMA|A0A5K4F0W4
MTTANPEIWVTSNFNQNGIMNQNTMSNGFNESNNNSISAMIPITDTTTSITTISTNNGSNNNSNGSNINTVLISDTDLQTYSSTKFICSSPNRIELNQSMNIHLKNNHTHNPPVTLIATDQDSNKSSNNSKLSTYCTQNKNRNDPNFNKINLLRCNECQSIIFDQYYHSIDDLTWHQNCLRCFDCGFVLTERCYTKDGHLYCREDFIKNFGPKCSACHKLIRNGELVRFARHYVYHINCFQCTICKKQFTTGDQYYLLYSDKFLICREHYYESGSSLIPQISTTRTSSEMDLLSILTNSNSSIKDVMKTERISESPSTLSNSVNCELLVNNGNCIQNIYDCETNTNMKNQLEQLKVFSQDDISDSFNQLNSSISEASIFSSTQSLSSIPSLLVLCSTPSSTSTAATTTPPVTSVNIVSSPIMNTITAFTSPSKTQINDTSKLIKPITDIGTSISNNNLINSEFKTQQILTENSLPDKYFSTIAKSQSTLEIKLQQNSNQSDNEYSTNLLYQSQTKSDYLFPSEMIDIMTSRTIASSSSSSSSSSSSSSTVSYLPNSITDHSQSIINTSINNTILNTTPFLSDQSINTNIPLFQCNQQFLKKSEQLTRHTTNLGAKIDMDKYLDENNLNCLRKLYETHDNYENHITKEMIHSNSNTTTTITTNVNNSSINSNYHNLSWINKEINENNELFINENSFSTLCNHNTFCLSTINERISNKENQLINQTKNKVYLTRNEKLPLTVDTNHHCIDNNNNNNNNNDNLAILSRSKMIINDRFAQNVNLLIHNNNEVNDVNRELVNHISEDDDEGDDNDDKDDETMNNSREQCENNNNNNGRHHSKQLDEFKNTMLHSDHENDYNDINSSSSQDRFIHLLHQSHSFESPIQTNCCEMPTSEVSSQRSLVDDEGDDVEVDDDDDDDIDDDDESMTGQCGINHRQHHLTSGIESGLSCGGPGNNSGIGLNTNSGNNNNNNGSGAKRRGPRTTIKAKQLDTLKTAFAATPKPTRHVRESLAQETGLSMRVIQVWFQNRRSKERRMKQLNALGTRRSFYRNPRRLRGIRSGILSNELNSGGPGDIITNSAYHEYLVGPSPDIYNAIASASAIASGVPFNLPGAIPNLTVNYPLSQAHPLPSNDSLISGTTAHLLNNDTGSFHNDNASHFNSNPFHLTQNFPSNSLNCLPYNPSNLSGSSGFRDETKSDLLYTPSYFPSSSSSSTSSMSSQQLIKFPLYNNTNHNCSPNGSIFSLSDPRDYHLSNFLESNNNMKSYNSTCQPNSLTNRPVYNSTGINFRNVPPPIFDEMTCRPNLV
					

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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	31.7	Very low	31.2	Very low	238 Å²	238	149.6 Å²	149.6	100%	1.172	82%	0.818	S	S	*	*				0	127.7	0	-66	170	172.5	0	0	108
2	T	31.1	Very low	30.7	Very low	123 Å²	123	145.3 Å²	145.3	76%	0.755	81%	0.807	S	S	*	*			cis	-154.1	110.5	-4.9	16.8	0	0	0	0	109.9
3	T	31.3	Very low	30.2	Very low	134 Å²	134	144.5 Å²	144.5	82%	0.822	80%	0.8	S	S	*	*			trans	32.3	117.3	130.3	54.5	0	0	0	0	120.7
4	A	36.3	Very low	29.9	Very low	101 Å²	101	146.1 Å²	146.1	84%	0.835	80%	0.796	S	S	*	*			trans	-167.1	143.1	131.9	0	0	0	0	0	112.3
5	N	29.7	Very low	29.7	Very low	134 Å²	134	144.7 Å²	144.7	72%	0.717	79%	0.787	S	S	*	*			trans	-68.1	158.1	-172.7	-68	4.7	0	0	0	115.9	E7	N5-E7 HydrophobicContact CB-CB 4.23Å
6	P	35.9	Very low	29.7	Very low	135 Å²	135	144.4 Å²	144.4	88%	0.877	78%	0.779	S	S	*	*			trans	-110.7	96.2	140.6	34.5	-21.9	0	0	0	110.1
7	E	31.5	Very low	29.6	Very low	154 Å²	154	144.5 Å²	144.5	72%	0.72	78%	0.779	S	S	*	*			trans	-140.2	166.8	179.9	-156.4	173.1	-133.8	0	0	111.9	N5	N5-E7 HydrophobicContact CB-CB 4.23Å
8	I	30.3	Very low	29.8	Very low	135 Å²	135	140.3 Å²	140.3	69%	0.692	78%	0.775	S	S	*	*			trans	75.8	101.7	176.1	-54.3	174.8	0	0	0	115	V10	I8-V10 HydrophobicContact CG2-CG2 3.73Å
9	W	25.9	Very low	29.7	Very low	254 Å²	254	140.7 Å²	140.7	96%	0.962	77%	0.774	S	S	*	*			trans	-75.9	128.8	149.5	-77.3	15.3	0	0	0	109.3
10	V	29.2	Very low	29.7	Very low	121 Å²	121	141.7 Å²	141.7	73%	0.733	78%	0.775	S	S	*	*			trans	-131.8	118.1	154.3	172.1	0	0	0	0	108.9	I8	I8-V10 HydrophobicContact CG2-CG2 3.73Å
11	T	30	Very low	29.8	Very low	117 Å²	117	142.1 Å²	142.1	72%	0.718	78%	0.776	S	S	*	*			trans	-81.3	165.4	166.9	49.9	0	0	0	0	110.9
12	S	25.2	Very low	29.8	Very low	97 Å²	97	138.1 Å²	138.1	68%	0.678	76%	0.755	S	S	*	*			trans	81.2	147.9	177.9	90.5	0	0	0	0	114.4
13	N	25	Very low	29.9	Very low	135 Å²	135	140.1 Å²	140.1	72%	0.722	76%	0.761	S	S	*	*			cis	-158.5	145.8	-7.5	-121.1	0.3	0	0	0	112.4
14	F	25.4	Very low	29.9	Very low	168 Å²	168	139 Å²	139	74%	0.737	75%	0.754	S	S	*	*			trans	51.6	144.8	147.7	-86.6	-108.2	0	0	0	123.4
15	N	27	Very low	29.6	Very low	124 Å²	124	142.6 Å²	142.6	66%	0.663	76%	0.756	S	S	*	*			trans	73	150.7	148.5	-74.9	-9.8	0	0	0	120.5
16	Q	30.3	Very low	29.6	Very low	141 Å²	141	140.7 Å²	140.7	66%	0.659	75%	0.753	S	S	*	*			cis	-171	147	-33.3	-132.3	-176.1	23	0	0	109.7
17	N	28.2	Very low	29.4	Very low	145 Å²	145	141.8 Å²	141.8	78%	0.775	75%	0.752	S	S	*	*			trans	63.7	162.2	168.7	-44.5	-41.2	0	0	0	113.9
18	G	31.9	Very low	29.3	Very low	69 Å²	69	137.4 Å²	137.4	71%	0.711	75%	0.748	S	S	*	*			cis	166.9	157.4	2.8	0	0	0	0	0	105.9
19	I	28.8	Very low	29.3	Very low	149 Å²	149	140.5 Å²	140.5	76%	0.764	76%	0.757	S	S	*	*			cis	-177.8	140.2	45.9	-101.8	162.4	0	0	0	106.7
20	M	29.3	Very low	29.6	Very low	159 Å²	159	134.8 Å²	134.8	78%	0.783	75%	0.745	S	S	*	*			trans	49.8	150.5	147.1	-66.2	167.1	-178.2	0	0	120.6
21	N	32.1	Very low	29.5	Very low	151 Å²	151	137.3 Å²	137.3	81%	0.807	75%	0.749	S	S	*	*			cis	-141.4	157.8	37	-134.7	-14.6	0	0	0	115.3
22	Q	32.1	Very low	29.6	Very low	155 Å²	155	136.4 Å²	136.4	72%	0.724	75%	0.747	S	S	*	*			trans	-94.5	159.1	179.7	-62.5	170.5	-13.5	0	0	110.5
23	N	31.5	Very low	29.9	Very low	164 Å²	164	137.8 Å²	137.8	88%	0.877	75%	0.747	S	S	*	*				-163.9	125.7	116.7	-96.1	-22.9	0	0	0	111.1
24	T	31.9	Very low	30.1	Very low	112 Å²	112	137.4 Å²	137.4	69%	0.687	75%	0.745	S	S	*	*			trans	-92	166.5	171.1	48.9	0	0	0	0	110.3
25	M	30.2	Very low	30.4	Very low	175 Å²	175	136.8 Å²	136.8	86%	0.862	75%	0.749	S	S	*	*			trans	-164.6	154.1	134.7	-101.9	-68	109.3	0	0	108.7
26	S	30.3	Very low	30.7	Very low	94 Å²	94	135.7 Å²	135.7	66%	0.657	75%	0.751	S	S	*	*			trans	-132.4	-174.2	-164.6	-54.5	0	0	0	0	112.2
27	N	31	Very low	30.7	Very low	159 Å²	159	136.5 Å²	136.5	85%	0.85	76%	0.759	S	S	*	*			trans	102	137.6	170.5	-49.8	-19.9	0	0	0	114.4
28	G	29.9	Very low	30.8	Very low	62 Å²	62	134.7 Å²	134.7	64%	0.639	76%	0.757	S	S	*	*			cis	127.3	93.4	-10.9	0	0	0	0	0	115.1
29	F	31	Very low	30.6	Very low	200 Å²	200	135.1 Å²	135.1	88%	0.877	75%	0.754	S	S	*	*			trans	-153.2	116.1	163	-78.7	-71.7	0	0	0	106.8
30	N	30.9	Very low	30.6	Very low	133 Å²	133	136.6 Å²	136.6	71%	0.711	76%	0.759	S	S	*	*				78.4	109.1	84.3	-82.4	25.8	0	0	0	115.2
31	E	28.3	Very low	30.7	Very low	175 Å²	175	134.9 Å²	134.9	82%	0.818	75%	0.752	S	S	*	*				34.2	125.2	129.3	-59.8	-174.5	142.6	0	0	118.2
32	S	31.1	Very low	30.5	Very low	97 Å²	97	133.6 Å²	133.6	68%	0.678	75%	0.752	S	S	*	*			cis	178.4	175.2	45.9	44.7	0	0	0	0	113.1
33	N	31	Very low	30.4	Very low	126 Å²	126	133 Å²	133	67%	0.674	75%	0.752	S	S	*	*			trans	78.1	101.2	152.5	-64	-37	0	0	0	121.6
34	N	29.7	Very low	30.4	Very low	128 Å²	128	130.5 Å²	130.5	68%	0.684	74%	0.743	S	S	*	*				60.6	117	119.3	-47.3	-24.5	0	0	0	120.6
35	N	31.7	Very low	30.2	Very low	154 Å²	154	133 Å²	133	82%	0.824	75%	0.753	S	S	*	*				-171.5	166.1	99.8	-93.2	-30.6	0	0	0	112.6
36	S	33.9	Very low	30.2	Very low	102 Å²	102	131 Å²	131	71%	0.713	75%	0.75	S	S	*	*			trans	65.4	100.9	173	-53.2	0	0	0	0	115.8
37	I	30.9	Very low	30	Very low	158 Å²	158	133 Å²	133	81%	0.81	76%	0.758	S	S	*	*				57.9	126.9	68.7	-54.1	169.4	0	0	0	110.7
38	S	28.7	Very low	30	Very low	107 Å²	107	131.9 Å²	131.9	75%	0.748	76%	0.758	S	S	*	*			cis	160.7	139	-17.2	-96	0	0	0	0	104.8
39	A	29	Very low	29.8	Very low	77 Å²	77	133.2 Å²	133.2	64%	0.636	76%	0.757	S	S	*	*			trans	26.5	110.6	157.3	0	0	0	0	0	120.2	I41	A39-I41 HydrophobicContact CB-CG1 4.41Å
40	M	27.8	Very low	29.6	Very low	180 Å²	180	130.7 Å²	130.7	89%	0.887	75%	0.752	S	S	*	*				-99.8	118.5	129.9	-67.5	178.6	175.5	0	0	105.4
41	I	32.2	Very low	29.6	Very low	124 Å²	124	130 Å²	130	64%	0.636	75%	0.752	S	S	*	*			cis	62.9	102.6	49.3	-51.6	175.9	0	0	0	110.2	A39 I43	A39-I41 HydrophobicContact CB-CG1 4.41Å; I41-I43 PolarHBondContact O-N 2.79Å
42	P	27.5	Very low	29.5	Very low	123 Å²	123	127.5 Å²	127.5	80%	0.799	75%	0.749	S	S	*	*			trans	-72.3	118.6	171.3	30.1	-31.6	0	0	0	109	T44	P42-T44 PolarHBondContact O-N 2.94Å
43	I	31.1	Very low	29.5	Very low	143 Å²	143	131 Å²	131	73%	0.733	76%	0.758	S	S	*	*			trans	-84.9	112.8	176	-62.1	178.1	0	0	0	108.2	I41	I41-I43 PolarHBondContact O-N 2.79Å
44	T	30.8	Very low	29.3	Very low	112 Å²	112	129.3 Å²	129.3	69%	0.687	76%	0.756	S	S	*	*			trans	-77.7	141.8	166	51.4	0	0	0	0	110.4	P42 T46	P42-T44 PolarHBondContact O-N 2.94Å; T44-T46 PolarHBondContact O-N 3.33Å
45	D	27.2	Very low	29.5	Very low	165 Å²	165	129.1 Å²	129.1	88%	0.882	76%	0.76	S	S	*	*			trans	-51.3	127.2	-179.8	-61.2	-68.3	0	0	0	113.5
46	T	31.4	Very low	29.5	Very low	132 Å²	132	127.9 Å²	127.9	81%	0.81	75%	0.754	S	S	*	*			trans	-137.4	137.2	164.9	33.1	0	0	0	0	110.1	T44	T44-T46 PolarHBondContact O-N 3.33Å
47	T	25.1	Very low	29.4	Very low	135 Å²	135	130.5 Å²	130.5	83%	0.828	76%	0.76	S	S	*	*			trans	-102.8	121.4	-163.5	41.1	0	0	0	0	113.6
48	T	31.2	Very low	29.4	Very low	137 Å²	137	126.2 Å²	126.2	84%	0.84	75%	0.754	S	S	*	*			trans	-175.3	149.8	158.2	32.3	0	0	0	0	109.6
49	S	25.4	Very low	29.7	Very low	90 Å²	90	126.4 Å²	126.4	63%	0.629	76%	0.756	S	S	*	*			cis	171.5	152	-32.4	47.7	0	0	0	0	109.4
50	I	27.5	Very low	29.9	Very low	147 Å²	147	129 Å²	129	75%	0.754	76%	0.759	S	S	*	*			trans	85.3	124.8	148.5	-75.8	160.2	0	0	0	121.2
51	T	29.8	Very low	30.2	Very low	117 Å²	117	126.6 Å²	126.6	72%	0.718	75%	0.75	S	S	*	*			trans	56.3	123	159.3	54.3	0	0	0	0	120.2
52	T	27.6	Very low	30	Very low	124 Å²	124	127.8 Å²	127.8	76%	0.761	76%	0.757	S	S	*	*			cis	90.4	114.2	35.9	67.2	0	0	0	0	116.7
53	I	30.3	Very low	30.3	Very low	169 Å²	169	128 Å²	128	87%	0.867	76%	0.761	S	S	*	*			trans	-176.2	149.7	150.1	-107.1	157.8	0	0	0	108.4
54	S	27.1	Very low	30.2	Very low	91 Å²	91	129 Å²	129	64%	0.636	77%	0.768	S	S	*	*			cis	-172.8	170.8	-31.5	-101.3	0	0	0	0	110.1
55	T	32.9	Very low	30.3	Very low	124 Å²	124	127.2 Å²	127.2	76%	0.761	77%	0.772	S	S	*	*			trans	76.1	147	167.2	73.2	0	0	0	0	119.2
56	N	31.6	Very low	30.5	Very low	129 Å²	129	125 Å²	125	69%	0.69	77%	0.769	S	S	*	*			cis	-168	138.8	-35.1	-106.7	-2.8	0	0	0	110.7
57	N	32.1	Very low	30.3	Very low	157 Å²	157	126.1 Å²	126.1	84%	0.84	77%	0.77	S	S	*	*			trans	59.8	143.4	155.6	-51.6	-23.8	0	0	0	119.5
58	G	31.9	Very low	30.4	Very low	67 Å²	67	127 Å²	127	69%	0.691	77%	0.768	S	S	*	*			cis	155.1	156.8	-9.7	0	0	0	0	0	113.5
59	S	35.2	Very low	30.2	Very low	112 Å²	112	127.7 Å²	127.7	78%	0.783	77%	0.767	S	S	*	*			trans	68.3	152.1	168.8	-59.6	0	0	0	0	118.6
60	N	32.8	Very low	30.3	Very low	132 Å²	132	129.2 Å²	129.2	71%	0.706	77%	0.773	S	S	*	*			cis	-164	152.6	-21.8	-109.2	-10.4	0	0	0	112.1
61	N	32.9	Very low	30.3	Very low	129 Å²	129	129 Å²	129	69%	0.69	78%	0.778	S	S	*	*			trans	60.9	117.3	146.1	-59.2	-15.2	0	0	0	123.5
62	N	28.8	Very low	30.3	Very low	149 Å²	149	131.1 Å²	131.1	80%	0.797	78%	0.784	S	S	*	*			trans	42.6	122.8	130.2	-62.3	-7.1	0	0	0	122.4
63	S	33.9	Very low	30.3	Very low	126 Å²	126	132.4 Å²	132.4	88%	0.881	79%	0.785	S	S	*	*				-165.8	154.4	118.2	-84	0	0	0	0	112.9
64	N	29.6	Very low	30.3	Very low	166 Å²	166	129.2 Å²	129.2	89%	0.888	78%	0.777	S	S	*	*			trans	-69.5	134.9	-176.7	-68.3	-54.7	0	0	0	112.7
65	G	31.6	Very low	30.5	Very low	74 Å²	74	132.3 Å²	132.3	76%	0.763	79%	0.787	S	S	*	*			trans	-167.9	105.6	170.4	0	0	0	0	0	111.8	N67	G65-N67 PolarHBondContact O-N 3.3Å
66	S	30.8	Very low	30.6	Very low	117 Å²	117	132 Å²	132	82%	0.818	79%	0.785	S	S	*	*			trans	-71.8	110.9	-179	54.3	0	0	0	0	111.6
67	N	29.1	Very low	30.5	Very low	156 Å²	156	133.7 Å²	133.7	83%	0.834	79%	0.794	S	S	*	*			trans	-155.2	152.5	158	-103.9	-40.1	0	0	0	113	G65	G65-N67 PolarHBondContact O-N 3.3Å
68	I	26	Very low	30.4	Very low	153 Å²	153	134.6 Å²	134.6	79%	0.785	80%	0.798	S	S	*	*			trans	-62	135.4	179.3	-61.9	150.3	0	0	0	110.3
69	N	27.5	Very low	30.3	Very low	152 Å²	152	140 Å²	140	81%	0.813	81%	0.805	S	S	*	*			trans	-157	147	151.1	-101	-38.1	0	0	0	112.8
70	T	27.3	Very low	30.1	Very low	123 Å²	123	140.8 Å²	140.8	76%	0.755	81%	0.806	S	S	*	*			trans	-66.6	141.1	176	43.1	0	0	0	0	112.5
71	V	28.5	Very low	30.1	Very low	143 Å²	143	145.6 Å²	145.6	87%	0.867	82%	0.815	S	S	*	*			trans	-109.4	138.4	160.4	178.9	0	0	0	0	108.2
72	L	28.7	Very low	29.9	Very low	161 Å²	161	144.5 Å²	144.5	84%	0.843	82%	0.818	S	S	*	*			trans	-83.8	141.9	-176.2	-65.9	161	0	0	0	110.6
73	I	28.4	Very low	29.8	Very low	151 Å²	151	142.7 Å²	142.7	77%	0.774	82%	0.817	S	S	*	*			trans	-82.7	134.1	162.4	-60.8	172.8	0	0	0	106.9
74	S	30.5	Very low	29.7	Very low	102 Å²	102	142.6 Å²	142.6	71%	0.713	81%	0.811	S	S	*	*			trans	-95.3	113.4	171.7	52.8	0	0	0	0	109.8	T76	S74-T76 PolarHBondContact O-N 2.88Å
75	D	29.7	Very low	29.6	Very low	156 Å²	156	144 Å²	144	83%	0.834	81%	0.809	S	S	*	*			trans	-74.6	104.2	-179.3	-62.9	-53	0	0	0	111.9
76	T	36	Very low	29.5	Very low	118 Å²	118	149.2 Å²	149.2	72%	0.724	81%	0.811	S	S	*	*			trans	-141.1	91.2	163	53.1	0	0	0	0	110.2	S74	S74-T76 PolarHBondContact O-N 2.88Å
77	D	29.4	Very low	29.2	Very low	163 Å²	163	150.6 Å²	150.6	87%	0.872	81%	0.808	S	S	*	*			trans	166.4	74.6	140.4	-84.8	-10.8	0	0	0	109.9
78	L	29.7	Very low	29.2	Very low	176 Å²	176	148.3 Å²	148.3	92%	0.921	80%	0.803	S	S	*	*			trans	-143.6	62.2	177.6	-148.3	85.7	0	0	0	112.7
79	Q	30.9	Very low	29.3	Very low	180 Å²	180	146.1 Å²	146.1	84%	0.841	80%	0.801	S	S	*	*			trans	-136.2	142.3	165.7	-68	-165.5	7.5	0	0	111
80	T	31.4	Very low	29.5	Very low	130 Å²	130	143.4 Å²	143.4	80%	0.798	79%	0.794	S	S	*	*			trans	60.2	119.3	-173.4	68.2	0	0	0	0	113.4
81	Y	30.7	Very low	29.5	Very low	233 Å²	233	143 Å²	143	91%	0.914	79%	0.793	S	S	*	*			cis	-125.3	144.6	36.9	-93.3	-103.4	0	0	0	114.3
82	S	29.5	Very low	29.5	Very low	105 Å²	105	143.9 Å²	143.9	73%	0.734	79%	0.793	S	S	*	*			trans	-123.9	157.3	166.6	178.4	0	0	0	0	109.4
83	S	28	Very low	29.7	Very low	111 Å²	111	146.7 Å²	146.7	78%	0.776	79%	0.793	S	S	*	*			trans	78.4	71.1	172.7	-51.6	0	0	0	0	118.6
84	T	31.1	Very low	29.7	Very low	124 Å²	124	147.8 Å²	147.8	76%	0.761	80%	0.798	S	S	*	*			trans	-125.9	122.4	135.9	47.6	0	0	0	0	110.2
85	K	27.1	Very low	29.6	Very low	195 Å²	195	151.2 Å²	151.2	85%	0.848	80%	0.803	S	S	*	*			trans	-103.2	85.4	-170.4	-177	-175.3	178.4	-178.8	0	110.1
86	F	29.2	Very low	29.7	Very low	185 Å²	185	150.8 Å²	150.8	81%	0.811	80%	0.8	S	S	*	*			trans	-101.5	121.5	176.8	-79.2	-77.8	0	0	0	112.3
87	I	25.3	Very low	29.4	Very low	146 Å²	146	151.7 Å²	151.7	75%	0.749	80%	0.8	S	S	*	*			trans	-92.2	122.9	169.2	-61.8	170.9	0	0	0	107.1
88	C	28.4	Very low	29.5	Very low	108 Å²	108	153.1 Å²	153.1	73%	0.73	80%	0.802	S	S	*	*			trans	-130.6	96.8	170.4	-172.3	0	0	0	0	110	S90	C88-S90 PolarHBondContact O-N 3.28Å
89	S	27.4	Very low	29.5	Very low	106 Å²	106	149.5 Å²	149.5	74%	0.741	79%	0.791	S	S	*	*			trans	-83.5	105.7	169.6	-60	0	0	0	0	109.4	P91	S89-P91 WeakPolarHBondContact O-CD 3.49Å
90	S	31.7	Very low	29.4	Very low	96 Å²	96	148.3 Å²	148.3	67%	0.671	79%	0.788	S	S	*	*			trans	-105.2	105	169	-67	0	0	0	0	109.9	C88 N92	C88-S90 PolarHBondContact O-N 3.28Å; S90-N92 PolarHBondContact O-N 3.02Å
91	P	28	Very low	29.4	Very low	113 Å²	113	149.9 Å²	149.9	73%	0.734	79%	0.791	S	S	*	*			trans	-90.3	104.8	-175.7	33.1	-31.8	0	0	0	111.6	S89	S89-P91 WeakPolarHBondContact O-CD 3.49Å
92	N	29.2	Very low	29.6	Very low	163 Å²	163	146.1 Å²	146.1	87%	0.872	79%	0.785	S	S	*	*			trans	-174.5	85.5	151.2	-101.2	-26.3	0	0	0	113.1	S90	S90-N92 PolarHBondContact O-N 3.02Å
93	R	31.6	Very low	29.7	Very low	219 Å²	219	149.3 Å²	149.3	83%	0.826	79%	0.788	S	S	*	*			trans	-165.2	53.7	158.2	-122.3	-179.7	-168.9	-85.9	1.8	112.9	E95	R93-E95 PolarHBondContact O-N 3.37Å
94	I	28.4	Very low	30	Very low	174 Å²	174	152 Å²	152	89%	0.892	79%	0.793	S	S	*	*			trans	-100.5	69.3	175.3	-50.6	-177.7	0	0	0	109.9
95	E	28.9	Very low	29.9	Very low	174 Å²	174	155.4 Å²	155.4	81%	0.813	80%	0.797	S	S	*	*			trans	-161.5	164	161.8	-113.5	163.7	-152.2	0	0	108.6	R93	R93-E95 PolarHBondContact O-N 3.37Å
96	L	31.5	Very low	30.4	Very low	148 Å²	148	153 Å²	153	78%	0.775	79%	0.794	S	S	*	*	S	Bend	trans	70.1	34.2	-175.8	-58.4	169.9	0	0	0	118	K149	L96-K149 PolarHBondContact O-NZ 3.46Å
97	N	29.9	Very low	30.6	Very low	136 Å²	136	150.1 Å²	150.1	73%	0.727	79%	0.787	S	S	*	*			trans	-139.2	48.2	159.8	-92.5	-26.1	0	0	0	113.2	K149	N97-K149 PolarHBondContact OD1-NZ 3.19Å
98	Q	30.6	Very low	31	Very low	194 Å²	194	150.9 Å²	150.9	91%	0.907	79%	0.787	S	S	*	*			trans	-108.9	69.5	164	-72.9	-171.3	-1.4	0	0	110.6
99	S	30.3	Very low	31.2	Very low	100 Å²	100	150.7 Å²	150.7	70%	0.699	78%	0.782	S	S	*	*	S	Bend	trans	-166	154	168	-4.8	0	0	0	0	109.8
100	M	29.4	Very low	31.6	Very low	155 Å²	155	153.4 Å²	153.4	76%	0.764	78%	0.783	S	S	*	*			trans	62.1	56.8	176.7	-53.6	-144.8	-61	0	0	116.4
101	N	31	Very low	31.6	Very low	163 Å²	163	155.6 Å²	155.6	87%	0.872	79%	0.787	S	S	*	*			trans	-125.2	84	155.2	-154.3	-21.5	0	0	0	109.4
102	I	34.9	Very low	31.9	Very low	154 Å²	154	155.9 Å²	155.9	79%	0.79	79%	0.789	S	S	*	*			trans	-106.2	114.7	179.9	-66.8	178.1	0	0	0	108.6
103	H	31.2	Very low	32.2	Very low	171 Å²	171	153.8 Å²	153.8	79%	0.792	78%	0.784	S	S	*	*			trans	41	106.5	156	-108.5	-97.8	0	0	0	118.8
104	L	34.1	Very low	32.3	Very low	167 Å²	167	150.1 Å²	150.1	87%	0.874	79%	0.786	S	S	*	*				179.7	116.5	114.5	-93.3	154.3	0	0	0	110.7
105	K	30.7	Very low	32.3	Very low	196 Å²	196	147.8 Å²	147.8	85%	0.852	78%	0.78	S	S	*	*			trans	-120	138.5	168	-90.9	-172.6	174.8	-178.6	0	109.3
106	N	35.6	Very low	32.5	Very low	145 Å²	145	147.8 Å²	147.8	78%	0.775	79%	0.785	S	S	*	*			trans	156.3	137.9	158.6	-81.8	-19.6	0	0	0	106.9
107	N	33.5	Very low	32.3	Very low	125 Å²	125	148.4 Å²	148.4	67%	0.668	79%	0.787	S	S	*	*			cis	-157.7	172.8	-11.6	-102.8	-28.3	0	0	0	109.9
108	H	35	Very low	32.5	Very low	161 Å²	161	145.8 Å²	145.8	75%	0.745	79%	0.785	S	S	*	*			trans	-7.5	146.6	152.8	-63.4	-88.5	0	0	0	118.4
109	T	31.5	Very low	32.5	Very low	104 Å²	104	142.1 Å²	142.1	64%	0.638	78%	0.775	S	S	*	*			cis	-175.2	166.1	11.7	12.8	0	0	0	0	113.9
110	H	36.5	Very low	32.6	Very low	163 Å²	163	144.9 Å²	144.9	76%	0.755	78%	0.782	S	S	*	*			trans	75.3	134.6	145.8	-78.3	-62.6	0	0	0	123.3
111	N	32.4	Very low	32.8	Very low	143 Å²	143	145.9 Å²	145.9	77%	0.765	79%	0.785	S	S	*	*			trans	83.7	118.8	149.6	-61.7	0.1	0	0	0	121.8
112	P	33	Very low	32.9	Very low	119 Å²	119	145.1 Å²	145.1	77%	0.773	78%	0.781	S	S	*	*			trans	-105.7	-164.1	161.7	41.1	-30.5	0	0	0	111.5
113	P	36	Very low	32.8	Very low	118 Å²	118	142.5 Å²	142.5	77%	0.766	78%	0.776	S	S	*	*				-118.5	165.9	-72.8	38.9	-26.2	0	0	0	112.3
114	V	34.1	Very low	32.8	Very low	142 Å²	142	141.4 Å²	141.4	86%	0.861	78%	0.777	S	S	*	*			trans	-138.6	137.5	172.2	179.7	0	0	0	0	111.3
115	T	28.9	Very low	32.8	Very low	125 Å²	125	143.9 Å²	143.9	77%	0.767	78%	0.78	S	S	*	*			trans	-95.4	146.4	174.1	41.7	0	0	0	0	112.1
116	L	31.8	Very low	32.9	Very low	174 Å²	174	140 Å²	140	91%	0.911	78%	0.777	S	S	*	*			trans	-143.7	154.7	158.7	-88.2	-178.8	0	0	0	110.6
117	I	26.8	Very low	32.8	Very low	161 Å²	161	137.7 Å²	137.7	83%	0.826	77%	0.773	S	S	*	*			trans	-130.7	127.9	-169.6	-59.6	169.2	0	0	0	109.6
118	A	34.7	Very low	32.8	Very low	82 Å²	82	137.9 Å²	137.9	68%	0.678	77%	0.774	S	S	*	*			trans	-167.7	120.6	159.9	0	0	0	0	0	106.6
119	T	30	Very low	32.8	Very low	116 Å²	116	138.2 Å²	138.2	71%	0.712	78%	0.781	S	S	*	*				49.1	103.6	75.3	67.6	0	0	0	0	110.7
120	D	33.6	Very low	33.2	Very low	159 Å²	159	135.8 Å²	135.8	85%	0.85	77%	0.768	S	S	*	*				-156.6	-175	62.8	-84	-35.6	0	0	0	114.7
121	Q	33.1	Very low	33.5	Very low	175 Å²	175	135.9 Å²	135.9	82%	0.818	77%	0.767	S	S	*	*			trans	-85.8	133.8	-179	-60.8	170.2	-24.2	0	0	111.7
122	D	33.3	Very low	33.8	Very low	147 Å²	147	136.4 Å²	136.4	79%	0.786	77%	0.769	S	S	*	*				171.7	126.6	116.9	-94.9	-21.7	0	0	0	114.8
123	S	34	Very low	34.1	Very low	99 Å²	99	134.3 Å²	134.3	69%	0.692	76%	0.757	S	S	*	*			trans	42.9	127.1	151.4	75.5	0	0	0	0	122.7
124	N	29.9	Very low	34.3	Very low	149 Å²	149	130.7 Å²	130.7	80%	0.797	73%	0.733	S	S	*	*			trans	65.1	86.2	143.9	-61.5	-29.6	0	0	0	120.3
125	K	34.2	Very low	34.4	Very low	219 Å²	219	130.5 Å²	130.5	95%	0.952	72%	0.717	S	S	*	*				-156.5	131.8	128	-111.9	150.3	-170.9	167.6	0	113.8
126	S	33.3	Very low	34.8	Very low	113 Å²	113	129.2 Å²	129.2	79%	0.79	71%	0.713	S	S	*	*			trans	-81.8	139.7	179.4	172.8	0	0	0	0	112.4
127	S	33.9	Very low	35.4	Very low	98 Å²	98	126 Å²	126	69%	0.685	70%	0.701	S	S	*	*			trans	169.3	121.1	138.6	-79.1	0	0	0	0	111.4
128	N	33.9	Very low	36	Very low	128 Å²	128	125.4 Å²	125.4	68%	0.684	69%	0.694	S	S	*	*	S	Bend	trans	-175	-24.1	144	-100	-35.5	0	0	0	115.2	S130	N128-S130 PolarHBondContact O-N 3.2Å
129	N	33.7	Very low	36	Very low	168 Å²	168	126.3 Å²	126.3	90%	0.898	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	42.3	179.3	-72.6	5.1	0	0	0	114
130	S	41.1	Very low	36.5	Very low	53 Å²	53	130 Å²	130	37%	0.371	69%	0.694	S	S	.	*	T	Hydrogen-bonded Turn	trans	-121.8	-10.6	-172	57.1	0	0	0	0	115.6	N128 L132 T134	N128-S130 PolarHBondContact O-N 3.2Å; S130-L132 VanDerWaalsContact C-N 3.31Å; S130-L132 PolarHBondContact O-N 3.08Å; S130-T134 WeakPolarHBondContact O-CB 3.28Å; S130-T134 PolarHBondContact O-N 2.85Å; S130-T134 VanDerWaalsContact O-N 3.1Å; S130-T134 PolarHBondContact O-OG1 2.81Å
131	K	40.9	Very low	36.6	Very low	165 Å²	165	129.3 Å²	129.3	72%	0.717	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-15.6	-170.6	-73.8	-175.7	178.4	174.3	0	115.8	Y135	K131-Y135 WeakPolarHBondContact O-CD2 3.06Å
132	L	40.3	Very low	36.9	Very low	154 Å²	154	131.6 Å²	131.6	81%	0.806	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.6	-37.4	174	-138.7	69.4	0	0	0	112.7	S130 T134 Y135	S130-L132 VanDerWaalsContact C-N 3.31Å; S130-L132 PolarHBondContact O-N 3.08Å; L132-T134 VanDerWaalsContact C-N 3.34Å; L132-T134 PolarHBondContact O-N 2.94Å; L132-Y135 PolarHBondContact O-N 3.16Å
133	S	38.3	Very low	37.1	Very low	76 Å²	76	132.5 Å²	132.5	53%	0.531	70%	0.696	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.8	-25.2	178	48.3	0	0	0	0	113.9	T137	S133-T137 PolarHBondContact O-OG1 3.33Å
134	T	39.8	Very low	37.4	Very low	41 Å²	41	132.6 Å²	132.6	25%	0.252	69%	0.689	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.5	-25.8	177.6	-54.8	0	0	0	0	112.6	S130 L132 C136 T137 Q138	S130-T134 WeakPolarHBondContact O-CB 3.28Å; S130-T134 PolarHBondContact O-N 2.85Å; S130-T134 VanDerWaalsContact O-N 3.1Å; S130-T134 PolarHBondContact O-OG1 2.81Å; L132-T134 VanDerWaalsContact C-N 3.34Å; L132-T134 PolarHBondContact O-N 2.94Å; T134-C136 PolarHBondContact O-N 2.77Å; T134-T137 PolarHBondContact O-N 2.82Å; T134-T137 VanDerWaalsContact O-N 3.12Å; T134-T137 PolarHBondContact O-OG1 3.32Å; T134-Q138 HydrophobicContact CG2-CB 4.29Å; T134-Q138 HydrophobicContact CG2-CG 3.7Å; T134-Q138 PolarHBondContact O-N 3.5Å
135	Y	37.4	Very low	38.1	Very low	138 Å²	138	130.3 Å²	130.3	54%	0.541	68%	0.682	S	S	.	*	H	α-helix	trans	-58.5	-34.6	-179.3	-98.9	-116.3	0	0	0	112.8	K131 L132 F147	K131-Y135 WeakPolarHBondContact O-CD2 3.06Å; L132-Y135 PolarHBondContact O-N 3.16Å; Y135-F147 AromaticContact CD1-CE1 3.81Å; Y135-F147 HydrophobicContact CD1-CE1 3.81Å; Y135-F147 HydrophobicContact CD1-CZ 4.06Å; Y135-F147 AromaticContact CE1-CE1 3.6Å; Y135-F147 HydrophobicContact CE1-CE1 3.6Å; Y135-F147 AromaticContact CE1-CZ 3.55Å; Y135-F147 HydrophobicContact CE1-CZ 3.55Å
136	C	37.8	Very low	38.4	Very low	99 Å²	99	125.7 Å²	125.7	67%	0.669	67%	0.668	S	S	*	*	H	α-helix	trans	-86.4	-7.3	-179.4	-62.7	0	0	0	0	114.7	T134	T134-C136 PolarHBondContact O-N 2.77Å
137	T	43.6	Very low	38.8	Very low	107 Å²	107	124 Å²	124	66%	0.656	65%	0.647	S	S	*	*	H	α-helix	trans	-117.5	-17.2	-170.9	48.6	0	0	0	0	115.2	S133 T134	S133-T137 PolarHBondContact O-OG1 3.33Å; T134-T137 PolarHBondContact O-N 2.82Å; T134-T137 VanDerWaalsContact O-N 3.12Å; T134-T137 PolarHBondContact O-OG1 3.32Å
138	Q	40.1	Very low	39.1	Very low	148 Å²	148	126.6 Å²	126.6	69%	0.692	65%	0.652	S	S	*	*	H	α-helix	trans	-109.6	-19.8	-177	-65.5	-171.9	-1.2	0	0	115.4	T134 K140	T134-Q138 HydrophobicContact CG2-CB 4.29Å; T134-Q138 HydrophobicContact CG2-CG 3.7Å; T134-Q138 PolarHBondContact O-N 3.5Å; Q138-K140 VanDerWaalsContact C-N 3.26Å; Q138-K140 PolarHBondContact O-N 3.36Å
139	N	34.3	Very low	39.7	Very low	101 Å²	101	127 Å²	127	54%	0.54	65%	0.648	S	S	.	*			trans	-79.8	65.2	178.2	-95.1	-1.5	0	0	0	113.3
140	K	40.7	Very low	40.5	Very low	193 Å²	193	123.6 Å²	123.6	84%	0.839	63%	0.629	S	S	*	*	S	Bend	trans	-98.3	-4.3	167.4	-98.3	-175	176.7	179	0	114.6	Q138	Q138-K140 VanDerWaalsContact C-N 3.26Å; Q138-K140 PolarHBondContact O-N 3.36Å
141	N	35.1	Very low	41.4	Very low	145 Å²	145	128 Å²	128	78%	0.775	65%	0.648	S	S	*	*	S	Bend	trans	-160.1	96.5	176.4	-91.1	-52.3	0	0	0	111.8
142	R	39.5	Very low	43.1	Very low	222 Å²	222	124.8 Å²	124.8	84%	0.838	64%	0.638	S	S	*	*			trans	174.8	147.5	140	-95.2	150.1	-162.7	-146.1	1.1	111.6	D144	R142-D144 PolarHBondContact O-N 2.84Å
143	N	37.1	Very low	45.2	Very low	167 Å²	167	119.8 Å²	119.8	89%	0.893	61%	0.612	S	S	*	*			trans	-90.1	82.3	-177.4	-60.7	-21	0	0	0	110.1	P145	N143-P145 VanDerWaalsContact O-CD 3.29Å; N143-P145 WeakPolarHBondContact O-CD 3.33Å
144	D	40.1	Very low	47.6	Very low	101 Å²	101	123.3 Å²	123.3	54%	0.54	61%	0.614	S	S	.	*			trans	-91.2	104	169.5	-95.9	-55.1	0	0	0	110.3	R142 N146 F147	R142-D144 PolarHBondContact O-N 2.84Å; D144-N146 PolarHBondContact O-N 3.35Å; D144-F147 HydrophobicContact CB-CD2 3.88Å; D144-F147 HydrophobicContact CB-CE2 4.41Å; D144-F147 PolarHBondContact O-N 2.86Å
145	P	44.9	Very low	50.1	Low	101 Å²	101	121.4 Å²	121.4	66%	0.656	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-67.1	-11.4	-174.3	27.2	-35.3	0	0	0	114.2	N143	N143-P145 VanDerWaalsContact O-CD 3.29Å; N143-P145 WeakPolarHBondContact O-CD 3.33Å
146	N	41.5	Very low	52.5	Low	121 Å²	121	117.7 Å²	117.7	65%	0.647	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-84.3	-4.1	179.1	-81.1	-30.7	0	0	0	114.8	D144 N148	D144-N146 PolarHBondContact O-N 3.35Å; N146-N148 VanDerWaalsContact C-N 3.26Å; N146-N148 PolarHBondContact O-N 2.8Å
147	F	39.9	Very low	54.8	Low	79 Å²	79	116.2 Å²	116.2	35%	0.346	58%	0.575	S	S	.	*	G	3₁₀ helix	trans	-73.2	-14.8	176.4	-98.9	-92.6	0	0	0	114.1	Y135 D144 K149 I150	Y135-F147 AromaticContact CD1-CE1 3.81Å; Y135-F147 HydrophobicContact CD1-CE1 3.81Å; Y135-F147 HydrophobicContact CD1-CZ 4.06Å; Y135-F147 AromaticContact CE1-CE1 3.6Å; Y135-F147 HydrophobicContact CE1-CE1 3.6Å; Y135-F147 AromaticContact CE1-CZ 3.55Å; Y135-F147 HydrophobicContact CE1-CZ 3.55Å; D144-F147 HydrophobicContact CB-CD2 3.88Å; D144-F147 HydrophobicContact CB-CE2 4.41Å; D144-F147 PolarHBondContact O-N 2.86Å; F147-K149 PolarHBondContact O-N 2.8Å; F147-I150 HydrophobicContact CD1-CD1 4.25Å; F147-I150 HydrophobicContact CE1-CD1 4.37Å
148	N	41	Very low	57.1	Low	151 Å²	151	112.5 Å²	112.5	81%	0.807	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	20.7	-171.1	-70.4	-15	0	0	0	115.9	N146	N146-N148 VanDerWaalsContact C-N 3.26Å; N146-N148 PolarHBondContact O-N 2.8Å
149	K	47	Very low	59.3	Low	137 Å²	137	108.3 Å²	108.3	60%	0.596	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.9	15.6	176.3	-145.2	-176.3	-179.5	-175.9	0	114.8	L96 N97 F147 N151	L96-K149 PolarHBondContact O-NZ 3.46Å; N97-K149 PolarHBondContact OD1-NZ 3.19Å; F147-K149 PolarHBondContact O-N 2.8Å; K149-N151 PolarHBondContact O-N 3.13Å
150	I	50.2	Low	61.8	Low	97 Å²	97	106.4 Å²	106.4	50%	0.497	53%	0.528	S	S	.	.			trans	-83.7	105.1	162.7	-52.3	179.4	0	0	0	107.7	F147 L152	F147-I150 HydrophobicContact CD1-CD1 4.25Å; F147-I150 HydrophobicContact CE1-CD1 4.37Å; I150-L152 HydrophobicContact CB-CG 4.44Å; I150-L152 HydrophobicContact CG2-CD2 3.72Å; I150-L152 HydrophobicContact CG2-CG 3.87Å; I150-L152 PolarHBondContact O-N 2.94Å
151	N	59.2	Low	64	Low	144 Å²	144	99.3 Å²	99.3	77%	0.77	50%	0.499	S	S	*	.			trans	-72.7	78.3	172.9	-77.9	-2.8	0	0	0	109.8	K149 L153	K149-N151 PolarHBondContact O-N 3.13Å; N151-L153 PolarHBondContact O-N 3.48Å
152	L	76.9	Confident	66.5	Low	98 Å²	98	92.8 Å²	92.8	51%	0.513	46%	0.464	S	S	.	.			trans	-65.1	97.2	175	-66	168	0	0	0	109.3	I150 R154 I161	I150-L152 HydrophobicContact CB-CG 4.44Å; I150-L152 HydrophobicContact CG2-CD2 3.72Å; I150-L152 HydrophobicContact CG2-CG 3.87Å; I150-L152 PolarHBondContact O-N 2.94Å; L152-R154 PolarHBondContact O-N 3.25Å; L152-I161 HydrophobicContact CB-CD1 4.34Å; L152-I161 HydrophobicContact CB-CG1 4.3Å; L152-I161 HydrophobicContact CB-CG2 4.35Å; L152-I161 HydrophobicContact CD1-CD1 4.01Å; L152-I161 HydrophobicContact CD2-CD1 4.48Å; L152-I161 HydrophobicContact CD2-CG2 4.25Å
153	L	84.3	Confident	68.6	Low	50 Å²	50	89.5 Å²	89.5	26%	0.262	46%	0.456	S	S	.	.			trans	-55	131.1	177.2	-59.8	178.6	0	0	0	109.7	N151 I161 I162 Y167 T174	N151-L153 PolarHBondContact O-N 3.48Å; L153-I161 CarbonylContact O-C 3.57Å; L153-I161 WeakPolarHBondContact O-CA 2.88Å; L153-I162 HydrophobicContact CB-CB 4.44Å; L153-I162 HydrophobicContact CB-CD1 4.28Å; L153-I162 HydrophobicContact CB-CG1 4.48Å; L153-I162 PolarHBondContact O-N 2.8Å; L153-Y167 HydrophobicContact CD1-CD1 3.91Å; L153-Y167 HydrophobicContact CD1-CD2 4.37Å; L153-Y167 HydrophobicContact CD1-CE1 3.54Å; L153-Y167 HydrophobicContact CD1-CE2 4.07Å; L153-Y167 HydrophobicContact CD1-CG 4.28Å; L153-T174 HydrophobicContact CD2-CG2 4.31Å
154	R	90.1	Very high	70.8	Confident	150 Å²	150	83.9 Å²	83.9	57%	0.566	43%	0.426	S	S	*	.	B	Isolated β-bridge	trans	-113.7	136.1	179.6	-70.2	178.3	179.3	-105.8	5.8	109.6	L152 N156 Q159 S160 T174	L152-R154 PolarHBondContact O-N 3.25Å; R154-N156 PolarHBondContact O-N 3.36Å; R154-Q159 PolarHBondContact NH1-O 3.49Å; R154-S160 WeakPolarHBondContact CA-O 3.41Å; R154-T174 PolarHBondContact O-OG1 3.1Å
155	C	91.5	Very high	72.9	Confident	0 Å²	0	85.3 Å²	85.3	0%	0	43%	0.429	C	S	.	.			trans	-71.8	130.1	171.9	176.1	0	0	0	0	110.8	E157 Q159 S160 I162 T174 H176 C179	C155-E157 VanDerWaalsContact C-N 3.32Å; C155-E157 PolarHBondContact O-N 3.49Å; C155-Q159 WeakPolarHBondContact O-CA 3.22Å; C155-Q159 PolarHBondContact O-N 2.68Å; C155-S160 PolarHBondContact N-O 2.78Å; C155-I162 HydrophobicContact CB-CD1 4.32Å; C155-I162 HydrophobicContact CB-CG1 4.09Å; C155-T174 CarbonylContact C-O 3.52Å; C155-T174 VanDerWaalsContact CA-O 3.24Å; C155-T174 WeakPolarHBondContact CA-O 3.2Å; C155-H176 VanDerWaalsContact CB-CE1 3.44Å; C155-H176 WeakPolarHBondContact CB-CE1 3.23Å; C155-H176 WeakPolarHBondContact CB-ND1 3.35Å; C155-C179 WeakPolarHBondContact SG-CB 3.37Å
156	N	87.8	Confident	74.8	Confident	60 Å²	60	85.1 Å²	85.1	32%	0.321	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-38.7	180	-170.8	57.8	0	0	0	113	R154 Q159 L173 T174 W175	R154-N156 PolarHBondContact O-N 3.36Å; N156-Q159 PolarHBondContact O-NE2 2.98Å; N156-L173 HydrophobicContact CB-CB 4.29Å; N156-T174 PolarHBondContact N-O 3.41Å; N156-W175 HydrophobicContact CB-CD2 4.12Å; N156-W175 HydrophobicContact CB-CE3 4.33Å; N156-W175 HydrophobicContact CB-CH2 4.02Å; N156-W175 HydrophobicContact CB-CZ2 3.77Å; N156-W175 HydrophobicContact CB-CZ3 4.29Å; N156-W175 VanDerWaalsContact ND2-CH2 3.3Å; N156-W175 WeakPolarHBondContact ND2-CH2 3.27Å; N156-W175 VanDerWaalsContact ND2-CZ2 3.31Å; N156-W175 WeakPolarHBondContact ND2-CZ2 3.1Å
157	E	87.2	Confident	77	Confident	68 Å²	68	81.4 Å²	81.4	32%	0.318	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-70.1	176.1	176.8	76.4	167.1	0	0	112.4	C155 W175 C179 R181	C155-E157 VanDerWaalsContact C-N 3.32Å; C155-E157 PolarHBondContact O-N 3.49Å; E157-W175 HydrophobicContact CB-CE3 3.88Å; E157-W175 HydrophobicContact CB-CZ3 3.77Å; E157-C179 HydrophobicContact CB-CB 3.97Å; E157-C179 HydrophobicContact CG-CB 4.13Å; E157-R181 IonicContact OE1-CZ 3.97Å; E157-R181 IonicContact OE1-NE 3.75Å; E157-R181 PolarHBondContact OE1-NE 3.16Å; E157-R181 IonicContact OE1-NH2 3.8Å; E157-R181 PolarHBondContact OE1-NH2 3.29Å
158	C	90.9	Very high	79.2	Confident	29 Å²	29	78 Å²	78	20%	0.196	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	2.9	-168.8	69.3	0	0	0	0	114	S160 H176	C158-S160 PolarHBondContact O-N 2.8Å; C158-S160 PolarHBondContact O-OG 3.37Å; C158-S160 VanDerWaalsContact O-OG 3.1Å; C158-H176 PolarHBondContact SG-CE1 2.81Å; C158-H176 PolarHBondContact SG-ND1 3.47Å
159	Q	87	Confident	81.3	Confident	61 Å²	61	72.9 Å²	72.9	29%	0.285	35%	0.354	S	S	.	.			trans	56.6	6.5	179	-63.5	-68.5	-46.6	0	0	115.9	R154 C155 N156	R154-Q159 PolarHBondContact NH1-O 3.49Å; C155-Q159 WeakPolarHBondContact O-CA 3.22Å; C155-Q159 PolarHBondContact O-N 2.68Å; N156-Q159 PolarHBondContact O-NE2 2.98Å
160	S	85.6	Confident	83.1	Confident	61 Å²	61	66.8 Å²	66.8	43%	0.427	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-88.4	156.3	-178	-60.9	0	0	0	0	111.1	R154 C155 C158	R154-S160 WeakPolarHBondContact CA-O 3.41Å; C155-S160 PolarHBondContact N-O 2.78Å; C158-S160 PolarHBondContact O-N 2.8Å; C158-S160 PolarHBondContact O-OG 3.37Å; C158-S160 VanDerWaalsContact O-OG 3.1Å
161	I	86.8	Confident	84.4	Confident	44 Å²	44	67.4 Å²	67.4	23%	0.226	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-65.4	141.1	177.8	-61.6	165.5	0	0	0	109.4	L152 L153 F163 H176	L152-I161 HydrophobicContact CB-CD1 4.34Å; L152-I161 HydrophobicContact CB-CG1 4.3Å; L152-I161 HydrophobicContact CB-CG2 4.35Å; L152-I161 HydrophobicContact CD1-CD1 4.01Å; L152-I161 HydrophobicContact CD2-CD1 4.48Å; L152-I161 HydrophobicContact CD2-CG2 4.25Å; L153-I161 CarbonylContact O-C 3.57Å; L153-I161 WeakPolarHBondContact O-CA 2.88Å; I161-F163 HydrophobicContact CB-CD2 4.37Å; I161-F163 HydrophobicContact CB-CE2 3.73Å; I161-F163 HydrophobicContact CB-CZ 3.82Å; I161-F163 HydrophobicContact CD1-CZ 4.32Å; I161-F163 HydrophobicContact CG2-CD1 4.34Å; I161-F163 HydrophobicContact CG2-CD2 4.37Å; I161-F163 HydrophobicContact CG2-CE1 3.88Å; I161-F163 HydrophobicContact CG2-CE2 3.93Å; I161-F163 HydrophobicContact CG2-CZ 3.66Å; I161-F163 WeakPolarHBondContact O-CD2 3.29Å; I161-H176 PolarHBondContact O-NE2 3.32Å
162	I	87.7	Confident	85.4	Confident	7 Å²	7	68.3 Å²	68.3	4%	0.036	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-83.3	117.2	176.2	-51.6	177.5	0	0	0	109.1	L153 C155 D164 V1302	L153-I162 HydrophobicContact CB-CB 4.44Å; L153-I162 HydrophobicContact CB-CD1 4.28Å; L153-I162 HydrophobicContact CB-CG1 4.48Å; L153-I162 PolarHBondContact O-N 2.8Å; C155-I162 HydrophobicContact CB-CD1 4.32Å; C155-I162 HydrophobicContact CB-CG1 4.09Å; I162-D164 HydrophobicContact CG2-CB 4.11Å; I162-V1302 HydrophobicContact CG2-CG2 4.18Å
163	F	84.6	Confident	85.9	Confident	153 Å²	153	67.3 Å²	67.3	67%	0.671	33%	0.333	S	S	*	.			trans	-115.8	-1	176.2	-62.5	-72.3	0	0	0	112.3	I161	I161-F163 HydrophobicContact CB-CD2 4.37Å; I161-F163 HydrophobicContact CB-CE2 3.73Å; I161-F163 HydrophobicContact CB-CZ 3.82Å; I161-F163 HydrophobicContact CD1-CZ 4.32Å; I161-F163 HydrophobicContact CG2-CD1 4.34Å; I161-F163 HydrophobicContact CG2-CD2 4.37Å; I161-F163 HydrophobicContact CG2-CE1 3.88Å; I161-F163 HydrophobicContact CG2-CE2 3.93Å; I161-F163 HydrophobicContact CG2-CZ 3.66Å; I161-F163 WeakPolarHBondContact O-CD2 3.29Å
164	D	83.7	Confident	86.1	Confident	50 Å²	50	66.1 Å²	66.1	27%	0.267	33%	0.327	S	S	.	.	S	Bend	trans	-59.9	151.7	172.7	-58.6	-2.2	0	0	0	109.6	I162 Y166 H176 Q177 V1302	I162-D164 HydrophobicContact CG2-CB 4.11Å; D164-Y166 VanDerWaalsContact CB-O 3.24Å; D164-Y166 WeakPolarHBondContact CB-O 3.43Å; D164-Y166 PolarHBondContact O-N 3.47Å; D164-H176 IonicContact OD1-CD2 2.95Å; D164-H176 PolarHBondContact OD1-CD2 3.5Å; D164-H176 VanDerWaalsContact OD2-CA 3.26Å; D164-H176 WeakPolarHBondContact OD2-CA 3.48Å; D164-H176 WeakPolarHBondContact OD2-CB 3.27Å; D164-H176 IonicContact OD2-CD2 3.1Å; D164-H176 IonicContact OD2-CG 2.65Å; D164-Q177 PolarHBondContact OD2-N 3.17Å; D164-V1302 WeakPolarHBondContact O-CG2 3.28Å
165	Q	83.7	Confident	86.1	Confident	131 Å²	131	59.8 Å²	59.8	61%	0.612	30%	0.303	S	S	*	.	S	Bend	trans	-62.7	-30.2	171.9	-176.9	179	-9	0	0	111.9	L1301 V1302	Q165-L1301 HydrophobicContact CG-CD1 3.84Å; Q165-L1301 WeakPolarHBondContact O-CD1 3.33Å; Q165-V1302 PolarHBondContact O-N 3.06Å
166	Y	84.3	Confident	86.1	Confident	97 Å²	97	60.8 Å²	60.8	38%	0.38	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	140.9	-178.6	-60	-81.1	0	0	0	111.3	D164 N1300 L1301	D164-Y166 VanDerWaalsContact CB-O 3.24Å; D164-Y166 WeakPolarHBondContact CB-O 3.43Å; D164-Y166 PolarHBondContact O-N 3.47Å; Y166-N1300 CarbonylContact C-O 3.52Å; Y166-N1300 WeakPolarHBondContact CA-O 3.43Å; Y166-L1301 HydrophobicContact CD1-CD1 3.98Å; Y166-L1301 HydrophobicContact CE1-CD1 3.51Å
167	Y	88.1	Confident	86	Confident	43 Å²	43	62.3 Å²	62.3	17%	0.169	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	149.9	174.2	74.6	-87.4	0	0	0	110.5	L153 T174 W175 N1300 L1301 V1302	L153-Y167 HydrophobicContact CD1-CD1 3.91Å; L153-Y167 HydrophobicContact CD1-CD2 4.37Å; L153-Y167 HydrophobicContact CD1-CE1 3.54Å; L153-Y167 HydrophobicContact CD1-CE2 4.07Å; L153-Y167 HydrophobicContact CD1-CG 4.28Å; Y167-T174 HydrophobicContact CD2-CG2 3.64Å; Y167-T174 HydrophobicContact CE2-CG2 3.48Å; Y167-T174 VanDerWaalsContact CE2-CG2 3.48Å; Y167-W175 WeakPolarHBondContact CA-O 3.19Å; Y167-N1300 HydrophobicContact CD1-CB 3.92Å; Y167-N1300 HydrophobicContact CD2-CB 4.38Å; Y167-N1300 HydrophobicContact CE1-CB 3.5Å; Y167-N1300 HydrophobicContact CE2-CB 3.97Å; Y167-N1300 WeakPolarHBondContact CE2-ND2 3.29Å; Y167-N1300 HydrophobicContact CG-CB 4.36Å; Y167-N1300 PolarHBondContact N-O 2.73Å; Y167-N1300 PolarHBondContact O-N 3.2Å; Y167-L1301 WeakPolarHBondContact CE1-O 3.34Å; Y167-V1302 HydrophobicContact CD1-CB 4.44Å; Y167-V1302 HydrophobicContact CD1-CG2 3.57Å; Y167-V1302 HydrophobicContact CE1-CG2 4.32Å; Y167-V1302 HydrophobicContact CG-CG2 4.39Å
168	H	85.8	Confident	86	Confident	7 Å²	7	64.4 Å²	64.4	3%	0.032	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	135.4	171.2	-63.1	-85.9	0	0	0	110.4	T174 W175 L180 C1297 R1298	H168-T174 CarbonylContact O-C 3.56Å; H168-T174 WeakPolarHBondContact O-CA 3.24Å; H168-W175 PolarHBondContact N-O 3.16Å; H168-W175 PolarHBondContact O-N 3.03Å; H168-L180 HydrophobicContact CB-CD2 3.65Å; H168-C1297 PolarHBondContact CE1-O 2.95Å; H168-C1297 VanDerWaalsContact CE1-O 3.3Å; H168-C1297 PolarHBondContact ND1-O 3.3Å; H168-R1298 WeakPolarHBondContact CA-O 3.23Å
169	S	85.6	Confident	85.9	Confident	43 Å²	43	63.7 Å²	63.7	30%	0.301	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	123.8	169.6	61.3	0	0	0	0	110.1	L173 N1300	S169-L173 WeakPolarHBondContact CA-O 3.46Å; S169-N1300 VanDerWaalsContact CB-ND2 3.32Å; S169-N1300 WeakPolarHBondContact CB-ND2 3.23Å; S169-N1300 PolarHBondContact OG-ND2 3.05Å
170	I	83.4	Confident	86.1	Confident	10 Å²	10	60.8 Å²	60.8	5%	0.051	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	122.4	178	-50.6	-164	0	0	0	107.3	D172 L173 L180 C193 M1295 C1297	I170-D172 VanDerWaalsContact C-N 3.33Å; I170-D172 PolarHBondContact O-N 3.27Å; I170-L173 PolarHBondContact N-O 3.32Å; I170-L173 WeakPolarHBondContact O-CA 3.27Å; I170-L173 VanDerWaalsContact O-CB 3.29Å; I170-L173 WeakPolarHBondContact O-CB 3.44Å; I170-L173 PolarHBondContact O-N 3.34Å; I170-L180 HydrophobicContact CD1-CD1 3.63Å; I170-L180 HydrophobicContact CD1-CD2 3.81Å; I170-L180 HydrophobicContact CD1-CG 4.34Å; I170-L180 HydrophobicContact CG1-CD1 4.35Å; I170-C193 WeakPolarHBondContact CD1-SG 3.43Å; I170-M1295 HydrophobicContact CG2-CB 3.94Å; I170-M1295 HydrophobicContact CG2-CG 4.25Å; I170-M1295 HydrophobicContact CG2-SD 3.49Å; I170-M1295 WeakPolarHBondContact CG2-SD 3.42Å; I170-C1297 HydrophobicContact CD1-CB 4.23Å
171	D	78.5	Confident	86.4	Confident	109 Å²	109	62 Å²	62	58%	0.583	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.6	52.5	-174	-70.1	12.7	0	0	0	113.5	L173 M1295	D171-L173 PolarHBondContact O-N 2.92Å; D171-M1295 VanDerWaalsContact CG-CE 3.47Å; D171-M1295 WeakPolarHBondContact OD1-CE 3.21Å; D171-M1295 WeakPolarHBondContact OD2-CE 3.34Å
172	D	80.8	Confident	86.7	Confident	164 Å²	164	60.1 Å²	60.1	88%	0.877	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	-2.7	-173.8	-64.5	-37.4	0	0	0	116.2	I170	I170-D172 VanDerWaalsContact C-N 3.33Å; I170-D172 PolarHBondContact O-N 3.27Å
173	L	86.5	Confident	86.8	Confident	77 Å²	77	63.1 Å²	63.1	40%	0.403	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	130.5	172.5	-56.7	174.6	0	0	0	110.6	N156 S169 I170 D171 W175	N156-L173 HydrophobicContact CB-CB 4.29Å; S169-L173 WeakPolarHBondContact CA-O 3.46Å; I170-L173 PolarHBondContact N-O 3.32Å; I170-L173 WeakPolarHBondContact O-CA 3.27Å; I170-L173 VanDerWaalsContact O-CB 3.29Å; I170-L173 WeakPolarHBondContact O-CB 3.44Å; I170-L173 PolarHBondContact O-N 3.34Å; D171-L173 PolarHBondContact O-N 2.92Å; L173-W175 HydrophobicContact CD1-CZ2 4.35Å; L173-W175 VanDerWaalsContact O-CD1 3.26Å; L173-W175 PolarHBondContact O-NE1 3.44Å
174	T	89.6	Confident	87	Confident	24 Å²	24	58.6 Å²	58.6	15%	0.147	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	146	176.9	51.8	0	0	0	0	112.6	L153 R154 C155 N156 Y167 H168	L153-T174 HydrophobicContact CD2-CG2 4.31Å; R154-T174 PolarHBondContact O-OG1 3.1Å; C155-T174 CarbonylContact C-O 3.52Å; C155-T174 VanDerWaalsContact CA-O 3.24Å; C155-T174 WeakPolarHBondContact CA-O 3.2Å; N156-T174 PolarHBondContact N-O 3.41Å; Y167-T174 HydrophobicContact CD2-CG2 3.64Å; Y167-T174 HydrophobicContact CE2-CG2 3.48Å; Y167-T174 VanDerWaalsContact CE2-CG2 3.48Å; H168-T174 CarbonylContact O-C 3.56Å; H168-T174 WeakPolarHBondContact O-CA 3.24Å
175	W	89.9	Confident	87.4	Confident	17 Å²	17	59.7 Å²	59.7	6%	0.064	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	138.8	-176.8	-51.9	75.4	0	0	0	111.3	N156 E157 Y167 H168 L173 L180 L200	N156-W175 HydrophobicContact CB-CD2 4.12Å; N156-W175 HydrophobicContact CB-CE3 4.33Å; N156-W175 HydrophobicContact CB-CH2 4.02Å; N156-W175 HydrophobicContact CB-CZ2 3.77Å; N156-W175 HydrophobicContact CB-CZ3 4.29Å; N156-W175 VanDerWaalsContact ND2-CH2 3.3Å; N156-W175 WeakPolarHBondContact ND2-CH2 3.27Å; N156-W175 VanDerWaalsContact ND2-CZ2 3.31Å; N156-W175 WeakPolarHBondContact ND2-CZ2 3.1Å; E157-W175 HydrophobicContact CB-CE3 3.88Å; E157-W175 HydrophobicContact CB-CZ3 3.77Å; Y167-W175 WeakPolarHBondContact CA-O 3.19Å; H168-W175 PolarHBondContact N-O 3.16Å; H168-W175 PolarHBondContact O-N 3.03Å; L173-W175 HydrophobicContact CD1-CZ2 4.35Å; L173-W175 VanDerWaalsContact O-CD1 3.26Å; L173-W175 PolarHBondContact O-NE1 3.44Å; W175-L180 HydrophobicContact CB-CB 4.05Å; W175-L180 HydrophobicContact CB-CD1 4.07Å; W175-L180 HydrophobicContact CD2-CD1 3.86Å; W175-L180 HydrophobicContact CE3-CD1 4.37Å; W175-L180 HydrophobicContact CG-CD1 3.68Å; W175-L200 HydrophobicContact CD2-CD1 4.22Å; W175-L200 HydrophobicContact CE3-CD1 4.18Å; W175-L200 HydrophobicContact CH2-CD1 3.53Å; W175-L200 HydrophobicContact CH2-CG 4.41Å; W175-L200 HydrophobicContact CZ2-CD1 3.55Å; W175-L200 HydrophobicContact CZ2-CG 4.4Å; W175-L200 HydrophobicContact CZ3-CD1 3.85Å
176	H	90.7	Very high	87.7	Confident	22 Å²	22	55.5 Å²	55.5	10%	0.102	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	152	163.5	-63.1	99.9	0	0	0	109.6	C155 C158 I161 D164 N178 C179 L180	C155-H176 VanDerWaalsContact CB-CE1 3.44Å; C155-H176 WeakPolarHBondContact CB-CE1 3.23Å; C155-H176 WeakPolarHBondContact CB-ND1 3.35Å; C158-H176 PolarHBondContact SG-CE1 2.81Å; C158-H176 PolarHBondContact SG-ND1 3.47Å; I161-H176 PolarHBondContact O-NE2 3.32Å; D164-H176 IonicContact OD1-CD2 2.95Å; D164-H176 PolarHBondContact OD1-CD2 3.5Å; D164-H176 VanDerWaalsContact OD2-CA 3.26Å; D164-H176 WeakPolarHBondContact OD2-CA 3.48Å; D164-H176 WeakPolarHBondContact OD2-CB 3.27Å; D164-H176 IonicContact OD2-CD2 3.1Å; D164-H176 IonicContact OD2-CG 2.65Å; H176-N178 PolarHBondContact O-N 2.73Å; H176-C179 HydrophobicContact CB-CB 3.83Å; H176-C179 PolarHBondContact O-N 2.97Å; H176-L180 PolarHBondContact O-N 3.45Å
177	Q	85.7	Confident	88	Confident	92 Å²	92	57.2 Å²	57.2	43%	0.43	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-39.7	-179	-170.4	174.1	5.5	0	0	112.1	D164 V188	D164-Q177 PolarHBondContact OD2-N 3.17Å; Q177-V188 WeakPolarHBondContact O-CG1 3.41Å
178	N	86.3	Confident	88.1	Confident	111 Å²	111	57.4 Å²	57.4	59%	0.594	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-14.5	178.4	-65.6	-28	0	0	0	114.3	H176 R181	H176-N178 PolarHBondContact O-N 2.73Å; N178-R181 PolarHBondContact O-NH1 3.12Å
179	C	90.4	Very high	88.3	Confident	14 Å²	14	57.4 Å²	57.4	10%	0.095	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-13	179.7	-70.8	0	0	0	0	113.1	C155 E157 H176 R181	C155-C179 WeakPolarHBondContact SG-CB 3.37Å; E157-C179 HydrophobicContact CB-CB 3.97Å; E157-C179 HydrophobicContact CG-CB 4.13Å; H176-C179 HydrophobicContact CB-CB 3.83Å; H176-C179 PolarHBondContact O-N 2.97Å; C179-R181 WeakPolarHBondContact O-CG 3.39Å; C179-R181 PolarHBondContact O-N 3.3Å
180	L	90.2	Very high	88.1	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.32	C	S	.	.			trans	-82.3	94	172.1	-170.1	76.4	0	0	0	109.7	H168 I170 W175 H176 V188 L189 L200 C1297	H168-L180 HydrophobicContact CB-CD2 3.65Å; I170-L180 HydrophobicContact CD1-CD1 3.63Å; I170-L180 HydrophobicContact CD1-CD2 3.81Å; I170-L180 HydrophobicContact CD1-CG 4.34Å; I170-L180 HydrophobicContact CG1-CD1 4.35Å; W175-L180 HydrophobicContact CB-CB 4.05Å; W175-L180 HydrophobicContact CB-CD1 4.07Å; W175-L180 HydrophobicContact CD2-CD1 3.86Å; W175-L180 HydrophobicContact CE3-CD1 4.37Å; W175-L180 HydrophobicContact CG-CD1 3.68Å; H176-L180 PolarHBondContact O-N 3.45Å; L180-V188 CarbonylContact O-C 3.57Å; L180-V188 WeakPolarHBondContact O-CA 3.26Å; L180-L189 HydrophobicContact CD2-CB 4.31Å; L180-L189 WeakPolarHBondContact CD2-O 3.33Å; L180-L189 HydrophobicContact CG-CB 4.27Å; L180-L189 PolarHBondContact O-N 2.89Å; L180-L200 HydrophobicContact CD1-CD1 3.45Å; L180-L200 VanDerWaalsContact CD1-CD1 3.45Å; L180-C1297 HydrophobicContact CD2-CB 3.74Å
181	R	91.8	Very high	87.9	Confident	87 Å²	87	65.7 Å²	65.7	33%	0.328	35%	0.348	S	S	.	.	B	Isolated β-bridge	trans	-140.1	153.6	-172	38.4	176.5	175.1	-112.1	0.3	112.4	E157 N178 C179 G186 F187	E157-R181 IonicContact OE1-CZ 3.97Å; E157-R181 IonicContact OE1-NE 3.75Å; E157-R181 PolarHBondContact OE1-NE 3.16Å; E157-R181 IonicContact OE1-NH2 3.8Å; E157-R181 PolarHBondContact OE1-NH2 3.29Å; N178-R181 PolarHBondContact O-NH1 3.12Å; C179-R181 WeakPolarHBondContact O-CG 3.39Å; C179-R181 PolarHBondContact O-N 3.3Å; R181-G186 WeakPolarHBondContact CB-O 3.11Å; R181-F187 CarbonylContact C-O 3.56Å; R181-F187 VanDerWaalsContact CA-O 3.27Å; R181-F187 WeakPolarHBondContact CA-O 3.42Å
182	C	93.8	Very high	88.3	Confident	4 Å²	4	67 Å²	67	3%	0.027	34%	0.344	C	S	.	.			trans	-65.5	132.6	174.3	179.4	0	0	0	0	110.7	D184 G186 F187 L189 C202	C182-D184 PolarHBondContact SG-N 3.34Å; C182-G186 WeakPolarHBondContact O-CA 3.5Å; C182-G186 PolarHBondContact O-N 2.69Å; C182-F187 PolarHBondContact N-O 3.11Å; C182-L189 HydrophobicContact CB-CD2 4.18Å; C182-C202 HydrophobicContact CB-CB 4.03Å; C182-C202 PolarHBondContact SG-N 2.79Å
183	F	89.9	Confident	88.6	Confident	71 Å²	71	59.2 Å²	59.2	31%	0.311	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-43.6	176.4	179.6	-106.7	0	0	0	113	H199 L200 Y201 T697	F183-H199 HydrophobicContact CB-CB 4.44Å; F183-H199 AromaticContact CD2-CD2 3.61Å; F183-H199 AromaticContact CE2-CD2 3.63Å; F183-H199 HydrophobicContact CG-CB 4.42Å; F183-H199 AromaticContact CG-CD2 3.93Å; F183-H199 AromaticContact CZ-CD2 3.98Å; F183-L200 WeakPolarHBondContact CB-O 3.5Å; F183-L200 PolarHBondContact N-O 3.41Å; F183-Y201 HydrophobicContact CB-CD1 4.47Å; F183-Y201 HydrophobicContact CB-CE1 4.21Å; F183-Y201 AromaticContact CD1-CE1 3.99Å; F183-Y201 HydrophobicContact CD1-CE1 3.99Å; F183-T697 HydrophobicContact CE2-CG2 3.88Å; F183-T697 HydrophobicContact CZ-CG2 3.81Å; F183-T697 VanDerWaalsContact CZ-OG1 3.28Å; F183-T697 WeakPolarHBondContact CZ-OG1 3.34Å
184	D	88.9	Confident	88.7	Confident	58 Å²	58	56 Å²	56	31%	0.31	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-67.5	179.3	-87	33.8	0	0	0	113	C182 Y201 D205 K208 N209	C182-D184 PolarHBondContact SG-N 3.34Å; D184-Y201 WeakPolarHBondContact OD1-CE1 3.48Å; D184-D205 HydrophobicContact CB-CB 3.76Å; D184-D205 WeakPolarHBondContact CB-OD2 3.49Å; D184-K208 IonicContact OD2-NZ 3.14Å; D184-K208 PolarHBondContact OD2-NZ 3.28Å; D184-K208 VanDerWaalsContact OD2-NZ 3.1Å; D184-N209 PolarHBondContact OD1-ND2 3.2Å; D184-N209 PolarHBondContact OD2-ND2 3.05Å
185	C	92.5	Very high	88.7	Confident	72 Å²	72	56.5 Å²	56.5	49%	0.486	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-1.3	-173.4	61	0	0	0	0	115.8	F187 D205	C185-F187 PolarHBondContact O-N 3.25Å; C185-F187 VanDerWaalsContact O-N 3.07Å; C185-D205 VanDerWaalsContact CB-OD2 3.23Å; C185-D205 WeakPolarHBondContact CB-OD2 3.35Å; C185-D205 PolarHBondContact N-OD2 2.96Å; C185-D205 PolarHBondContact SG-OD2 3Å
186	G	89.4	Confident	88.4	Confident	43 Å²	43	59 Å²	59	44%	0.443	30%	0.3	S	S	.	.			trans	69.6	-2.8	-178	0	0	0	0	0	115.8	R181 C182	R181-G186 WeakPolarHBondContact CB-O 3.11Å; C182-G186 WeakPolarHBondContact O-CA 3.5Å; C182-G186 PolarHBondContact O-N 2.69Å
187	F	89.6	Confident	88.1	Confident	133 Å²	133	62.3 Å²	62.3	58%	0.583	32%	0.318	S	S	*	.			trans	-65.6	134.6	-174.4	-171.9	-92.4	0	0	0	112.5	R181 C182 C185 L189	R181-F187 CarbonylContact C-O 3.56Å; R181-F187 VanDerWaalsContact CA-O 3.27Å; R181-F187 WeakPolarHBondContact CA-O 3.42Å; C182-F187 PolarHBondContact N-O 3.11Å; C185-F187 PolarHBondContact O-N 3.25Å; C185-F187 VanDerWaalsContact O-N 3.07Å; F187-L189 PolarHBondContact O-N 3.12Å
188	V	90.3	Very high	87.9	Confident	48 Å²	48	61.3 Å²	61.3	29%	0.291	33%	0.332	S	S	.	.	B	Isolated β-bridge	trans	-69.5	124.4	-179.8	178.6	0	0	0	0	110.5	Q177 L180 T190	Q177-V188 WeakPolarHBondContact O-CG1 3.41Å; L180-V188 CarbonylContact O-C 3.57Å; L180-V188 WeakPolarHBondContact O-CA 3.26Å; V188-T190 PolarHBondContact O-N 3.22Å
189	L	89.9	Confident	88	Confident	6 Å²	6	58 Å²	58	3%	0.031	31%	0.313	C	S	.	.			trans	-90.6	101.2	-171.5	-59.3	174.2	0	0	0	110	L180 C182 F187 C193 L200 C202	L180-L189 HydrophobicContact CD2-CB 4.31Å; L180-L189 WeakPolarHBondContact CD2-O 3.33Å; L180-L189 HydrophobicContact CG-CB 4.27Å; L180-L189 PolarHBondContact O-N 2.89Å; C182-L189 HydrophobicContact CB-CD2 4.18Å; F187-L189 PolarHBondContact O-N 3.12Å; L189-C193 HydrophobicContact CB-CB 4.37Å; L189-C193 HydrophobicContact CD1-CB 3.56Å; L189-C193 HydrophobicContact CG-CB 4.46Å; L189-L200 HydrophobicContact CD1-CB 4.1Å; L189-C202 HydrophobicContact CD2-CB 3.74Å
190	T	82.2	Confident	88	Confident	90 Å²	90	57.8 Å²	57.8	55%	0.552	31%	0.311	S	S	*	.	S	Bend	trans	-88.2	-42.1	-170.4	51.3	0	0	0	0	114.6	V188	V188-T190 PolarHBondContact O-N 3.22Å
191	E	79.4	Confident	88	Confident	138 Å²	138	58.2 Å²	58.2	65%	0.645	31%	0.313	S	S	*	.	S	Bend	trans	-109.9	-44.3	-175.3	-65	-173	-174.7	0	0	113.7	C1297	E191-C1297 PolarHBondContact O-N 3.31Å
192	R	85.8	Confident	88	Confident	136 Å²	136	54.8 Å²	54.8	51%	0.513	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	142.7	-170.8	-52.3	-174.6	-161.7	-154	1	111	E1294 M1295 C1297	R192-E1294 WeakPolarHBondContact CD-OE1 3.32Å; R192-E1294 IonicContact CZ-OE1 3.43Å; R192-E1294 IonicContact NE-OE1 3.32Å; R192-E1294 IonicContact NH1-OE1 3.51Å; R192-E1294 PolarHBondContact NH1-OE1 2.94Å; R192-M1295 WeakPolarHBondContact CA-O 3.2Å; R192-C1297 VanDerWaalsContact CA-SG 3.55Å; R192-C1297 PolarHBondContact N-SG 3.29Å
193	C	88.6	Confident	87.8	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	163.8	170.3	63.9	0	0	0	0	109.9	I170 L189 L200 M1295 C1297	I170-C193 WeakPolarHBondContact CD1-SG 3.43Å; L189-C193 HydrophobicContact CB-CB 4.37Å; L189-C193 HydrophobicContact CD1-CB 3.56Å; L189-C193 HydrophobicContact CG-CB 4.46Å; C193-L200 HydrophobicContact CB-CD2 3.94Å; C193-L200 VanDerWaalsContact SG-CD2 3.57Å; C193-M1295 PolarHBondContact N-O 2.86Å; C193-M1295 PolarHBondContact O-N 2.63Å; C193-C1297 PolarHBondContact N-SG 2.73Å; C193-C1297 VanDerWaalsContact N-SG 3.41Å
194	Y	88.8	Confident	87.7	Confident	10 Å²	10	62 Å²	62	4%	0.039	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.1	168.9	-60.3	-96.1	0	0	0	107.6	Y201 R203 F206 F1292 E1294	Y194-Y201 PolarHBondContact N-O 2.95Å; Y194-Y201 PolarHBondContact O-N 2.8Å; Y194-R203 HydrophobicContact CD2-CB 4.22Å; Y194-R203 HydrophobicContact CE2-CB 3.53Å; Y194-R203 HydrophobicContact CE2-CG 3.65Å; Y194-F206 VanDerWaalsContact CB-CG 3.46Å; Y194-F206 HydrophobicContact CD1-CD1 4.31Å; Y194-F206 HydrophobicContact CD1-CE1 4.41Å; Y194-F206 HydrophobicContact CD2-CB 4.42Å; Y194-F206 HydrophobicContact CG-CB 4.36Å; Y194-F206 HydrophobicContact CG-CD1 4.09Å; Y194-F206 HydrophobicContact CG-CD2 4.33Å; Y194-F206 HydrophobicContact CG-CE1 4.49Å; Y194-F206 HydrophobicContact CG-CG 4Å; Y194-F1292 HydrophobicContact CD1-CB 4.01Å; Y194-F1292 HydrophobicContact CE1-CB 4.3Å; Y194-E1294 HydrophobicContact CD1-CB 4.1Å; Y194-E1294 HydrophobicContact CD1-CG 4.39Å; Y194-E1294 HydrophobicContact CE1-CB 3.55Å; Y194-E1294 HydrophobicContact CE1-CG 3.61Å; Y194-E1294 WeakPolarHBondContact CE1-OE2 3.46Å; Y194-E1294 PolarHBondContact OH-OE2 2.88Å
195	T	88.5	Confident	87.7	Confident	34 Å²	34	60.1 Å²	60.1	21%	0.209	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	141.3	172.1	49.7	0	0	0	0	110.4	H199 L200 M1295	T195-H199 CarbonylContact C-O 3.53Å; T195-H199 VanDerWaalsContact CA-O 3.31Å; T195-H199 WeakPolarHBondContact CA-O 3.44Å; T195-L200 HydrophobicContact CG2-CD2 3.66Å; T195-M1295 HydrophobicContact CG2-CE 4.09Å; T195-M1295 HydrophobicContact CG2-SD 3.47Å; T195-M1295 WeakPolarHBondContact CG2-SD 3.38Å; T195-M1295 WeakPolarHBondContact OG1-CE 3.3Å; T195-M1295 PolarHBondContact OG1-SD 3.49Å
196	K	84.5	Confident	87.6	Confident	71 Å²	71	57.1 Å²	57.1	31%	0.309	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	135.7	157	171.3	170.9	167.6	-170.6	0	109.7	G198 H199 Y201 F206 F210	K196-G198 PolarHBondContact O-N 3.3Å; K196-H199 PolarHBondContact N-O 2.87Å; K196-H199 PolarHBondContact O-N 2.74Å; K196-Y201 HydrophobicContact CB-CE2 4.29Å; K196-F206 HydrophobicContact CB-CE2 3.63Å; K196-F206 HydrophobicContact CB-CZ 4.25Å; K196-F210 HydrophobicContact CB-CD2 4.39Å; K196-F210 HydrophobicContact CB-CE2 4.13Å; K196-F210 HydrophobicContact CD-CB 4.5Å; K196-F210 HydrophobicContact CD-CD1 3.77Å; K196-F210 HydrophobicContact CD-CD2 3.81Å; K196-F210 HydrophobicContact CD-CE1 3.84Å; K196-F210 HydrophobicContact CD-CE2 3.89Å; K196-F210 HydrophobicContact CD-CG 3.75Å; K196-F210 HydrophobicContact CD-CZ 3.89Å; K196-F210 HydrophobicContact CG-CE2 4.4Å; K196-F210 HydrophobicContact CG-CZ 4.47Å; K196-F210 VanDerWaalsContact NZ-CD1 3.27Å
197	D	83	Confident	87.5	Confident	91 Å²	91	57.2 Å²	57.2	49%	0.487	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	45.1	175.7	-50.3	-25.8	0	0	0	112.2	H199 N693	D197-H199 VanDerWaalsContact C-N 3.27Å; D197-H199 PolarHBondContact O-N 3.18Å; D197-H199 PolarHBondContact O-ND1 3.04Å; D197-N693 WeakPolarHBondContact CB-ND2 3.47Å; D197-N693 VanDerWaalsContact CG-ND2 3.3Å; D197-N693 PolarHBondContact OD2-ND2 2.78Å
198	G	82.9	Confident	87.3	Confident	70 Å²	70	56 Å²	56	72%	0.722	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	-10.5	-178.8	0	0	0	0	0	116.3	K196	K196-G198 PolarHBondContact O-N 3.3Å
199	H	87.3	Confident	87.1	Confident	42 Å²	42	55.8 Å²	55.8	19%	0.194	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	142.8	-175.2	-61.8	75.8	0	0	0	111.6	F183 T195 K196 D197 Y201	F183-H199 HydrophobicContact CB-CB 4.44Å; F183-H199 AromaticContact CD2-CD2 3.61Å; F183-H199 AromaticContact CE2-CD2 3.63Å; F183-H199 HydrophobicContact CG-CB 4.42Å; F183-H199 AromaticContact CG-CD2 3.93Å; F183-H199 AromaticContact CZ-CD2 3.98Å; T195-H199 CarbonylContact C-O 3.53Å; T195-H199 VanDerWaalsContact CA-O 3.31Å; T195-H199 WeakPolarHBondContact CA-O 3.44Å; K196-H199 PolarHBondContact N-O 2.87Å; K196-H199 PolarHBondContact O-N 2.74Å; D197-H199 VanDerWaalsContact C-N 3.27Å; D197-H199 PolarHBondContact O-N 3.18Å; D197-H199 PolarHBondContact O-ND1 3.04Å; H199-Y201 HydrophobicContact CB-CE2 3.63Å; H199-Y201 WeakPolarHBondContact O-CD2 3.28Å; H199-Y201 WeakPolarHBondContact O-CE2 3.33Å
200	L	90.5	Very high	87	Confident	10 Å²	10	57.9 Å²	57.9	5%	0.052	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	136.8	178.5	-72.5	165.9	0	0	0	111.3	W175 L180 F183 L189 C193 T195	W175-L200 HydrophobicContact CD2-CD1 4.22Å; W175-L200 HydrophobicContact CE3-CD1 4.18Å; W175-L200 HydrophobicContact CH2-CD1 3.53Å; W175-L200 HydrophobicContact CH2-CG 4.41Å; W175-L200 HydrophobicContact CZ2-CD1 3.55Å; W175-L200 HydrophobicContact CZ2-CG 4.4Å; W175-L200 HydrophobicContact CZ3-CD1 3.85Å; L180-L200 HydrophobicContact CD1-CD1 3.45Å; L180-L200 VanDerWaalsContact CD1-CD1 3.45Å; F183-L200 WeakPolarHBondContact CB-O 3.5Å; F183-L200 PolarHBondContact N-O 3.41Å; L189-L200 HydrophobicContact CD1-CB 4.1Å; C193-L200 HydrophobicContact CB-CD2 3.94Å; C193-L200 VanDerWaalsContact SG-CD2 3.57Å; T195-L200 HydrophobicContact CG2-CD2 3.66Å
201	Y	91.1	Very high	87.2	Confident	9 Å²	9	53.9 Å²	53.9	4%	0.035	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	151.1	178.8	-58.2	-95.6	0	0	0	112	F183 D184 Y194 K196 H199 F206 F210	F183-Y201 HydrophobicContact CB-CD1 4.47Å; F183-Y201 HydrophobicContact CB-CE1 4.21Å; F183-Y201 AromaticContact CD1-CE1 3.99Å; F183-Y201 HydrophobicContact CD1-CE1 3.99Å; D184-Y201 WeakPolarHBondContact OD1-CE1 3.48Å; Y194-Y201 PolarHBondContact N-O 2.95Å; Y194-Y201 PolarHBondContact O-N 2.8Å; K196-Y201 HydrophobicContact CB-CE2 4.29Å; H199-Y201 HydrophobicContact CB-CE2 3.63Å; H199-Y201 WeakPolarHBondContact O-CD2 3.28Å; H199-Y201 WeakPolarHBondContact O-CE2 3.33Å; Y201-F206 AromaticContact CD2-CD2 3.82Å; Y201-F206 HydrophobicContact CD2-CD2 3.82Å; Y201-F206 HydrophobicContact CD2-CE2 4.38Å; Y201-F206 HydrophobicContact CG-CB 4.5Å; Y201-F206 HydrophobicContact CG-CD2 4.02Å; Y201-F210 HydrophobicContact CD1-CE2 4.36Å; Y201-F210 HydrophobicContact CD2-CE2 4.12Å; Y201-F210 HydrophobicContact CE1-CE2 4.01Å; Y201-F210 HydrophobicContact CE1-CZ 4.24Å; Y201-F210 AromaticContact CE2-CE2 3.76Å; Y201-F210 HydrophobicContact CE2-CE2 3.76Å; Y201-F210 HydrophobicContact CE2-CZ 4.22Å; Y201-F210 HydrophobicContact CG-CE2 4.42Å; Y201-F210 AromaticContact CZ-CE2 3.7Å; Y201-F210 AromaticContact CZ-CZ 3.82Å
202	C	91.2	Very high	87.5	Confident	15 Å²	15	48.9 Å²	48.9	10%	0.101	25%	0.247	C	C	.	.			trans	-70.2	161.8	161.8	77.1	0	0	0	0	109.8	C182 L189 E204 D205 F206	C182-C202 HydrophobicContact CB-CB 4.03Å; C182-C202 PolarHBondContact SG-N 2.79Å; L189-C202 HydrophobicContact CD2-CB 3.74Å; C202-E204 VanDerWaalsContact C-N 3.28Å; C202-E204 PolarHBondContact O-N 2.78Å; C202-D205 PolarHBondContact SG-N 3Å; C202-D205 VanDerWaalsContact SG-N 3.38Å; C202-D205 PolarHBondContact SG-OD2 3.31Å; C202-D205 VanDerWaalsContact SG-OD2 3.39Å; C202-F206 WeakPolarHBondContact O-CB 3.46Å; C202-F206 PolarHBondContact O-N 3.31Å
203	R	88.6	Confident	87.8	Confident	114 Å²	114	46 Å²	46	43%	0.43	24%	0.238	S	C	.	.	H	α-helix	trans	-57.7	-40.9	-177.5	-174.7	173.9	168.4	-82.1	3.5	112.7	Y194 I207	Y194-R203 HydrophobicContact CD2-CB 4.22Å; Y194-R203 HydrophobicContact CE2-CB 3.53Å; Y194-R203 HydrophobicContact CE2-CG 3.65Å; R203-I207 HydrophobicContact CG-CD1 3.8Å; R203-I207 WeakPolarHBondContact O-CB 3.25Å; R203-I207 WeakPolarHBondContact O-CD1 3.42Å; R203-I207 WeakPolarHBondContact O-CG1 3.36Å; R203-I207 PolarHBondContact O-N 2.68Å
204	E	88.1	Confident	88	Confident	111 Å²	111	46 Å²	46	52%	0.519	24%	0.238	S	C	.	.	H	α-helix	trans	-73.1	-46.8	-173.1	-74.7	55.3	-122.2	0	0	111.8	C202 I207 K208	C202-E204 VanDerWaalsContact C-N 3.28Å; C202-E204 PolarHBondContact O-N 2.78Å; E204-I207 PolarHBondContact O-N 3.25Å; E204-K208 VanDerWaalsContact O-CB 3.23Å; E204-K208 WeakPolarHBondContact O-CB 3.49Å; E204-K208 PolarHBondContact O-N 2.84Å
205	D	90	Very high	88.1	Confident	20 Å²	20	46.4 Å²	46.4	11%	0.107	24%	0.242	C	C	.	.	H	α-helix	trans	-68.6	-38	176.2	-73	-38.4	0	0	0	112.1	D184 C185 C202 I207 K208 N209	D184-D205 HydrophobicContact CB-CB 3.76Å; D184-D205 WeakPolarHBondContact CB-OD2 3.49Å; C185-D205 VanDerWaalsContact CB-OD2 3.23Å; C185-D205 WeakPolarHBondContact CB-OD2 3.35Å; C185-D205 PolarHBondContact N-OD2 2.96Å; C185-D205 PolarHBondContact SG-OD2 3Å; C202-D205 PolarHBondContact SG-N 3Å; C202-D205 VanDerWaalsContact SG-N 3.38Å; C202-D205 PolarHBondContact SG-OD2 3.31Å; C202-D205 VanDerWaalsContact SG-OD2 3.39Å; D205-I207 PolarHBondContact O-N 2.85Å; D205-K208 WeakPolarHBondContact O-CB 3.32Å; D205-K208 PolarHBondContact O-N 3.15Å; D205-K208 IonicContact OD1-NZ 3.62Å; D205-K208 PolarHBondContact OD1-NZ 3.17Å; D205-N209 WeakPolarHBondContact O-CB 3.1Å; D205-N209 PolarHBondContact O-N 3.33Å
206	F	89	Confident	88.2	Confident	8 Å²	8	46.2 Å²	46.2	4%	0.035	24%	0.244	C	C	.	.	H	α-helix	trans	-60.6	-46.1	174.9	-168.4	-86.6	0	0	0	111.8	Y194 K196 Y201 C202 F210 F1292	Y194-F206 VanDerWaalsContact CB-CG 3.46Å; Y194-F206 HydrophobicContact CD1-CD1 4.31Å; Y194-F206 HydrophobicContact CD1-CE1 4.41Å; Y194-F206 HydrophobicContact CD2-CB 4.42Å; Y194-F206 HydrophobicContact CG-CB 4.36Å; Y194-F206 HydrophobicContact CG-CD1 4.09Å; Y194-F206 HydrophobicContact CG-CD2 4.33Å; Y194-F206 HydrophobicContact CG-CE1 4.49Å; Y194-F206 HydrophobicContact CG-CG 4Å; K196-F206 HydrophobicContact CB-CE2 3.63Å; K196-F206 HydrophobicContact CB-CZ 4.25Å; Y201-F206 AromaticContact CD2-CD2 3.82Å; Y201-F206 HydrophobicContact CD2-CD2 3.82Å; Y201-F206 HydrophobicContact CD2-CE2 4.38Å; Y201-F206 HydrophobicContact CG-CB 4.5Å; Y201-F206 HydrophobicContact CG-CD2 4.02Å; C202-F206 WeakPolarHBondContact O-CB 3.46Å; C202-F206 PolarHBondContact O-N 3.31Å; F206-F210 HydrophobicContact CD1-CD2 4.38Å; F206-F210 AromaticContact CD2-CD2 3.66Å; F206-F210 HydrophobicContact CD2-CD2 3.66Å; F206-F210 HydrophobicContact CD2-CE2 4.03Å; F206-F210 HydrophobicContact CE1-CB 4.48Å; F206-F210 HydrophobicContact CE1-CD2 4.41Å; F206-F210 AromaticContact CE2-CD2 3.78Å; F206-F210 HydrophobicContact CE2-CD2 3.78Å; F206-F210 HydrophobicContact CE2-CE2 4.24Å; F206-F210 HydrophobicContact CG-CD2 4.01Å; F206-F210 HydrophobicContact CZ-CD2 4.16Å; F206-F210 WeakPolarHBondContact O-CB 3.39Å; F206-F210 PolarHBondContact O-N 3.28Å; F206-F1292 AromaticContact CD1-CD2 3.92Å; F206-F1292 HydrophobicContact CD1-CD2 3.92Å; F206-F1292 HydrophobicContact CD1-CE1 4.47Å; F206-F1292 AromaticContact CD1-CE2 3.83Å; F206-F1292 HydrophobicContact CD1-CE2 3.83Å; F206-F1292 HydrophobicContact CD1-CG 4.27Å; F206-F1292 HydrophobicContact CD1-CZ 4.1Å; F206-F1292 HydrophobicContact CE1-CB 3.94Å; F206-F1292 AromaticContact CE1-CD1 3.5Å; F206-F1292 HydrophobicContact CE1-CD1 3.5Å; F206-F1292 VanDerWaalsContact CE1-CD1 3.5Å; F206-F1292 AromaticContact CE1-CD2 3.55Å; F206-F1292 HydrophobicContact CE1-CD2 3.55Å; F206-F1292 AromaticContact CE1-CE1 3.61Å; F206-F1292 HydrophobicContact CE1-CE1 3.61Å; F206-F1292 AromaticContact CE1-CE2 3.66Å; F206-F1292 HydrophobicContact CE1-CE2 3.66Å; F206-F1292 AromaticContact CE1-CG 3.44Å; F206-F1292 HydrophobicContact CE1-CG 3.44Å; F206-F1292 VanDerWaalsContact CE1-CG 3.44Å; F206-F1292 AromaticContact CE1-CZ 3.67Å; F206-F1292 HydrophobicContact CE1-CZ 3.67Å; F206-F1292 HydrophobicContact CZ-CB 4.42Å; F206-F1292 HydrophobicContact CZ-CD1 4.12Å; F206-F1292 HydrophobicContact CZ-CE1 4.4Å; F206-F1292 HydrophobicContact CZ-CG 4.25Å
207	I	87.6	Confident	88.6	Confident	45 Å²	45	44.7 Å²	44.7	23%	0.231	24%	0.242	C	C	.	.	H	α-helix	trans	-67.5	-37	175.7	-71	170	0	0	0	111.3	R203 E204 D205 G211 L220 F1292	R203-I207 HydrophobicContact CG-CD1 3.8Å; R203-I207 WeakPolarHBondContact O-CB 3.25Å; R203-I207 WeakPolarHBondContact O-CD1 3.42Å; R203-I207 WeakPolarHBondContact O-CG1 3.36Å; R203-I207 PolarHBondContact O-N 2.68Å; E204-I207 PolarHBondContact O-N 3.25Å; D205-I207 PolarHBondContact O-N 2.85Å; I207-G211 WeakPolarHBondContact O-CA 3.43Å; I207-G211 PolarHBondContact O-N 3.08Å; I207-L220 HydrophobicContact CG2-CD1 4.17Å; I207-L220 HydrophobicContact CG2-CD2 3.62Å; I207-L220 WeakPolarHBondContact O-CD1 3.49Å; I207-F1292 HydrophobicContact CG1-CE2 4.2Å
208	K	86.4	Confident	88.9	Confident	108 Å²	108	43.1 Å²	43.1	47%	0.47	23%	0.231	S	C	.	.	H	α-helix	trans	-60.3	-46.8	175.6	-176.5	-169.8	82.8	-163.1	0	111.7	D184 E204 D205	D184-K208 IonicContact OD2-NZ 3.14Å; D184-K208 PolarHBondContact OD2-NZ 3.28Å; D184-K208 VanDerWaalsContact OD2-NZ 3.1Å; E204-K208 VanDerWaalsContact O-CB 3.23Å; E204-K208 WeakPolarHBondContact O-CB 3.49Å; E204-K208 PolarHBondContact O-N 2.84Å; D205-K208 WeakPolarHBondContact O-CB 3.32Å; D205-K208 PolarHBondContact O-N 3.15Å; D205-K208 IonicContact OD1-NZ 3.62Å; D205-K208 PolarHBondContact OD1-NZ 3.17Å
209	N	85.7	Confident	89.2	Confident	44 Å²	44	47.1 Å²	47.1	24%	0.235	23%	0.229	C	C	.	.	H	α-helix	trans	-83.3	-45	-173.5	-65.8	-4.6	0	0	0	112.2	D184 D205 K213	D184-N209 PolarHBondContact OD1-ND2 3.2Å; D184-N209 PolarHBondContact OD2-ND2 3.05Å; D205-N209 WeakPolarHBondContact O-CB 3.1Å; D205-N209 PolarHBondContact O-N 3.33Å; N209-K213 WeakPolarHBondContact O-CE 3.42Å; N209-K213 PolarHBondContact O-NZ 3.01Å
210	F	87.6	Confident	89.2	Confident	50 Å²	50	47.6 Å²	47.6	22%	0.219	23%	0.232	C	C	.	.	H	α-helix	trans	-115.4	-2.5	-167.6	-46	-53.5	0	0	0	114.5	K196 Y201 F206	K196-F210 HydrophobicContact CB-CD2 4.39Å; K196-F210 HydrophobicContact CB-CE2 4.13Å; K196-F210 HydrophobicContact CD-CB 4.5Å; K196-F210 HydrophobicContact CD-CD1 3.77Å; K196-F210 HydrophobicContact CD-CD2 3.81Å; K196-F210 HydrophobicContact CD-CE1 3.84Å; K196-F210 HydrophobicContact CD-CE2 3.89Å; K196-F210 HydrophobicContact CD-CG 3.75Å; K196-F210 HydrophobicContact CD-CZ 3.89Å; K196-F210 HydrophobicContact CG-CE2 4.4Å; K196-F210 HydrophobicContact CG-CZ 4.47Å; K196-F210 VanDerWaalsContact NZ-CD1 3.27Å; Y201-F210 HydrophobicContact CD1-CE2 4.36Å; Y201-F210 HydrophobicContact CD2-CE2 4.12Å; Y201-F210 HydrophobicContact CE1-CE2 4.01Å; Y201-F210 HydrophobicContact CE1-CZ 4.24Å; Y201-F210 AromaticContact CE2-CE2 3.76Å; Y201-F210 HydrophobicContact CE2-CE2 3.76Å; Y201-F210 HydrophobicContact CE2-CZ 4.22Å; Y201-F210 HydrophobicContact CG-CE2 4.42Å; Y201-F210 AromaticContact CZ-CE2 3.7Å; Y201-F210 AromaticContact CZ-CZ 3.82Å; F206-F210 HydrophobicContact CD1-CD2 4.38Å; F206-F210 AromaticContact CD2-CD2 3.66Å; F206-F210 HydrophobicContact CD2-CD2 3.66Å; F206-F210 HydrophobicContact CD2-CE2 4.03Å; F206-F210 HydrophobicContact CE1-CB 4.48Å; F206-F210 HydrophobicContact CE1-CD2 4.41Å; F206-F210 AromaticContact CE2-CD2 3.78Å; F206-F210 HydrophobicContact CE2-CD2 3.78Å; F206-F210 HydrophobicContact CE2-CE2 4.24Å; F206-F210 HydrophobicContact CG-CD2 4.01Å; F206-F210 HydrophobicContact CZ-CD2 4.16Å; F206-F210 WeakPolarHBondContact O-CB 3.39Å; F206-F210 PolarHBondContact O-N 3.28Å
211	G	85.7	Confident	89.2	Confident	5 Å²	5	47.3 Å²	47.3	5%	0.052	23%	0.231	C	C	.	.	S	Bend	trans	-64.6	164.5	173.7	0	0	0	0	0	113.8	I207 K213	I207-G211 WeakPolarHBondContact O-CA 3.43Å; I207-G211 PolarHBondContact O-N 3.08Å; G211-K213 PolarHBondContact O-N 3.2Å
212	P	87.1	Confident	88.8	Confident	34 Å²	34	55.3 Å²	55.3	22%	0.221	26%	0.261	C	S	.	.			trans	-67	103.2	-176.1	26.8	-34.4	0	0	0	111.6	I221 V1287	P212-I221 HydrophobicContact CB-CD1 4.46Å; P212-I221 WeakPolarHBondContact O-CB 3.24Å; P212-I221 WeakPolarHBondContact O-CD1 3.38Å; P212-I221 WeakPolarHBondContact O-CG1 3.4Å; P212-I221 PolarHBondContact O-N 3.02Å; P212-V1287 HydrophobicContact CB-CG1 4.08Å; P212-V1287 HydrophobicContact CG-CG1 3.97Å
213	K	90.5	Very high	88.2	Confident	75 Å²	75	60.9 Å²	60.9	33%	0.326	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-84.1	138.1	176.9	-57.7	179.6	-160	172	0	111.6	N209 G211 S215 H218 E289	N209-K213 WeakPolarHBondContact O-CE 3.42Å; N209-K213 PolarHBondContact O-NZ 3.01Å; G211-K213 PolarHBondContact O-N 3.2Å; K213-S215 PolarHBondContact O-N 3.41Å; K213-H218 WeakPolarHBondContact CB-O 3.49Å; K213-E289 IonicContact NZ-OE1 3.16Å; K213-E289 PolarHBondContact NZ-OE1 2.82Å
214	C	93.8	Very high	87.7	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.296	C	S	.	.			trans	-68.3	125.4	174.7	169.2	0	0	0	0	111.4	A216 C217 H218 K219 I221 V234 H236	C214-A216 VanDerWaalsContact C-N 3.29Å; C214-A216 PolarHBondContact O-N 2.97Å; C214-C217 PolarHBondContact O-N 3.31Å; C214-C217 VanDerWaalsContact SG-SG 3.62Å; C214-H218 VanDerWaalsContact O-CA 3.22Å; C214-H218 WeakPolarHBondContact O-CA 3.49Å; C214-H218 PolarHBondContact O-N 2.9Å; C214-K219 PolarHBondContact N-O 3.14Å; C214-I221 HydrophobicContact CB-CD1 4.25Å; C214-I221 HydrophobicContact CB-CG1 4.03Å; C214-V234 CarbonylContact C-O 3.6Å; C214-V234 WeakPolarHBondContact CA-O 3.34Å; C214-H236 WeakPolarHBondContact CB-CE1 3.44Å; C214-H236 WeakPolarHBondContact CB-ND1 3.42Å
215	S	91.4	Very high	87.7	Confident	18 Å²	18	55.9 Å²	55.9	13%	0.126	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-32	-175.3	-51.6	0	0	0	0	113.6	K213 Y233 V234 R285	K213-S215 PolarHBondContact O-N 3.41Å; S215-Y233 WeakPolarHBondContact OG-CB 3.28Å; S215-V234 PolarHBondContact N-O 2.88Å; S215-R285 PolarHBondContact O-NH2 3.04Å
216	A	91	Very high	87.5	Confident	31 Å²	31	58.6 Å²	58.6	26%	0.256	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-4	179.4	0	0	0	0	0	115.8	C214 Y235 C239 R285	C214-A216 VanDerWaalsContact C-N 3.29Å; C214-A216 PolarHBondContact O-N 2.97Å; A216-Y235 HydrophobicContact CB-CD1 3.56Å; A216-Y235 HydrophobicContact CB-CE1 3.79Å; A216-C239 HydrophobicContact CB-CB 3.99Å; A216-C239 WeakPolarHBondContact CB-O 3.47Å; A216-R285 PolarHBondContact O-NH1 2.87Å
217	C	92.5	Very high	87.6	Confident	38 Å²	38	58.3 Å²	58.3	26%	0.257	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-144.9	1.9	172.7	70.6	0	0	0	0	116.4	C214 K219 H236 C239	C214-C217 PolarHBondContact O-N 3.31Å; C214-C217 VanDerWaalsContact SG-SG 3.62Å; C217-K219 PolarHBondContact O-N 3.16Å; C217-H236 PolarHBondContact SG-CE1 3.4Å; C217-H236 PolarHBondContact SG-ND1 3.46Å; C217-H236 VanDerWaalsContact SG-ND1 3.38Å; C217-C239 VanDerWaalsContact SG-SG 3.63Å
218	H	88.3	Confident	87.7	Confident	58 Å²	58	57.2 Å²	57.2	27%	0.269	29%	0.292	S	S	.	.			trans	53.9	-5.9	-175.6	-55.6	-40.1	0	0	0	117.9	K213 C214 L220 R285	K213-H218 WeakPolarHBondContact CB-O 3.49Å; C214-H218 VanDerWaalsContact O-CA 3.22Å; C214-H218 WeakPolarHBondContact O-CA 3.49Å; C214-H218 PolarHBondContact O-N 2.9Å; H218-L220 PolarHBondContact O-N 3.34Å; H218-R285 PolarHBondContact CD2-NE 3.46Å; H218-R285 PolarHBondContact CD2-NH2 2.92Å; H218-R285 PolarHBondContact CE1-NH2 2.86Å; H218-R285 PolarHBondContact ND1-NH2 2.79Å; H218-R285 PolarHBondContact NE2-NE 2.85Å; H218-R285 PolarHBondContact NE2-NH2 2.92Å
219	K	89.5	Confident	87.8	Confident	154 Å²	154	55 Å²	55	67%	0.67	28%	0.283	S	S	*	.	P	Polyproline II helix	trans	-59.8	138.2	170.2	-58.8	-172.1	179.3	-170.7	0	110.5	C214 C217 I221	C214-K219 PolarHBondContact N-O 3.14Å; C217-K219 PolarHBondContact O-N 3.16Å; K219-I221 PolarHBondContact O-N 3.13Å
220	L	88.5	Confident	88	Confident	52 Å²	52	53 Å²	53	27%	0.272	27%	0.271	S	S	.	.	B	Isolated β-bridge	trans	-55.4	130.6	169.5	171.8	67.7	0	0	0	110.1	I207 H218	I207-L220 HydrophobicContact CG2-CD1 4.17Å; I207-L220 HydrophobicContact CG2-CD2 3.62Å; I207-L220 WeakPolarHBondContact O-CD1 3.49Å; H218-L220 PolarHBondContact O-N 3.34Å
221	I	89.7	Confident	87.8	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.021	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-83.2	125.5	172.3	-56.6	153.7	0	0	0	108.3	P212 C214 K219 E225 V227 V234 H236 V1287	P212-I221 HydrophobicContact CB-CD1 4.46Å; P212-I221 WeakPolarHBondContact O-CB 3.24Å; P212-I221 WeakPolarHBondContact O-CD1 3.38Å; P212-I221 WeakPolarHBondContact O-CG1 3.4Å; P212-I221 PolarHBondContact O-N 3.02Å; C214-I221 HydrophobicContact CB-CD1 4.25Å; C214-I221 HydrophobicContact CB-CG1 4.03Å; K219-I221 PolarHBondContact O-N 3.13Å; I221-E225 WeakPolarHBondContact CA-OE2 3.39Å; I221-E225 HydrophobicContact CG2-CB 3.96Å; I221-V227 HydrophobicContact CD1-CG1 4.05Å; I221-V227 HydrophobicContact CG1-CG1 4.35Å; I221-V227 HydrophobicContact CG2-CG1 3.61Å; I221-V234 HydrophobicContact CD1-CB 3.85Å; I221-V234 HydrophobicContact CD1-CG1 3.53Å; I221-H236 WeakPolarHBondContact CG1-NE2 3.43Å; I221-V1287 HydrophobicContact CB-CG2 4.25Å; I221-V1287 HydrophobicContact CG2-CG2 3.5Å; I221-V1287 VanDerWaalsContact CG2-CG2 3.5Å
222	R	82.4	Confident	87.7	Confident	178 Å²	178	58.7 Å²	58.7	67%	0.672	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-85.5	156.1	-176.7	-59.4	178.1	167.2	-166.6	-4.5	112.4	G224 E225	R222-G224 PolarHBondContact O-N 3.31Å; R222-E225 HydrophobicContact CB-CG 4.01Å; R222-E225 WeakPolarHBondContact CB-OE1 3.38Å; R222-E225 PolarHBondContact N-OE2 2.83Å; R222-E225 WeakPolarHBondContact O-CB 3.48Å; R222-E225 PolarHBondContact O-N 2.92Å
223	N	78.7	Confident	87.9	Confident	132 Å²	132	59.1 Å²	59.1	71%	0.706	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	125.3	175	-71.1	-8.6	0	0	0	110.7
224	G	79.2	Confident	87.9	Confident	54 Å²	54	56.6 Å²	56.6	56%	0.557	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	92	-11.5	-177	0	0	0	0	0	115	R222	R222-G224 PolarHBondContact O-N 3.31Å
225	E	86.6	Confident	87.8	Confident	66 Å²	66	56.6 Å²	56.6	31%	0.308	28%	0.282	S	S	.	.			trans	-68.1	134.3	172.3	-70	178	174.3	0	0	111	I221 R222 H236	I221-E225 WeakPolarHBondContact CA-OE2 3.39Å; I221-E225 HydrophobicContact CG2-CB 3.96Å; R222-E225 HydrophobicContact CB-CG 4.01Å; R222-E225 WeakPolarHBondContact CB-OE1 3.38Å; R222-E225 PolarHBondContact N-OE2 2.83Å; R222-E225 WeakPolarHBondContact O-CB 3.48Å; R222-E225 PolarHBondContact O-N 2.92Å; E225-H236 IonicContact OE2-CD2 2.69Å; E225-H236 IonicContact OE2-NE2 3.61Å
226	L	86.6	Confident	87.9	Confident	77 Å²	77	57.1 Å²	57.1	40%	0.403	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	127.3	178	-64	-178.8	0	0	0	110.3	I237 F1284	L226-I237 HydrophobicContact CB-CD1 3.54Å; L226-I237 HydrophobicContact CB-CG1 4.35Å; L226-I237 HydrophobicContact CD1-CD1 4.21Å; L226-F1284 HydrophobicContact CD1-CD1 4.46Å; L226-F1284 HydrophobicContact CD2-CB 4.47Å
227	V	90.4	Very high	87.9	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.012	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	160.1	-178.8	-69.8	0	0	0	0	113.2	I221 F229 V234 Y235 R1285 V1287	I221-V227 HydrophobicContact CD1-CG1 4.05Å; I221-V227 HydrophobicContact CG1-CG1 4.35Å; I221-V227 HydrophobicContact CG2-CG1 3.61Å; V227-F229 HydrophobicContact CG2-CD2 4.23Å; V227-F229 HydrophobicContact CG2-CE2 3.52Å; V227-F229 HydrophobicContact CG2-CZ 4.03Å; V227-V234 HydrophobicContact CB-CG1 3.71Å; V227-V234 HydrophobicContact CG1-CG1 3.77Å; V227-V234 HydrophobicContact CG2-CG1 3.89Å; V227-Y235 CarbonylContact C-O 3.58Å; V227-Y235 VanDerWaalsContact CA-O 3.28Å; V227-Y235 WeakPolarHBondContact CA-O 3.39Å; V227-Y235 WeakPolarHBondContact CB-O 3.4Å; V227-R1285 VanDerWaalsContact CG2-O 3.29Å; V227-R1285 WeakPolarHBondContact CG2-O 3.46Å; V227-R1285 PolarHBondContact N-O 3.47Å; V227-V1287 HydrophobicContact CB-CG2 4.43Å; V227-V1287 HydrophobicContact CG1-CG2 3.75Å; V227-V1287 HydrophobicContact CG2-CG2 3.79Å
228	R	90.1	Very high	87.9	Confident	22 Å²	22	61.6 Å²	61.6	8%	0.083	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	143.8	166.6	-69.5	176.3	161	-111	-1.7	108.9	Y235 I237 F240 F249 T250 T251	R228-Y235 PolarHBondContact N-O 3.41Å; R228-Y235 PolarHBondContact O-N 3.19Å; R228-I237 HydrophobicContact CG-CG1 4.42Å; R228-F240 HydrophobicContact CB-CB 3.97Å; R228-F240 HydrophobicContact CB-CD1 4.14Å; R228-F240 HydrophobicContact CB-CD2 3.5Å; R228-F240 VanDerWaalsContact CB-CD2 3.5Å; R228-F240 HydrophobicContact CB-CE2 3.92Å; R228-F240 HydrophobicContact CB-CG 3.61Å; R228-F240 HydrophobicContact CB-CZ 4.42Å; R228-F240 VanDerWaalsContact CD-CG 3.5Å; R228-F240 HydrophobicContact CG-CB 4.38Å; R228-F240 HydrophobicContact CG-CD1 4.38Å; R228-F240 HydrophobicContact CG-CG 4.2Å; R228-F249 PolarHBondContact NH1-O 3.22Å; R228-F249 PolarHBondContact NH2-O 2.76Å; R228-T250 PolarHBondContact NH1-O 2.8Å; R228-T250 PolarHBondContact NH2-O 3.32Å; R228-T251 PolarHBondContact NH2-OG1 3.39Å
229	F	89.3	Confident	88.2	Confident	62 Å²	62	60 Å²	60	27%	0.272	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	128.1	-179.1	-71	-99.3	0	0	0	110.2	V227 Y233 V234 R1285	V227-F229 HydrophobicContact CG2-CD2 4.23Å; V227-F229 HydrophobicContact CG2-CE2 3.52Å; V227-F229 HydrophobicContact CG2-CZ 4.03Å; F229-Y233 WeakPolarHBondContact CA-O 2.99Å; F229-V234 HydrophobicContact CD1-CG1 4.42Å; F229-V234 HydrophobicContact CD1-CG2 3.94Å; F229-V234 HydrophobicContact CE1-CB 4.41Å; F229-V234 HydrophobicContact CE1-CG1 4.07Å; F229-V234 HydrophobicContact CE1-CG2 3.61Å; F229-V234 HydrophobicContact CZ-CG1 4.14Å; F229-V234 HydrophobicContact CZ-CG2 4.4Å; F229-R1285 HydrophobicContact CE2-CB 4.35Å
230	A	88.7	Confident	88.4	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	117	165	0	0	0	0	0	109.3	H232 Y233 Y235 F240 Y255 L257 L264	A230-H232 VanDerWaalsContact C-N 3.31Å; A230-H232 PolarHBondContact O-N 2.66Å; A230-Y233 PolarHBondContact N-O 2.87Å; A230-Y233 PolarHBondContact O-N 3.2Å; A230-Y235 HydrophobicContact CB-CD2 4.43Å; A230-Y235 HydrophobicContact CB-CE2 3.7Å; A230-F240 HydrophobicContact CB-CE2 3.98Å; A230-Y255 HydrophobicContact CB-CE2 3.64Å; A230-L257 HydrophobicContact CB-CD2 4.49Å; A230-L264 HydrophobicContact CB-CD2 3.63Å
231	R	84.6	Confident	88.7	Confident	75 Å²	75	53.4 Å²	53.4	28%	0.283	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	-83.8	-163.1	-71.4	-174.5	75.2	103.6	-14.3	114.4	L257 Y259 R1050 Y1277	R231-L257 HydrophobicContact CB-CD2 4.04Å; R231-L257 HydrophobicContact CG-CD2 3.83Å; R231-Y259 VanDerWaalsContact CD-CE1 3.48Å; R231-Y259 PolarHBondContact NH1-OH 3.25Å; R231-R1050 VanDerWaalsContact O-CZ 3.29Å; R231-R1050 PolarHBondContact O-NH1 3.29Å; R231-R1050 PolarHBondContact O-NH2 3.46Å; R231-Y1277 VanDerWaalsContact CD-OH 3.31Å; R231-Y1277 WeakPolarHBondContact CD-OH 3.1Å; R231-Y1277 HydrophobicContact CG-CE1 3.87Å; R231-Y1277 PolarHBondContact NH1-OH 3.41Å
232	H	83.6	Confident	88.9	Confident	100 Å²	100	53.2 Å²	53.2	46%	0.463	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.6	-2	-174.3	55.6	-85	0	0	0	112	A230	A230-H232 VanDerWaalsContact C-N 3.31Å; A230-H232 PolarHBondContact O-N 2.66Å
233	Y	89.9	Confident	89.4	Confident	43 Å²	43	46 Å²	46	17%	0.169	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	147.1	173.7	-59.9	-57.5	0	0	0	110.7	S215 F229 A230 Y235 L257 K262	S215-Y233 WeakPolarHBondContact OG-CB 3.28Å; F229-Y233 WeakPolarHBondContact CA-O 2.99Å; A230-Y233 PolarHBondContact N-O 2.87Å; A230-Y233 PolarHBondContact O-N 3.2Å; Y233-Y235 WeakPolarHBondContact CB-OH 3.43Å; Y233-Y235 WeakPolarHBondContact O-CE2 3.23Å; Y233-L257 HydrophobicContact CD2-CD1 4.01Å; Y233-L257 HydrophobicContact CD2-CD2 3.89Å; Y233-L257 HydrophobicContact CE2-CD1 4.38Å; Y233-L257 HydrophobicContact CE2-CD2 4.09Å; Y233-K262 HydrophobicContact CD1-CB 4.41Å; Y233-K262 HydrophobicContact CD1-CD 4.08Å; Y233-K262 HydrophobicContact CD1-CG 4.02Å; Y233-K262 HydrophobicContact CD2-CB 4.33Å; Y233-K262 HydrophobicContact CD2-CG 4.44Å; Y233-K262 HydrophobicContact CE1-CB 4.49Å; Y233-K262 HydrophobicContact CE1-CD 3.84Å; Y233-K262 HydrophobicContact CE1-CG 3.69Å; Y233-K262 HydrophobicContact CE2-CB 4.41Å; Y233-K262 HydrophobicContact CE2-CG 4.13Å; Y233-K262 HydrophobicContact CG-CB 4.35Å; Y233-K262 HydrophobicContact CG-CG 4.4Å
234	V	90.8	Very high	89.9	Confident	22 Å²	22	42.3 Å²	42.3	13%	0.133	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	136.1	-172.9	-160.3	0	0	0	0	110.4	C214 S215 I221 V227 F229	C214-V234 CarbonylContact C-O 3.6Å; C214-V234 WeakPolarHBondContact CA-O 3.34Å; S215-V234 PolarHBondContact N-O 2.88Å; I221-V234 HydrophobicContact CD1-CB 3.85Å; I221-V234 HydrophobicContact CD1-CG1 3.53Å; V227-V234 HydrophobicContact CB-CG1 3.71Å; V227-V234 HydrophobicContact CG1-CG1 3.77Å; V227-V234 HydrophobicContact CG2-CG1 3.89Å; F229-V234 HydrophobicContact CD1-CG1 4.42Å; F229-V234 HydrophobicContact CD1-CG2 3.94Å; F229-V234 HydrophobicContact CE1-CB 4.41Å; F229-V234 HydrophobicContact CE1-CG1 4.07Å; F229-V234 HydrophobicContact CE1-CG2 3.61Å; F229-V234 HydrophobicContact CZ-CG1 4.14Å; F229-V234 HydrophobicContact CZ-CG2 4.4Å
235	Y	92.8	Very high	90.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	135.4	-175.4	-54	-104.7	0	0	0	109.7	A216 V227 R228 A230 Y233 F240 K262 L264	A216-Y235 HydrophobicContact CB-CD1 3.56Å; A216-Y235 HydrophobicContact CB-CE1 3.79Å; V227-Y235 CarbonylContact C-O 3.58Å; V227-Y235 VanDerWaalsContact CA-O 3.28Å; V227-Y235 WeakPolarHBondContact CA-O 3.39Å; V227-Y235 WeakPolarHBondContact CB-O 3.4Å; R228-Y235 PolarHBondContact N-O 3.41Å; R228-Y235 PolarHBondContact O-N 3.19Å; A230-Y235 HydrophobicContact CB-CD2 4.43Å; A230-Y235 HydrophobicContact CB-CE2 3.7Å; Y233-Y235 WeakPolarHBondContact CB-OH 3.43Å; Y233-Y235 WeakPolarHBondContact O-CE2 3.23Å; Y235-F240 AromaticContact CD2-CD2 3.89Å; Y235-F240 HydrophobicContact CD2-CD2 3.89Å; Y235-F240 HydrophobicContact CD2-CE2 4.28Å; Y235-F240 AromaticContact CG-CD2 3.87Å; Y235-F240 HydrophobicContact CG-CD2 3.87Å; Y235-K262 PolarHBondContact OH-O 3.48Å; Y235-L264 HydrophobicContact CD1-CD1 3.83Å; Y235-L264 HydrophobicContact CE1-CD1 3.66Å; Y235-L264 HydrophobicContact CE1-CD2 4.47Å; Y235-L264 HydrophobicContact CE1-CG 3.88Å; Y235-L264 HydrophobicContact CE2-CD1 4.36Å; Y235-L264 HydrophobicContact CG-CD1 4.29Å
236	H	93.2	Very high	90.9	Very high	30 Å²	30	45 Å²	45	14%	0.139	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	152.2	160.7	-49.5	114.8	0	0	0	109.1	C214 C217 I221 E225 N238 C239 F240	C214-H236 WeakPolarHBondContact CB-CE1 3.44Å; C214-H236 WeakPolarHBondContact CB-ND1 3.42Å; C217-H236 PolarHBondContact SG-CE1 3.4Å; C217-H236 PolarHBondContact SG-ND1 3.46Å; C217-H236 VanDerWaalsContact SG-ND1 3.38Å; I221-H236 WeakPolarHBondContact CG1-NE2 3.43Å; E225-H236 IonicContact OE2-CD2 2.69Å; E225-H236 IonicContact OE2-NE2 3.61Å; H236-N238 PolarHBondContact O-N 2.8Å; H236-N238 VanDerWaalsContact O-N 3.16Å; H236-C239 HydrophobicContact CB-CB 4.19Å; H236-C239 PolarHBondContact ND1-SG 2.96Å; H236-C239 PolarHBondContact O-N 3.48Å; H236-F240 PolarHBondContact O-N 3.04Å; H236-F240 VanDerWaalsContact O-N 3.13Å
237	I	91.1	Very high	91.2	Very high	44 Å²	44	45.6 Å²	45.6	23%	0.226	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-48.8	-44.9	175.6	-75.1	168.2	0	0	0	111.6	L226 R228 C239 F240 Q248 F1284	L226-I237 HydrophobicContact CB-CD1 3.54Å; L226-I237 HydrophobicContact CB-CG1 4.35Å; L226-I237 HydrophobicContact CD1-CD1 4.21Å; R228-I237 HydrophobicContact CG-CG1 4.42Å; I237-C239 VanDerWaalsContact C-N 3.29Å; I237-C239 PolarHBondContact O-N 3.5Å; I237-F240 PolarHBondContact O-N 3.19Å; I237-Q248 PolarHBondContact O-NE2 3.23Å; I237-F1284 HydrophobicContact CD1-CD1 3.91Å; I237-F1284 HydrophobicContact CD1-CE1 3.62Å; I237-F1284 HydrophobicContact CG1-CD1 4.45Å; I237-F1284 HydrophobicContact CG1-CE1 4.15Å
238	N	92.2	Very high	91.3	Very high	119 Å²	119	49.6 Å²	49.6	64%	0.636	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-75.2	-15.5	-178.4	-60.1	2.6	0	0	0	113.5	H236 Q241	H236-N238 PolarHBondContact O-N 2.8Å; H236-N238 VanDerWaalsContact O-N 3.16Å; N238-Q241 PolarHBondContact O-OE1 3.17Å
239	C	94.1	Very high	91.4	Very high	25 Å²	25	48.8 Å²	48.8	17%	0.169	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-97.1	-4.6	176.7	-57	0	0	0	0	112.5	A216 C217 H236 I237 Q241	A216-C239 HydrophobicContact CB-CB 3.99Å; A216-C239 WeakPolarHBondContact CB-O 3.47Å; C217-C239 VanDerWaalsContact SG-SG 3.63Å; H236-C239 HydrophobicContact CB-CB 4.19Å; H236-C239 PolarHBondContact ND1-SG 2.96Å; H236-C239 PolarHBondContact O-N 3.48Å; I237-C239 VanDerWaalsContact C-N 3.29Å; I237-C239 PolarHBondContact O-N 3.5Å; C239-Q241 VanDerWaalsContact C-N 3.28Å; C239-Q241 PolarHBondContact O-N 2.94Å; C239-Q241 VanDerWaalsContact O-N 3.14Å
240	F	93.7	Very high	91.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.246	C	C	.	.			trans	-88.1	67.8	176.6	-163.5	-96.1	0	0	0	110.1	R228 A230 Y235 H236 I237 F249 Y255 L264	R228-F240 HydrophobicContact CB-CB 3.97Å; R228-F240 HydrophobicContact CB-CD1 4.14Å; R228-F240 HydrophobicContact CB-CD2 3.5Å; R228-F240 VanDerWaalsContact CB-CD2 3.5Å; R228-F240 HydrophobicContact CB-CE2 3.92Å; R228-F240 HydrophobicContact CB-CG 3.61Å; R228-F240 HydrophobicContact CB-CZ 4.42Å; R228-F240 VanDerWaalsContact CD-CG 3.5Å; R228-F240 HydrophobicContact CG-CB 4.38Å; R228-F240 HydrophobicContact CG-CD1 4.38Å; R228-F240 HydrophobicContact CG-CG 4.2Å; A230-F240 HydrophobicContact CB-CE2 3.98Å; Y235-F240 AromaticContact CD2-CD2 3.89Å; Y235-F240 HydrophobicContact CD2-CD2 3.89Å; Y235-F240 HydrophobicContact CD2-CE2 4.28Å; Y235-F240 AromaticContact CG-CD2 3.87Å; Y235-F240 HydrophobicContact CG-CD2 3.87Å; H236-F240 PolarHBondContact O-N 3.04Å; H236-F240 VanDerWaalsContact O-N 3.13Å; I237-F240 PolarHBondContact O-N 3.19Å; F240-F249 HydrophobicContact CD1-CB 3.7Å; F240-F249 AromaticContact CD1-CD2 3.93Å; F240-F249 HydrophobicContact CD1-CD2 3.93Å; F240-F249 HydrophobicContact CD1-CG 4.29Å; F240-F249 HydrophobicContact CE1-CB 3.67Å; F240-F249 HydrophobicContact CE1-CD2 4.05Å; F240-F249 HydrophobicContact CE1-CG 4.22Å; F240-F249 WeakPolarHBondContact O-CD2 3.5Å; F240-F249 PolarHBondContact O-N 3.03Å; F240-Y255 HydrophobicContact CE1-CD1 4.41Å; F240-Y255 HydrophobicContact CE1-CE1 4.39Å; F240-Y255 HydrophobicContact CZ-CD1 4.11Å; F240-Y255 AromaticContact CZ-CE1 3.75Å; F240-Y255 HydrophobicContact CZ-CE1 3.75Å; F240-Y255 AromaticContact CZ-CZ 4Å; F240-L264 HydrophobicContact CD2-CD1 3.59Å; F240-L264 HydrophobicContact CE2-CD1 3.86Å; F240-L264 HydrophobicContact CG-CD1 4.08Å
241	Q	94.9	Very high	91.3	Very high	66 Å²	66	53.8 Å²	53.8	31%	0.308	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-139.4	160.1	-173.1	68	-175.8	16.7	0	0	111.3	N238 C239 T243 K246 K247 Q248	N238-Q241 PolarHBondContact O-OE1 3.17Å; C239-Q241 VanDerWaalsContact C-N 3.28Å; C239-Q241 PolarHBondContact O-N 2.94Å; C239-Q241 VanDerWaalsContact O-N 3.14Å; Q241-T243 PolarHBondContact O-N 3.28Å; Q241-K246 PolarHBondContact OE1-O 3.19Å; Q241-K247 CarbonylContact C-O 3.57Å; Q241-K247 WeakPolarHBondContact CA-O 3.35Å; Q241-Q248 HydrophobicContact CB-CB 4.31Å
242	C	94.7	Very high	91.4	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.284	C	S	.	.			trans	-61.7	130.5	176	-179.4	0	0	0	0	110.9	I244 K246 K247 F249 L264 C266	C242-I244 PolarHBondContact O-N 3.14Å; C242-K246 WeakPolarHBondContact O-CA 3.28Å; C242-K246 PolarHBondContact O-N 3.43Å; C242-K247 HydrophobicContact CB-CB 4.48Å; C242-K247 PolarHBondContact N-O 2.74Å; C242-F249 HydrophobicContact CB-CE2 4.46Å; C242-F249 HydrophobicContact CB-CZ 3.94Å; C242-L264 CarbonylContact C-O 3.52Å; C242-L264 VanDerWaalsContact CA-O 3.32Å; C242-L264 WeakPolarHBondContact CA-O 3.37Å; C242-C266 HydrophobicContact CB-CB 4.08Å; C242-C266 PolarHBondContact SG-N 3.04Å; C242-C266 VanDerWaalsContact SG-N 3.41Å
243	T	92	Very high	91.7	Very high	27 Å²	27	50.3 Å²	50.3	17%	0.166	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-24.3	179.5	48.9	0	0	0	0	113.4	Q241 K246 F263 L264	Q241-T243 PolarHBondContact O-N 3.28Å; T243-K246 PolarHBondContact O-NZ 2.85Å; T243-F263 HydrophobicContact CG2-CB 3.74Å; T243-F263 HydrophobicContact CG2-CD1 3.87Å; T243-F263 HydrophobicContact CG2-CG 3.84Å; T243-L264 PolarHBondContact N-O 2.81Å; T243-L264 PolarHBondContact OG1-O 3.23Å
244	I	90.5	Very high	91.7	Very high	54 Å²	54	51.2 Å²	51.2	28%	0.277	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-83.5	177.6	-60.3	164.7	0	0	0	109	C242 K246 I265 H269	C242-I244 PolarHBondContact O-N 3.14Å; I244-K246 VanDerWaalsContact C-N 3.3Å; I244-K246 WeakPolarHBondContact O-CE 3.48Å; I244-K246 PolarHBondContact O-N 3.06Å; I244-I265 HydrophobicContact CD1-CD1 4.29Å; I244-I265 HydrophobicContact CD1-CG2 4.27Å; I244-H269 HydrophobicContact CB-CB 4.39Å; I244-H269 HydrophobicContact CD1-CB 3.83Å; I244-H269 WeakPolarHBondContact CG2-CD2 3.49Å
245	C	93.7	Very high	91.7	Very high	54 Å²	54	50.6 Å²	50.6	37%	0.365	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	2	-175.2	64.4	0	0	0	0	117	K247 H269	C245-K247 PolarHBondContact O-N 2.89Å; C245-K247 WeakPolarHBondContact SG-CB 3.37Å; C245-H269 WeakPolarHBondContact CB-CE1 3.36Å; C245-H269 PolarHBondContact SG-CE1 3.07Å; C245-H269 PolarHBondContact SG-ND1 3.41Å
246	K	92.8	Very high	91.6	Very high	123 Å²	123	51 Å²	51	54%	0.535	28%	0.277	S	S	.	.			trans	58.8	9.5	-176.8	-38.9	-53.1	178.2	-169.5	0	115.6	Q241 C242 T243 I244 Q248	Q241-K246 PolarHBondContact OE1-O 3.19Å; C242-K246 WeakPolarHBondContact O-CA 3.28Å; C242-K246 PolarHBondContact O-N 3.43Å; T243-K246 PolarHBondContact O-NZ 2.85Å; I244-K246 VanDerWaalsContact C-N 3.3Å; I244-K246 WeakPolarHBondContact O-CE 3.48Å; I244-K246 PolarHBondContact O-N 3.06Å; K246-Q248 PolarHBondContact O-N 2.78Å; K246-Q248 VanDerWaalsContact O-N 3.11Å
247	K	92.5	Very high	91.5	Very high	90 Å²	90	50 Å²	50	39%	0.391	27%	0.273	S	S	.	.			trans	-55.9	113.1	172.8	-179.1	172.3	175.3	175.4	0	110.6	Q241 C242 C245 E268	Q241-K247 CarbonylContact C-O 3.57Å; Q241-K247 WeakPolarHBondContact CA-O 3.35Å; C242-K247 HydrophobicContact CB-CB 4.48Å; C242-K247 PolarHBondContact N-O 2.74Å; C245-K247 PolarHBondContact O-N 2.89Å; C245-K247 WeakPolarHBondContact SG-CB 3.37Å; K247-E268 IonicContact NZ-OE1 2.68Å; K247-E268 PolarHBondContact NZ-OE1 3.45Å; K247-E268 IonicContact NZ-OE2 2.81Å; K247-E268 PolarHBondContact NZ-OE2 3.38Å
248	Q	93.1	Very high	91.3	Very high	86 Å²	86	49 Å²	49	40%	0.402	27%	0.267	S	S	.	.	B	Isolated β-bridge	trans	-69.8	131.2	178	-170.1	179.3	33.5	0	0	110.5	I237 Q241 K246	I237-Q248 PolarHBondContact O-NE2 3.23Å; Q241-Q248 HydrophobicContact CB-CB 4.31Å; K246-Q248 PolarHBondContact O-N 2.78Å; K246-Q248 VanDerWaalsContact O-N 3.11Å
249	F	92.2	Very high	90.5	Very high	5 Å²	5	48.3 Å²	48.3	2%	0.022	26%	0.257	C	S	.	.			trans	-82.1	125.7	178.9	-55.1	-74.6	0	0	0	110.8	R228 F240 C242 D253 L264 C266	R228-F249 PolarHBondContact NH1-O 3.22Å; R228-F249 PolarHBondContact NH2-O 2.76Å; F240-F249 HydrophobicContact CD1-CB 3.7Å; F240-F249 AromaticContact CD1-CD2 3.93Å; F240-F249 HydrophobicContact CD1-CD2 3.93Å; F240-F249 HydrophobicContact CD1-CG 4.29Å; F240-F249 HydrophobicContact CE1-CB 3.67Å; F240-F249 HydrophobicContact CE1-CD2 4.05Å; F240-F249 HydrophobicContact CE1-CG 4.22Å; F240-F249 WeakPolarHBondContact O-CD2 3.5Å; F240-F249 PolarHBondContact O-N 3.03Å; C242-F249 HydrophobicContact CB-CE2 4.46Å; C242-F249 HydrophobicContact CB-CZ 3.94Å; F249-D253 HydrophobicContact CB-CB 4.29Å; F249-D253 HydrophobicContact CD1-CB 4.09Å; F249-L264 HydrophobicContact CE2-CB 3.79Å; F249-L264 HydrophobicContact CE2-CD1 4.42Å; F249-C266 HydrophobicContact CE1-CB 3.48Å; F249-C266 VanDerWaalsContact CE1-CB 3.48Å; F249-C266 HydrophobicContact CZ-CB 3.9Å
250	T	88.4	Confident	89.4	Confident	79 Å²	79	51.3 Å²	51.3	49%	0.485	28%	0.278	S	S	.	.			trans	-86.1	-147.1	177	72.8	0	0	0	0	110.8	R228 D253	R228-T250 PolarHBondContact NH1-O 2.8Å; R228-T250 PolarHBondContact NH2-O 3.32Å; T250-D253 WeakPolarHBondContact CA-OD2 3.22Å; T250-D253 WeakPolarHBondContact CB-OD2 3.45Å; T250-D253 PolarHBondContact N-OD2 2.95Å; T250-D253 PolarHBondContact OG1-OD2 3.19Å
251	T	86.4	Confident	88.6	Confident	87 Å²	87	54.8 Å²	54.8	53%	0.534	30%	0.297	S	S	.	.	S	Bend	trans	-117.6	103.6	176.4	-58.6	0	0	0	0	108.3	R228	R228-T251 PolarHBondContact NH2-OG1 3.39Å
252	G	86.2	Confident	88.2	Confident	52 Å²	52	55.2 Å²	55.2	54%	0.536	30%	0.297	S	S	.	.	S	Bend	trans	137.2	-39.2	-166.4	0	0	0	0	0	110.8	S1279	G252-S1279 VanDerWaalsContact C-OG 3.22Å; G252-S1279 WeakPolarHBondContact CA-OG 3.25Å; G252-S1279 PolarHBondContact N-OG 2.9Å
253	D	90.6	Very high	88	Confident	51 Å²	51	57.7 Å²	57.7	27%	0.273	31%	0.308	S	S	.	.			trans	-60.8	150.3	-177.9	-65.7	-44.6	0	0	0	114.1	F249 T250 S1279	F249-D253 HydrophobicContact CB-CB 4.29Å; F249-D253 HydrophobicContact CD1-CB 4.09Å; T250-D253 WeakPolarHBondContact CA-OD2 3.22Å; T250-D253 WeakPolarHBondContact CB-OD2 3.45Å; T250-D253 PolarHBondContact N-OD2 2.95Å; T250-D253 PolarHBondContact OG1-OD2 3.19Å; D253-S1279 PolarHBondContact N-OG 3.1Å; D253-S1279 WeakPolarHBondContact O-CB 3.49Å; D253-S1279 PolarHBondContact O-N 2.93Å; D253-S1279 PolarHBondContact O-OG 2.9Å
254	Q	89.4	Confident	88	Confident	61 Å²	61	56.5 Å²	56.5	29%	0.285	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	134.7	176.3	-56.2	-173.5	-12	0	0	110	V1276 N1278	Q254-V1276 HydrophobicContact CB-CG1 4.15Å; Q254-N1278 VanDerWaalsContact CD-OD1 3.27Å; Q254-N1278 VanDerWaalsContact CG-OD1 3.28Å; Q254-N1278 WeakPolarHBondContact CG-OD1 3.37Å; Q254-N1278 PolarHBondContact NE2-OD1 3.04Å
255	Y	91.7	Very high	88.1	Confident	9 Å²	9	54.6 Å²	54.6	4%	0.035	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	159.4	176	69.8	-88.6	0	0	0	111.4	A230 F240 L264 I265 Y1277	A230-Y255 HydrophobicContact CB-CE2 3.64Å; F240-Y255 HydrophobicContact CE1-CD1 4.41Å; F240-Y255 HydrophobicContact CE1-CE1 4.39Å; F240-Y255 HydrophobicContact CZ-CD1 4.11Å; F240-Y255 AromaticContact CZ-CE1 3.75Å; F240-Y255 HydrophobicContact CZ-CE1 3.75Å; F240-Y255 AromaticContact CZ-CZ 4Å; Y255-L264 HydrophobicContact CD2-CD2 3.8Å; Y255-L264 HydrophobicContact CE2-CD2 4Å; Y255-I265 CarbonylContact C-O 3.5Å; Y255-I265 WeakPolarHBondContact CA-O 3.46Å; Y255-Y1277 WeakPolarHBondContact CD1-O 3.29Å; Y255-Y1277 HydrophobicContact CD2-CD2 4.48Å; Y255-Y1277 WeakPolarHBondContact CE1-O 3.06Å; Y255-Y1277 VanDerWaalsContact CE2-CB 3.49Å; Y255-Y1277 HydrophobicContact CE2-CD2 4.07Å; Y255-Y1277 AromaticContact CE2-CG 3.9Å; Y255-Y1277 HydrophobicContact CE2-CG 3.9Å; Y255-Y1277 PolarHBondContact N-O 3.03Å; Y255-Y1277 WeakPolarHBondContact O-CB 3.46Å; Y255-Y1277 PolarHBondContact O-N 2.83Å
256	Y	90.8	Very high	88.1	Confident	8 Å²	8	52.1 Å²	52.1	3%	0.031	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	141.7	172.8	-63.9	-101.8	0	0	0	108.1	L264 I265 R267 Y270 Y271 V1276	Y256-L264 CarbonylContact O-C 3.53Å; Y256-L264 WeakPolarHBondContact O-CA 3.44Å; Y256-I265 PolarHBondContact N-O 3.26Å; Y256-I265 PolarHBondContact O-N 2.89Å; Y256-R267 HydrophobicContact CE2-CB 4.41Å; Y256-R267 HydrophobicContact CE2-CG 4.41Å; Y256-Y270 AromaticContact CD1-CD1 3.94Å; Y256-Y270 HydrophobicContact CD1-CD1 3.94Å; Y256-Y270 AromaticContact CD1-CD2 3.42Å; Y256-Y270 HydrophobicContact CD1-CD2 3.42Å; Y256-Y270 VanDerWaalsContact CD1-CD2 3.42Å; Y256-Y270 HydrophobicContact CD1-CE1 4Å; Y256-Y270 AromaticContact CD1-CE2 3.45Å; Y256-Y270 HydrophobicContact CD1-CE2 3.45Å; Y256-Y270 VanDerWaalsContact CD1-CE2 3.45Å; Y256-Y270 AromaticContact CD1-CG 3.7Å; Y256-Y270 HydrophobicContact CD1-CG 3.7Å; Y256-Y270 AromaticContact CD1-CZ 3.8Å; Y256-Y270 AromaticContact CD2-CD1 3.88Å; Y256-Y270 HydrophobicContact CD2-CD1 3.88Å; Y256-Y270 AromaticContact CD2-CD2 3.74Å; Y256-Y270 HydrophobicContact CD2-CD2 3.74Å; Y256-Y270 AromaticContact CD2-CG 3.36Å; Y256-Y270 HydrophobicContact CD2-CG 3.36Å; Y256-Y270 AromaticContact CE1-CD1 3.54Å; Y256-Y270 HydrophobicContact CE1-CD1 3.54Å; Y256-Y270 AromaticContact CE1-CD2 3.93Å; Y256-Y270 HydrophobicContact CE1-CD2 3.93Å; Y256-Y270 AromaticContact CE1-CE1 3.48Å; Y256-Y270 HydrophobicContact CE1-CE1 3.48Å; Y256-Y270 VanDerWaalsContact CE1-CE1 3.48Å; Y256-Y270 AromaticContact CE1-CE2 3.84Å; Y256-Y270 HydrophobicContact CE1-CE2 3.84Å; Y256-Y270 AromaticContact CE1-CG 3.81Å; Y256-Y270 HydrophobicContact CE1-CG 3.81Å; Y256-Y270 AromaticContact CE1-CZ 3.66Å; Y256-Y270 AromaticContact CE2-CD1 3.52Å; Y256-Y270 HydrophobicContact CE2-CD1 3.52Å; Y256-Y270 HydrophobicContact CE2-CD2 4.24Å; Y256-Y270 HydrophobicContact CE2-CE1 4.31Å; Y256-Y270 AromaticContact CE2-CG 3.53Å; Y256-Y270 HydrophobicContact CE2-CG 3.53Å; Y256-Y270 HydrophobicContact CG-CD1 4.08Å; Y256-Y270 AromaticContact CG-CD2 3.29Å; Y256-Y270 HydrophobicContact CG-CD2 3.29Å; Y256-Y270 AromaticContact CG-CE2 3.85Å; Y256-Y270 HydrophobicContact CG-CE2 3.85Å; Y256-Y270 AromaticContact CG-CG 3.45Å; Y256-Y270 HydrophobicContact CG-CG 3.45Å; Y256-Y270 VanDerWaalsContact CG-CG 3.45Å; Y256-Y270 AromaticContact CZ-CD1 3.31Å; Y256-Y270 AromaticContact CZ-CE1 3.66Å; Y256-Y270 AromaticContact CZ-CG 3.72Å; Y256-Y271 PolarHBondContact OH-OH 3.16Å; Y256-V1276 HydrophobicContact CE1-CB 4.24Å; Y256-V1276 HydrophobicContact CE1-CG1 4.35Å; Y256-V1276 HydrophobicContact CE1-CG2 3.78Å; Y256-V1276 HydrophobicContact CE2-CG1 4.18Å; Y256-V1276 WeakPolarHBondContact OH-CG2 3.43Å
257	L	90.4	Very high	88	Confident	10 Å²	10	52.6 Å²	52.6	5%	0.052	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	116.1	178.7	172	66.9	0	0	0	108.2	A230 R231 Y233 F263 L264 Y1277	A230-L257 HydrophobicContact CB-CD2 4.49Å; R231-L257 HydrophobicContact CB-CD2 4.04Å; R231-L257 HydrophobicContact CG-CD2 3.83Å; Y233-L257 HydrophobicContact CD2-CD1 4.01Å; Y233-L257 HydrophobicContact CD2-CD2 3.89Å; Y233-L257 HydrophobicContact CE2-CD1 4.38Å; Y233-L257 HydrophobicContact CE2-CD2 4.09Å; L257-F263 WeakPolarHBondContact CA-O 3.38Å; L257-L264 HydrophobicContact CB-CD2 4.41Å; L257-L264 HydrophobicContact CD1-CD2 3.86Å; L257-Y1277 HydrophobicContact CB-CD2 4.35Å; L257-Y1277 HydrophobicContact CB-CE2 4.15Å
258	L	87.1	Confident	87.9	Confident	22 Å²	22	52.2 Å²	52.2	12%	0.115	27%	0.273	C	S	.	.			trans	-75.1	124.8	166.9	-65.3	-178.9	0	0	0	108.4	K262 F263 I265	L258-K262 PolarHBondContact O-N 3.47Å; L258-F263 HydrophobicContact CB-CB 4.41Å; L258-F263 PolarHBondContact N-O 3.39Å; L258-I265 HydrophobicContact CD1-CD1 3.64Å; L258-I265 HydrophobicContact CG-CD1 4.05Å
259	Y	75.2	Confident	87.8	Confident	105 Å²	105	50 Å²	50	41%	0.412	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-31.3	-169.3	-72.4	-83.5	0	0	0	114	R231 P1275 Y1277	R231-Y259 VanDerWaalsContact CD-CE1 3.48Å; R231-Y259 PolarHBondContact NH1-OH 3.25Å; Y259-P1275 HydrophobicContact CE2-CG 4.41Å; Y259-Y1277 PolarHBondContact OH-OH 3.29Å
260	S	71.3	Confident	87.6	Confident	88 Å²	88	51.7 Å²	51.7	62%	0.615	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-62.8	173.3	36.3	0	0	0	0	110.9
261	D	76.8	Confident	87.5	Confident	73 Å²	73	54.5 Å²	54.5	39%	0.39	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	1	-159.5	-40.8	-66.4	0	0	0	113	F263	D261-F263 HydrophobicContact CB-CB 4.4Å; D261-F263 HydrophobicContact CB-CD1 4Å; D261-F263 HydrophobicContact CB-CD2 3.39Å; D261-F263 HydrophobicContact CB-CE1 4.08Å; D261-F263 HydrophobicContact CB-CE2 3.48Å; D261-F263 VanDerWaalsContact CB-CE2 3.48Å; D261-F263 HydrophobicContact CB-CG 3.67Å; D261-F263 HydrophobicContact CB-CZ 3.82Å; D261-F263 VanDerWaalsContact O-CD1 3.24Å; D261-F263 WeakPolarHBondContact O-CD1 3.36Å; D261-F263 PolarHBondContact O-N 3.41Å; D261-F263 VanDerWaalsContact O-N 3.16Å
262	K	87	Confident	87.4	Confident	75 Å²	75	56.5 Å²	56.5	33%	0.326	28%	0.275	S	S	.	.			trans	62.3	20	-177.8	-44.6	163.6	-170.4	159.9	0	111.9	Y233 Y235 L258	Y233-K262 HydrophobicContact CD1-CB 4.41Å; Y233-K262 HydrophobicContact CD1-CD 4.08Å; Y233-K262 HydrophobicContact CD1-CG 4.02Å; Y233-K262 HydrophobicContact CD2-CB 4.33Å; Y233-K262 HydrophobicContact CD2-CG 4.44Å; Y233-K262 HydrophobicContact CE1-CB 4.49Å; Y233-K262 HydrophobicContact CE1-CD 3.84Å; Y233-K262 HydrophobicContact CE1-CG 3.69Å; Y233-K262 HydrophobicContact CE2-CB 4.41Å; Y233-K262 HydrophobicContact CE2-CG 4.13Å; Y233-K262 HydrophobicContact CG-CB 4.35Å; Y233-K262 HydrophobicContact CG-CG 4.4Å; Y235-K262 PolarHBondContact OH-O 3.48Å; L258-K262 PolarHBondContact O-N 3.47Å
263	F	90	Very high	86.5	Confident	52 Å²	52	55.7 Å²	55.7	23%	0.228	26%	0.261	C	S	.	.			trans	-81.3	140.4	-177.5	-68.4	-17.7	0	0	0	112.6	T243 L257 L258 D261 I281	T243-F263 HydrophobicContact CG2-CB 3.74Å; T243-F263 HydrophobicContact CG2-CD1 3.87Å; T243-F263 HydrophobicContact CG2-CG 3.84Å; L257-F263 WeakPolarHBondContact CA-O 3.38Å; L258-F263 HydrophobicContact CB-CB 4.41Å; L258-F263 PolarHBondContact N-O 3.39Å; D261-F263 HydrophobicContact CB-CB 4.4Å; D261-F263 HydrophobicContact CB-CD1 4Å; D261-F263 HydrophobicContact CB-CD2 3.39Å; D261-F263 HydrophobicContact CB-CE1 4.08Å; D261-F263 HydrophobicContact CB-CE2 3.48Å; D261-F263 VanDerWaalsContact CB-CE2 3.48Å; D261-F263 HydrophobicContact CB-CG 3.67Å; D261-F263 HydrophobicContact CB-CZ 3.82Å; D261-F263 VanDerWaalsContact O-CD1 3.24Å; D261-F263 WeakPolarHBondContact O-CD1 3.36Å; D261-F263 PolarHBondContact O-N 3.41Å; D261-F263 VanDerWaalsContact O-N 3.16Å; F263-I281 HydrophobicContact CE2-CD1 4.34Å
264	L	92.6	Very high	84.8	Confident	2 Å²	2	56 Å²	56	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	130.6	176.6	-56.3	173.5	0	0	0	109.9	A230 Y235 F240 C242 T243 F249 Y255 Y256 L257	A230-L264 HydrophobicContact CB-CD2 3.63Å; Y235-L264 HydrophobicContact CD1-CD1 3.83Å; Y235-L264 HydrophobicContact CE1-CD1 3.66Å; Y235-L264 HydrophobicContact CE1-CD2 4.47Å; Y235-L264 HydrophobicContact CE1-CG 3.88Å; Y235-L264 HydrophobicContact CE2-CD1 4.36Å; Y235-L264 HydrophobicContact CG-CD1 4.29Å; F240-L264 HydrophobicContact CD2-CD1 3.59Å; F240-L264 HydrophobicContact CE2-CD1 3.86Å; F240-L264 HydrophobicContact CG-CD1 4.08Å; C242-L264 CarbonylContact C-O 3.52Å; C242-L264 VanDerWaalsContact CA-O 3.32Å; C242-L264 WeakPolarHBondContact CA-O 3.37Å; T243-L264 PolarHBondContact N-O 2.81Å; T243-L264 PolarHBondContact OG1-O 3.23Å; F249-L264 HydrophobicContact CE2-CB 3.79Å; F249-L264 HydrophobicContact CE2-CD1 4.42Å; Y255-L264 HydrophobicContact CD2-CD2 3.8Å; Y255-L264 HydrophobicContact CE2-CD2 4Å; Y256-L264 CarbonylContact O-C 3.53Å; Y256-L264 WeakPolarHBondContact O-CA 3.44Å; L257-L264 HydrophobicContact CB-CD2 4.41Å; L257-L264 HydrophobicContact CD1-CD2 3.86Å
265	I	92.6	Very high	83.1	Confident	14 Å²	14	58.7 Å²	58.7	7%	0.072	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	138.6	178.8	-57.4	-177.2	0	0	0	109.1	I244 Y255 Y256 L258 H269	I244-I265 HydrophobicContact CD1-CD1 4.29Å; I244-I265 HydrophobicContact CD1-CG2 4.27Å; Y255-I265 CarbonylContact C-O 3.5Å; Y255-I265 WeakPolarHBondContact CA-O 3.46Å; Y256-I265 PolarHBondContact N-O 3.26Å; Y256-I265 PolarHBondContact O-N 2.89Å; L258-I265 HydrophobicContact CD1-CD1 3.64Å; L258-I265 HydrophobicContact CG-CD1 4.05Å; I265-H269 HydrophobicContact CG2-CB 3.76Å
266	C	93.5	Very high	81.2	Confident	3 Å²	3	63.5 Å²	63.5	2%	0.02	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	167.4	177.7	71	0	0	0	0	111.5	C242 F249 E268 H269 Y270	C242-C266 HydrophobicContact CB-CB 4.08Å; C242-C266 PolarHBondContact SG-N 3.04Å; C242-C266 VanDerWaalsContact SG-N 3.41Å; F249-C266 HydrophobicContact CE1-CB 3.48Å; F249-C266 VanDerWaalsContact CE1-CB 3.48Å; F249-C266 HydrophobicContact CZ-CB 3.9Å; C266-E268 VanDerWaalsContact C-N 3.29Å; C266-E268 PolarHBondContact O-N 3.27Å; C266-E268 PolarHBondContact SG-OE2 3.42Å; C266-H269 PolarHBondContact SG-ND1 3.22Å; C266-Y270 WeakPolarHBondContact O-CB 3.29Å; C266-Y270 PolarHBondContact O-N 3.47Å
267	R	90.5	Very high	79	Confident	132 Å²	132	69.6 Å²	69.6	50%	0.498	37%	0.369	S	S	.	.	H	α-helix	trans	-55.4	-42.4	-179.8	-170.2	-176.2	175.2	-179.6	-4.1	113.3	Y256 Y271	Y256-R267 HydrophobicContact CE2-CB 4.41Å; Y256-R267 HydrophobicContact CE2-CG 4.41Å; R267-Y271 HydrophobicContact CG-CD2 3.89Å; R267-Y271 HydrophobicContact CG-CE2 3.7Å; R267-Y271 WeakPolarHBondContact O-CD2 3.31Å; R267-Y271 PolarHBondContact O-N 3.14Å
268	E	90.1	Very high	77.3	Confident	83 Å²	83	74.2 Å²	74.2	39%	0.388	39%	0.393	S	S	.	.	H	α-helix	trans	-56	-71.7	179.3	-62.5	111.6	-165.8	0	0	111	K247 C266 Y270 Y271 E272	K247-E268 IonicContact NZ-OE1 2.68Å; K247-E268 PolarHBondContact NZ-OE1 3.45Å; K247-E268 IonicContact NZ-OE2 2.81Å; K247-E268 PolarHBondContact NZ-OE2 3.38Å; C266-E268 VanDerWaalsContact C-N 3.29Å; C266-E268 PolarHBondContact O-N 3.27Å; C266-E268 PolarHBondContact SG-OE2 3.42Å; E268-Y270 PolarHBondContact O-N 3.06Å; E268-Y271 PolarHBondContact O-N 3.29Å; E268-E272 WeakPolarHBondContact CB-OE1 3.32Å; E268-E272 WeakPolarHBondContact O-CG 3.45Å; E268-E272 PolarHBondContact O-N 3.47Å
269	H	92	Very high	75.3	Confident	40 Å²	40	76.1 Å²	76.1	19%	0.185	41%	0.406	C	S	.	.	H	α-helix	trans	-57.4	-26.7	179.6	-62.2	86.4	0	0	0	114.7	I244 C245 I265 C266 E272 S273	I244-H269 HydrophobicContact CB-CB 4.39Å; I244-H269 HydrophobicContact CD1-CB 3.83Å; I244-H269 WeakPolarHBondContact CG2-CD2 3.49Å; C245-H269 WeakPolarHBondContact CB-CE1 3.36Å; C245-H269 PolarHBondContact SG-CE1 3.07Å; C245-H269 PolarHBondContact SG-ND1 3.41Å; I265-H269 HydrophobicContact CG2-CB 3.76Å; C266-H269 PolarHBondContact SG-ND1 3.22Å; H269-E272 VanDerWaalsContact CA-OE2 3.26Å; H269-E272 WeakPolarHBondContact CA-OE2 3.48Å; H269-E272 IonicContact CD2-OE2 3.29Å; H269-E272 PolarHBondContact CD2-OE2 3.38Å; H269-E272 VanDerWaalsContact CD2-OE2 3.29Å; H269-E272 IonicContact CG-OE2 3.59Å; H269-E272 PolarHBondContact N-OE2 3.46Å; H269-E272 IonicContact NE2-OE2 3.72Å; H269-S273 VanDerWaalsContact O-CB 3.25Å; H269-S273 WeakPolarHBondContact O-CB 3.47Å; H269-S273 PolarHBondContact O-N 2.81Å; H269-S273 PolarHBondContact O-OG 2.83Å
270	Y	88.1	Confident	73.9	Confident	39 Å²	39	79.8 Å²	79.8	15%	0.153	43%	0.427	C	S	.	.	H	α-helix	trans	-65.3	-39.6	175.1	171.2	-88.9	0	0	0	112.4	Y256 C266 E268 R1274	Y256-Y270 AromaticContact CD1-CD1 3.94Å; Y256-Y270 HydrophobicContact CD1-CD1 3.94Å; Y256-Y270 AromaticContact CD1-CD2 3.42Å; Y256-Y270 HydrophobicContact CD1-CD2 3.42Å; Y256-Y270 VanDerWaalsContact CD1-CD2 3.42Å; Y256-Y270 HydrophobicContact CD1-CE1 4Å; Y256-Y270 AromaticContact CD1-CE2 3.45Å; Y256-Y270 HydrophobicContact CD1-CE2 3.45Å; Y256-Y270 VanDerWaalsContact CD1-CE2 3.45Å; Y256-Y270 AromaticContact CD1-CG 3.7Å; Y256-Y270 HydrophobicContact CD1-CG 3.7Å; Y256-Y270 AromaticContact CD1-CZ 3.8Å; Y256-Y270 AromaticContact CD2-CD1 3.88Å; Y256-Y270 HydrophobicContact CD2-CD1 3.88Å; Y256-Y270 AromaticContact CD2-CD2 3.74Å; Y256-Y270 HydrophobicContact CD2-CD2 3.74Å; Y256-Y270 AromaticContact CD2-CG 3.36Å; Y256-Y270 HydrophobicContact CD2-CG 3.36Å; Y256-Y270 AromaticContact CE1-CD1 3.54Å; Y256-Y270 HydrophobicContact CE1-CD1 3.54Å; Y256-Y270 AromaticContact CE1-CD2 3.93Å; Y256-Y270 HydrophobicContact CE1-CD2 3.93Å; Y256-Y270 AromaticContact CE1-CE1 3.48Å; Y256-Y270 HydrophobicContact CE1-CE1 3.48Å; Y256-Y270 VanDerWaalsContact CE1-CE1 3.48Å; Y256-Y270 AromaticContact CE1-CE2 3.84Å; Y256-Y270 HydrophobicContact CE1-CE2 3.84Å; Y256-Y270 AromaticContact CE1-CG 3.81Å; Y256-Y270 HydrophobicContact CE1-CG 3.81Å; Y256-Y270 AromaticContact CE1-CZ 3.66Å; Y256-Y270 AromaticContact CE2-CD1 3.52Å; Y256-Y270 HydrophobicContact CE2-CD1 3.52Å; Y256-Y270 HydrophobicContact CE2-CD2 4.24Å; Y256-Y270 HydrophobicContact CE2-CE1 4.31Å; Y256-Y270 AromaticContact CE2-CG 3.53Å; Y256-Y270 HydrophobicContact CE2-CG 3.53Å; Y256-Y270 HydrophobicContact CG-CD1 4.08Å; Y256-Y270 AromaticContact CG-CD2 3.29Å; Y256-Y270 HydrophobicContact CG-CD2 3.29Å; Y256-Y270 AromaticContact CG-CE2 3.85Å; Y256-Y270 HydrophobicContact CG-CE2 3.85Å; Y256-Y270 AromaticContact CG-CG 3.45Å; Y256-Y270 HydrophobicContact CG-CG 3.45Å; Y256-Y270 VanDerWaalsContact CG-CG 3.45Å; Y256-Y270 AromaticContact CZ-CD1 3.31Å; Y256-Y270 AromaticContact CZ-CE1 3.66Å; Y256-Y270 AromaticContact CZ-CG 3.72Å; C266-Y270 WeakPolarHBondContact O-CB 3.29Å; C266-Y270 PolarHBondContact O-N 3.47Å; E268-Y270 PolarHBondContact O-N 3.06Å; Y270-R1274 WeakPolarHBondContact OH-CB 3.32Å; Y270-R1274 WeakPolarHBondContact OH-CD 3.44Å
271	Y	86.2	Confident	72.6	Confident	138 Å²	138	79.9 Å²	79.9	54%	0.541	42%	0.42	S	S	.	.	H	α-helix	trans	-82.5	-34.4	175.3	-73.9	-70.1	0	0	0	111.8	Y256 R267 E268 G274	Y256-Y271 PolarHBondContact OH-OH 3.16Å; R267-Y271 HydrophobicContact CG-CD2 3.89Å; R267-Y271 HydrophobicContact CG-CE2 3.7Å; R267-Y271 WeakPolarHBondContact O-CD2 3.31Å; R267-Y271 PolarHBondContact O-N 3.14Å; E268-Y271 PolarHBondContact O-N 3.29Å; Y271-G274 WeakPolarHBondContact O-CA 3.24Å; Y271-G274 PolarHBondContact O-N 3.16Å; Y271-G274 VanDerWaalsContact O-N 3.15Å
272	E	82.6	Confident	70.7	Confident	129 Å²	129	80.1 Å²	80.1	60%	0.603	43%	0.427	S	S	*	.	H	α-helix	trans	-65.8	-36.4	177.2	-66.4	151.3	-165.3	0	0	112.6	E268 H269 G274	E268-E272 WeakPolarHBondContact CB-OE1 3.32Å; E268-E272 WeakPolarHBondContact O-CG 3.45Å; E268-E272 PolarHBondContact O-N 3.47Å; H269-E272 VanDerWaalsContact CA-OE2 3.26Å; H269-E272 WeakPolarHBondContact CA-OE2 3.48Å; H269-E272 IonicContact CD2-OE2 3.29Å; H269-E272 PolarHBondContact CD2-OE2 3.38Å; H269-E272 VanDerWaalsContact CD2-OE2 3.29Å; H269-E272 IonicContact CG-OE2 3.59Å; H269-E272 PolarHBondContact N-OE2 3.46Å; H269-E272 IonicContact NE2-OE2 3.72Å; E272-G274 PolarHBondContact O-N 3.43Å
273	S	67.2	Low	68.2	Low	36 Å²	36	81.6 Å²	81.6	25%	0.252	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	15.2	174.3	-48.9	0	0	0	0	113	H269 S275	H269-S273 VanDerWaalsContact O-CB 3.25Å; H269-S273 WeakPolarHBondContact O-CB 3.47Å; H269-S273 PolarHBondContact O-N 2.81Å; H269-S273 PolarHBondContact O-OG 2.83Å; S273-S275 VanDerWaalsContact C-N 3.27Å; S273-S275 PolarHBondContact O-N 3.33Å; S273-S275 VanDerWaalsContact O-N 3.08Å
274	G	56.5	Low	65.4	Low	56 Å²	56	85.5 Å²	85.5	58%	0.577	47%	0.471	S	S	*	.	S	Bend	trans	-68.2	-7.1	-160.1	0	0	0	0	0	117.9	Y271 E272	Y271-G274 WeakPolarHBondContact O-CA 3.24Å; Y271-G274 PolarHBondContact O-N 3.16Å; Y271-G274 VanDerWaalsContact O-N 3.15Å; E272-G274 PolarHBondContact O-N 3.43Å
275	S	53.7	Low	62.7	Low	119 Å²	119	90.4 Å²	90.4	83%	0.832	49%	0.489	S	S	*	.	S	Bend	trans	-126.8	-49	-173.2	-57.2	0	0	0	0	115.9	S273	S273-S275 VanDerWaalsContact C-N 3.27Å; S273-S275 PolarHBondContact O-N 3.33Å; S273-S275 VanDerWaalsContact O-N 3.08Å
276	S	51	Low	59.9	Low	110 Å²	110	94.3 Å²	94.3	77%	0.769	51%	0.514	S	S	*	.	S	Bend	trans	-145.5	-6.4	-168.5	-51.3	0	0	0	0	117.6
277	L	45.4	Very low	57	Low	136 Å²	136	100 Å²	100	71%	0.712	55%	0.554	S	S	*	*			trans	-127.1	80.8	-167.9	-66.4	174.7	0	0	0	112.8
278	I	53.1	Low	54.5	Low	107 Å²	107	98.4 Å²	98.4	55%	0.549	56%	0.563	S	S	.	*			trans	-77.9	121.6	150	-60.3	177.6	0	0	0	105.7	Q280	I278-Q280 PolarHBondContact O-N 3.49Å
279	P	45.8	Very low	52.3	Low	61 Å²	61	99.9 Å²	99.9	40%	0.396	57%	0.57	S	S	.	*			trans	-64.7	128.9	-179	25.7	-33.6	0	0	0	110.2	I281	P279-I281 HydrophobicContact CB-CG1 4.01Å; P279-I281 HydrophobicContact CG-CD1 4.11Å; P279-I281 HydrophobicContact CG-CG1 4.04Å; P279-I281 PolarHBondContact O-N 2.88Å
280	Q	45.5	Very low	49.8	Very low	182 Å²	182	103.6 Å²	103.6	85%	0.85	59%	0.589	S	S	*	*			trans	-69.6	83.6	166.2	-67.7	-167.9	6.1	0	0	108.7	I278 S282	I278-Q280 PolarHBondContact O-N 3.49Å; Q280-S282 VanDerWaalsContact C-N 3.26Å; Q280-S282 PolarHBondContact O-N 3.49Å
281	I	44.4	Very low	47.3	Very low	91 Å²	91	107.7 Å²	107.7	47%	0.467	61%	0.613	S	S	.	*			trans	-78.9	82.4	173.9	-56.1	179	0	0	0	107.4	F263 P279 T283	F263-I281 HydrophobicContact CE2-CD1 4.34Å; P279-I281 HydrophobicContact CB-CG1 4.01Å; P279-I281 HydrophobicContact CG-CD1 4.11Å; P279-I281 HydrophobicContact CG-CG1 4.04Å; P279-I281 PolarHBondContact O-N 2.88Å; I281-T283 PolarHBondContact O-N 3.25Å
282	S	37.7	Very low	45.1	Very low	77 Å²	77	106 Å²	106	54%	0.538	61%	0.613	S	S	.	*			trans	-58	107.5	-176.6	-53	0	0	0	0	112.3	Q280 T284	Q280-S282 VanDerWaalsContact C-N 3.26Å; Q280-S282 PolarHBondContact O-N 3.49Å; S282-T284 PolarHBondContact O-N 2.87Å; S282-T284 PolarHBondContact O-OG1 3.41Å
283	T	33.7	Very low	43	Very low	107 Å²	107	106.2 Å²	106.2	66%	0.656	62%	0.618	S	S	*	*			trans	26.9	64.8	135.9	34.5	0	0	0	0	117.3	I281 M290	I281-T283 PolarHBondContact O-N 3.25Å; T283-M290 HydrophobicContact CG2-CE 3.78Å; T283-M290 HydrophobicContact CG2-SD 4.07Å
284	T	30.7	Very low	41.5	Very low	134 Å²	134	107.8 Å²	107.8	82%	0.822	63%	0.628	S	S	*	*			trans	-121.8	37.1	171	38.4	0	0	0	0	111.9	S282	S282-T284 PolarHBondContact O-N 2.87Å; S282-T284 PolarHBondContact O-OG1 3.41Å
285	R	35.7	Very low	40.7	Very low	104 Å²	104	111.4 Å²	111.4	39%	0.392	63%	0.633	S	S	.	*	S	Bend	trans	-137.5	106	176.4	-83.5	156.7	65.8	151.8	-1.6	110.2	S215 A216 H218	S215-R285 PolarHBondContact O-NH2 3.04Å; A216-R285 PolarHBondContact O-NH1 2.87Å; H218-R285 PolarHBondContact CD2-NE 3.46Å; H218-R285 PolarHBondContact CD2-NH2 2.92Å; H218-R285 PolarHBondContact CE1-NH2 2.86Å; H218-R285 PolarHBondContact ND1-NH2 2.79Å; H218-R285 PolarHBondContact NE2-NE 2.85Å; H218-R285 PolarHBondContact NE2-NH2 2.92Å
286	T	34.8	Very low	39.9	Very low	97 Å²	97	112.4 Å²	112.4	60%	0.595	63%	0.628	S	S	*	*			trans	39.1	99.4	162.7	52.3	0	0	0	0	116	S288	T286-S288 PolarHBondContact O-N 3.26Å
287	S	31.6	Very low	39.1	Very low	123 Å²	123	112.3 Å²	112.3	86%	0.86	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	50.6	-176.3	56.2	0	0	0	0	114.7
288	S	38.4	Very low	38.5	Very low	98 Å²	98	113 Å²	113	69%	0.685	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.6	5.6	-174.9	67.8	0	0	0	0	114.8	T286	T286-S288 PolarHBondContact O-N 3.26Å
289	E	45	Very low	37.5	Very low	114 Å²	114	113 Å²	113	53%	0.533	64%	0.637	S	S	.	*	S	Bend	trans	-134.2	23.9	177.9	-66.7	-173.4	-179.2	0	0	112.2	K213	K213-E289 IonicContact NZ-OE1 3.16Å; K213-E289 PolarHBondContact NZ-OE1 2.82Å
290	M	39	Very low	37	Very low	118 Å²	118	118.4 Å²	118.4	58%	0.581	66%	0.663	S	S	*	*	S	Bend	trans	-114.4	-21	-169	-87.4	-87.2	171.2	0	0	117.3	T283 S294	T283-M290 HydrophobicContact CG2-CE 3.78Å; T283-M290 HydrophobicContact CG2-SD 4.07Å; M290-S294 PolarHBondContact O-OG 2.8Å
291	D	35.4	Very low	36.3	Very low	125 Å²	125	115.7 Å²	115.7	67%	0.668	66%	0.664	S	S	*	*	S	Bend	trans	-96.7	-2.6	-164.9	-71.8	-37.5	0	0	0	116.7	I295	D291-I295 WeakPolarHBondContact O-CD1 3.31Å
292	L	40.8	Very low	35.8	Very low	101 Å²	101	116.8 Å²	116.8	53%	0.529	68%	0.68	S	S	.	*	S	Bend	trans	-109.6	-6.4	-171.6	-64.7	173	0	0	0	115.4	E692	L292-E692 HydrophobicContact CD1-CB 4.48Å; L292-E692 HydrophobicContact CD1-CG 4.09Å
293	L	37.2	Very low	35.5	Very low	135 Å²	135	120.5 Å²	120.5	71%	0.707	69%	0.692	S	S	*	*	S	Bend	trans	-116.7	-8.2	174.6	-71.9	174.7	0	0	0	114.2	I295 T297	L293-I295 VanDerWaalsContact C-N 3.3Å; L293-T297 PolarHBondContact O-OG1 3.47Å
294	S	36	Very low	35.3	Very low	68 Å²	68	124 Å²	124	48%	0.476	70%	0.698	S	S	.	*	S	Bend	trans	-74.2	-20.2	169.9	45.2	0	0	0	0	113.1	M290	M290-S294 PolarHBondContact O-OG 2.8Å
295	I	39.9	Very low	35.3	Very low	132 Å²	132	123.9 Å²	123.9	68%	0.677	69%	0.693	S	S	*	*	S	Bend	trans	-87.9	-25.3	-175.6	-60.7	177	0	0	0	112.6	D291 L293	D291-I295 WeakPolarHBondContact O-CD1 3.31Å; L293-I295 VanDerWaalsContact C-N 3.3Å
296	L	35.9	Very low	35.2	Very low	140 Å²	140	126 Å²	126	73%	0.733	72%	0.716	S	S	*	*	S	Bend	trans	-99.9	-2.5	-173.1	-71.1	171.9	0	0	0	115
297	T	34.7	Very low	34.8	Very low	108 Å²	108	129.6 Å²	129.6	66%	0.663	73%	0.729	S	S	*	*	S	Bend	trans	-133.4	50.4	-175.1	67.2	0	0	0	0	113.5	L293	L293-T297 PolarHBondContact O-OG1 3.47Å
298	N	33.6	Very low	34.9	Very low	151 Å²	151	132.5 Å²	132.5	81%	0.807	73%	0.726	S	S	*	*			trans	-147	42.9	179.6	-121.3	-6.8	0	0	0	115.9
299	S	32.6	Very low	34.5	Very low	107 Å²	107	133.4 Å²	133.4	75%	0.748	73%	0.727	S	S	*	*			trans	-160.4	81	169.7	47.3	0	0	0	0	113.2
300	N	34	Very low	33.8	Very low	175 Å²	175	134.8 Å²	134.8	94%	0.936	73%	0.734	S	S	*	*			trans	-170.2	58.5	153.8	-102.8	-40.7	0	0	0	114.3
301	S	31	Very low	33.2	Very low	124 Å²	124	139 Å²	139	87%	0.867	74%	0.743	S	S	*	*			trans	-152.9	147.8	149.9	58.3	0	0	0	0	107.3
302	S	34	Very low	33	Very low	115 Å²	115	140.6 Å²	140.6	80%	0.804	75%	0.75	S	S	*	*			cis	-125.3	157.3	18	-167.1	0	0	0	0	113.6
303	I	30.6	Very low	32.3	Very low	154 Å²	154	140.1 Å²	140.1	79%	0.79	76%	0.755	S	S	*	*			trans	-102.7	109.5	172	-64.9	169.1	0	0	0	108.3
304	K	31	Very low	32	Very low	182 Å²	182	140.6 Å²	140.6	79%	0.791	75%	0.754	S	S	*	*			trans	177.7	161.2	138.2	-103	159	-171.4	-180	0	115.9
305	D	31.3	Very low	31.6	Very low	131 Å²	131	140.7 Å²	140.7	70%	0.701	75%	0.754	S	S	*	*			trans	68.8	67.6	154.2	-53.5	-19.1	0	0	0	120.4
306	V	32.2	Very low	31.3	Very low	147 Å²	147	138.4 Å²	138.4	89%	0.891	75%	0.748	S	S	*	*				-129.8	97.4	123.6	-176.9	0	0	0	0	109.7
307	M	27.6	Very low	30.8	Very low	174 Å²	174	134.7 Å²	134.7	86%	0.857	73%	0.734	S	S	*	*			trans	-85.7	111.9	163.4	-68.5	-178.6	81.6	0	0	109.5
308	K	33.1	Very low	30.3	Very low	184 Å²	184	131.8 Å²	131.8	80%	0.8	72%	0.716	S	S	*	*			trans	-167.9	123.8	149.4	-111.5	159.5	-173.7	174.3	0	112.8
309	T	28.8	Very low	29.9	Very low	117 Å²	117	127.7 Å²	127.7	72%	0.718	69%	0.694	S	S	*	*			trans	35.7	121.3	133.6	56.1	0	0	0	0	117.9
310	E	31.2	Very low	29.6	Very low	142 Å²	142	126.4 Å²	126.4	66%	0.664	69%	0.685	S	S	*	*			cis	-141.7	153.4	18.2	-61.6	-160.5	98.4	0	0	111.4
311	R	26.5	Very low	29.2	Very low	208 Å²	208	124.1 Å²	124.1	79%	0.785	67%	0.673	S	S	*	*				36.6	133.1	94.9	-39.5	-171.8	-91.8	-168.3	-5.2	113.3
312	I	31.3	Very low	29.2	Very low	158 Å²	158	121.7 Å²	121.7	81%	0.81	66%	0.656	S	S	*	*			cis	-136.7	161.3	25.2	-66	170.5	0	0	0	110.7
313	S	26.4	Very low	29	Very low	90 Å²	90	121.3 Å²	121.3	63%	0.629	65%	0.648	S	S	*	*			trans	-70.3	152.3	173.6	47.7	0	0	0	0	114.6
314	E	30.3	Very low	28.8	Very low	145 Å²	145	119.4 Å²	119.4	68%	0.678	64%	0.639	S	S	*	*				-177.5	167.9	112.4	-96.6	164.7	-145	0	0	111.6	N1251	E314-N1251 PolarHBondContact OE2-ND2 2.95Å
315	S	28.3	Very low	28.7	Very low	70 Å²	70	116.3 Å²	116.3	49%	0.49	64%	0.64	S	S	.	*			trans	-115.2	-173.8	-168.5	61.5	0	0	0	0	112	S1250	S315-S1250 WeakPolarHBondContact O-CA 3.47Å; S315-S1250 WeakPolarHBondContact O-CB 3.41Å; S315-S1250 PolarHBondContact O-N 2.75Å
316	P	33.3	Very low	28.5	Very low	85 Å²	85	118.3 Å²	118.3	55%	0.552	65%	0.645	S	S	*	*				-116.1	-158.7	-69.4	36.1	-22	0	0	0	110.3	L1249	P316-L1249 VanDerWaalsContact O-CD1 3.29Å; P316-L1249 WeakPolarHBondContact O-CD1 3.3Å
317	S	24.7	Very low	28.3	Very low	61 Å²	61	117.6 Å²	117.6	43%	0.427	64%	0.635	S	S	.	*			trans	79.3	171.1	161.5	82.7	0	0	0	0	119.5	Y1247 H1248 L1249	S317-Y1247 VanDerWaalsContact CB-O 3.25Å; S317-Y1247 WeakPolarHBondContact CB-O 3.29Å; S317-Y1247 PolarHBondContact OG-O 3.38Å; S317-H1248 VanDerWaalsContact OG-C 3.24Å; S317-H1248 WeakPolarHBondContact OG-CA 3.33Å; S317-L1249 VanDerWaalsContact OG-CA 3.29Å; S317-L1249 WeakPolarHBondContact OG-CA 3.38Å; S317-L1249 PolarHBondContact OG-N 3.34Å
318	T	25	Very low	28.5	Very low	48 Å²	48	116.8 Å²	116.8	29%	0.294	63%	0.633	S	S	.	*			trans	62.6	124.4	176.8	127.6	0	0	0	0	119.6	Y1247 H1248 L1249	T318-Y1247 HydrophobicContact CG2-CD1 3.92Å; T318-H1248 HydrophobicContact CG2-CB 4.47Å; T318-L1249 HydrophobicContact CG2-CD1 3.69Å
319	L	24.9	Very low	28.2	Very low	65 Å²	65	113.1 Å²	113.1	34%	0.34	63%	0.626	S	S	.	*			trans	53.4	109.3	143.8	-85.9	84.8	0	0	0	119.6	D1246 Y1247	L319-D1246 WeakPolarHBondContact CA-OD1 3.38Å; L319-D1246 HydrophobicContact CD1-CB 3.42Å; L319-D1246 VanDerWaalsContact CD1-CB 3.42Å; L319-D1246 HydrophobicContact CG-CB 4.43Å; L319-D1246 PolarHBondContact N-OD1 3.45Å; L319-Y1247 HydrophobicContact CD1-CD1 3.91Å; L319-Y1247 HydrophobicContact CD1-CD2 3.75Å; L319-Y1247 HydrophobicContact CD1-CE1 3.53Å; L319-Y1247 HydrophobicContact CD1-CE2 3.36Å; L319-Y1247 HydrophobicContact CD1-CG 4.03Å; L319-Y1247 HydrophobicContact CD2-CE2 4.47Å; L319-Y1247 WeakPolarHBondContact CD2-OH 3.42Å
320	S	25.6	Very low	28.3	Very low	79 Å²	79	113.7 Å²	113.7	55%	0.552	63%	0.625	S	S	*	*				59.9	117.5	112.6	94.7	0	0	0	0	119.4
321	N	26.5	Very low	28.2	Very low	128 Å²	128	114.3 Å²	114.3	68%	0.684	63%	0.633	S	S	*	*			trans	57.8	105.5	139.3	-59	-44.9	0	0	0	117.4
322	S	30.1	Very low	28.4	Very low	73 Å²	73	107.5 Å²	107.5	51%	0.51	63%	0.627	S	S	.	*				141.5	177.2	52.7	49.5	0	0	0	0	109.9
323	V	30.2	Very low	28.4	Very low	107 Å²	107	107.9 Å²	107.9	65%	0.648	63%	0.631	S	S	*	*			trans	91	97.2	165.1	-166.9	0	0	0	0	118.1	Y729	V323-Y729 WeakPolarHBondContact CA-OH 3.35Å; V323-Y729 PolarHBondContact N-OH 2.95Å
324	N	27	Very low	28.4	Very low	113 Å²	113	108.8 Å²	108.8	60%	0.604	64%	0.636	S	S	*	*			trans	20.8	138	131.3	-52.4	-11.7	0	0	0	121.9	Y729	N324-Y729 WeakPolarHBondContact OD1-CE1 3.42Å
325	C	27.4	Very low	28.3	Very low	118 Å²	118	109 Å²	109	80%	0.797	64%	0.64	S	S	*	*				156.9	94.7	115.2	-84.1	0	0	0	0	108.1
326	E	28.8	Very low	28.3	Very low	172 Å²	172	113.4 Å²	113.4	80%	0.804	65%	0.653	S	S	*	*				74.4	135.7	64.1	-143.4	-162.1	-179.3	0	0	115
327	L	28.2	Very low	28	Very low	133 Å²	133	115.2 Å²	115.2	70%	0.696	66%	0.658	S	S	*	*			trans	92.7	134.6	158.6	-76.9	163.8	0	0	0	122.8
328	L	30.1	Very low	28.1	Very low	156 Å²	156	118.7 Å²	118.7	82%	0.817	67%	0.67	S	S	*	*			trans	83.7	138.2	156.6	-59.7	142.1	0	0	0	120.3
329	V	28.5	Very low	28.1	Very low	107 Å²	107	126.2 Å²	126.2	65%	0.648	70%	0.695	S	S	*	*			cis	-169.5	153.5	-34.2	112	0	0	0	0	111.6
330	N	29.5	Very low	28.1	Very low	130 Å²	130	129.7 Å²	129.7	70%	0.695	71%	0.714	S	S	*	*			trans	67.1	116.6	166.2	-70.5	-9.5	0	0	0	121.8
331	N	29.7	Very low	28	Very low	155 Å²	155	131 Å²	131	83%	0.829	72%	0.722	S	S	*	*				30.1	143.6	118.4	-46.4	-6	0	0	0	120.6
332	G	31.4	Very low	28.1	Very low	64 Å²	64	132.8 Å²	132.8	66%	0.66	73%	0.726	S	S	*	*			cis	139.4	142.6	-4	0	0	0	0	0	113.8
333	N	30.6	Very low	27.9	Very low	167 Å²	167	134.4 Å²	134.4	89%	0.893	73%	0.733	S	S	*	*			trans	65.8	160.7	175.5	-63.5	1.9	0	0	0	115.7
334	C	25.8	Very low	27.9	Very low	108 Å²	108	136 Å²	136	73%	0.73	74%	0.738	S	S	*	*			cis	-136.1	153.8	6.9	-156.7	0	0	0	0	114.8
335	I	28.8	Very low	28	Very low	150 Å²	150	136.2 Å²	136.2	77%	0.769	74%	0.743	S	S	*	*			trans	-56.5	133.9	161.4	-67.2	159.8	0	0	0	111
336	Q	27.7	Very low	28	Very low	163 Å²	163	137 Å²	137	76%	0.762	74%	0.74	S	S	*	*			trans	-177.4	157.5	144.5	-130.4	88	33.9	0	0	106.4
337	N	26.6	Very low	28.2	Very low	122 Å²	122	136.5 Å²	136.5	65%	0.652	74%	0.739	S	S	*	*			cis	-160.9	-177.1	-2.4	-151.5	1.9	0	0	0	108.6
338	I	27.4	Very low	28.4	Very low	134 Å²	134	140.1 Å²	140.1	69%	0.687	75%	0.749	S	S	*	*			trans	70.2	120.1	158.1	-64.8	154.5	0	0	0	114.6
339	Y	24.2	Very low	28.5	Very low	207 Å²	207	138.4 Å²	138.4	81%	0.812	74%	0.741	S	S	*	*				73.8	139.8	69.2	-93.6	-96.7	0	0	0	115.7
340	D	25.2	Very low	28.7	Very low	138 Å²	138	141.5 Å²	141.5	74%	0.738	75%	0.748	S	S	*	*			trans	71.9	157.2	164.3	-52.4	-33.8	0	0	0	121.7
341	C	24.1	Very low	28.9	Very low	106 Å²	106	143.7 Å²	143.7	72%	0.716	76%	0.759	S	S	*	*			trans	46.5	111	173.1	-72.4	0	0	0	0	119.2
342	E	27.9	Very low	29.2	Very low	165 Å²	165	144 Å²	144	77%	0.771	76%	0.756	S	S	*	*				89.3	131.7	70.2	-83.4	-172.7	124.3	0	0	115.7
343	T	26.3	Very low	29.5	Very low	107 Å²	107	149 Å²	149	66%	0.656	76%	0.762	S	S	*	*			trans	38.4	105.5	152	60.6	0	0	0	0	120.4
344	N	31.1	Very low	29.6	Very low	141 Å²	141	149.3 Å²	149.3	75%	0.754	76%	0.762	S	S	*	*				-163.5	102.6	123.5	-114.7	-87.5	0	0	0	110.4
345	T	28.4	Very low	29.7	Very low	118 Å²	118	154.1 Å²	154.1	72%	0.724	77%	0.771	S	S	*	*				51.8	48.9	75.5	63.9	0	0	0	0	117
346	N	28.4	Very low	30.1	Very low	134 Å²	134	152.5 Å²	152.5	72%	0.717	77%	0.768	S	S	*	*			trans	-153.2	86.9	155.2	-108.4	-39.3	0	0	0	114.6
347	M	31.8	Very low	30.4	Very low	161 Å²	161	153.7 Å²	153.7	79%	0.793	77%	0.771	S	S	*	*	S	Bend	trans	179.8	-13.3	152	-110.9	-175.9	-73.2	0	0	112.6	N349	M347-N349 PolarHBondContact O-N 2.64Å
348	K	33.2	Very low	30.6	Very low	209 Å²	209	152.6 Å²	152.6	91%	0.909	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	22.6	173.7	-150.6	-177.8	-178.8	-175.7	0	114.4
349	N	32.2	Very low	30.9	Very low	121 Å²	121	153.4 Å²	153.4	65%	0.647	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.2	9.2	-170.1	-105.9	5.2	0	0	0	113.4	M347	M347-N349 PolarHBondContact O-N 2.64Å
350	Q	33.1	Very low	31.1	Very low	171 Å²	171	149.6 Å²	149.6	80%	0.799	77%	0.767	S	S	*	*	S	Bend	trans	-119.3	9.2	179.2	-74.4	-171.8	-18.9	0	0	114.2
351	L	33.3	Very low	31.4	Very low	176 Å²	176	149.4 Å²	149.4	92%	0.921	77%	0.766	S	S	*	*	S	Bend	trans	-129.4	32.9	174.9	-151.5	72.4	0	0	0	112.2
352	E	36.8	Very low	31.6	Very low	162 Å²	162	150.9 Å²	150.9	76%	0.757	77%	0.765	S	S	*	*	S	Bend	trans	-122.7	23.7	179	-165	155.8	-146.7	0	0	111.7
353	Q	37.5	Very low	31.5	Very low	169 Å²	169	147.1 Å²	147.1	79%	0.79	76%	0.758	S	S	*	*	S	Bend	trans	-124.9	148.7	171	-60.1	-175.1	24.2	0	0	108.6
354	L	32.4	Very low	31.4	Very low	173 Å²	173	148.8 Å²	148.8	91%	0.906	76%	0.762	S	S	*	*			trans	76.4	55.4	-176.3	-47.5	180	0	0	0	116.7
355	K	28.4	Very low	31.4	Very low	209 Å²	209	148.1 Å²	148.1	91%	0.909	77%	0.769	S	S	*	*			trans	-114.6	104.3	150.3	-93.5	-170.4	173.2	-175.5	0	109.4
356	V	36.5	Very low	31.2	Very low	117 Å²	117	151.4 Å²	151.4	71%	0.709	77%	0.774	S	S	*	*			trans	-151.2	116.7	177.2	178.4	0	0	0	0	111.4
357	F	33.1	Very low	31.1	Very low	188 Å²	188	151.3 Å²	151.3	83%	0.825	77%	0.773	S	S	*	*			trans	55.8	135	172.9	-54.7	-53.3	0	0	0	118.1
358	S	31.8	Very low	30.8	Very low	98 Å²	98	151.6 Å²	151.6	69%	0.685	77%	0.773	S	S	*	*			cis	86.3	141.3	29.7	-60.9	0	0	0	0	114.8
359	Q	32.6	Very low	30.5	Very low	151 Å²	151	147.7 Å²	147.7	71%	0.706	76%	0.761	S	S	*	*			cis	-175.1	151.3	-11.4	168.2	164.4	-11.4	0	0	111.2
360	D	29.7	Very low	30.3	Very low	128 Å²	128	149 Å²	149	68%	0.684	77%	0.768	S	S	*	*			trans	66.5	151.7	158	-66.3	-13.8	0	0	0	125.1
361	D	31.7	Very low	30.1	Very low	133 Å²	133	146.2 Å²	146.2	71%	0.711	77%	0.768	S	S	*	*			trans	96.1	104.1	145.3	-73.7	-11.8	0	0	0	126
362	I	28.1	Very low	30.1	Very low	137 Å²	137	142.3 Å²	142.3	70%	0.703	76%	0.755	S	S	*	*				75	104.3	121	-61.6	168.6	0	0	0	121.5
363	S	24.5	Very low	29.8	Very low	87 Å²	87	141.6 Å²	141.6	61%	0.608	76%	0.755	S	S	*	*			trans	56.8	155.8	131.9	94.8	0	0	0	0	124.9
364	D	25.8	Very low	29.6	Very low	141 Å²	141	138.1 Å²	138.1	75%	0.754	75%	0.749	S	S	*	*			trans	51	103.7	154	-50.1	-46.5	0	0	0	120.4
365	S	30.9	Very low	29.5	Very low	128 Å²	128	138 Å²	138	90%	0.895	74%	0.744	S	S	*	*				-171.7	149.8	108.8	-84	0	0	0	0	115.1
366	F	24.1	Very low	29.6	Very low	187 Å²	187	132 Å²	132	82%	0.82	73%	0.733	S	S	*	*			trans	-78.9	146.5	170.7	-123.7	-99.1	0	0	0	111.3
367	N	24.8	Very low	29.4	Very low	132 Å²	132	131.9 Å²	131.9	71%	0.706	74%	0.737	S	S	*	*			trans	67.9	139.6	173.4	-41.7	-66.3	0	0	0	114.3
368	Q	26.9	Very low	29.2	Very low	167 Å²	167	129.4 Å²	129.4	78%	0.78	73%	0.731	S	S	*	*				-169.7	145.5	63.1	-83.8	-174.2	16.6	0	0	113.4
369	L	26.1	Very low	29.1	Very low	126 Å²	126	133.8 Å²	133.8	66%	0.66	74%	0.738	S	S	*	*			trans	58.1	109.3	137.1	-58.1	172.9	0	0	0	119.2
370	N	27.6	Very low	29.1	Very low	148 Å²	148	130.8 Å²	130.8	79%	0.791	73%	0.734	S	S	*	*				75.7	100.5	79	-77.7	-8.9	0	0	0	115.5
371	S	30.1	Very low	29.3	Very low	114 Å²	114	129 Å²	129	80%	0.797	73%	0.731	S	S	*	*			trans	-171.1	140.7	150.6	7.2	0	0	0	0	107.3
372	S	33.4	Very low	29.4	Very low	94 Å²	94	128.9 Å²	128.9	66%	0.657	74%	0.736	S	S	*	*			cis	-160.3	146.3	4.5	-93.7	0	0	0	0	111.4
373	I	29.8	Very low	29.6	Very low	146 Å²	146	130.9 Å²	130.9	75%	0.749	74%	0.742	S	S	*	*				49.8	133.8	119.8	-50.9	168.4	0	0	0	116.8
374	S	32.4	Very low	30.1	Very low	96 Å²	96	131.1 Å²	131.1	67%	0.671	74%	0.744	S	S	*	*			cis	-164.6	178	21.1	29.1	0	0	0	0	110.4
375	E	31.6	Very low	30.4	Very low	172 Å²	172	131.8 Å²	131.8	80%	0.804	75%	0.746	S	S	*	*			cis	-167.5	164.3	-23.1	-98.3	164.4	146.1	0	0	109.7
376	A	30.6	Very low	30.6	Very low	82 Å²	82	130.6 Å²	130.6	68%	0.678	74%	0.738	S	S	*	*			trans	30.9	137.1	152.6	0	0	0	0	0	121.5
377	S	31.8	Very low	30.8	Very low	114 Å²	114	126.6 Å²	126.6	80%	0.797	73%	0.733	S	S	*	*				165.4	161	82.5	45.3	0	0	0	0	110.8
378	I	29.7	Very low	31.6	Very low	137 Å²	137	127.1 Å²	127.1	70%	0.703	74%	0.735	S	S	*	*			cis	-163.6	140.1	-31.9	-120.5	166.3	0	0	0	109.2
379	F	29.7	Very low	32	Very low	189 Å²	189	124.8 Å²	124.8	83%	0.829	73%	0.734	S	S	*	*			trans	62.9	162	164	-78	-133.6	0	0	0	116.9
380	S	31.2	Very low	32.3	Very low	89 Å²	89	122.6 Å²	122.6	62%	0.622	73%	0.73	S	S	*	*			cis	-171.1	167.3	-19.7	-99.8	0	0	0	0	110.2
381	S	33.6	Very low	32.4	Very low	89 Å²	89	122.7 Å²	122.7	62%	0.622	73%	0.729	S	S	*	*			cis	-178.2	133	-26.3	-88.5	0	0	0	0	110.6
382	T	34	Very low	32.3	Very low	132 Å²	132	124.4 Å²	124.4	81%	0.81	73%	0.728	S	S	*	*			trans	69.4	160	167.2	79.3	0	0	0	0	117.5
383	Q	33.7	Very low	32.1	Very low	179 Å²	179	125.1 Å²	125.1	84%	0.836	73%	0.729	S	S	*	*			cis	-132	176.3	2.7	-48.5	171.1	10.2	0	0	108.4
384	S	34.4	Very low	32	Very low	91 Å²	91	125 Å²	125	64%	0.636	73%	0.729	S	S	*	*			cis	-158.4	139.5	9.5	53.5	0	0	0	0	111.3
385	L	32.3	Very low	31.6	Very low	155 Å²	155	125.9 Å²	125.9	81%	0.812	73%	0.734	S	S	*	*				48.6	141.7	129	-57.4	171.6	0	0	0	120.2
386	S	33.8	Very low	31.4	Very low	104 Å²	104	123.1 Å²	123.1	73%	0.727	73%	0.733	S	S	*	*			cis	-175.5	161.4	6.8	37	0	0	0	0	110.1
387	S	30.1	Very low	31.7	Very low	102 Å²	102	125.5 Å²	125.5	71%	0.713	74%	0.739	S	S	*	*			cis	-167.1	145.4	-19	-90.9	0	0	0	0	109.8
388	I	40.2	Very low	31.9	Very low	144 Å²	144	125.3 Å²	125.3	74%	0.738	74%	0.736	S	S	*	*			trans	-74.5	154.5	159.6	-30	177.7	0	0	0	108.4
389	P	36.3	Very low	31.7	Very low	118 Å²	118	123.5 Å²	123.5	77%	0.766	74%	0.735	S	S	*	*				-138.7	138.8	109.9	34.8	-22.1	0	0	0	112.8
390	S	31.9	Very low	31.6	Very low	80 Å²	80	119.3 Å²	119.3	56%	0.559	73%	0.729	S	S	*	*			cis	84.2	134.4	35.6	-60.5	0	0	0	0	115.2
391	L	29.9	Very low	31.3	Very low	149 Å²	149	120.6 Å²	120.6	78%	0.78	73%	0.734	S	S	*	*			trans	82.1	142.4	137.1	-85.2	170.8	0	0	0	121.1
392	L	28.5	Very low	31	Very low	150 Å²	150	121 Å²	121	79%	0.785	74%	0.737	S	S	*	*			trans	73.6	153.3	155.7	-57.2	152.8	0	0	0	115.3
393	V	28.2	Very low	30.7	Very low	109 Å²	109	121.1 Å²	121.1	66%	0.661	74%	0.737	S	S	*	*			cis	-152.9	143.8	-2	100.9	0	0	0	0	113.5
394	L	27.5	Very low	30.5	Very low	145 Å²	145	117.3 Å²	117.3	76%	0.759	74%	0.736	S	S	*	*			trans	21.6	143.6	145.7	-59.9	171.7	0	0	0	123.8
395	C	24.8	Very low	30.3	Very low	114 Å²	114	117.3 Å²	117.3	77%	0.77	74%	0.742	S	S	*	*			trans	94.3	143.2	132.8	-84.3	0	0	0	0	122.9
396	S	26.3	Very low	30.2	Very low	114 Å²	114	115.5 Å²	115.5	80%	0.797	74%	0.737	S	S	*	*			trans	83.3	101.7	153	-57.5	0	0	0	0	120.1
397	T	37.5	Very low	30.4	Very low	131 Å²	131	116.2 Å²	116.2	80%	0.804	74%	0.737	S	S	*	*			trans	-56	168.3	139.6	53	0	0	0	0	110.6
398	P	37.3	Very low	30.3	Very low	111 Å²	111	117.6 Å²	117.6	72%	0.721	74%	0.742	S	S	*	*			cis	-148	-163.2	26.3	40.8	-17.3	0	0	0	116.7
399	S	25.2	Very low	30.7	Very low	98 Å²	98	116.5 Å²	116.5	69%	0.685	74%	0.744	S	S	*	*			trans	75.5	99.8	145	-63.5	0	0	0	0	121.8
400	S	26.4	Very low	31.2	Very low	102 Å²	102	115.6 Å²	115.6	71%	0.713	74%	0.738	S	S	*	*				65	165.9	122.3	67.2	0	0	0	0	121.9
401	T	25.6	Very low	31	Very low	116 Å²	116	117.3 Å²	117.3	71%	0.712	75%	0.745	S	S	*	*			trans	59.6	99.9	162.4	42.4	0	0	0	0	116.1
402	S	26.7	Very low	30.9	Very low	98 Å²	98	116.2 Å²	116.2	69%	0.685	74%	0.744	S	S	*	*				67	137.9	93.9	70.5	0	0	0	0	114.1
403	T	28.1	Very low	30.8	Very low	134 Å²	134	113.5 Å²	113.5	82%	0.822	74%	0.738	S	S	*	*			cis	-158.7	166.2	44.8	-41	0	0	0	0	112
404	A	28.8	Very low	30.7	Very low	98 Å²	98	114 Å²	114	81%	0.81	74%	0.741	S	S	*	*			trans	-60	148.2	-176.6	0	0	0	0	0	116.9
405	A	31	Very low	30.5	Very low	91 Å²	91	113.2 Å²	113.2	75%	0.752	74%	0.738	S	S	*	*			trans	-166.3	134.7	140.1	0	0	0	0	0	109.2
406	T	30.7	Very low	30.6	Very low	118 Å²	118	114.7 Å²	114.7	72%	0.724	74%	0.737	S	S	*	*			cis	-160.5	144.3	-12.5	-70.8	0	0	0	0	107.6
407	T	37.4	Very low	30.6	Very low	118 Å²	118	115.4 Å²	115.4	72%	0.724	74%	0.736	S	S	*	*			trans	47.6	109.4	169.7	50.9	0	0	0	0	117
408	T	29.2	Very low	30	Very low	132 Å²	132	114.4 Å²	114.4	81%	0.81	73%	0.734	S	S	*	*			cis	56.6	142.3	24.1	60.2	0	0	0	0	117.2
409	P	48	Very low	29.9	Very low	121 Å²	121	113.7 Å²	113.7	79%	0.786	73%	0.732	S	S	*	*			trans	-105.4	-88.1	-157	17.8	4.9	0	0	0	114.5
410	P	45.5	Very low	30.4	Very low	99 Å²	99	114.8 Å²	114.8	64%	0.643	74%	0.737	S	S	*	*				-114.9	-142.2	-75.5	35.9	-19.7	0	0	0	112.5
411	V	28.7	Very low	30.6	Very low	115 Å²	115	116.6 Å²	116.6	70%	0.697	74%	0.737	S	S	*	*			trans	67.6	146.7	159.2	-83.2	0	0	0	0	122.2
412	T	28.6	Very low	30.9	Very low	126 Å²	126	119 Å²	119	77%	0.773	74%	0.742	S	S	*	*			trans	68.8	150.1	148.2	48.4	0	0	0	0	118.9
413	S	26	Very low	31.1	Very low	93 Å²	93	119.8 Å²	119.8	65%	0.65	74%	0.739	S	S	*	*			cis	-172.6	158.7	-15.8	50.9	0	0	0	0	112
414	V	25.5	Very low	31.1	Very low	119 Å²	119	118.2 Å²	118.2	72%	0.721	73%	0.729	S	S	*	*			trans	64.6	148.4	136.6	162.9	0	0	0	0	120.5
415	N	24.4	Very low	31.2	Very low	129 Å²	129	120.7 Å²	120.7	69%	0.69	73%	0.727	S	S	*	*			trans	74	115.2	168.6	-71.6	-12.5	0	0	0	117
416	I	25.6	Very low	31.1	Very low	146 Å²	146	121.9 Å²	121.9	75%	0.749	73%	0.725	S	S	*	*				85.2	157.3	76.6	-73.8	172.6	0	0	0	111.5
417	V	26.2	Very low	31.1	Very low	128 Å²	128	119.7 Å²	119.7	78%	0.776	72%	0.719	S	S	*	*			trans	81.5	86.3	-172.5	-167.3	0	0	0	0	111.8
418	S	25.7	Very low	30.7	Very low	111 Å²	111	123.2 Å²	123.2	78%	0.776	72%	0.724	S	S	*	*				93.2	140.9	69.3	-72.8	0	0	0	0	113.3
419	S	33.8	Very low	30.9	Very low	96 Å²	96	123.1 Å²	123.1	67%	0.671	72%	0.723	S	S	*	*			trans	-65.4	159.3	-178.2	-39.4	0	0	0	0	114.4
420	P	37.6	Very low	30.2	Very low	121 Å²	121	122.1 Å²	122.1	79%	0.786	72%	0.72	S	S	*	*				-107.3	129.1	118.2	31.5	-30.6	0	0	0	108.5
421	I	29.1	Very low	29.8	Very low	139 Å²	139	122.5 Å²	122.5	71%	0.713	72%	0.722	S	S	*	*			cis	51.8	72.6	33.6	-50.9	172.7	0	0	0	111.5
422	M	31.9	Very low	29.8	Very low	168 Å²	168	121.7 Å²	121.7	83%	0.828	72%	0.722	S	S	*	*			trans	-161.8	142	131.2	-81.4	-143.6	-164.9	0	0	107.7
423	N	30.6	Very low	29.7	Very low	114 Å²	114	124 Å²	124	61%	0.61	72%	0.721	S	S	*	*			cis	-163	126.8	-15.5	-115.4	-8.7	0	0	0	105.5
424	T	29.2	Very low	29.8	Very low	100 Å²	100	125 Å²	125	61%	0.613	72%	0.723	S	S	*	*				102.7	123	83.6	-83	0	0	0	0	112.6
425	I	30	Very low	29.9	Very low	150 Å²	150	126.8 Å²	126.8	77%	0.769	72%	0.724	S	S	*	*			trans	68.5	137.5	156.3	-68.3	171	0	0	0	117.1
426	T	29.8	Very low	30.1	Very low	117 Å²	117	125.2 Å²	125.2	72%	0.718	71%	0.714	S	S	*	*			cis	-169.6	166.2	-19.9	35.4	0	0	0	0	107.8
427	A	30.1	Very low	30.2	Very low	71 Å²	71	122.2 Å²	122.2	59%	0.587	70%	0.7	S	S	*	*			trans	66.9	144.4	148.8	0	0	0	0	0	117.8
428	F	30.1	Very low	30.5	Very low	193 Å²	193	120.8 Å²	120.8	85%	0.846	69%	0.688	S	S	*	*			cis	-149.6	170.4	-12.8	-80.5	-45.3	0	0	0	106.5
429	T	33.5	Very low	30.8	Very low	129 Å²	129	119.1 Å²	119.1	79%	0.791	67%	0.673	S	S	*	*			cis	-147.9	164.1	8.9	-20	0	0	0	0	110.6
430	S	32.5	Very low	30.7	Very low	101 Å²	101	119 Å²	119	71%	0.706	67%	0.672	S	S	*	*			trans	-94.7	-174.6	155.6	57.3	0	0	0	0	109.3
431	P	36.1	Very low	30.5	Very low	107 Å²	107	122.3 Å²	122.3	70%	0.695	67%	0.674	S	S	*	*			cis	-116.8	170.5	4.9	11	17	0	0	0	113.7
432	S	28.8	Very low	30.5	Very low	98 Å²	98	122.5 Å²	122.5	69%	0.685	68%	0.676	S	S	*	*				69.1	141.5	54.6	115.9	0	0	0	0	113.2
433	K	28	Very low	30.5	Very low	174 Å²	174	122.1 Å²	122.1	76%	0.757	68%	0.676	S	S	*	*			cis	-172.4	161.5	31.7	-129.6	172.9	-173.8	178.3	0	111.9
434	T	27.7	Very low	30.6	Very low	114 Å²	114	125.6 Å²	125.6	70%	0.699	69%	0.685	S	S	*	*			trans	59.3	-171.6	153.2	50.3	0	0	0	0	118.3
435	Q	26.9	Very low	30.8	Very low	157 Å²	157	126.7 Å²	126.7	73%	0.734	69%	0.694	S	S	*	*				-147.8	-161.7	-91.7	-93	157.6	-108.7	0	0	107.7
436	I	28.2	Very low	30.8	Very low	95 Å²	95	125.3 Å²	125.3	49%	0.487	69%	0.687	S	S	.	*			cis	-163.5	152.1	15.8	-158.4	160.7	0	0	0	112.4	G951	I436-G951 PolarHBondContact O-N 2.93Å
437	N	29	Very low	30.9	Very low	84 Å²	84	125 Å²	125	45%	0.449	69%	0.685	S	S	.	*			trans	57.8	140.3	156.6	-77.4	14	0	0	0	121.2	G949	N437-G949 WeakPolarHBondContact CB-O 3.49Å; N437-G949 PolarHBondContact ND2-O 2.84Å
438	D	32.9	Very low	30.8	Very low	98 Å²	98	126.7 Å²	126.7	52%	0.524	68%	0.684	S	S	.	*				68.9	131.7	70.1	-82.6	-16.1	0	0	0	115.2	G949 P950	D438-G949 CarbonylContact O-C 3.4Å; D438-G949 WeakPolarHBondContact O-CA 3.37Å; D438-G949 PolarHBondContact O-N 3.08Å; D438-P950 WeakPolarHBondContact O-CB 3.05Å; D438-P950 VanDerWaalsContact O-CG 3.23Å; D438-P950 WeakPolarHBondContact O-CG 3.04Å
439	T	31.4	Very low	30.6	Very low	76 Å²	76	122.5 Å²	122.5	47%	0.466	67%	0.67	S	S	.	*			cis	-166	155.4	23.9	0.2	0	0	0	0	113	G948 G949	T439-G948 WeakPolarHBondContact OG1-CA 3.31Å; T439-G949 PolarHBondContact OG1-N 3.25Å
440	S	30.5	Very low	30.6	Very low	93 Å²	93	119.3 Å²	119.3	65%	0.65	66%	0.662	S	S	*	*			trans	42.1	129.3	143.2	72.9	0	0	0	0	123.4
441	K	34.8	Very low	30.6	Very low	190 Å²	190	120.7 Å²	120.7	83%	0.826	67%	0.666	S	S	*	*				153	149.1	119.8	-84.5	174.4	-176.8	179.3	0	110.8
442	L	29.1	Very low	30.2	Very low	144 Å²	144	119.9 Å²	119.9	75%	0.754	66%	0.663	S	S	*	*			cis	-172.1	174.4	-31.8	-126.1	-179	0	0	0	106.8
443	I	32.5	Very low	30.2	Very low	160 Å²	160	122.4 Å²	122.4	82%	0.821	67%	0.668	S	S	*	*			trans	78.2	155.4	163.3	-63.4	149	0	0	0	116.6
444	K	32.3	Very low	30.2	Very low	187 Å²	187	118.5 Å²	118.5	81%	0.813	66%	0.662	S	S	*	*			trans	-116.1	170.2	-166.8	-100.5	-178.6	177.7	-179.8	0	110.9
445	P	33.8	Very low	30.3	Very low	122 Å²	122	119.5 Å²	119.5	79%	0.792	66%	0.663	S	S	*	*			trans	-77.8	159.2	-173.4	32.9	-37.6	0	0	0	113.9
446	I	29.8	Very low	30.4	Very low	121 Å²	121	119.4 Å²	119.4	62%	0.621	67%	0.667	S	S	*	*			trans	-125.5	156.2	165.7	-65.6	177.3	0	0	0	108.1	E822	I446-E822 HydrophobicContact CD1-CG 4.09Å; I446-E822 WeakPolarHBondContact CD1-OE2 3.49Å
447	T	31.1	Very low	30.4	Very low	111 Å²	111	122.5 Å²	122.5	68%	0.681	69%	0.685	S	S	*	*			trans	-86.5	175.1	-173	38.6	0	0	0	0	114.1
448	D	27	Very low	30.3	Very low	106 Å²	106	125.7 Å²	125.7	57%	0.567	70%	0.701	S	S	*	*				127.8	129.1	129.2	-69.9	-46.4	0	0	0	121.1	N819	D448-N819 WeakPolarHBondContact CB-OD1 3.44Å
449	I	27.6	Very low	30.1	Very low	106 Å²	106	127.4 Å²	127.4	54%	0.544	71%	0.709	S	S	.	*			trans	56.7	116.9	149.2	-61.7	-164.3	0	0	0	121.8	N818 N819	I449-N818 WeakPolarHBondContact CD1-OD1 3.47Å; I449-N819 WeakPolarHBondContact CD1-OD1 3.29Å; I449-N819 VanDerWaalsContact CG1-OD1 3.28Å; I449-N819 WeakPolarHBondContact CG1-OD1 3.46Å
450	G	33.6	Very low	29.9	Very low	61 Å²	61	131 Å²	131	63%	0.629	73%	0.726	S	S	*	*			trans	-164.4	107.2	139.5	0	0	0	0	0	107.2
451	T	31.8	Very low	29.8	Very low	130 Å²	130	131.2 Å²	131.2	80%	0.798	73%	0.727	S	S	*	*				49.9	136	90.7	57.6	0	0	0	0	115.2
452	S	27.7	Very low	29.6	Very low	90 Å²	90	130 Å²	130	63%	0.629	72%	0.724	S	S	*	*			cis	-172.1	166.5	-14	49.3	0	0	0	0	110.2
453	I	28.2	Very low	29.6	Very low	152 Å²	152	131.5 Å²	131.5	78%	0.779	73%	0.725	S	S	*	*			trans	70.7	147	149.4	-72.2	158	0	0	0	120
454	S	29.3	Very low	29.5	Very low	91 Å²	91	132.1 Å²	132.1	64%	0.636	72%	0.722	S	S	*	*			trans	74.6	107.9	158.9	62.7	0	0	0	0	121.1
455	N	28.2	Very low	29.4	Very low	136 Å²	136	128.3 Å²	128.3	73%	0.727	71%	0.714	S	S	*	*				40.9	112.5	112	-47.3	-11.6	0	0	0	118.2
456	N	30.6	Very low	29.1	Very low	154 Å²	154	130.7 Å²	130.7	82%	0.824	72%	0.715	S	S	*	*				178.1	136.1	89.5	-89.2	-55	0	0	0	112
457	N	27.4	Very low	29.1	Very low	160 Å²	160	132.6 Å²	132.6	86%	0.856	72%	0.721	S	S	*	*			trans	-83	113.7	158.4	-80.2	-35	0	0	0	108.4
458	L	27	Very low	29	Very low	151 Å²	151	133.6 Å²	133.6	79%	0.791	72%	0.721	S	S	*	*			trans	-172.1	152	146.2	-129	64.5	0	0	0	112
459	I	29.3	Very low	29.2	Very low	135 Å²	135	135.2 Å²	135.2	69%	0.692	73%	0.729	S	S	*	*			trans	65.3	104	160.1	-63.9	157	0	0	0	113.5
460	N	25.5	Very low	29.3	Very low	151 Å²	151	135 Å²	135	81%	0.807	73%	0.733	S	S	*	*				49.4	160	74.5	-84.7	-20.9	0	0	0	114.5
461	S	28.9	Very low	29.2	Very low	97 Å²	97	139 Å²	139	68%	0.678	74%	0.735	S	S	*	*			trans	67.1	156.3	-175.9	90.6	0	0	0	0	112.8
462	E	30.4	Very low	29.2	Very low	164 Å²	164	138.3 Å²	138.3	77%	0.766	73%	0.726	S	S	*	*			cis	-156.4	143.5	-12	-131.5	169.4	-132.9	0	0	110.8
463	F	29.2	Very low	29.5	Very low	177 Å²	177	137.7 Å²	137.7	78%	0.776	72%	0.722	S	S	*	*			trans	52.4	168.1	136.7	-96.1	-116.1	0	0	0	123
464	K	31.7	Very low	29.8	Very low	173 Å²	173	138.2 Å²	138.2	75%	0.752	73%	0.725	S	S	*	*			trans	64.8	94.5	163.7	-71.9	162.9	-176.5	169.2	0	116.2
465	T	29.2	Very low	30	Very low	106 Å²	106	139.1 Å²	139.1	65%	0.65	73%	0.729	S	S	*	*				65.9	126.5	71.6	69.3	0	0	0	0	114.9
466	Q	27.9	Very low	30	Very low	173 Å²	173	140.8 Å²	140.8	81%	0.808	74%	0.738	S	S	*	*			trans	58.5	117.5	150.9	-57.7	167.6	17.7	0	0	115.1
467	Q	29.6	Very low	30.2	Very low	161 Å²	161	142.1 Å²	142.1	75%	0.752	74%	0.736	S	S	*	*				-172.7	158.3	77.4	-93.5	-173.4	-17.7	0	0	111.5
468	I	29.2	Very low	30.2	Very low	131 Å²	131	144.3 Å²	144.3	67%	0.672	73%	0.734	S	S	*	*			trans	55.5	130.8	134.8	-64.3	171.8	0	0	0	118.5
469	L	30.8	Very low	30.3	Very low	140 Å²	140	147.6 Å²	147.6	73%	0.733	74%	0.743	S	S	*	*			cis	-162.3	-179.9	-8	-103.5	179.6	0	0	0	107.5
470	T	29.1	Very low	30.3	Very low	102 Å²	102	146.2 Å²	146.2	63%	0.626	75%	0.745	S	S	*	*			trans	17.2	140.8	146.8	58.6	0	0	0	0	120.2
471	E	32.1	Very low	30.5	Very low	146 Å²	146	144 Å²	144	68%	0.682	74%	0.737	S	S	*	*			cis	-176.2	160.7	27.7	-131	168.2	-116.9	0	0	112.3
472	N	31.8	Very low	30.4	Very low	114 Å²	114	147.4 Å²	147.4	61%	0.61	75%	0.746	S	S	*	*			trans	61.6	158	155.9	-53.9	-36.7	0	0	0	119.6
473	S	33.4	Very low	30.3	Very low	78 Å²	78	144.1 Å²	144.1	55%	0.545	75%	0.746	S	S	.	*			cis	-167.6	151.4	-35.4	58.9	0	0	0	0	111.6
474	L	35.4	Very low	30.5	Very low	162 Å²	162	144.9 Å²	144.9	85%	0.848	75%	0.75	S	S	*	*			trans	68.4	156.5	160.7	-70.2	155.6	0	0	0	119
475	P	33.3	Very low	30.5	Very low	110 Å²	110	141.7 Å²	141.7	71%	0.714	75%	0.749	S	S	*	*			cis	-128	109.8	-6.5	32.6	-12.6	0	0	0	114.3
476	D	29	Very low	30.5	Very low	171 Å²	171	146.3 Å²	146.3	91%	0.914	76%	0.763	S	S	*	*			trans	-70.7	138.2	161.8	-89.3	-53.5	0	0	0	111.5
477	K	33.8	Very low	30.7	Very low	182 Å²	182	142.6 Å²	142.6	79%	0.791	76%	0.756	S	S	*	*			trans	-140.5	135	168.4	-105.2	-177.4	178.5	177	0	110.9
478	Y	28.4	Very low	30.7	Very low	206 Å²	206	141.1 Å²	141.1	81%	0.808	76%	0.758	S	S	*	*	S	Bend	trans	75.7	48.4	177.6	-59.9	-75.4	0	0	0	118.2
479	F	28.8	Very low	30.8	Very low	221 Å²	221	142.2 Å²	142.2	97%	0.969	77%	0.765	S	S	*	*			trans	-134.8	89.4	132.4	-103.2	-75.3	0	0	0	111.3
480	S	29.4	Very low	30.6	Very low	106 Å²	106	144.4 Å²	144.4	74%	0.741	77%	0.771	S	S	*	*			trans	-160.3	152.7	170.5	83.5	0	0	0	0	108.2
481	T	30.4	Very low	30.8	Very low	104 Å²	104	146.5 Å²	146.5	64%	0.638	78%	0.777	S	S	*	*			cis	-140.1	136.4	-2.9	-52.8	0	0	0	0	109
482	I	26.3	Very low	30.7	Very low	169 Å²	169	147.6 Å²	147.6	87%	0.867	78%	0.78	S	S	*	*			trans	-124.3	147.7	158.5	-65.4	179.8	0	0	0	106.7
483	A	28	Very low	30.5	Very low	94 Å²	94	149 Å²	149	78%	0.777	79%	0.786	S	S	*	*			trans	71.3	69.3	179.8	0	0	0	0	0	117.7
484	K	32.4	Very low	30.4	Very low	194 Å²	194	151.9 Å²	151.9	84%	0.843	79%	0.791	S	S	*	*			trans	-138	141.3	137.3	-67.9	-172.9	-178.2	-179.9	0	106.7
485	S	32.8	Very low	30	Very low	106 Å²	106	151.9 Å²	151.9	74%	0.741	79%	0.787	S	S	*	*			cis	-154	151.1	-1.4	41.3	0	0	0	0	109.8
486	Q	28.1	Very low	29.8	Very low	203 Å²	203	153.9 Å²	153.9	95%	0.949	79%	0.792	S	S	*	*			trans	-74.2	131.6	169	-66.5	169.5	-55.4	0	0	110.4
487	S	33.1	Very low	29.6	Very low	94 Å²	94	149.6 Å²	149.6	66%	0.657	78%	0.775	S	S	*	*			trans	-159.9	97.2	159.5	58.7	0	0	0	0	113.3
488	T	29.6	Very low	29.2	Very low	130 Å²	130	147.7 Å²	147.7	80%	0.798	77%	0.774	S	S	*	*			trans	63.9	147.4	133.3	57.7	0	0	0	0	123
489	L	30.6	Very low	29.4	Very low	155 Å²	155	145.5 Å²	145.5	81%	0.812	77%	0.771	S	S	*	*			trans	89.7	87.8	157.7	-70.3	158.8	0	0	0	118.6
490	E	27.1	Very low	29.3	Very low	185 Å²	185	138.8 Å²	138.8	86%	0.864	75%	0.751	S	S	*	*			trans	-59.8	139.9	143.1	-50.1	167.9	114.9	0	0	110.9
491	I	33.6	Very low	29.4	Very low	146 Å²	146	139.9 Å²	139.9	75%	0.749	75%	0.749	S	S	*	*			trans	-171.8	137.7	151.2	-98.9	145.5	0	0	0	104.4
492	K	29.5	Very low	29.3	Very low	170 Å²	170	141.2 Å²	141.2	74%	0.739	75%	0.752	S	S	*	*			cis	160	133.8	-15.3	-115.9	178	-179.1	176	0	102.3
493	L	28.1	Very low	29.4	Very low	143 Å²	143	140.2 Å²	140.2	75%	0.749	74%	0.744	S	S	*	*			trans	68.1	158.1	163	-52	166.4	0	0	0	114.7
494	Q	31.4	Very low	29.4	Very low	139 Å²	139	144.9 Å²	144.9	65%	0.65	74%	0.742	S	S	*	*			cis	-148.8	136.1	-9.2	-118.6	151.2	-27	0	0	107.1
495	Q	26.9	Very low	29.1	Very low	161 Å²	161	140.2 Å²	140.2	75%	0.752	73%	0.734	S	S	*	*				55.1	145.9	104.2	-67	-174.8	-48.1	0	0	117.7
496	N	28.3	Very low	28.8	Very low	153 Å²	153	140.6 Å²	140.6	82%	0.818	73%	0.732	S	S	*	*			trans	81.1	144.5	175.8	-53.5	-13.8	0	0	0	115.6
497	S	24.7	Very low	28.8	Very low	81 Å²	81	138.6 Å²	138.6	57%	0.566	73%	0.728	S	S	*	*			cis	160.1	145.1	-34.8	50	0	0	0	0	107.3
498	N	26.7	Very low	28.5	Very low	142 Å²	142	140.4 Å²	140.4	76%	0.759	73%	0.73	S	S	*	*			trans	71.8	143.6	176.6	-45.9	-19.1	0	0	0	112.6
499	Q	30.9	Very low	28.3	Very low	160 Å²	160	140.8 Å²	140.8	75%	0.748	73%	0.726	S	S	*	*			cis	-143.1	147.4	0.3	-115.4	158.3	-86.5	0	0	107.4
500	S	26.9	Very low	28.1	Very low	79 Å²	79	142.8 Å²	142.8	55%	0.552	72%	0.724	S	S	*	*				58.3	132.8	94	99.9	0	0	0	0	113.6
501	D	31.2	Very low	28.1	Very low	130 Å²	130	139.9 Å²	139.9	70%	0.695	71%	0.711	S	S	*	*			cis	-149.7	169.6	24.3	-77.1	-71.1	0	0	0	114.5
502	N	28.9	Very low	27.7	Very low	131 Å²	131	137.3 Å²	137.3	70%	0.701	71%	0.705	S	S	*	*			trans	68.8	108.7	158.3	-62	-9.8	0	0	0	118.8
503	E	28.8	Very low	27.5	Very low	149 Å²	149	137.5 Å²	137.5	70%	0.696	71%	0.709	S	S	*	*				89.1	136.2	71	-83.1	-173.7	171.1	0	0	112.6
504	Y	28.5	Very low	27.4	Very low	192 Å²	192	136.4 Å²	136.4	75%	0.753	71%	0.708	S	S	*	*			cis	-135.1	166.7	-0.6	-122	-76	0	0	0	110.6
505	S	25.2	Very low	27.2	Very low	96 Å²	96	138.8 Å²	138.8	67%	0.671	72%	0.717	S	S	*	*			trans	-148.2	174.8	174.7	-79.2	0	0	0	0	112.2
506	T	27.3	Very low	27.1	Very low	114 Å²	114	135.1 Å²	135.1	70%	0.699	71%	0.709	S	S	*	*			trans	72.5	121.9	166.3	61.2	0	0	0	0	119.7
507	N	28	Very low	27.1	Very low	161 Å²	161	133.2 Å²	133.2	86%	0.861	70%	0.699	S	S	*	*			trans	168	99.8	139.9	-86.7	-26.8	0	0	0	106.9
508	L	25.9	Very low	27.3	Very low	132 Å²	132	139.3 Å²	139.3	69%	0.691	71%	0.711	S	S	*	*			cis	69.2	70.5	6.1	-126.2	177	0	0	0	115.8
509	L	25.6	Very low	27.4	Very low	137 Å²	137	140 Å²	140	72%	0.717	71%	0.713	S	S	*	*				179.3	124.9	116.6	-116.7	102.7	0	0	0	112.6
510	Y	26.6	Very low	27.3	Very low	198 Å²	198	141.5 Å²	141.5	78%	0.776	72%	0.718	S	S	*	*				-165.4	113.9	124.9	-125.5	-109.8	0	0	0	106.5
511	Q	28	Very low	27.6	Very low	124 Å²	124	143.8 Å²	143.8	58%	0.579	73%	0.731	S	S	*	*				53.2	98.1	95.1	-87.9	-175.9	5.7	0	0	111.8
512	S	24.1	Very low	27.5	Very low	91 Å²	91	142.7 Å²	142.7	64%	0.636	73%	0.733	S	S	*	*				84.4	137.7	91.8	66	0	0	0	0	112.1
513	Q	26.5	Very low	27.5	Very low	174 Å²	174	144.4 Å²	144.4	81%	0.813	74%	0.737	S	S	*	*			cis	-155.2	-176.5	27.1	-130.7	150.5	35	0	0	111.5
514	T	25.7	Very low	27.6	Very low	120 Å²	120	143.9 Å²	143.9	74%	0.736	74%	0.736	S	S	*	*			trans	-21	155.4	163.2	54.2	0	0	0	0	118.4
515	K	26.9	Very low	27.8	Very low	190 Å²	190	140.9 Å²	140.9	83%	0.826	73%	0.732	S	S	*	*			cis	-156.6	-163.1	29.6	-144.2	178	176.9	-172.3	0	113.6
516	S	24.7	Very low	28.1	Very low	84 Å²	84	143.4 Å²	143.4	59%	0.587	74%	0.738	S	S	*	*			trans	-91.4	-162.1	-167.9	53.8	0	0	0	0	114.9
517	D	27.4	Very low	28.1	Very low	113 Å²	113	144.3 Å²	144.3	60%	0.604	74%	0.737	S	S	*	*			trans	92.7	126.8	165.8	-39.6	-19.1	0	0	0	112.7
518	Y	28.8	Very low	28.3	Very low	209 Å²	209	144.9 Å²	144.9	82%	0.82	74%	0.737	S	S	*	*			cis	-131.5	131.9	10	-64.6	-104	0	0	0	108.9
519	L	29.4	Very low	28.5	Very low	155 Å²	155	144 Å²	144	81%	0.812	74%	0.737	S	S	*	*				62.5	111.7	74.8	-78.5	172.9	0	0	0	115.6
520	F	29	Very low	28.8	Very low	192 Å²	192	143.5 Å²	143.5	84%	0.842	75%	0.745	S	S	*	*			trans	-83.6	143	173.6	-74.3	-110.5	0	0	0	111.7
521	P	33.1	Very low	29	Very low	127 Å²	127	144.6 Å²	144.6	83%	0.825	75%	0.748	S	S	*	*			trans	-89.6	105.4	151.6	4.5	15.2	0	0	0	109.2
522	S	28.2	Very low	29.2	Very low	108 Å²	108	144.9 Å²	144.9	76%	0.755	76%	0.758	S	S	*	*			trans	-154.3	49.2	171	-73	0	0	0	0	111.4
523	E	30.2	Very low	29.6	Very low	167 Å²	167	143.9 Å²	143.9	78%	0.78	75%	0.745	S	S	*	*			trans	-93.8	152.7	156	-70.6	-159.9	134.8	0	0	108.4
524	M	29.6	Very low	29.9	Very low	137 Å²	137	139.8 Å²	139.8	68%	0.675	74%	0.741	S	S	*	*			cis	-154.1	170.7	9.9	-143.9	-171.5	-117.1	0	0	111.3
525	I	33.7	Very low	30.2	Very low	130 Å²	130	137.3 Å²	137.3	67%	0.667	73%	0.729	S	S	*	*			trans	73.9	132.8	160.6	-61.1	154.2	0	0	0	113.1
526	D	30.2	Very low	30.5	Very low	149 Å²	149	134.3 Å²	134.3	80%	0.797	73%	0.731	S	S	*	*			cis	-133.7	169	33.3	-142.7	-22	0	0	0	116
527	I	29.2	Very low	30.9	Very low	132 Å²	132	135.9 Å²	135.9	68%	0.677	74%	0.742	S	S	*	*			trans	-114.4	134.3	-166.3	-63	164.8	0	0	0	110.9
528	M	30.5	Very low	31.2	Very low	173 Å²	173	136.6 Å²	136.6	85%	0.852	76%	0.756	S	S	*	*			trans	-158.5	93.5	147.1	-113.5	167.2	-153.4	0	0	115.1
529	T	30.5	Very low	31.4	Very low	115 Å²	115	131.7 Å²	131.7	71%	0.706	75%	0.752	S	S	*	*			trans	35.2	119.7	134.6	56.4	0	0	0	0	121.3
530	S	32.3	Very low	31.6	Very low	126 Å²	126	129.9 Å²	129.9	88%	0.881	75%	0.753	S	S	*	*				-161.8	126.6	119.5	-82.1	0	0	0	0	111.5
531	R	31.8	Very low	31.9	Very low	221 Å²	221	125.5 Å²	125.5	83%	0.834	75%	0.746	S	S	*	*			trans	-120.7	132.6	171.1	-96.5	-173.2	175.3	-179.7	0.1	108.9
532	T	31.7	Very low	31.9	Very low	130 Å²	130	124 Å²	124	80%	0.798	74%	0.738	S	S	*	*			trans	-141.5	134	161.8	-35.1	0	0	0	0	108.3
533	I	32	Very low	32.3	Very low	70 Å²	70	124.1 Å²	124.1	36%	0.359	74%	0.739	S	S	.	*			trans	-137.8	136.2	178.8	-45.6	165.3	0	0	0	108.7	N1166 F1167	I533-N1166 WeakPolarHBondContact CG2-OD1 3.23Å; I533-F1167 HydrophobicContact CB-CD2 3.77Å; I533-F1167 HydrophobicContact CB-CE2 3.67Å; I533-F1167 HydrophobicContact CD1-CD2 4.44Å; I533-F1167 HydrophobicContact CD1-CE2 4.16Å; I533-F1167 HydrophobicContact CG1-CD2 4.32Å; I533-F1167 HydrophobicContact CG1-CE2 3.85Å; I533-F1167 VanDerWaalsContact N-CE2 3.28Å; I533-F1167 VanDerWaalsContact O-CD2 3.28Å; I533-F1167 WeakPolarHBondContact O-CD2 3.49Å
534	A	32.6	Very low	32.5	Very low	88 Å²	88	120.9 Å²	120.9	73%	0.727	74%	0.735	S	S	*	*			trans	-139.6	125.4	149.8	0	0	0	0	0	106
535	S	32.6	Very low	32.8	Very low	68 Å²	68	119.3 Å²	119.3	48%	0.476	74%	0.737	S	S	.	*			cis	72.8	92.1	41.9	86	0	0	0	0	113.3	N1166	S535-N1166 WeakPolarHBondContact CB-ND2 3.32Å
536	S	33.3	Very low	32.9	Very low	127 Å²	127	117.9 Å²	117.9	89%	0.888	74%	0.739	S	S	*	*			trans	-144.6	117.3	159.5	49.3	0	0	0	0	109.5
537	S	32.2	Very low	33	Very low	117 Å²	117	115.9 Å²	115.9	82%	0.818	74%	0.737	S	S	*	*			trans	-142.9	118.9	176.7	54.6	0	0	0	0	108.9
538	S	33.7	Very low	33	Very low	127 Å²	127	114.6 Å²	114.6	89%	0.888	74%	0.739	S	S	*	*			trans	-165.4	132.1	166.3	49.6	0	0	0	0	111.2
539	S	32.8	Very low	32.9	Very low	106 Å²	106	112.2 Å²	112.2	74%	0.741	74%	0.735	S	S	*	*			trans	-152.8	133.1	163.1	52.5	0	0	0	0	108.2
540	S	34.8	Very low	32.9	Very low	117 Å²	117	112.1 Å²	112.1	82%	0.818	73%	0.734	S	S	*	*			trans	59.5	142.9	-179.5	34.3	0	0	0	0	117.1
541	S	34.7	Very low	32.6	Very low	100 Å²	100	110.3 Å²	110.3	70%	0.699	72%	0.721	S	S	*	*			cis	-164.6	161.7	-12.6	46	0	0	0	0	112.2
542	S	34	Very low	32.6	Very low	95 Å²	95	109.2 Å²	109.2	66%	0.664	72%	0.718	S	S	*	*			trans	61.4	127.4	145.9	55.8	0	0	0	0	121.3
543	S	35.1	Very low	32.5	Very low	111 Å²	111	110.2 Å²	110.2	78%	0.776	72%	0.718	S	S	*	*			trans	62.9	141.9	149.1	49	0	0	0	0	119.6
544	S	36	Very low	32.6	Very low	100 Å²	100	111.1 Å²	111.1	70%	0.699	73%	0.729	S	S	*	*			cis	-169	164.1	-14.2	44.7	0	0	0	0	110
545	S	35.5	Very low	32.4	Very low	103 Å²	103	114 Å²	114	72%	0.72	73%	0.732	S	S	*	*			trans	7.5	141.1	152.7	57.2	0	0	0	0	120.5
546	S	34.8	Very low	32.2	Very low	100 Å²	100	115.5 Å²	115.5	70%	0.699	74%	0.743	S	S	*	*			cis	177.2	153.2	-4.1	46.6	0	0	0	0	109.7
547	S	33.5	Very low	31.9	Very low	108 Å²	108	116.7 Å²	116.7	76%	0.755	74%	0.737	S	S	*	*			trans	70.9	134.8	159.4	-52.7	0	0	0	0	118.8
548	S	29.1	Very low	31.9	Very low	104 Å²	104	116.6 Å²	116.6	73%	0.727	73%	0.732	S	S	*	*				37.9	132	126.3	-46.8	0	0	0	0	119.3
549	T	28.7	Very low	31.7	Very low	123 Å²	123	116.6 Å²	116.6	76%	0.755	72%	0.722	S	S	*	*			cis	-172.5	172.2	24.1	-7.3	0	0	0	0	112
550	V	30	Very low	31.8	Very low	114 Å²	114	118.7 Å²	118.7	69%	0.691	72%	0.72	S	S	*	*			trans	63.4	87	146.3	174.7	0	0	0	0	118.2
551	S	26.2	Very low	31.8	Very low	88 Å²	88	117 Å²	117	62%	0.615	71%	0.708	S	S	*	*				55.6	174.3	126.1	68.6	0	0	0	0	123.1
552	Y	30.4	Very low	31.7	Very low	197 Å²	197	120.2 Å²	120.2	77%	0.773	71%	0.712	S	S	*	*			trans	75.5	113.1	-177.9	-60.6	-80	0	0	0	114.3
553	L	29.6	Very low	31.7	Very low	152 Å²	152	120.4 Å²	120.4	80%	0.796	71%	0.713	S	S	*	*				96.8	162.7	72.1	-114	78.7	0	0	0	110.9
554	P	36.2	Very low	31.6	Very low	89 Å²	89	121.6 Å²	121.6	58%	0.578	71%	0.709	S	S	*	*				-132.6	-161.9	-112.1	42.6	-23.9	0	0	0	114.2
555	N	27.1	Very low	31.4	Very low	147 Å²	147	123.2 Å²	123.2	79%	0.786	71%	0.709	S	S	*	*			trans	72	-179	159.8	-61.8	-10.7	0	0	0	117.1
556	S	28	Very low	31.2	Very low	101 Å²	101	124.6 Å²	124.6	71%	0.706	71%	0.708	S	S	*	*			trans	69	118.4	-174.9	41	0	0	0	0	115.3
557	I	27	Very low	31	Very low	151 Å²	151	125.2 Å²	125.2	77%	0.774	71%	0.708	S	S	*	*				79.7	149.6	53	-62.5	159.6	0	0	0	110.4
558	T	31.9	Very low	30.9	Very low	116 Å²	116	124.1 Å²	124.1	71%	0.712	70%	0.701	S	S	*	*			trans	72.6	149.1	-170.3	77.9	0	0	0	0	112.8
559	D	30.9	Very low	31	Very low	127 Å²	127	126 Å²	126	68%	0.679	70%	0.701	S	S	*	*			cis	-168.7	173	-24.7	-104.2	-40.8	0	0	0	106.3
560	H	35.2	Very low	31.1	Very low	149 Å²	149	126.4 Å²	126.4	69%	0.69	70%	0.698	S	S	*	*			cis	-156.5	174.3	5.4	-137.7	19.4	0	0	0	109.1
561	S	33.8	Very low	31	Very low	82 Å²	82	127.3 Å²	127.3	57%	0.573	70%	0.7	S	S	*	*			trans	30.8	141.7	133.7	88.7	0	0	0	0	121.4
562	Q	33.3	Very low	31.2	Very low	167 Å²	167	129.3 Å²	129.3	78%	0.78	71%	0.708	S	S	*	*			cis	-177.5	163	8.3	-128.2	168.8	37.4	0	0	112.1
563	S	32.9	Very low	31.1	Very low	99 Å²	99	126.2 Å²	126.2	69%	0.692	70%	0.703	S	S	*	*			trans	70.8	151.3	146.9	84.8	0	0	0	0	116.8
564	I	33.4	Very low	31	Very low	136 Å²	136	125.8 Å²	125.8	70%	0.697	70%	0.701	S	S	*	*			cis	-134	124.4	2.9	-73.8	-175.4	0	0	0	105.4
565	I	31.9	Very low	30.7	Very low	135 Å²	135	127.9 Å²	127.9	69%	0.692	71%	0.707	S	S	*	*				62.8	126.6	84.2	-75.3	163.9	0	0	0	110.6
566	N	31.1	Very low	30.9	Very low	131 Å²	131	126.9 Å²	126.9	70%	0.701	71%	0.707	S	S	*	*			cis	-147.5	150	14.2	-103.3	-9.7	0	0	0	109.8
567	T	31.7	Very low	30.9	Very low	114 Å²	114	128.1 Å²	128.1	70%	0.699	71%	0.711	S	S	*	*				44.7	147.8	94.1	32.9	0	0	0	0	116.5
568	S	30.6	Very low	31.3	Very low	85 Å²	85	126 Å²	126	59%	0.594	71%	0.706	S	S	*	*			cis	-171.1	169.4	26.4	-132.8	0	0	0	0	114.2
569	I	32.3	Very low	31.1	Very low	142 Å²	142	128.9 Å²	128.9	73%	0.728	71%	0.71	S	S	*	*			trans	66.6	144	142.1	-70.4	162.3	0	0	0	118.3
570	N	29.7	Very low	31	Very low	132 Å²	132	130 Å²	130	71%	0.706	71%	0.714	S	S	*	*			cis	-168.9	171.2	-28.7	-101.8	-11.2	0	0	0	108.9
571	N	27.8	Very low	30.7	Very low	134 Å²	134	127.7 Å²	127.7	72%	0.717	72%	0.715	S	S	*	*			trans	-24.4	139.7	161.6	-45.6	-29.6	0	0	0	117.8
572	T	31.3	Very low	30.4	Very low	130 Å²	130	130.6 Å²	130.6	80%	0.798	72%	0.724	S	S	*	*				179	111.8	129.7	-73.7	0	0	0	0	106.9
573	I	27.3	Very low	30.2	Very low	131 Å²	131	131.3 Å²	131.3	67%	0.672	73%	0.728	S	S	*	*				83.1	124.6	53.9	-64.2	172.5	0	0	0	113.2
574	L	27.8	Very low	30.1	Very low	143 Å²	143	132.3 Å²	132.3	75%	0.749	73%	0.734	S	S	*	*			trans	76.7	146.7	162.8	-78.4	166.3	0	0	0	121.6
575	N	30	Very low	29.7	Very low	133 Å²	133	132.9 Å²	132.9	71%	0.711	74%	0.737	S	S	*	*			trans	71.9	141.8	157.1	-56.1	-21.4	0	0	0	119.3
576	T	31.3	Very low	29.5	Very low	127 Å²	127	134 Å²	134	78%	0.779	75%	0.745	S	S	*	*			cis	-161.6	156.2	-19.5	19.2	0	0	0	0	109.2
577	T	28.4	Very low	29.4	Very low	127 Å²	127	132.8 Å²	132.8	78%	0.779	74%	0.742	S	S	*	*			trans	-67.2	172.9	162.1	46.9	0	0	0	0	110.8
578	P	34.6	Very low	29.4	Very low	105 Å²	105	134.7 Å²	134.7	68%	0.682	75%	0.748	S	S	*	*			cis	-161.8	-167.5	36.6	46.7	-23.1	0	0	0	120.9
579	F	28.1	Very low	29.5	Very low	178 Å²	178	137.9 Å²	137.9	78%	0.781	76%	0.757	S	S	*	*			trans	77.9	105.3	148.1	-90.1	-75.7	0	0	0	123.4
580	L	27.8	Very low	29.4	Very low	149 Å²	149	136.5 Å²	136.5	78%	0.78	76%	0.757	S	S	*	*			trans	29.8	137.2	135.3	-50.1	-179.3	0	0	0	120.3
581	S	30.1	Very low	29.5	Very low	101 Å²	101	135.3 Å²	135.3	71%	0.706	75%	0.75	S	S	*	*				-168.1	141.6	63.2	57.3	0	0	0	0	116
582	D	26.8	Very low	29.7	Very low	144 Å²	144	136.3 Å²	136.3	77%	0.77	75%	0.748	S	S	*	*			trans	35	115.5	149.3	-48.5	-20.7	0	0	0	122.4
583	Q	30	Very low	30	Very low	182 Å²	182	138.1 Å²	138.1	85%	0.85	75%	0.748	S	S	*	*				-174.3	135.2	98.6	-96.6	176.2	23.7	0	0	113.7
584	S	29.8	Very low	30.2	Very low	119 Å²	119	136.3 Å²	136.3	83%	0.832	75%	0.746	S	S	*	*			trans	37.5	104.7	164.4	57.4	0	0	0	0	119.8
585	I	25.7	Very low	30.5	Very low	148 Å²	148	133.8 Å²	133.8	76%	0.759	73%	0.733	S	S	*	*			trans	-97	144	169	-62.7	165.9	0	0	0	109.7	T587	I585-T587 HydrophobicContact CG2-CG2 4Å
586	N	28.1	Very low	31.2	Very low	159 Å²	159	132.1 Å²	132.1	85%	0.85	72%	0.721	S	S	*	*			trans	-150.2	106.3	154.5	-153.4	-7.2	0	0	0	110.5
587	T	28.8	Very low	31.7	Very low	105 Å²	105	133.6 Å²	133.6	64%	0.644	72%	0.719	S	S	*	*			trans	-125.2	119.2	-170.9	47.9	0	0	0	0	111.5	I585	I585-T587 HydrophobicContact CG2-CG2 4Å
588	N	30.4	Very low	32.1	Very low	154 Å²	154	133.5 Å²	133.5	82%	0.824	71%	0.708	S	S	*	*			trans	-127.4	103.8	168.4	-94.6	-57.4	0	0	0	109.6
589	I	32.3	Very low	32.3	Very low	153 Å²	153	133.6 Å²	133.6	79%	0.785	70%	0.702	S	S	*	*			trans	-111.2	113.7	175.7	-60.5	175.5	0	0	0	107.3	L591	I589-L591 PolarHBondContact O-N 3.45Å
590	P	31.6	Very low	33.1	Very low	112 Å²	112	131.5 Å²	131.5	73%	0.727	69%	0.693	S	S	*	*			trans	-65.7	131.2	-175	-24.9	35.4	0	0	0	114.2	F592	P590-F592 PolarHBondContact O-N 3.01Å
591	L	31.5	Very low	34	Very low	107 Å²	107	132 Å²	132	56%	0.56	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	29.4	-180	-79.2	155.8	0	0	0	115.1	I589 N595 Y640	I589-L591 PolarHBondContact O-N 3.45Å; L591-N595 PolarHBondContact O-ND2 2.84Å; L591-Y640 HydrophobicContact CD1-CE2 3.95Å
592	F	31.6	Very low	34.4	Very low	155 Å²	155	129.5 Å²	129.5	68%	0.68	67%	0.671	S	S	*	*	H	α-helix	trans	-81.2	-33.7	-164.3	-138.2	-102	0	0	0	114.3	P590	P590-F592 PolarHBondContact O-N 3.01Å
593	Q	37.7	Very low	35.1	Very low	168 Å²	168	127.5 Å²	127.5	79%	0.785	66%	0.657	S	S	*	*	H	α-helix	trans	-74.4	-38.7	-173.9	-153.6	81	-18.8	0	0	113.1
594	C	31	Very low	35.8	Very low	94 Å²	94	125.4 Å²	125.4	64%	0.635	65%	0.648	S	S	*	*	H	α-helix	trans	-75.2	-41.2	-171.5	-168.5	0	0	0	0	112.6	Q596 Q597	C594-Q596 VanDerWaalsContact C-N 3.27Å; C594-Q596 PolarHBondContact O-N 2.89Å; C594-Q597 PolarHBondContact O-N 3.09Å; C594-Q597 VanDerWaalsContact O-N 3.17Å
595	N	35.8	Very low	36.3	Very low	89 Å²	89	125.7 Å²	125.7	48%	0.476	64%	0.639	S	S	.	*	H	α-helix	trans	-57.6	-35.5	-177.1	-86.3	-60.4	0	0	0	113.5	L591 Q597 F598 L599	L591-N595 PolarHBondContact O-ND2 2.84Å; N595-Q597 VanDerWaalsContact C-N 3.31Å; N595-Q597 PolarHBondContact O-N 2.87Å; N595-F598 PolarHBondContact O-N 3.14Å; N595-L599 WeakPolarHBondContact O-CB 3.2Å; N595-L599 PolarHBondContact O-N 2.98Å
596	Q	43.5	Very low	37	Very low	99 Å²	99	122.8 Å²	122.8	46%	0.463	63%	0.628	S	S	.	*	H	α-helix	trans	-63.8	-31.7	-179.5	-68.7	-160	31.8	0	0	113.9	C594 K600	C594-Q596 VanDerWaalsContact C-N 3.27Å; C594-Q596 PolarHBondContact O-N 2.89Å; Q596-K600 WeakPolarHBondContact O-CB 3.23Å; Q596-K600 WeakPolarHBondContact O-CG 3.41Å; Q596-K600 PolarHBondContact O-N 2.67Å
597	Q	41.4	Very low	37.5	Very low	157 Å²	157	123.3 Å²	123.3	73%	0.734	62%	0.618	S	S	*	*	H	α-helix	trans	-76.4	-35.5	177.9	-68.1	-166.8	1.4	0	0	111.9	C594 N595 K601	C594-Q597 PolarHBondContact O-N 3.09Å; C594-Q597 VanDerWaalsContact O-N 3.17Å; N595-Q597 VanDerWaalsContact C-N 3.31Å; N595-Q597 PolarHBondContact O-N 2.87Å; Q597-K601 PolarHBondContact O-N 3.09Å
598	F	37.6	Very low	38.1	Very low	126 Å²	126	126.4 Å²	126.4	55%	0.553	63%	0.625	S	S	*	*	H	α-helix	trans	-70.3	-44.3	178	-141.7	-89.1	0	0	0	111.4	N595 K600 K601 S602 L633	N595-F598 PolarHBondContact O-N 3.14Å; F598-K600 PolarHBondContact O-N 3.26Å; F598-K601 PolarHBondContact O-N 3.1Å; F598-K601 VanDerWaalsContact O-N 3.1Å; F598-S602 PolarHBondContact O-N 2.87Å; F598-S602 PolarHBondContact O-OG 3.32Å; F598-L633 HydrophobicContact CE2-CD1 4.44Å; F598-L633 HydrophobicContact CZ-CD1 4.27Å
599	L	38.3	Very low	38.5	Very low	106 Å²	106	123.6 Å²	123.6	56%	0.555	61%	0.614	S	S	*	*	H	α-helix	trans	-59.5	-41.4	173.6	-85	156.8	0	0	0	112.9	N595 K601 S602 E603	N595-L599 WeakPolarHBondContact O-CB 3.2Å; N595-L599 PolarHBondContact O-N 2.98Å; L599-K601 VanDerWaalsContact C-N 3.25Å; L599-K601 PolarHBondContact O-N 3.31Å; L599-S602 WeakPolarHBondContact CA-OG 3.48Å; L599-S602 PolarHBondContact O-N 2.89Å; L599-S602 PolarHBondContact O-OG 3.08Å; L599-E603 PolarHBondContact O-N 3.46Å
600	K	46	Very low	38.6	Very low	135 Å²	135	121.8 Å²	121.8	59%	0.587	61%	0.61	S	S	*	*	H	α-helix	trans	-65.7	-24.3	175.6	-79.3	173.8	176.3	167.9	0	113.6	Q596 F598 Q604	Q596-K600 WeakPolarHBondContact O-CB 3.23Å; Q596-K600 WeakPolarHBondContact O-CG 3.41Å; Q596-K600 PolarHBondContact O-N 2.67Å; F598-K600 PolarHBondContact O-N 3.26Å; K600-Q604 WeakPolarHBondContact O-CG 3.19Å
601	K	46.2	Very low	38.7	Very low	160 Å²	160	123.4 Å²	123.4	70%	0.696	61%	0.612	S	S	*	*	H	α-helix	trans	-83	-41.7	170.9	-84.4	-173.7	172.1	-178.3	0	113	Q597 F598 L599 E603 Q604 L605	Q597-K601 PolarHBondContact O-N 3.09Å; F598-K601 PolarHBondContact O-N 3.1Å; F598-K601 VanDerWaalsContact O-N 3.1Å; L599-K601 VanDerWaalsContact C-N 3.25Å; L599-K601 PolarHBondContact O-N 3.31Å; K601-E603 VanDerWaalsContact C-N 3.35Å; K601-E603 PolarHBondContact O-N 2.95Å; K601-Q604 PolarHBondContact O-N 3.38Å; K601-L605 PolarHBondContact O-N 3.45Å; K601-L605 VanDerWaalsContact O-N 3.13Å
602	S	39	Very low	38.9	Very low	48 Å²	48	125.5 Å²	125.5	34%	0.336	62%	0.624	S	S	.	*	H	α-helix	trans	-66.7	-34.9	179.9	63.8	0	0	0	0	112.4	F598 L599 Q604 L605 T606	F598-S602 PolarHBondContact O-N 2.87Å; F598-S602 PolarHBondContact O-OG 3.32Å; L599-S602 WeakPolarHBondContact CA-OG 3.48Å; L599-S602 PolarHBondContact O-N 2.89Å; L599-S602 PolarHBondContact O-OG 3.08Å; S602-Q604 VanDerWaalsContact C-N 3.35Å; S602-Q604 PolarHBondContact O-N 3.24Å; S602-L605 PolarHBondContact O-N 2.97Å; S602-T606 WeakPolarHBondContact O-CB 3.44Å; S602-T606 PolarHBondContact O-N 2.93Å; S602-T606 PolarHBondContact O-OG1 3.04Å
603	E	41.2	Very low	38.7	Very low	102 Å²	102	122.7 Å²	122.7	48%	0.477	64%	0.638	S	S	.	*	H	α-helix	trans	-63.9	-36.7	171.7	-79.1	-150	172.2	0	0	113.2	L599 K601 T606 R607	L599-E603 PolarHBondContact O-N 3.46Å; K601-E603 VanDerWaalsContact C-N 3.35Å; K601-E603 PolarHBondContact O-N 2.95Å; E603-T606 PolarHBondContact O-N 2.79Å; E603-R607 VanDerWaalsContact O-CG 3.24Å; E603-R607 WeakPolarHBondContact O-CG 3.2Å; E603-R607 PolarHBondContact O-N 3.07Å; E603-R607 VanDerWaalsContact O-N 3.16Å; E603-R607 IonicContact OE2-CZ 2.7Å; E603-R607 IonicContact OE2-NE 2.93Å; E603-R607 IonicContact OE2-NH2 3.67Å; E603-R607 PolarHBondContact OE2-NH2 2.99Å
604	Q	45	Very low	38.5	Very low	138 Å²	138	118 Å²	118	65%	0.645	63%	0.628	S	S	*	*	H	α-helix	trans	-66.6	-39.3	176	-72.9	-178.3	-0.7	0	0	111.4	K600 K601 S602	K600-Q604 WeakPolarHBondContact O-CG 3.19Å; K601-Q604 PolarHBondContact O-N 3.38Å; S602-Q604 VanDerWaalsContact C-N 3.35Å; S602-Q604 PolarHBondContact O-N 3.24Å
605	L	39.2	Very low	38.5	Very low	124 Å²	124	122.9 Å²	122.9	65%	0.649	64%	0.638	S	S	*	*	H	α-helix	trans	-66.1	-43.3	176.3	-144	71.8	0	0	0	111.7	K601 S602 R607 H608	K601-L605 PolarHBondContact O-N 3.45Å; K601-L605 VanDerWaalsContact O-N 3.13Å; S602-L605 PolarHBondContact O-N 2.97Å; L605-R607 VanDerWaalsContact C-N 3.3Å; L605-R607 PolarHBondContact O-N 3.22Å; L605-H608 PolarHBondContact O-N 3.35Å
606	T	40.2	Very low	38.4	Very low	87 Å²	87	124.4 Å²	124.4	53%	0.534	65%	0.645	S	S	.	*	H	α-helix	trans	-70.9	-23.9	-176.2	-48.9	0	0	0	0	113.1	S602 E603 H608 T609	S602-T606 WeakPolarHBondContact O-CB 3.44Å; S602-T606 PolarHBondContact O-N 2.93Å; S602-T606 PolarHBondContact O-OG1 3.04Å; E603-T606 PolarHBondContact O-N 2.79Å; T606-H608 VanDerWaalsContact C-N 3.31Å; T606-H608 PolarHBondContact O-N 2.91Å; T606-T609 PolarHBondContact O-OG1 3.38Å
607	R	38.7	Very low	37.9	Very low	171 Å²	171	124.8 Å²	124.8	65%	0.645	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-11.2	176.1	-71.2	173.6	-163.7	-147.1	8.4	113.9	E603 L605	E603-R607 VanDerWaalsContact O-CG 3.24Å; E603-R607 WeakPolarHBondContact O-CG 3.2Å; E603-R607 PolarHBondContact O-N 3.07Å; E603-R607 VanDerWaalsContact O-N 3.16Å; E603-R607 IonicContact OE2-CZ 2.7Å; E603-R607 IonicContact OE2-NE 2.93Å; E603-R607 IonicContact OE2-NH2 3.67Å; E603-R607 PolarHBondContact OE2-NH2 2.99Å; L605-R607 VanDerWaalsContact C-N 3.3Å; L605-R607 PolarHBondContact O-N 3.22Å
608	H	41.4	Very low	37.5	Very low	170 Å²	170	123.7 Å²	123.7	79%	0.787	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	-16.8	178.1	-85.6	-78.9	0	0	0	114.7	L605 T606	L605-H608 PolarHBondContact O-N 3.35Å; T606-H608 VanDerWaalsContact C-N 3.31Å; T606-H608 PolarHBondContact O-N 2.91Å
609	T	38.9	Very low	37.3	Very low	94 Å²	94	123.9 Å²	123.9	58%	0.577	65%	0.654	S	S	*	*	S	Bend	trans	-91.2	-5.3	-173.8	48.4	0	0	0	0	115.1	T606 N611	T606-T609 PolarHBondContact O-OG1 3.38Å; T609-N611 VanDerWaalsContact C-N 3.32Å; T609-N611 PolarHBondContact O-N 2.91Å
610	T	34.5	Very low	37.8	Very low	115 Å²	115	127.8 Å²	127.8	71%	0.706	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	4.3	-172.8	48.5	0	0	0	0	115.7
611	N	34.7	Very low	37.2	Very low	146 Å²	146	131 Å²	131	78%	0.781	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.9	-2.1	-166.1	-131.3	5.1	0	0	0	116.2	T609	T609-N611 VanDerWaalsContact C-N 3.32Å; T609-N611 PolarHBondContact O-N 2.91Å
612	L	36	Very low	36.6	Very low	152 Å²	152	125.7 Å²	125.7	80%	0.796	66%	0.655	S	S	*	*			trans	-139.5	127.1	166.8	-83.4	100.1	0	0	0	111.2	A614	L612-A614 PolarHBondContact O-N 2.91Å; L612-A614 VanDerWaalsContact O-N 3.08Å
613	G	26.9	Very low	36.6	Very low	95 Å²	95	127.8 Å²	127.8	98%	0.979	66%	0.663	S	S	*	*			trans	-76.6	87	169.8	0	0	0	0	0	111.2
614	A	33.8	Very low	36.5	Very low	70 Å²	70	130.6 Å²	130.6	58%	0.579	68%	0.676	S	S	*	*			trans	-136.3	135.4	169.4	0	0	0	0	0	109.8	L612 I616	L612-A614 PolarHBondContact O-N 2.91Å; L612-A614 VanDerWaalsContact O-N 3.08Å; A614-I616 PolarHBondContact O-N 3.15Å
615	K	31.3	Very low	36.2	Very low	197 Å²	197	130.3 Å²	130.3	86%	0.857	68%	0.679	S	S	*	*			trans	-76.5	103.2	178.1	-171.9	-176	179	-169.7	0	108.7
616	I	32.1	Very low	36.5	Very low	120 Å²	120	128.2 Å²	128.2	62%	0.615	67%	0.668	S	S	*	*			trans	-96.1	118.2	177.1	-60.1	176.3	0	0	0	108.6	A614 M618	A614-I616 PolarHBondContact O-N 3.15Å; I616-M618 PolarHBondContact O-N 2.87Å
617	D	33.9	Very low	36.7	Very low	108 Å²	108	126.3 Å²	126.3	58%	0.578	66%	0.655	S	S	*	*			trans	-69.9	116.6	168.8	-67.5	-36.9	0	0	0	109.5	D619	D617-D619 PolarHBondContact O-N 3.06Å
618	M	32	Very low	37	Very low	133 Å²	133	121.9 Å²	121.9	66%	0.655	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-68.1	-24.8	-178.4	-71.7	-73.1	-71.9	0	0	112.9	I616 K620 Y621	I616-M618 PolarHBondContact O-N 2.87Å; M618-K620 PolarHBondContact O-N 3.23Å; M618-Y621 PolarHBondContact O-N 2.89Å
619	D	35.1	Very low	36.9	Very low	130 Å²	130	116.9 Å²	116.9	70%	0.695	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-64	-11.8	-175.2	-61.1	-30.3	0	0	0	114.3	D617	D617-D619 PolarHBondContact O-N 3.06Å
620	K	48.8	Very low	37	Very low	188 Å²	188	115 Å²	115	82%	0.817	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-98.4	-2.2	-177.7	-119	174.3	-175.3	171.5	0	115.5	M618	M618-K620 PolarHBondContact O-N 3.23Å
621	Y	33.3	Very low	37.5	Very low	202 Å²	202	115.8 Å²	115.8	79%	0.792	60%	0.603	S	S	*	*	S	Bend	trans	-117.9	14.3	-177.7	-92.5	-81.9	0	0	0	114.2	M618	M618-Y621 PolarHBondContact O-N 2.89Å
622	L	33.6	Very low	38.2	Very low	50 Å²	50	115.5 Å²	115.5	26%	0.262	60%	0.595	S	S	.	*			trans	-124.5	113.2	177.3	-74.5	158.8	0	0	0	110.2	N626 L627 L630	L622-N626 HydrophobicContact CD2-CB 3.84Å; L622-L627 HydrophobicContact CB-CB 4.13Å; L622-L627 HydrophobicContact CB-CD1 4.15Å; L622-L627 HydrophobicContact CB-CG 3.85Å; L622-L627 HydrophobicContact CD1-CG 4.44Å; L622-L630 HydrophobicContact CD1-CD1 3.5Å; L622-L630 VanDerWaalsContact CD1-CD1 3.5Å; L622-L630 HydrophobicContact CD2-CD1 3.6Å; L622-L630 HydrophobicContact CG-CD1 4.2Å
623	D	38.2	Very low	38.3	Very low	92 Å²	92	111.7 Å²	111.7	49%	0.492	58%	0.575	S	S	.	*			trans	-63.2	145.2	166.5	52.8	-55.5	0	0	0	110.6	N625 N626 L627	D623-N625 PolarHBondContact O-N 3.35Å; D623-N626 VanDerWaalsContact CG-ND2 3.33Å; D623-N626 CarbonylContact O-C 3.56Å; D623-N626 WeakPolarHBondContact O-CA 3.32Å; D623-N626 PolarHBondContact O-N 2.94Å; D623-N626 PolarHBondContact OD1-ND2 2.95Å; D623-N626 PolarHBondContact OD2-ND2 3.49Å; D623-N626 VanDerWaalsContact OD2-ND2 3.16Å; D623-L627 PolarHBondContact O-N 3.12Å
624	E	39.7	Very low	38.7	Very low	160 Å²	160	114.5 Å²	114.5	75%	0.748	56%	0.557	S	S	*	*	H	α-helix	trans	-55.4	-26.5	-166.4	-71.3	-172.3	111.8	0	0	114.9	N628	E624-N628 VanDerWaalsContact O-CB 3.29Å; E624-N628 WeakPolarHBondContact O-CB 3.35Å; E624-N628 PolarHBondContact O-N 3.13Å; E624-N628 PolarHBondContact O-ND2 2.8Å
625	N	38.9	Very low	38.9	Very low	132 Å²	132	115.9 Å²	115.9	71%	0.706	55%	0.551	S	S	*	*	H	α-helix	trans	-72	-40.9	174.1	-71.9	-42.9	0	0	0	112.2	D623 C629	D623-N625 PolarHBondContact O-N 3.35Å; N625-C629 VanDerWaalsContact O-CB 3.23Å; N625-C629 WeakPolarHBondContact O-CB 3.27Å; N625-C629 PolarHBondContact O-N 2.98Å
626	N	45	Very low	39.3	Very low	80 Å²	80	110.4 Å²	110.4	43%	0.428	54%	0.535	S	S	.	.	H	α-helix	trans	-73.4	-30.2	171.8	-75.1	-43.9	0	0	0	112	L622 D623 C629 L630	L622-N626 HydrophobicContact CD2-CB 3.84Å; D623-N626 VanDerWaalsContact CG-ND2 3.33Å; D623-N626 CarbonylContact O-C 3.56Å; D623-N626 WeakPolarHBondContact O-CA 3.32Å; D623-N626 PolarHBondContact O-N 2.94Å; D623-N626 PolarHBondContact OD1-ND2 2.95Å; D623-N626 PolarHBondContact OD2-ND2 3.49Å; D623-N626 VanDerWaalsContact OD2-ND2 3.16Å; N626-C629 PolarHBondContact O-N 3.09Å; N626-L630 WeakPolarHBondContact O-CB 3.24Å; N626-L630 PolarHBondContact O-N 3.25Å
627	L	45	Very low	39.6	Very low	48 Å²	48	110.5 Å²	110.5	25%	0.251	53%	0.532	S	S	.	.	H	α-helix	trans	-70.3	-39	173.2	-133	171.1	0	0	0	111.5	L622 D623 R631	L622-L627 HydrophobicContact CB-CB 4.13Å; L622-L627 HydrophobicContact CB-CD1 4.15Å; L622-L627 HydrophobicContact CB-CG 3.85Å; L622-L627 HydrophobicContact CD1-CG 4.44Å; D623-L627 PolarHBondContact O-N 3.12Å; L627-R631 VanDerWaalsContact O-CB 3.23Å; L627-R631 WeakPolarHBondContact O-CB 3.45Å; L627-R631 PolarHBondContact O-N 3.01Å
628	N	44.6	Very low	39.7	Very low	77 Å²	77	110.1 Å²	110.1	41%	0.412	53%	0.53	S	S	.	.	H	α-helix	trans	-71.3	-30.4	168.5	-86.8	-43.1	0	0	0	112.9	E624 K632	E624-N628 VanDerWaalsContact O-CB 3.29Å; E624-N628 WeakPolarHBondContact O-CB 3.35Å; E624-N628 PolarHBondContact O-N 3.13Å; E624-N628 PolarHBondContact O-ND2 2.8Å; N628-K632 VanDerWaalsContact O-CB 3.29Å; N628-K632 WeakPolarHBondContact O-CB 3.38Å; N628-K632 WeakPolarHBondContact O-CG 3.42Å; N628-K632 PolarHBondContact O-N 3.12Å
629	C	39	Very low	39.9	Very low	65 Å²	65	108.5 Å²	108.5	44%	0.439	52%	0.524	S	S	.	.	H	α-helix	trans	-68.3	-43.6	173.4	-166.2	0	0	0	0	110.8	N625 N626 K632 L633	N625-C629 VanDerWaalsContact O-CB 3.23Å; N625-C629 WeakPolarHBondContact O-CB 3.27Å; N625-C629 PolarHBondContact O-N 2.98Å; N626-C629 PolarHBondContact O-N 3.09Å; C629-K632 PolarHBondContact O-N 3.38Å; C629-L633 WeakPolarHBondContact O-CB 3.26Å; C629-L633 VanDerWaalsContact O-CG 3.27Å; C629-L633 WeakPolarHBondContact O-CG 3.41Å; C629-L633 PolarHBondContact O-N 3.18Å
630	L	41.1	Very low	39.8	Very low	55 Å²	55	109.8 Å²	109.8	29%	0.288	52%	0.52	S	S	.	.	H	α-helix	trans	-68.2	-39.5	172.4	-82	173.4	0	0	0	112.5	L622 N626 L633 Y634	L622-L630 HydrophobicContact CD1-CD1 3.5Å; L622-L630 VanDerWaalsContact CD1-CD1 3.5Å; L622-L630 HydrophobicContact CD2-CD1 3.6Å; L622-L630 HydrophobicContact CG-CD1 4.2Å; N626-L630 WeakPolarHBondContact O-CB 3.24Å; N626-L630 PolarHBondContact O-N 3.25Å; L630-L633 HydrophobicContact CD2-CD1 4.32Å; L630-L633 PolarHBondContact O-N 3.48Å; L630-Y634 WeakPolarHBondContact O-CB 3.38Å; L630-Y634 WeakPolarHBondContact O-CD2 3.33Å; L630-Y634 PolarHBondContact O-N 3.01Å
631	R	45.3	Very low	39.2	Very low	132 Å²	132	108.5 Å²	108.5	50%	0.498	52%	0.517	S	S	.	.	H	α-helix	trans	-61.7	-45.4	174.2	-169.2	-179.6	-63.6	151.2	2.1	110.8	L627 L633 Y634 E635	L627-R631 VanDerWaalsContact O-CB 3.23Å; L627-R631 WeakPolarHBondContact O-CB 3.45Å; L627-R631 PolarHBondContact O-N 3.01Å; R631-L633 VanDerWaalsContact C-N 3.35Å; R631-L633 PolarHBondContact O-N 3.34Å; R631-Y634 PolarHBondContact O-N 3.09Å; R631-E635 HydrophobicContact CG-CG 4.41Å; R631-E635 WeakPolarHBondContact CG-OE1 3.21Å; R631-E635 VanDerWaalsContact O-CB 3.27Å; R631-E635 WeakPolarHBondContact O-CB 3.09Å; R631-E635 WeakPolarHBondContact O-CG 3.2Å; R631-E635 PolarHBondContact O-N 3.49Å
632	K	48.1	Very low	39.2	Very low	140 Å²	140	102.8 Å²	102.8	61%	0.609	50%	0.5	S	S	*	.	H	α-helix	trans	-63	-37.4	171.5	-77.7	-176.8	175	-175.1	0	113	N628 C629 T636	N628-K632 VanDerWaalsContact O-CB 3.29Å; N628-K632 WeakPolarHBondContact O-CB 3.38Å; N628-K632 WeakPolarHBondContact O-CG 3.42Å; N628-K632 PolarHBondContact O-N 3.12Å; C629-K632 PolarHBondContact O-N 3.38Å; K632-T636 WeakPolarHBondContact O-CB 3.48Å; K632-T636 WeakPolarHBondContact O-CG2 3.44Å; K632-T636 PolarHBondContact O-N 3.16Å; K632-T636 PolarHBondContact O-OG1 2.93Å
633	L	38.3	Very low	39.2	Very low	71 Å²	71	105.1 Å²	105.1	37%	0.372	51%	0.51	S	S	.	.	H	α-helix	trans	-65.4	-45.5	176.1	-80.4	165	0	0	0	111.3	F598 C629 L630 R631 T636 H637	F598-L633 HydrophobicContact CE2-CD1 4.44Å; F598-L633 HydrophobicContact CZ-CD1 4.27Å; C629-L633 WeakPolarHBondContact O-CB 3.26Å; C629-L633 VanDerWaalsContact O-CG 3.27Å; C629-L633 WeakPolarHBondContact O-CG 3.41Å; C629-L633 PolarHBondContact O-N 3.18Å; L630-L633 HydrophobicContact CD2-CD1 4.32Å; L630-L633 PolarHBondContact O-N 3.48Å; R631-L633 VanDerWaalsContact C-N 3.35Å; R631-L633 PolarHBondContact O-N 3.34Å; L633-T636 WeakPolarHBondContact CA-OG1 3.44Å; L633-T636 CarbonylContact O-C 3.58Å; L633-T636 PolarHBondContact O-N 2.91Å; L633-T636 PolarHBondContact O-OG1 3.24Å; L633-H637 WeakPolarHBondContact O-CB 3.32Å; L633-H637 PolarHBondContact O-N 3.05Å
634	Y	35.6	Very low	38.8	Very low	155 Å²	155	108.1 Å²	108.1	61%	0.608	52%	0.524	S	S	*	.	H	α-helix	trans	-64.9	-44.9	173.9	-89.4	-80.3	0	0	0	112	L630 R631 T636 H637 D638	L630-Y634 WeakPolarHBondContact O-CB 3.38Å; L630-Y634 WeakPolarHBondContact O-CD2 3.33Å; L630-Y634 PolarHBondContact O-N 3.01Å; R631-Y634 PolarHBondContact O-N 3.09Å; Y634-T636 VanDerWaalsContact C-N 3.26Å; Y634-T636 PolarHBondContact O-N 3.42Å; Y634-H637 WeakPolarHBondContact O-CA 3.49Å; Y634-H637 WeakPolarHBondContact O-CB 3.42Å; Y634-H637 PolarHBondContact O-N 3Å; Y634-D638 PolarHBondContact O-N 3.15Å
635	E	38.3	Very low	38.4	Very low	98 Å²	98	105.7 Å²	105.7	46%	0.458	52%	0.521	S	S	.	.	H	α-helix	trans	-57.1	-38.4	171.4	-73.9	165	175.9	0	0	111.1	R631 N639	R631-E635 HydrophobicContact CG-CG 4.41Å; R631-E635 WeakPolarHBondContact CG-OE1 3.21Å; R631-E635 VanDerWaalsContact O-CB 3.27Å; R631-E635 WeakPolarHBondContact O-CB 3.09Å; R631-E635 WeakPolarHBondContact O-CG 3.2Å; R631-E635 PolarHBondContact O-N 3.49Å; E635-N639 VanDerWaalsContact O-CB 3.28Å; E635-N639 WeakPolarHBondContact O-CB 3.29Å; E635-N639 PolarHBondContact O-N 3.48Å; E635-N639 PolarHBondContact O-ND2 2.82Å
636	T	39	Very low	38	Very low	82 Å²	82	107 Å²	107	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-74.6	-27.2	172	55.8	0	0	0	0	113.6	K632 L633 Y634 Y640	K632-T636 WeakPolarHBondContact O-CB 3.48Å; K632-T636 WeakPolarHBondContact O-CG2 3.44Å; K632-T636 PolarHBondContact O-N 3.16Å; K632-T636 PolarHBondContact O-OG1 2.93Å; L633-T636 WeakPolarHBondContact CA-OG1 3.44Å; L633-T636 CarbonylContact O-C 3.58Å; L633-T636 PolarHBondContact O-N 2.91Å; L633-T636 PolarHBondContact O-OG1 3.24Å; Y634-T636 VanDerWaalsContact C-N 3.26Å; Y634-T636 PolarHBondContact O-N 3.42Å; T636-Y640 WeakPolarHBondContact O-CB 3.33Å; T636-Y640 PolarHBondContact O-N 3.07Å
637	H	38.9	Very low	37.4	Very low	123 Å²	123	110.2 Å²	110.2	57%	0.569	53%	0.532	S	S	*	.	H	α-helix	trans	-74.2	-47.4	179.5	-135.5	-78.7	0	0	0	110.9	L633 Y634 N639 Y640 E641	L633-H637 WeakPolarHBondContact O-CB 3.32Å; L633-H637 PolarHBondContact O-N 3.05Å; Y634-H637 WeakPolarHBondContact O-CA 3.49Å; Y634-H637 WeakPolarHBondContact O-CB 3.42Å; Y634-H637 PolarHBondContact O-N 3Å; H637-N639 VanDerWaalsContact C-N 3.26Å; H637-N639 PolarHBondContact O-N 3.36Å; H637-Y640 PolarHBondContact O-N 3.49Å; H637-E641 PolarHBondContact O-N 2.96Å
638	D	35.5	Very low	36.5	Very low	99 Å²	99	115.7 Å²	115.7	53%	0.529	56%	0.558	S	S	.	*	H	α-helix	trans	-65.2	-31.6	175	-67.1	-26.6	0	0	0	111.2	Y634 N642	Y634-D638 PolarHBondContact O-N 3.15Å; D638-N642 WeakPolarHBondContact O-CB 3.13Å; D638-N642 PolarHBondContact O-N 3.37Å; D638-N642 PolarHBondContact O-ND2 2.86Å
639	N	37.2	Very low	35.6	Very low	99 Å²	99	118.3 Å²	118.3	53%	0.529	57%	0.571	S	S	.	*	H	α-helix	trans	-77.1	-21.7	170.7	-78.8	-62	0	0	0	114	E635 H637 H643	E635-N639 VanDerWaalsContact O-CB 3.28Å; E635-N639 WeakPolarHBondContact O-CB 3.29Å; E635-N639 PolarHBondContact O-N 3.48Å; E635-N639 PolarHBondContact O-ND2 2.82Å; H637-N639 VanDerWaalsContact C-N 3.26Å; H637-N639 PolarHBondContact O-N 3.36Å; N639-H643 WeakPolarHBondContact O-CB 3.3Å; N639-H643 PolarHBondContact O-N 2.85Å
640	Y	32.3	Very low	35.1	Very low	157 Å²	157	121.3 Å²	121.3	62%	0.616	58%	0.578	S	S	*	*	H	α-helix	trans	-79.5	-35.6	177.2	-136.9	-92.1	0	0	0	112.7	L591 T636 H637 N642	L591-Y640 HydrophobicContact CD1-CE2 3.95Å; T636-Y640 WeakPolarHBondContact O-CB 3.33Å; T636-Y640 PolarHBondContact O-N 3.07Å; H637-Y640 PolarHBondContact O-N 3.49Å; Y640-N642 VanDerWaalsContact C-N 3.29Å; Y640-N642 PolarHBondContact O-N 3.39Å
641	E	35.5	Very low	34.4	Very low	162 Å²	162	123.7 Å²	123.7	76%	0.757	60%	0.6	S	S	*	*	H	α-helix	trans	-77	-12.5	172.3	-67.3	-158	138.1	0	0	113.4	H637	H637-E641 PolarHBondContact O-N 2.96Å
642	N	34.7	Very low	33.6	Very low	81 Å²	81	124.9 Å²	124.9	43%	0.433	62%	0.616	S	S	.	*	H	α-helix	trans	-98.5	-15.9	175.2	-80.9	-83.5	0	0	0	115.2	D638 Y640 I644	D638-N642 WeakPolarHBondContact O-CB 3.13Å; D638-N642 PolarHBondContact O-N 3.37Å; D638-N642 PolarHBondContact O-ND2 2.86Å; Y640-N642 VanDerWaalsContact C-N 3.29Å; Y640-N642 PolarHBondContact O-N 3.39Å; N642-I644 PolarHBondContact O-N 3.07Å
643	H	32.8	Very low	32.6	Very low	100 Å²	100	122.9 Å²	122.9	46%	0.463	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.1	-20.1	-174.3	-123.1	-83.1	0	0	0	115.2	N639 E647	N639-H643 WeakPolarHBondContact O-CB 3.3Å; N639-H643 PolarHBondContact O-N 2.85Å; H643-E647 IonicContact CE1-OE1 2.72Å; H643-E647 IonicContact CE1-OE2 3.79Å; H643-E647 PolarHBondContact CE1-OE2 2.93Å; H643-E647 IonicContact ND1-OE2 3.67Å; H643-E647 PolarHBondContact ND1-OE2 3.07Å; H643-E647 VanDerWaalsContact ND1-OE2 3.16Å
644	I	30.8	Very low	32.1	Very low	155 Å²	155	126.7 Å²	126.7	80%	0.795	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-7.4	-177	-66.3	177.6	0	0	0	112.5	N642	N642-I644 PolarHBondContact O-N 3.07Å
645	T	30.1	Very low	31.9	Very low	109 Å²	109	126 Å²	126	67%	0.669	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.2	5.4	-175.6	53.7	0	0	0	0	115.4
646	K	31.7	Very low	31.2	Very low	158 Å²	158	127.8 Å²	127.8	69%	0.687	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133	-11	178.1	-82.4	-179.4	179.3	166.6	0	117.4	M648	K646-M648 PolarHBondContact O-N 3.37Å; K646-M648 VanDerWaalsContact O-N 3.08Å
647	E	31.4	Very low	30.7	Very low	148 Å²	148	130.4 Å²	130.4	69%	0.692	69%	0.687	S	S	*	*	S	Bend	trans	-87	54.5	174.6	-71.2	-151.1	121.9	0	0	114	H643	H643-E647 IonicContact CE1-OE1 2.72Å; H643-E647 IonicContact CE1-OE2 3.79Å; H643-E647 PolarHBondContact CE1-OE2 2.93Å; H643-E647 IonicContact ND1-OE2 3.67Å; H643-E647 PolarHBondContact ND1-OE2 3.07Å; H643-E647 VanDerWaalsContact ND1-OE2 3.16Å
648	M	25.4	Very low	30	Very low	163 Å²	163	130.4 Å²	130.4	80%	0.803	70%	0.695	S	S	*	*	S	Bend	trans	-154.6	131.9	151	-118.5	173.7	-78.6	0	0	107.7	K646	K646-M648 PolarHBondContact O-N 3.37Å; K646-M648 VanDerWaalsContact O-N 3.08Å
649	I	26.9	Very low	29.5	Very low	133 Å²	133	133 Å²	133	68%	0.682	71%	0.708	S	S	*	*	S	Bend	trans	70.2	88.1	-161.2	-42.9	163.6	0	0	0	111.9
650	H	28.2	Very low	28.9	Very low	127 Å²	127	133.8 Å²	133.8	59%	0.588	72%	0.716	S	S	*	*				179.5	38.9	128.9	-90.1	107.6	0	0	0	114.5	N759	H650-N759 PolarHBondContact CD2-ND2 3.04Å; H650-N759 WeakPolarHBondContact NE2-CB 3.22Å
651	S	27.3	Very low	28.8	Very low	106 Å²	106	132 Å²	132	74%	0.741	72%	0.722	S	S	*	*	S	Bend	trans	-153	130.9	160.5	48.9	0	0	0	0	107.8
652	N	27.9	Very low	28.3	Very low	157 Å²	157	131.4 Å²	131.4	84%	0.84	72%	0.724	S	S	*	*			cis	-121.6	142.1	6	-64.2	-49.7	0	0	0	112.4
653	S	27.1	Very low	28.1	Very low	97 Å²	97	134.5 Å²	134.5	68%	0.678	75%	0.745	S	S	*	*			trans	-130	144.8	150.9	58.3	0	0	0	0	107.9
654	N	28.3	Very low	27.8	Very low	151 Å²	151	135.9 Å²	135.9	81%	0.807	76%	0.756	S	S	*	*			trans	66.4	123.3	-166.4	-40.2	-44.9	0	0	0	112.1
655	T	30.3	Very low	27.6	Very low	140 Å²	140	136.2 Å²	136.2	86%	0.859	76%	0.759	S	S	*	*			cis	-134.5	150.8	26.6	44.2	0	0	0	0	114.3
656	T	24.6	Very low	27.6	Very low	137 Å²	137	135.2 Å²	135.2	84%	0.84	76%	0.757	S	S	*	*			trans	-68.3	134.5	175.7	-6.7	0	0	0	0	113
657	T	28.2	Very low	27.4	Very low	137 Å²	137	132.5 Å²	132.5	84%	0.84	76%	0.758	S	S	*	*			trans	-164.9	150.2	131.9	-76.2	0	0	0	0	109.5
658	T	23.9	Very low	27.3	Very low	122 Å²	122	131.4 Å²	131.4	75%	0.748	76%	0.755	S	S	*	*			trans	-74.4	175.2	-165.1	40.4	0	0	0	0	116.6
659	I	25.8	Very low	27.5	Very low	154 Å²	154	129.8 Å²	129.8	79%	0.79	75%	0.75	S	S	*	*			trans	104	82	166.1	-51.7	173.6	0	0	0	115.4
660	T	24.6	Very low	27.7	Very low	116 Å²	116	127.2 Å²	127.2	71%	0.712	74%	0.744	S	S	*	*			trans	-9.3	132.6	143.6	53	0	0	0	0	118.7
661	T	28.4	Very low	27.9	Very low	119 Å²	119	127.7 Å²	127.7	73%	0.73	75%	0.751	S	S	*	*				-171.2	142.4	95	31.2	0	0	0	0	113.6
662	N	25.6	Very low	28	Very low	149 Å²	149	129.5 Å²	129.5	80%	0.797	74%	0.743	S	S	*	*			trans	-3.4	119.6	166.5	-58	-6.9	0	0	0	120.5
663	V	30.9	Very low	28.4	Very low	146 Å²	146	127.5 Å²	127.5	89%	0.885	73%	0.728	S	S	*	*			trans	-122	145.7	139.2	179.9	0	0	0	0	107.2
664	N	27	Very low	28.7	Very low	129 Å²	129	127.3 Å²	127.3	69%	0.69	72%	0.719	S	S	*	*			trans	-83	139.3	-152.9	-66	-47.3	0	0	0	116.2	S666	N664-S666 PolarHBondContact O-N 3.39Å
665	N	25.8	Very low	29	Very low	162 Å²	162	123.9 Å²	123.9	87%	0.866	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	79.5	171	-80	-27.8	0	0	0	112.1
666	S	29.5	Very low	29.2	Very low	89 Å²	89	119.8 Å²	119.8	62%	0.622	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125	-23.4	171.7	50.3	0	0	0	0	114.2	N664 I668	N664-S666 PolarHBondContact O-N 3.39Å; S666-I668 PolarHBondContact O-N 2.79Å
667	S	29	Very low	29.8	Very low	101 Å²	101	117.9 Å²	117.9	71%	0.706	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	0.3	-168.3	-44.1	0	0	0	0	115.7
668	I	29.5	Very low	30.1	Very low	124 Å²	124	114.3 Å²	114.3	64%	0.636	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	-16.1	-174.6	-64.6	173.5	0	0	0	112	S666 S670	S666-I668 PolarHBondContact O-N 2.79Å; I668-S670 PolarHBondContact O-N 3.47Å
669	N	28.6	Very low	30.7	Very low	129 Å²	129	114.5 Å²	114.5	69%	0.69	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-83.7	-9.9	-173.3	-123.1	6.7	0	0	0	114.5
670	S	30.7	Very low	31.5	Very low	80 Å²	80	115.1 Å²	115.1	56%	0.559	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-68.3	-35.7	-180	41.1	0	0	0	0	113.2	I668 Y672	I668-S670 PolarHBondContact O-N 3.47Å; S670-Y672 PolarHBondContact O-N 3.43Å
671	N	32.9	Very low	32	Very low	137 Å²	137	114.7 Å²	114.7	73%	0.733	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-76.4	-5.9	-174.9	-69.8	-4	0	0	0	114.2
672	Y	29.4	Very low	32.3	Very low	144 Å²	144	113 Å²	113	57%	0.565	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-83.2	-10.6	178.1	-84.2	-72.3	0	0	0	114.4	S670 N674	S670-Y672 PolarHBondContact O-N 3.43Å; Y672-N674 PolarHBondContact O-N 3.3Å
673	H	35.6	Very low	32.8	Very low	115 Å²	115	108.8 Å²	108.8	53%	0.532	58%	0.576	S	S	.	*	G	3₁₀ helix	trans	-75.1	-24.3	-174.5	-127.9	-83.5	0	0	0	114.1	L675 S676	H673-L675 PolarHBondContact O-N 3.02Å; H673-S676 WeakPolarHBondContact O-CB 3.23Å; H673-S676 PolarHBondContact O-N 3.22Å
674	N	33.5	Very low	33.1	Very low	92 Å²	92	111.2 Å²	111.2	49%	0.492	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-75.9	-1	-176.9	-69.5	20.1	0	0	0	114.2	Y672 W677	Y672-N674 PolarHBondContact O-N 3.3Å; N674-W677 PolarHBondContact O-NE1 2.9Å
675	L	35	Very low	33.5	Very low	79 Å²	79	110.5 Å²	110.5	41%	0.414	57%	0.574	S	S	.	*	G	3₁₀ helix	trans	-100.9	15.7	174.6	-58.9	173.7	0	0	0	112.7	H673 W677 I678 N679	H673-L675 PolarHBondContact O-N 3.02Å; L675-W677 VanDerWaalsContact C-N 3.35Å; L675-W677 PolarHBondContact O-N 3.47Å; L675-I678 HydrophobicContact CD2-CD1 3.85Å; L675-I678 PolarHBondContact O-N 2.59Å; L675-N679 PolarHBondContact O-ND2 3.39Å
676	S	34.7	Very low	34	Very low	54 Å²	54	109 Å²	109	38%	0.378	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.5	-41	-179.7	-176.8	0	0	0	0	113.3	H673 I678 N679	H673-S676 WeakPolarHBondContact O-CB 3.23Å; H673-S676 PolarHBondContact O-N 3.22Å; S676-I678 PolarHBondContact O-N 3.22Å; S676-N679 PolarHBondContact O-N 2.82Å
677	W	38	Very low	34.2	Very low	98 Å²	98	109.6 Å²	109.6	37%	0.371	56%	0.559	S	S	.	*	G	3₁₀ helix	trans	-65.5	-35.6	-176.7	62.1	-88.3	0	0	0	113.5	N674 L675 N679 K680 E681	N674-W677 PolarHBondContact O-NE1 2.9Å; L675-W677 VanDerWaalsContact C-N 3.35Å; L675-W677 PolarHBondContact O-N 3.47Å; W677-N679 PolarHBondContact O-N 3.47Å; W677-N679 VanDerWaalsContact O-N 3.12Å; W677-K680 WeakPolarHBondContact O-CA 3.43Å; W677-K680 WeakPolarHBondContact O-CB 3.32Å; W677-K680 PolarHBondContact O-N 2.82Å; W677-E681 PolarHBondContact O-N 3.24Å
678	I	34.7	Very low	34.3	Very low	61 Å²	61	110 Å²	110	31%	0.313	55%	0.553	S	S	.	*	G	3₁₀ helix	trans	-61.9	-23.5	178.7	-56.3	-177.1	0	0	0	112.2	L675 S676	L675-I678 HydrophobicContact CD2-CD1 3.85Å; L675-I678 PolarHBondContact O-N 2.59Å; S676-I678 PolarHBondContact O-N 3.22Å
679	N	35	Very low	34.4	Very low	126 Å²	126	111.9 Å²	111.9	67%	0.674	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-91.4	3.2	174.9	-63	-72.2	0	0	0	113.4	L675 S676 W677	L675-N679 PolarHBondContact O-ND2 3.39Å; S676-N679 PolarHBondContact O-N 2.82Å; W677-N679 PolarHBondContact O-N 3.47Å; W677-N679 VanDerWaalsContact O-N 3.12Å
680	K	44.1	Very low	34.6	Very low	168 Å²	168	110 Å²	110	73%	0.73	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	-15.3	-169.5	-150	-179.8	-178.7	-170.5	0	114	W677	W677-K680 WeakPolarHBondContact O-CA 3.43Å; W677-K680 WeakPolarHBondContact O-CB 3.32Å; W677-K680 PolarHBondContact O-N 2.82Å
681	E	34.9	Very low	34.6	Very low	106 Å²	106	109.7 Å²	109.7	50%	0.495	54%	0.538	S	S	.	.			trans	-101.2	20.2	177.4	-64.8	-174.8	125.8	0	0	113.6	W677 N683	W677-E681 PolarHBondContact O-N 3.24Å; E681-N683 PolarHBondContact O-N 2.83Å
682	I	33	Very low	34.6	Very low	83 Å²	83	109.9 Å²	109.9	43%	0.426	53%	0.534	S	S	.	.			trans	-80.1	103.2	166.5	-58.1	177.9	0	0	0	107.4
683	N	37.1	Very low	34.9	Very low	61 Å²	61	104.9 Å²	104.9	33%	0.326	52%	0.517	S	S	.	.			trans	-73.3	169.6	171.5	71.7	13	0	0	0	111.4	E681 N685 N686 E687	E681-N683 PolarHBondContact O-N 2.83Å; N683-N685 PolarHBondContact O-N 2.81Å; N683-N685 WeakPolarHBondContact OD1-CA 3.18Å; N683-N685 WeakPolarHBondContact OD1-CB 3.42Å; N683-N685 PolarHBondContact OD1-N 3.21Å; N683-N685 VanDerWaalsContact OD1-N 3.11Å; N683-N686 PolarHBondContact O-N 3.4Å; N683-N686 VanDerWaalsContact O-N 3.09Å; N683-N686 PolarHBondContact OD1-N 2.87Å; N683-N686 VanDerWaalsContact OD1-N 3.15Å; N683-E687 PolarHBondContact OD1-N 3.36Å
684	E	37.7	Very low	35	Very low	198 Å²	198	99.8 Å²	99.8	93%	0.925	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-13.7	-178	-59.2	-175	166.2	0	0	113.5
685	N	35.6	Very low	35	Very low	114 Å²	114	100.7 Å²	100.7	61%	0.61	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-4.8	178.7	-61.4	-13.3	0	0	0	114.2	N683 E687	N683-N685 PolarHBondContact O-N 2.81Å; N683-N685 WeakPolarHBondContact OD1-CA 3.18Å; N683-N685 WeakPolarHBondContact OD1-CB 3.42Å; N683-N685 PolarHBondContact OD1-N 3.21Å; N683-N685 VanDerWaalsContact OD1-N 3.11Å; N685-E687 HydrophobicContact CB-CB 4.48Å; N685-E687 HydrophobicContact CB-CG 3.92Å; N685-E687 PolarHBondContact ND2-OE2 3.48Å; N685-E687 PolarHBondContact O-N 3.4Å
686	N	36.6	Very low	34.9	Very low	131 Å²	131	99.3 Å²	99.3	70%	0.701	49%	0.492	S	S	*	.			trans	60.6	20.4	-166	-65.9	-71.6	0	0	0	115.2	N683 L688	N683-N686 PolarHBondContact O-N 3.4Å; N683-N686 VanDerWaalsContact O-N 3.09Å; N683-N686 PolarHBondContact OD1-N 2.87Å; N683-N686 VanDerWaalsContact OD1-N 3.15Å; N686-L688 PolarHBondContact O-N 2.65Å
687	E	31.9	Very low	34.9	Very low	100 Å²	100	97.9 Å²	97.9	47%	0.467	48%	0.481	S	S	.	.			trans	-86.3	111.3	179.7	-66.2	176.5	129.5	0	0	111.3	N683 N685 F689	N683-E687 PolarHBondContact OD1-N 3.36Å; N685-E687 HydrophobicContact CB-CB 4.48Å; N685-E687 HydrophobicContact CB-CG 3.92Å; N685-E687 PolarHBondContact ND2-OE2 3.48Å; N685-E687 PolarHBondContact O-N 3.4Å; E687-F689 HydrophobicContact CB-CD2 4.3Å; E687-F689 HydrophobicContact CB-CE2 4.22Å; E687-F689 PolarHBondContact O-N 2.84Å
688	L	30.9	Very low	34.7	Very low	110 Å²	110	94.8 Å²	94.8	58%	0.576	47%	0.471	S	S	*	.			trans	-84.6	92.6	179.3	-118.1	166.9	0	0	0	110.5	N686 I690	N686-L688 PolarHBondContact O-N 2.65Å; L688-I690 HydrophobicContact CB-CG1 4.43Å; L688-I690 HydrophobicContact CD2-CD1 4.48Å; L688-I690 HydrophobicContact CD2-CG1 3.91Å; L688-I690 PolarHBondContact O-N 3.39Å
689	F	31.7	Very low	34.7	Very low	164 Å²	164	95.3 Å²	95.3	72%	0.719	48%	0.479	S	S	*	.			trans	-75.2	73	174.8	-89.9	-89.2	0	0	0	112	E687 N691	E687-F689 HydrophobicContact CB-CD2 4.3Å; E687-F689 HydrophobicContact CB-CE2 4.22Å; E687-F689 PolarHBondContact O-N 2.84Å; F689-N691 PolarHBondContact O-N 3.01Å
690	I	33	Very low	34.9	Very low	90 Å²	90	95.1 Å²	95.1	46%	0.462	48%	0.478	S	S	.	.			trans	-70.6	109.4	174.1	-55.6	176.2	0	0	0	108.7	L688 S694 F695	L688-I690 HydrophobicContact CB-CG1 4.43Å; L688-I690 HydrophobicContact CD2-CD1 4.48Å; L688-I690 HydrophobicContact CD2-CG1 3.91Å; L688-I690 PolarHBondContact O-N 3.39Å; I690-S694 WeakPolarHBondContact CG2-OG 3.44Å; I690-F695 HydrophobicContact CG2-CD2 4.02Å
691	N	31.8	Very low	34.5	Very low	73 Å²	73	93.1 Å²	93.1	39%	0.39	47%	0.471	S	S	.	.			trans	-73.2	154	174.4	69.1	63.7	0	0	0	111.8	F689 N693 S694 F695	F689-N691 PolarHBondContact O-N 3.01Å; N691-N693 PolarHBondContact O-N 3.47Å; N691-N693 VanDerWaalsContact O-N 3.09Å; N691-N693 PolarHBondContact OD1-N 3.43Å; N691-S694 PolarHBondContact N-OG 3.13Å; N691-S694 PolarHBondContact O-N 3.48Å; N691-S694 VanDerWaalsContact O-N 3.1Å; N691-S694 PolarHBondContact O-OG 2.97Å; N691-S694 PolarHBondContact OD1-N 2.76Å; N691-F695 PolarHBondContact O-N 3.31Å
692	E	32.1	Very low	34.5	Very low	141 Å²	141	93.6 Å²	93.6	66%	0.659	48%	0.477	S	S	*	.	H	α-helix	trans	-58.6	-29	-173	-61.6	-178	155.6	0	0	113.2	L292 F695	L292-E692 HydrophobicContact CD1-CB 4.48Å; L292-E692 HydrophobicContact CD1-CG 4.09Å; E692-F695 WeakPolarHBondContact O-CB 3.16Å
693	N	36.7	Very low	34.8	Very low	38 Å²	38	95.6 Å²	95.6	20%	0.203	49%	0.493	C	S	.	.	H	α-helix	trans	-77.6	-37.5	178.2	-59.1	-54.4	0	0	0	112.8	D197 N691 F695 S696 T697	D197-N693 WeakPolarHBondContact CB-ND2 3.47Å; D197-N693 VanDerWaalsContact CG-ND2 3.3Å; D197-N693 PolarHBondContact OD2-ND2 2.78Å; N691-N693 PolarHBondContact O-N 3.47Å; N691-N693 VanDerWaalsContact O-N 3.09Å; N691-N693 PolarHBondContact OD1-N 3.43Å; N693-F695 PolarHBondContact O-N 2.98Å; N693-S696 WeakPolarHBondContact O-CA 3.48Å; N693-S696 PolarHBondContact O-N 3.38Å; N693-S696 PolarHBondContact O-OG 2.96Å; N693-T697 PolarHBondContact O-N 3.16Å; N693-T697 PolarHBondContact O-OG1 2.74Å
694	S	37.7	Very low	34.6	Very low	9 Å²	9	99.9 Å²	99.9	6%	0.063	51%	0.509	C	S	.	.	H	α-helix	trans	-64.6	-22.9	176.7	67.1	0	0	0	0	111.9	I690 N691 L698	I690-S694 WeakPolarHBondContact CG2-OG 3.44Å; N691-S694 PolarHBondContact N-OG 3.13Å; N691-S694 PolarHBondContact O-N 3.48Å; N691-S694 VanDerWaalsContact O-N 3.1Å; N691-S694 PolarHBondContact O-OG 2.97Å; N691-S694 PolarHBondContact OD1-N 2.76Å; S694-L698 WeakPolarHBondContact O-CD1 3.5Å; S694-L698 PolarHBondContact O-N 3.17Å
695	F	32.3	Very low	34.5	Very low	111 Å²	111	93 Å²	93	49%	0.487	48%	0.483	S	S	.	.	H	α-helix	trans	-68.1	-37.8	167.7	-138.6	-77.9	0	0	0	113	I690 N691 E692 N693 L698 C699	I690-F695 HydrophobicContact CG2-CD2 4.02Å; N691-F695 PolarHBondContact O-N 3.31Å; E692-F695 WeakPolarHBondContact O-CB 3.16Å; N693-F695 PolarHBondContact O-N 2.98Å; F695-L698 WeakPolarHBondContact O-CB 3.3Å; F695-L698 PolarHBondContact O-N 2.69Å; F695-C699 PolarHBondContact O-N 2.76Å; F695-C699 PolarHBondContact O-SG 3.17Å; F695-C699 VanDerWaalsContact O-SG 3.37Å
696	S	33.2	Very low	34.4	Very low	50 Å²	50	89.8 Å²	89.8	35%	0.35	47%	0.465	S	S	.	.	H	α-helix	trans	-71.5	-36.5	174.6	78.5	0	0	0	0	111.8	N693 L698 C699 N700	N693-S696 WeakPolarHBondContact O-CA 3.48Å; N693-S696 PolarHBondContact O-N 3.38Å; N693-S696 PolarHBondContact O-OG 2.96Å; S696-L698 VanDerWaalsContact C-N 3.31Å; S696-L698 PolarHBondContact O-N 2.77Å; S696-C699 PolarHBondContact O-N 3.16Å; S696-N700 PolarHBondContact O-N 3.38Å
697	T	35.6	Very low	34.5	Very low	24 Å²	24	86.6 Å²	86.6	15%	0.147	45%	0.453	C	S	.	.	H	α-helix	trans	-57.6	-41.8	168.9	-48.2	0	0	0	0	111.9	F183 N693	F183-T697 HydrophobicContact CE2-CG2 3.88Å; F183-T697 HydrophobicContact CZ-CG2 3.81Å; F183-T697 VanDerWaalsContact CZ-OG1 3.28Å; F183-T697 WeakPolarHBondContact CZ-OG1 3.34Å; N693-T697 PolarHBondContact O-N 3.16Å; N693-T697 PolarHBondContact O-OG1 2.74Å
698	L	33	Very low	35	Very low	33 Å²	33	83.8 Å²	83.8	17%	0.173	44%	0.443	C	S	.	.	H	α-helix	trans	-66.4	-37.9	174.6	-106.6	67.4	0	0	0	113	S694 F695 S696 I709	S694-L698 WeakPolarHBondContact O-CD1 3.5Å; S694-L698 PolarHBondContact O-N 3.17Å; F695-L698 WeakPolarHBondContact O-CB 3.3Å; F695-L698 PolarHBondContact O-N 2.69Å; S696-L698 VanDerWaalsContact C-N 3.31Å; S696-L698 PolarHBondContact O-N 2.77Å; L698-I709 HydrophobicContact CD2-CD1 3.87Å; L698-I709 HydrophobicContact CG-CD1 4.03Å
699	C	34.2	Very low	35.7	Very low	71 Å²	71	80.9 Å²	80.9	48%	0.48	43%	0.427	S	S	.	.	H	α-helix	trans	-74.6	-31.3	-179.9	-74.1	0	0	0	0	113.6	F695 S696 H701	F695-C699 PolarHBondContact O-N 2.76Å; F695-C699 PolarHBondContact O-SG 3.17Å; F695-C699 VanDerWaalsContact O-SG 3.37Å; S696-C699 PolarHBondContact O-N 3.16Å; C699-H701 VanDerWaalsContact C-N 3.34Å
700	N	39.1	Very low	36	Very low	122 Å²	122	77.7 Å²	77.7	65%	0.652	42%	0.418	S	S	*	.	H	α-helix	trans	-72.3	-25.7	178.6	-74.1	-11.2	0	0	0	113	S696 N702	S696-N700 PolarHBondContact O-N 3.38Å; N700-N702 PolarHBondContact O-N 2.94Å
701	H	36.4	Very low	36.8	Very low	127 Å²	127	79.2 Å²	79.2	59%	0.588	42%	0.423	S	S	*	.	S	Bend	trans	-92.5	97.7	172.8	-84.2	-69.4	0	0	0	111.8	C699 C705	C699-H701 VanDerWaalsContact C-N 3.34Å; H701-C705 WeakPolarHBondContact O-CB 3.3Å
702	N	34.8	Very low	37.2	Very low	116 Å²	116	82.9 Å²	82.9	62%	0.62	43%	0.431	S	S	*	.			trans	33.6	123.9	161.2	-80.3	-23.8	0	0	0	117.4	N700 F704 C705	N700-N702 PolarHBondContact O-N 2.94Å; N702-F704 CarbonylContact O-C 3.52Å; N702-F704 PolarHBondContact O-N 3.01Å; N702-C705 WeakPolarHBondContact O-CB 3.35Å; N702-C705 PolarHBondContact O-N 3.17Å
703	T	38.7	Very low	38	Very low	124 Å²	124	80.1 Å²	80.1	76%	0.761	42%	0.42	S	S	*	.	H	α-helix	trans	-46.6	-23.9	176.2	12.9	0	0	0	0	115.8	S707	T703-S707 PolarHBondContact O-N 3.42Å; T703-S707 VanDerWaalsContact O-N 3.17Å
704	F	34.8	Very low	38.3	Very low	151 Å²	151	80.8 Å²	80.8	66%	0.662	43%	0.428	S	S	*	.	H	α-helix	trans	-57.6	-44.1	169.7	-150.4	-90.2	0	0	0	113.3	N702 S707 T708	N702-F704 CarbonylContact O-C 3.52Å; N702-F704 PolarHBondContact O-N 3.01Å; F704-S707 PolarHBondContact O-N 3.35Å; F704-S707 VanDerWaalsContact O-N 3.16Å; F704-S707 PolarHBondContact O-OG 3.18Å; F704-T708 PolarHBondContact O-N 3.45Å; F704-T708 PolarHBondContact O-OG1 2.89Å
705	C	34.9	Very low	38.8	Very low	54 Å²	54	84.5 Å²	84.5	37%	0.365	45%	0.447	S	S	.	.	H	α-helix	trans	-61.1	-46.8	178.7	-70.1	0	0	0	0	111.8	H701 N702 S707 T708 I709	H701-C705 WeakPolarHBondContact O-CB 3.3Å; N702-C705 WeakPolarHBondContact O-CB 3.35Å; N702-C705 PolarHBondContact O-N 3.17Å; C705-S707 VanDerWaalsContact C-N 3.29Å; C705-S707 PolarHBondContact O-N 3.01Å; C705-T708 PolarHBondContact O-N 3.15Å; C705-I709 WeakPolarHBondContact O-CB 3.4Å; C705-I709 VanDerWaalsContact O-CG1 3.26Å; C705-I709 WeakPolarHBondContact O-CG1 3.19Å; C705-I709 PolarHBondContact O-N 2.98Å
706	L	34.2	Very low	39.5	Very low	47 Å²	47	85 Å²	85	25%	0.246	45%	0.449	C	S	.	.	H	α-helix	trans	-60.3	-37.3	174.6	-86.5	161.7	0	0	0	112.2	N710	L706-N710 VanDerWaalsContact O-CB 3.31Å; L706-N710 WeakPolarHBondContact O-CB 3.47Å; L706-N710 VanDerWaalsContact O-CG 3.28Å; L706-N710 PolarHBondContact O-N 3.01Å; L706-N710 PolarHBondContact O-ND2 3.09Å
707	S	38.1	Very low	40.2	Very low	63 Å²	63	87.6 Å²	87.6	44%	0.441	46%	0.455	S	S	.	.	H	α-helix	trans	-66.9	-42.6	174.1	74.9	0	0	0	0	112.7	T703 F704 C705 N710 E711	T703-S707 PolarHBondContact O-N 3.42Å; T703-S707 VanDerWaalsContact O-N 3.17Å; F704-S707 PolarHBondContact O-N 3.35Å; F704-S707 VanDerWaalsContact O-N 3.16Å; F704-S707 PolarHBondContact O-OG 3.18Å; C705-S707 VanDerWaalsContact C-N 3.29Å; C705-S707 PolarHBondContact O-N 3.01Å; S707-N710 PolarHBondContact O-N 2.91Å; S707-E711 VanDerWaalsContact O-CB 3.27Å; S707-E711 WeakPolarHBondContact O-CB 3.31Å; S707-E711 PolarHBondContact O-N 3.45Å
708	T	42.1	Very low	40.5	Very low	41 Å²	41	90.1 Å²	90.1	25%	0.252	47%	0.468	S	S	.	.	H	α-helix	trans	-71.3	-30.7	177.9	-42.4	0	0	0	0	112.3	F704 C705 R712	F704-T708 PolarHBondContact O-N 3.45Å; F704-T708 PolarHBondContact O-OG1 2.89Å; C705-T708 PolarHBondContact O-N 3.15Å; T708-R712 VanDerWaalsContact O-CB 3.27Å; T708-R712 WeakPolarHBondContact O-CB 3.31Å; T708-R712 VanDerWaalsContact O-CG 3.23Å; T708-R712 WeakPolarHBondContact O-CG 3.42Å; T708-R712 PolarHBondContact O-N 2.74Å
709	I	45.2	Very low	41	Very low	49 Å²	49	94.5 Å²	94.5	25%	0.251	49%	0.488	S	S	.	.	H	α-helix	trans	-71.2	-47.4	173.6	-71.6	168.6	0	0	0	109.8	L698 C705 E711 R712 I713	L698-I709 HydrophobicContact CD2-CD1 3.87Å; L698-I709 HydrophobicContact CG-CD1 4.03Å; C705-I709 WeakPolarHBondContact O-CB 3.4Å; C705-I709 VanDerWaalsContact O-CG1 3.26Å; C705-I709 WeakPolarHBondContact O-CG1 3.19Å; C705-I709 PolarHBondContact O-N 2.98Å; I709-E711 VanDerWaalsContact C-N 3.32Å; I709-E711 PolarHBondContact O-N 2.81Å; I709-R712 CarbonylContact O-C 3.57Å; I709-R712 PolarHBondContact O-N 2.86Å; I709-R712 VanDerWaalsContact O-N 3.14Å; I709-I713 HydrophobicContact CG2-CD1 3.71Å; I709-I713 HydrophobicContact CG2-CG1 4.33Å; I709-I713 WeakPolarHBondContact O-CB 3.44Å; I709-I713 VanDerWaalsContact O-CG1 3.31Å; I709-I713 WeakPolarHBondContact O-CG1 3.43Å; I709-I713 PolarHBondContact O-N 2.89Å
710	N	39	Very low	41.5	Very low	97 Å²	97	95.4 Å²	95.4	52%	0.519	49%	0.488	S	S	.	.	H	α-helix	trans	-63.5	-36.5	175	-73.9	-16.6	0	0	0	112.3	L706 S707 S714	L706-N710 VanDerWaalsContact O-CB 3.31Å; L706-N710 WeakPolarHBondContact O-CB 3.47Å; L706-N710 VanDerWaalsContact O-CG 3.28Å; L706-N710 PolarHBondContact O-N 3.01Å; L706-N710 PolarHBondContact O-ND2 3.09Å; S707-N710 PolarHBondContact O-N 2.91Å; N710-S714 WeakPolarHBondContact O-CB 3.49Å; N710-S714 PolarHBondContact O-N 3.3Å
711	E	48.3	Very low	41.6	Very low	123 Å²	123	94.5 Å²	94.5	58%	0.575	48%	0.481	S	S	*	.	H	α-helix	trans	-68.3	-36.1	173	-176.8	173.8	-145.7	0	0	111.9	S707 I709 N715	S707-E711 VanDerWaalsContact O-CB 3.27Å; S707-E711 WeakPolarHBondContact O-CB 3.31Å; S707-E711 PolarHBondContact O-N 3.45Å; I709-E711 VanDerWaalsContact C-N 3.32Å; I709-E711 PolarHBondContact O-N 2.81Å; E711-N715 WeakPolarHBondContact CG-ND2 3.45Å; E711-N715 WeakPolarHBondContact O-CB 3.42Å; E711-N715 VanDerWaalsContact O-CG 3.32Å; E711-N715 PolarHBondContact O-N 3.45Å; E711-N715 PolarHBondContact O-ND2 3.04Å
712	R	40.9	Very low	41.6	Very low	150 Å²	150	93 Å²	93	57%	0.566	48%	0.478	S	S	*	.	H	α-helix	trans	-75.5	-34.6	175.1	-78.1	175.4	175.8	-171.7	-1.2	113.4	T708 I709 K716	T708-R712 VanDerWaalsContact O-CB 3.27Å; T708-R712 WeakPolarHBondContact O-CB 3.31Å; T708-R712 VanDerWaalsContact O-CG 3.23Å; T708-R712 WeakPolarHBondContact O-CG 3.42Å; T708-R712 PolarHBondContact O-N 2.74Å; I709-R712 CarbonylContact O-C 3.57Å; I709-R712 PolarHBondContact O-N 2.86Å; I709-R712 VanDerWaalsContact O-N 3.14Å; R712-K716 WeakPolarHBondContact O-CB 3.43Å; R712-K716 PolarHBondContact O-N 2.89Å
713	I	48.9	Very low	41.9	Very low	82 Å²	82	94.7 Å²	94.7	42%	0.421	48%	0.482	S	S	.	.	H	α-helix	trans	-64.4	-54.3	170.2	-70.7	169.7	0	0	0	107.9	I709 N715 K716 E717	I709-I713 HydrophobicContact CG2-CD1 3.71Å; I709-I713 HydrophobicContact CG2-CG1 4.33Å; I709-I713 WeakPolarHBondContact O-CB 3.44Å; I709-I713 VanDerWaalsContact O-CG1 3.31Å; I709-I713 WeakPolarHBondContact O-CG1 3.43Å; I709-I713 PolarHBondContact O-N 2.89Å; I713-N715 VanDerWaalsContact C-N 3.28Å; I713-N715 PolarHBondContact O-N 3.41Å; I713-K716 CarbonylContact O-C 3.57Å; I713-K716 WeakPolarHBondContact O-CA 3.49Å; I713-K716 PolarHBondContact O-N 3.2Å; I713-E717 HydrophobicContact CG2-CG 4.18Å; I713-E717 WeakPolarHBondContact O-CB 3.49Å; I713-E717 WeakPolarHBondContact O-CG 3.43Å; I713-E717 PolarHBondContact O-N 2.94Å
714	S	42.2	Very low	41.7	Very low	53 Å²	53	92.5 Å²	92.5	37%	0.371	47%	0.468	S	S	.	.	H	α-helix	trans	-61	-33.9	178.5	-165.3	0	0	0	0	112.8	N710 N718	N710-S714 WeakPolarHBondContact O-CB 3.49Å; N710-S714 PolarHBondContact O-N 3.3Å; S714-N718 VanDerWaalsContact O-CB 3.23Å; S714-N718 WeakPolarHBondContact O-CB 3.35Å; S714-N718 PolarHBondContact O-N 2.99Å; S714-N718 PolarHBondContact O-ND2 3.41Å; S714-N718 PolarHBondContact OG-ND2 3.47Å
715	N	47.9	Very low	41.4	Very low	86 Å²	86	92.4 Å²	92.4	46%	0.46	47%	0.468	S	S	.	.	H	α-helix	trans	-74.4	-33	172.6	-80.6	-59.7	0	0	0	113.4	E711 I713 Q719	E711-N715 WeakPolarHBondContact CG-ND2 3.45Å; E711-N715 WeakPolarHBondContact O-CB 3.42Å; E711-N715 VanDerWaalsContact O-CG 3.32Å; E711-N715 PolarHBondContact O-N 3.45Å; E711-N715 PolarHBondContact O-ND2 3.04Å; I713-N715 VanDerWaalsContact C-N 3.28Å; I713-N715 PolarHBondContact O-N 3.41Å; N715-Q719 WeakPolarHBondContact O-CB 3.37Å; N715-Q719 WeakPolarHBondContact O-CG 3.4Å; N715-Q719 PolarHBondContact O-N 2.84Å
716	K	48.6	Very low	41.2	Very low	123 Å²	123	96.9 Å²	96.9	54%	0.535	49%	0.488	S	S	.	.	H	α-helix	trans	-69	-42.4	170	-91.8	-168.2	170.9	-172.7	0	111.5	R712 I713 Q719 L720	R712-K716 WeakPolarHBondContact O-CB 3.43Å; R712-K716 PolarHBondContact O-N 2.89Å; I713-K716 CarbonylContact O-C 3.57Å; I713-K716 WeakPolarHBondContact O-CA 3.49Å; I713-K716 PolarHBondContact O-N 3.2Å; K716-Q719 CarbonylContact O-C 3.6Å; K716-Q719 PolarHBondContact O-N 2.87Å; K716-L720 VanDerWaalsContact O-CD1 3.29Å; K716-L720 WeakPolarHBondContact O-CD1 3.28Å; K716-L720 PolarHBondContact O-N 2.96Å
717	E	47.5	Very low	40.7	Very low	103 Å²	103	101.7 Å²	101.7	48%	0.481	51%	0.507	S	S	.	.	H	α-helix	trans	-59.8	-48.1	172.1	-71.7	178.6	137.5	0	0	110.2	I713 Q719 L720 I721	I713-E717 HydrophobicContact CG2-CG 4.18Å; I713-E717 WeakPolarHBondContact O-CB 3.49Å; I713-E717 WeakPolarHBondContact O-CG 3.43Å; I713-E717 PolarHBondContact O-N 2.94Å; E717-Q719 VanDerWaalsContact C-N 3.28Å; E717-Q719 PolarHBondContact O-N 2.7Å; E717-L720 PolarHBondContact O-N 3.47Å; E717-I721 HydrophobicContact CB-CD1 4.31Å; E717-I721 WeakPolarHBondContact O-CB 3.27Å; E717-I721 WeakPolarHBondContact O-CD1 3.33Å; E717-I721 WeakPolarHBondContact O-CG1 3.43Å; E717-I721 PolarHBondContact O-N 2.93Å
718	N	41.3	Very low	40.1	Very low	78 Å²	78	103.8 Å²	103.8	42%	0.417	52%	0.517	S	S	.	.	H	α-helix	trans	-65.6	-27.2	175.5	-81.6	-68.6	0	0	0	113.1	S714 N722	S714-N718 VanDerWaalsContact O-CB 3.23Å; S714-N718 WeakPolarHBondContact O-CB 3.35Å; S714-N718 PolarHBondContact O-N 2.99Å; S714-N718 PolarHBondContact O-ND2 3.41Å; S714-N718 PolarHBondContact OG-ND2 3.47Å; N718-N722 WeakPolarHBondContact O-CB 3.16Å; N718-N722 PolarHBondContact O-N 3.27Å; N718-N722 PolarHBondContact O-ND2 3.15Å
719	Q	44.2	Very low	39.2	Very low	124 Å²	124	107.5 Å²	107.5	58%	0.579	53%	0.527	S	S	*	.	H	α-helix	trans	-73	-47	169.5	-79.1	-178	-1.1	0	0	111.7	N715 K716 E717 N722 Q723	N715-Q719 WeakPolarHBondContact O-CB 3.37Å; N715-Q719 WeakPolarHBondContact O-CG 3.4Å; N715-Q719 PolarHBondContact O-N 2.84Å; K716-Q719 CarbonylContact O-C 3.6Å; K716-Q719 PolarHBondContact O-N 2.87Å; E717-Q719 VanDerWaalsContact C-N 3.28Å; E717-Q719 PolarHBondContact O-N 2.7Å; Q719-N722 PolarHBondContact O-N 2.57Å; Q719-Q723 WeakPolarHBondContact O-CB 3.2Å; Q719-Q723 VanDerWaalsContact O-CG 3.31Å; Q719-Q723 WeakPolarHBondContact O-CG 3.33Å; Q719-Q723 PolarHBondContact O-N 2.89Å
720	L	44.6	Very low	38.3	Very low	91 Å²	91	112.2 Å²	112.2	48%	0.476	55%	0.552	S	S	.	*	H	α-helix	trans	-60.1	-50	175.1	-95.2	75.2	0	0	0	110.8	K716 E717 N722 Q723 T724	K716-L720 VanDerWaalsContact O-CD1 3.29Å; K716-L720 WeakPolarHBondContact O-CD1 3.28Å; K716-L720 PolarHBondContact O-N 2.96Å; E717-L720 PolarHBondContact O-N 3.47Å; L720-N722 PolarHBondContact O-N 3.06Å; L720-N722 VanDerWaalsContact O-N 3.16Å; L720-Q723 CarbonylContact O-C 3.47Å; L720-Q723 WeakPolarHBondContact O-CA 3.36Å; L720-Q723 PolarHBondContact O-N 3.45Å; L720-T724 PolarHBondContact O-N 3.34Å; L720-T724 PolarHBondContact O-OG1 3.04Å
721	I	40.4	Very low	37.7	Very low	102 Å²	102	113.9 Å²	113.9	52%	0.523	57%	0.566	S	S	.	*	H	α-helix	trans	-60.5	-25.4	178.4	-68.5	164.6	0	0	0	112.4	E717	E717-I721 HydrophobicContact CB-CD1 4.31Å; E717-I721 WeakPolarHBondContact O-CB 3.27Å; E717-I721 WeakPolarHBondContact O-CD1 3.33Å; E717-I721 WeakPolarHBondContact O-CG1 3.43Å; E717-I721 PolarHBondContact O-N 2.93Å
722	N	37.5	Very low	36.7	Very low	95 Å²	95	118 Å²	118	51%	0.508	58%	0.576	S	S	.	*	H	α-helix	trans	-88.1	-16.5	170.9	-80.3	-64.8	0	0	0	114.3	N718 Q719 L720 K725	N718-N722 WeakPolarHBondContact O-CB 3.16Å; N718-N722 PolarHBondContact O-N 3.27Å; N718-N722 PolarHBondContact O-ND2 3.15Å; Q719-N722 PolarHBondContact O-N 2.57Å; L720-N722 PolarHBondContact O-N 3.06Å; L720-N722 VanDerWaalsContact O-N 3.16Å; N722-K725 PolarHBondContact OD1-NZ 2.89Å
723	Q	40.4	Very low	36.1	Very low	153 Å²	153	116.3 Å²	116.3	72%	0.715	58%	0.578	S	S	*	*	H	α-helix	trans	-93.8	-30.2	174.4	-71.1	173	0.1	0	0	112.8	Q719 L720 K725	Q719-Q723 WeakPolarHBondContact O-CB 3.2Å; Q719-Q723 VanDerWaalsContact O-CG 3.31Å; Q719-Q723 WeakPolarHBondContact O-CG 3.33Å; Q719-Q723 PolarHBondContact O-N 2.89Å; L720-Q723 CarbonylContact O-C 3.47Å; L720-Q723 WeakPolarHBondContact O-CA 3.36Å; L720-Q723 PolarHBondContact O-N 3.45Å; Q723-K725 PolarHBondContact O-N 3.37Å
724	T	34.4	Very low	35.1	Very low	77 Å²	77	121.6 Å²	121.6	47%	0.472	60%	0.601	S	S	.	*			trans	-97.4	33.8	-178.7	62.3	0	0	0	0	112.9	L720 N726	L720-T724 PolarHBondContact O-N 3.34Å; L720-T724 PolarHBondContact O-OG1 3.04Å; T724-N726 PolarHBondContact O-N 3.37Å
725	K	29.6	Very low	34.6	Very low	149 Å²	149	128.1 Å²	128.1	65%	0.648	62%	0.623	S	S	*	*			trans	-70.3	54.9	166.6	-81.5	176.2	172.2	157.3	0	112.1	N722 Q723	N722-K725 PolarHBondContact OD1-NZ 2.89Å; Q723-K725 PolarHBondContact O-N 3.37Å
726	N	29.1	Very low	33.5	Very low	149 Å²	149	131 Å²	131	80%	0.797	64%	0.637	S	S	*	*	S	Bend	trans	-161.9	112.4	165	-96	-45.4	0	0	0	110.3	T724	T724-N726 PolarHBondContact O-N 3.37Å
727	K	25.3	Very low	32.5	Very low	147 Å²	147	130.6 Å²	130.6	64%	0.639	65%	0.647	S	S	*	*			trans	54.2	80.4	167.8	-62	-173.8	177.6	-175	0	117.5
728	V	25.5	Very low	31.4	Very low	107 Å²	107	133 Å²	133	65%	0.648	66%	0.663	S	S	*	*			trans	-110.2	125.2	146.8	176.1	0	0	0	0	108	L730	V728-L730 HydrophobicContact CG1-CB 4.34Å; V728-L730 HydrophobicContact CG1-CD1 3.95Å; V728-L730 HydrophobicContact CG1-CG 4.02Å
729	Y	23	Very low	30.7	Very low	120 Å²	120	135.4 Å²	135.4	47%	0.471	68%	0.681	S	S	.	*			trans	-100.6	106.1	170	-82.6	-98.3	0	0	0	108.8	V323 N324	V323-Y729 WeakPolarHBondContact CA-OH 3.35Å; V323-Y729 PolarHBondContact N-OH 2.95Å; N324-Y729 WeakPolarHBondContact OD1-CE1 3.42Å
730	L	24.7	Very low	29.8	Very low	147 Å²	147	134.5 Å²	134.5	77%	0.77	68%	0.684	S	S	*	*			trans	-139.8	83	173.6	-85	175.2	0	0	0	111.2	V728	V728-L730 HydrophobicContact CG1-CB 4.34Å; V728-L730 HydrophobicContact CG1-CD1 3.95Å; V728-L730 HydrophobicContact CG1-CG 4.02Å
731	T	27	Very low	28.9	Very low	132 Å²	132	137.1 Å²	137.1	81%	0.81	70%	0.698	S	S	*	*			trans	-95.8	113.6	159.5	47.4	0	0	0	0	106.9
732	R	27	Very low	28.2	Very low	209 Å²	209	136.3 Å²	136.3	79%	0.789	70%	0.698	S	S	*	*			cis	65.3	127.4	32.6	-125.5	-160	160.2	121.9	3.9	110.8
733	N	28.2	Very low	27.7	Very low	115 Å²	115	139 Å²	139	62%	0.615	71%	0.712	S	S	*	*			cis	-148.4	146.6	12.7	-55.3	-109.9	0	0	0	111.7
734	E	29.2	Very low	27.2	Very low	193 Å²	193	138.2 Å²	138.2	90%	0.902	71%	0.708	S	S	*	*			trans	-142.8	98.9	139.5	-67.3	-162.3	144.2	0	0	106.8
735	K	30.4	Very low	26.9	Very low	191 Å²	191	141.8 Å²	141.8	83%	0.83	72%	0.719	S	S	*	*				62.9	105.1	88.4	-81.4	-168	172.4	-177.6	0	115.1
736	L	25.4	Very low	26.7	Very low	145 Å²	145	138.7 Å²	138.7	76%	0.759	72%	0.715	S	S	*	*			trans	-64.9	158.7	167	-77.3	69.1	0	0	0	111.9	L738	L736-L738 HydrophobicContact CD2-CG 4.27Å
737	P	27.6	Very low	26.6	Very low	115 Å²	115	137.9 Å²	137.9	75%	0.747	71%	0.71	S	S	*	*			trans	-107	120.9	132.2	32.8	-27.3	0	0	0	111.2
738	L	24	Very low	26.8	Very low	153 Å²	153	137 Å²	137	80%	0.801	71%	0.712	S	S	*	*			trans	-82.2	108.4	156.5	-88.4	160.2	0	0	0	107.4	L736 V740	L736-L738 HydrophobicContact CD2-CG 4.27Å; L738-V740 PolarHBondContact O-N 3.36Å
739	T	26.4	Very low	27	Very low	129 Å²	129	136.9 Å²	136.9	79%	0.791	71%	0.707	S	S	*	*			trans	-88.3	100.9	166.9	50.9	0	0	0	0	109.3
740	V	25.3	Very low	27.3	Very low	106 Å²	106	136.9 Å²	136.9	64%	0.642	72%	0.716	S	S	*	*			trans	-86.9	118.5	161.1	173.8	0	0	0	0	107.6	L738 T742	L738-V740 PolarHBondContact O-N 3.36Å; V740-T742 HydrophobicContact CG1-CG2 3.86Å
741	D	26.3	Very low	27.6	Very low	146 Å²	146	135.7 Å²	135.7	78%	0.781	71%	0.71	S	S	*	*			trans	-131.1	120	146.9	-88.8	-52.7	0	0	0	105.8
742	T	25.8	Very low	27.8	Very low	85 Å²	85	135.3 Å²	135.3	52%	0.521	70%	0.703	S	S	.	*			cis	60.9	58	38.3	56.6	0	0	0	0	115.9	V740	V740-T742 HydrophobicContact CG1-CG2 3.86Å
743	N	28.1	Very low	28.1	Very low	150 Å²	150	131 Å²	131	80%	0.802	70%	0.696	S	S	*	*				-144.3	134.8	124.8	-86.6	-55.9	0	0	0	108.5
744	H	28.5	Very low	28.2	Very low	137 Å²	137	131.1 Å²	131.1	63%	0.634	70%	0.697	S	S	*	*			cis	63.8	148.9	40.6	-65.4	-43.7	0	0	0	113
745	H	27.7	Very low	28.3	Very low	153 Å²	153	128.1 Å²	128.1	71%	0.708	69%	0.686	S	S	*	*			cis	-153	152.5	0.8	-138.7	72.2	0	0	0	107.8
746	C	26.4	Very low	28.5	Very low	83 Å²	83	126.5 Å²	126.5	56%	0.561	69%	0.687	S	S	*	*			cis	-172.3	-160.1	-33.1	-108.3	0	0	0	0	107.5
747	I	27	Very low	28.7	Very low	133 Å²	133	126.8 Å²	126.8	68%	0.682	69%	0.689	S	S	*	*			trans	35.7	122.3	134.9	-66.7	161.1	0	0	0	117.6
748	D	28.9	Very low	28.8	Very low	128 Å²	128	128.5 Å²	128.5	68%	0.684	69%	0.692	S	S	*	*				-173	162.8	84.1	-128.7	0	0	0	0	111.4
749	N	29.9	Very low	29.1	Very low	104 Å²	104	125.9 Å²	125.9	56%	0.556	68%	0.679	S	S	*	*			cis	-161.3	157	-1.3	-150.7	-31.5	0	0	0	111.1
750	N	30.3	Very low	29.3	Very low	120 Å²	120	126.1 Å²	126.1	64%	0.642	68%	0.675	S	S	*	*			trans	56.7	152.5	153.8	-74.2	-37.6	0	0	0	119.9
751	N	31.3	Very low	29.6	Very low	123 Å²	123	125 Å²	125	66%	0.658	68%	0.677	S	S	*	*			cis	-168.6	160.7	-5.7	-113.7	-27.6	0	0	0	107.5
752	N	31	Very low	29.6	Very low	124 Å²	124	125.7 Å²	125.7	66%	0.663	68%	0.679	S	S	*	*			cis	-165.5	-173.4	-14	-154.8	-16.9	0	0	0	108.9
753	N	32	Very low	29.9	Very low	117 Å²	117	127 Å²	127	63%	0.626	68%	0.682	S	S	*	*			trans	75.6	98	151.1	-71.6	-24.7	0	0	0	120.7
754	N	31.8	Very low	29.9	Very low	119 Å²	119	125.3 Å²	125.3	64%	0.636	68%	0.682	S	S	*	*				94.3	118.6	113.2	-64.7	-15	0	0	0	122
755	N	31.2	Very low	29.9	Very low	129 Å²	129	129.3 Å²	129.3	69%	0.69	69%	0.692	S	S	*	*			trans	67.5	110.8	134.7	-53.4	-9.1	0	0	0	117.2
756	N	32.6	Very low	30	Very low	158 Å²	158	127.2 Å²	127.2	85%	0.845	69%	0.694	S	S	*	*				-152.2	145.6	55.4	-76.2	-52.6	0	0	0	113
757	N	29.6	Very low	30.2	Very low	150 Å²	150	132.4 Å²	132.4	80%	0.802	71%	0.707	S	S	*	*			trans	-98.5	139.7	169.3	-71.2	-50.7	0	0	0	110.4
758	D	30.3	Very low	30.2	Very low	151 Å²	151	131.5 Å²	131.5	81%	0.807	70%	0.701	S	S	*	*			trans	-161.5	174.3	134.2	-106.9	-32.5	0	0	0	109.7	L760	D758-L760 VanDerWaalsContact C-N 3.3Å; D758-L760 PolarHBondContact O-N 3.21Å
759	N	30.1	Very low	30.2	Very low	98 Å²	98	131.7 Å²	131.7	52%	0.524	70%	0.701	S	S	.	*	S	Bend	trans	70.1	-7.6	-177.1	-65.4	-38.4	0	0	0	118.3	H650 A761	H650-N759 PolarHBondContact CD2-ND2 3.04Å; H650-N759 WeakPolarHBondContact NE2-CB 3.22Å; N759-A761 PolarHBondContact O-N 2.92Å; N759-A761 VanDerWaalsContact O-N 3.07Å
760	L	31.6	Very low	30.2	Very low	134 Å²	134	134.7 Å²	134.7	70%	0.702	72%	0.715	S	S	*	*			trans	-84	39.3	173	-148.9	77.9	0	0	0	113.8	D758 L763	D758-L760 VanDerWaalsContact C-N 3.3Å; D758-L760 PolarHBondContact O-N 3.21Å; L760-L763 HydrophobicContact CD1-CD1 3.74Å; L760-L763 HydrophobicContact CD2-CD1 4.36Å; L760-L763 HydrophobicContact CG-CD1 3.85Å
761	A	30.4	Very low	30.2	Very low	84 Å²	84	134.3 Å²	134.3	69%	0.694	71%	0.713	S	S	*	*			trans	-113.8	0.9	-166.4	0	0	0	0	0	116.2	N759	N759-A761 PolarHBondContact O-N 2.92Å; N759-A761 VanDerWaalsContact O-N 3.07Å
762	I	27.5	Very low	30.2	Very low	159 Å²	159	132.8 Å²	132.8	82%	0.815	71%	0.705	S	S	*	*	S	Bend	trans	-98.8	-10	169.7	-64	179.9	0	0	0	111.6	S764	I762-S764 VanDerWaalsContact C-N 3.34Å; I762-S764 PolarHBondContact O-N 3.35Å
763	L	31.2	Very low	30.1	Very low	113 Å²	113	137.6 Å²	137.6	59%	0.592	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	85.2	159.8	-93.1	155.6	0	0	0	110.3	L760	L760-L763 HydrophobicContact CD1-CD1 3.74Å; L760-L763 HydrophobicContact CD2-CD1 4.36Å; L760-L763 HydrophobicContact CG-CD1 3.85Å
764	S	29.2	Very low	30.1	Very low	114 Å²	114	139 Å²	139	80%	0.797	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-168.4	-24.5	162.1	-87.1	0	0	0	0	116.2	I762	I762-S764 VanDerWaalsContact C-N 3.34Å; I762-S764 PolarHBondContact O-N 3.35Å
765	R	27.2	Very low	30.1	Very low	222 Å²	222	136.4 Å²	136.4	84%	0.838	71%	0.71	S	S	*	*	S	Bend	trans	-126.6	6.1	-161.5	-143.3	168.3	-175.3	148.4	3.3	118.3
766	S	30.5	Very low	30.1	Very low	109 Å²	109	137.5 Å²	137.5	76%	0.762	71%	0.711	S	S	*	*	S	Bend	trans	-111.4	-14.4	173.5	52	0	0	0	0	114.3	M768	S766-M768 VanDerWaalsContact C-N 3.27Å; S766-M768 PolarHBondContact O-N 2.94Å
767	K	30.1	Very low	30	Very low	191 Å²	191	136.9 Å²	136.9	83%	0.83	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	29.1	172.4	-73.4	-169.1	173.6	-175.5	0	113.6
768	M	27.5	Very low	30.1	Very low	115 Å²	115	134.8 Å²	134.8	57%	0.567	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-153.5	31	177.5	-125.5	-178.3	89.2	0	0	115.9	S766 D772	S766-M768 VanDerWaalsContact C-N 3.27Å; S766-M768 PolarHBondContact O-N 2.94Å; M768-D772 VanDerWaalsContact O-CB 3.3Å; M768-D772 WeakPolarHBondContact O-CB 3.42Å
769	I	29.4	Very low	30	Very low	131 Å²	131	133.6 Å²	133.6	67%	0.672	69%	0.693	S	S	*	*	S	Bend	trans	-131.6	51.3	170.7	-40.5	-179.6	0	0	0	112
770	I	29.9	Very low	30	Very low	168 Å²	168	136.2 Å²	136.2	86%	0.862	71%	0.706	S	S	*	*	S	Bend	trans	-155.7	55.8	149.3	-94.8	145.3	0	0	0	106.6
771	N	28.7	Very low	29.8	Very low	112 Å²	112	136.4 Å²	136.4	60%	0.599	71%	0.708	S	S	*	*	S	Bend	trans	-168	-21.9	165.9	-109.3	-21.1	0	0	0	111.1	R773 F774 A775	N771-R773 PolarHBondContact O-N 3.32Å; N771-F774 PolarHBondContact O-N 3.19Å; N771-A775 PolarHBondContact O-N 3.14Å
772	D	31.4	Very low	29.6	Very low	90 Å²	90	138.6 Å²	138.6	48%	0.481	71%	0.706	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.9	26.5	168.7	-144.7	35.8	0	0	0	113.8	M768	M768-D772 VanDerWaalsContact O-CB 3.3Å; M768-D772 WeakPolarHBondContact O-CB 3.42Å
773	R	30.4	Very low	29.6	Very low	226 Å²	226	139.4 Å²	139.4	85%	0.853	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.2	4.5	165.8	-132.1	178.2	-170.8	-178.5	2.5	113.4	N771	N771-R773 PolarHBondContact O-N 3.32Å
774	F	30.9	Very low	29.4	Very low	146 Å²	146	139.1 Å²	139.1	64%	0.64	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	-32.7	173	-145.5	-99.5	0	0	0	110.8	N771 Q776 N777	N771-F774 PolarHBondContact O-N 3.19Å; F774-Q776 PolarHBondContact O-N 2.83Å; F774-N777 PolarHBondContact O-N 2.88Å
775	A	32.4	Very low	29.4	Very low	64 Å²	64	139.7 Å²	139.7	53%	0.529	70%	0.699	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.5	-5.5	170.6	0	0	0	0	0	115	N771	N771-A775 PolarHBondContact O-N 3.14Å
776	Q	32	Very low	29.3	Very low	153 Å²	153	136.4 Å²	136.4	72%	0.715	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	5.6	174.5	-68.5	-176.9	-7	0	0	113.9	F774	F774-Q776 PolarHBondContact O-N 2.83Å
777	N	30.4	Very low	29	Very low	145 Å²	145	139.6 Å²	139.6	78%	0.775	70%	0.701	S	S	*	*	S	Bend	trans	-125.5	12.5	177	-99.5	-15.3	0	0	0	114.2	F774	F774-N777 PolarHBondContact O-N 2.88Å
778	V	30.7	Very low	29	Very low	105 Å²	105	136.5 Å²	136.5	64%	0.636	70%	0.698	S	S	*	*	S	Bend	trans	-128.3	38.5	175.4	-159.7	0	0	0	0	111
779	N	28.3	Very low	29	Very low	126 Å²	126	137 Å²	137	67%	0.674	70%	0.703	S	S	*	*			trans	-120	27.3	171	-103.2	-42.1	0	0	0	112.2
780	L	30.6	Very low	28.8	Very low	153 Å²	153	137.6 Å²	137.6	80%	0.801	71%	0.708	S	S	*	*	S	Bend	trans	-144.2	96.5	163.4	-67.3	172	0	0	0	103.3
781	L	26.9	Very low	28.9	Very low	139 Å²	139	135.6 Å²	135.6	73%	0.728	70%	0.703	S	S	*	*	S	Bend		-143.9	74.7	54	-167.9	77	0	0	0	112.4	N784	L781-N784 HydrophobicContact CD1-CB 4.28Å
782	I	26.8	Very low	29	Very low	130 Å²	130	137.3 Å²	137.3	67%	0.667	71%	0.712	S	S	*	*	S	Bend	trans	-115.5	134.9	154.3	-60.9	179.4	0	0	0	105.4
783	H	27.4	Very low	28.9	Very low	176 Å²	176	144.6 Å²	144.6	82%	0.815	73%	0.733	S	S	*	*	S	Bend	trans	63.5	69.6	-165	-68	-75.6	0	0	0	115.8
784	N	26.4	Very low	28.9	Very low	106 Å²	106	141.4 Å²	141.4	57%	0.567	73%	0.728	S	S	*	*			trans	-162.6	125	136.6	-90.4	-16.8	0	0	0	105.5	L781	L781-N784 HydrophobicContact CD1-CB 4.28Å
785	N	29.1	Very low	28.9	Very low	127 Å²	127	140.9 Å²	140.9	68%	0.679	73%	0.731	S	S	*	*			cis	-148	153.3	-1.4	-99.2	-27.4	0	0	0	110.3
786	N	24.7	Very low	28.9	Very low	152 Å²	152	142.5 Å²	142.5	81%	0.813	73%	0.734	S	S	*	*			trans	-77.7	167.2	152.8	-66.5	-41.6	0	0	0	108.2
787	E	25.9	Very low	28.9	Very low	176 Å²	176	141.1 Å²	141.1	82%	0.822	73%	0.731	S	S	*	*			trans	81.4	135.2	-158.7	-50.2	167.9	170.4	0	0	110.5
788	V	29.1	Very low	29	Very low	126 Å²	126	141.3 Å²	141.3	76%	0.764	73%	0.727	S	S	*	*			cis	-132.3	143.8	20.9	175.3	0	0	0	0	113.3
789	N	27.5	Very low	28.9	Very low	126 Å²	126	143 Å²	143	67%	0.674	73%	0.732	S	S	*	*			trans	-28.9	154.4	164.8	-35.9	-35.5	0	0	0	120.7
790	D	26.3	Very low	29	Very low	143 Å²	143	140.6 Å²	140.6	77%	0.765	73%	0.725	S	S	*	*			trans	66.1	152.8	141.8	-61.9	-37.8	0	0	0	122.8
791	V	31.3	Very low	29	Very low	126 Å²	126	141 Å²	141	76%	0.764	72%	0.722	S	S	*	*			trans	68.5	112.7	168.1	-165.1	0	0	0	0	114.9
792	N	31.6	Very low	29.5	Very low	148 Å²	148	141 Å²	141	79%	0.791	72%	0.723	S	S	*	*			cis	-125.5	146.3	20.5	-86.4	-57.8	0	0	0	113.9
793	R	28.6	Very low	29.8	Very low	244 Å²	244	141.8 Å²	141.8	92%	0.921	73%	0.728	S	S	*	*			trans	-145.7	81.3	175.9	-178	-157	-178.5	-139.8	4.6	109.9
794	E	30.9	Very low	30.3	Very low	158 Å²	158	140.3 Å²	140.3	74%	0.738	73%	0.727	S	S	*	*			trans	-155.6	145.4	179.6	-85.7	-155.2	135.3	0	0	107.5
795	L	30.1	Very low	30.6	Very low	135 Å²	135	144.5 Å²	144.5	71%	0.707	74%	0.743	S	S	*	*			cis	-151	164.4	-4.2	-89.4	139.7	0	0	0	106.1
796	V	32.7	Very low	30.9	Very low	99 Å²	99	142 Å²	142	60%	0.6	75%	0.746	S	S	*	*			cis	-179.8	152.5	-27.2	78.6	0	0	0	0	104.7
797	N	31.7	Very low	31.4	Very low	123 Å²	123	141 Å²	141	66%	0.658	74%	0.741	S	S	*	*				175.2	133.2	70.6	-113.4	-4.8	0	0	0	105.2
798	H	31.6	Very low	32.2	Very low	149 Å²	149	139.9 Å²	139.9	69%	0.69	74%	0.741	S	S	*	*				77.9	130.9	76.6	-88.6	-26.7	0	0	0	115.5
799	I	29.3	Very low	32.5	Very low	142 Å²	142	138.8 Å²	138.8	73%	0.728	73%	0.731	S	S	*	*			trans	69.3	130.8	136.5	-64.2	168.8	0	0	0	116.4
800	S	30.4	Very low	32.8	Very low	75 Å²	75	139.4 Å²	139.4	52%	0.524	73%	0.734	S	S	.	*			cis	-168.3	171.7	-11.3	52.6	0	0	0	0	110.3
801	E	31.4	Very low	33.4	Very low	161 Å²	161	138 Å²	138	75%	0.752	73%	0.727	S	S	*	*			trans	61.9	167.7	142.9	-72.5	147.8	167.5	0	0	120.1
802	D	36.2	Very low	33.7	Very low	139 Å²	139	138.9 Å²	138.9	74%	0.743	72%	0.72	S	S	*	*			trans	55.5	111.6	167.8	-47.7	-20.6	0	0	0	117.4
803	D	33.4	Very low	33.9	Very low	146 Å²	146	137.9 Å²	137.9	78%	0.781	72%	0.715	S	S	*	*				92.2	162.4	62.2	-78.9	-17.5	0	0	0	113
804	D	37.6	Very low	34.2	Very low	146 Å²	146	132.6 Å²	132.6	78%	0.781	71%	0.705	S	S	*	*			trans	63.2	114.3	179.6	-58.7	-18.2	0	0	0	117
805	E	33.8	Very low	34.4	Very low	194 Å²	194	132.4 Å²	132.4	91%	0.907	70%	0.704	S	S	*	*				90.6	153.2	61.2	-80.2	-160.9	-176.9	0	0	114.3
806	G	34.9	Very low	34.6	Very low	73 Å²	73	130.5 Å²	130.5	75%	0.753	70%	0.698	S	S	*	*			trans	87.4	101.9	-172.9	0	0	0	0	0	112.7
807	D	34.7	Very low	34.6	Very low	132 Å²	132	132.9 Å²	132.9	71%	0.706	71%	0.705	S	S	*	*			cis	66.8	82.7	31.7	-144.3	13.3	0	0	0	112.8	N809	D807-N809 PolarHBondContact OD1-ND2 3.46Å
808	D	42.8	Very low	34.5	Very low	152 Å²	152	131.7 Å²	131.7	81%	0.813	70%	0.698	S	S	*	*			trans	-167.9	102.8	135.7	-95.2	-23.1	0	0	0	107.9
809	N	34.7	Very low	34.4	Very low	104 Å²	104	127.5 Å²	127.5	56%	0.556	68%	0.681	S	S	*	*				76.7	136.8	63.8	-64.2	-47.8	0	0	0	113.6	D807	D807-N809 PolarHBondContact OD1-ND2 3.46Å
810	D	34.3	Very low	34.3	Very low	138 Å²	138	125.1 Å²	125.1	74%	0.738	68%	0.677	S	S	*	*			trans	42.7	96.7	142.1	-63.3	-2.3	0	0	0	118.2
811	D	39.8	Very low	34.3	Very low	115 Å²	115	131.9 Å²	131.9	62%	0.615	69%	0.691	S	S	*	*				-174.4	118.1	102	-96.1	11.6	0	0	0	111.3
812	K	37.9	Very low	34	Very low	143 Å²	143	129.7 Å²	129.7	62%	0.622	68%	0.681	S	S	*	*				94.8	143.3	81	-87.3	-171.3	-168.9	80.5	0	111.7
813	D	35.2	Very low	33.6	Very low	128 Å²	128	130 Å²	130	68%	0.684	68%	0.677	S	S	*	*				42.4	127.3	125	-42.1	-8.1	0	0	0	116.9
814	D	34.9	Very low	33.2	Very low	133 Å²	133	128.6 Å²	128.6	71%	0.711	68%	0.678	S	S	*	*			cis	-171.8	-155.7	8.9	-140.8	-34.4	0	0	0	111.3
815	E	34.5	Very low	32.9	Very low	154 Å²	154	130 Å²	130	72%	0.72	68%	0.68	S	S	*	*			trans	27.7	136.3	130.8	-66.7	-154.6	155.1	0	0	119.6
816	T	34.4	Very low	32.6	Very low	94 Å²	94	127.5 Å²	127.5	58%	0.577	67%	0.673	S	S	*	*			cis	-177.3	-178.8	22.8	21.9	0	0	0	0	111.3
817	M	33.8	Very low	32.6	Very low	150 Å²	150	131.1 Å²	131.1	74%	0.739	68%	0.675	S	S	*	*				22.8	144.8	127.4	-46	-85.8	-178.4	0	0	118.2
818	N	29.8	Very low	32.3	Very low	98 Å²	98	130.3 Å²	130.3	52%	0.524	67%	0.671	S	S	.	*			cis	-172.7	-177.8	4.3	-117.7	-18.2	0	0	0	110	I449	I449-N818 WeakPolarHBondContact CD1-OD1 3.47Å
819	N	27.6	Very low	31.9	Very low	61 Å²	61	130.3 Å²	130.3	33%	0.326	67%	0.67	S	S	.	*			trans	-0.9	135.5	141.5	-50.8	-35.8	0	0	0	117.8	D448 I449	D448-N819 WeakPolarHBondContact CB-OD1 3.44Å; I449-N819 WeakPolarHBondContact CD1-OD1 3.29Å; I449-N819 VanDerWaalsContact CG1-OD1 3.28Å; I449-N819 WeakPolarHBondContact CG1-OD1 3.46Å
820	S	28.8	Very low	31.7	Very low	92 Å²	92	131.1 Å²	131.1	64%	0.643	68%	0.675	S	S	*	*				152.9	143.3	111.5	-71.6	0	0	0	0	112.8
821	R	29.2	Very low	31.6	Very low	216 Å²	216	132 Å²	132	82%	0.815	68%	0.68	S	S	*	*			trans	61.6	127.4	151.8	-71.1	175.6	145.8	88.6	1.9	117.2
822	E	26.7	Very low	31.2	Very low	115 Å²	115	130.1 Å²	130.1	54%	0.537	69%	0.687	S	S	.	*				66.6	126.9	57.8	-74.2	-148.7	100.3	0	0	116.1	I446	I446-E822 HydrophobicContact CD1-CG 4.09Å; I446-E822 WeakPolarHBondContact CD1-OE2 3.49Å
823	Q	26.6	Very low	30.8	Very low	145 Å²	145	133.8 Å²	133.8	68%	0.678	70%	0.697	S	S	*	*			trans	77	111.8	146.6	-69.4	172.6	40.1	0	0	119.9
824	C	25	Very low	30.7	Very low	117 Å²	117	134.2 Å²	134.2	79%	0.791	70%	0.695	S	S	*	*			trans	72.8	160.3	146.3	-51.7	0	0	0	0	116.1
825	E	31	Very low	30.6	Very low	176 Å²	176	136.6 Å²	136.6	82%	0.822	70%	0.701	S	S	*	*			cis	-125.8	137.8	3.2	-67.7	173.9	141.5	0	0	109.4
826	N	27.7	Very low	30.3	Very low	141 Å²	141	133.2 Å²	133.2	75%	0.754	69%	0.694	S	S	*	*				47.8	97.9	85.1	-106.4	2.2	0	0	0	115.9
827	N	34.3	Very low	30	Very low	150 Å²	150	138 Å²	138	80%	0.802	71%	0.707	S	S	*	*			trans	-172.3	106.7	140.4	-92.3	-43.1	0	0	0	108.9
828	N	29.2	Very low	29.7	Very low	115 Å²	115	139.2 Å²	139.2	62%	0.615	71%	0.711	S	S	*	*				57.9	104.3	75	-76.1	-27.7	0	0	0	115.6
829	N	34.9	Very low	29.7	Very low	151 Å²	151	141.4 Å²	141.4	81%	0.807	72%	0.722	S	S	*	*				-174.7	113.7	125.6	-88	-38.7	0	0	0	108.4
830	N	30.5	Very low	29.7	Very low	121 Å²	121	147 Å²	147	65%	0.647	75%	0.752	S	S	*	*				60.5	95.7	68.1	-72.4	-24.1	0	0	0	115
831	N	31.1	Very low	29.8	Very low	158 Å²	158	150 Å²	150	85%	0.845	76%	0.756	S	S	*	*				165.9	131.8	93.7	-88.6	-46.5	0	0	0	115.5
832	G	32.7	Very low	29.8	Very low	75 Å²	75	148.4 Å²	148.4	77%	0.773	76%	0.755	S	S	*	*			trans	87.6	161.4	148.6	0	0	0	0	0	118.8
833	R	29.4	Very low	29.8	Very low	219 Å²	219	151.8 Å²	151.8	83%	0.826	77%	0.768	S	S	*	*			cis	-161.3	144.5	-9.6	-165.6	162.7	-171.6	172.1	1.6	112.5
834	H	31.6	Very low	29.9	Very low	137 Å²	137	152 Å²	152	63%	0.634	77%	0.774	S	S	*	*			trans	11.4	120.8	170.4	-41.9	-56.2	0	0	0	118.8
835	H	33	Very low	29.9	Very low	183 Å²	183	152.1 Å²	152.1	85%	0.847	77%	0.771	S	S	*	*				-178.4	161.6	76.6	-102.3	-102.8	0	0	0	108.3
836	S	28.9	Very low	29.8	Very low	83 Å²	83	152.2 Å²	152.2	58%	0.58	77%	0.774	S	S	*	*			cis	164.4	110.4	-24	-178.1	0	0	0	0	106.2
837	K	28.5	Very low	29.8	Very low	194 Å²	194	151.6 Å²	151.6	84%	0.843	77%	0.77	S	S	*	*			trans	77.3	154.6	170.8	-54.5	177.5	179.5	-177.9	0	119
838	Q	27.2	Very low	29.6	Very low	176 Å²	176	152.3 Å²	152.3	82%	0.822	77%	0.768	S	S	*	*			trans	63.7	94.3	170	-69	177.2	-41.4	0	0	118.5
839	L	30.9	Very low	29.4	Very low	144 Å²	144	151.3 Å²	151.3	75%	0.754	77%	0.77	S	S	*	*			trans	-167.2	26.7	136.3	-110.6	161.8	0	0	0	115.7	E841 F842	L839-E841 PolarHBondContact O-N 2.84Å; L839-F842 HydrophobicContact CD2-CD2 3.99Å
840	D	27.1	Very low	29.2	Very low	180 Å²	180	150.2 Å²	150.2	96%	0.963	76%	0.764	S	S	*	*	S	Bend	trans	-87.4	35.3	170	-92.5	-50.8	0	0	0	112.2
841	E	29.8	Very low	29.2	Very low	154 Å²	154	150.1 Å²	150.1	72%	0.72	76%	0.76	S	S	*	*			trans	-148.5	57.2	-168.9	-154.4	157.2	-139.4	0	0	111.1	L839	L839-E841 PolarHBondContact O-N 2.84Å
842	F	29.1	Very low	29.1	Very low	183 Å²	183	144.2 Å²	144.2	80%	0.803	73%	0.727	S	S	*	*			trans	-127.9	38.7	174.1	-123.9	-91.7	0	0	0	113.1	L839	L839-F842 HydrophobicContact CD2-CD2 3.99Å
843	K	28.1	Very low	28.9	Very low	185 Å²	185	141.9 Å²	141.9	80%	0.804	70%	0.697	S	S	*	*	S	Bend	trans	-128.8	121	159.6	-75.9	179.3	179.1	171.1	0	107.7
844	N	27.2	Very low	29	Very low	150 Å²	150	135.5 Å²	135.5	80%	0.802	68%	0.679	S	S	*	*	S	Bend	trans	77.8	169.3	-178	-42.5	-32	0	0	0	114.8
845	T	26.4	Very low	29	Very low	119 Å²	119	137 Å²	137	73%	0.73	68%	0.68	S	S	*	*			trans	67.8	56.9	175.8	58.6	0	0	0	0	119.3
846	M	27.9	Very low	28.8	Very low	179 Å²	179	134.7 Å²	134.7	88%	0.882	67%	0.674	S	S	*	*			trans	-154.9	131.5	146.7	-88.8	-172.1	168.5	0	0	107.9
847	L	27.9	Very low	28.9	Very low	128 Å²	128	137.8 Å²	137.8	67%	0.67	68%	0.684	S	S	*	*			cis	68.3	136	-4.7	-36.4	-177.9	0	0	0	115.9
848	H	29.3	Very low	29.1	Very low	165 Å²	165	134.8 Å²	134.8	76%	0.764	68%	0.676	S	S	*	*			cis	-157.2	169.5	-13.7	-110.8	-44.1	0	0	0	108.5
849	S	26.5	Very low	29	Very low	93 Å²	93	134.9 Å²	134.9	65%	0.65	68%	0.682	S	S	*	*			trans	66.2	145.2	172.7	-28.2	0	0	0	0	116.2
850	D	30.6	Very low	28.9	Very low	129 Å²	129	132.6 Å²	132.6	69%	0.69	68%	0.679	S	S	*	*			cis	-145.8	176.8	24.8	-124.6	-46.1	0	0	0	115.1	Y1262	D850-Y1262 WeakPolarHBondContact CA-OH 3.49Å; D850-Y1262 VanDerWaalsContact O-CE1 3.29Å; D850-Y1262 WeakPolarHBondContact O-CE1 3.46Å; D850-Y1262 PolarHBondContact OD1-OH 3.1Å
851	H	29.7	Very low	28.9	Very low	118 Å²	118	128.8 Å²	128.8	55%	0.546	67%	0.666	S	S	.	*			trans	-65.3	121.7	-155.3	-79.8	-100.9	0	0	0	120.2	Y1262	H851-Y1262 HydrophobicContact CB-CE2 4.43Å; H851-Y1262 AromaticContact CD2-CE2 3.86Å; H851-Y1262 AromaticContact CD2-CZ 3.78Å; H851-Y1262 PolarHBondContact CD2-OH 3.35Å; H851-Y1262 AromaticContact CE1-CE2 3.64Å; H851-Y1262 AromaticContact CG-CE2 3.65Å; H851-Y1262 AromaticContact CG-CZ 3.71Å; H851-Y1262 PolarHBondContact N-OH 2.84Å; H851-Y1262 AromaticContact ND1-CE2 3.53Å; H851-Y1262 AromaticContact NE2-CE2 3.84Å
852	E	29.4	Very low	29.1	Very low	34 Å²	34	127.3 Å²	127.3	16%	0.159	67%	0.672	C	S	.	*				166.7	-165.6	118.3	-48.7	176.9	159.3	0	0	121.1	K1260 S1261 Y1262 N1263	E852-K1260 VanDerWaalsContact OE2-C 3.31Å; E852-K1260 WeakPolarHBondContact OE2-CA 3.4Å; E852-K1260 WeakPolarHBondContact OE2-CB 3.27Å; E852-K1260 WeakPolarHBondContact OE2-CG 3.19Å; E852-S1261 VanDerWaalsContact CD-C 3.45Å; E852-S1261 VanDerWaalsContact CG-N 3.32Å; E852-S1261 WeakPolarHBondContact OE1-CA 3.49Å; E852-S1261 PolarHBondContact OE1-N 3.4Å; E852-S1261 PolarHBondContact OE2-N 3.46Å; E852-Y1262 HydrophobicContact CG-CD1 4.36Å; E852-Y1262 HydrophobicContact CG-CD2 3.83Å; E852-Y1262 HydrophobicContact CG-CE2 4.28Å; E852-Y1262 HydrophobicContact CG-CG 3.86Å; E852-Y1262 VanDerWaalsContact CG-N 3.34Å; E852-Y1262 WeakPolarHBondContact OE1-CD2 3.4Å; E852-Y1262 PolarHBondContact OE1-N 2.99Å; E852-N1263 WeakPolarHBondContact O-CB 3.33Å; E852-N1263 PolarHBondContact O-ND2 3.43Å
853	N	28.2	Very low	29.1	Very low	27 Å²	27	122.7 Å²	122.7	14%	0.144	66%	0.663	C	S	.	*			trans	-121	-143	-141.3	-148	12.1	0	0	0	119.3	Y855 M1259 K1260 S1261	N853-Y855 WeakPolarHBondContact ND2-CD2 3.23Å; N853-Y855 WeakPolarHBondContact OD1-CD2 3.27Å; N853-M1259 HydrophobicContact CB-CB 3.76Å; N853-M1259 HydrophobicContact CB-CG 4.46Å; N853-M1259 VanDerWaalsContact O-CE 3.23Å; N853-M1259 WeakPolarHBondContact O-CE 3.31Å; N853-K1260 VanDerWaalsContact CB-N 3.33Å; N853-K1260 VanDerWaalsContact CG-C 3.42Å; N853-K1260 PolarHBondContact ND2-O 3.42Å; N853-S1261 WeakPolarHBondContact CA-O 3.36Å; N853-S1261 PolarHBondContact ND2-N 2.81Å; N853-S1261 WeakPolarHBondContact OD1-CA 3.26Å; N853-S1261 WeakPolarHBondContact OD1-CB 3.31Å; N853-S1261 PolarHBondContact OD1-N 2.81Å; N853-S1261 PolarHBondContact OD1-O 3.21Å; N853-S1261 PolarHBondContact OD1-OG 2.75Å
854	D	32.6	Very low	29.1	Very low	84 Å²	84	121.4 Å²	121.4	45%	0.449	66%	0.66	S	S	.	*			cis	-149.3	160.8	12.9	-108	-13.4	0	0	0	110.1	M1259	D854-M1259 HydrophobicContact CB-CG 4.19Å; D854-M1259 VanDerWaalsContact OD2-CA 3.23Å; D854-M1259 WeakPolarHBondContact OD2-CA 3.42Å; D854-M1259 WeakPolarHBondContact OD2-CG 3.46Å
855	Y	30.4	Very low	29.1	Very low	168 Å²	168	121.9 Å²	121.9	66%	0.659	66%	0.662	S	S	*	*			cis	76.4	137.5	15.7	-76.8	-84.4	0	0	0	119	N853	N853-Y855 WeakPolarHBondContact ND2-CD2 3.23Å; N853-Y855 WeakPolarHBondContact OD1-CD2 3.27Å
856	N	29.2	Very low	29	Very low	136 Å²	136	126.3 Å²	126.3	73%	0.727	67%	0.666	S	S	*	*			cis	-104.7	167.5	-17.2	-63.2	-85.2	0	0	0	109.1
857	D	31.7	Very low	28.9	Very low	147 Å²	147	127.5 Å²	127.5	79%	0.786	67%	0.666	S	S	*	*	S	Bend		-175.3	153.2	62.8	-108.2	-22.6	0	0	0	108.1
858	I	31.8	Very low	28.8	Very low	131 Å²	131	128 Å²	128	67%	0.672	67%	0.668	S	S	*	*			cis	-127.1	136.8	-6.6	-83.6	147.3	0	0	0	107.5	S860	I858-S860 WeakPolarHBondContact CG2-OG 3.43Å
859	N	26.3	Very low	28.7	Very low	178 Å²	178	128 Å²	128	95%	0.952	67%	0.668	S	S	*	*			trans	-141.6	83.6	158.9	-157.5	18.3	0	0	0	108.6
860	S	26.9	Very low	28.7	Very low	97 Å²	97	130.1 Å²	130.1	68%	0.678	67%	0.671	S	S	*	*			trans	-127	142.2	-178.1	54.7	0	0	0	0	110.8	I858	I858-S860 WeakPolarHBondContact CG2-OG 3.43Å
861	S	27.6	Very low	28.6	Very low	99 Å²	99	132.2 Å²	132.2	69%	0.692	68%	0.682	S	S	*	*			cis	-153.8	137.1	-11.3	49.6	0	0	0	0	109.8
862	S	35.1	Very low	28.6	Very low	123 Å²	123	133.3 Å²	133.3	86%	0.86	69%	0.687	S	S	*	*			trans	-82	115.1	160.5	56	0	0	0	0	109.5
863	S	28.4	Very low	28.5	Very low	86 Å²	86	138 Å²	138	60%	0.601	71%	0.709	S	S	*	*			trans	-150.9	146.5	173.5	-77.3	0	0	0	0	111.8
864	Q	27.5	Very low	28.6	Very low	159 Å²	159	142 Å²	142	74%	0.743	74%	0.739	S	S	*	*			trans	48.2	90.6	175	-70.7	94.8	19.1	0	0	117.7
865	D	27.1	Very low	28.4	Very low	160 Å²	160	144.9 Å²	144.9	86%	0.856	75%	0.75	S	S	*	*	S	Bend		-60.1	146.8	120.9	-140.7	-37.4	0	0	0	109.3
866	R	25.4	Very low	28.2	Very low	211 Å²	211	140.5 Å²	140.5	80%	0.796	74%	0.743	S	S	*	*			trans	59	103.4	-172.8	-54.5	178.4	177.8	-175	-1.4	117
867	F	24.5	Very low	28.2	Very low	205 Å²	205	142.6 Å²	142.6	90%	0.899	75%	0.746	S	S	*	*				-138.5	139.1	114.4	-133.9	-86.6	0	0	0	111.1
868	I	26.5	Very low	28.3	Very low	139 Å²	139	143.8 Å²	143.8	71%	0.713	75%	0.747	S	S	*	*			trans	-102.1	131	-172.4	-82.1	174.4	0	0	0	110.4
869	H	28	Very low	28.4	Very low	164 Å²	164	142.9 Å²	142.9	76%	0.759	75%	0.752	S	S	*	*			trans	62.7	148.4	160.8	-102.2	-119.7	0	0	0	120.8
870	L	26.9	Very low	28.9	Very low	137 Å²	137	139.8 Å²	139.8	72%	0.717	74%	0.742	S	S	*	*			trans	60.9	119.6	153.6	-66	158.7	0	0	0	116.8
871	L	27.2	Very low	29.1	Very low	174 Å²	174	142 Å²	142	91%	0.911	75%	0.745	S	S	*	*				-139.4	177.7	67.4	-99.3	166.9	0	0	0	115.4
872	H	29.5	Very low	29.3	Very low	140 Å²	140	145.4 Å²	145.4	65%	0.648	75%	0.749	S	S	*	*			trans	-123.5	157	-158.4	-171.3	-113.2	0	0	0	111.4
873	Q	28.1	Very low	29.1	Very low	134 Å²	134	144.5 Å²	144.5	63%	0.626	74%	0.739	S	S	*	*			trans	60.8	116.4	175.6	-72.6	155.5	-66	0	0	116.3
874	S	30.6	Very low	29.3	Very low	111 Å²	111	147 Å²	147	78%	0.776	75%	0.746	S	S	*	*				-149.2	134.3	74.9	2.1	0	0	0	0	110.8
875	H	27	Very low	29.5	Very low	144 Å²	144	144.1 Å²	144.1	67%	0.667	74%	0.742	S	S	*	*				59.8	120.6	80.6	-68.2	-62.9	0	0	0	113.1
876	S	27.5	Very low	29.6	Very low	75 Å²	75	141.5 Å²	141.5	52%	0.524	74%	0.735	S	S	.	*			cis	-165.4	177	4	-79.8	0	0	0	0	111.1
877	F	28.1	Very low	30.1	Very low	181 Å²	181	139.9 Å²	139.9	79%	0.794	74%	0.737	S	S	*	*			trans	74	142.9	166.2	-53.5	-78.2	0	0	0	116.1
878	E	34.4	Very low	30.8	Very low	172 Å²	172	137 Å²	137	80%	0.804	73%	0.727	S	S	*	*			cis	-151	153.3	0.1	-147.2	155.4	-142	0	0	113
879	S	33.8	Very low	31.3	Very low	111 Å²	111	135.6 Å²	135.6	78%	0.776	73%	0.728	S	S	*	*			trans	-147.8	142.4	167.8	65	0	0	0	0	111.1
880	P	36	Very low	31.6	Very low	113 Å²	113	133.1 Å²	133.1	73%	0.734	72%	0.724	S	S	*	*				-141.7	-171.8	124.8	40.5	-27.2	0	0	0	110.2
881	I	32.9	Very low	31.9	Very low	145 Å²	145	131.6 Å²	131.6	74%	0.744	73%	0.725	S	S	*	*			cis	-139.2	135.5	1	-21.2	163.7	0	0	0	103.9
882	Q	31.1	Very low	32.2	Very low	169 Å²	169	132.2 Å²	132.2	79%	0.79	72%	0.723	S	S	*	*			cis	81	146.9	33.5	-152.9	-174.6	48.8	0	0	114.7
883	T	30.4	Very low	32.2	Very low	105 Å²	105	131.6 Å²	131.6	64%	0.644	73%	0.729	S	S	*	*			trans	77.6	144.7	175.5	74.2	0	0	0	0	116.5
884	N	33	Very low	32.4	Very low	138 Å²	138	130.3 Å²	130.3	74%	0.738	74%	0.735	S	S	*	*			cis	-169.4	169	-7.4	-105.7	10.4	0	0	0	108
885	C	31.1	Very low	32.4	Very low	99 Å²	99	129.6 Å²	129.6	67%	0.669	73%	0.73	S	S	*	*			cis	-170.2	174.4	-23.3	-114.6	0	0	0	0	109.9
886	C	30.6	Very low	32.6	Very low	104 Å²	104	130.1 Å²	130.1	70%	0.703	73%	0.732	S	S	*	*			trans	71.1	146.8	164.7	-63.7	0	0	0	0	118
887	E	35.3	Very low	32.6	Very low	178 Å²	178	137.3 Å²	137.3	83%	0.832	75%	0.748	S	S	*	*			cis	-154.1	170	1.8	-126.6	148.9	-137	0	0	113.5
888	M	38.7	Very low	32.8	Very low	143 Å²	143	133.6 Å²	133.6	70%	0.704	74%	0.744	S	S	*	*			trans	-110.5	168.8	-177.4	-80.1	-111.6	68.4	0	0	111	T890	M888-T890 HydrophobicContact CE-CG2 3.83Å; M888-T890 HydrophobicContact SD-CG2 3.73Å
889	P	36.8	Very low	32.8	Very low	111 Å²	111	132.2 Å²	132.2	72%	0.721	74%	0.742	S	S	*	*				-133.7	170.1	56.4	20.2	6	0	0	0	114
890	T	34	Very low	33.1	Very low	111 Å²	111	133 Å²	133	68%	0.681	74%	0.742	S	S	*	*			cis	86.7	86	25.7	74.3	0	0	0	0	118.2	M888	M888-T890 HydrophobicContact CE-CG2 3.83Å; M888-T890 HydrophobicContact SD-CG2 3.73Å
891	S	34.3	Very low	33.2	Very low	106 Å²	106	132.8 Å²	132.8	74%	0.741	74%	0.735	S	S	*	*			trans	-169.4	154.4	159.1	53.4	0	0	0	0	110.1
892	E	32.7	Very low	33.5	Very low	187 Å²	187	133.2 Å²	133.2	87%	0.874	74%	0.738	S	S	*	*			cis	-152.1	-171.3	-13.8	-120.7	170.1	-73.4	0	0	113.3
893	V	30.5	Very low	33.7	Very low	127 Å²	127	134.1 Å²	134.1	77%	0.77	74%	0.742	S	S	*	*			trans	-98.8	141.6	-162.2	179	0	0	0	0	114.7
894	S	31.4	Very low	34.2	Very low	106 Å²	106	132.6 Å²	132.6	74%	0.741	75%	0.747	S	S	*	*			trans	161	122.8	138.2	-81.1	0	0	0	0	113.8
895	S	30	Very low	34.4	Very low	96 Å²	96	133.8 Å²	133.8	67%	0.671	75%	0.754	S	S	*	*				66.9	135.5	93.3	-67.3	0	0	0	0	115.6
896	Q	32	Very low	34.9	Very low	155 Å²	155	137.1 Å²	137.1	72%	0.724	77%	0.765	S	S	*	*			cis	-169.4	144.2	10.2	-117.8	167.2	54.8	0	0	112.3
897	R	28.5	Very low	35.8	Very low	227 Å²	227	137.6 Å²	137.6	86%	0.857	77%	0.765	S	S	*	*			trans	60.7	161.7	152.9	-66.1	175.2	164.6	-164.7	-7.8	118
898	S	32.3	Very low	35.8	Very low	102 Å²	102	138.4 Å²	138.4	71%	0.713	77%	0.769	S	S	*	*			cis	-143.8	155.6	4.3	-11.3	0	0	0	0	109
899	L	32.8	Very low	36.3	Very low	143 Å²	143	136 Å²	136	75%	0.749	76%	0.762	S	S	*	*				40.4	130.8	95.7	-93.9	74.8	0	0	0	114.1
900	V	40.8	Very low	36.5	Very low	129 Å²	129	138.2 Å²	138.2	78%	0.782	77%	0.767	S	S	*	*			cis	-140.9	-175.1	16.4	-61.8	0	0	0	0	112
901	D	38.2	Very low	37.1	Very low	108 Å²	108	139.8 Å²	139.8	58%	0.578	77%	0.772	S	S	*	*				-172.8	159.6	-61.3	-71.4	-32.3	0	0	0	107.1
902	D	39.3	Very low	37.4	Very low	153 Å²	153	141.5 Å²	141.5	82%	0.818	77%	0.773	S	S	*	*			trans	60.6	156.5	170	-55.2	-38.2	0	0	0	118.8
903	E	35.6	Very low	37.9	Very low	188 Å²	188	139.9 Å²	139.9	88%	0.879	77%	0.77	S	S	*	*			cis	-157.2	155.7	-13.9	-120.5	179.1	171.6	0	0	106.9
904	G	40.9	Very low	38.6	Very low	73 Å²	73	142.2 Å²	142.2	75%	0.753	78%	0.778	S	S	*	*			trans	154.6	81.4	171.1	0	0	0	0	0	117.2
905	D	37.5	Very low	39.3	Very low	164 Å²	164	143.4 Å²	143.4	88%	0.877	78%	0.776	S	S	*	*			trans	-82.3	117.6	163.6	-69.2	-55.8	0	0	0	110.2
906	D	41.8	Very low	40.1	Very low	168 Å²	168	147.2 Å²	147.2	90%	0.898	79%	0.789	S	S	*	*			trans	-122.1	90.3	166.1	-93.8	-45.6	0	0	0	109.6
907	V	47.7	Very low	40.8	Very low	115 Å²	115	146 Å²	146	70%	0.697	79%	0.786	S	S	*	*			trans	-16.3	124.7	171.2	-169.9	0	0	0	0	116.3	V909	V907-V909 HydrophobicContact CB-CG2 4.16Å; V907-V909 HydrophobicContact CG1-CG2 3.81Å; V907-V909 PolarHBondContact O-N 2.93Å; V907-V909 VanDerWaalsContact O-N 3.1Å
908	E	36.9	Very low	41.5	Very low	195 Å²	195	142 Å²	142	91%	0.911	78%	0.781	S	S	*	*			trans	-67.1	102.7	155.6	-68.7	-175.3	152.1	0	0	108.2
909	V	48.1	Very low	42.3	Very low	92 Å²	92	144.7 Å²	144.7	56%	0.558	79%	0.788	S	S	*	*			trans	-89.4	109.7	175.8	-174	0	0	0	0	108.7	V907 D911	V907-V909 HydrophobicContact CB-CG2 4.16Å; V907-V909 HydrophobicContact CG1-CG2 3.81Å; V907-V909 PolarHBondContact O-N 2.93Å; V907-V909 VanDerWaalsContact O-N 3.1Å; V909-D911 HydrophobicContact CG1-CB 4.37Å; V909-D911 PolarHBondContact O-N 3.29Å
910	D	42	Very low	42.7	Very low	158 Å²	158	145 Å²	145	85%	0.845	79%	0.791	S	S	*	*			trans	-70	80.7	161.1	-69.3	-53.6	0	0	0	108.8	D912	D910-D912 PolarHBondContact O-N 2.99Å
911	D	45.3	Very low	42.7	Very low	144 Å²	144	145.6 Å²	145.6	77%	0.77	79%	0.789	S	S	*	*			trans	-81.2	108.3	166.3	-82.3	-39.8	0	0	0	108.7	V909	V909-D911 HydrophobicContact CG1-CB 4.37Å; V909-D911 PolarHBondContact O-N 3.29Å
912	D	41.5	Very low	42.9	Very low	142 Å²	142	148.3 Å²	148.3	76%	0.759	80%	0.798	S	S	*	*			trans	-64.9	176.6	168.1	-77.5	-59.3	0	0	0	111.9	D910	D910-D912 PolarHBondContact O-N 2.99Å
913	D	42.4	Very low	42.9	Very low	153 Å²	153	145 Å²	145	82%	0.818	79%	0.787	S	S	*	*			trans	64.7	83.9	163.8	-58.6	-28.1	0	0	0	117.9
914	D	45.7	Very low	43.3	Very low	176 Å²	176	143.7 Å²	143.7	94%	0.941	78%	0.783	S	S	*	*			trans	-117.5	102.5	157.3	-141.7	-4.2	0	0	0	107.9
915	D	45.8	Very low	43.2	Very low	131 Å²	131	146 Å²	146	70%	0.701	78%	0.783	S	S	*	*			trans	-60.9	149.2	-160.9	-84.6	-62.6	0	0	0	116.5	I917	D915-I917 HydrophobicContact CB-CD1 4.19Å; D915-I917 HydrophobicContact CB-CG1 3.63Å; D915-I917 PolarHBondContact O-N 3.48Å
916	D	46.5	Very low	43.1	Very low	176 Å²	176	141.5 Å²	141.5	94%	0.941	78%	0.775	S	S	*	*			trans	-69.9	65.7	162.9	-105.1	-35.8	0	0	0	110.6	D918	D916-D918 PolarHBondContact O-N 2.89Å
917	I	46.5	Very low	43.2	Very low	130 Å²	130	141.2 Å²	141.2	67%	0.667	77%	0.768	S	S	*	*			trans	-76.7	102.8	175.6	-57.3	-176.3	0	0	0	109.7	D915 D919	D915-I917 HydrophobicContact CB-CD1 4.19Å; D915-I917 HydrophobicContact CB-CG1 3.63Å; D915-I917 PolarHBondContact O-N 3.48Å; I917-D919 PolarHBondContact O-N 3.1Å; I917-D919 VanDerWaalsContact O-N 3.17Å
918	D	43.2	Very low	42.3	Very low	141 Å²	141	141.6 Å²	141.6	75%	0.754	78%	0.775	S	S	*	*			trans	-62.5	109	163.7	-92.6	-48.9	0	0	0	109.4	D916 D920	D916-D918 PolarHBondContact O-N 2.89Å; D918-D920 PolarHBondContact O-N 3.21Å
919	D	48.9	Very low	42.2	Very low	159 Å²	159	135.7 Å²	135.7	85%	0.85	77%	0.766	S	S	*	*			trans	-64.9	70.7	171.2	-87	-38.9	0	0	0	111.6	I917	I917-D919 PolarHBondContact O-N 3.1Å; I917-D919 VanDerWaalsContact O-N 3.17Å
920	D	42	Very low	41.5	Very low	151 Å²	151	137.8 Å²	137.8	81%	0.807	77%	0.773	S	S	*	*			trans	-107.1	62	179.7	-121.2	0.1	0	0	0	111.6	D918	D918-D920 PolarHBondContact O-N 3.21Å
921	D	40.2	Very low	41.2	Very low	141 Å²	141	137.1 Å²	137.1	75%	0.754	77%	0.769	S	S	*	*			trans	-156.7	164.2	165.3	-113.3	-31.7	0	0	0	110.5	S923	D921-S923 PolarHBondContact OD1-N 2.8Å
922	E	43	Very low	40.6	Very low	164 Å²	164	137.8 Å²	137.8	77%	0.766	77%	0.767	S	S	*	*			cis	-100.4	145.8	6.1	-67.8	-171.8	137.4	0	0	114.5	M924	E922-M924 WeakPolarHBondContact OE2-CE 3.38Å
923	S	38.8	Very low	40.1	Very low	83 Å²	83	140.4 Å²	140.4	58%	0.58	77%	0.767	S	S	*	*			trans	-87.4	129	152.9	69.5	0	0	0	0	112.4	D921 T925	D921-S923 PolarHBondContact OD1-N 2.8Å; S923-T925 PolarHBondContact O-N 2.96Å
924	M	43.8	Very low	39.6	Very low	161 Å²	161	140 Å²	140	79%	0.793	76%	0.76	S	S	*	*			trans	-76	115.9	164.2	-79.3	-71.3	108.4	0	0	109.3	E922	E922-M924 WeakPolarHBondContact OE2-CE 3.38Å
925	T	38.5	Very low	38.9	Very low	123 Å²	123	139 Å²	139	76%	0.755	75%	0.749	S	S	*	*			trans	-77.8	158.9	-170	51.1	0	0	0	0	113.7	S923	S923-T925 PolarHBondContact O-N 2.96Å
926	G	36.5	Very low	38.3	Very low	69 Å²	69	141 Å²	141	71%	0.711	75%	0.754	S	S	*	*			trans	-163.2	38.3	-169.3	0	0	0	0	0	117.1
927	Q	44.1	Very low	37.3	Very low	162 Å²	162	140.3 Å²	140.3	76%	0.757	75%	0.749	S	S	*	*			trans	50.6	127.4	160.6	-97.4	67.5	-3.4	0	0	122.1
928	C	29	Very low	36.7	Very low	123 Å²	123	140.1 Å²	140.1	83%	0.831	75%	0.754	S	S	*	*			trans	61.3	144	156.4	-81	0	0	0	0	118.3
929	G	33.6	Very low	36	Very low	71 Å²	71	139.2 Å²	139.2	73%	0.732	76%	0.759	S	S	*	*			cis	137.6	161.5	13.5	0	0	0	0	0	108.8
930	I	35	Very low	35.1	Very low	136 Å²	136	134.7 Å²	134.7	70%	0.697	75%	0.75	S	S	*	*			cis	-158	152.5	1.3	-104.4	159	0	0	0	106.8
931	N	34.9	Very low	34.4	Very low	144 Å²	144	134.4 Å²	134.4	77%	0.77	75%	0.747	S	S	*	*			trans	64.2	126.3	174.2	-63.5	-19.6	0	0	0	117.5
932	H	32.6	Very low	33.9	Very low	157 Å²	157	135.8 Å²	135.8	73%	0.727	75%	0.749	S	S	*	*				83.3	108.8	57.4	-108.4	-3	0	0	0	115.2
933	R	30.3	Very low	33.3	Very low	198 Å²	198	133.7 Å²	133.7	75%	0.747	75%	0.752	S	S	*	*			trans	59.9	148.2	134.3	-86.9	-176.7	170.5	-174.4	-1.5	120.8
934	Q	31.6	Very low	33.1	Very low	143 Å²	143	133.2 Å²	133.2	67%	0.668	76%	0.761	S	S	*	*			trans	83.3	127.3	141.8	-87.5	166.8	-24.3	0	0	120.2
935	H	31.6	Very low	32.6	Very low	155 Å²	155	133.9 Å²	133.9	72%	0.718	77%	0.767	S	S	*	*			trans	77.9	121.1	150.4	-61.6	-53	0	0	0	121.9
936	H	32.8	Very low	32.4	Very low	174 Å²	174	133.5 Å²	133.5	81%	0.806	77%	0.769	S	S	*	*			trans	92.9	130.2	135.9	-98	-89.7	0	0	0	122.1
937	L	26.8	Very low	32.1	Very low	162 Å²	162	136.1 Å²	136.1	85%	0.848	78%	0.775	S	S	*	*			trans	-82.1	121.9	166.4	-62.5	130.1	0	0	0	110.1
938	T	32.9	Very low	31.5	Very low	125 Å²	125	130.1 Å²	130.1	77%	0.767	76%	0.757	S	S	*	*			trans	-152.5	133	146.7	46.3	0	0	0	0	106.1
939	S	28.8	Very low	31.8	Very low	122 Å²	122	125.8 Å²	125.8	85%	0.853	73%	0.733	S	S	*	*				61.5	80.4	53	-58.3	0	0	0	0	112.7
940	G	29.6	Very low	32.1	Very low	64 Å²	64	127.1 Å²	127.1	66%	0.66	73%	0.728	S	S	*	*			trans	-178.6	106.5	172.5	0	0	0	0	0	108.2
941	I	28.9	Very low	32	Very low	145 Å²	145	122.4 Å²	122.4	74%	0.744	71%	0.714	S	S	*	*				77.8	122.4	65	-64.4	167.6	0	0	0	111.4
942	E	29.4	Very low	32	Very low	170 Å²	170	123 Å²	123	79%	0.794	72%	0.717	S	S	*	*			trans	65	117.4	163.7	-76	151.4	-144.4	0	0	117.8
943	S	30.5	Very low	32.3	Very low	120 Å²	120	122.1 Å²	122.1	84%	0.839	72%	0.717	S	S	*	*				80	115.1	78.7	-62.2	0	0	0	0	112.9
944	G	33.5	Very low	32.6	Very low	74 Å²	74	118 Å²	118	76%	0.763	72%	0.719	S	S	*	*			trans	177.8	79.1	178.8	0	0	0	0	0	117.2
945	L	33.7	Very low	32.7	Very low	175 Å²	175	114.6 Å²	114.6	92%	0.916	72%	0.723	S	S	*	*			trans	49.1	118.5	141.4	-59.6	170.1	0	0	0	120.6
946	S	33.5	Very low	32.8	Very low	115 Å²	115	115.7 Å²	115.7	80%	0.804	73%	0.732	S	S	*	*			trans	-103.6	132.3	159.3	174.5	0	0	0	0	111
947	C	30.6	Very low	32.8	Very low	123 Å²	123	110.6 Å²	110.6	83%	0.831	73%	0.727	S	S	*	*			trans	-164.7	151.9	159.5	54.6	0	0	0	0	109.7
948	G	32.4	Very low	33.2	Very low	36 Å²	36	110.1 Å²	110.1	37%	0.371	72%	0.724	S	S	.	*			cis	138.8	137.5	-13.8	0	0	0	0	0	115.3	T439	T439-G948 WeakPolarHBondContact OG1-CA 3.31Å
949	G	35.2	Very low	33.1	Very low	32 Å²	32	110.7 Å²	110.7	33%	0.33	72%	0.723	S	S	.	*			trans	101.1	145.7	152.3	0	0	0	0	0	119.2	N437 D438 T439	N437-G949 WeakPolarHBondContact CB-O 3.49Å; N437-G949 PolarHBondContact ND2-O 2.84Å; D438-G949 CarbonylContact O-C 3.4Å; D438-G949 WeakPolarHBondContact O-CA 3.37Å; D438-G949 PolarHBondContact O-N 3.08Å; T439-G949 PolarHBondContact OG1-N 3.25Å
950	P	39.4	Very low	33.4	Very low	99 Å²	99	110.1 Å²	110.1	64%	0.643	71%	0.714	S	S	*	*				-127.9	165.1	-129.2	18.7	4.1	0	0	0	118.4	D438	D438-P950 WeakPolarHBondContact O-CB 3.05Å; D438-P950 VanDerWaalsContact O-CG 3.23Å; D438-P950 WeakPolarHBondContact O-CG 3.04Å
951	G	32.9	Very low	33.7	Very low	38 Å²	38	114.1 Å²	114.1	39%	0.392	72%	0.72	S	S	.	*				87.4	161.7	120.7	0	0	0	0	0	122.2	I436	I436-G951 PolarHBondContact O-N 2.93Å
952	N	35	Very low	34.1	Very low	155 Å²	155	112.3 Å²	112.3	83%	0.829	72%	0.721	S	S	*	*			trans	68.2	155.8	171.6	-57.7	-30	0	0	0	116.3
953	N	38.1	Very low	34.3	Very low	139 Å²	139	106.5 Å²	106.5	74%	0.743	71%	0.706	S	S	*	*			cis	-156	156.5	11.9	-148.1	-6.4	0	0	0	115
954	S	37.3	Very low	34.6	Very low	112 Å²	112	107.8 Å²	107.8	78%	0.783	70%	0.704	S	S	*	*			trans	49.5	135	150	-69.7	0	0	0	0	124.3
955	G	34.5	Very low	34.8	Very low	72 Å²	72	110.3 Å²	110.3	74%	0.742	70%	0.699	S	S	*	*			trans	164.3	64.6	158	0	0	0	0	0	120.6
956	I	32.9	Very low	35	Very low	177 Å²	177	108.3 Å²	108.3	91%	0.908	69%	0.69	S	S	*	*			trans	23.6	129.9	146	-51	157.7	0	0	0	118.2
957	G	33.6	Very low	35.2	Very low	68 Å²	68	108.6 Å²	108.6	70%	0.701	68%	0.682	S	S	*	*			cis	176.7	-177.7	7.8	0	0	0	0	0	107.9
958	L	34.4	Very low	35.5	Very low	152 Å²	152	109 Å²	109	80%	0.796	68%	0.676	S	S	*	*			cis	-152.1	148.9	14.6	-80.8	156.8	0	0	0	110.2
959	N	32.1	Very low	35.7	Very low	137 Å²	137	115 Å²	115	73%	0.733	70%	0.7	S	S	*	*			trans	53.4	138.9	148.5	-66	4.4	0	0	0	121.4
960	T	34.2	Very low	36	Very low	110 Å²	110	117.2 Å²	117.2	68%	0.675	72%	0.723	S	S	*	*			cis	-160.9	144.9	-0.5	7.1	0	0	0	0	111.4
961	N	35.5	Very low	35.9	Very low	148 Å²	148	118.8 Å²	118.8	79%	0.791	74%	0.736	S	S	*	*			trans	44.4	125.4	155.1	-59.5	-2.6	0	0	0	120.2
962	S	36.7	Very low	36	Very low	107 Å²	107	120.9 Å²	120.9	75%	0.748	76%	0.757	S	S	*	*			cis	82.6	128	46.6	-169.3	0	0	0	0	113.6
963	G	34.3	Very low	36.7	Very low	47 Å²	47	117.7 Å²	117.7	49%	0.485	75%	0.753	S	S	.	*			cis	161.9	173.4	-5.4	0	0	0	0	0	113.6
964	N	37.5	Very low	37.2	Very low	148 Å²	148	121.4 Å²	121.4	79%	0.791	76%	0.762	S	S	*	*			trans	63	154.1	161.9	-76.5	-3.9	0	0	0	120
965	N	36.8	Very low	38	Very low	126 Å²	126	127.4 Å²	127.4	67%	0.674	77%	0.768	S	S	*	*			cis	-169.7	176.6	-30.7	-125.5	-10.6	0	0	0	110.6
966	N	37.6	Very low	39.2	Very low	133 Å²	133	134.6 Å²	134.6	71%	0.711	77%	0.772	S	S	*	*			trans	74.5	149.4	162.2	-58.2	-18.5	0	0	0	117.8
967	N	38.3	Very low	40.8	Very low	121 Å²	121	129 Å²	129	65%	0.647	76%	0.759	S	S	*	*			cis	-156.6	136.1	-6.3	-118.8	-17.8	0	0	0	114.4
968	N	36.8	Very low	42.4	Very low	133 Å²	133	132.2 Å²	132.2	71%	0.711	77%	0.767	S	S	*	*			trans	50.7	150	141.3	-66	-23.3	0	0	0	126.4
969	N	37.1	Very low	44.3	Very low	162 Å²	162	136.1 Å²	136.1	87%	0.866	77%	0.771	S	S	*	*			trans	76	117.6	156.5	-65.6	-15.2	0	0	0	120.4
970	G	41.2	Very low	46.5	Very low	78 Å²	78	134.3 Å²	134.3	80%	0.804	77%	0.765	S	S	*	*			trans	173.1	33.5	175.3	0	0	0	0	0	116	G972	G970-G972 PolarHBondContact O-N 3.3Å
971	S	37.3	Very low	48.9	Very low	132 Å²	132	135.1 Å²	135.1	92%	0.923	77%	0.77	S	S	*	*			trans	-69.5	127.4	-170	-58.9	0	0	0	0	114.3
972	G	35.4	Very low	51.5	Low	81 Å²	81	130.5 Å²	130.5	84%	0.835	75%	0.745	S	S	*	*			trans	116.8	40.6	147.4	0	0	0	0	0	120.6	G970	G970-G972 PolarHBondContact O-N 3.3Å
973	A	49.3	Very low	54.1	Low	89 Å²	89	132.8 Å²	132.8	74%	0.736	74%	0.741	S	S	*	*			trans	-135	92.2	169.6	0	0	0	0	0	114	R975	A973-R975 VanDerWaalsContact C-N 3.31Å; A973-R975 PolarHBondContact O-N 3.19Å
974	K	49	Very low	56.9	Low	216 Å²	216	134 Å²	134	94%	0.939	75%	0.747	S	S	*	*			trans	-71.7	79.9	173.1	-73.1	-174.8	177.7	178.3	0	111.4	R976	K974-R976 PolarHBondContact O-N 3.21Å
975	R	54.1	Low	59.5	Low	239 Å²	239	135.2 Å²	135.2	90%	0.902	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-55.2	124.2	169.3	-74.2	-177.7	168	-177.2	-4.1	109.4	A973	A973-R975 VanDerWaalsContact C-N 3.31Å; A973-R975 PolarHBondContact O-N 3.19Å
976	R	58.9	Low	62.2	Low	222 Å²	222	130.6 Å²	130.6	84%	0.838	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-67.3	131.7	174.2	-68.5	179.3	177.4	159.2	1	108.7	K974	K974-R976 PolarHBondContact O-N 3.21Å
977	G	67.6	Low	65	Low	61 Å²	61	127.2 Å²	127.2	63%	0.629	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-65.8	167.3	-179.7	0	0	0	0	0	113.5
978	P	66.5	Low	67.7	Low	135 Å²	135	124.6 Å²	124.6	88%	0.877	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-54.7	138	-177.7	-26.8	35.6	0	0	0	113.3	T980	P978-T980 PolarHBondContact O-N 2.85Å
979	R	74.9	Confident	70.5	Confident	234 Å²	234	119.5 Å²	119.5	88%	0.883	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-80.6	118.6	177.2	-168.7	177.6	-166.3	158	3.8	110	T981	R979-T981 PolarHBondContact O-N 3.3Å
980	T	77.8	Confident	73.3	Confident	99 Å²	99	111.8 Å²	111.8	61%	0.607	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-57.7	121.6	174.7	53.3	0	0	0	0	111.8	P978 V1018	P978-T980 PolarHBondContact O-N 2.85Å; T980-V1018 HydrophobicContact CG2-CG2 4.17Å
981	T	84.8	Confident	75.9	Confident	126 Å²	126	112.5 Å²	112.5	77%	0.773	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-94.3	137.7	171.6	49.6	0	0	0	0	110.1	R979	R979-T981 PolarHBondContact O-N 3.3Å
982	I	89.5	Confident	78.7	Confident	52 Å²	52	111 Å²	111	27%	0.267	59%	0.586	S	S	.	*			trans	-106	125.9	178	-63.7	172	0	0	0	107.5	Q986 L987 L990 L1014 V1018 W1022	I982-Q986 HydrophobicContact CG2-CB 3.75Å; I982-L987 HydrophobicContact CG2-CB 4.13Å; I982-L987 HydrophobicContact CG2-CD1 4.33Å; I982-L990 HydrophobicContact CG2-CD1 4.4Å; I982-L1014 HydrophobicContact CD1-CD1 4.38Å; I982-L1014 HydrophobicContact CG1-CD1 4.16Å; I982-L1014 HydrophobicContact CG2-CD1 4.21Å; I982-V1018 HydrophobicContact CD1-CG1 4.24Å; I982-W1022 HydrophobicContact CD1-CG 4.34Å
983	K	91.7	Very high	81.5	Confident	154 Å²	154	107.9 Å²	107.9	67%	0.67	55%	0.552	S	S	*	*			trans	-72.4	155.6	179.9	-59.8	178.6	179.3	-179.5	0	110.7	K985 Q986 L987	K983-K985 PolarHBondContact O-N 2.82Å; K983-Q986 HydrophobicContact CB-CG 4.24Å; K983-Q986 WeakPolarHBondContact O-CB 3.36Å; K983-Q986 PolarHBondContact O-N 3.49Å; K983-L987 PolarHBondContact O-N 3.4Å
984	A	92.3	Very high	83.8	Confident	73 Å²	73	104.4 Å²	104.4	60%	0.603	52%	0.521	S	S	*	.	H	α-helix	trans	-49	-58.1	179.8	0	0	0	0	0	113	Q986 L987 D988	A984-Q986 VanDerWaalsContact C-N 3.28Å; A984-Q986 PolarHBondContact O-N 3.43Å; A984-Q986 VanDerWaalsContact O-N 3.15Å; A984-L987 CarbonylContact O-C 3.58Å; A984-L987 WeakPolarHBondContact O-CA 3.47Å; A984-L987 VanDerWaalsContact O-CB 3.24Å; A984-L987 WeakPolarHBondContact O-CB 3.32Å; A984-L987 PolarHBondContact O-N 3.04Å; A984-D988 VanDerWaalsContact O-CG 3.31Å; A984-D988 PolarHBondContact O-N 2.83Å
985	K	92.2	Very high	85.9	Confident	173 Å²	173	98.2 Å²	98.2	75%	0.752	51%	0.51	S	S	*	.	H	α-helix	trans	-52.6	-40.7	177.1	-175	176.7	179	-180	0	113.8	K983 D988 T989	K983-K985 PolarHBondContact O-N 2.82Å; K985-D988 PolarHBondContact O-N 2.99Å; K985-T989 PolarHBondContact O-N 3.28Å; K985-T989 VanDerWaalsContact O-N 3.12Å; K985-T989 PolarHBondContact O-OG1 3.15Å
986	Q	94.7	Very high	87.8	Confident	30 Å²	30	90.6 Å²	90.6	14%	0.14	50%	0.498	C	S	.	.	H	α-helix	trans	-67.7	-39.7	176.7	-62.7	170.8	-42.5	0	0	111.4	I982 K983 A984 D988 L990 T1012 L1014	I982-Q986 HydrophobicContact CG2-CB 3.75Å; K983-Q986 HydrophobicContact CB-CG 4.24Å; K983-Q986 WeakPolarHBondContact O-CB 3.36Å; K983-Q986 PolarHBondContact O-N 3.49Å; A984-Q986 VanDerWaalsContact C-N 3.28Å; A984-Q986 PolarHBondContact O-N 3.43Å; A984-Q986 VanDerWaalsContact O-N 3.15Å; Q986-D988 VanDerWaalsContact C-N 3.28Å; Q986-D988 PolarHBondContact O-N 2.88Å; Q986-L990 WeakPolarHBondContact O-CB 3.29Å; Q986-L990 WeakPolarHBondContact O-CD1 3.47Å; Q986-L990 WeakPolarHBondContact O-CG 3.37Å; Q986-L990 PolarHBondContact O-N 3.26Å; Q986-L990 VanDerWaalsContact O-N 3.12Å; Q986-T1012 HydrophobicContact CB-CG2 4.42Å; Q986-T1012 PolarHBondContact NE2-O 3.02Å; Q986-L1014 HydrophobicContact CB-CD1 4.22Å
987	L	95.1	Very high	89.4	Confident	62 Å²	62	82.9 Å²	82.9	33%	0.325	48%	0.475	S	S	.	.	H	α-helix	trans	-62.9	-37.1	175.6	-168.4	75.7	0	0	0	111.1	I982 K983 A984 L990 K991 W1022	I982-L987 HydrophobicContact CG2-CB 4.13Å; I982-L987 HydrophobicContact CG2-CD1 4.33Å; K983-L987 PolarHBondContact O-N 3.4Å; A984-L987 CarbonylContact O-C 3.58Å; A984-L987 WeakPolarHBondContact O-CA 3.47Å; A984-L987 VanDerWaalsContact O-CB 3.24Å; A984-L987 WeakPolarHBondContact O-CB 3.32Å; A984-L987 PolarHBondContact O-N 3.04Å; L987-L990 PolarHBondContact O-N 3.16Å; L987-K991 VanDerWaalsContact O-CG 3.3Å; L987-K991 WeakPolarHBondContact O-CG 3.27Å; L987-K991 PolarHBondContact O-N 2.99Å; L987-W1022 HydrophobicContact CD1-CZ2 4.33Å
988	D	95.6	Very high	90.6	Very high	66 Å²	66	82.7 Å²	82.7	35%	0.353	46%	0.463	S	S	.	.	H	α-helix	trans	-74.4	-44.5	-177.6	-61.2	-39.7	0	0	0	112.3	A984 K985 Q986 L990 K991 T992	A984-D988 VanDerWaalsContact O-CG 3.31Å; A984-D988 PolarHBondContact O-N 2.83Å; K985-D988 PolarHBondContact O-N 2.99Å; Q986-D988 VanDerWaalsContact C-N 3.28Å; Q986-D988 PolarHBondContact O-N 2.88Å; D988-L990 VanDerWaalsContact C-N 3.25Å; D988-L990 PolarHBondContact O-N 2.97Å; D988-K991 WeakPolarHBondContact O-CB 3.49Å; D988-K991 PolarHBondContact O-N 2.78Å; D988-K991 VanDerWaalsContact O-N 3.13Å; D988-K991 WeakPolarHBondContact OD1-CD 3.29Å; D988-K991 WeakPolarHBondContact OD1-CE 3.28Å; D988-K991 IonicContact OD1-NZ 3.9Å; D988-K991 PolarHBondContact OD1-NZ 3.01Å; D988-T992 PolarHBondContact O-N 2.86Å; D988-T992 PolarHBondContact O-OG1 3.18Å
989	T	95.4	Very high	91.9	Very high	25 Å²	25	84.9 Å²	84.9	15%	0.153	46%	0.459	C	S	.	.	H	α-helix	trans	-50.7	-47.2	165.8	-68.7	0	0	0	0	111	K985 T992 A993 L1008 E1011 T1012	K985-T989 PolarHBondContact O-N 3.28Å; K985-T989 VanDerWaalsContact O-N 3.12Å; K985-T989 PolarHBondContact O-OG1 3.15Å; T989-T992 PolarHBondContact O-N 3.42Å; T989-A993 WeakPolarHBondContact O-CB 3.41Å; T989-A993 PolarHBondContact O-N 3.5Å; T989-L1008 HydrophobicContact CG2-CD2 3.64Å; T989-E1011 WeakPolarHBondContact CG2-OE1 3.02Å; T989-E1011 VanDerWaalsContact CG2-OE2 3.29Å; T989-E1011 WeakPolarHBondContact CG2-OE2 3.2Å; T989-E1011 PolarHBondContact OG1-OE1 2.96Å; T989-T1012 HydrophobicContact CG2-CG2 3.63Å
990	L	96.7	Very high	92.7	Very high	0 Å²	0	74 Å²	74	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-66.8	-36.1	179.3	-71	169.7	0	0	0	113.1	I982 Q986 L987 D988 F994 T1012 L1014 I1019 W1022 F1023	I982-L990 HydrophobicContact CG2-CD1 4.4Å; Q986-L990 WeakPolarHBondContact O-CB 3.29Å; Q986-L990 WeakPolarHBondContact O-CD1 3.47Å; Q986-L990 WeakPolarHBondContact O-CG 3.37Å; Q986-L990 PolarHBondContact O-N 3.26Å; Q986-L990 VanDerWaalsContact O-N 3.12Å; L987-L990 PolarHBondContact O-N 3.16Å; D988-L990 VanDerWaalsContact C-N 3.25Å; D988-L990 PolarHBondContact O-N 2.97Å; L990-F994 VanDerWaalsContact O-CB 3.31Å; L990-F994 WeakPolarHBondContact O-CB 3.14Å; L990-F994 PolarHBondContact O-N 2.72Å; L990-T1012 HydrophobicContact CG-CG2 4.41Å; L990-L1014 HydrophobicContact CD1-CD1 3.91Å; L990-I1019 HydrophobicContact CD2-CD1 4.36Å; L990-I1019 HydrophobicContact CD2-CG1 4.23Å; L990-I1019 HydrophobicContact CD2-CG2 4.02Å; L990-W1022 VanDerWaalsContact C-CH2 3.42Å; L990-W1022 HydrophobicContact CB-CD2 4.04Å; L990-W1022 HydrophobicContact CB-CE3 3.98Å; L990-W1022 HydrophobicContact CB-CH2 3.72Å; L990-W1022 HydrophobicContact CB-CZ2 3.74Å; L990-W1022 HydrophobicContact CB-CZ3 3.83Å; L990-W1022 HydrophobicContact CD1-CD2 3.98Å; L990-W1022 HydrophobicContact CD1-CE3 4.47Å; L990-W1022 HydrophobicContact CD1-CG 4Å; L990-W1022 HydrophobicContact CD2-CE3 4.26Å; L990-W1022 HydrophobicContact CG-CD2 4.43Å; L990-W1022 HydrophobicContact CG-CE3 4.48Å; L990-W1022 WeakPolarHBondContact O-CH2 2.92Å; L990-W1022 WeakPolarHBondContact O-CZ3 3.13Å; L990-F1023 HydrophobicContact CD2-CD2 4.46Å; L990-F1023 HydrophobicContact CD2-CE2 3.79Å
991	K	95.6	Very high	93.6	Very high	93 Å²	93	73.2 Å²	73.2	40%	0.404	41%	0.414	S	S	.	.	H	α-helix	trans	-62.3	-48.8	172.7	-74.4	169.8	-166.7	166.5	0	111	L987 D988 F994 A995	L987-K991 VanDerWaalsContact O-CG 3.3Å; L987-K991 WeakPolarHBondContact O-CG 3.27Å; L987-K991 PolarHBondContact O-N 2.99Å; D988-K991 WeakPolarHBondContact O-CB 3.49Å; D988-K991 PolarHBondContact O-N 2.78Å; D988-K991 VanDerWaalsContact O-N 3.13Å; D988-K991 WeakPolarHBondContact OD1-CD 3.29Å; D988-K991 WeakPolarHBondContact OD1-CE 3.28Å; D988-K991 IonicContact OD1-NZ 3.9Å; D988-K991 PolarHBondContact OD1-NZ 3.01Å; K991-F994 WeakPolarHBondContact O-CB 3.44Å; K991-F994 PolarHBondContact O-N 3.45Å; K991-F994 VanDerWaalsContact O-N 3.14Å; K991-A995 PolarHBondContact O-N 2.85Å
992	T	95.2	Very high	94	Very high	102 Å²	102	75.1 Å²	75.1	63%	0.626	41%	0.407	S	S	*	.	H	α-helix	trans	-61.9	-45.9	-179.5	-57.5	0	0	0	0	110.8	D988 T989 F994 A995 A996	D988-T992 PolarHBondContact O-N 2.86Å; D988-T992 PolarHBondContact O-OG1 3.18Å; T989-T992 PolarHBondContact O-N 3.42Å; T992-F994 VanDerWaalsContact C-N 3.28Å; T992-F994 PolarHBondContact O-N 2.82Å; T992-A995 PolarHBondContact O-N 2.84Å; T992-A996 PolarHBondContact O-N 3.24Å
993	A	95.4	Very high	94.2	Very high	15 Å²	15	79.5 Å²	79.5	12%	0.124	43%	0.426	C	S	.	.	H	α-helix	trans	-64	-31.2	174.9	0	0	0	0	0	113.4	T989 T997 L1008 F1023	T989-A993 WeakPolarHBondContact O-CB 3.41Å; T989-A993 PolarHBondContact O-N 3.5Å; A993-T997 PolarHBondContact O-N 3.14Å; A993-L1008 HydrophobicContact CB-CD1 3.67Å; A993-L1008 HydrophobicContact CB-CD2 3.69Å; A993-L1008 HydrophobicContact CB-CG 4.32Å; A993-F1023 HydrophobicContact CB-CZ 4.05Å
994	F	96.2	Very high	94.3	Very high	16 Å²	16	74.7 Å²	74.7	7%	0.07	41%	0.409	C	S	.	.	H	α-helix	trans	-70.3	-37.9	173.4	-170.6	-90.1	0	0	0	113.2	L990 K991 T992 A996 T997 P998 W1022 F1023 R1026 R1027 E1030	L990-F994 VanDerWaalsContact O-CB 3.31Å; L990-F994 WeakPolarHBondContact O-CB 3.14Å; L990-F994 PolarHBondContact O-N 2.72Å; K991-F994 WeakPolarHBondContact O-CB 3.44Å; K991-F994 PolarHBondContact O-N 3.45Å; K991-F994 VanDerWaalsContact O-N 3.14Å; T992-F994 VanDerWaalsContact C-N 3.28Å; T992-F994 PolarHBondContact O-N 2.82Å; F994-A996 VanDerWaalsContact C-N 3.33Å; F994-T997 CarbonylContact O-C 3.56Å; F994-P998 HydrophobicContact CD2-CB 4.33Å; F994-P998 HydrophobicContact CE1-CB 4.16Å; F994-P998 HydrophobicContact CE2-CB 3.82Å; F994-P998 HydrophobicContact CZ-CB 3.72Å; F994-W1022 HydrophobicContact CB-CH2 3.95Å; F994-W1022 HydrophobicContact CB-CZ3 3.94Å; F994-W1022 HydrophobicContact CD2-CZ3 4.05Å; F994-W1022 HydrophobicContact CG-CH2 4.4Å; F994-W1022 HydrophobicContact CG-CZ3 4.32Å; F994-F1023 HydrophobicContact CB-CE1 4.01Å; F994-F1023 HydrophobicContact CB-CZ 4.49Å; F994-F1023 AromaticContact CD2-CD1 3.62Å; F994-F1023 HydrophobicContact CD2-CD1 3.62Å; F994-F1023 AromaticContact CD2-CE1 3.73Å; F994-F1023 HydrophobicContact CD2-CE1 3.73Å; F994-F1023 HydrophobicContact CE2-CD1 4.27Å; F994-F1023 HydrophobicContact CG-CE1 4.36Å; F994-R1026 HydrophobicContact CD1-CG 3.91Å; F994-R1026 HydrophobicContact CD2-CB 4.02Å; F994-R1026 HydrophobicContact CD2-CG 3.39Å; F994-R1026 HydrophobicContact CE1-CG 3.83Å; F994-R1026 HydrophobicContact CE2-CB 3.82Å; F994-R1026 HydrophobicContact CE2-CG 3.31Å; F994-R1026 HydrophobicContact CG-CG 3.71Å; F994-R1026 HydrophobicContact CZ-CB 4.37Å; F994-R1026 HydrophobicContact CZ-CG 3.55Å; F994-R1027 HydrophobicContact CE2-CG 3.75Å; F994-R1027 HydrophobicContact CZ-CG 4.05Å; F994-E1030 WeakPolarHBondContact CE1-OE2 3.44Å; F994-E1030 VanDerWaalsContact CZ-OE2 3.29Å; F994-E1030 WeakPolarHBondContact CZ-OE2 3.21Å
995	A	94.1	Very high	94.5	Very high	86 Å²	86	74.1 Å²	74.1	71%	0.711	39%	0.392	S	S	*	.	H	α-helix	trans	-66	-36.8	174.3	0	0	0	0	0	111.5	K991 T992	K991-A995 PolarHBondContact O-N 2.85Å; T992-A995 PolarHBondContact O-N 2.84Å
996	A	94	Very high	94.7	Very high	79 Å²	79	69.2 Å²	69.2	65%	0.653	37%	0.371	S	S	*	.	H	α-helix	trans	-73	-49	174.7	0	0	0	0	0	113.2	T992 F994	T992-A996 PolarHBondContact O-N 3.24Å; F994-A996 VanDerWaalsContact C-N 3.33Å
997	T	91.8	Very high	94.7	Very high	59 Å²	59	71 Å²	71	36%	0.362	39%	0.388	S	S	.	.			trans	-143.3	105.7	177.3	55.5	0	0	0	0	112	A993 F994 K999 P1000	A993-T997 PolarHBondContact O-N 3.14Å; F994-T997 CarbonylContact O-C 3.56Å; T997-K999 VanDerWaalsContact C-N 3.26Å; T997-K999 PolarHBondContact O-N 2.92Å; T997-P1000 WeakPolarHBondContact O-CD 3.08Å
998	P	92.5	Very high	94.7	Very high	58 Å²	58	68.6 Å²	68.6	38%	0.377	38%	0.375	S	S	.	.	S	Bend	trans	-71.6	-19.7	179.2	27	-34.4	0	0	0	113.1	F994 P1000 R1027	F994-P998 HydrophobicContact CD2-CB 4.33Å; F994-P998 HydrophobicContact CE1-CB 4.16Å; F994-P998 HydrophobicContact CE2-CB 3.82Å; F994-P998 HydrophobicContact CZ-CB 3.72Å; P998-P1000 WeakPolarHBondContact O-CD 3.43Å; P998-R1027 WeakPolarHBondContact O-CD 3.37Å; P998-R1027 PolarHBondContact O-NH1 3.24Å
999	K	93.8	Very high	94.8	Very high	180 Å²	180	66.3 Å²	66.3	78%	0.783	37%	0.365	S	S	*	.	S	Bend	trans	-111.9	72.6	169.4	-67.4	-178.7	-178.5	177.2	0	110.1	T997	T997-K999 VanDerWaalsContact C-N 3.26Å; T997-K999 PolarHBondContact O-N 2.92Å
1000	P	93.3	Very high	94.7	Very high	7 Å²	7	72.4 Å²	72.4	5%	0.045	39%	0.392	C	S	.	.			trans	-68.8	138.8	-175.1	30.7	-38.7	0	0	0	112.4	T997 P998 V1004 R1005 F1023	T997-P1000 WeakPolarHBondContact O-CD 3.08Å; P998-P1000 WeakPolarHBondContact O-CD 3.43Å; P1000-V1004 HydrophobicContact CB-CB 4.04Å; P1000-V1004 HydrophobicContact CB-CG1 3.65Å; P1000-R1005 HydrophobicContact CB-CG 3.98Å; P1000-R1005 HydrophobicContact CG-CG 3.66Å; P1000-R1005 PolarHBondContact O-NE 3.33Å; P1000-F1023 HydrophobicContact CB-CE1 4.27Å; P1000-F1023 HydrophobicContact CB-CZ 4.4Å; P1000-F1023 HydrophobicContact CG-CB 4.5Å; P1000-F1023 HydrophobicContact CG-CD1 3.47Å; P1000-F1023 VanDerWaalsContact CG-CD1 3.47Å; P1000-F1023 HydrophobicContact CG-CD2 4.01Å; P1000-F1023 HydrophobicContact CG-CE1 3.5Å; P1000-F1023 VanDerWaalsContact CG-CE1 3.5Å; P1000-F1023 HydrophobicContact CG-CE2 4.05Å; P1000-F1023 HydrophobicContact CG-CG 3.74Å; P1000-F1023 HydrophobicContact CG-CZ 3.81Å
1001	T	95.1	Very high	94.5	Very high	82 Å²	82	77.9 Å²	77.9	50%	0.503	42%	0.417	S	S	.	.			trans	-61.1	171.3	177.3	71.2	0	0	0	0	111.8	V1004 R1005	T1001-V1004 PolarHBondContact O-N 2.82Å; T1001-V1004 WeakPolarHBondContact OG1-CG2 3.2Å; T1001-V1004 PolarHBondContact OG1-N 2.73Å; T1001-R1005 WeakPolarHBondContact O-CG 3.37Å; T1001-R1005 PolarHBondContact O-N 3.5Å; T1001-R1005 VanDerWaalsContact O-N 3.09Å; T1001-R1005 PolarHBondContact O-NE 3.2Å
1002	R	93.3	Very high	94.4	Very high	165 Å²	165	74 Å²	74	62%	0.623	40%	0.402	S	S	*	.	H	α-helix	trans	-55.4	-52.2	173.3	177.5	-179.4	166.5	177.7	-4.3	110.9	V1004 R1005 E1006	R1002-V1004 PolarHBondContact O-N 2.96Å; R1002-R1005 PolarHBondContact O-N 3.49Å; R1002-R1005 VanDerWaalsContact O-N 3.15Å; R1002-E1006 IonicContact NE-OE2 3.57Å; R1002-E1006 PolarHBondContact NE-OE2 3.44Å; R1002-E1006 IonicContact NH2-OE2 3.29Å; R1002-E1006 PolarHBondContact O-N 3.42Å
1003	H	94.8	Very high	94.4	Very high	145 Å²	145	72.3 Å²	72.3	67%	0.671	40%	0.404	S	S	*	.	H	α-helix	trans	-61	-41	-178	-59.2	120.3	0	0	0	112.9	R1005 E1006 S1007	H1003-R1005 PolarHBondContact O-N 3.26Å; H1003-E1006 PolarHBondContact O-N 3.48Å; H1003-E1006 VanDerWaalsContact O-N 3.16Å; H1003-S1007 PolarHBondContact O-N 2.91Å
1004	V	94.2	Very high	94.3	Very high	53 Å²	53	72.6 Å²	72.6	32%	0.321	40%	0.403	S	S	.	.	H	α-helix	trans	-63.3	-42.8	175.3	173.2	0	0	0	0	111	P1000 T1001 R1002 E1006 S1007 L1008	P1000-V1004 HydrophobicContact CB-CB 4.04Å; P1000-V1004 HydrophobicContact CB-CG1 3.65Å; T1001-V1004 PolarHBondContact O-N 2.82Å; T1001-V1004 WeakPolarHBondContact OG1-CG2 3.2Å; T1001-V1004 PolarHBondContact OG1-N 2.73Å; R1002-V1004 PolarHBondContact O-N 2.96Å; V1004-E1006 VanDerWaalsContact C-N 3.27Å; V1004-E1006 PolarHBondContact O-N 3.4Å; V1004-S1007 PolarHBondContact O-N 3.4Å; V1004-L1008 HydrophobicContact CG1-CD1 3.87Å; V1004-L1008 HydrophobicContact CG1-CG 4.48Å; V1004-L1008 WeakPolarHBondContact O-CB 3.45Å; V1004-L1008 WeakPolarHBondContact O-CD1 3.23Å; V1004-L1008 WeakPolarHBondContact O-CG 3.49Å; V1004-L1008 PolarHBondContact O-N 3.26Å
1005	R	95.3	Very high	94.2	Very high	60 Å²	60	75.2 Å²	75.2	23%	0.226	42%	0.423	C	S	.	.	H	α-helix	trans	-66.3	-27.8	174.7	-71.3	-178.6	-85.1	140.6	-7.5	113.3	P1000 T1001 R1002 H1003 A1009 M1016 I1019	P1000-R1005 HydrophobicContact CB-CG 3.98Å; P1000-R1005 HydrophobicContact CG-CG 3.66Å; P1000-R1005 PolarHBondContact O-NE 3.33Å; T1001-R1005 WeakPolarHBondContact O-CG 3.37Å; T1001-R1005 PolarHBondContact O-N 3.5Å; T1001-R1005 VanDerWaalsContact O-N 3.09Å; T1001-R1005 PolarHBondContact O-NE 3.2Å; R1002-R1005 PolarHBondContact O-N 3.49Å; R1002-R1005 VanDerWaalsContact O-N 3.15Å; H1003-R1005 PolarHBondContact O-N 3.26Å; R1005-A1009 WeakPolarHBondContact O-CB 3.42Å; R1005-A1009 PolarHBondContact O-N 3.22Å; R1005-A1009 VanDerWaalsContact O-N 3.09Å; R1005-M1016 HydrophobicContact CB-CE 4.27Å; R1005-M1016 HydrophobicContact CB-SD 3.61Å; R1005-I1019 HydrophobicContact CB-CG2 4.43Å; R1005-I1019 HydrophobicContact CG-CG2 4.22Å
1006	E	95.9	Very high	94.1	Very high	70 Å²	70	73.8 Å²	73.8	33%	0.327	40%	0.403	S	S	.	.	H	α-helix	trans	-75.3	-44.4	177.6	-148.9	150.6	163	0	0	111.4	R1002 H1003 V1004 A1009 Q1010 M1016	R1002-E1006 IonicContact NE-OE2 3.57Å; R1002-E1006 PolarHBondContact NE-OE2 3.44Å; R1002-E1006 IonicContact NH2-OE2 3.29Å; R1002-E1006 PolarHBondContact O-N 3.42Å; H1003-E1006 PolarHBondContact O-N 3.48Å; H1003-E1006 VanDerWaalsContact O-N 3.16Å; V1004-E1006 VanDerWaalsContact C-N 3.27Å; V1004-E1006 PolarHBondContact O-N 3.4Å; E1006-A1009 WeakPolarHBondContact O-CB 3.35Å; E1006-A1009 PolarHBondContact O-N 3.33Å; E1006-Q1010 WeakPolarHBondContact O-CG 3.38Å; E1006-Q1010 PolarHBondContact O-N 3.36Å; E1006-Q1010 VanDerWaalsContact O-N 3.14Å; E1006-M1016 HydrophobicContact CB-CE 3.61Å; E1006-M1016 HydrophobicContact CG-CE 3.71Å
1007	S	95	Very high	94.1	Very high	69 Å²	69	78.9 Å²	78.9	48%	0.483	41%	0.405	S	S	.	.	H	α-helix	trans	-58.1	-49	170.8	-177.5	0	0	0	0	111.6	H1003 V1004 A1009 Q1010 E1011	H1003-S1007 PolarHBondContact O-N 2.91Å; V1004-S1007 PolarHBondContact O-N 3.4Å; S1007-A1009 PolarHBondContact O-N 3.43Å; S1007-Q1010 WeakPolarHBondContact O-CB 3.44Å; S1007-Q1010 PolarHBondContact O-N 3.4Å; S1007-Q1010 VanDerWaalsContact O-N 3.09Å; S1007-E1011 PolarHBondContact O-N 2.78Å
1008	L	96.3	Very high	94.2	Very high	10 Å²	10	77.3 Å²	77.3	5%	0.052	40%	0.395	C	S	.	.	H	α-helix	trans	-63	-29.5	177.1	-65.9	165.7	0	0	0	112.9	T989 A993 V1004 T1012 I1019 F1023	T989-L1008 HydrophobicContact CG2-CD2 3.64Å; A993-L1008 HydrophobicContact CB-CD1 3.67Å; A993-L1008 HydrophobicContact CB-CD2 3.69Å; A993-L1008 HydrophobicContact CB-CG 4.32Å; V1004-L1008 HydrophobicContact CG1-CD1 3.87Å; V1004-L1008 HydrophobicContact CG1-CG 4.48Å; V1004-L1008 WeakPolarHBondContact O-CB 3.45Å; V1004-L1008 WeakPolarHBondContact O-CD1 3.23Å; V1004-L1008 WeakPolarHBondContact O-CG 3.49Å; V1004-L1008 PolarHBondContact O-N 3.26Å; L1008-T1012 WeakPolarHBondContact O-CB 3.44Å; L1008-T1012 WeakPolarHBondContact O-CG2 3.3Å; L1008-T1012 PolarHBondContact O-N 2.92Å; L1008-T1012 PolarHBondContact O-OG1 3.39Å; L1008-I1019 HydrophobicContact CB-CD1 3.8Å; L1008-I1019 HydrophobicContact CB-CG2 4.49Å; L1008-I1019 VanDerWaalsContact O-CD1 3.32Å; L1008-I1019 WeakPolarHBondContact O-CD1 3.46Å; L1008-F1023 HydrophobicContact CD1-CE2 3.93Å; L1008-F1023 HydrophobicContact CD1-CZ 4.06Å
1009	A	96.2	Very high	94.4	Very high	18 Å²	18	74.5 Å²	74.5	15%	0.149	38%	0.377	C	S	.	.	H	α-helix	trans	-68.5	-39.1	175.2	0	0	0	0	0	111.6	R1005 E1006 S1007 G1013 L1014 I1019	R1005-A1009 WeakPolarHBondContact O-CB 3.42Å; R1005-A1009 PolarHBondContact O-N 3.22Å; R1005-A1009 VanDerWaalsContact O-N 3.09Å; E1006-A1009 WeakPolarHBondContact O-CB 3.35Å; E1006-A1009 PolarHBondContact O-N 3.33Å; S1007-A1009 PolarHBondContact O-N 3.43Å; A1009-G1013 WeakPolarHBondContact O-CA 3.31Å; A1009-G1013 PolarHBondContact O-N 2.79Å; A1009-G1013 VanDerWaalsContact O-N 3.09Å; A1009-L1014 VanDerWaalsContact CA-O 3.29Å; A1009-L1014 WeakPolarHBondContact CA-O 3.24Å; A1009-L1014 VanDerWaalsContact CB-O 3.3Å; A1009-L1014 WeakPolarHBondContact CB-O 3.46Å; A1009-L1014 PolarHBondContact O-N 2.89Å; A1009-I1019 VanDerWaalsContact CA-CD1 3.41Å; A1009-I1019 HydrophobicContact CB-CD1 3.96Å; A1009-I1019 VanDerWaalsContact N-CD1 3.28Å
1010	Q	94.6	Very high	94.4	Very high	153 Å²	153	69.3 Å²	69.3	72%	0.715	36%	0.356	S	S	*	.	H	α-helix	trans	-70	-48.4	175	-63.6	170.4	15.6	0	0	111.2	E1006 S1007	E1006-Q1010 WeakPolarHBondContact O-CG 3.38Å; E1006-Q1010 PolarHBondContact O-N 3.36Å; E1006-Q1010 VanDerWaalsContact O-N 3.14Å; S1007-Q1010 WeakPolarHBondContact O-CB 3.44Å; S1007-Q1010 PolarHBondContact O-N 3.4Å; S1007-Q1010 VanDerWaalsContact O-N 3.09Å
1011	E	92.8	Very high	94.5	Very high	116 Å²	116	71.6 Å²	71.6	54%	0.542	37%	0.37	S	S	.	.	H	α-helix	trans	-64.8	-45.1	-178.5	-166.2	-153.7	138.8	0	0	112.7	T989 S1007	T989-E1011 WeakPolarHBondContact CG2-OE1 3.02Å; T989-E1011 VanDerWaalsContact CG2-OE2 3.29Å; T989-E1011 WeakPolarHBondContact CG2-OE2 3.2Å; T989-E1011 PolarHBondContact OG1-OE1 2.96Å; S1007-E1011 PolarHBondContact O-N 2.78Å
1012	T	92.8	Very high	94.5	Very high	12 Å²	12	69.2 Å²	69.2	7%	0.074	35%	0.351	C	S	.	.	H	α-helix	trans	-85.1	-16.3	-177.7	65.2	0	0	0	0	113.6	Q986 T989 L990 L1008 L1014	Q986-T1012 HydrophobicContact CB-CG2 4.42Å; Q986-T1012 PolarHBondContact NE2-O 3.02Å; T989-T1012 HydrophobicContact CG2-CG2 3.63Å; L990-T1012 HydrophobicContact CG-CG2 4.41Å; L1008-T1012 WeakPolarHBondContact O-CB 3.44Å; L1008-T1012 WeakPolarHBondContact O-CG2 3.3Å; L1008-T1012 PolarHBondContact O-N 2.92Å; L1008-T1012 PolarHBondContact O-OG1 3.39Å; T1012-L1014 PolarHBondContact O-N 2.9Å; T1012-L1014 WeakPolarHBondContact OG1-CB 3.26Å; T1012-L1014 WeakPolarHBondContact OG1-CG 3.29Å; T1012-L1014 PolarHBondContact OG1-N 2.94Å
1013	G	94.2	Very high	94.7	Very high	65 Å²	65	61.4 Å²	61.4	67%	0.67	32%	0.322	S	S	*	.			trans	65.7	21	-170.3	0	0	0	0	0	113.8	A1009	A1009-G1013 WeakPolarHBondContact O-CA 3.31Å; A1009-G1013 PolarHBondContact O-N 2.79Å; A1009-G1013 VanDerWaalsContact O-N 3.09Å
1014	L	93.8	Very high	94.6	Very high	22 Å²	22	58.7 Å²	58.7	12%	0.115	31%	0.31	C	S	.	.			trans	-98.6	145.7	174.7	-61.7	173.8	0	0	0	109.9	I982 Q986 L990 A1009 T1012 V1018 I1019	I982-L1014 HydrophobicContact CD1-CD1 4.38Å; I982-L1014 HydrophobicContact CG1-CD1 4.16Å; I982-L1014 HydrophobicContact CG2-CD1 4.21Å; Q986-L1014 HydrophobicContact CB-CD1 4.22Å; L990-L1014 HydrophobicContact CD1-CD1 3.91Å; A1009-L1014 VanDerWaalsContact CA-O 3.29Å; A1009-L1014 WeakPolarHBondContact CA-O 3.24Å; A1009-L1014 VanDerWaalsContact CB-O 3.3Å; A1009-L1014 WeakPolarHBondContact CB-O 3.46Å; A1009-L1014 PolarHBondContact O-N 2.89Å; T1012-L1014 PolarHBondContact O-N 2.9Å; T1012-L1014 WeakPolarHBondContact OG1-CB 3.26Å; T1012-L1014 WeakPolarHBondContact OG1-CG 3.29Å; T1012-L1014 PolarHBondContact OG1-N 2.94Å; L1014-V1018 HydrophobicContact CB-CB 4.47Å; L1014-V1018 HydrophobicContact CB-CG1 4.27Å; L1014-V1018 HydrophobicContact CD1-CG1 4.32Å; L1014-V1018 HydrophobicContact CD2-CG1 4.37Å; L1014-I1019 HydrophobicContact CB-CD1 4.23Å; L1014-I1019 HydrophobicContact CB-CG1 3.98Å
1015	S	94.2	Very high	94.7	Very high	70 Å²	70	61 Å²	61	49%	0.49	32%	0.32	S	S	.	.			trans	-65.7	146.9	178	73	0	0	0	0	111.8	R1017 V1018 I1019	S1015-R1017 PolarHBondContact O-N 2.92Å; S1015-V1018 WeakPolarHBondContact O-CA 3.13Å; S1015-V1018 WeakPolarHBondContact O-CB 3.2Å; S1015-V1018 PolarHBondContact O-N 3.35Å; S1015-V1018 WeakPolarHBondContact OG-CG2 3.42Å; S1015-V1018 PolarHBondContact OG-N 3.33Å; S1015-I1019 PolarHBondContact O-N 2.84Å; S1015-I1019 VanDerWaalsContact O-N 3.08Å
1016	M	92.4	Very high	94.7	Very high	57 Å²	57	63.5 Å²	63.5	28%	0.281	33%	0.33	S	S	.	.	H	α-helix	trans	-43.2	-40.3	173.8	175	65.2	74.8	0	0	112.6	R1005 E1006 I1019 Q1020	R1005-M1016 HydrophobicContact CB-CE 4.27Å; R1005-M1016 HydrophobicContact CB-SD 3.61Å; E1006-M1016 HydrophobicContact CB-CE 3.61Å; E1006-M1016 HydrophobicContact CG-CE 3.71Å; M1016-I1019 PolarHBondContact O-N 2.8Å; M1016-Q1020 WeakPolarHBondContact O-CB 3.23Å; M1016-Q1020 PolarHBondContact O-N 3.02Å
1017	R	93.6	Very high	94.6	Very high	185 Å²	185	64.2 Å²	64.2	70%	0.698	33%	0.329	S	S	*	.	H	α-helix	trans	-68.5	-40.6	177.7	-168.9	176.2	-173.5	84.5	-1.3	113	S1015 I1019 V1021	S1015-R1017 PolarHBondContact O-N 2.92Å; R1017-I1019 VanDerWaalsContact C-N 3.32Å; R1017-V1021 HydrophobicContact CG-CG2 4.48Å; R1017-V1021 VanDerWaalsContact O-CB 3.31Å; R1017-V1021 WeakPolarHBondContact O-CB 3.47Å; R1017-V1021 VanDerWaalsContact O-CG2 3.24Å; R1017-V1021 WeakPolarHBondContact O-CG2 2.98Å; R1017-V1021 PolarHBondContact O-N 3.26Å
1018	V	94.7	Very high	94.3	Very high	26 Å²	26	62.9 Å²	62.9	16%	0.158	32%	0.32	C	S	.	.	H	α-helix	trans	-63.6	-40.5	175.5	170	0	0	0	0	110.4	T980 I982 L1014 S1015 V1021 W1022	T980-V1018 HydrophobicContact CG2-CG2 4.17Å; I982-V1018 HydrophobicContact CD1-CG1 4.24Å; L1014-V1018 HydrophobicContact CB-CB 4.47Å; L1014-V1018 HydrophobicContact CB-CG1 4.27Å; L1014-V1018 HydrophobicContact CD1-CG1 4.32Å; L1014-V1018 HydrophobicContact CD2-CG1 4.37Å; S1015-V1018 WeakPolarHBondContact O-CA 3.13Å; S1015-V1018 WeakPolarHBondContact O-CB 3.2Å; S1015-V1018 PolarHBondContact O-N 3.35Å; S1015-V1018 WeakPolarHBondContact OG-CG2 3.42Å; S1015-V1018 PolarHBondContact OG-N 3.33Å; V1018-V1021 PolarHBondContact O-N 2.62Å; V1018-W1022 VanDerWaalsContact O-CB 3.32Å; V1018-W1022 WeakPolarHBondContact O-CB 3.45Å; V1018-W1022 PolarHBondContact O-N 3.46Å
1019	I	95.3	Very high	94	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-68.6	-46.8	177.4	-63.6	-174	0	0	0	111.3	L990 R1005 L1008 A1009 L1014 S1015 M1016 R1017 V1021 W1022 F1023	L990-I1019 HydrophobicContact CD2-CD1 4.36Å; L990-I1019 HydrophobicContact CD2-CG1 4.23Å; L990-I1019 HydrophobicContact CD2-CG2 4.02Å; R1005-I1019 HydrophobicContact CB-CG2 4.43Å; R1005-I1019 HydrophobicContact CG-CG2 4.22Å; L1008-I1019 HydrophobicContact CB-CD1 3.8Å; L1008-I1019 HydrophobicContact CB-CG2 4.49Å; L1008-I1019 VanDerWaalsContact O-CD1 3.32Å; L1008-I1019 WeakPolarHBondContact O-CD1 3.46Å; A1009-I1019 VanDerWaalsContact CA-CD1 3.41Å; A1009-I1019 HydrophobicContact CB-CD1 3.96Å; A1009-I1019 VanDerWaalsContact N-CD1 3.28Å; L1014-I1019 HydrophobicContact CB-CD1 4.23Å; L1014-I1019 HydrophobicContact CB-CG1 3.98Å; S1015-I1019 PolarHBondContact O-N 2.84Å; S1015-I1019 VanDerWaalsContact O-N 3.08Å; M1016-I1019 PolarHBondContact O-N 2.8Å; R1017-I1019 VanDerWaalsContact C-N 3.32Å; I1019-V1021 VanDerWaalsContact C-N 3.3Å; I1019-V1021 PolarHBondContact O-N 3.46Å; I1019-W1022 PolarHBondContact O-N 3.43Å; I1019-W1022 VanDerWaalsContact O-N 3.13Å; I1019-F1023 HydrophobicContact CG2-CD2 3.74Å; I1019-F1023 HydrophobicContact CG2-CE2 3.85Å; I1019-F1023 WeakPolarHBondContact O-CD2 3.17Å; I1019-F1023 PolarHBondContact O-N 2.77Å
1020	Q	94.7	Very high	93.5	Very high	71 Å²	71	69.7 Å²	69.7	33%	0.332	35%	0.347	S	S	.	.	H	α-helix	trans	-54.3	-46.6	173.9	-177.7	-179.7	9.3	0	0	111.6	M1016 Q1024	M1016-Q1020 WeakPolarHBondContact O-CB 3.23Å; M1016-Q1020 PolarHBondContact O-N 3.02Å; Q1020-Q1024 WeakPolarHBondContact O-CB 3.39Å; Q1020-Q1024 VanDerWaalsContact O-CG 3.26Å; Q1020-Q1024 WeakPolarHBondContact O-CG 3.47Å; Q1020-Q1024 PolarHBondContact O-N 3.28Å
1021	V	94.7	Very high	93.2	Very high	55 Å²	55	70.9 Å²	70.9	33%	0.333	35%	0.345	S	S	.	.	H	α-helix	trans	-68.4	-35.7	177.3	168.9	0	0	0	0	111.9	R1017 V1018 I1019 N1025	R1017-V1021 HydrophobicContact CG-CG2 4.48Å; R1017-V1021 VanDerWaalsContact O-CB 3.31Å; R1017-V1021 WeakPolarHBondContact O-CB 3.47Å; R1017-V1021 VanDerWaalsContact O-CG2 3.24Å; R1017-V1021 WeakPolarHBondContact O-CG2 2.98Å; R1017-V1021 PolarHBondContact O-N 3.26Å; V1018-V1021 PolarHBondContact O-N 2.62Å; I1019-V1021 VanDerWaalsContact C-N 3.3Å; I1019-V1021 PolarHBondContact O-N 3.46Å; V1021-N1025 VanDerWaalsContact CG1-ND2 3.35Å; V1021-N1025 WeakPolarHBondContact CG1-ND2 3.44Å; V1021-N1025 VanDerWaalsContact O-CB 3.27Å; V1021-N1025 WeakPolarHBondContact O-CB 3.14Å; V1021-N1025 PolarHBondContact O-N 2.92Å; V1021-N1025 PolarHBondContact O-ND2 2.8Å
1022	W	95.7	Very high	92.7	Very high	31 Å²	31	72 Å²	72	12%	0.117	34%	0.344	C	S	.	.	H	α-helix	trans	-64.2	-48.3	174.6	-175.8	95.9	0	0	0	111.2	I982 L987 L990 F994 V1018 I1019 Q1024 N1025 R1026	I982-W1022 HydrophobicContact CD1-CG 4.34Å; L987-W1022 HydrophobicContact CD1-CZ2 4.33Å; L990-W1022 VanDerWaalsContact C-CH2 3.42Å; L990-W1022 HydrophobicContact CB-CD2 4.04Å; L990-W1022 HydrophobicContact CB-CE3 3.98Å; L990-W1022 HydrophobicContact CB-CH2 3.72Å; L990-W1022 HydrophobicContact CB-CZ2 3.74Å; L990-W1022 HydrophobicContact CB-CZ3 3.83Å; L990-W1022 HydrophobicContact CD1-CD2 3.98Å; L990-W1022 HydrophobicContact CD1-CE3 4.47Å; L990-W1022 HydrophobicContact CD1-CG 4Å; L990-W1022 HydrophobicContact CD2-CE3 4.26Å; L990-W1022 HydrophobicContact CG-CD2 4.43Å; L990-W1022 HydrophobicContact CG-CE3 4.48Å; L990-W1022 WeakPolarHBondContact O-CH2 2.92Å; L990-W1022 WeakPolarHBondContact O-CZ3 3.13Å; F994-W1022 HydrophobicContact CB-CH2 3.95Å; F994-W1022 HydrophobicContact CB-CZ3 3.94Å; F994-W1022 HydrophobicContact CD2-CZ3 4.05Å; F994-W1022 HydrophobicContact CG-CH2 4.4Å; F994-W1022 HydrophobicContact CG-CZ3 4.32Å; V1018-W1022 VanDerWaalsContact O-CB 3.32Å; V1018-W1022 WeakPolarHBondContact O-CB 3.45Å; V1018-W1022 PolarHBondContact O-N 3.46Å; I1019-W1022 PolarHBondContact O-N 3.43Å; I1019-W1022 VanDerWaalsContact O-N 3.13Å; W1022-Q1024 PolarHBondContact O-N 3.15Å; W1022-N1025 PolarHBondContact O-N 2.97Å; W1022-R1026 HydrophobicContact CE3-CB 4.26Å; W1022-R1026 HydrophobicContact CH2-CB 4.25Å; W1022-R1026 HydrophobicContact CH2-CG 3.94Å; W1022-R1026 HydrophobicContact CZ2-CG 4.45Å; W1022-R1026 HydrophobicContact CZ3-CB 4.09Å; W1022-R1026 HydrophobicContact CZ3-CG 4.12Å; W1022-R1026 VanDerWaalsContact O-CB 3.3Å; W1022-R1026 WeakPolarHBondContact O-CB 3.37Å; W1022-R1026 PolarHBondContact O-N 3.26Å
1023	F	97	Very high	91.9	Very high	1 Å²	1	75.2 Å²	75.2	0%	0.004	36%	0.359	C	S	.	.	H	α-helix	trans	-64.3	-39.8	177.2	-88.8	-91.2	0	0	0	112.1	L990 A993 F994 P1000 L1008 I1019 R1026 R1027	L990-F1023 HydrophobicContact CD2-CD2 4.46Å; L990-F1023 HydrophobicContact CD2-CE2 3.79Å; A993-F1023 HydrophobicContact CB-CZ 4.05Å; F994-F1023 HydrophobicContact CB-CE1 4.01Å; F994-F1023 HydrophobicContact CB-CZ 4.49Å; F994-F1023 AromaticContact CD2-CD1 3.62Å; F994-F1023 HydrophobicContact CD2-CD1 3.62Å; F994-F1023 AromaticContact CD2-CE1 3.73Å; F994-F1023 HydrophobicContact CD2-CE1 3.73Å; F994-F1023 HydrophobicContact CE2-CD1 4.27Å; F994-F1023 HydrophobicContact CG-CE1 4.36Å; P1000-F1023 HydrophobicContact CB-CE1 4.27Å; P1000-F1023 HydrophobicContact CB-CZ 4.4Å; P1000-F1023 HydrophobicContact CG-CB 4.5Å; P1000-F1023 HydrophobicContact CG-CD1 3.47Å; P1000-F1023 VanDerWaalsContact CG-CD1 3.47Å; P1000-F1023 HydrophobicContact CG-CD2 4.01Å; P1000-F1023 HydrophobicContact CG-CE1 3.5Å; P1000-F1023 VanDerWaalsContact CG-CE1 3.5Å; P1000-F1023 HydrophobicContact CG-CE2 4.05Å; P1000-F1023 HydrophobicContact CG-CG 3.74Å; P1000-F1023 HydrophobicContact CG-CZ 3.81Å; L1008-F1023 HydrophobicContact CD1-CE2 3.93Å; L1008-F1023 HydrophobicContact CD1-CZ 4.06Å; I1019-F1023 HydrophobicContact CG2-CD2 3.74Å; I1019-F1023 HydrophobicContact CG2-CE2 3.85Å; I1019-F1023 WeakPolarHBondContact O-CD2 3.17Å; I1019-F1023 PolarHBondContact O-N 2.77Å; F1023-R1026 PolarHBondContact O-N 3.23Å; F1023-R1027 WeakPolarHBondContact O-CG 3.47Å; F1023-R1027 PolarHBondContact O-N 2.9Å
1024	Q	94	Very high	91.2	Very high	89 Å²	89	78.4 Å²	78.4	42%	0.416	36%	0.355	S	S	.	.	H	α-helix	trans	-59.2	-49.2	171.2	-77.1	171.1	-14.6	0	0	111.6	Q1020 W1022 R1026 S1028	Q1020-Q1024 WeakPolarHBondContact O-CB 3.39Å; Q1020-Q1024 VanDerWaalsContact O-CG 3.26Å; Q1020-Q1024 WeakPolarHBondContact O-CG 3.47Å; Q1020-Q1024 PolarHBondContact O-N 3.28Å; W1022-Q1024 PolarHBondContact O-N 3.15Å; Q1024-R1026 PolarHBondContact O-N 3.16Å; Q1024-S1028 WeakPolarHBondContact O-CB 3.14Å; Q1024-S1028 PolarHBondContact O-N 2.78Å
1025	N	95.1	Very high	90.3	Very high	100 Å²	100	80.5 Å²	80.5	54%	0.535	36%	0.364	S	S	.	.	H	α-helix	trans	-65.6	-35.7	178.8	-75.5	-34.8	0	0	0	112.6	V1021 W1022 S1028 K1029	V1021-N1025 VanDerWaalsContact CG1-ND2 3.35Å; V1021-N1025 WeakPolarHBondContact CG1-ND2 3.44Å; V1021-N1025 VanDerWaalsContact O-CB 3.27Å; V1021-N1025 WeakPolarHBondContact O-CB 3.14Å; V1021-N1025 PolarHBondContact O-N 2.92Å; V1021-N1025 PolarHBondContact O-ND2 2.8Å; W1022-N1025 PolarHBondContact O-N 2.97Å; N1025-S1028 PolarHBondContact O-N 3.34Å; N1025-K1029 WeakPolarHBondContact O-CB 3.4Å; N1025-K1029 PolarHBondContact O-N 2.73Å
1026	R	94.7	Very high	89.2	Confident	114 Å²	114	82.8 Å²	82.8	43%	0.43	37%	0.37	S	S	.	.	H	α-helix	trans	-66.5	-51	177.5	-177.7	67.5	-173.5	-174.4	4	110.9	F994 W1022 F1023 Q1024 S1028 K1029 E1030	F994-R1026 HydrophobicContact CD1-CG 3.91Å; F994-R1026 HydrophobicContact CD2-CB 4.02Å; F994-R1026 HydrophobicContact CD2-CG 3.39Å; F994-R1026 HydrophobicContact CE1-CG 3.83Å; F994-R1026 HydrophobicContact CE2-CB 3.82Å; F994-R1026 HydrophobicContact CE2-CG 3.31Å; F994-R1026 HydrophobicContact CG-CG 3.71Å; F994-R1026 HydrophobicContact CZ-CB 4.37Å; F994-R1026 HydrophobicContact CZ-CG 3.55Å; W1022-R1026 HydrophobicContact CE3-CB 4.26Å; W1022-R1026 HydrophobicContact CH2-CB 4.25Å; W1022-R1026 HydrophobicContact CH2-CG 3.94Å; W1022-R1026 HydrophobicContact CZ2-CG 4.45Å; W1022-R1026 HydrophobicContact CZ3-CB 4.09Å; W1022-R1026 HydrophobicContact CZ3-CG 4.12Å; W1022-R1026 VanDerWaalsContact O-CB 3.3Å; W1022-R1026 WeakPolarHBondContact O-CB 3.37Å; W1022-R1026 PolarHBondContact O-N 3.26Å; F1023-R1026 PolarHBondContact O-N 3.23Å; Q1024-R1026 PolarHBondContact O-N 3.16Å; R1026-S1028 VanDerWaalsContact C-N 3.3Å; R1026-S1028 PolarHBondContact O-N 3.2Å; R1026-K1029 PolarHBondContact O-N 3.32Å; R1026-E1030 PolarHBondContact O-N 3.46Å
1027	R	94.7	Very high	88.2	Confident	84 Å²	84	86 Å²	86	32%	0.317	39%	0.388	S	S	.	.	H	α-helix	trans	-58.8	-40.3	171.4	-68.4	-166.5	-63.3	-86.6	2.9	112.1	F994 P998 F1023 E1030 R1031	F994-R1027 HydrophobicContact CE2-CG 3.75Å; F994-R1027 HydrophobicContact CZ-CG 4.05Å; P998-R1027 WeakPolarHBondContact O-CD 3.37Å; P998-R1027 PolarHBondContact O-NH1 3.24Å; F1023-R1027 WeakPolarHBondContact O-CG 3.47Å; F1023-R1027 PolarHBondContact O-N 2.9Å; R1027-E1030 PolarHBondContact O-N 2.85Å; R1027-R1031 PolarHBondContact O-N 3.12Å
1028	S	88.5	Confident	86.9	Confident	42 Å²	42	78.3 Å²	78.3	29%	0.294	36%	0.364	S	S	.	.	H	α-helix	trans	-66.4	-36.2	178	-169.4	0	0	0	0	112.4	Q1024 N1025 R1026 R1032	Q1024-S1028 WeakPolarHBondContact O-CB 3.14Å; Q1024-S1028 PolarHBondContact O-N 2.78Å; N1025-S1028 PolarHBondContact O-N 3.34Å; R1026-S1028 VanDerWaalsContact C-N 3.3Å; R1026-S1028 PolarHBondContact O-N 3.2Å; S1028-R1032 VanDerWaalsContact C-NH1 3.28Å; S1028-R1032 PolarHBondContact O-N 3.35Å; S1028-R1032 PolarHBondContact O-NH1 2.85Å; S1028-R1032 PolarHBondContact OG-NH1 3.23Å; S1028-R1032 PolarHBondContact OG-NH2 2.89Å
1029	K	89.3	Confident	85.4	Confident	106 Å²	106	81.4 Å²	81.4	46%	0.461	38%	0.379	S	S	.	.	H	α-helix	trans	-68.1	-48.6	171.6	-174	176.7	179.7	-177.4	0	110.3	N1025 R1026 R1031 R1032 M1033	N1025-K1029 WeakPolarHBondContact O-CB 3.4Å; N1025-K1029 PolarHBondContact O-N 2.73Å; R1026-K1029 PolarHBondContact O-N 3.32Å; K1029-R1031 VanDerWaalsContact C-N 3.35Å; K1029-R1031 PolarHBondContact O-N 3.26Å; K1029-R1032 PolarHBondContact O-N 3.27Å; K1029-M1033 HydrophobicContact CG-CG 4.2Å; K1029-M1033 HydrophobicContact CG-SD 4.49Å; K1029-M1033 WeakPolarHBondContact O-CG 3.33Å; K1029-M1033 PolarHBondContact O-N 3.02Å
1030	E	87.7	Confident	82.9	Confident	65 Å²	65	83.6 Å²	83.6	30%	0.304	40%	0.402	S	S	.	.	H	α-helix	trans	-55.4	-46.9	180	-167.6	-162.9	139.6	0	0	112.2	F994 R1026 R1027 R1032 M1033 K1034	F994-E1030 WeakPolarHBondContact CE1-OE2 3.44Å; F994-E1030 VanDerWaalsContact CZ-OE2 3.29Å; F994-E1030 WeakPolarHBondContact CZ-OE2 3.21Å; R1026-E1030 PolarHBondContact O-N 3.46Å; R1027-E1030 PolarHBondContact O-N 2.85Å; E1030-R1032 VanDerWaalsContact C-N 3.3Å; E1030-R1032 PolarHBondContact O-N 3.22Å; E1030-M1033 PolarHBondContact O-N 2.88Å; E1030-M1033 VanDerWaalsContact O-N 3.15Å; E1030-K1034 HydrophobicContact CG-CD 4.41Å; E1030-K1034 PolarHBondContact O-N 3.49Å; E1030-K1034 WeakPolarHBondContact OE1-CE 3.15Å; E1030-K1034 IonicContact OE1-NZ 2.67Å; E1030-K1034 PolarHBondContact OE1-NZ 2.74Å
1031	R	87.2	Confident	80.6	Confident	177 Å²	177	86.7 Å²	86.7	67%	0.668	43%	0.426	S	S	*	.	H	α-helix	trans	-59.3	-38.3	175.4	-173.7	179	-70.6	150.7	-7.5	112.7	R1027 K1029 Q1035	R1027-R1031 PolarHBondContact O-N 3.12Å; K1029-R1031 VanDerWaalsContact C-N 3.35Å; K1029-R1031 PolarHBondContact O-N 3.26Å; R1031-Q1035 WeakPolarHBondContact O-CB 3.29Å; R1031-Q1035 VanDerWaalsContact O-CG 3.27Å; R1031-Q1035 WeakPolarHBondContact O-CG 3.37Å; R1031-Q1035 PolarHBondContact O-N 3.27Å
1032	R	82	Confident	77.8	Confident	140 Å²	140	95.1 Å²	95.1	53%	0.528	45%	0.452	S	S	.	.	H	α-helix	trans	-70	-37.9	174.6	-72.3	-173.3	-162.9	80.5	-2.9	112.7	S1028 K1029 E1030 Q1035 L1036	S1028-R1032 VanDerWaalsContact C-NH1 3.28Å; S1028-R1032 PolarHBondContact O-N 3.35Å; S1028-R1032 PolarHBondContact O-NH1 2.85Å; S1028-R1032 PolarHBondContact OG-NH1 3.23Å; S1028-R1032 PolarHBondContact OG-NH2 2.89Å; K1029-R1032 PolarHBondContact O-N 3.27Å; E1030-R1032 VanDerWaalsContact C-N 3.3Å; E1030-R1032 PolarHBondContact O-N 3.22Å; R1032-Q1035 PolarHBondContact O-N 2.91Å; R1032-L1036 WeakPolarHBondContact O-CB 3.14Å; R1032-L1036 VanDerWaalsContact O-CG 3.28Å; R1032-L1036 WeakPolarHBondContact O-CG 3.44Å; R1032-L1036 PolarHBondContact O-N 3.1Å
1033	M	75.4	Confident	75.3	Confident	80 Å²	80	104.9 Å²	104.9	39%	0.394	49%	0.488	S	S	.	.	H	α-helix	trans	-64	-46.6	174.3	-59.5	-55.5	-56.7	0	0	110	K1029 E1030 Q1035 L1036 N1037	K1029-M1033 HydrophobicContact CG-CG 4.2Å; K1029-M1033 HydrophobicContact CG-SD 4.49Å; K1029-M1033 WeakPolarHBondContact O-CG 3.33Å; K1029-M1033 PolarHBondContact O-N 3.02Å; E1030-M1033 PolarHBondContact O-N 2.88Å; E1030-M1033 VanDerWaalsContact O-N 3.15Å; M1033-Q1035 PolarHBondContact O-N 2.89Å; M1033-L1036 PolarHBondContact O-N 2.89Å; M1033-N1037 WeakPolarHBondContact O-CB 3.21Å; M1033-N1037 PolarHBondContact O-N 3.45Å; M1033-N1037 PolarHBondContact O-OD1 3.36Å
1034	K	80.2	Confident	72.4	Confident	132 Å²	132	110.3 Å²	110.3	57%	0.574	53%	0.527	S	S	*	.	H	α-helix	trans	-56.4	-47.3	174.7	-77.1	176	167.3	169.1	0	111.6	E1030 L1036 A1038	E1030-K1034 HydrophobicContact CG-CD 4.41Å; E1030-K1034 PolarHBondContact O-N 3.49Å; E1030-K1034 WeakPolarHBondContact OE1-CE 3.15Å; E1030-K1034 IonicContact OE1-NZ 2.67Å; E1030-K1034 PolarHBondContact OE1-NZ 2.74Å; K1034-L1036 PolarHBondContact O-N 3.31Å; K1034-A1038 WeakPolarHBondContact O-CB 3.41Å; K1034-A1038 PolarHBondContact O-N 3.31Å
1035	Q	75.3	Confident	69.6	Low	65 Å²	65	115 Å²	115	30%	0.304	55%	0.546	S	S	.	.	H	α-helix	trans	-60.6	-43.8	174.4	-74.8	170.2	-22.6	0	0	113.3	R1031 R1032 M1033 L1039 L1060	R1031-Q1035 WeakPolarHBondContact O-CB 3.29Å; R1031-Q1035 VanDerWaalsContact O-CG 3.27Å; R1031-Q1035 WeakPolarHBondContact O-CG 3.37Å; R1031-Q1035 PolarHBondContact O-N 3.27Å; R1032-Q1035 PolarHBondContact O-N 2.91Å; M1033-Q1035 PolarHBondContact O-N 2.89Å; Q1035-L1039 WeakPolarHBondContact O-CB 3.45Å; Q1035-L1039 WeakPolarHBondContact O-CD1 3.24Å; Q1035-L1039 PolarHBondContact O-N 2.89Å; Q1035-L1060 HydrophobicContact CG-CD2 4.04Å
1036	L	71	Confident	66.6	Low	118 Å²	118	121.2 Å²	121.2	62%	0.618	56%	0.563	S	S	*	*	H	α-helix	trans	-67.9	-42.9	-179.8	-74.7	167.8	0	0	0	112.6	R1032 M1033 K1034 L1039	R1032-L1036 WeakPolarHBondContact O-CB 3.14Å; R1032-L1036 VanDerWaalsContact O-CG 3.28Å; R1032-L1036 WeakPolarHBondContact O-CG 3.44Å; R1032-L1036 PolarHBondContact O-N 3.1Å; M1033-L1036 PolarHBondContact O-N 2.89Å; K1034-L1036 PolarHBondContact O-N 3.31Å; L1036-L1039 PolarHBondContact O-N 3.3Å
1037	N	71.5	Confident	63.8	Low	125 Å²	125	127.5 Å²	127.5	67%	0.668	59%	0.587	S	S	*	*	H	α-helix	trans	-64.5	-42.5	176.7	-71.1	35	0	0	0	111	M1033 L1039	M1033-N1037 WeakPolarHBondContact O-CB 3.21Å; M1033-N1037 PolarHBondContact O-N 3.45Å; M1033-N1037 PolarHBondContact O-OD1 3.36Å; N1037-L1039 VanDerWaalsContact C-N 3.33Å; N1037-L1039 PolarHBondContact O-N 3.31Å
1038	A	65.4	Low	60.8	Low	23 Å²	23	128.9 Å²	128.9	19%	0.19	60%	0.601	C	S	.	*	H	α-helix	trans	-67.9	-29.6	179.6	0	0	0	0	0	112.4	K1034 G1040 S1061 N1062	K1034-A1038 WeakPolarHBondContact O-CB 3.41Å; K1034-A1038 PolarHBondContact O-N 3.31Å; A1038-G1040 PolarHBondContact O-N 3.47Å; A1038-G1040 VanDerWaalsContact O-N 3.15Å; A1038-S1061 CarbonylContact C-O 3.55Å; A1038-S1061 WeakPolarHBondContact CB-O 3.39Å; A1038-N1062 VanDerWaalsContact C-N 3.3Å; A1038-N1062 WeakPolarHBondContact CB-O 3.46Å; A1038-N1062 WeakPolarHBondContact O-CB 3.4Å; A1038-N1062 PolarHBondContact O-N 3.07Å; A1038-N1062 PolarHBondContact O-ND2 2.78Å
1039	L	63.7	Low	58.3	Low	92 Å²	92	132.5 Å²	132.5	48%	0.482	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.8	-9.6	-179.7	-111.8	84.8	0	0	0	115.6	Q1035 L1036 N1037 T1041 S1061 N1062	Q1035-L1039 WeakPolarHBondContact O-CB 3.45Å; Q1035-L1039 WeakPolarHBondContact O-CD1 3.24Å; Q1035-L1039 PolarHBondContact O-N 2.89Å; L1036-L1039 PolarHBondContact O-N 3.3Å; N1037-L1039 VanDerWaalsContact C-N 3.33Å; N1037-L1039 PolarHBondContact O-N 3.31Å; L1039-T1041 PolarHBondContact O-N 2.98Å; L1039-S1061 WeakPolarHBondContact CD1-OG 3.15Å; L1039-N1062 WeakPolarHBondContact CA-ND2 3.4Å; L1039-N1062 PolarHBondContact O-ND2 3.03Å
1040	G	42.3	Very low	55.5	Low	46 Å²	46	132.1 Å²	132.1	47%	0.474	62%	0.619	S	S	.	*			trans	-72.5	114.3	-171.9	0	0	0	0	0	114.6	A1038	A1038-G1040 PolarHBondContact O-N 3.47Å; A1038-G1040 VanDerWaalsContact O-N 3.15Å
1041	T	47	Very low	52.8	Low	136 Å²	136	140.8 Å²	140.8	83%	0.834	65%	0.649	S	S	*	*	S	Bend	trans	172.5	-29.2	137.8	-75.5	0	0	0	0	113	L1039	L1039-T1041 PolarHBondContact O-N 2.98Å
1042	R	36.7	Very low	50.4	Low	232 Å²	232	140.8 Å²	140.8	88%	0.875	66%	0.661	S	S	*	*	S	Bend	trans	-125.1	139.4	-176.3	-64.9	-161.8	-172.1	-121.4	8.2	115.5
1043	R	43.4	Very low	47.9	Very low	235 Å²	235	144.4 Å²	144.4	89%	0.887	68%	0.675	S	S	*	*			trans	90.8	88.1	168.9	-55.6	179.2	-177.2	-87.8	0.9	117.6
1044	S	35.2	Very low	45.6	Very low	115 Å²	115	143.6 Å²	143.6	80%	0.804	69%	0.687	S	S	*	*			trans	-89.6	105.6	142.8	-178.5	0	0	0	0	109
1045	F	35.2	Very low	43.4	Very low	187 Å²	187	145.9 Å²	145.9	82%	0.82	70%	0.704	S	S	*	*			trans	-162.4	117.5	162.4	-81.9	-58.6	0	0	0	111.1	R1047	F1045-R1047 PolarHBondContact O-N 2.85Å
1046	Y	32.8	Very low	41	Very low	231 Å²	231	153.4 Å²	153.4	91%	0.906	73%	0.729	S	S	*	*			trans	1.4	102.5	165.9	-73.3	-94.5	0	0	0	119.7
1047	R	34.7	Very low	38.9	Very low	246 Å²	246	153.4 Å²	153.4	93%	0.928	74%	0.74	S	S	*	*			trans	-141	89.6	154.1	-78	-157	170.1	-163.1	-2.2	115.4	F1045	F1045-R1047 PolarHBondContact O-N 2.85Å
1048	N	33.2	Very low	36.7	Very low	113 Å²	113	150.6 Å²	150.6	60%	0.604	74%	0.74	S	S	*	*			trans	16.8	118.1	143.9	-171.9	1.5	0	0	0	118.7	R1050	N1048-R1050 PolarHBondContact O-N 3.44Å
1049	P	34.4	Very low	35	Very low	119 Å²	119	156.9 Å²	156.9	77%	0.773	77%	0.769	S	S	*	*	S	Bend	trans	-78.4	50.5	-174.5	35.3	-39.3	0	0	0	114.3
1050	R	32.4	Very low	33.3	Very low	98 Å²	98	158 Å²	158	37%	0.37	77%	0.774	S	S	.	*			trans	-155.2	60.1	-169.3	-136	-177.9	-51.4	-80.2	-2.2	117.2	R231 N1048	R231-R1050 VanDerWaalsContact O-CZ 3.29Å; R231-R1050 PolarHBondContact O-NH1 3.29Å; R231-R1050 PolarHBondContact O-NH2 3.46Å; N1048-R1050 PolarHBondContact O-N 3.44Å
1051	R	31	Very low	32.5	Very low	246 Å²	246	157.7 Å²	157.7	93%	0.928	77%	0.765	S	S	*	*			trans	-161.7	94.2	157.3	-108.1	172.7	-173.3	175.2	1.5	110.9
1052	L	35.4	Very low	31.7	Very low	177 Å²	177	155 Å²	155	93%	0.927	75%	0.745	S	S	*	*			trans	-165.5	100.3	156	-135.8	76.6	0	0	0	110.7
1053	R	29.2	Very low	31.2	Very low	216 Å²	216	151.7 Å²	151.7	82%	0.815	74%	0.74	S	S	*	*			trans	-151.4	83.9	165.5	-173	179.1	-176.3	169.1	1	108.5	T1280	R1053-T1280 PolarHBondContact NH1-OG1 3.27Å
1054	G	27.7	Very low	30.6	Very low	63 Å²	63	146 Å²	146	65%	0.649	73%	0.726	S	S	*	*	S	Bend	trans	158.9	134.5	178.8	0	0	0	0	0	111.4
1055	I	34	Very low	30.5	Very low	180 Å²	180	147.2 Å²	147.2	92%	0.923	72%	0.724	S	S	*	*			trans	71.6	165.8	165.3	-54.9	179	0	0	0	115.8
1056	R	25.3	Very low	30.3	Very low	223 Å²	223	143.9 Å²	143.9	84%	0.842	72%	0.724	S	S	*	*			trans	-72.4	162.8	-166.6	-72.8	179.9	169.3	-164.6	-0.7	114.8
1057	S	26.9	Very low	30.1	Very low	119 Å²	119	136.7 Å²	136.7	83%	0.832	72%	0.72	S	S	*	*			trans	21.3	140.5	139.3	-50.5	0	0	0	0	123.5
1058	G	26	Very low	29.9	Very low	65 Å²	65	128.7 Å²	128.7	67%	0.67	71%	0.714	S	S	*	*			trans	85.8	-178.9	155.5	0	0	0	0	0	115.7
1059	I	29.1	Very low	30	Very low	155 Å²	155	130 Å²	130	80%	0.795	73%	0.729	S	S	*	*			cis	-171.9	149.7	-19.7	-118.3	160.9	0	0	0	106.4
1060	L	27.6	Very low	29.6	Very low	115 Å²	115	127.6 Å²	127.6	60%	0.602	73%	0.725	S	S	*	*			cis	-149.1	171.5	-24.5	-133.4	179	0	0	0	107.6	Q1035	Q1035-L1060 HydrophobicContact CG-CD2 4.04Å
1061	S	26.6	Very low	29.4	Very low	41 Å²	41	130.6 Å²	130.6	29%	0.287	75%	0.749	S	S	.	*			trans	-171.4	150.1	171.4	-7.5	0	0	0	0	109	A1038 L1039	A1038-S1061 CarbonylContact C-O 3.55Å; A1038-S1061 WeakPolarHBondContact CB-O 3.39Å; L1039-S1061 WeakPolarHBondContact CD1-OG 3.15Å
1062	N	28.8	Very low	29.2	Very low	78 Å²	78	127 Å²	127	42%	0.417	75%	0.746	S	S	.	*			cis	-134.1	156.6	-23.9	-44.4	-81.7	0	0	0	107.6	A1038 L1039	A1038-N1062 VanDerWaalsContact C-N 3.3Å; A1038-N1062 WeakPolarHBondContact CB-O 3.46Å; A1038-N1062 WeakPolarHBondContact O-CB 3.4Å; A1038-N1062 PolarHBondContact O-N 3.07Å; A1038-N1062 PolarHBondContact O-ND2 2.78Å; L1039-N1062 WeakPolarHBondContact CA-ND2 3.4Å; L1039-N1062 PolarHBondContact O-ND2 3.03Å
1063	E	26.7	Very low	28.8	Very low	163 Å²	163	125.8 Å²	125.8	76%	0.762	74%	0.739	S	S	*	*			trans	-101.2	134.4	140.1	-67.1	-71.1	132.6	0	0	104.8
1064	L	30.1	Very low	28.7	Very low	115 Å²	115	121.6 Å²	121.6	60%	0.602	74%	0.738	S	S	*	*				67.9	131.5	53.4	-61.7	174.3	0	0	0	112.5
1065	N	33.3	Very low	28.6	Very low	141 Å²	141	126.5 Å²	126.5	75%	0.754	75%	0.749	S	S	*	*			cis	-163.4	-176.2	-20.3	-152.5	-10.5	0	0	0	109.8
1066	S	30.6	Very low	28.4	Very low	118 Å²	118	123.6 Å²	123.6	83%	0.825	75%	0.745	S	S	*	*			trans	95	132.5	172.3	-40.8	0	0	0	0	115
1067	G	30	Very low	28.6	Very low	80 Å²	80	117.4 Å²	117.4	83%	0.825	74%	0.742	S	S	*	*			cis	171.8	173.7	-7.2	0	0	0	0	0	112.2
1068	G	30.4	Very low	28.6	Very low	77 Å²	77	120.9 Å²	120.9	79%	0.794	74%	0.738	S	S	*	*			trans	120.8	144.9	174.4	0	0	0	0	0	114.1
1069	P	35.2	Very low	28.8	Very low	141 Å²	141	126.5 Å²	126.5	92%	0.916	75%	0.746	S	S	*	*			trans	-111.6	157.3	-169.4	40.3	-32	0	0	0	114.9
1070	G	26.3	Very low	28.9	Very low	68 Å²	68	127.6 Å²	127.6	70%	0.701	75%	0.748	S	S	*	*			trans	169.8	121.9	168.1	0	0	0	0	0	113
1071	D	26.4	Very low	29	Very low	161 Å²	161	132.3 Å²	132.3	86%	0.861	76%	0.759	S	S	*	*			trans	27.3	112.9	154	-48.2	-27.3	0	0	0	120.3
1072	I	28.2	Very low	29.2	Very low	170 Å²	170	138.1 Å²	138.1	87%	0.872	79%	0.786	S	S	*	*			trans	-161.8	148.8	149.5	-106.4	150.4	0	0	0	110.5
1073	I	25.4	Very low	29.6	Very low	153 Å²	153	139.6 Å²	139.6	79%	0.785	80%	0.798	S	S	*	*			trans	-111.8	151.6	178.4	-59.3	174.4	0	0	0	109.4
1074	T	27.6	Very low	29.7	Very low	127 Å²	127	134.8 Å²	134.8	78%	0.779	79%	0.792	S	S	*	*			trans	106.9	123.5	168.8	70.3	0	0	0	0	119
1075	N	27.2	Very low	29.9	Very low	166 Å²	166	133.9 Å²	133.9	89%	0.888	79%	0.793	S	S	*	*			trans	24.3	118.9	154.1	-70.6	-15.6	0	0	0	122.5
1076	S	29.2	Very low	29.9	Very low	119 Å²	119	130.3 Å²	130.3	83%	0.832	78%	0.779	S	S	*	*				-177.9	99.6	124.5	171	0	0	0	0	111.6
1077	A	28.6	Very low	30	Very low	94 Å²	94	130.2 Å²	130.2	78%	0.777	78%	0.776	S	S	*	*			trans	-119.8	68.8	-175.5	0	0	0	0	0	113.8
1078	Y	27.4	Very low	30.4	Very low	191 Å²	191	132.3 Å²	132.3	75%	0.749	77%	0.768	S	S	*	*			trans	-143.2	146.7	170.3	-80	-86.1	0	0	0	111.8
1079	H	29.6	Very low	31	Very low	184 Å²	184	133.2 Å²	133.2	85%	0.852	75%	0.754	S	S	*	*			trans	102.1	71.4	166	-161.3	-69.9	0	0	0	118.8
1080	E	31.7	Very low	30.9	Very low	177 Å²	177	135 Å²	135	83%	0.827	74%	0.743	S	S	*	*			trans	-149.8	105.3	146.7	-173.2	171	-174.9	0	0	112.1
1081	Y	28.9	Very low	31.5	Very low	215 Å²	215	138.9 Å²	138.9	84%	0.843	75%	0.748	S	S	*	*			trans	-164.7	102.7	152.3	-96.9	-59	0	0	0	111
1082	L	31.4	Very low	32.1	Very low	162 Å²	162	134.3 Å²	134.3	85%	0.848	73%	0.733	S	S	*	*			trans	-146.3	133.7	168.3	-108	171.3	0	0	0	109.6
1083	V	36.7	Very low	32.6	Very low	109 Å²	109	131.8 Å²	131.8	66%	0.661	72%	0.72	S	S	*	*	S	Bend	trans	73.9	89.6	-163.9	-168.9	0	0	0	0	112.2
1084	G	29.5	Very low	33.1	Very low	63 Å²	63	129 Å²	129	65%	0.649	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-72.4	150.5	174.7	0	0	0	0	0	113.5
1085	P	34.8	Very low	33.7	Very low	95 Å²	95	127.4 Å²	127.4	62%	0.617	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-76.9	163.9	172.7	33.5	-35.4	0	0	0	112.2
1086	S	32.5	Very low	34.2	Very low	67 Å²	67	123.4 Å²	123.4	47%	0.469	70%	0.704	S	S	.	*	P	Polyproline II helix	trans	-73.3	150.4	169.9	-152.6	0	0	0	0	110.5	D1088	S1086-D1088 WeakPolarHBondContact CB-OD2 3.4Å; S1086-D1088 PolarHBondContact O-N 2.93Å; S1086-D1088 PolarHBondContact OG-OD2 2.72Å
1087	P	33.6	Very low	34.3	Very low	115 Å²	115	123.2 Å²	123.2	75%	0.747	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-60.6	-18.2	-179.5	-24.5	35.6	0	0	0	115	I1089	P1087-I1089 VanDerWaalsContact C-N 3.31Å; P1087-I1089 PolarHBondContact O-N 3.24Å
1088	D	37.9	Very low	34.5	Very low	125 Å²	125	123.1 Å²	123.1	67%	0.668	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-76.7	-10	-163.8	-41.7	-84.8	0	0	0	115	S1086	S1086-D1088 WeakPolarHBondContact CB-OD2 3.4Å; S1086-D1088 PolarHBondContact O-N 2.93Å; S1086-D1088 PolarHBondContact OG-OD2 2.72Å
1089	I	43.5	Very low	34.9	Very low	95 Å²	95	122.2 Å²	122.2	49%	0.487	71%	0.708	S	S	.	*	G	3₁₀ helix	trans	-94	-26.2	-170.9	-62.7	176.8	0	0	0	112.9	P1087 N1091 A1092 I1093	P1087-I1089 VanDerWaalsContact C-N 3.31Å; P1087-I1089 PolarHBondContact O-N 3.24Å; I1089-N1091 PolarHBondContact O-N 3.09Å; I1089-N1091 VanDerWaalsContact O-N 3.16Å; I1089-A1092 WeakPolarHBondContact O-CB 3.32Å; I1089-A1092 PolarHBondContact O-N 3.15Å; I1089-I1093 HydrophobicContact CG2-CD1 4.01Å
1090	Y	33.6	Very low	35	Very low	179 Å²	179	118 Å²	118	70%	0.702	71%	0.705	S	S	*	*	H	α-helix	trans	-65.7	-22.7	-172.4	-99.7	-86.9	0	0	0	114.5
1091	N	38.7	Very low	35.1	Very low	149 Å²	149	115.9 Å²	115.9	80%	0.797	71%	0.71	S	S	*	*	H	α-helix	trans	-86.6	-7.9	175	-71.1	-17.5	0	0	0	114	I1089	I1089-N1091 PolarHBondContact O-N 3.09Å; I1089-N1091 VanDerWaalsContact O-N 3.16Å
1092	A	38.9	Very low	35.4	Very low	66 Å²	66	109 Å²	109	55%	0.545	70%	0.704	S	S	.	*	H	α-helix	trans	-92.1	-14.3	-177.9	0	0	0	0	0	114	I1089	I1089-A1092 WeakPolarHBondContact O-CB 3.32Å; I1089-A1092 PolarHBondContact O-N 3.15Å
1093	I	38.5	Very low	35.6	Very low	116 Å²	116	108 Å²	108	60%	0.595	71%	0.705	S	S	*	*	H	α-helix	trans	-105.9	-29.3	-174.8	-59.8	177.2	0	0	0	111.6	I1089 S1095 A1096	I1089-I1093 HydrophobicContact CG2-CD1 4.01Å; I1093-S1095 PolarHBondContact O-N 3.41Å; I1093-S1095 VanDerWaalsContact O-N 3.07Å; I1093-A1096 PolarHBondContact O-N 3.11Å
1094	A	35.1	Very low	35.7	Very low	94 Å²	94	107.5 Å²	107.5	78%	0.777	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-8.7	179.9	0	0	0	0	0	114.9
1095	S	40.7	Very low	35.8	Very low	95 Å²	95	113.4 Å²	113.4	66%	0.664	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	-1.5	-177.1	47.8	0	0	0	0	114.5	I1093	I1093-S1095 PolarHBondContact O-N 3.41Å; I1093-S1095 VanDerWaalsContact O-N 3.07Å
1096	A	36.8	Very low	35.6	Very low	81 Å²	81	116 Å²	116	67%	0.669	72%	0.72	S	S	*	*	S	Bend	trans	-109.8	9.8	-167.3	0	0	0	0	0	115.8	I1093	I1093-A1096 PolarHBondContact O-N 3.11Å
1097	S	32.7	Very low	35.7	Very low	115 Å²	115	120.6 Å²	120.6	80%	0.804	74%	0.739	S	S	*	*			trans	-134.7	31	-170.1	-52.1	0	0	0	0	115
1098	A	32.1	Very low	35.9	Very low	93 Å²	93	121 Å²	121	77%	0.769	74%	0.741	S	S	*	*			trans	-110.8	24.6	-174.3	0	0	0	0	0	115
1099	I	35.2	Very low	35.5	Very low	171 Å²	171	118.6 Å²	118.6	88%	0.877	75%	0.746	S	S	*	*			trans	-139.1	73.2	178.6	-44.4	178.4	0	0	0	111.9
1100	A	32.2	Very low	35.1	Very low	96 Å²	96	119.2 Å²	119.2	79%	0.793	77%	0.766	S	S	*	*			trans	-162.4	126.6	161.5	0	0	0	0	0	112.8
1101	S	33.5	Very low	35.2	Very low	133 Å²	133	118.1 Å²	118.1	93%	0.93	77%	0.771	S	S	*	*			trans	109.4	109.3	172	-52.6	0	0	0	0	114.9
1102	G	35.7	Very low	35.2	Very low	70 Å²	70	116.5 Å²	116.5	72%	0.722	77%	0.768	S	S	*	*			trans	-161	-24.8	-176.9	0	0	0	0	0	116.8
1103	V	35	Very low	34.8	Very low	141 Å²	141	120 Å²	120	86%	0.855	78%	0.778	S	S	*	*			trans	66.4	-177.3	170	-129.4	0	0	0	0	113.9
1104	P	39.6	Very low	34.5	Very low	99 Å²	99	121.7 Å²	121.7	64%	0.643	79%	0.787	S	S	*	*				-121.7	176	-120.8	42.8	-27.1	0	0	0	115.8
1105	F	30.7	Very low	34.3	Very low	186 Å²	186	122.4 Å²	122.4	82%	0.816	78%	0.782	S	S	*	*			trans	-178.4	133.6	130.8	-102.2	-65.6	0	0	0	114.3
1106	N	30.6	Very low	33.8	Very low	149 Å²	149	123.5 Å²	123.5	80%	0.797	78%	0.784	S	S	*	*			trans	46.6	133.9	153.2	-69.2	-12.7	0	0	0	124.9
1107	L	35	Very low	33.6	Very low	164 Å²	164	125.7 Å²	125.7	86%	0.859	79%	0.785	S	S	*	*			trans	-67	179.5	154.8	-108	70.4	0	0	0	112.3
1108	P	37.4	Very low	33.5	Very low	123 Å²	123	130.3 Å²	130.3	80%	0.799	79%	0.786	S	S	*	*			cis	-136.1	178.1	8.6	41.3	-24.4	0	0	0	116.7
1109	G	30.4	Very low	33.8	Very low	75 Å²	75	131 Å²	131	77%	0.773	78%	0.783	S	S	*	*			trans	147.2	118.2	143.7	0	0	0	0	0	121.2
1110	A	35.3	Very low	33.7	Very low	108 Å²	108	130.7 Å²	130.7	89%	0.893	78%	0.782	S	S	*	*			trans	65.2	103.5	140.9	0	0	0	0	0	124.2
1111	I	35.4	Very low	33.7	Very low	157 Å²	157	130.5 Å²	130.5	81%	0.805	78%	0.775	S	S	*	*			trans	-52.4	150.3	145.9	-63.5	157.2	0	0	0	110.6
1112	P	38.4	Very low	33.8	Very low	115 Å²	115	132.9 Å²	132.9	75%	0.747	77%	0.771	S	S	*	*			cis	-131	166.2	46	16.4	11	0	0	0	116.1
1113	N	30.4	Very low	33.8	Very low	139 Å²	139	133.6 Å²	133.6	74%	0.743	77%	0.771	S	S	*	*			cis	88.5	148	40.1	-159.4	14	0	0	0	114.8
1114	L	32.9	Very low	33.8	Very low	151 Å²	151	135.5 Å²	135.5	79%	0.791	77%	0.77	S	S	*	*			trans	109.9	74.1	173.7	-66.5	148.3	0	0	0	120.5
1115	T	30.4	Very low	33.8	Very low	109 Å²	109	135.8 Å²	135.8	67%	0.669	77%	0.772	S	S	*	*				55	105.2	100.8	-49.7	0	0	0	0	121.4
1116	V	31	Very low	34	Very low	119 Å²	119	134.8 Å²	134.8	72%	0.721	77%	0.774	S	S	*	*				94.9	122.4	126.2	164.3	0	0	0	0	123.9
1117	N	31	Very low	34.5	Very low	126 Å²	126	132.6 Å²	132.6	67%	0.674	77%	0.768	S	S	*	*			trans	92.6	105.2	143.3	-74.4	1.1	0	0	0	126.8
1118	Y	30.8	Very low	34.5	Very low	213 Å²	213	129.8 Å²	129.8	84%	0.835	76%	0.762	S	S	*	*			trans	65.2	152.3	133.1	-71.1	-85.5	0	0	0	124.8
1119	P	39.7	Very low	34.4	Very low	107 Å²	107	130.9 Å²	130.9	70%	0.695	76%	0.761	S	S	*	*			trans	-130.3	171.6	-164.4	44.4	-29.4	0	0	0	117.5
1120	L	31.6	Very low	34.6	Very low	165 Å²	165	133.7 Å²	133.7	86%	0.864	76%	0.758	S	S	*	*			trans	-170.6	144.8	138.3	-135.3	70.5	0	0	0	116.6
1121	S	33.6	Very low	34.6	Very low	92 Å²	92	132.9 Å²	132.9	64%	0.643	75%	0.746	S	S	*	*			trans	68.3	127.8	144.1	-78.9	0	0	0	0	127.1
1122	Q	35.2	Very low	34.5	Very low	182 Å²	182	132.9 Å²	132.9	85%	0.85	75%	0.747	S	S	*	*			trans	89.5	108.5	131.9	-70	175.3	5.3	0	0	125.5
1123	A	35.6	Very low	34.4	Very low	86 Å²	86	134.1 Å²	134.1	71%	0.711	75%	0.746	S	S	*	*				70	117.2	124.7	0	0	0	0	0	126.4
1124	H	35.7	Very low	34.6	Very low	181 Å²	181	133.2 Å²	133.2	84%	0.838	75%	0.75	S	S	*	*				36.2	165	126.1	-66.6	-68.7	0	0	0	124.5
1125	P	39.9	Very low	34.8	Very low	105 Å²	105	129.3 Å²	129.3	68%	0.682	75%	0.747	S	S	*	*			cis	-143.1	169.6	-39.4	41.7	-24.4	0	0	0	117
1126	L	33.6	Very low	35.2	Very low	164 Å²	164	130.1 Å²	130.1	86%	0.859	75%	0.752	S	S	*	*			trans	30.9	168.5	140.8	-67.9	174.1	0	0	0	124.4
1127	P	41.3	Very low	35.5	Very low	104 Å²	104	130.8 Å²	130.8	68%	0.675	76%	0.756	S	S	*	*			cis	-140.4	-174.1	-26.6	37.4	-17.2	0	0	0	116.4
1128	S	35.4	Very low	35.7	Very low	104 Å²	104	128.6 Å²	128.6	73%	0.727	76%	0.755	S	S	*	*			trans	127.9	127.3	131.9	71.6	0	0	0	0	122.6
1129	N	34	Very low	36	Very low	147 Å²	147	126.6 Å²	126.6	79%	0.786	75%	0.754	S	S	*	*			trans	80.1	139.6	138.9	-76.5	35.2	0	0	0	128.2
1130	D	36.3	Very low	35.8	Very low	133 Å²	133	127.8 Å²	127.8	71%	0.711	75%	0.753	S	S	*	*			trans	95.8	99.3	141.6	-82	-57.3	0	0	0	126.6
1131	S	34	Very low	36.1	Very low	92 Å²	92	126.5 Å²	126.5	64%	0.643	75%	0.747	S	S	*	*				86.8	128.3	112.1	-75.2	0	0	0	0	127.6
1132	L	34.6	Very low	36.1	Very low	156 Å²	156	127.3 Å²	127.3	82%	0.817	74%	0.744	S	S	*	*			trans	99.1	134.2	131.7	-76.5	166.4	0	0	0	127.1
1133	I	35.9	Very low	36	Very low	141 Å²	141	124.5 Å²	124.5	72%	0.723	73%	0.734	S	S	*	*			trans	103.4	99.2	140.2	-71.9	159.2	0	0	0	124.9
1134	S	34.2	Very low	36	Very low	120 Å²	120	126.3 Å²	126.3	84%	0.839	73%	0.732	S	S	*	*				53.9	137.3	124	-46.7	0	0	0	0	129.2
1135	G	38	Very low	36	Very low	70 Å²	70	124 Å²	124	72%	0.722	73%	0.731	S	S	*	*			trans	124.9	143.9	135.2	0	0	0	0	0	118.3
1136	T	37.8	Very low	35.7	Very low	126 Å²	126	122.6 Å²	122.6	77%	0.773	74%	0.736	S	S	*	*			cis	-166.4	135.9	-15	-15	0	0	0	0	112.3
1137	T	37	Very low	35.5	Very low	133 Å²	133	119.2 Å²	119.2	82%	0.816	73%	0.726	S	S	*	*			trans	42.4	145	145.7	48.3	0	0	0	0	123.1
1138	A	36.5	Very low	35	Very low	79 Å²	79	122.6 Å²	122.6	65%	0.653	73%	0.73	S	S	*	*			cis	-147.5	-146.7	2.5	0	0	0	0	0	109.1
1139	H	35.7	Very low	34.8	Very low	172 Å²	172	124.9 Å²	124.9	80%	0.796	73%	0.729	S	S	*	*			cis	-163.5	-180	4.4	-126	-20.4	0	0	0	107.3
1140	L	35.7	Very low	34.4	Very low	131 Å²	131	123.3 Å²	123.3	69%	0.686	72%	0.721	S	S	*	*			cis	-139.6	-85.8	5.7	-149.3	-176	0	0	0	112.1
1141	L	37.5	Very low	34.1	Very low	139 Å²	139	122.6 Å²	122.6	73%	0.728	72%	0.717	S	S	*	*			trans	-157.7	178.2	-177	-68.7	177.2	0	0	0	107.3
1142	N	34.2	Very low	33.8	Very low	109 Å²	109	125.7 Å²	125.7	58%	0.583	73%	0.726	S	S	*	*			cis	-151.2	-152.6	6.4	-151.8	52	0	0	0	109.9	D1144	N1142-D1144 PolarHBondContact ND2-OD2 3.02Å
1143	N	32.7	Very low	33.7	Very low	122 Å²	122	122.2 Å²	122.2	65%	0.652	72%	0.72	S	S	*	*				-163.4	-179	-112.4	-81.7	-22.5	0	0	0	111.1
1144	D	36.2	Very low	33.4	Very low	125 Å²	125	120.1 Å²	120.1	67%	0.668	72%	0.718	S	S	*	*			trans	85.7	145	154.7	-49.6	-40.1	0	0	0	119.7	N1142	N1142-D1144 PolarHBondContact ND2-OD2 3.02Å
1145	T	35.4	Very low	33.2	Very low	131 Å²	131	121.6 Å²	121.6	80%	0.804	71%	0.711	S	S	*	*			cis	-165.7	160.3	-38.4	34.7	0	0	0	0	110
1146	G	33.6	Very low	32.8	Very low	77 Å²	77	126.8 Å²	126.8	79%	0.794	71%	0.714	S	S	*	*			trans	85.1	143.9	160.5	0	0	0	0	0	116.7
1147	S	29.7	Very low	32.3	Very low	93 Å²	93	127.3 Å²	127.3	65%	0.65	71%	0.713	S	S	*	*			cis	130.6	142.6	-13.5	-169.2	0	0	0	0	113.1
1148	F	29.9	Very low	32	Very low	174 Å²	174	125.9 Å²	125.9	76%	0.763	71%	0.708	S	S	*	*			trans	90.2	114.7	164.2	-57.6	-63.7	0	0	0	122.2
1149	H	31.2	Very low	31.6	Very low	153 Å²	153	128.5 Å²	128.5	71%	0.708	71%	0.711	S	S	*	*				71.8	114.9	129.1	-75.2	-54.1	0	0	0	124.2
1150	N	27.7	Very low	31.7	Very low	113 Å²	113	124.9 Å²	124.9	60%	0.604	70%	0.703	S	S	*	*				87.6	127.1	120.9	-78	40.2	0	0	0	123.8
1151	D	28.6	Very low	31.3	Very low	118 Å²	118	126.3 Å²	126.3	63%	0.631	70%	0.704	S	S	*	*			trans	56.8	106.9	133.1	-42.9	-19.5	0	0	0	120.7
1152	N	28.3	Very low	30.8	Very low	157 Å²	157	126.8 Å²	126.8	84%	0.84	70%	0.702	S	S	*	*				163.9	165.9	97.9	-89.2	-62.7	0	0	0	114.5
1153	A	32.2	Very low	30.4	Very low	83 Å²	83	127.8 Å²	127.8	69%	0.686	71%	0.706	S	S	*	*			trans	69.1	97	151.5	0	0	0	0	0	120.5
1154	S	29.9	Very low	30.2	Very low	97 Å²	97	126.9 Å²	126.9	68%	0.678	71%	0.705	S	S	*	*				55.4	134.8	124.5	69.7	0	0	0	0	120.4
1155	H	30.2	Very low	29.8	Very low	151 Å²	151	128.4 Å²	128.4	70%	0.699	71%	0.709	S	S	*	*				-167.2	155	54.5	-119.8	-76.3	0	0	0	113.7
1156	F	28.2	Very low	29.6	Very low	179 Å²	179	125.3 Å²	125.3	79%	0.785	69%	0.687	S	S	*	*			trans	73.8	142.3	160.4	-72.8	-67	0	0	0	123.3
1157	N	28.6	Very low	29.4	Very low	138 Å²	138	126.1 Å²	126.1	74%	0.738	67%	0.669	S	S	*	*			trans	60.2	74.5	162.9	-71.5	16.9	0	0	0	122.1
1158	S	31.3	Very low	29.4	Very low	103 Å²	103	127.5 Å²	127.5	72%	0.72	68%	0.676	S	S	*	*				54.8	76.1	108.2	70.2	0	0	0	0	119.6
1159	N	27.8	Very low	29.3	Very low	133 Å²	133	123.4 Å²	123.4	71%	0.711	67%	0.669	S	S	*	*				-51.4	178.6	122.6	-130.8	-8.3	0	0	0	110.7
1160	P	36.8	Very low	29.1	Very low	97 Å²	97	123.7 Å²	123.7	63%	0.63	68%	0.676	S	S	*	*			cis	-144.1	171.3	-0.7	43	-23.5	0	0	0	117.6
1161	F	26.6	Very low	29.2	Very low	161 Å²	161	124 Å²	124	71%	0.706	69%	0.686	S	S	*	*			trans	55.5	150.5	130.4	-75	-148.1	0	0	0	124
1162	H	27.3	Very low	29.1	Very low	149 Å²	149	125.4 Å²	125.4	69%	0.69	69%	0.693	S	S	*	*				93.2	151.7	126.9	-96.4	-157.8	0	0	0	124.1
1163	L	27.1	Very low	29.1	Very low	129 Å²	129	125 Å²	125	68%	0.675	69%	0.691	S	S	*	*			trans	55.3	99.5	144.1	-66.4	168.9	0	0	0	117.4
1164	T	26.7	Very low	28.8	Very low	103 Å²	103	126.6 Å²	126.6	63%	0.632	70%	0.696	S	S	*	*				67.8	129.5	88.4	62.3	0	0	0	0	116.5
1165	Q	29.9	Very low	28.9	Very low	157 Å²	157	129.6 Å²	129.6	73%	0.734	70%	0.703	S	S	*	*			trans	75.2	120.8	144.8	-71.1	175.4	33.2	0	0	120.6
1166	N	30.4	Very low	29.1	Very low	66 Å²	66	127.4 Å²	127.4	35%	0.353	70%	0.702	S	S	.	*			trans	74.3	108.7	133.5	-51.9	-13.4	0	0	0	121.7	I533 S535	I533-N1166 WeakPolarHBondContact CG2-OD1 3.23Å; S535-N1166 WeakPolarHBondContact CB-ND2 3.32Å
1167	F	28.2	Very low	29.1	Very low	95 Å²	95	128.5 Å²	128.5	42%	0.417	70%	0.703	S	S	.	*				15.5	137.4	127.1	-73	-98.3	0	0	0	119.4	I533	I533-F1167 HydrophobicContact CB-CD2 3.77Å; I533-F1167 HydrophobicContact CB-CE2 3.67Å; I533-F1167 HydrophobicContact CD1-CD2 4.44Å; I533-F1167 HydrophobicContact CD1-CE2 4.16Å; I533-F1167 HydrophobicContact CG1-CD2 4.32Å; I533-F1167 HydrophobicContact CG1-CE2 3.85Å; I533-F1167 VanDerWaalsContact N-CE2 3.28Å; I533-F1167 VanDerWaalsContact O-CD2 3.28Å; I533-F1167 WeakPolarHBondContact O-CD2 3.49Å
1168	P	29.9	Very low	29.3	Very low	121 Å²	121	128.7 Å²	128.7	79%	0.786	70%	0.704	S	S	*	*				-119	168.3	66.9	2.9	20	0	0	0	113.3
1169	S	28.8	Very low	29.7	Very low	89 Å²	89	128.3 Å²	128.3	62%	0.622	70%	0.699	S	S	*	*			cis	78.9	98.9	30.8	-53.1	0	0	0	0	115.9
1170	N	26.2	Very low	30.1	Very low	159 Å²	159	126.1 Å²	126.1	85%	0.85	69%	0.694	S	S	*	*			trans	48.7	102.7	159.6	-64.1	-5.3	0	0	0	119.8
1171	S	29.4	Very low	29.8	Very low	118 Å²	118	128.3 Å²	128.3	83%	0.825	70%	0.701	S	S	*	*				-163.1	131.2	128.7	2.8	0	0	0	0	114.4
1172	L	28.2	Very low	30.2	Very low	149 Å²	149	128 Å²	128	78%	0.78	71%	0.705	S	S	*	*			trans	-3.6	128.3	137.3	-57.3	161.2	0	0	0	117.4
1173	N	27.2	Very low	30.5	Very low	147 Å²	147	126 Å²	126	79%	0.786	71%	0.708	S	S	*	*				167.3	163.7	100.4	-91.7	-39.4	0	0	0	116.1
1174	C	26.6	Very low	30.8	Very low	118 Å²	118	122.8 Å²	122.8	80%	0.797	71%	0.707	S	S	*	*			trans	64.7	91.5	152.3	-69.3	0	0	0	0	121.7
1175	L	32	Very low	31.3	Very low	159 Å²	159	123.4 Å²	123.4	83%	0.832	72%	0.715	S	S	*	*				-25.7	152.4	122.7	-84.8	167.6	0	0	0	115
1176	P	33.1	Very low	31.6	Very low	105 Å²	105	122.2 Å²	122.2	68%	0.682	72%	0.724	S	S	*	*				-144.5	-165.3	63.8	45	-27.5	0	0	0	114
1177	Y	29.9	Very low	31.7	Very low	203 Å²	203	122 Å²	122	80%	0.796	74%	0.737	S	S	*	*			cis	-150.2	120.7	3.3	-132.9	-78.5	0	0	0	104.2
1178	N	32.4	Very low	32	Very low	141 Å²	141	127 Å²	127	75%	0.754	76%	0.759	S	S	*	*				46.4	148.7	83.2	-126.8	16.5	0	0	0	115.2
1179	P	39.6	Very low	32	Very low	95 Å²	95	130.6 Å²	130.6	62%	0.617	76%	0.757	S	S	*	*			cis	-145.2	-173.6	8.2	45.4	-26.3	0	0	0	118.5
1180	S	35.9	Very low	32.2	Very low	88 Å²	88	132 Å²	132	62%	0.615	76%	0.758	S	S	*	*			trans	80.6	116.8	146.7	-70.2	0	0	0	0	119.8
1181	N	30.1	Very low	32.3	Very low	143 Å²	143	132.8 Å²	132.8	77%	0.765	76%	0.756	S	S	*	*				94.7	144.7	68.9	-70.7	-18.1	0	0	0	111.2
1182	L	34.8	Very low	32.5	Very low	153 Å²	153	133.2 Å²	133.2	80%	0.801	75%	0.754	S	S	*	*			cis	-154	172.5	27.4	-118.3	133.9	0	0	0	112.5
1183	S	34.2	Very low	32.6	Very low	108 Å²	108	135.2 Å²	135.2	76%	0.755	76%	0.756	S	S	*	*			trans	-8.2	156.5	161.8	56.3	0	0	0	0	121.7
1184	G	33.9	Very low	32.7	Very low	62 Å²	62	132.9 Å²	132.9	64%	0.639	75%	0.752	S	S	*	*			cis	160.2	139.4	3.1	0	0	0	0	0	109.8
1185	S	37.4	Very low	33	Very low	116 Å²	116	133.3 Å²	133.3	81%	0.811	75%	0.746	S	S	*	*				108.3	139.1	94.7	-68.7	0	0	0	0	113.8
1186	S	35.7	Very low	32.9	Very low	131 Å²	131	132.9 Å²	132.9	92%	0.916	74%	0.744	S	S	*	*			trans	67.1	147.9	174.6	71.2	0	0	0	0	117.8
1187	G	33.3	Very low	32.8	Very low	62 Å²	62	135.3 Å²	135.3	64%	0.639	75%	0.75	S	S	*	*			cis	167.8	157	-10.4	0	0	0	0	0	114.4
1188	F	33	Very low	32.9	Very low	199 Å²	199	134.9 Å²	134.9	87%	0.873	75%	0.749	S	S	*	*			trans	62.3	168.2	171.2	-65.6	-99.4	0	0	0	118.2
1189	R	31.2	Very low	33	Very low	198 Å²	198	133.3 Å²	133.3	75%	0.747	74%	0.744	S	S	*	*				-171.7	171.9	-54.1	-144.5	-173.6	169	-146.4	1.3	109.5
1190	D	32.8	Very low	33	Very low	118 Å²	118	134.5 Å²	134.5	63%	0.631	75%	0.752	S	S	*	*			trans	73.9	172.8	156.8	-53.7	-31	0	0	0	118.4
1191	E	28.7	Very low	32.8	Very low	176 Å²	176	135.2 Å²	135.2	82%	0.822	76%	0.757	S	S	*	*			trans	-130.1	-177.8	-142.1	-57.9	176.8	102.7	0	0	115.2
1192	T	31.9	Very low	32.9	Very low	126 Å²	126	138.5 Å²	138.5	77%	0.773	76%	0.76	S	S	*	*			trans	104.9	120.6	150.2	72.3	0	0	0	0	121.7
1193	K	30.8	Very low	32.9	Very low	191 Å²	191	139.2 Å²	139.2	83%	0.83	76%	0.757	S	S	*	*			trans	55.8	121.7	131	-68.4	-174.7	175.2	-179.9	0	124.3
1194	S	29.1	Very low	33.2	Very low	98 Å²	98	139.1 Å²	139.1	69%	0.685	75%	0.754	S	S	*	*				87	155	121.6	72.4	0	0	0	0	123.8
1195	D	32.8	Very low	33.2	Very low	127 Å²	127	141.4 Å²	141.4	68%	0.679	76%	0.76	S	S	*	*			trans	94.3	85.6	153.3	-52.3	-50.2	0	0	0	123.1
1196	L	30.1	Very low	33.1	Very low	150 Å²	150	140.7 Å²	140.7	79%	0.785	76%	0.755	S	S	*	*				62.2	155.8	118.9	-63	169.5	0	0	0	123.6
1197	L	31.8	Very low	33.1	Very low	157 Å²	157	139.8 Å²	139.8	82%	0.822	75%	0.749	S	S	*	*			trans	81	154.3	161.8	-49.7	-176.1	0	0	0	119.7
1198	Y	31.7	Very low	33.2	Very low	194 Å²	194	141.4 Å²	141.4	76%	0.761	75%	0.75	S	S	*	*			cis	-165.7	95.8	-37.8	-166.2	-101.2	0	0	0	113.7
1199	T	34.3	Very low	33.3	Very low	108 Å²	108	137 Å²	137	66%	0.663	74%	0.744	S	S	*	*			trans	69.7	174.5	148.8	80.8	0	0	0	0	119.2
1200	P	39.6	Very low	33.4	Very low	119 Å²	119	132 Å²	132	77%	0.773	74%	0.739	S	S	*	*			trans	-129.1	-167.2	-150.7	46.9	-35	0	0	0	116.6
1201	S	32	Very low	33.4	Very low	103 Å²	103	132.6 Å²	132.6	72%	0.72	75%	0.747	S	S	*	*			trans	177	140.9	144	40.5	0	0	0	0	118.2
1202	Y	32.6	Very low	33.6	Very low	212 Å²	212	128.6 Å²	128.6	83%	0.831	74%	0.739	S	S	*	*			trans	65.9	157.6	134.1	-77.2	-133.2	0	0	0	121.3
1203	F	34.8	Very low	33.5	Very low	169 Å²	169	127.5 Å²	127.5	74%	0.741	74%	0.737	S	S	*	*			cis	-161.6	-154.6	-33.9	-135.7	-34.1	0	0	0	109.8
1204	P	40.1	Very low	33.6	Very low	105 Å²	105	126.4 Å²	126.4	68%	0.682	74%	0.737	S	S	*	*			trans	-124.4	-158.7	-143.9	47.1	-29.2	0	0	0	116.7
1205	S	34.1	Very low	33.5	Very low	111 Å²	111	126 Å²	126	78%	0.776	73%	0.734	S	S	*	*			trans	127.1	153.7	158.6	70.7	0	0	0	0	113.8
1206	S	35.1	Very low	33.5	Very low	101 Å²	101	125.8 Å²	125.8	71%	0.706	74%	0.742	S	S	*	*			cis	-168.6	179.7	-15.3	49.7	0	0	0	0	112.3
1207	S	35.4	Very low	33.6	Very low	112 Å²	112	127.3 Å²	127.3	78%	0.783	75%	0.745	S	S	*	*			trans	74.9	151.4	160.9	76.6	0	0	0	0	119.4
1208	S	35.7	Very low	33.7	Very low	96 Å²	96	129 Å²	129	67%	0.671	75%	0.749	S	S	*	*			cis	-170.9	166.6	-22	53.1	0	0	0	0	112.7
1209	S	34.8	Very low	33.4	Very low	106 Å²	106	127.2 Å²	127.2	74%	0.741	75%	0.752	S	S	*	*			trans	65.2	150	149	43.7	0	0	0	0	120.5
1210	S	33.8	Very low	33.3	Very low	93 Å²	93	129.5 Å²	129.5	65%	0.65	76%	0.758	S	S	*	*			cis	-176	152.2	-11.8	48.5	0	0	0	0	112.7
1211	T	32	Very low	32.8	Very low	130 Å²	130	132.9 Å²	132.9	80%	0.798	76%	0.761	S	S	*	*			trans	58.9	152.7	146	50.6	0	0	0	0	121.2
1212	S	32.4	Very low	32.4	Very low	92 Å²	92	136.7 Å²	136.7	64%	0.643	77%	0.765	S	S	*	*			cis	-174.4	170.8	-13.1	52	0	0	0	0	110.6
1213	S	30.8	Very low	32.4	Very low	104 Å²	104	132.4 Å²	132.4	73%	0.727	76%	0.763	S	S	*	*			trans	63.8	152	150.4	48	0	0	0	0	119.5
1214	M	32.2	Very low	32	Very low	168 Å²	168	131.1 Å²	131.1	83%	0.828	76%	0.763	S	S	*	*			cis	-155.5	153.5	-5.1	-116	-89.4	151.8	0	0	111.3
1215	S	27.6	Very low	31.4	Very low	89 Å²	89	136 Å²	136	62%	0.622	77%	0.769	S	S	*	*			trans	-11.6	143.1	160	-47.4	0	0	0	0	120.5
1216	S	32.9	Very low	30.9	Very low	123 Å²	123	137.4 Å²	137.4	86%	0.86	77%	0.768	S	S	*	*				-173.9	143.7	101	-79.1	0	0	0	0	115.7
1217	Q	31.3	Very low	30.6	Very low	182 Å²	182	138.9 Å²	138.9	85%	0.85	77%	0.768	S	S	*	*			trans	-63.7	151.6	-173.3	-55.4	151.2	10.2	0	0	115.3
1218	Q	34.5	Very low	30.3	Very low	191 Å²	191	138.1 Å²	138.1	89%	0.893	76%	0.759	S	S	*	*			trans	-148.7	137.6	134.7	-116.3	179	47	0	0	111.8
1219	L	25.9	Very low	29.8	Very low	158 Å²	158	139.4 Å²	139.4	83%	0.827	76%	0.758	S	S	*	*			trans	-119	109.4	-172.3	-87.6	162.4	0	0	0	111.1
1220	I	31.8	Very low	29.7	Very low	155 Å²	155	143.4 Å²	143.4	80%	0.795	77%	0.765	S	S	*	*			trans	-140.7	93.7	160.4	-51.6	-179.1	0	0	0	106.5
1221	K	29.9	Very low	29.3	Very low	190 Å²	190	145.1 Å²	145.1	83%	0.826	77%	0.767	S	S	*	*				85.5	111.5	61.5	-165.3	175.7	-169.6	178	0	112
1222	F	23.1	Very low	29.2	Very low	183 Å²	183	145 Å²	145	80%	0.803	77%	0.77	S	S	*	*			trans	-56.6	157	176.7	-66.5	-98.1	0	0	0	113.4
1223	P	32.9	Very low	29.4	Very low	122 Å²	122	145.8 Å²	145.8	79%	0.792	78%	0.775	S	S	*	*			trans	-101.8	101.8	131.9	32.8	-26.8	0	0	0	110.1
1224	L	25.7	Very low	29.7	Very low	143 Å²	143	145.5 Å²	145.5	75%	0.749	77%	0.771	S	S	*	*			trans	-71.4	131	152.3	-77.1	167.1	0	0	0	106.9
1225	Y	28	Very low	29.4	Very low	206 Å²	206	145 Å²	145	81%	0.808	77%	0.772	S	S	*	*			trans	-136	89.2	163.3	-129.5	-80.2	0	0	0	110.7
1226	N	23.8	Very low	29.5	Very low	142 Å²	142	144.5 Å²	144.5	76%	0.759	78%	0.78	S	S	*	*			trans	-64.7	136.2	155.8	-88.8	-16.4	0	0	0	108.5
1227	N	28.9	Very low	29.5	Very low	131 Å²	131	143.6 Å²	143.6	70%	0.701	77%	0.774	S	S	*	*			trans	-161.2	92.4	139.5	-98.6	-5.1	0	0	0	106.5
1228	T	28.1	Very low	29.2	Very low	96 Å²	96	140.5 Å²	140.5	59%	0.589	76%	0.762	S	S	*	*				73.7	118.3	83.2	60.8	0	0	0	0	114.1
1229	N	25.7	Very low	29.3	Very low	123 Å²	123	140.6 Å²	140.6	66%	0.658	76%	0.76	S	S	*	*			trans	55.9	98.2	138.8	-52.3	-7.6	0	0	0	118.1
1230	H	32.8	Very low	29.3	Very low	190 Å²	190	137.1 Å²	137.1	88%	0.88	75%	0.749	S	S	*	*				-143	118.2	105.1	-87.2	-78	0	0	0	106.2
1231	N	26.1	Very low	29.1	Very low	130 Å²	130	137.4 Å²	137.4	70%	0.695	75%	0.751	S	S	*	*				46.8	77.8	54.7	-80	5	0	0	0	112.8
1232	C	28.9	Very low	29	Very low	128 Å²	128	132.7 Å²	132.7	87%	0.865	74%	0.742	S	S	*	*				-165.4	105.9	118.6	-97.7	0	0	0	0	111.8
1233	S	35.5	Very low	29.9	Very low	108 Å²	108	130.1 Å²	130.1	76%	0.755	74%	0.736	S	S	*	*			trans	-68.3	163.5	137.3	-140.3	0	0	0	0	107.2
1234	P	38.1	Very low	29.9	Very low	98 Å²	98	129.3 Å²	129.3	64%	0.636	73%	0.731	S	S	*	*				-159.9	176.6	64.1	46.2	-25.7	0	0	0	118.8
1235	N	26.7	Very low	30	Very low	158 Å²	158	131.7 Å²	131.7	85%	0.845	73%	0.73	S	S	*	*			trans	68.9	135.8	143.9	-64.7	-15.6	0	0	0	122.5
1236	G	28.7	Very low	29.9	Very low	78 Å²	78	126.2 Å²	126.2	80%	0.804	72%	0.715	S	S	*	*			trans	97.6	125	155.1	0	0	0	0	0	114.7
1237	S	32.6	Very low	29.9	Very low	103 Å²	103	125.9 Å²	125.9	72%	0.72	70%	0.704	S	S	*	*			cis	-157.7	134.6	-7.8	47.6	0	0	0	0	108.2
1238	I	26.6	Very low	29.8	Very low	118 Å²	118	126 Å²	126	61%	0.605	70%	0.7	S	S	*	*				47.2	115.2	103.1	-48.4	161.9	0	0	0	111.2
1239	F	34.7	Very low	29.6	Very low	193 Å²	193	126 Å²	126	85%	0.846	70%	0.696	S	S	*	*			cis	-122.9	139.5	27.5	-60.6	-100.7	0	0	0	110.8
1240	S	26.6	Very low	29.6	Very low	84 Å²	84	122 Å²	122	59%	0.587	68%	0.677	S	S	*	*			cis	66.6	134	3.7	-47	0	0	0	0	118.3
1241	L	26.9	Very low	29.1	Very low	161 Å²	161	116.4 Å²	116.4	84%	0.843	65%	0.654	S	S	*	*			trans	79.4	134.8	168	-56	149.4	0	0	0	114.9
1242	S	28.9	Very low	29.1	Very low	91 Å²	91	118.6 Å²	118.6	64%	0.636	66%	0.658	S	S	*	*			cis	-158.5	137.7	-4.8	36.5	0	0	0	0	112.8	P1244	S1242-P1244 VanDerWaalsContact O-CD 3.3Å; S1242-P1244 WeakPolarHBondContact O-CD 3.48Å
1243	D	41.9	Very low	28.9	Very low	129 Å²	129	118.2 Å²	118.2	69%	0.69	65%	0.647	S	S	*	*			trans	-69	126.5	144.4	171.3	39.5	0	0	0	108.1	R1245	D1243-R1245 IonicContact OD2-NE 3.9Å
1244	P	32.5	Very low	28.5	Very low	106 Å²	106	121.2 Å²	121.2	69%	0.688	65%	0.649	S	S	*	*			trans	-122.4	121.3	150.3	35.3	-25.4	0	0	0	110.6	S1242	S1242-P1244 VanDerWaalsContact O-CD 3.3Å; S1242-P1244 WeakPolarHBondContact O-CD 3.48Å
1245	R	28.3	Very low	28	Very low	193 Å²	193	121.1 Å²	121.1	73%	0.728	65%	0.65	S	S	*	*			trans	-61.2	178.9	157.7	-56.2	167.4	-164.9	-177.8	-0.5	110.2	D1243	D1243-R1245 IonicContact OD2-NE 3.9Å
1246	D	24.9	Very low	28	Very low	90 Å²	90	119.6 Å²	119.6	48%	0.481	64%	0.642	S	S	.	*			trans	88.3	160.1	147.3	-69.3	-50.7	0	0	0	120.3	L319	L319-D1246 WeakPolarHBondContact CA-OD1 3.38Å; L319-D1246 HydrophobicContact CD1-CB 3.42Å; L319-D1246 VanDerWaalsContact CD1-CB 3.42Å; L319-D1246 HydrophobicContact CG-CB 4.43Å; L319-D1246 PolarHBondContact N-OD1 3.45Å
1247	Y	24.1	Very low	27.9	Very low	136 Å²	136	121.9 Å²	121.9	53%	0.533	64%	0.636	S	S	.	*			trans	89.7	164.9	164.8	-72.5	-64.8	0	0	0	121.2	S317 T318 L319	S317-Y1247 VanDerWaalsContact CB-O 3.25Å; S317-Y1247 WeakPolarHBondContact CB-O 3.29Å; S317-Y1247 PolarHBondContact OG-O 3.38Å; T318-Y1247 HydrophobicContact CG2-CD1 3.92Å; L319-Y1247 HydrophobicContact CD1-CD1 3.91Å; L319-Y1247 HydrophobicContact CD1-CD2 3.75Å; L319-Y1247 HydrophobicContact CD1-CE1 3.53Å; L319-Y1247 HydrophobicContact CD1-CE2 3.36Å; L319-Y1247 HydrophobicContact CD1-CG 4.03Å; L319-Y1247 HydrophobicContact CD2-CE2 4.47Å; L319-Y1247 WeakPolarHBondContact CD2-OH 3.42Å
1248	H	26.6	Very low	27.7	Very low	134 Å²	134	123.9 Å²	123.9	62%	0.62	64%	0.639	S	S	*	*			trans	-53.5	167.8	-145.4	-73.9	-72.1	0	0	0	120.1	S317 T318	S317-H1248 VanDerWaalsContact OG-C 3.24Å; S317-H1248 WeakPolarHBondContact OG-CA 3.33Å; T318-H1248 HydrophobicContact CG2-CB 4.47Å
1249	L	25.5	Very low	27.6	Very low	94 Å²	94	122.9 Å²	122.9	49%	0.492	63%	0.633	S	S	.	*			cis	-169.9	160.8	-33.4	-155.9	78.7	0	0	0	108.2	P316 S317 T318	P316-L1249 VanDerWaalsContact O-CD1 3.29Å; P316-L1249 WeakPolarHBondContact O-CD1 3.3Å; S317-L1249 VanDerWaalsContact OG-CA 3.29Å; S317-L1249 WeakPolarHBondContact OG-CA 3.38Å; S317-L1249 PolarHBondContact OG-N 3.34Å; T318-L1249 HydrophobicContact CG2-CD1 3.69Å
1250	S	24	Very low	27.3	Very low	39 Å²	39	120.6 Å²	120.6	27%	0.273	62%	0.622	S	S	.	*			trans	10.3	129.6	153.3	65.1	0	0	0	0	120.6	S315	S315-S1250 WeakPolarHBondContact O-CA 3.47Å; S315-S1250 WeakPolarHBondContact O-CB 3.41Å; S315-S1250 PolarHBondContact O-N 2.75Å
1251	N	23.8	Very low	27.3	Very low	73 Å²	73	118.6 Å²	118.6	39%	0.39	61%	0.608	S	S	.	*			trans	66.5	154.1	155.4	-47.7	-23	0	0	0	113.1	E314	E314-N1251 PolarHBondContact OE2-ND2 2.95Å
1252	F	25.6	Very low	27.3	Very low	177 Å²	177	115.8 Å²	115.8	78%	0.776	59%	0.587	S	S	*	*			cis	-122.6	135.8	26.4	-92	-116.5	0	0	0	109.6
1253	L	25.3	Very low	27.3	Very low	120 Å²	120	116.2 Å²	116.2	63%	0.628	58%	0.582	S	S	*	*				62.4	130	85.5	-89.9	163.9	0	0	0	113.2
1254	E	26.6	Very low	26.8	Very low	171 Å²	171	114.3 Å²	114.3	80%	0.799	58%	0.579	S	S	*	*			trans	67.9	129.1	159.9	-66.1	159.1	-176.6	0	0	117
1255	S	28.1	Very low	26.6	Very low	95 Å²	95	116 Å²	116	66%	0.664	59%	0.588	S	S	*	*			cis	-165.1	161.8	-3.9	57.3	0	0	0	0	112.5
1256	N	27	Very low	26.5	Very low	127 Å²	127	111.3 Å²	111.3	68%	0.679	58%	0.583	S	S	*	*			trans	48.8	111.1	145.3	-60.6	-29.1	0	0	0	120.4
1257	N	25.8	Very low	26.7	Very low	126 Å²	126	114.9 Å²	114.9	67%	0.674	60%	0.597	S	S	*	*				43.6	121.3	108.7	-44.6	-33.9	0	0	0	118.3
1258	N	28.1	Very low	27.2	Very low	145 Å²	145	112.8 Å²	112.8	78%	0.775	60%	0.6	S	S	*	*				-173	130.3	94.4	-96.8	-46.1	0	0	0	115.1
1259	M	25.4	Very low	27.1	Very low	97 Å²	97	113.4 Å²	113.4	48%	0.478	61%	0.608	S	S	.	*			trans	-75.4	136.6	-169	-59.4	163.2	98	0	0	115.8	N853 D854	N853-M1259 HydrophobicContact CB-CB 3.76Å; N853-M1259 HydrophobicContact CB-CG 4.46Å; N853-M1259 VanDerWaalsContact O-CE 3.23Å; N853-M1259 WeakPolarHBondContact O-CE 3.31Å; D854-M1259 HydrophobicContact CB-CG 4.19Å; D854-M1259 VanDerWaalsContact OD2-CA 3.23Å; D854-M1259 WeakPolarHBondContact OD2-CA 3.42Å; D854-M1259 WeakPolarHBondContact OD2-CG 3.46Å
1260	K	26.9	Very low	27.2	Very low	145 Å²	145	113.9 Å²	113.9	63%	0.63	62%	0.619	S	S	*	*			trans	-156.5	88.4	164.5	-105	104.2	-134.5	165.5	0	118.3	E852 N853	E852-K1260 VanDerWaalsContact OE2-C 3.31Å; E852-K1260 WeakPolarHBondContact OE2-CA 3.4Å; E852-K1260 WeakPolarHBondContact OE2-CB 3.27Å; E852-K1260 WeakPolarHBondContact OE2-CG 3.19Å; N853-K1260 VanDerWaalsContact CB-N 3.33Å; N853-K1260 VanDerWaalsContact CG-C 3.42Å; N853-K1260 PolarHBondContact ND2-O 3.42Å
1261	S	27.2	Very low	27.5	Very low	42 Å²	42	118.6 Å²	118.6	29%	0.294	64%	0.641	S	S	.	*	S	Bend	trans	-172.5	121.4	156.2	105.8	0	0	0	0	113.4	E852 N853	E852-S1261 VanDerWaalsContact CD-C 3.45Å; E852-S1261 VanDerWaalsContact CG-N 3.32Å; E852-S1261 WeakPolarHBondContact OE1-CA 3.49Å; E852-S1261 PolarHBondContact OE1-N 3.4Å; E852-S1261 PolarHBondContact OE2-N 3.46Å; N853-S1261 WeakPolarHBondContact CA-O 3.36Å; N853-S1261 PolarHBondContact ND2-N 2.81Å; N853-S1261 WeakPolarHBondContact OD1-CA 3.26Å; N853-S1261 WeakPolarHBondContact OD1-CB 3.31Å; N853-S1261 PolarHBondContact OD1-N 2.81Å; N853-S1261 PolarHBondContact OD1-O 3.21Å; N853-S1261 PolarHBondContact OD1-OG 2.75Å
1262	Y	27.5	Very low	27.6	Very low	102 Å²	102	121.5 Å²	121.5	40%	0.4	66%	0.661	S	S	.	*			trans	-71.3	137.9	-172.9	-82	-87.4	0	0	0	112.8	D850 H851 E852	D850-Y1262 WeakPolarHBondContact CA-OH 3.49Å; D850-Y1262 VanDerWaalsContact O-CE1 3.29Å; D850-Y1262 WeakPolarHBondContact O-CE1 3.46Å; D850-Y1262 PolarHBondContact OD1-OH 3.1Å; H851-Y1262 HydrophobicContact CB-CE2 4.43Å; H851-Y1262 AromaticContact CD2-CE2 3.86Å; H851-Y1262 AromaticContact CD2-CZ 3.78Å; H851-Y1262 PolarHBondContact CD2-OH 3.35Å; H851-Y1262 AromaticContact CE1-CE2 3.64Å; H851-Y1262 AromaticContact CG-CE2 3.65Å; H851-Y1262 AromaticContact CG-CZ 3.71Å; H851-Y1262 PolarHBondContact N-OH 2.84Å; H851-Y1262 AromaticContact ND1-CE2 3.53Å; H851-Y1262 AromaticContact NE2-CE2 3.84Å; E852-Y1262 HydrophobicContact CG-CD1 4.36Å; E852-Y1262 HydrophobicContact CG-CD2 3.83Å; E852-Y1262 HydrophobicContact CG-CE2 4.28Å; E852-Y1262 HydrophobicContact CG-CG 3.86Å; E852-Y1262 VanDerWaalsContact CG-N 3.34Å; E852-Y1262 WeakPolarHBondContact OE1-CD2 3.4Å; E852-Y1262 PolarHBondContact OE1-N 2.99Å
1263	N	27.9	Very low	27.9	Very low	99 Å²	99	120.6 Å²	120.6	53%	0.529	67%	0.665	S	S	.	*			cis	61.5	112.7	27.7	-87.1	-34.7	0	0	0	116	E852	E852-N1263 WeakPolarHBondContact O-CB 3.33Å; E852-N1263 PolarHBondContact O-ND2 3.43Å
1264	S	32.7	Very low	28.8	Very low	89 Å²	89	121.2 Å²	121.2	62%	0.622	66%	0.659	S	S	*	*			cis	103.8	128.3	24.5	96.3	0	0	0	0	115.2
1265	T	27.4	Very low	29.9	Very low	142 Å²	142	116 Å²	116	87%	0.871	64%	0.64	S	S	*	*			trans	-169.3	112	169.1	-8.7	0	0	0	0	106.7
1266	C	26.2	Very low	31.1	Very low	95 Å²	95	114.3 Å²	114.3	64%	0.642	63%	0.625	S	S	*	*			cis	81.9	143	17.2	-149.4	0	0	0	0	115.1
1267	Q	29.6	Very low	32.7	Very low	165 Å²	165	110 Å²	110	77%	0.771	60%	0.6	S	S	*	*			trans	70.7	158.6	179.9	-54.8	-63.9	-54.2	0	0	116.1
1268	P	33.9	Very low	33.7	Very low	91 Å²	91	108 Å²	108	59%	0.591	59%	0.589	S	S	*	*			cis	-140.5	-169.6	-48.6	39.6	-24.2	0	0	0	114.8
1269	N	24.8	Very low	34.8	Very low	147 Å²	147	101.2 Å²	101.2	79%	0.786	55%	0.553	S	S	*	*			trans	89.2	151.3	155.1	-63.9	-19.3	0	0	0	121.2
1270	S	28	Very low	35.4	Very low	105 Å²	105	100.8 Å²	100.8	73%	0.734	56%	0.556	S	S	*	*			trans	78.1	100.1	159.3	-60.9	0	0	0	0	120.3
1271	L	29	Very low	35.9	Very low	137 Å²	137	96.8 Å²	96.8	72%	0.717	56%	0.556	S	S	*	*			trans	76.2	106.6	136.6	-58.3	169.9	0	0	0	119.8	N1273	L1271-N1273 PolarHBondContact O-ND2 3.19Å
1272	T	27.6	Very low	36.6	Very low	135 Å²	135	97.8 Å²	97.8	83%	0.828	56%	0.557	S	S	*	*			trans	41.1	80.4	132.8	60.6	0	0	0	0	118.4
1273	N	31.7	Very low	37.5	Very low	158 Å²	158	97.4 Å²	97.4	85%	0.845	56%	0.562	S	S	*	*			trans	-123.9	75	171.4	-87.7	-78.2	0	0	0	113.1	L1271	L1271-N1273 PolarHBondContact O-ND2 3.19Å
1274	R	44.4	Very low	38.5	Very low	133 Å²	133	98.3 Å²	98.3	50%	0.502	56%	0.561	S	S	.	*			trans	-68.2	141.7	163.6	-96.8	169.7	161.5	-175.7	-1.3	109.4	Y270 V1276	Y270-R1274 WeakPolarHBondContact OH-CB 3.32Å; Y270-R1274 WeakPolarHBondContact OH-CD 3.44Å; R1274-V1276 PolarHBondContact O-N 2.77Å
1275	P	49.1	Very low	39.8	Very low	61 Å²	61	101.9 Å²	101.9	40%	0.396	56%	0.561	S	S	.	*			trans	-71.5	112.7	-169.8	27	-34.5	0	0	0	113.1	Y259 Y1277	Y259-P1275 HydrophobicContact CE2-CG 4.41Å; P1275-Y1277 HydrophobicContact CB-CE2 4.27Å; P1275-Y1277 HydrophobicContact CG-CE2 4.21Å; P1275-Y1277 WeakPolarHBondContact O-CD2 3.18Å; P1275-Y1277 WeakPolarHBondContact O-CE2 3.29Å
1276	V	52.1	Low	41.2	Very low	59 Å²	59	100.1 Å²	100.1	36%	0.358	55%	0.546	S	S	.	.			trans	-74.8	125.3	172	-162.6	0	0	0	0	110	Q254 Y256 R1274 N1278	Q254-V1276 HydrophobicContact CB-CG1 4.15Å; Y256-V1276 HydrophobicContact CE1-CB 4.24Å; Y256-V1276 HydrophobicContact CE1-CG1 4.35Å; Y256-V1276 HydrophobicContact CE1-CG2 3.78Å; Y256-V1276 HydrophobicContact CE2-CG1 4.18Å; Y256-V1276 WeakPolarHBondContact OH-CG2 3.43Å; R1274-V1276 PolarHBondContact O-N 2.77Å; V1276-N1278 PolarHBondContact O-N 3.12Å
1277	Y	61	Low	42.6	Very low	38 Å²	38	97 Å²	97	15%	0.149	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	91.7	176.1	-66.5	-79.8	0	0	0	111.2	R231 Y255 L257 Y259 P1275 S1279	R231-Y1277 VanDerWaalsContact CD-OH 3.31Å; R231-Y1277 WeakPolarHBondContact CD-OH 3.1Å; R231-Y1277 HydrophobicContact CG-CE1 3.87Å; R231-Y1277 PolarHBondContact NH1-OH 3.41Å; Y255-Y1277 WeakPolarHBondContact CD1-O 3.29Å; Y255-Y1277 HydrophobicContact CD2-CD2 4.48Å; Y255-Y1277 WeakPolarHBondContact CE1-O 3.06Å; Y255-Y1277 VanDerWaalsContact CE2-CB 3.49Å; Y255-Y1277 HydrophobicContact CE2-CD2 4.07Å; Y255-Y1277 AromaticContact CE2-CG 3.9Å; Y255-Y1277 HydrophobicContact CE2-CG 3.9Å; Y255-Y1277 PolarHBondContact N-O 3.03Å; Y255-Y1277 WeakPolarHBondContact O-CB 3.46Å; Y255-Y1277 PolarHBondContact O-N 2.83Å; L257-Y1277 HydrophobicContact CB-CD2 4.35Å; L257-Y1277 HydrophobicContact CB-CE2 4.15Å; Y259-Y1277 PolarHBondContact OH-OH 3.29Å; P1275-Y1277 HydrophobicContact CB-CE2 4.27Å; P1275-Y1277 HydrophobicContact CG-CE2 4.21Å; P1275-Y1277 WeakPolarHBondContact O-CD2 3.18Å; P1275-Y1277 WeakPolarHBondContact O-CE2 3.29Å; Y1277-S1279 PolarHBondContact O-N 2.67Å
1278	N	47.5	Very low	43.7	Very low	83 Å²	83	93.1 Å²	93.1	44%	0.444	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	122.1	172.6	-67.4	-3.6	0	0	0	110.3	Q254 V1276 T1280	Q254-N1278 VanDerWaalsContact CD-OD1 3.27Å; Q254-N1278 VanDerWaalsContact CG-OD1 3.28Å; Q254-N1278 WeakPolarHBondContact CG-OD1 3.37Å; Q254-N1278 PolarHBondContact NE2-OD1 3.04Å; V1276-N1278 PolarHBondContact O-N 3.12Å; N1278-T1280 HydrophobicContact CB-CG2 4.28Å; N1278-T1280 PolarHBondContact O-N 3.43Å
1279	S	50.2	Low	44.4	Very low	3 Å²	3	93.7 Å²	93.7	2%	0.021	52%	0.517	C	S	.	.			trans	-71.9	28.8	-176.3	57.7	0	0	0	0	115.8	G252 D253 Y1277 G1281	G252-S1279 VanDerWaalsContact C-OG 3.22Å; G252-S1279 WeakPolarHBondContact CA-OG 3.25Å; G252-S1279 PolarHBondContact N-OG 2.9Å; D253-S1279 PolarHBondContact N-OG 3.1Å; D253-S1279 WeakPolarHBondContact O-CB 3.49Å; D253-S1279 PolarHBondContact O-N 2.93Å; D253-S1279 PolarHBondContact O-OG 2.9Å; Y1277-S1279 PolarHBondContact O-N 2.67Å; S1279-G1281 PolarHBondContact O-N 3.22Å
1280	T	39.1	Very low	45.8	Very low	88 Å²	88	88.9 Å²	88.9	54%	0.54	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	85	-175.1	61.6	0	0	0	0	113.4	R1053 N1278	R1053-T1280 PolarHBondContact NH1-OG1 3.27Å; N1278-T1280 HydrophobicContact CB-CG2 4.28Å; N1278-T1280 PolarHBondContact O-N 3.43Å
1281	G	36.3	Very low	47	Very low	61 Å²	61	91.7 Å²	91.7	63%	0.629	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.4	23	168.5	0	0	0	0	0	116.3	S1279 N1283	S1279-G1281 PolarHBondContact O-N 3.22Å; G1281-N1283 PolarHBondContact O-N 3.41Å
1282	I	42.6	Very low	48.6	Very low	63 Å²	63	87.6 Å²	87.6	32%	0.323	48%	0.476	S	S	.	.			trans	-77	108.4	176.1	-52.6	178.4	0	0	0	109.2
1283	N	46.5	Very low	50.2	Low	93 Å²	93	84.9 Å²	84.9	50%	0.497	46%	0.456	S	S	.	.			trans	-73.6	144.4	169.3	-66.9	-95.4	0	0	0	109	G1281 R1285	G1281-N1283 PolarHBondContact O-N 3.41Å; N1283-R1285 PolarHBondContact O-N 2.86Å
1284	F	49.6	Very low	52.1	Low	119 Å²	119	81.7 Å²	81.7	52%	0.522	44%	0.436	S	S	.	.			trans	-53.7	134.8	157.8	-61.4	-78.7	0	0	0	108.8	L226 I237	L226-F1284 HydrophobicContact CD1-CD1 4.46Å; L226-F1284 HydrophobicContact CD2-CB 4.47Å; I237-F1284 HydrophobicContact CD1-CD1 3.91Å; I237-F1284 HydrophobicContact CD1-CE1 3.62Å; I237-F1284 HydrophobicContact CG1-CD1 4.45Å; I237-F1284 HydrophobicContact CG1-CE1 4.15Å
1285	R	58.4	Low	53.7	Low	164 Å²	164	76.6 Å²	76.6	62%	0.619	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.7	140.8	173	-66.2	-178.2	178.4	-174	-1.3	107.4	V227 F229 N1283	V227-R1285 VanDerWaalsContact CG2-O 3.29Å; V227-R1285 WeakPolarHBondContact CG2-O 3.46Å; V227-R1285 PolarHBondContact N-O 3.47Å; F229-R1285 HydrophobicContact CE2-CB 4.35Å; N1283-R1285 PolarHBondContact O-N 2.86Å
1286	N	57.1	Low	55.2	Low	105 Å²	105	77.6 Å²	77.6	56%	0.561	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.4	148.5	156	-57.7	16.4	0	0	0	106.8
1287	V	56.3	Low	56.4	Low	28 Å²	28	74.9 Å²	74.9	17%	0.17	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-56.7	132.7	164.8	-163.9	0	0	0	0	107.1	P212 I221 V227	P212-V1287 HydrophobicContact CB-CG1 4.08Å; P212-V1287 HydrophobicContact CG-CG1 3.97Å; I221-V1287 HydrophobicContact CB-CG2 4.25Å; I221-V1287 HydrophobicContact CG2-CG2 3.5Å; I221-V1287 VanDerWaalsContact CG2-CG2 3.5Å; V227-V1287 HydrophobicContact CB-CG2 4.43Å; V227-V1287 HydrophobicContact CG1-CG2 3.75Å; V227-V1287 HydrophobicContact CG2-CG2 3.79Å
1288	P	51.7	Low	56.8	Low	85 Å²	85	80.7 Å²	80.7	55%	0.552	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-56.6	142.7	167.5	26.5	-34	0	0	0	107.9	P1290	P1288-P1290 VanDerWaalsContact O-N 3.1Å
1289	P	49.6	Very low	58.1	Low	103 Å²	103	80.6 Å²	80.6	67%	0.669	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-53.8	125.4	172.1	25	-33	0	0	0	107.2	I1291	P1289-I1291 PolarHBondContact O-N 3.47Å
1290	P	54.9	Low	59.4	Low	46 Å²	46	82.8 Å²	82.8	30%	0.299	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-59.6	129	178.4	27.3	-35.8	0	0	0	108	P1288 F1292	P1288-P1290 VanDerWaalsContact O-N 3.1Å; P1290-F1292 HydrophobicContact CB-CD1 4.04Å; P1290-F1292 HydrophobicContact CB-CD2 4.28Å; P1290-F1292 HydrophobicContact CB-CE1 3.57Å; P1290-F1292 HydrophobicContact CB-CE2 3.84Å; P1290-F1292 HydrophobicContact CB-CG 4.4Å; P1290-F1292 HydrophobicContact CB-CZ 3.48Å; P1290-F1292 VanDerWaalsContact CB-CZ 3.48Å; P1290-F1292 HydrophobicContact CG-CD2 3.88Å; P1290-F1292 HydrophobicContact CG-CE1 4.05Å; P1290-F1292 HydrophobicContact CG-CE2 3.32Å; P1290-F1292 HydrophobicContact CG-CG 4.48Å; P1290-F1292 HydrophobicContact CG-CZ 3.43Å; P1290-F1292 VanDerWaalsContact CG-CZ 3.43Å; P1290-F1292 PolarHBondContact O-N 3.44Å
1291	I	52.9	Low	61.1	Low	164 Å²	164	83.6 Å²	83.6	84%	0.841	44%	0.444	S	S	*	.			trans	-73.6	115	179.4	-57.8	175	0	0	0	106.1	P1289	P1289-I1291 PolarHBondContact O-N 3.47Å
1292	F	62.2	Low	62.6	Low	51 Å²	51	85.9 Å²	85.9	22%	0.224	45%	0.446	C	S	.	.			trans	-132.4	139.6	-177.1	-62.5	-33.8	0	0	0	107.8	Y194 F206 I207 P1290 E1294	Y194-F1292 HydrophobicContact CD1-CB 4.01Å; Y194-F1292 HydrophobicContact CE1-CB 4.3Å; F206-F1292 AromaticContact CD1-CD2 3.92Å; F206-F1292 HydrophobicContact CD1-CD2 3.92Å; F206-F1292 HydrophobicContact CD1-CE1 4.47Å; F206-F1292 AromaticContact CD1-CE2 3.83Å; F206-F1292 HydrophobicContact CD1-CE2 3.83Å; F206-F1292 HydrophobicContact CD1-CG 4.27Å; F206-F1292 HydrophobicContact CD1-CZ 4.1Å; F206-F1292 HydrophobicContact CE1-CB 3.94Å; F206-F1292 AromaticContact CE1-CD1 3.5Å; F206-F1292 HydrophobicContact CE1-CD1 3.5Å; F206-F1292 VanDerWaalsContact CE1-CD1 3.5Å; F206-F1292 AromaticContact CE1-CD2 3.55Å; F206-F1292 HydrophobicContact CE1-CD2 3.55Å; F206-F1292 AromaticContact CE1-CE1 3.61Å; F206-F1292 HydrophobicContact CE1-CE1 3.61Å; F206-F1292 AromaticContact CE1-CE2 3.66Å; F206-F1292 HydrophobicContact CE1-CE2 3.66Å; F206-F1292 AromaticContact CE1-CG 3.44Å; F206-F1292 HydrophobicContact CE1-CG 3.44Å; F206-F1292 VanDerWaalsContact CE1-CG 3.44Å; F206-F1292 AromaticContact CE1-CZ 3.67Å; F206-F1292 HydrophobicContact CE1-CZ 3.67Å; F206-F1292 HydrophobicContact CZ-CB 4.42Å; F206-F1292 HydrophobicContact CZ-CD1 4.12Å; F206-F1292 HydrophobicContact CZ-CE1 4.4Å; F206-F1292 HydrophobicContact CZ-CG 4.25Å; I207-F1292 HydrophobicContact CG1-CE2 4.2Å; P1290-F1292 HydrophobicContact CB-CD1 4.04Å; P1290-F1292 HydrophobicContact CB-CD2 4.28Å; P1290-F1292 HydrophobicContact CB-CE1 3.57Å; P1290-F1292 HydrophobicContact CB-CE2 3.84Å; P1290-F1292 HydrophobicContact CB-CG 4.4Å; P1290-F1292 HydrophobicContact CB-CZ 3.48Å; P1290-F1292 VanDerWaalsContact CB-CZ 3.48Å; P1290-F1292 HydrophobicContact CG-CD2 3.88Å; P1290-F1292 HydrophobicContact CG-CE1 4.05Å; P1290-F1292 HydrophobicContact CG-CE2 3.32Å; P1290-F1292 HydrophobicContact CG-CG 4.48Å; P1290-F1292 HydrophobicContact CG-CZ 3.43Å; P1290-F1292 VanDerWaalsContact CG-CZ 3.43Å; P1290-F1292 PolarHBondContact O-N 3.44Å; F1292-E1294 VanDerWaalsContact C-N 3.34Å; F1292-E1294 PolarHBondContact O-N 3.29Å
1293	D	61.5	Low	63.6	Low	78 Å²	78	87 Å²	87	42%	0.417	45%	0.452	S	S	.	.			trans	-77.6	89.1	178	-56.4	-64.8	0	0	0	109.1	M1295	D1293-M1295 HydrophobicContact CB-CE 4.1Å; D1293-M1295 PolarHBondContact O-N 2.89Å
1294	E	72.3	Confident	64.5	Low	91 Å²	91	86.7 Å²	86.7	43%	0.425	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	109.7	178.6	-173.9	171.1	134.7	0	0	109.8	R192 Y194 F1292	R192-E1294 WeakPolarHBondContact CD-OE1 3.32Å; R192-E1294 IonicContact CZ-OE1 3.43Å; R192-E1294 IonicContact NE-OE1 3.32Å; R192-E1294 IonicContact NH1-OE1 3.51Å; R192-E1294 PolarHBondContact NH1-OE1 2.94Å; Y194-E1294 HydrophobicContact CD1-CB 4.1Å; Y194-E1294 HydrophobicContact CD1-CG 4.39Å; Y194-E1294 HydrophobicContact CE1-CB 3.55Å; Y194-E1294 HydrophobicContact CE1-CG 3.61Å; Y194-E1294 WeakPolarHBondContact CE1-OE2 3.46Å; Y194-E1294 PolarHBondContact OH-OE2 2.88Å; F1292-E1294 VanDerWaalsContact C-N 3.34Å; F1292-E1294 PolarHBondContact O-N 3.29Å
1295	M	77.1	Confident	65.3	Low	26 Å²	26	84.9 Å²	84.9	13%	0.128	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	130.1	-172.9	-67.5	169.4	-177.6	0	0	111	I170 D171 R192 C193 T195 D1293	I170-M1295 HydrophobicContact CG2-CB 3.94Å; I170-M1295 HydrophobicContact CG2-CG 4.25Å; I170-M1295 HydrophobicContact CG2-SD 3.49Å; I170-M1295 WeakPolarHBondContact CG2-SD 3.42Å; D171-M1295 VanDerWaalsContact CG-CE 3.47Å; D171-M1295 WeakPolarHBondContact OD1-CE 3.21Å; D171-M1295 WeakPolarHBondContact OD2-CE 3.34Å; R192-M1295 WeakPolarHBondContact CA-O 3.2Å; C193-M1295 PolarHBondContact N-O 2.86Å; C193-M1295 PolarHBondContact O-N 2.63Å; T195-M1295 HydrophobicContact CG2-CE 4.09Å; T195-M1295 HydrophobicContact CG2-SD 3.47Å; T195-M1295 WeakPolarHBondContact CG2-SD 3.38Å; T195-M1295 WeakPolarHBondContact OG1-CE 3.3Å; T195-M1295 PolarHBondContact OG1-SD 3.49Å; D1293-M1295 HydrophobicContact CB-CE 4.1Å; D1293-M1295 PolarHBondContact O-N 2.89Å
1296	T	79.6	Confident	65.8	Low	81 Å²	81	80.2 Å²	80.2	50%	0.497	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	119.9	176.4	60.1	0	0	0	0	110.2	R1298	T1296-R1298 PolarHBondContact O-N 3.4Å
1297	C	78.3	Confident	66.3	Low	3 Å²	3	78.7 Å²	78.7	2%	0.02	43%	0.427	C	S	.	.			trans	-74	66.6	179.2	-54	0	0	0	0	110.9	H168 I170 L180 E191 R192 C193 P1299	H168-C1297 PolarHBondContact CE1-O 2.95Å; H168-C1297 VanDerWaalsContact CE1-O 3.3Å; H168-C1297 PolarHBondContact ND1-O 3.3Å; I170-C1297 HydrophobicContact CD1-CB 4.23Å; L180-C1297 HydrophobicContact CD2-CB 3.74Å; E191-C1297 PolarHBondContact O-N 3.31Å; R192-C1297 VanDerWaalsContact CA-SG 3.55Å; R192-C1297 PolarHBondContact N-SG 3.29Å; C193-C1297 PolarHBondContact N-SG 2.73Å; C193-C1297 VanDerWaalsContact N-SG 3.41Å; C1297-P1299 VanDerWaalsContact O-CD 3.29Å; C1297-P1299 WeakPolarHBondContact O-CD 3.29Å
1298	R	69.8	Low	67	Low	159 Å²	159	82.1 Å²	82.1	60%	0.6	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-66.8	121.6	-175.6	-68.9	-174.2	178.6	-153.6	-2.4	111.2	H168 T1296 N1300	H168-R1298 WeakPolarHBondContact CA-O 3.23Å; T1296-R1298 PolarHBondContact O-N 3.4Å; R1298-N1300 PolarHBondContact O-N 3.29Å
1299	P	75.2	Confident	68.1	Low	81 Å²	81	81.9 Å²	81.9	53%	0.526	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	119.4	168.8	30.8	-31.4	0	0	0	109.1	C1297	C1297-P1299 VanDerWaalsContact O-CD 3.29Å; C1297-P1299 WeakPolarHBondContact O-CD 3.29Å
1300	N	76.1	Confident	69.5	Low	49 Å²	49	80.2 Å²	80.2	26%	0.262	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	151	168.4	-54.6	-56.6	0	0	0	109	Y166 Y167 S169 R1298	Y166-N1300 CarbonylContact C-O 3.52Å; Y166-N1300 WeakPolarHBondContact CA-O 3.43Å; Y167-N1300 HydrophobicContact CD1-CB 3.92Å; Y167-N1300 HydrophobicContact CD2-CB 4.38Å; Y167-N1300 HydrophobicContact CE1-CB 3.5Å; Y167-N1300 HydrophobicContact CE2-CB 3.97Å; Y167-N1300 WeakPolarHBondContact CE2-ND2 3.29Å; Y167-N1300 HydrophobicContact CG-CB 4.36Å; Y167-N1300 PolarHBondContact N-O 2.73Å; Y167-N1300 PolarHBondContact O-N 3.2Å; S169-N1300 VanDerWaalsContact CB-ND2 3.32Å; S169-N1300 WeakPolarHBondContact CB-ND2 3.23Å; S169-N1300 PolarHBondContact OG-ND2 3.05Å; R1298-N1300 PolarHBondContact O-N 3.29Å
1301	L	74.9	Confident	70.7	Confident	105 Å²	105	83.1 Å²	83.1	55%	0.55	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	140	166	-161.2	80.2	0	0	0	109.2	Q165 Y166 Y167	Q165-L1301 HydrophobicContact CG-CD1 3.84Å; Q165-L1301 WeakPolarHBondContact O-CD1 3.33Å; Y166-L1301 HydrophobicContact CD1-CD1 3.98Å; Y166-L1301 HydrophobicContact CE1-CD1 3.51Å; Y167-L1301 WeakPolarHBondContact CE1-O 3.34Å
1302	V	68.6	Low	72.3	Confident	109 Å²	109	75.7 Å²	75.7	66%	0.661	39%	0.392	S	S	*	.			trans	-68.3	0	169.8	176.1	0	0	0	0	111.2	I162 D164 Q165 Y167	I162-V1302 HydrophobicContact CG2-CG2 4.18Å; D164-V1302 WeakPolarHBondContact O-CG2 3.28Å; Q165-V1302 PolarHBondContact O-N 3.06Å; Y167-V1302 HydrophobicContact CD1-CB 4.44Å; Y167-V1302 HydrophobicContact CD1-CG2 3.57Å; Y167-V1302 HydrophobicContact CE1-CG2 4.32Å; Y167-V1302 HydrophobicContact CG-CG2 4.39Å

Retrieved 1,302 of 1,302 residues in 1001.5 ms (Link to these results)

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