A0A3Q0KN31_SCHMA Loading...

Serine/threonine-protein kinase DDB_G0282963

AlphaFold DB , UniProt , Accession A0A3Q0KN31, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 967 aa.

						>A0A3Q0KN31_SCHMA|A0A3Q0KN31
MALINSNKPDSDGNLTGTIVRHLDSPSQSSVSSEELLIWSKEGNDYDWELFPISPPLNGELSRIQGSSNVECDSSFTPVTNNNLNDVNNGSKAITITESNFSNSNSSNDTTIYSYNHHNSVTGQLSTSPLTLQSCSHYMNGSSIQPQLIHSTKTNIIETTINELIPSSSFSRTLSSSKTVTNNSFSFNNLYDQINVNTLADDFIDLDIKTIPTTSGCSLTTSYHPDFDYVGFPESPIQSLQNSASNKKSQPLNLFISNNGINVQKSSVVSQSPETEIIRQTSLNPHFRQMLSSVNEIPTTKVFVGYNNGVGNNNDDSSTNYTDYRCNQNGYNNKKNNKSFHCQSSELIDHLLSSDNESSEDLPGYSFLSSSSASSCIHIPSTCNDDNHNDNNSCHVNHMENNTLSTNTIHKIVNNEENADNCHHHHEYHKHKNRQYQRQDNGLMSLTSCNSIPLPFMLIPTSELASGGSLTCTVVNILRCLGLLDRCGVEDLCAILYDFWNNNCHAPFYPAHSFFNSYVIYPTCWELSRMEESVVTRSSSFTSCTLVDSRRSTVPGEDYERNYQMLINCRESKPLNGSCLVSYLLSCSYMGTSFLASHPIYNLNNLSSPCCLRLPTSCCYFVMDRANQISPYNTPATYHPNLIQPISNSNMNWRRGCADNLVLMLTHHSPGSKNTSSVVDKLLTGRFLPGPTSWRSVWPFIHKNHSKCFNCTKPESNMSDSLALWFSAWLYCGAIPVLAQLCDSAYSNAQYFPPDILQQSCNSSRYSAQELVWSHRLVYGVTENNEVYLTNPNELVPVQYVLDQLSKKPEIRISKAQISNLWTKHYLHSKLYPDRDQTIEDKQHISCKSTFFTGESLTLLARHPDPRWASMNIMGQVLCTLRSLERWANTLELSNVVSLDCVNYQSALFPDTTSSISCSRTNSTETEQFSNSPAITIPSAQLPGISLFIEKSNWELVHTLLQTKCIE
					

Structure Viewer

Loading PAE data...

(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	27.9	Very low	32.3	Very low	222 Å²	222	140.2 Å²	140.2	100%	1.094	78%	0.78	S	S	*	*				0	157.5	0	-53.1	-167.6	-144.7	0	0	106.5
2	A	31.3	Very low	32.3	Very low	88 Å²	88	142.3 Å²	142.3	73%	0.727	79%	0.789	S	S	*	*			cis	60.1	155.4	37.4	0	0	0	0	0	113.2
3	L	29.1	Very low	32.4	Very low	143 Å²	143	137.5 Å²	137.5	75%	0.749	79%	0.792	S	S	*	*			trans	32	143.1	140.4	-65.6	170.8	0	0	0	121.8
4	I	30.7	Very low	32	Very low	144 Å²	144	139.4 Å²	139.4	74%	0.738	80%	0.798	S	S	*	*			trans	83.9	131.2	156.2	-64.1	150.3	0	0	0	116.6
5	N	27.3	Very low	32.1	Very low	160 Å²	160	141.4 Å²	141.4	86%	0.856	80%	0.804	S	S	*	*			trans	-88.9	113.8	173.2	178.4	14.4	0	0	0	109.2
6	S	32	Very low	31.9	Very low	95 Å²	95	141.2 Å²	141.2	66%	0.664	81%	0.807	S	S	*	*			trans	-153	94.3	178.6	60.2	0	0	0	0	114
7	N	32.9	Very low	31.8	Very low	150 Å²	150	137.6 Å²	137.6	80%	0.802	81%	0.808	S	S	*	*			trans	30.3	122.3	148.8	-66.4	-27.2	0	0	0	121.8
8	K	34.6	Very low	31.6	Very low	202 Å²	202	137.6 Å²	137.6	88%	0.878	81%	0.81	S	S	*	*			trans	82.9	157.1	139.6	-86.5	-161.6	170.5	-168.8	0	119.4
9	P	40.7	Very low	31.6	Very low	97 Å²	97	139.6 Å²	139.6	63%	0.63	82%	0.815	S	S	*	*				-133.4	-179.3	-129.6	32.4	-8.8	0	0	0	115.7
10	D	33.2	Very low	31.4	Very low	145 Å²	145	138.5 Å²	138.5	78%	0.775	81%	0.81	S	S	*	*				162.8	152.1	115.4	-82.7	-34.9	0	0	0	115.1
11	S	35.2	Very low	31.4	Very low	96 Å²	96	143.6 Å²	143.6	67%	0.671	82%	0.815	S	S	*	*			trans	52.1	115.4	158.3	64.4	0	0	0	0	123.5
12	D	33.2	Very low	31.2	Very low	166 Å²	166	140.7 Å²	140.7	89%	0.888	80%	0.799	S	S	*	*				63.5	135.5	123.2	-51.5	-23.6	0	0	0	124.4
13	G	32.9	Very low	31.2	Very low	80 Å²	80	144.4 Å²	144.4	83%	0.825	81%	0.805	S	S	*	*			trans	155.2	103.6	160.1	0	0	0	0	0	116
14	N	27.6	Very low	31.1	Very low	163 Å²	163	143.6 Å²	143.6	87%	0.872	80%	0.802	S	S	*	*			trans	-77.9	149.2	172.7	-75.3	-47.6	0	0	0	112.6
15	L	33.2	Very low	31.2	Very low	170 Å²	170	142.4 Å²	142.4	89%	0.89	81%	0.806	S	S	*	*				-176.4	167.4	122	-100.4	162.4	0	0	0	113.9
16	T	28	Very low	31.3	Very low	138 Å²	138	140.9 Å²	140.9	85%	0.847	81%	0.805	S	S	*	*			trans	-101.7	153.9	-168.3	47.8	0	0	0	0	114.1
17	G	31	Very low	31.1	Very low	81 Å²	81	141.2 Å²	141.2	84%	0.835	81%	0.808	S	S	*	*			trans	-173.7	120.2	169.3	0	0	0	0	0	114.5
18	T	27.4	Very low	31	Very low	137 Å²	137	143.4 Å²	143.4	84%	0.84	81%	0.813	S	S	*	*			trans	-94.1	151.1	176.2	41.3	0	0	0	0	112.6
19	I	32.4	Very low	30.8	Very low	175 Å²	175	139 Å²	139	90%	0.897	81%	0.807	S	S	*	*			trans	-152.4	153.1	154.3	-104.6	153.4	0	0	0	109.1
20	V	28	Very low	30.1	Very low	118 Å²	118	139.6 Å²	139.6	72%	0.715	81%	0.814	S	S	*	*			trans	-126.4	141.2	-169.6	173.8	0	0	0	0	110.5
21	R	30.2	Very low	30	Very low	245 Å²	245	139.9 Å²	139.9	93%	0.925	82%	0.821	S	S	*	*			trans	-179.3	157.4	137.6	-97.4	153.9	-153.1	-132.7	4.9	114.8
22	H	24.9	Very low	29.6	Very low	161 Å²	161	139.9 Å²	139.9	75%	0.745	82%	0.821	S	S	*	*			trans	-59.3	160.3	-178	-69.6	-116.9	0	0	0	116
23	L	30.6	Very low	29.4	Very low	166 Å²	166	136.4 Å²	136.4	87%	0.869	81%	0.81	S	S	*	*				-158.6	165.9	116.7	-105.3	164.9	0	0	0	111.1
24	D	28	Very low	29.1	Very low	127 Å²	127	141.5 Å²	141.5	68%	0.679	81%	0.812	S	S	*	*			trans	-102.9	170.9	-153.2	-53.3	-79.4	0	0	0	116.4
25	S	31.2	Very low	29.1	Very low	118 Å²	118	142.8 Å²	142.8	83%	0.825	81%	0.812	S	S	*	*			trans	-76.6	154.3	171.9	-43.2	0	0	0	0	113
26	P	31.2	Very low	28.9	Very low	128 Å²	128	143 Å²	143	83%	0.831	81%	0.813	S	S	*	*			trans	-119.7	155.6	155.4	36.8	-27.4	0	0	0	113.3
27	S	25.8	Very low	28.9	Very low	103 Å²	103	144 Å²	144	72%	0.72	81%	0.813	S	S	*	*			trans	-133.8	135.6	173	56.7	0	0	0	0	110.9
28	Q	31.3	Very low	28.8	Very low	196 Å²	196	146.5 Å²	146.5	92%	0.916	81%	0.806	S	S	*	*			trans	163.6	156.1	169.5	-99	156.4	85.6	0	0	108.2
29	S	30	Very low	28.8	Very low	108 Å²	108	152.5 Å²	152.5	76%	0.755	81%	0.813	S	S	*	*			cis	-155.4	173.9	-2.5	49.1	0	0	0	0	111.2
30	S	26.5	Very low	28.5	Very low	110 Å²	110	149.1 Å²	149.1	77%	0.769	81%	0.805	S	S	*	*			trans	-70.5	148	179.9	52.6	0	0	0	0	116.7
31	V	31.2	Very low	28.7	Very low	151 Å²	151	152 Å²	152	92%	0.915	81%	0.808	S	S	*	*			trans	-144.6	155.2	149.2	-173.8	0	0	0	0	108.5
32	S	26.9	Very low	28.7	Very low	97 Å²	97	148.4 Å²	148.4	68%	0.678	80%	0.802	S	S	*	*			trans	-116.1	171.8	-179.5	63.9	0	0	0	0	113.6
33	S	29	Very low	29	Very low	93 Å²	93	143.8 Å²	143.8	65%	0.65	80%	0.798	S	S	*	*			trans	64.5	109	153.3	45.4	0	0	0	0	120
34	E	27.1	Very low	29	Very low	187 Å²	187	142.2 Å²	142.2	87%	0.874	79%	0.791	S	S	*	*			trans	78.9	145.7	134.3	-64.3	177.7	148.2	0	0	122.2
35	E	27.4	Very low	29.1	Very low	189 Å²	189	142 Å²	142	88%	0.883	79%	0.789	S	S	*	*			trans	38.1	108.4	170.1	-58.8	-159.5	132.9	0	0	121
36	L	28	Very low	29	Very low	174 Å²	174	146.6 Å²	146.6	91%	0.911	79%	0.79	S	S	*	*			trans	-140.1	91.8	148.8	-120	173.9	0	0	0	111.1
37	L	28.7	Very low	28.9	Very low	161 Å²	161	146.3 Å²	146.3	84%	0.843	78%	0.782	S	S	*	*			trans	-110.4	172.8	163.6	-115.1	172.1	0	0	0	109.1
38	I	28.4	Very low	29.2	Very low	132 Å²	132	153.4 Å²	153.4	68%	0.677	79%	0.793	S	S	*	*			trans	81.4	95.6	179.9	-49	170.1	0	0	0	115
39	W	28.1	Very low	29	Very low	263 Å²	263	151.2 Å²	151.2	100%	0.996	78%	0.783	S	S	*	*			trans	-99.5	109.2	132.2	-97.8	16.3	0	0	0	107.9
40	S	27.1	Very low	28.9	Very low	105 Å²	105	154.8 Å²	154.8	73%	0.734	79%	0.792	S	S	*	*			trans	-164.3	124.9	166.8	-76.5	0	0	0	0	109.1
41	K	31.7	Very low	28.9	Very low	179 Å²	179	157.1 Å²	157.1	78%	0.778	79%	0.789	S	S	*	*			trans	-156.9	94.6	166.6	-148.2	163.7	-174	178.8	0	109.1
42	E	30	Very low	29	Very low	168 Å²	168	155.3 Å²	155.3	79%	0.785	78%	0.78	S	S	*	*				73.1	130.2	107.3	-67.4	177.3	135.8	0	0	114.1
43	G	30.6	Very low	29	Very low	65 Å²	65	157.9 Å²	157.9	67%	0.67	78%	0.784	S	S	*	*			trans	169.3	106.9	178.3	0	0	0	0	0	112.8
44	N	30.2	Very low	28.8	Very low	133 Å²	133	158.5 Å²	158.5	71%	0.711	79%	0.789	S	S	*	*			trans	-155.2	148.4	-163.4	-61.4	90.8	0	0	0	109.2
45	D	31.6	Very low	29.5	Very low	121 Å²	121	155.3 Å²	155.3	65%	0.647	78%	0.784	S	S	*	*			cis	-161.7	168.4	-13.4	-102	-36.7	0	0	0	109.6
46	Y	29.3	Very low	29.7	Very low	216 Å²	216	151.8 Å²	151.8	85%	0.847	78%	0.778	S	S	*	*			trans	67.5	163.4	170.5	-60.7	-75.2	0	0	0	118.5
47	D	28.9	Very low	29.6	Very low	122 Å²	122	150.6 Å²	150.6	65%	0.652	77%	0.772	S	S	*	*			cis	179.5	117.4	-35.8	-167	8.9	0	0	0	109.9
48	W	30.3	Very low	29.4	Very low	251 Å²	251	150.5 Å²	150.5	95%	0.951	77%	0.772	S	S	*	*			trans	-149.5	128.8	157.3	-1.5	-84.5	0	0	0	115.6
49	E	27.2	Very low	29.3	Very low	151 Å²	151	147.4 Å²	147.4	71%	0.706	77%	0.773	S	S	*	*			trans	-46.3	150.1	175.5	-50.7	173.4	124.5	0	0	118.2	F51	E49-F51 HydrophobicContact CB-CD2 4.1Å; E49-F51 HydrophobicContact CG-CD2 4.06Å; E49-F51 HydrophobicContact CG-CE2 4.36Å
50	L	28.5	Very low	29.1	Very low	182 Å²	182	143.6 Å²	143.6	95%	0.953	77%	0.766	S	S	*	*			trans	-143.9	83	132.3	-102.5	178.5	0	0	0	110.5
51	F	26.1	Very low	29.2	Very low	160 Å²	160	144.4 Å²	144.4	70%	0.702	76%	0.761	S	S	*	*			trans	-74.6	-170.9	164.9	-81	-71.6	0	0	0	110.9	E49	E49-F51 HydrophobicContact CB-CD2 4.1Å; E49-F51 HydrophobicContact CG-CD2 4.06Å; E49-F51 HydrophobicContact CG-CE2 4.36Å
52	P	33.6	Very low	29.1	Very low	113 Å²	113	140.9 Å²	140.9	73%	0.734	76%	0.759	S	S	*	*			cis	-118.1	-154.1	-1.4	23	4.2	0	0	0	111.3
53	I	28.3	Very low	29	Very low	150 Å²	150	143 Å²	143	77%	0.769	76%	0.76	S	S	*	*			cis	-146.5	164.5	18.5	-56.6	163.3	0	0	0	109.8
54	S	24.4	Very low	29	Very low	107 Å²	107	146.5 Å²	146.5	75%	0.748	76%	0.762	S	S	*	*			trans	-145.4	165	163.4	-62.6	0	0	0	0	110.1
55	P	41.5	Very low	29.1	Very low	119 Å²	119	149 Å²	149	77%	0.773	77%	0.769	S	S	*	*			cis	-114.5	-164.6	-35.3	39.1	-23.6	0	0	0	110
56	P	30.7	Very low	29	Very low	115 Å²	115	146.3 Å²	146.3	75%	0.747	77%	0.77	S	S	*	*				-158.8	178.4	85.1	43.1	-22.2	0	0	0	117.9
57	L	25.7	Very low	29.1	Very low	149 Å²	149	142.1 Å²	142.1	78%	0.78	77%	0.773	S	S	*	*			trans	4.3	131.4	151.6	-67.6	157.7	0	0	0	122.5
58	N	24.4	Very low	29.2	Very low	159 Å²	159	141.1 Å²	141.1	85%	0.85	78%	0.775	S	S	*	*			trans	51.9	131.9	136.3	-62.9	5.6	0	0	0	123.4
59	G	26.4	Very low	29.1	Very low	67 Å²	67	136.2 Å²	136.2	69%	0.691	77%	0.768	S	S	*	*			trans	137	111.3	162	0	0	0	0	0	111.3
60	E	25.2	Very low	29.3	Very low	183 Å²	183	135.4 Å²	135.4	86%	0.855	77%	0.773	S	S	*	*				59.8	134.1	56.6	-68.1	-147.5	142.6	0	0	114.2
61	L	28	Very low	29.1	Very low	122 Å²	122	135 Å²	135	64%	0.639	77%	0.766	S	S	*	*			cis	-134.4	162.8	0.6	-67.1	90.8	0	0	0	109.4
62	S	30.2	Very low	29.3	Very low	105 Å²	105	133.6 Å²	133.6	73%	0.734	78%	0.775	S	S	*	*				163.4	157.7	86.9	-69.6	0	0	0	0	109.2
63	R	28.7	Very low	28.8	Very low	212 Å²	212	136.1 Å²	136.1	80%	0.8	78%	0.782	S	S	*	*			cis	-160.1	157.9	-19.6	-98.7	178.8	-178.7	-175.6	0.9	103.7
64	I	30.6	Very low	28.9	Very low	139 Å²	139	134.3 Å²	134.3	71%	0.713	78%	0.783	S	S	*	*				-164.3	125.7	70.2	-80	174.9	0	0	0	109.5
65	Q	31.3	Very low	28.9	Very low	185 Å²	185	133.6 Å²	133.6	86%	0.864	78%	0.778	S	S	*	*			trans	38.8	134.1	145.7	-57.4	170.6	-66.2	0	0	121.8
66	G	29.6	Very low	28.3	Very low	65 Å²	65	136.9 Å²	136.9	67%	0.67	78%	0.78	S	S	*	*			cis	158.9	-178.9	-8.3	0	0	0	0	0	116.2
67	S	31	Very low	28.2	Very low	128 Å²	128	137.3 Å²	137.3	90%	0.895	78%	0.781	S	S	*	*			trans	64	139.2	169.4	36.7	0	0	0	0	118.5
68	S	32.5	Very low	28.4	Very low	101 Å²	101	136.1 Å²	136.1	71%	0.706	78%	0.782	S	S	*	*			cis	-159.8	147	0.6	51.5	0	0	0	0	113.9
69	N	27.1	Very low	28.4	Very low	149 Å²	149	134.2 Å²	134.2	80%	0.797	78%	0.776	S	S	*	*			trans	14.3	147.7	145.7	-42.4	1.5	0	0	0	119.3
70	V	32	Very low	28.5	Very low	134 Å²	134	136.9 Å²	136.9	81%	0.812	78%	0.779	S	S	*	*				-156.6	163.1	51	170.1	0	0	0	0	111.4
71	E	24.2	Very low	28.5	Very low	173 Å²	173	134.3 Å²	134.3	81%	0.808	77%	0.771	S	S	*	*			trans	-71.6	160	178.9	-57.7	145.7	107.9	0	0	115.7
72	C	30.6	Very low	28.5	Very low	131 Å²	131	133.9 Å²	133.9	89%	0.885	77%	0.77	S	S	*	*				175.7	138.9	116	-97.8	0	0	0	0	113.2
73	D	23.4	Very low	28.4	Very low	165 Å²	165	135.5 Å²	135.5	88%	0.882	77%	0.77	S	S	*	*			trans	-78.8	143.2	169.3	-79	-62.1	0	0	0	112.8
74	S	29.7	Very low	28.6	Very low	112 Å²	112	132.6 Å²	132.6	78%	0.783	77%	0.77	S	S	*	*			trans	179.1	144.9	131.9	34.6	0	0	0	0	113.8
75	S	25.1	Very low	28.6	Very low	92 Å²	92	132.2 Å²	132.2	64%	0.643	77%	0.769	S	S	*	*			trans	-0.5	134.7	158.9	57.9	0	0	0	0	118.6
76	F	28.1	Very low	28.6	Very low	188 Å²	188	130.2 Å²	130.2	83%	0.825	76%	0.764	S	S	*	*				-164.4	148.5	64.4	-106.1	-85.3	0	0	0	113.9
77	T	27.4	Very low	28.7	Very low	125 Å²	125	132.4 Å²	132.4	77%	0.767	76%	0.764	S	S	*	*			trans	-141.2	154.4	150.5	54.8	0	0	0	0	109.3
78	P	30.7	Very low	28.5	Very low	123 Å²	123	133 Å²	133	80%	0.799	76%	0.757	S	S	*	*			trans	-139.1	156.9	137.2	37.2	-25.4	0	0	0	113.5
79	V	25.3	Very low	28.5	Very low	119 Å²	119	135.9 Å²	135.9	72%	0.721	77%	0.765	S	S	*	*			trans	-135	109.7	-173.9	169.4	0	0	0	0	110.8
80	T	26.9	Very low	28.7	Very low	123 Å²	123	132.1 Å²	132.1	76%	0.755	76%	0.761	S	S	*	*			trans	58.6	158.9	159.6	70.6	0	0	0	0	117.2
81	N	25.7	Very low	28.5	Very low	130 Å²	130	131.6 Å²	131.6	70%	0.695	76%	0.763	S	S	*	*			cis	-175.4	176.2	27.6	-140.4	-6.4	0	0	0	111.9
82	N	29.2	Very low	28.9	Very low	113 Å²	113	133.8 Å²	133.8	60%	0.604	77%	0.77	S	S	*	*			trans	80.2	98.5	149.7	-63.1	-15.3	0	0	0	124.1
83	N	27.8	Very low	28.6	Very low	139 Å²	139	131.6 Å²	131.6	74%	0.743	76%	0.762	S	S	*	*				83.3	151.2	109.8	-61.6	-13.6	0	0	0	125.1
84	L	32.8	Very low	28.9	Very low	151 Å²	151	131.2 Å²	131.2	79%	0.791	76%	0.758	S	S	*	*			trans	87.4	86.5	156.1	-72.7	156	0	0	0	121
85	N	29.3	Very low	28.7	Very low	130 Å²	130	131.6 Å²	131.6	70%	0.695	76%	0.756	S	S	*	*				49	152.9	115.3	-63.5	19.9	0	0	0	124.3
86	D	31.5	Very low	28.7	Very low	144 Å²	144	133.7 Å²	133.7	77%	0.77	76%	0.758	S	S	*	*			trans	74.6	144.5	149.1	-67.4	-14.1	0	0	0	120
87	V	31.2	Very low	28.8	Very low	110 Å²	110	130.9 Å²	130.9	67%	0.667	76%	0.756	S	S	*	*			cis	-163.8	150.3	-24.6	96.7	0	0	0	0	109.7
88	N	28.6	Very low	28.8	Very low	141 Å²	141	133.2 Å²	133.2	75%	0.754	76%	0.759	S	S	*	*			trans	53.7	141.9	167.5	-62.9	-22.7	0	0	0	118.1
89	N	32.3	Very low	28.9	Very low	161 Å²	161	132.5 Å²	132.5	86%	0.861	76%	0.757	S	S	*	*				-178.5	170.6	54.2	-135.4	-24.7	0	0	0	110.8
90	G	30	Very low	29.1	Very low	70 Å²	70	133.1 Å²	133.1	72%	0.722	76%	0.756	S	S	*	*			trans	112.2	82.1	152.3	0	0	0	0	0	118.8
91	S	28.9	Very low	29.2	Very low	123 Å²	123	136 Å²	136	86%	0.86	76%	0.759	S	S	*	*			trans	-86.3	144.3	173	-41.3	0	0	0	0	113.7
92	K	32.2	Very low	29.3	Very low	220 Å²	220	134.7 Å²	134.7	96%	0.957	76%	0.759	S	S	*	*			trans	-162.2	161.4	150.1	-111.3	163.8	-173.7	177.2	0	111
93	A	24.6	Very low	29.1	Very low	85 Å²	85	136.7 Å²	136.7	70%	0.702	77%	0.77	S	S	*	*			trans	-139.3	-165.8	-163	0	0	0	0	0	112.9
94	I	28.8	Very low	29.2	Very low	157 Å²	157	134.6 Å²	134.6	81%	0.805	77%	0.766	S	S	*	*			trans	66.8	141.6	172.8	9.6	-177	0	0	0	115.4
95	T	25.7	Very low	28.9	Very low	119 Å²	119	134.7 Å²	134.7	73%	0.73	77%	0.767	S	S	*	*			cis	-151.7	140.5	12.6	-43.7	0	0	0	0	115
96	I	25.3	Very low	28.9	Very low	137 Å²	137	133.9 Å²	133.9	70%	0.703	77%	0.772	S	S	*	*			trans	-4	135.3	154.6	-53.3	157.4	0	0	0	121.9	E98	I96-E98 HydrophobicContact CG2-CG 4.47Å
97	T	29.6	Very low	28.7	Very low	128 Å²	128	131.6 Å²	131.6	79%	0.785	77%	0.767	S	S	*	*				-156.7	115.7	123	32.9	0	0	0	0	108.1
98	E	28.1	Very low	28.5	Very low	174 Å²	174	132.5 Å²	132.5	81%	0.813	77%	0.768	S	S	*	*				54.6	127.8	99.3	-62.1	-170.2	174.2	0	0	114.3	I96	I96-E98 HydrophobicContact CG2-CG 4.47Å
99	S	32.5	Very low	28.5	Very low	108 Å²	108	131.9 Å²	131.9	76%	0.755	77%	0.765	S	S	*	*			cis	-139.8	150.3	29.9	47.9	0	0	0	0	112.6
100	N	29.2	Very low	28.3	Very low	132 Å²	132	129.8 Å²	129.8	71%	0.706	76%	0.758	S	S	*	*				53.2	136.5	76.4	-74.5	-14.6	0	0	0	114.7
101	F	30.2	Very low	28.1	Very low	185 Å²	185	131.7 Å²	131.7	81%	0.811	76%	0.756	S	S	*	*			cis	-148.9	-164.6	2.3	-130.3	-70.7	0	0	0	110.8
102	S	27.5	Very low	28	Very low	101 Å²	101	132.5 Å²	132.5	71%	0.706	75%	0.749	S	S	*	*			trans	-113.7	151.1	-160.9	-41.1	0	0	0	0	116.7
103	N	25.9	Very low	27.8	Very low	156 Å²	156	131 Å²	131	83%	0.834	74%	0.739	S	S	*	*			trans	82.3	154.2	138.6	-142.8	16.7	0	0	0	122
104	S	28.5	Very low	27.8	Very low	94 Å²	94	131.1 Å²	131.1	66%	0.657	74%	0.735	S	S	*	*			trans	87.3	105.2	158.1	-20.2	0	0	0	0	121.6
105	N	26.4	Very low	27.8	Very low	153 Å²	153	134 Å²	134	82%	0.818	74%	0.737	S	S	*	*			trans	35.9	136.7	135.9	-64.2	-1.2	0	0	0	124.2
106	S	29	Very low	27.9	Very low	114 Å²	114	134.1 Å²	134.1	80%	0.797	73%	0.733	S	S	*	*			trans	66.1	149.1	147.6	59.6	0	0	0	0	119
107	S	28.2	Very low	28.1	Very low	96 Å²	96	134.2 Å²	134.2	67%	0.671	73%	0.73	S	S	*	*			cis	-172	156.4	-19.5	50	0	0	0	0	110.1
108	N	27.5	Very low	28.2	Very low	128 Å²	128	135.8 Å²	135.8	68%	0.684	73%	0.728	S	S	*	*			trans	72.9	135.9	151.9	-81.7	50.3	0	0	0	121.6
109	D	28.1	Very low	28.3	Very low	128 Å²	128	133.9 Å²	133.9	68%	0.684	72%	0.724	S	S	*	*			trans	71.8	150.1	131.9	-60	-11.4	0	0	0	121.1
110	T	27.7	Very low	28.1	Very low	117 Å²	117	132.9 Å²	132.9	72%	0.718	72%	0.717	S	S	*	*			cis	-155.6	159.4	-5.3	8.7	0	0	0	0	114.8
111	T	25.9	Very low	28.2	Very low	111 Å²	111	132.6 Å²	132.6	68%	0.681	72%	0.72	S	S	*	*			trans	-4.7	177.3	151.6	54.7	0	0	0	0	125.7
112	I	28	Very low	28.2	Very low	140 Å²	140	130.5 Å²	130.5	72%	0.718	72%	0.722	S	S	*	*			trans	130.9	136.1	146.4	-73.2	170.4	0	0	0	111.8
113	Y	27	Very low	28.2	Very low	189 Å²	189	128.6 Å²	128.6	74%	0.741	72%	0.719	S	S	*	*			cis	-160.5	156	-21.9	-96.8	165.8	0	0	0	107.1
114	S	25	Very low	28.1	Very low	87 Å²	87	130.5 Å²	130.5	61%	0.608	72%	0.722	S	S	*	*			cis	90.2	122	42.1	-50.6	0	0	0	0	115.9
115	Y	27.9	Very low	28.1	Very low	216 Å²	216	133.7 Å²	133.7	85%	0.847	73%	0.731	S	S	*	*			trans	-156.8	128.9	153.9	-96.2	-86.3	0	0	0	107.4
116	N	27.8	Very low	28.1	Very low	123 Å²	123	130.6 Å²	130.6	66%	0.658	72%	0.722	S	S	*	*			cis	79.3	140.5	48.1	-75.3	-33.9	0	0	0	113.8
117	H	29.8	Very low	28	Very low	138 Å²	138	131 Å²	131	64%	0.639	72%	0.719	S	S	*	*			cis	-133.4	167.6	5.6	-85.5	-52	0	0	0	110.5
118	H	31.8	Very low	27.8	Very low	161 Å²	161	131.8 Å²	131.8	75%	0.745	73%	0.725	S	S	*	*				-168.6	170.3	59.2	-81.2	-83.1	0	0	0	109.9
119	N	31.1	Very low	28.2	Very low	134 Å²	134	131.4 Å²	131.4	72%	0.717	73%	0.73	S	S	*	*			cis	-153	-179.2	2.3	-135.9	19.1	0	0	0	113.6
120	S	28.3	Very low	28	Very low	88 Å²	88	133.1 Å²	133.1	62%	0.615	74%	0.738	S	S	*	*			trans	-64.5	162	164.3	57	0	0	0	0	114.7
121	V	30.1	Very low	27.7	Very low	125 Å²	125	133 Å²	133	76%	0.758	74%	0.737	S	S	*	*			cis	-155.2	154.4	38.9	179.6	0	0	0	0	107.6
122	T	31.4	Very low	27.6	Very low	142 Å²	142	135 Å²	135	87%	0.871	74%	0.743	S	S	*	*			cis	-108.5	-119.2	6.4	-30.2	0	0	0	0	111.7
123	G	27.7	Very low	27.3	Very low	61 Å²	61	136 Å²	136	63%	0.629	74%	0.744	S	S	*	*			cis	177.6	152.7	-3.2	0	0	0	0	0	113.2
124	Q	23.3	Very low	27.1	Very low	195 Å²	195	131.4 Å²	131.4	91%	0.911	74%	0.74	S	S	*	*			trans	-151.6	145	178.1	-62.2	177.4	-50.6	0	0	114.1
125	L	28.8	Very low	26.9	Very low	161 Å²	161	132.7 Å²	132.7	84%	0.843	75%	0.748	S	S	*	*				-171.9	126.5	128.2	-105.6	167.4	0	0	0	114.3
126	S	25.7	Very low	26.7	Very low	89 Å²	89	126.2 Å²	126.2	62%	0.622	73%	0.734	S	S	*	*			trans	48.7	123.7	144.5	62.5	0	0	0	0	124.5
127	T	27.6	Very low	26.6	Very low	121 Å²	121	127.6 Å²	127.6	74%	0.742	74%	0.736	S	S	*	*				77.1	104.2	129.4	55.6	0	0	0	0	123.6
128	S	23.7	Very low	26.5	Very low	114 Å²	114	129.5 Å²	129.5	80%	0.797	74%	0.739	S	S	*	*			trans	70.9	154.2	135.3	49.4	0	0	0	0	120.9
129	P	35.7	Very low	26.3	Very low	120 Å²	120	128.6 Å²	128.6	78%	0.779	74%	0.737	S	S	*	*			trans	-109.3	151.6	-157.4	39.4	-31.8	0	0	0	115.4
130	L	22.6	Very low	26.2	Very low	164 Å²	164	129 Å²	129	86%	0.859	74%	0.739	S	S	*	*			trans	-161.2	179.7	141.5	-113	170.5	0	0	0	111.1
131	T	23.3	Very low	26.3	Very low	114 Å²	114	127.7 Å²	127.7	70%	0.699	74%	0.74	S	S	*	*			trans	-64.5	165	-167.6	47.9	0	0	0	0	118
132	L	22.4	Very low	26.3	Very low	152 Å²	152	127.8 Å²	127.8	80%	0.796	75%	0.746	S	S	*	*			trans	100.5	142.1	140.1	-93.5	160.5	0	0	0	121.1
133	Q	22.3	Very low	26.2	Very low	161 Å²	161	125.4 Å²	125.4	75%	0.752	74%	0.735	S	S	*	*			trans	70	95.9	152.3	-102.5	175.3	-34.1	0	0	122
134	S	21.9	Very low	26.3	Very low	93 Å²	93	129.6 Å²	129.6	65%	0.65	74%	0.741	S	S	*	*				81	156.9	113.9	69.6	0	0	0	0	122
135	C	22.2	Very low	26.6	Very low	115 Å²	115	128 Å²	128	78%	0.777	73%	0.734	S	S	*	*			trans	75.8	144.8	162	-63.9	0	0	0	0	118.5
136	S	23.1	Very low	26.8	Very low	79 Å²	79	125.5 Å²	125.5	55%	0.552	73%	0.727	S	S	*	*			cis	-173	169.7	-20.2	-101.6	0	0	0	0	111
137	H	25.4	Very low	26.9	Very low	153 Å²	153	129 Å²	129	71%	0.708	73%	0.734	S	S	*	*			trans	75.9	164.8	158.7	-45.7	-59.1	0	0	0	117.6
138	Y	27.5	Very low	26.8	Very low	177 Å²	177	130 Å²	130	69%	0.694	73%	0.734	S	S	*	*			cis	-152.5	153.2	12.1	-127.2	-42.2	0	0	0	114.2
139	M	27.8	Very low	27	Very low	143 Å²	143	130.8 Å²	130.8	70%	0.704	73%	0.728	S	S	*	*			trans	69.3	144.1	156.9	-59.9	-47.6	-171.3	0	0	118
140	N	29.6	Very low	26.7	Very low	142 Å²	142	132.4 Å²	132.4	76%	0.759	73%	0.725	S	S	*	*			cis	-141.5	155	0	-97.8	-32	0	0	0	108.3
141	G	29.5	Very low	26.8	Very low	61 Å²	61	129.1 Å²	129.1	63%	0.629	72%	0.715	S	S	*	*			cis	98.6	125.2	9.8	0	0	0	0	0	112.1
142	S	30.1	Very low	26.9	Very low	126 Å²	126	130 Å²	130	88%	0.881	72%	0.721	S	S	*	*			cis	-154.6	-177.7	-0.9	-63.8	0	0	0	0	107.5
143	S	30.7	Very low	27.1	Very low	93 Å²	93	132 Å²	132	65%	0.65	72%	0.723	S	S	*	*			cis	-146.1	-154.9	14.8	48	0	0	0	0	107.9
144	I	29.7	Very low	27.3	Very low	148 Å²	148	130.1 Å²	130.1	76%	0.759	72%	0.723	S	S	*	*			cis	-140.8	136.6	20.7	-68.3	176.9	0	0	0	105.4
145	Q	28.2	Very low	27.4	Very low	162 Å²	162	132.6 Å²	132.6	76%	0.757	73%	0.728	S	S	*	*				88.8	145	50.3	-76.5	-171.8	-66.4	0	0	115.2
146	P	33	Very low	27.6	Very low	109 Å²	109	134.1 Å²	134.1	71%	0.708	73%	0.728	S	S	*	*				-147.5	-154.8	-127.8	44	-22.7	0	0	0	115.6
147	Q	28.9	Very low	27.8	Very low	163 Å²	163	136.8 Å²	136.8	76%	0.762	73%	0.734	S	S	*	*			trans	156.9	122.9	133.6	-80.4	-158.1	13.9	0	0	111
148	L	25.9	Very low	27.8	Very low	142 Å²	142	137.4 Å²	137.4	74%	0.743	74%	0.737	S	S	*	*				67.6	135.7	88.2	-64.7	169	0	0	0	113.5
149	I	27.8	Very low	27.8	Very low	130 Å²	130	134.8 Å²	134.8	67%	0.667	74%	0.74	S	S	*	*			cis	-163.1	163.1	10.1	-146.4	168.2	0	0	0	114.4
150	H	29.7	Very low	27.7	Very low	154 Å²	154	133.6 Å²	133.6	71%	0.713	74%	0.741	S	S	*	*			trans	61.3	109.8	157.2	-71.4	-49.4	0	0	0	125.6
151	S	23.8	Very low	27.6	Very low	94 Å²	94	133.6 Å²	133.6	66%	0.657	74%	0.739	S	S	*	*				89.3	129.7	113.6	-63.3	0	0	0	0	124.5
152	T	26.3	Very low	27.5	Very low	133 Å²	133	136.7 Å²	136.7	82%	0.816	74%	0.742	S	S	*	*			trans	78.6	114.9	147.5	48	0	0	0	0	123.1
153	K	24.9	Very low	27.3	Very low	195 Å²	195	138.2 Å²	138.2	85%	0.848	74%	0.735	S	S	*	*			trans	77.2	151.7	148.2	-83.5	-173.8	174.2	-178.6	0	120.5
154	T	27.5	Very low	27.1	Very low	121 Å²	121	141.5 Å²	141.5	74%	0.742	74%	0.744	S	S	*	*			trans	63.9	107.9	164.7	40.6	0	0	0	0	119.8
155	N	24.1	Very low	27	Very low	144 Å²	144	142.1 Å²	142.1	77%	0.77	75%	0.747	S	S	*	*			trans	72.4	153.1	138.9	-65.4	1.2	0	0	0	120.9
156	I	26.8	Very low	27	Very low	148 Å²	148	139.5 Å²	139.5	76%	0.759	75%	0.745	S	S	*	*			trans	80.7	113.7	153.7	-73.6	156.4	0	0	0	118.2
157	I	27.6	Very low	26.6	Very low	135 Å²	135	139.3 Å²	139.3	69%	0.692	75%	0.746	S	S	*	*			trans	74.8	104.8	146.5	-69.4	174.6	0	0	0	120.4
158	E	24.2	Very low	26.6	Very low	165 Å²	165	137 Å²	137	77%	0.771	75%	0.748	S	S	*	*				64.9	153.8	128.6	-57.3	-172.9	127.3	0	0	124.8
159	T	28.1	Very low	26.5	Very low	122 Å²	122	135.3 Å²	135.3	75%	0.748	75%	0.748	S	S	*	*			trans	67.3	97.9	162.5	47	0	0	0	0	120.3
160	T	25	Very low	26.3	Very low	118 Å²	118	138.1 Å²	138.1	72%	0.724	76%	0.756	S	S	*	*				28.8	137.5	115.2	55	0	0	0	0	119
161	I	27.9	Very low	26	Very low	142 Å²	142	134.9 Å²	134.9	73%	0.728	75%	0.75	S	S	*	*			cis	-162	153.5	35.7	-132.1	152.8	0	0	0	110.7
162	N	27.4	Very low	25.9	Very low	127 Å²	127	140.2 Å²	140.2	68%	0.679	76%	0.756	S	S	*	*			trans	36	155.5	157	-58	17.4	0	0	0	121.3
163	E	25.7	Very low	25.9	Very low	157 Å²	157	140.6 Å²	140.6	73%	0.734	76%	0.758	S	S	*	*			cis	-158.4	143.3	11.9	-142.6	150.1	-104.9	0	0	110.7
164	L	26.8	Very low	26	Very low	162 Å²	162	138.8 Å²	138.8	85%	0.848	76%	0.757	S	S	*	*			trans	165.4	80.2	133.4	-89.9	163.6	0	0	0	112.4
165	I	27	Very low	26.1	Very low	161 Å²	161	138.5 Å²	138.5	83%	0.826	76%	0.76	S	S	*	*			trans	-75.3	138.9	148.4	-58.8	162.8	0	0	0	104.5
166	P	29.3	Very low	26.3	Very low	108 Å²	108	137 Å²	137	70%	0.701	76%	0.761	S	S	*	*				-149.6	-168.5	60.2	45.6	-24.9	0	0	0	113.5
167	S	24.5	Very low	26.5	Very low	104 Å²	104	135.3 Å²	135.3	73%	0.727	76%	0.762	S	S	*	*			cis	-157.9	169.9	-2.9	15.8	0	0	0	0	105.9
168	S	28.3	Very low	26.6	Very low	115 Å²	115	138 Å²	138	80%	0.804	77%	0.769	S	S	*	*			cis	-165.5	165.4	42.1	42.6	0	0	0	0	112.1
169	S	24.2	Very low	26.7	Very low	107 Å²	107	135.9 Å²	135.9	75%	0.748	77%	0.767	S	S	*	*			trans	-79.5	148	175.4	-46	0	0	0	0	113.1
170	F	23.6	Very low	26.5	Very low	189 Å²	189	136.2 Å²	136.2	83%	0.829	77%	0.769	S	S	*	*			trans	59	122.9	148	-94.9	-107	0	0	0	121
171	S	22.3	Very low	26.5	Very low	86 Å²	86	137 Å²	137	60%	0.601	77%	0.774	S	S	*	*				57.3	139.2	128.2	-83.9	0	0	0	0	120.6
172	R	22.7	Very low	26.2	Very low	205 Å²	205	137.3 Å²	137.3	77%	0.774	78%	0.777	S	S	*	*			cis	-169.3	140.6	-1.3	-159.1	-176.1	-63.4	-178.6	-0.4	108.2
173	T	26.7	Very low	26.1	Very low	142 Å²	142	138.7 Å²	138.7	87%	0.871	78%	0.784	S	S	*	*			trans	-146.2	111.3	165.1	23.9	0	0	0	0	110.4
174	L	26.1	Very low	25.9	Very low	157 Å²	157	135.6 Å²	135.6	82%	0.822	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-77.3	150.5	160.3	-94	77.7	0	0	0	109.2
175	S	29.3	Very low	25.9	Very low	115 Å²	115	137.4 Å²	137.4	80%	0.804	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-71.6	153.6	171.8	43.2	0	0	0	0	112.2
176	S	29	Very low	25.7	Very low	112 Å²	112	133.7 Å²	133.7	78%	0.783	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-47.6	134.4	-177.1	53.1	0	0	0	0	116.4
177	S	30.4	Very low	25.4	Very low	113 Å²	113	137.2 Å²	137.2	79%	0.79	77%	0.774	S	S	*	*				-171	133.2	106	40.1	0	0	0	0	115.9
178	K	29.3	Very low	25.5	Very low	190 Å²	190	138 Å²	138	83%	0.826	77%	0.771	S	S	*	*			trans	52.9	99.8	146.7	-69.8	-175	175.8	-180	0	122.4
179	T	27.5	Very low	25.3	Very low	122 Å²	122	138.8 Å²	138.8	75%	0.748	77%	0.766	S	S	*	*				70.8	101.4	122.6	55.5	0	0	0	0	123.3
180	V	23	Very low	25.5	Very low	129 Å²	129	141.3 Å²	141.3	78%	0.782	77%	0.77	S	S	*	*				44.1	110.7	127.2	-149.1	0	0	0	0	120.6
181	T	26.5	Very low	25.6	Very low	135 Å²	135	141.1 Å²	141.1	83%	0.828	77%	0.765	S	S	*	*				177.4	163.9	109.3	28	0	0	0	0	111.4
182	N	21.5	Very low	25.9	Very low	148 Å²	148	144.5 Å²	144.5	79%	0.791	78%	0.776	S	S	*	*			trans	-87.6	135.9	-178.6	-57.8	-22.6	0	0	0	111.7
183	N	24.6	Very low	26.1	Very low	155 Å²	155	142.3 Å²	142.3	83%	0.829	78%	0.775	S	S	*	*				174.1	164.3	113.8	-89	-9.8	0	0	0	113.2
184	S	21.6	Very low	26	Very low	92 Å²	92	143.4 Å²	143.4	64%	0.643	77%	0.774	S	S	*	*			trans	-47.5	139.8	174.9	50.6	0	0	0	0	116.2
185	F	25.8	Very low	26	Very low	201 Å²	201	141.6 Å²	141.6	88%	0.882	77%	0.765	S	S	*	*				-172	169.5	100	-109.7	-79	0	0	0	111.9
186	S	22.7	Very low	25.9	Very low	83 Å²	83	141.9 Å²	141.9	58%	0.58	76%	0.761	S	S	*	*			trans	-106.5	148.5	-176.1	52.2	0	0	0	0	113.1
187	F	24.4	Very low	25.6	Very low	182 Å²	182	143.3 Å²	143.3	80%	0.798	76%	0.76	S	S	*	*				177.5	125.9	115.5	-104.8	-75.9	0	0	0	114.5
188	N	25.3	Very low	25.3	Very low	121 Å²	121	143.7 Å²	143.7	65%	0.647	76%	0.758	S	S	*	*			trans	43.7	132.4	143	-72.1	15	0	0	0	126.1
189	N	24.7	Very low	25.2	Very low	131 Å²	131	143 Å²	143	70%	0.701	76%	0.762	S	S	*	*			trans	77	109	131.7	-63.5	1.9	0	0	0	122
190	L	27.7	Very low	25	Very low	159 Å²	159	140.8 Å²	140.8	83%	0.832	76%	0.756	S	S	*	*				164.7	141.7	116.2	-85.9	145.2	0	0	0	106.7
191	Y	26.5	Very low	25.1	Very low	186 Å²	186	141.9 Å²	141.9	73%	0.729	76%	0.758	S	S	*	*			cis	179.4	132.1	-14.8	-144.4	-102.4	0	0	0	104.4
192	D	27.5	Very low	25	Very low	157 Å²	157	142.3 Å²	142.3	84%	0.84	76%	0.755	S	S	*	*			trans	-168.3	85.3	165.2	-100.4	-24.7	0	0	0	104.6
193	Q	27.6	Very low	25.2	Very low	158 Å²	158	145.8 Å²	145.8	74%	0.738	76%	0.764	S	S	*	*				61	71.9	72.8	-159	172.1	65.8	0	0	113.9
194	I	25.8	Very low	25.4	Very low	166 Å²	166	146 Å²	146	85%	0.851	76%	0.763	S	S	*	*			trans	-109.6	128.8	149.4	-64.1	179	0	0	0	107.1
195	N	24.1	Very low	25.5	Very low	119 Å²	119	148 Å²	148	64%	0.636	77%	0.767	S	S	*	*			trans	-132.1	121.1	179.7	177.1	13.7	0	0	0	108.8
196	V	27.9	Very low	25.5	Very low	121 Å²	121	146.4 Å²	146.4	73%	0.733	77%	0.767	S	S	*	*			trans	-139.2	91.5	168.1	-174.4	0	0	0	0	108.4
197	N	22.3	Very low	25.6	Very low	142 Å²	142	148.6 Å²	148.6	76%	0.759	77%	0.771	S	S	*	*			trans	-79.7	113.4	165.2	-75.7	-21.4	0	0	0	109.4
198	T	25.8	Very low	25.7	Very low	121 Å²	121	146.3 Å²	146.3	74%	0.742	77%	0.766	S	S	*	*			trans	-163.1	97.7	154.4	8.9	0	0	0	0	111.7
199	L	27	Very low	25.6	Very low	174 Å²	174	149.5 Å²	149.5	91%	0.911	77%	0.774	S	S	*	*			trans	159.7	90.1	140.4	-87.6	163.8	0	0	0	108.8
200	A	22.6	Very low	25.7	Very low	76 Å²	76	149.3 Å²	149.3	63%	0.628	78%	0.778	S	S	*	*			trans	-92.2	-167.9	155.6	0	0	0	0	0	108.6
201	D	24.6	Very low	25.6	Very low	153 Å²	153	148.8 Å²	148.8	82%	0.818	78%	0.775	S	S	*	*			trans	70.3	121.4	179.4	-40.6	-28.5	0	0	0	112.8
202	D	25	Very low	25.5	Very low	144 Å²	144	145.7 Å²	145.7	77%	0.77	78%	0.778	S	S	*	*			cis	-125.6	136.4	4	-67.7	-58.6	0	0	0	111.9
203	F	25.5	Very low	25.6	Very low	221 Å²	221	143.8 Å²	143.8	97%	0.969	77%	0.771	S	S	*	*			trans	-158.8	122.4	150.5	-96	-69.5	0	0	0	109.4
204	I	29.2	Very low	25.6	Very low	158 Å²	158	142.5 Å²	142.5	81%	0.81	78%	0.775	S	S	*	*			trans	-99.4	123.9	177.5	-67.2	177.5	0	0	0	110.5
205	D	23.7	Very low	25.8	Very low	135 Å²	135	140.3 Å²	140.3	72%	0.722	77%	0.774	S	S	*	*			trans	10.7	130.2	158	-62.3	-32.1	0	0	0	121
206	L	25.5	Very low	25.9	Very low	168 Å²	168	138.3 Å²	138.3	88%	0.88	78%	0.782	S	S	*	*				-145.3	71.8	119.1	-125.2	171.7	0	0	0	110.7	I208	L206-I208 PolarHBondContact O-N 3.48Å
207	D	24.8	Very low	25.7	Very low	128 Å²	128	138.5 Å²	138.5	68%	0.684	79%	0.787	S	S	*	*			trans	-81.8	111.5	-173.3	-169.6	35.3	0	0	0	112.6	K209	D207-K209 PolarHBondContact O-N 2.77Å
208	I	26.4	Very low	25.9	Very low	135 Å²	135	137.5 Å²	137.5	69%	0.692	79%	0.791	S	S	*	*			trans	-88	99	178.2	-61.5	-177.9	0	0	0	109.8	L206 T210	L206-I208 PolarHBondContact O-N 3.48Å; I208-T210 PolarHBondContact O-N 3.04Å
209	K	23.3	Very low	25.8	Very low	187 Å²	187	139.8 Å²	139.8	81%	0.813	80%	0.798	S	S	*	*			trans	-56.6	102.6	171.7	-69.5	175.2	179.4	170.4	0	111.7	D207	D207-K209 PolarHBondContact O-N 2.77Å
210	T	27.1	Very low	25.8	Very low	127 Å²	127	137.7 Å²	137.7	78%	0.779	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-91.8	130.8	161.3	41.8	0	0	0	0	109.6	I208 P212	I208-T210 PolarHBondContact O-N 3.04Å; T210-P212 WeakPolarHBondContact O-CD 3.16Å
211	I	25.2	Very low	25.9	Very low	148 Å²	148	139.9 Å²	139.9	76%	0.759	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-83.7	121.3	-169.8	-61.8	166	0	0	0	109.8
212	P	24.7	Very low	25.8	Very low	122 Å²	122	137.1 Å²	137.1	79%	0.792	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-80.5	123.3	173.8	31.6	-32.1	0	0	0	110.7	T210	T210-P212 WeakPolarHBondContact O-CD 3.16Å
213	T	29.1	Very low	25.8	Very low	116 Å²	116	141 Å²	141	71%	0.712	80%	0.796	S	S	*	*			trans	-133.3	124.9	163.4	38.8	0	0	0	0	110.7
214	T	27.9	Very low	25.8	Very low	131 Å²	131	138.9 Å²	138.9	80%	0.804	79%	0.789	S	S	*	*			trans	14.1	135.6	145.8	52.4	0	0	0	0	118.8
215	S	29.2	Very low	26.1	Very low	121 Å²	121	135.7 Å²	135.7	85%	0.846	78%	0.779	S	S	*	*			cis	-177.5	159.2	10	46.8	0	0	0	0	110.8
216	G	26.7	Very low	26.1	Very low	77 Å²	77	135.4 Å²	135.4	79%	0.794	78%	0.777	S	S	*	*			trans	148.9	100.1	165.2	0	0	0	0	0	113.6
217	C	24.5	Very low	26.1	Very low	125 Å²	125	136.4 Å²	136.4	85%	0.845	78%	0.775	S	S	*	*			trans	-81.9	164.5	-171.7	-60.6	0	0	0	0	115.1
218	S	26.7	Very low	26.1	Very low	120 Å²	120	137.3 Å²	137.3	84%	0.839	78%	0.779	S	S	*	*			trans	91.5	103.1	147.9	-55.8	0	0	0	0	119.4
219	L	22.9	Very low	26	Very low	170 Å²	170	141.5 Å²	141.5	89%	0.89	79%	0.788	S	S	*	*			trans	-75.1	136.9	151.4	-75.5	152.3	0	0	0	110.4
220	T	27.4	Very low	26.2	Very low	129 Å²	129	139.5 Å²	139.5	79%	0.791	79%	0.791	S	S	*	*				-166.7	113.2	129.7	27.9	0	0	0	0	110.3
221	T	23.9	Very low	26.2	Very low	122 Å²	122	136.7 Å²	136.7	75%	0.748	79%	0.788	S	S	*	*				23.4	139.9	126.8	54.8	0	0	0	0	120
222	S	23.4	Very low	26.3	Very low	96 Å²	96	138.8 Å²	138.8	67%	0.671	79%	0.791	S	S	*	*			cis	-174.7	174.3	4.4	43.1	0	0	0	0	112.8
223	Y	24.6	Very low	26.6	Very low	225 Å²	225	139.1 Å²	139.1	88%	0.882	79%	0.794	S	S	*	*			trans	78.1	149.3	160.1	-79.9	-72.8	0	0	0	122.1
224	H	25.7	Very low	26.5	Very low	177 Å²	177	141.3 Å²	141.3	82%	0.819	80%	0.796	S	S	*	*			trans	-70.8	-178.7	-168.3	-116.9	-123	0	0	0	114.6
225	P	35.4	Very low	26.3	Very low	91 Å²	91	140.3 Å²	140.3	59%	0.591	79%	0.794	S	S	*	*				-135.4	-147.5	-124.3	37.7	-12.2	0	0	0	113.6
226	D	23.6	Very low	26.5	Very low	129 Å²	129	139.3 Å²	139.3	69%	0.69	79%	0.785	S	S	*	*			trans	93.1	130	165.1	-58.8	-20	0	0	0	118.5
227	F	25	Very low	26.5	Very low	189 Å²	189	142.1 Å²	142.1	83%	0.829	78%	0.781	S	S	*	*			trans	64.7	144.1	179.9	-57.3	-83.4	0	0	0	116
228	D	25.9	Very low	26.6	Very low	146 Å²	146	144.4 Å²	144.4	78%	0.781	78%	0.779	S	S	*	*			cis	-142.9	170.5	18.9	-134	-28.1	0	0	0	115
229	Y	22.9	Very low	26.6	Very low	223 Å²	223	142.9 Å²	142.9	88%	0.875	77%	0.768	S	S	*	*			trans	-81.9	122	-177.4	-118.5	-105	0	0	0	113.3
230	V	29	Very low	26.8	Very low	145 Å²	145	142 Å²	142	88%	0.879	76%	0.763	S	S	*	*			trans	-146.5	117.1	158.4	-173.1	0	0	0	0	113.4
231	G	27.1	Very low	26.9	Very low	68 Å²	68	144.5 Å²	144.5	70%	0.701	77%	0.766	S	S	*	*			trans	62.2	104	137.9	0	0	0	0	0	121.5
232	F	26.6	Very low	27	Very low	192 Å²	192	146.1 Å²	146.1	84%	0.842	77%	0.77	S	S	*	*			trans	-63.7	161.7	145.7	-81.7	-94.3	0	0	0	111	E234	F232-E234 HydrophobicContact CD1-CG 4.35Å
233	P	31	Very low	27.2	Very low	130 Å²	130	147.6 Å²	147.6	84%	0.844	78%	0.78	S	S	*	*				-131.7	155	103.4	37.7	-31.4	0	0	0	114
234	E	27.4	Very low	27.3	Very low	161 Å²	161	141.1 Å²	141.1	75%	0.752	77%	0.774	S	S	*	*			trans	-94.2	138.2	-176.3	-58.8	171.6	99.4	0	0	113.4	F232	F232-E234 HydrophobicContact CD1-CG 4.35Å
235	S	23.3	Very low	27.3	Very low	110 Å²	110	138.6 Å²	138.6	77%	0.769	78%	0.776	S	S	*	*			trans	67.1	-176.8	143	81.7	0	0	0	0	117.2
236	P	33.2	Very low	26.8	Very low	101 Å²	101	141.3 Å²	141.3	66%	0.656	79%	0.786	S	S	*	*			cis	-138.9	164.6	-3.8	42.1	-25	0	0	0	118
237	I	27	Very low	27	Very low	136 Å²	136	144.5 Å²	144.5	70%	0.697	79%	0.793	S	S	*	*			trans	68.6	116.7	133.4	-75.3	171.1	0	0	0	122.4
238	Q	26.9	Very low	27	Very low	173 Å²	173	144.7 Å²	144.7	81%	0.808	79%	0.794	S	S	*	*			trans	62.6	161.5	138	-67.7	176.6	11.3	0	0	121.6
239	S	25.8	Very low	27.1	Very low	88 Å²	88	142.7 Å²	142.7	62%	0.615	79%	0.791	S	S	*	*			cis	-171.5	-162.5	-29.2	64.5	0	0	0	0	110.3
240	L	27.8	Very low	27.2	Very low	151 Å²	151	141.4 Å²	141.4	79%	0.791	79%	0.793	S	S	*	*			trans	76.7	150.2	-177.4	-82.2	72.5	0	0	0	115.7
241	Q	28.6	Very low	27.4	Very low	181 Å²	181	139.8 Å²	139.8	85%	0.846	79%	0.785	S	S	*	*			cis	-115.8	149.4	5.4	-76.9	-173.4	-28.5	0	0	114.2
242	N	26.5	Very low	27.3	Very low	157 Å²	157	143.5 Å²	143.5	84%	0.84	79%	0.789	S	S	*	*			trans	-89.5	151.8	163.5	-70.1	-52.6	0	0	0	110.8
243	S	27.2	Very low	27.2	Very low	126 Å²	126	140.8 Å²	140.8	88%	0.881	78%	0.783	S	S	*	*			trans	-106.9	133.2	146.7	58.8	0	0	0	0	108.6
244	A	26.7	Very low	27	Very low	90 Å²	90	139.4 Å²	139.4	74%	0.744	77%	0.768	S	S	*	*			trans	-137.4	146.3	-170.5	0	0	0	0	0	112.2
245	S	27.2	Very low	27	Very low	123 Å²	123	140.1 Å²	140.1	86%	0.86	77%	0.769	S	S	*	*			trans	-128.5	125.2	160.5	60.4	0	0	0	0	108.4
246	N	24.2	Very low	27.2	Very low	149 Å²	149	141.3 Å²	141.3	80%	0.797	77%	0.765	S	S	*	*			trans	-148.6	126.3	-163.3	-162.7	-11	0	0	0	112.1
247	K	28	Very low	26.8	Very low	195 Å²	195	141.2 Å²	141.2	85%	0.848	77%	0.767	S	S	*	*			trans	-169	110.6	167	-100.3	161.3	-175.7	179.1	0	105.8
248	K	25.5	Very low	26.6	Very low	194 Å²	194	142 Å²	142	84%	0.843	77%	0.772	S	S	*	*				54.8	129	82.9	-74.5	-169.9	174.9	-175.7	0	112.9
249	S	27.5	Very low	26.6	Very low	104 Å²	104	141.9 Å²	141.9	73%	0.727	78%	0.778	S	S	*	*			cis	-164.2	138	16.6	48	0	0	0	0	116.9
250	Q	24.7	Very low	26.3	Very low	195 Å²	195	140.7 Å²	140.7	91%	0.911	78%	0.779	S	S	*	*			trans	65.3	160.9	141.8	-78.6	-166.8	-39.5	0	0	121.8
251	P	32.8	Very low	26.1	Very low	111 Å²	111	140.7 Å²	140.7	72%	0.721	78%	0.778	S	S	*	*			trans	-125	-176.3	-149.8	45.4	-33.6	0	0	0	115.4
252	L	26.4	Very low	25.9	Very low	147 Å²	147	139.1 Å²	139.1	77%	0.77	78%	0.775	S	S	*	*			trans	-171.2	133.3	146.6	-105.6	162.1	0	0	0	112.5
253	N	24.5	Very low	25.7	Very low	134 Å²	134	137.2 Å²	137.2	72%	0.717	77%	0.769	S	S	*	*			trans	57	151.5	155.3	-65.2	-7.7	0	0	0	120
254	L	26.6	Very low	25.6	Very low	101 Å²	101	140.7 Å²	140.7	53%	0.529	77%	0.772	S	S	.	*			cis	-162.2	164.9	-12.9	-104.2	168.8	0	0	0	105.2	I256	L254-I256 HydrophobicContact CD2-CD1 3.56Å; L254-I256 HydrophobicContact CD2-CG1 4.03Å
255	F	26.3	Very low	25.4	Very low	176 Å²	176	146 Å²	146	77%	0.772	78%	0.778	S	S	*	*			cis	-123.9	174.3	10.1	-70.5	-93.9	0	0	0	108.8
256	I	27.2	Very low	25.4	Very low	135 Å²	135	146.2 Å²	146.2	69%	0.692	78%	0.779	S	S	*	*			cis	76.5	120.2	28.5	-60.3	-179.1	0	0	0	114	L254	L254-I256 HydrophobicContact CD2-CD1 3.56Å; L254-I256 HydrophobicContact CD2-CG1 4.03Å
257	S	26.2	Very low	25.3	Very low	99 Å²	99	144.6 Å²	144.6	69%	0.692	78%	0.78	S	S	*	*			cis	-163.2	165.9	-16.5	59.1	0	0	0	0	112.1
258	N	22.1	Very low	25.3	Very low	153 Å²	153	141.6 Å²	141.6	82%	0.818	78%	0.778	S	S	*	*			trans	-59.3	165.8	159.5	-66.8	-20.8	0	0	0	111.9
259	N	26.8	Very low	25.4	Very low	171 Å²	171	138.4 Å²	138.4	91%	0.914	77%	0.774	S	S	*	*			trans	-157.5	151.7	147.7	-116.6	-21.8	0	0	0	112.3
260	G	20.5	Very low	25.2	Very low	62 Å²	62	137.6 Å²	137.6	64%	0.639	77%	0.768	S	S	*	*			trans	-156.1	130.4	177	0	0	0	0	0	114
261	I	23.7	Very low	25.3	Very low	152 Å²	152	137.3 Å²	137.3	78%	0.779	77%	0.767	S	S	*	*			trans	67.7	101.1	150.1	-53.1	-179	0	0	0	118.7
262	N	23.3	Very low	24.8	Very low	147 Å²	147	137.2 Å²	137.2	79%	0.786	77%	0.769	S	S	*	*			trans	59.8	169.9	143	-55.8	-21.1	0	0	0	119
263	V	22.5	Very low	25.2	Very low	118 Å²	118	134.7 Å²	134.7	72%	0.715	76%	0.761	S	S	*	*			cis	-142.1	147.1	7.5	-168.7	0	0	0	0	109.7
264	Q	24.8	Very low	25.1	Very low	199 Å²	199	136.4 Å²	136.4	93%	0.93	77%	0.765	S	S	*	*			trans	-153.5	162.1	138.8	-116.1	176.3	38.2	0	0	112.4
265	K	22.8	Very low	25.1	Very low	201 Å²	201	137 Å²	137	87%	0.874	77%	0.773	S	S	*	*			trans	-112.1	151.2	-164.8	-61.5	175.9	178.8	176.5	0	113.1
266	S	27.3	Very low	24.9	Very low	127 Å²	127	136.7 Å²	136.7	89%	0.888	77%	0.774	S	S	*	*			trans	-147	146	147.5	56.8	0	0	0	0	110.6
267	S	22.3	Very low	24.8	Very low	115 Å²	115	136.6 Å²	136.6	80%	0.804	77%	0.773	S	S	*	*			trans	-122.9	144.9	-169.7	53.7	0	0	0	0	113.1
268	V	27.3	Very low	24.9	Very low	133 Å²	133	139.1 Å²	139.1	81%	0.806	78%	0.777	S	S	*	*			trans	-173.9	115.2	156	129.9	0	0	0	0	106.5
269	V	27.2	Very low	24.9	Very low	127 Å²	127	142.9 Å²	142.9	77%	0.77	78%	0.78	S	S	*	*				61.8	126.3	95.8	173	0	0	0	0	113.1
270	S	24.4	Very low	24.9	Very low	86 Å²	86	144 Å²	144	60%	0.601	78%	0.78	S	S	*	*			cis	-173.4	163.1	-11.7	53.8	0	0	0	0	112.1
271	Q	26.8	Very low	25.1	Very low	190 Å²	190	146.9 Å²	146.9	89%	0.888	79%	0.785	S	S	*	*			trans	71.3	151.2	153.8	-74.1	168.8	-20.9	0	0	121.7
272	S	21.3	Very low	25.1	Very low	109 Å²	109	144.6 Å²	144.6	76%	0.762	78%	0.783	S	S	*	*			trans	-136.4	-175.5	161.5	65.6	0	0	0	0	106.5
273	P	35	Very low	25.2	Very low	94 Å²	94	145.7 Å²	145.7	61%	0.61	79%	0.788	S	S	*	*			cis	-133.1	-170.4	-1.3	43.3	-26.1	0	0	0	114.5
274	E	22.7	Very low	25.4	Very low	169 Å²	169	146.6 Å²	146.6	79%	0.79	79%	0.789	S	S	*	*			trans	66.3	158	158.4	-73.8	158.6	-141.6	0	0	117.6
275	T	26.3	Very low	25.5	Very low	113 Å²	113	143 Å²	143	69%	0.693	78%	0.782	S	S	*	*			cis	-147.9	147.4	5.1	-13.8	0	0	0	0	112.6
276	E	22.9	Very low	25.6	Very low	170 Å²	170	140.7 Å²	140.7	79%	0.794	77%	0.774	S	S	*	*			trans	61.7	164.9	139.7	-112.9	-176.2	167.6	0	0	126.3
277	I	25.6	Very low	25.5	Very low	133 Å²	133	143.3 Å²	143.3	68%	0.682	77%	0.77	S	S	*	*			trans	96.1	104.8	147.1	-81	161.2	0	0	0	122.5
278	I	27.6	Very low	25.7	Very low	152 Å²	152	147.7 Å²	147.7	78%	0.779	77%	0.769	S	S	*	*			trans	82.5	125.4	139.8	-64.9	176.8	0	0	0	123
279	R	23	Very low	25.7	Very low	232 Å²	232	150 Å²	150	88%	0.875	77%	0.771	S	S	*	*			trans	-39.6	148.9	165	-45.4	164.6	-178.4	179.7	-2	116.4
280	Q	25.7	Very low	25.7	Very low	195 Å²	195	150.7 Å²	150.7	91%	0.911	77%	0.767	S	S	*	*				-160.4	179.2	120.2	-114.7	174.9	13.2	0	0	113.1
281	T	24.2	Very low	25.8	Very low	123 Å²	123	152.5 Å²	152.5	76%	0.755	77%	0.77	S	S	*	*			trans	-114.4	146.3	-155.5	45.1	0	0	0	0	115.8
282	S	23.6	Very low	25.8	Very low	103 Å²	103	149 Å²	149	72%	0.72	77%	0.767	S	S	*	*			trans	76.2	158.8	142.4	75.1	0	0	0	0	121.4
283	L	25.7	Very low	26.2	Very low	170 Å²	170	148.7 Å²	148.7	89%	0.89	76%	0.764	S	S	*	*			trans	86.9	135.6	163	-70.2	161.5	0	0	0	119.9
284	N	26.4	Very low	25.8	Very low	138 Å²	138	149.7 Å²	149.7	74%	0.738	77%	0.768	S	S	*	*			trans	-108.3	135.3	-172.3	168.2	13.9	0	0	0	109.8
285	P	28.2	Very low	26	Very low	122 Å²	122	148.4 Å²	148.4	79%	0.792	77%	0.767	S	S	*	*			trans	-125.6	124.3	162.8	34.9	-20.8	0	0	0	113.8
286	H	23.3	Very low	26.1	Very low	154 Å²	154	151.5 Å²	151.5	71%	0.713	77%	0.773	S	S	*	*			trans	-94.1	138.1	168.6	-130	-54.7	0	0	0	110.6
287	F	26.2	Very low	26.1	Very low	181 Å²	181	151 Å²	151	79%	0.794	77%	0.774	S	S	*	*			trans	61.8	133.6	166.8	-76.2	-77.7	0	0	0	117.9
288	R	25.9	Very low	26.5	Very low	208 Å²	208	149.6 Å²	149.6	79%	0.785	77%	0.774	S	S	*	*				-167	147.1	56.1	-80.6	-172.6	165.1	-152.2	-3.5	112.9
289	Q	28.1	Very low	26.2	Very low	182 Å²	182	148.3 Å²	148.3	85%	0.85	77%	0.773	S	S	*	*				175.6	147.1	125.2	-97.2	-172.2	4.5	0	0	109.9
290	M	26	Very low	26.3	Very low	140 Å²	140	143.3 Å²	143.3	69%	0.69	77%	0.769	S	S	*	*			cis	-156	135	-31.1	-134.2	177.3	79.6	0	0	113
291	L	26.5	Very low	26.1	Very low	125 Å²	125	143.3 Å²	143.3	65%	0.654	77%	0.766	S	S	*	*			trans	19.3	117.1	151.1	-75.2	160.5	0	0	0	122.3
292	S	28.2	Very low	26.2	Very low	117 Å²	117	143.2 Å²	143.2	82%	0.818	77%	0.765	S	S	*	*				-162.9	141.2	120	56.4	0	0	0	0	109.1
293	S	29.3	Very low	26.1	Very low	101 Å²	101	148.2 Å²	148.2	71%	0.706	77%	0.774	S	S	*	*			cis	-156.3	118.1	-16.3	48.6	0	0	0	0	106.9
294	V	25.5	Very low	26.3	Very low	115 Å²	115	146.9 Å²	146.9	70%	0.697	77%	0.772	S	S	*	*				67.6	124.7	99.5	175.2	0	0	0	0	114.5
295	N	28.3	Very low	26	Very low	142 Å²	142	143 Å²	143	76%	0.759	77%	0.766	S	S	*	*			trans	98	127.4	-177.9	-60.5	-1.5	0	0	0	114.7
296	E	27.9	Very low	25.8	Very low	179 Å²	179	147.5 Å²	147.5	84%	0.836	77%	0.768	S	S	*	*			cis	-174.6	-176.3	-22.1	-121.2	175.6	178.8	0	0	106.3
297	I	23.5	Very low	25.9	Very low	159 Å²	159	146 Å²	146	82%	0.815	77%	0.766	S	S	*	*			trans	-130.4	161.2	-163.2	-77.6	166.8	0	0	0	107.8
298	P	33	Very low	26.1	Very low	104 Å²	104	144.8 Å²	144.8	68%	0.675	77%	0.767	S	S	*	*			cis	-138	-180	15.2	25.7	1	0	0	0	118.2
299	T	22.6	Very low	26.2	Very low	125 Å²	125	138 Å²	138	77%	0.767	76%	0.763	S	S	*	*			trans	21.6	139.5	146.5	63.5	0	0	0	0	122.7
300	T	24.1	Very low	26.3	Very low	126 Å²	126	136.8 Å²	136.8	77%	0.773	77%	0.767	S	S	*	*				-176.2	158.6	103.6	-72.1	0	0	0	0	111.6
301	K	22.2	Very low	26.5	Very low	196 Å²	196	133.7 Å²	133.7	85%	0.852	77%	0.771	S	S	*	*			trans	-59	142.9	172.4	-59.4	173	-179.5	176	0	111.8
302	V	25.5	Very low	26.7	Very low	121 Å²	121	134.1 Å²	134.1	73%	0.733	77%	0.774	S	S	*	*			trans	-133.7	113.2	167	-176.6	0	0	0	0	110.5	V304	V302-V304 HydrophobicContact CG1-CG2 3.68Å
303	F	22.2	Very low	26.8	Very low	208 Å²	208	134.6 Å²	134.6	91%	0.912	77%	0.767	S	S	*	*			trans	-73.7	135.7	152.6	-85.4	-109	0	0	0	107.5
304	V	28.9	Very low	26.9	Very low	141 Å²	141	135.6 Å²	135.6	86%	0.855	77%	0.765	S	S	*	*			trans	-114.9	111	166.1	-175.6	0	0	0	0	109.4	V302	V302-V304 HydrophobicContact CG1-CG2 3.68Å
305	G	20.3	Very low	27.2	Very low	58 Å²	58	136.7 Å²	136.7	60%	0.598	77%	0.767	S	S	*	*			trans	-159	128.9	170.8	0	0	0	0	0	110.6
306	Y	24.6	Very low	27.4	Very low	215 Å²	215	137.2 Å²	137.2	84%	0.843	77%	0.77	S	S	*	*			trans	76.5	111.2	162.6	-63.6	-67.4	0	0	0	121.2
307	N	26	Very low	27.6	Very low	124 Å²	124	132.6 Å²	132.6	66%	0.663	76%	0.757	S	S	*	*				111.9	130.8	109.9	-83.7	-11	0	0	0	121.7
308	N	30.2	Very low	28	Very low	154 Å²	154	130 Å²	130	82%	0.824	75%	0.753	S	S	*	*			trans	66.3	137	148.7	-54.1	-19.4	0	0	0	119.1
309	G	27.6	Very low	27.9	Very low	67 Å²	67	130.3 Å²	130.3	69%	0.691	75%	0.753	S	S	*	*			cis	163	175.9	-7.9	0	0	0	0	0	114.1
310	V	30.4	Very low	28.1	Very low	156 Å²	156	130.5 Å²	130.5	95%	0.945	75%	0.749	S	S	*	*			trans	74.8	128.4	170.4	-168.7	0	0	0	0	116.9
311	G	30.1	Very low	28.3	Very low	75 Å²	75	133.7 Å²	133.7	77%	0.773	75%	0.749	S	S	*	*			trans	173.5	26.2	179.5	0	0	0	0	0	121.1
312	N	30.3	Very low	28.7	Very low	133 Å²	133	129 Å²	129	71%	0.711	74%	0.737	S	S	*	*			trans	25	117.4	163.8	-72.9	11.5	0	0	0	123.2
313	N	31	Very low	28.8	Very low	128 Å²	128	129.1 Å²	129.1	68%	0.684	73%	0.733	S	S	*	*				68.1	129	117.4	-63.2	15.9	0	0	0	124.2
314	N	30.8	Very low	29.1	Very low	122 Å²	122	129.5 Å²	129.5	65%	0.652	73%	0.73	S	S	*	*			trans	67.2	154.7	136.8	-66	53.5	0	0	0	118.7
315	D	31.9	Very low	28.8	Very low	138 Å²	138	133.4 Å²	133.4	74%	0.738	73%	0.729	S	S	*	*			cis	-167.2	159.3	-14.8	-85.8	-17.9	0	0	0	105.2
316	D	31.9	Very low	28.9	Very low	153 Å²	153	135.6 Å²	135.6	82%	0.818	73%	0.734	S	S	*	*			cis	-158.2	-151.6	-22.5	-169.6	30.3	0	0	0	104.4
317	S	32.4	Very low	29.1	Very low	82 Å²	82	131.8 Å²	131.8	57%	0.573	73%	0.728	S	S	*	*			cis	-164.7	161	3.5	63.8	0	0	0	0	112.1
318	S	31.8	Very low	29.2	Very low	103 Å²	103	133.5 Å²	133.5	72%	0.72	73%	0.732	S	S	*	*			trans	71.3	148.2	157.8	85.2	0	0	0	0	119.2
319	T	30.6	Very low	29.1	Very low	112 Å²	112	133 Å²	133	69%	0.687	73%	0.73	S	S	*	*			cis	-145.9	156.8	-1.6	-16.9	0	0	0	0	112.6
320	N	27.4	Very low	29	Very low	128 Å²	128	133.2 Å²	133.2	68%	0.684	73%	0.732	S	S	*	*			trans	79.6	147.6	178.3	-48.8	-77.3	0	0	0	114.5
321	Y	27.9	Very low	28.9	Very low	194 Å²	194	136.6 Å²	136.6	76%	0.761	73%	0.729	S	S	*	*			cis	-141.7	137	-4.2	-125.1	-51.8	0	0	0	110.4
322	T	30.8	Very low	28.9	Very low	98 Å²	98	138.8 Å²	138.8	60%	0.601	72%	0.723	S	S	*	*			trans	13	118	158.4	52.4	0	0	0	0	119.4
323	D	27.6	Very low	28.9	Very low	122 Å²	122	139 Å²	139	65%	0.652	72%	0.724	S	S	*	*				85	144.4	67.2	-68.5	-16.2	0	0	0	113.3
324	Y	28.2	Very low	28.9	Very low	216 Å²	216	141.7 Å²	141.7	85%	0.847	73%	0.73	S	S	*	*			cis	-150.1	-171.6	-6.8	-120.3	-46.9	0	0	0	110.6
325	R	22.1	Very low	28.9	Very low	224 Å²	224	145.1 Å²	145.1	85%	0.845	74%	0.739	S	S	*	*			trans	-127	161.3	-169	-157.7	-171.7	-173.5	-177.8	3.6	112.1
326	C	24.2	Very low	28.8	Very low	103 Å²	103	145.2 Å²	145.2	70%	0.696	74%	0.74	S	S	*	*			trans	95	138	155	-61.1	0	0	0	0	122.1
327	N	27.3	Very low	28.7	Very low	136 Å²	136	145.8 Å²	145.8	73%	0.727	74%	0.743	S	S	*	*			trans	69.7	108.8	143	-74.1	4.1	0	0	0	124.9
328	Q	28.7	Very low	28.4	Very low	159 Å²	159	150.8 Å²	150.8	74%	0.743	75%	0.754	S	S	*	*				58.7	121.6	117	-66.9	-172.2	-8.1	0	0	122.6
329	N	27.4	Very low	28.1	Very low	145 Å²	145	150.7 Å²	150.7	78%	0.775	75%	0.753	S	S	*	*			trans	72.2	75.6	132.5	-59.6	-4.8	0	0	0	121.3
330	G	25.6	Very low	27.8	Very low	71 Å²	71	154.1 Å²	154.1	73%	0.732	76%	0.759	S	S	*	*				79.4	142.2	100.7	0	0	0	0	0	121.8
331	Y	28.5	Very low	27.6	Very low	226 Å²	226	156.9 Å²	156.9	89%	0.886	77%	0.767	S	S	*	*			trans	-164.3	148	131	-118.1	-82.8	0	0	0	113
332	N	29.8	Very low	27.4	Very low	122 Å²	122	153 Å²	153	65%	0.652	77%	0.767	S	S	*	*			trans	-52.6	146.8	-169.4	-55.1	-55.1	0	0	0	119.7
333	N	31.4	Very low	27	Very low	137 Å²	137	157.4 Å²	157.4	73%	0.733	78%	0.781	S	S	*	*				-177.5	126.3	94.2	-103.2	-58.2	0	0	0	118.3
334	K	30.6	Very low	26.8	Very low	184 Å²	184	157.4 Å²	157.4	80%	0.8	79%	0.791	S	S	*	*			trans	22.9	120.3	140.8	-59	173.9	-179.2	175	0	121.2
335	K	31.6	Very low	26.6	Very low	195 Å²	195	152.2 Å²	152.2	85%	0.848	79%	0.786	S	S	*	*				-175.9	129	94.6	-102.4	-178.4	179.9	178.1	0	115.4
336	N	28.6	Very low	26.8	Very low	140 Å²	140	150.9 Å²	150.9	75%	0.749	79%	0.789	S	S	*	*			trans	20.6	124.1	148.3	-52.1	11.4	0	0	0	121.5
337	N	29.4	Very low	26.8	Very low	165 Å²	165	154 Å²	154	88%	0.882	80%	0.798	S	S	*	*				-157.7	175	105.7	-107.4	-21.2	0	0	0	112.6
338	K	27.4	Very low	26.8	Very low	187 Å²	187	154.9 Å²	154.9	81%	0.813	80%	0.801	S	S	*	*			trans	-99	152.3	-157.3	-59.5	178.4	177.4	-179	0	115.8
339	S	25.3	Very low	26.8	Very low	100 Å²	100	154.3 Å²	154.3	70%	0.699	80%	0.803	S	S	*	*			trans	62.1	148.7	144.6	62.1	0	0	0	0	119.1
340	F	25.1	Very low	26.7	Very low	184 Å²	184	156.3 Å²	156.3	81%	0.807	81%	0.807	S	S	*	*			cis	-128.1	152.8	4.9	-96.1	-89.3	0	0	0	111
341	H	22.6	Very low	26.7	Very low	186 Å²	186	160.7 Å²	160.7	86%	0.861	81%	0.813	S	S	*	*			trans	-149.9	132.5	158.7	-137.8	-56.6	0	0	0	108
342	C	23.5	Very low	26.7	Very low	112 Å²	112	158 Å²	158	76%	0.757	81%	0.813	S	S	*	*			trans	-121.3	95.1	179.6	-69.8	0	0	0	0	111
343	Q	22.8	Very low	26.4	Very low	192 Å²	192	157 Å²	157	90%	0.897	82%	0.816	S	S	*	*			trans	-160.9	121.2	152	-113.5	-179.7	1.7	0	0	107.6
344	S	22.8	Very low	26.2	Very low	122 Å²	122	155.8 Å²	155.8	85%	0.853	82%	0.818	S	S	*	*			trans	-157.2	118.1	178	54.7	0	0	0	0	109.7
345	S	24.2	Very low	26	Very low	106 Å²	106	154.8 Å²	154.8	74%	0.741	82%	0.822	S	S	*	*			trans	-94.9	132.8	161.7	49.7	0	0	0	0	108.9
346	E	25.8	Very low	25.7	Very low	196 Å²	196	153.4 Å²	153.4	92%	0.916	82%	0.823	S	S	*	*				178	161.4	125.4	-97.6	167.3	-176.8	0	0	111.5
347	L	23.7	Very low	25.6	Very low	170 Å²	170	156.1 Å²	156.1	89%	0.89	83%	0.832	S	S	*	*			trans	-98.3	134.8	-178.5	-86.2	141.5	0	0	0	110.5
348	I	28.8	Very low	25.6	Very low	154 Å²	154	153.6 Å²	153.6	79%	0.79	83%	0.827	S	S	*	*			trans	-138.5	124.2	149.8	-69.4	-169.5	0	0	0	109.1
349	D	27.8	Very low	25.5	Very low	146 Å²	146	150 Å²	150	78%	0.781	83%	0.825	S	S	*	*			trans	42.6	137.8	153.4	-55.2	-22	0	0	0	124.1
350	H	24.5	Very low	25.7	Very low	187 Å²	187	154.1 Å²	154.1	87%	0.866	83%	0.833	S	S	*	*			trans	-59.3	135.4	157.6	-62.2	-108	0	0	0	111.5
351	L	26.7	Very low	25.9	Very low	163 Å²	163	152.7 Å²	152.7	85%	0.853	83%	0.834	S	S	*	*				-166.4	96.8	129.8	-109.1	175.8	0	0	0	110.9
352	L	27.2	Very low	26	Very low	170 Å²	170	151.6 Å²	151.6	89%	0.89	83%	0.834	S	S	*	*			trans	-164.9	87	142.8	-106.4	176.3	0	0	0	108.6
353	S	24.5	Very low	26.6	Very low	101 Å²	101	152.2 Å²	152.2	71%	0.706	84%	0.836	S	S	*	*			trans	-82.2	-179.8	156.1	-64.5	0	0	0	0	109.3
354	S	26.7	Very low	26.8	Very low	111 Å²	111	146.2 Å²	146.2	78%	0.776	83%	0.826	S	S	*	*			trans	61.3	91.9	172	66.7	0	0	0	0	117.1
355	D	26.6	Very low	27	Very low	164 Å²	164	151.5 Å²	151.5	88%	0.877	83%	0.829	S	S	*	*				-120.6	108.9	126.5	-94.3	-42.3	0	0	0	107.4
356	N	25.4	Very low	27	Very low	166 Å²	166	151.2 Å²	151.2	89%	0.888	83%	0.827	S	S	*	*			trans	174.8	96.1	161.6	-103.1	-23.7	0	0	0	110.9
357	E	25.7	Very low	27.1	Very low	197 Å²	197	150.8 Å²	150.8	92%	0.921	82%	0.823	S	S	*	*			trans	-165.5	94.5	149.4	-127.8	176.7	-142.4	0	0	112.7
358	S	29.4	Very low	27.4	Very low	111 Å²	111	149.4 Å²	149.4	78%	0.776	82%	0.815	S	S	*	*			trans	171.3	97.8	147.2	60	0	0	0	0	108.3
359	S	26.2	Very low	27.3	Very low	111 Å²	111	147.1 Å²	147.1	78%	0.776	81%	0.813	S	S	*	*				71.1	94.9	55.6	85.5	0	0	0	0	114.8
360	E	29.5	Very low	27.3	Very low	187 Å²	187	145 Å²	145	87%	0.874	81%	0.81	S	S	*	*			trans	-158.7	155.7	138.6	-114.1	165.7	-160.9	0	0	110.7
361	D	28.8	Very low	27.4	Very low	154 Å²	154	141.2 Å²	141.2	82%	0.824	80%	0.804	S	S	*	*			trans	60.2	96	171	-65.2	-4.5	0	0	0	122.7
362	L	25.4	Very low	27.3	Very low	163 Å²	163	139.5 Å²	139.5	85%	0.853	81%	0.806	S	S	*	*			trans	-89	-175.2	146.4	-86.9	168.1	0	0	0	109.8
363	P	35.1	Very low	27.1	Very low	126 Å²	126	136.1 Å²	136.1	82%	0.818	80%	0.802	S	S	*	*			cis	-129.9	176.2	-6.9	35.2	-16.7	0	0	0	115
364	G	28.3	Very low	27.1	Very low	66 Å²	66	136.6 Å²	136.6	68%	0.68	81%	0.805	S	S	*	*			trans	-179.8	84.5	167	0	0	0	0	0	118.9
365	Y	27.4	Very low	27	Very low	232 Å²	232	136.6 Å²	136.6	91%	0.91	81%	0.806	S	S	*	*			trans	59.8	109.6	159.2	-68.2	-79.6	0	0	0	121.5
366	S	23.6	Very low	26.9	Very low	100 Å²	100	134.1 Å²	134.1	70%	0.699	80%	0.8	S	S	*	*			trans	-81.7	159.9	163.2	56.2	0	0	0	0	114.1
367	F	27.9	Very low	26.9	Very low	188 Å²	188	133.3 Å²	133.3	83%	0.825	79%	0.794	S	S	*	*			trans	-153.4	121	140.9	-101.3	-71.2	0	0	0	113.1
368	L	29.3	Very low	26.9	Very low	141 Å²	141	131.3 Å²	131.3	74%	0.738	78%	0.784	S	S	*	*			trans	42.8	110.9	151.7	-64	170.1	0	0	0	119.4
369	S	27.5	Very low	26.7	Very low	105 Å²	105	132.1 Å²	132.1	73%	0.734	78%	0.779	S	S	*	*				92	141.7	78.4	-73.9	0	0	0	0	113.9
370	S	27.8	Very low	27	Very low	103 Å²	103	132.7 Å²	132.7	72%	0.72	78%	0.78	S	S	*	*			cis	-162.6	146.1	-3.1	44.4	0	0	0	0	113.4
371	S	26.8	Very low	26.9	Very low	106 Å²	106	128.6 Å²	128.6	74%	0.741	77%	0.772	S	S	*	*			trans	15.4	131.3	145	-45.7	0	0	0	0	120.4
372	S	24.9	Very low	26.9	Very low	128 Å²	128	127.3 Å²	127.3	90%	0.895	77%	0.77	S	S	*	*			cis	78.5	152.9	47.7	-58.6	0	0	0	0	115.4
373	A	22.8	Very low	26.9	Very low	99 Å²	99	125 Å²	125	82%	0.818	77%	0.766	S	S	*	*			trans	-90.6	174.9	-152	0	0	0	0	0	117.5
374	S	24.9	Very low	26.5	Very low	110 Å²	110	125.2 Å²	125.2	77%	0.769	76%	0.76	S	S	*	*			trans	-47.8	156.8	169.9	49.9	0	0	0	0	115.8
375	S	24.6	Very low	26.6	Very low	112 Å²	112	128 Å²	128	78%	0.783	76%	0.76	S	S	*	*			cis	-175.4	-169.7	-12.5	57.2	0	0	0	0	107
376	C	24.2	Very low	26.8	Very low	112 Å²	112	123.1 Å²	123.1	76%	0.757	75%	0.749	S	S	*	*			cis	-159	-146.6	2	-148	0	0	0	0	108.7
377	I	24.8	Very low	26.9	Very low	149 Å²	149	124.8 Å²	124.8	76%	0.764	75%	0.75	S	S	*	*			trans	70.4	129.9	163.6	-64.9	174.4	0	0	0	114.9
378	H	25.5	Very low	27.2	Very low	155 Å²	155	125.1 Å²	125.1	72%	0.718	75%	0.754	S	S	*	*			cis	-162.9	151.1	0.6	-130	-12.4	0	0	0	112.6
379	I	25.7	Very low	27.1	Very low	127 Å²	127	124.3 Å²	124.3	65%	0.651	75%	0.75	S	S	*	*			trans	66.8	155.3	140.5	-85.2	168.3	0	0	0	118.1
380	P	32.6	Very low	27.3	Very low	123 Å²	123	126.9 Å²	126.9	80%	0.799	76%	0.756	S	S	*	*			cis	-120.6	-156.5	25.1	43.8	-30.8	0	0	0	117.5
381	S	26	Very low	27.2	Very low	102 Å²	102	128.2 Å²	128.2	71%	0.713	76%	0.755	S	S	*	*			trans	-166.3	152	-156.1	50.9	0	0	0	0	112.7
382	T	29.8	Very low	27.4	Very low	127 Å²	127	130.5 Å²	130.5	78%	0.779	76%	0.759	S	S	*	*			trans	-150.6	130.4	171.7	48.3	0	0	0	0	113.4
383	C	24.9	Very low	27.5	Very low	113 Å²	113	128.9 Å²	128.9	76%	0.764	75%	0.747	S	S	*	*			trans	55.4	143.3	152.4	-47.4	0	0	0	0	119.3
384	N	26.7	Very low	27.7	Very low	131 Å²	131	129.3 Å²	129.3	70%	0.701	74%	0.743	S	S	*	*			cis	-166.8	-173	-7.6	-114.5	28.8	0	0	0	106.2
385	D	31.4	Very low	27.9	Very low	126 Å²	126	132.5 Å²	132.5	67%	0.674	75%	0.746	S	S	*	*			cis	-157.1	-179.2	8.5	-134.6	-39	0	0	0	112.4
386	D	31.8	Very low	28.3	Very low	129 Å²	129	132.9 Å²	132.9	69%	0.69	74%	0.743	S	S	*	*			trans	55.9	118.4	153.1	-97.2	-39.2	0	0	0	124.7
387	N	25.9	Very low	28.3	Very low	135 Å²	135	134.3 Å²	134.3	72%	0.722	74%	0.743	S	S	*	*			trans	1.8	131.3	143.3	-60	-76.4	0	0	0	121.1
388	H	34.1	Very low	28.5	Very low	194 Å²	194	135 Å²	135	90%	0.898	74%	0.743	S	S	*	*				-150.6	144.5	122.7	-122.4	-82.2	0	0	0	112.4
389	N	27.1	Very low	28.5	Very low	125 Å²	125	135.1 Å²	135.1	67%	0.668	75%	0.746	S	S	*	*			trans	-101	149.3	177.9	-152.6	6.8	0	0	0	109.1
390	D	31.5	Very low	28.7	Very low	158 Å²	158	138.2 Å²	138.2	85%	0.845	76%	0.757	S	S	*	*			trans	-174.8	155.2	133.2	-100.7	-25.9	0	0	0	114.1
391	N	26.3	Very low	28.4	Very low	132 Å²	132	138.3 Å²	138.3	71%	0.706	75%	0.751	S	S	*	*			trans	-108.6	147.7	-175.9	-72.9	-85.1	0	0	0	112.6
392	N	29.9	Very low	28.6	Very low	153 Å²	153	140.4 Å²	140.4	82%	0.818	75%	0.754	S	S	*	*			trans	-171.6	134.5	138.2	-91.4	-43.9	0	0	0	108.5
393	S	28	Very low	28.7	Very low	94 Å²	94	140.6 Å²	140.6	66%	0.657	76%	0.755	S	S	*	*			cis	70.6	125.1	47	-174.1	0	0	0	0	112.1
394	C	25.5	Very low	28.7	Very low	108 Å²	108	143.1 Å²	143.1	73%	0.73	76%	0.76	S	S	*	*			cis	-161	-174.4	0.4	-112.1	0	0	0	0	110.7
395	H	30.6	Very low	28.6	Very low	177 Å²	177	141.7 Å²	141.7	82%	0.819	76%	0.761	S	S	*	*			trans	94.9	136.9	170.6	-67.6	-86.7	0	0	0	118.6
396	V	31.9	Very low	28.5	Very low	120 Å²	120	142 Å²	142	73%	0.727	77%	0.767	S	S	*	*			cis	-158.3	150.6	-25.5	101.8	0	0	0	0	109.8
397	N	23.7	Very low	28.1	Very low	142 Å²	142	142.8 Å²	142.8	76%	0.759	77%	0.772	S	S	*	*			trans	-100.1	132.8	170.5	-71.2	-24	0	0	0	110.5
398	H	29.9	Very low	28.1	Very low	165 Å²	165	142.2 Å²	142.2	76%	0.764	77%	0.773	S	S	*	*				168.9	141.1	114.1	-100.7	-82.8	0	0	0	114.2
399	M	25	Very low	27.7	Very low	157 Å²	157	139.9 Å²	139.9	77%	0.773	77%	0.765	S	S	*	*			trans	19.5	123.8	142.6	-66.2	-75.8	-171.9	0	0	119.9
400	E	30.1	Very low	27.7	Very low	192 Å²	192	141.7 Å²	141.7	90%	0.897	77%	0.77	S	S	*	*				-154.5	168.3	114.5	-125.8	174.7	-156.1	0	0	112.5
401	N	27.2	Very low	27.5	Very low	125 Å²	125	143.5 Å²	143.5	67%	0.668	77%	0.77	S	S	*	*			trans	-100.5	150.1	-166.4	-57.3	-80.8	0	0	0	112.6
402	N	29.3	Very low	27.5	Very low	146 Å²	146	142.7 Å²	142.7	78%	0.781	76%	0.764	S	S	*	*				179.5	154	105	-97	-50.9	0	0	0	116.9
403	T	31.5	Very low	27.5	Very low	130 Å²	130	141.6 Å²	141.6	80%	0.798	76%	0.763	S	S	*	*			trans	57.8	101.9	154	49.6	0	0	0	0	120.7
404	L	26.1	Very low	27.5	Very low	167 Å²	167	141.3 Å²	141.3	87%	0.874	75%	0.754	S	S	*	*			trans	-48.8	170.4	143.2	-107.7	74.8	0	0	0	112.5
405	S	24.9	Very low	27.6	Very low	101 Å²	101	144.4 Å²	144.4	71%	0.706	76%	0.764	S	S	*	*			cis	-157.6	142.3	34	55.8	0	0	0	0	116
406	T	27.3	Very low	27.4	Very low	131 Å²	131	143.1 Å²	143.1	80%	0.804	76%	0.758	S	S	*	*			trans	-151.3	123.5	141.7	16.5	0	0	0	0	110.5
407	N	25.1	Very low	27.4	Very low	147 Å²	147	145.9 Å²	145.9	79%	0.786	76%	0.763	S	S	*	*			trans	24.5	125.2	156.5	-52.3	-15.5	0	0	0	120.6
408	T	26.2	Very low	27.6	Very low	122 Å²	122	145.8 Å²	145.8	75%	0.748	76%	0.762	S	S	*	*				156.3	127.9	111.4	-65	0	0	0	0	112.6
409	I	25.8	Very low	27.7	Very low	145 Å²	145	142.8 Å²	142.8	74%	0.744	77%	0.766	S	S	*	*			trans	32	118.3	156.9	-57.2	163.8	0	0	0	118.9
410	H	26.9	Very low	27.9	Very low	164 Å²	164	142 Å²	142	76%	0.759	77%	0.765	S	S	*	*				-156.2	121.4	127	-112.2	-84.9	0	0	0	110.8
411	K	26.9	Very low	27.8	Very low	195 Å²	195	140.1 Å²	140.1	85%	0.848	76%	0.761	S	S	*	*			trans	-148.6	67.6	156.8	-162.7	175.7	-175.2	179.5	0	110
412	I	26.1	Very low	27.9	Very low	115 Å²	115	140.5 Å²	140.5	59%	0.59	77%	0.772	S	S	*	*			trans	-88.1	135.6	163.8	-54.9	-179.8	0	0	0	106.7	N414	I412-N414 WeakPolarHBondContact CG2-OD1 3.46Å
413	V	29.7	Very low	27.7	Very low	131 Å²	131	141.4 Å²	141.4	79%	0.794	77%	0.771	S	S	*	*			trans	-122.2	113.9	156.9	175.3	0	0	0	0	104.7
414	N	27.4	Very low	27.4	Very low	87 Å²	87	142.1 Å²	142.1	47%	0.465	77%	0.765	S	S	.	*			trans	-66.4	154	179.3	-66.4	0.2	0	0	0	110.2	I412 E416	I412-N414 WeakPolarHBondContact CG2-OD1 3.46Å; N414-E416 HydrophobicContact CB-CG 4.24Å; N414-E416 PolarHBondContact ND2-OE1 3.42Å; N414-E416 PolarHBondContact ND2-OE2 2.99Å
415	N	28.5	Very low	27.5	Very low	174 Å²	174	143.5 Å²	143.5	93%	0.93	77%	0.767	S	S	*	*				-129.9	118.2	124	-97.3	-4.7	0	0	0	106
416	E	26.7	Very low	27.6	Very low	149 Å²	149	144.7 Å²	144.7	70%	0.696	76%	0.761	S	S	*	*			trans	-94.5	144	174.3	-69.1	146.3	116.9	0	0	109	N414	N414-E416 HydrophobicContact CB-CG 4.24Å; N414-E416 PolarHBondContact ND2-OE1 3.42Å; N414-E416 PolarHBondContact ND2-OE2 2.99Å
417	E	31.2	Very low	27.5	Very low	179 Å²	179	145.7 Å²	145.7	84%	0.836	76%	0.757	S	S	*	*			trans	-156.9	105.4	142.1	-123.8	174.8	172	0	0	112.5
418	N	28.8	Very low	27.5	Very low	139 Å²	139	148.9 Å²	148.9	74%	0.743	76%	0.759	S	S	*	*			trans	36.7	116.6	137.7	-51.5	-25.1	0	0	0	120.8
419	A	30.7	Very low	27.6	Very low	103 Å²	103	152.3 Å²	152.3	85%	0.851	77%	0.767	S	S	*	*				-162	125	122.8	0	0	0	0	0	111.6
420	D	29.7	Very low	27.6	Very low	141 Å²	141	154.4 Å²	154.4	75%	0.754	77%	0.77	S	S	*	*			trans	-68.3	175	-167.2	-55.9	-64.6	0	0	0	118.2
421	N	28.7	Very low	27.5	Very low	152 Å²	152	155.8 Å²	155.8	81%	0.813	78%	0.776	S	S	*	*			trans	71.9	96.7	153.2	-62	-41.6	0	0	0	119.4
422	C	27.6	Very low	27.5	Very low	133 Å²	133	155.9 Å²	155.9	90%	0.899	78%	0.777	S	S	*	*				-161.3	155.1	89.2	-114.1	0	0	0	0	112.8
423	H	25.2	Very low	27.4	Very low	164 Å²	164	158.4 Å²	158.4	76%	0.759	79%	0.792	S	S	*	*			trans	-101.4	160.8	-173	-100.6	1.4	0	0	0	113.7
424	H	25.6	Very low	27.1	Very low	145 Å²	145	163.9 Å²	163.9	67%	0.671	80%	0.798	S	S	*	*			trans	52.4	111	158.2	-56.1	-44	0	0	0	119.5
425	H	27.8	Very low	27	Very low	196 Å²	196	168.7 Å²	168.7	91%	0.907	82%	0.818	S	S	*	*				-130.5	124.2	124.5	-128.2	-77.2	0	0	0	110.2
426	H	27	Very low	26.9	Very low	127 Å²	127	170.6 Å²	170.6	59%	0.588	81%	0.813	S	S	*	*			trans	-74.8	155.5	-176.9	-110.4	-85.1	0	0	0	112.8	Y428	H426-Y428 PolarHBondContact O-N 3.5Å
427	E	27	Very low	26.8	Very low	152 Å²	152	173 Å²	173	71%	0.71	83%	0.825	S	S	*	*			trans	-19.1	96	154.6	-60.3	162.6	99.4	0	0	116.2
428	Y	24.9	Very low	26.6	Very low	213 Å²	213	172.3 Å²	172.3	84%	0.835	81%	0.814	S	S	*	*			trans	-132.8	27.8	170.4	-106.6	-81.2	0	0	0	114.8	H426	H426-Y428 PolarHBondContact O-N 3.5Å
429	H	26.5	Very low	26.7	Very low	195 Å²	195	174.5 Å²	174.5	90%	0.903	82%	0.82	S	S	*	*			trans	-117.7	11.8	-177.9	-95.1	-76.4	0	0	0	116.1
430	K	25.8	Very low	26.5	Very low	189 Å²	189	176.9 Å²	176.9	82%	0.822	82%	0.819	S	S	*	*	S	Bend	trans	-97.5	-3	-171.3	-131.3	170.9	-172.1	171.5	0	116.9
431	H	24.9	Very low	26.7	Very low	192 Å²	192	175.7 Å²	175.7	89%	0.889	81%	0.812	S	S	*	*	S	Bend	trans	-136.2	69.5	-178.4	-74.9	-51.1	0	0	0	114.3
432	K	26.9	Very low	26.5	Very low	198 Å²	198	170.6 Å²	170.6	86%	0.861	80%	0.795	S	S	*	*			trans	-148.2	-8.9	155.7	-123.7	173.5	-176.3	179.9	0	117	R434	K432-R434 PolarHBondContact O-N 3.19Å
433	N	25	Very low	26.8	Very low	168 Å²	168	171.8 Å²	171.8	90%	0.898	79%	0.792	S	S	*	*			trans	-88.8	82.1	175.7	-71.8	14.5	0	0	0	112.1
434	R	22.9	Very low	26.9	Very low	245 Å²	245	170.7 Å²	170.7	93%	0.925	79%	0.789	S	S	*	*			trans	-140.2	59.1	157	-84.6	-165.2	175.3	-176.6	-1.1	109.9	K432	K432-R434 PolarHBondContact O-N 3.19Å
435	Q	26	Very low	27	Very low	189 Å²	189	167.3 Å²	167.3	88%	0.883	78%	0.781	S	S	*	*			trans	-95.3	157.5	152.9	-73.8	-167.3	-31.7	0	0	109
436	Y	25.6	Very low	27.3	Very low	213 Å²	213	161.1 Å²	161.1	84%	0.835	76%	0.755	S	S	*	*			trans	-71.9	151.5	-171.1	-73.2	-96.3	0	0	0	111.8	R438	Y436-R438 PolarHBondContact O-N 3.12Å
437	Q	25.3	Very low	27.4	Very low	200 Å²	200	160.7 Å²	160.7	94%	0.935	76%	0.761	S	S	*	*			trans	-69.4	75.1	168.9	-67.1	177.1	-64	0	0	111.2
438	R	27.5	Very low	27.5	Very low	165 Å²	165	156.3 Å²	156.3	62%	0.623	75%	0.747	S	S	*	*	S	Bend		-63.8	159.5	129.6	-70.3	-169.5	179.7	165.8	11.2	106.7	Y436 D440 D485	Y436-R438 PolarHBondContact O-N 3.12Å; R438-D440 PolarHBondContact O-N 2.97Å; R438-D485 IonicContact CZ-OD2 3.72Å; R438-D485 IonicContact NH1-OD2 3.99Å; R438-D485 IonicContact NH2-OD2 2.74Å; R438-D485 PolarHBondContact NH2-OD2 2.95Å
439	Q	29.9	Very low	27.9	Very low	184 Å²	184	147.6 Å²	147.6	86%	0.86	72%	0.717	S	S	*	*			trans	-60.8	120	167.9	-77.8	176.1	-42.1	0	0	107.8	N441	Q439-N441 PolarHBondContact O-N 3.23Å
440	D	27.6	Very low	28.5	Very low	154 Å²	154	145.8 Å²	145.8	82%	0.824	71%	0.714	S	S	*	*			trans	-63.6	87.2	161.4	-78.4	-49.1	0	0	0	107.5	R438 G442	R438-D440 PolarHBondContact O-N 2.97Å; D440-G442 PolarHBondContact O-N 3.1Å
441	N	32.2	Very low	29.8	Very low	116 Å²	116	141.5 Å²	141.5	62%	0.62	71%	0.708	S	S	*	*			trans	-63.4	56.7	138.4	-73	-5.7	0	0	0	108.1	Q439	Q439-N441 PolarHBondContact O-N 3.23Å
442	G	25.6	Very low	31.7	Very low	44 Å²	44	133.9 Å²	133.9	45%	0.454	67%	0.674	S	S	.	*			trans	-56.2	140.6	161.6	0	0	0	0	0	106.7	D440 M444	D440-G442 PolarHBondContact O-N 3.1Å; G442-M444 VanDerWaalsContact C-N 3.33Å; G442-M444 PolarHBondContact O-N 3.23Å
443	L	32.6	Very low	33.5	Very low	159 Å²	159	126.6 Å²	126.6	83%	0.832	65%	0.646	S	S	*	*			trans	-53.8	94.3	-163.5	-75.5	79.2	0	0	0	111.5	S445	L443-S445 PolarHBondContact O-N 3.06Å
444	M	28.7	Very low	35.6	Very low	141 Å²	141	121.2 Å²	121.2	70%	0.695	62%	0.617	S	S	*	*			trans	-63.3	111.4	166.9	-107.5	-70	170.2	0	0	104.9	G442 L446	G442-M444 VanDerWaalsContact C-N 3.33Å; G442-M444 PolarHBondContact O-N 3.23Å; M444-L446 PolarHBondContact O-N 2.81Å
445	S	27.7	Very low	38.1	Very low	73 Å²	73	113 Å²	113	51%	0.51	60%	0.596	S	S	.	*			trans	-45	134.4	-179.8	177.6	0	0	0	0	109.4	L443 T447 S448	L443-S445 PolarHBondContact O-N 3.06Å; S445-T447 WeakPolarHBondContact CB-OG1 3.39Å; S445-T447 PolarHBondContact O-N 3.39Å; S445-T447 PolarHBondContact OG-OG1 3.18Å; S445-S448 PolarHBondContact O-N 3.3Å; S445-S448 PolarHBondContact O-OG 2.92Å
446	L	33.6	Very low	40.7	Very low	66 Å²	66	106 Å²	106	35%	0.346	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.1	5.8	-179.7	-71.8	160.9	0	0	0	114.7	M444 F700	M444-L446 PolarHBondContact O-N 2.81Å; L446-F700 HydrophobicContact CD2-CD1 4.33Å
447	T	29.2	Very low	43.5	Very low	118 Å²	118	99.9 Å²	99.9	72%	0.724	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-12.7	177.9	54.6	0	0	0	0	114.3	S445	S445-T447 WeakPolarHBondContact CB-OG1 3.39Å; S445-T447 PolarHBondContact O-N 3.39Å; S445-T447 PolarHBondContact OG-OG1 3.18Å
448	S	29	Very low	46.2	Very low	60 Å²	60	92.5 Å²	92.5	42%	0.42	51%	0.509	S	S	.	.			trans	-105.3	-5.4	-174.1	67.8	0	0	0	0	116.1	S445 N450	S445-S448 PolarHBondContact O-N 3.3Å; S445-S448 PolarHBondContact O-OG 2.92Å; S448-N450 VanDerWaalsContact C-N 3.3Å; S448-N450 PolarHBondContact O-N 3.05Å
449	C	33.3	Very low	48.9	Very low	30 Å²	30	85.4 Å²	85.4	20%	0.203	48%	0.484	C	S	.	.			trans	-73.3	65.7	-172.4	-54.2	0	0	0	0	114.5
450	N	39.2	Very low	51.4	Low	157 Å²	157	79.4 Å²	79.4	84%	0.84	46%	0.461	S	S	*	.	S	Bend	trans	-85.2	-7	176	-82	-46.8	0	0	0	114.5	S448	S448-N450 VanDerWaalsContact C-N 3.3Å; S448-N450 PolarHBondContact O-N 3.05Å
451	S	53	Low	53.9	Low	100 Å²	100	74.8 Å²	74.8	70%	0.699	44%	0.438	S	S	*	.	S	Bend	trans	-151.5	117.7	173	54.2	0	0	0	0	110
452	I	65.7	Low	56.1	Low	31 Å²	31	74.6 Å²	74.6	16%	0.159	45%	0.446	C	S	.	.			trans	-66.8	128.3	164.4	-66.4	155.2	0	0	0	106.6	L454 W698 F700 L724 A728	I452-L454 PolarHBondContact O-N 3.23Å; I452-W698 HydrophobicContact CD1-CH2 4.03Å; I452-W698 HydrophobicContact CD1-CZ3 4.04Å; I452-F700 HydrophobicContact CD1-CE2 4.24Å; I452-F700 HydrophobicContact CG1-CE2 4.32Å; I452-L724 HydrophobicContact CB-CD1 4.22Å; I452-L724 HydrophobicContact CD1-CD1 3.73Å; I452-L724 HydrophobicContact CD1-CG 3.92Å; I452-A728 HydrophobicContact CD1-CB 4Å
453	P	64.2	Low	58.6	Low	45 Å²	45	76.1 Å²	76.1	29%	0.292	44%	0.441	S	S	.	.			trans	-69	119.5	179.3	27	-32.6	0	0	0	110.4	F456 Y731	P453-F456 HydrophobicContact CG-CD2 4.02Å; P453-Y731 HydrophobicContact CG-CD2 3.34Å; P453-Y731 HydrophobicContact CG-CE2 3.69Å; P453-Y731 HydrophobicContact CG-CG 4.09Å
454	L	68.1	Low	60.9	Low	55 Å²	55	69 Å²	69	29%	0.288	40%	0.404	S	S	.	.	S	Bend	trans	-114.5	132.8	157.5	-74.9	164.2	0	0	0	105.9	I452 V781	I452-L454 PolarHBondContact O-N 3.23Å; L454-V781 HydrophobicContact CD2-CB 4.03Å; L454-V781 HydrophobicContact CD2-CG1 3.67Å
455	P	77	Confident	63	Low	74 Å²	74	63 Å²	63	48%	0.481	38%	0.377	S	S	.	.	S	Bend	cis	-74.9	162.4	-2.7	36.3	-34.3	0	0	0	111.4	V781 E783	P455-V781 CarbonylContact C-O 3.59Å; P455-V781 VanDerWaalsContact CA-O 3.27Å; P455-V781 WeakPolarHBondContact CA-O 3.37Å; P455-V781 WeakPolarHBondContact CB-O 3.08Å; P455-E783 HydrophobicContact CB-CG 4.34Å; P455-E783 WeakPolarHBondContact CD-OE1 3.12Å; P455-E783 HydrophobicContact CG-CG 4.31Å
456	F	80.8	Confident	64.9	Low	41 Å²	41	62.9 Å²	62.9	18%	0.18	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	143.3	171.7	-170.4	-90.6	0	0	0	110.9	P453 L458 L730 Y731 G780 V781	P453-F456 HydrophobicContact CG-CD2 4.02Å; F456-L458 HydrophobicContact CE1-CD2 3.95Å; F456-L458 HydrophobicContact CE1-CG 4.1Å; F456-L458 HydrophobicContact CZ-CD2 4.48Å; F456-L730 HydrophobicContact CD1-CB 3.51Å; F456-L730 HydrophobicContact CD1-CD1 4.42Å; F456-L730 VanDerWaalsContact CE1-C 3.44Å; F456-L730 HydrophobicContact CE1-CB 3.67Å; F456-L730 WeakPolarHBondContact CE1-O 3.45Å; F456-Y731 HydrophobicContact CD2-CD2 4.18Å; F456-Y731 AromaticContact CE2-CD2 3.84Å; F456-Y731 HydrophobicContact CE2-CD2 3.84Å; F456-G780 CarbonylContact O-C 3.43Å; F456-G780 WeakPolarHBondContact O-CA 3.4Å; F456-V781 PolarHBondContact N-O 3.18Å; F456-V781 PolarHBondContact O-N 2.89Å
457	M	82.5	Confident	66.3	Low	84 Å²	84	60.6 Å²	60.6	41%	0.414	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	126.4	176.1	-161	170	74.8	0	0	110.1	Y779 Y788	M457-Y779 CarbonylContact C-O 3.47Å; M457-Y779 WeakPolarHBondContact CA-O 3.41Å; M457-Y779 HydrophobicContact CG-CD2 3.91Å; M457-Y779 HydrophobicContact CG-CE2 4.29Å; M457-Y779 HydrophobicContact SD-CD2 4.25Å; M457-Y779 HydrophobicContact SD-CE2 4.01Å; M457-Y788 HydrophobicContact SD-CD2 4.39Å; M457-Y788 HydrophobicContact SD-CE2 4.36Å
458	L	83.9	Confident	67.7	Low	45 Å²	45	57.2 Å²	57.2	24%	0.236	36%	0.357	C	S	.	.	S	Bend	trans	-68.4	-37.9	-176.9	-83	173.7	0	0	0	113.1	F456 C480 L730 I735 Y779	F456-L458 HydrophobicContact CE1-CD2 3.95Å; F456-L458 HydrophobicContact CE1-CG 4.1Å; F456-L458 HydrophobicContact CZ-CD2 4.48Å; L458-C480 HydrophobicContact CD1-CB 4.2Å; L458-L730 HydrophobicContact CD1-CD2 3.43Å; L458-L730 VanDerWaalsContact CD1-CD2 3.43Å; L458-L730 HydrophobicContact CG-CB 4.47Å; L458-L730 HydrophobicContact CG-CD2 3.88Å; L458-I735 HydrophobicContact CD1-CG1 4.13Å; L458-Y779 PolarHBondContact N-O 2.97Å
459	I	84	Confident	69.2	Low	16 Å²	16	54.5 Å²	54.5	8%	0.082	34%	0.338	C	S	.	.	S	Bend	trans	-155	147.6	-170.9	-158	171.3	0	0	0	110.5	E463 L464 R479	I459-E463 HydrophobicContact CD1-CB 3.75Å; I459-E463 HydrophobicContact CG1-CB 3.87Å; I459-E463 HydrophobicContact CG1-CG 4.49Å; I459-L464 HydrophobicContact CG2-CD1 4.47Å; I459-L464 HydrophobicContact CG2-CD2 3.68Å; I459-L464 HydrophobicContact CG2-CG 3.95Å; I459-R479 HydrophobicContact CD1-CG 3.8Å
460	P	81.3	Confident	70.6	Confident	59 Å²	59	53.8 Å²	53.8	38%	0.383	33%	0.332	S	S	.	.			trans	-56.4	136.9	169.9	-26.9	36.1	0	0	0	112.7	S462 E463	P460-S462 PolarHBondContact O-N 3.37Å; P460-E463 WeakPolarHBondContact O-CB 3.27Å; P460-E463 PolarHBondContact O-N 3.4Å
461	T	81.3	Confident	71.8	Confident	57 Å²	57	47.6 Å²	47.6	35%	0.35	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-55.6	-27.9	178.4	-50.2	0	0	0	0	113.3	E463 L464 Y779 N793	T461-E463 PolarHBondContact O-N 3.28Å; T461-L464 PolarHBondContact O-N 2.82Å; T461-Y779 VanDerWaalsContact CG2-OH 3.24Å; T461-Y779 WeakPolarHBondContact CG2-OH 3.37Å; T461-Y779 WeakPolarHBondContact OG1-CE2 3.23Å; T461-Y779 PolarHBondContact OG1-OH 3.05Å; T461-N793 HydrophobicContact CG2-CB 4.1Å
462	S	78.1	Confident	72.6	Confident	111 Å²	111	42.9 Å²	42.9	78%	0.776	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-68.2	-14.2	176.2	52	0	0	0	0	114.9	P460	P460-S462 PolarHBondContact O-N 3.37Å
463	E	78.2	Confident	73.1	Confident	76 Å²	76	41.5 Å²	41.5	36%	0.355	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-97.3	-12.4	178.8	-74.7	-164.8	-121.1	0	0	113.6	I459 P460 T461 R479	I459-E463 HydrophobicContact CD1-CB 3.75Å; I459-E463 HydrophobicContact CG1-CB 3.87Å; I459-E463 HydrophobicContact CG1-CG 4.49Å; P460-E463 WeakPolarHBondContact O-CB 3.27Å; P460-E463 PolarHBondContact O-N 3.4Å; T461-E463 PolarHBondContact O-N 3.28Å; E463-R479 VanDerWaalsContact O-CD 3.24Å; E463-R479 WeakPolarHBondContact O-CD 3.46Å; E463-R479 PolarHBondContact O-NE 3.24Å; E463-R479 PolarHBondContact O-NH1 3.38Å; E463-R479 IonicContact OE2-CZ 2.75Å; E463-R479 IonicContact OE2-NE 3.16Å; E463-R479 PolarHBondContact OE2-NE 2.87Å; E463-R479 IonicContact OE2-NH2 3.99Å; E463-R479 PolarHBondContact OE2-NH2 2.85Å
464	L	80.6	Confident	73.6	Confident	11 Å²	11	39.6 Å²	39.6	6%	0.058	25%	0.247	C	C	.	.	S	Bend	trans	-74.2	137.1	179.4	-66.1	167.7	0	0	0	111.1	I459 T461 S466 N476 Y779 T790	I459-L464 HydrophobicContact CG2-CD1 4.47Å; I459-L464 HydrophobicContact CG2-CD2 3.68Å; I459-L464 HydrophobicContact CG2-CG 3.95Å; T461-L464 PolarHBondContact O-N 2.82Å; L464-S466 PolarHBondContact O-N 2.76Å; L464-N476 HydrophobicContact CD2-CB 4.05Å; L464-Y779 HydrophobicContact CD1-CD1 3.67Å; L464-Y779 HydrophobicContact CD1-CD2 3.9Å; L464-Y779 HydrophobicContact CD1-CE1 3.53Å; L464-Y779 HydrophobicContact CD1-CE2 3.78Å; L464-Y779 HydrophobicContact CD1-CG 3.84Å; L464-T790 HydrophobicContact CD1-CG2 3.96Å; L464-T790 HydrophobicContact CD2-CG2 4.43Å
465	A	71.9	Confident	74	Confident	15 Å²	15	38.2 Å²	38.2	12%	0.124	24%	0.241	C	C	.	.			trans	-63.5	124.4	170.4	0	0	0	0	0	110	V475 N476 L585	A465-V475 HydrophobicContact CB-CB 4.31Å; A465-V475 HydrophobicContact CB-CG1 3.72Å; A465-N476 WeakPolarHBondContact CB-OD1 3.5Å; A465-N476 PolarHBondContact N-OD1 3.48Å; A465-N476 PolarHBondContact O-ND2 3.41Å; A465-N476 VanDerWaalsContact O-ND2 3.09Å; A465-L585 HydrophobicContact CB-CD2 4.36Å
466	S	68.1	Low	74.3	Confident	70 Å²	70	34.7 Å²	34.7	49%	0.49	22%	0.218	S	C	.	.			trans	-97.2	99.7	-169.3	44.3	0	0	0	0	112.3	L464 S588	L464-S466 PolarHBondContact O-N 2.76Å; S466-S588 PolarHBondContact O-OG 3.16Å
467	G	62.2	Low	74.5	Confident	17 Å²	17	32.8 Å²	32.8	18%	0.175	21%	0.21	C	C	.	.	S	Bend	trans	178.3	160.5	173.6	0	0	0	0	0	114.5	S469 C472 S588 N791	G467-S469 VanDerWaalsContact C-N 3.25Å; G467-S469 PolarHBondContact O-N 3.2Å; G467-C472 VanDerWaalsContact C-SG 3.53Å; G467-C472 WeakPolarHBondContact O-CB 3.26Å; G467-C472 PolarHBondContact O-SG 3.31Å; G467-C472 VanDerWaalsContact O-SG 3.4Å; G467-S588 VanDerWaalsContact CA-O 3.3Å; G467-S588 WeakPolarHBondContact CA-O 3.29Å; G467-S588 WeakPolarHBondContact CA-OG 3.43Å; G467-S588 PolarHBondContact N-OG 3.26Å; G467-N791 PolarHBondContact O-OD1 3.49Å
468	G	59	Low	74.5	Confident	47 Å²	47	29 Å²	29	49%	0.485	19%	0.191	S	C	.	.	S	Bend	trans	-84.9	20.2	-179	0	0	0	0	0	114.8
469	S	60	Low	74.4	Confident	3 Å²	3	31.5 Å²	31.5	2%	0.021	20%	0.198	C	C	.	.	S	Bend	trans	-103.7	154.8	-173.9	101.2	0	0	0	0	112.9	G467 T471 C472 T473	G467-S469 VanDerWaalsContact C-N 3.25Å; G467-S469 PolarHBondContact O-N 3.2Å; S469-T471 PolarHBondContact O-N 2.89Å; S469-T471 WeakPolarHBondContact OG-CB 3.38Å; S469-T471 PolarHBondContact OG-N 3.05Å; S469-C472 VanDerWaalsContact O-CB 3.23Å; S469-C472 WeakPolarHBondContact O-CB 3.37Å; S469-C472 PolarHBondContact O-N 3.2Å; S469-C472 PolarHBondContact O-SG 3.49Å; S469-C472 PolarHBondContact OG-N 2.93Å; S469-C472 PolarHBondContact OG-SG 3.4Å; S469-T473 PolarHBondContact O-N 3.16Å
470	L	64.6	Low	74.5	Confident	16 Å²	16	31.8 Å²	31.8	8%	0.084	20%	0.201	C	C	.	.	H	α-helix	trans	-58.5	-34.8	176	-170.9	59.3	0	0	0	112.1	C472 T473 V474 W653 L661 M664	L470-C472 VanDerWaalsContact C-N 3.29Å; L470-C472 PolarHBondContact O-N 2.68Å; L470-T473 WeakPolarHBondContact O-CB 3.34Å; L470-T473 PolarHBondContact O-N 3.12Å; L470-T473 VanDerWaalsContact O-N 3.13Å; L470-V474 WeakPolarHBondContact O-CG2 3.26Å; L470-V474 PolarHBondContact O-N 3.3Å; L470-W653 HydrophobicContact CB-CD2 3.77Å; L470-W653 HydrophobicContact CB-CE3 3.74Å; L470-W653 HydrophobicContact CB-CG 4.46Å; L470-W653 HydrophobicContact CB-CH2 3.84Å; L470-W653 HydrophobicContact CB-CZ2 3.83Å; L470-W653 HydrophobicContact CB-CZ3 3.79Å; L470-W653 HydrophobicContact CD2-CB 3.67Å; L470-W653 HydrophobicContact CD2-CD2 3.67Å; L470-W653 HydrophobicContact CD2-CE3 3.97Å; L470-W653 HydrophobicContact CD2-CG 3.54Å; L470-W653 HydrophobicContact CG-CD2 4.36Å; L470-W653 HydrophobicContact CG-CE3 4.36Å; L470-W653 VanDerWaalsContact N-CH2 3.35Å; L470-L661 HydrophobicContact CD1-CD1 4Å; L470-M664 HydrophobicContact CD1-CE 4.12Å; L470-M664 HydrophobicContact CD2-CE 3.71Å; L470-M664 HydrophobicContact CD2-SD 4.1Å; L470-M664 HydrophobicContact CG-CE 3.91Å
471	T	62.6	Low	74.7	Confident	26 Å²	26	29.6 Å²	29.6	16%	0.16	19%	0.186	C	C	.	.	H	α-helix	trans	-59.3	-40	174.7	-43.6	0	0	0	0	111.4	S469 V474 V475 L496 L584	S469-T471 PolarHBondContact O-N 2.89Å; S469-T471 WeakPolarHBondContact OG-CB 3.38Å; S469-T471 PolarHBondContact OG-N 3.05Å; T471-V474 PolarHBondContact O-N 3.5Å; T471-V475 WeakPolarHBondContact O-CB 3.14Å; T471-V475 WeakPolarHBondContact O-CG2 3.38Å; T471-V475 PolarHBondContact O-N 3.29Å; T471-L496 HydrophobicContact CG2-CD1 3.85Å; T471-L584 HydrophobicContact CG2-CD2 4.18Å
472	C	70.1	Confident	74.5	Confident	2 Å²	2	27.2 Å²	27.2	1%	0.014	17%	0.173	C	C	.	.	H	α-helix	trans	-61.7	-44.7	174.5	-42.9	0	0	0	0	110.8	G467 S469 L470 V475 N476 S588	G467-C472 VanDerWaalsContact C-SG 3.53Å; G467-C472 WeakPolarHBondContact O-CB 3.26Å; G467-C472 PolarHBondContact O-SG 3.31Å; G467-C472 VanDerWaalsContact O-SG 3.4Å; S469-C472 VanDerWaalsContact O-CB 3.23Å; S469-C472 WeakPolarHBondContact O-CB 3.37Å; S469-C472 PolarHBondContact O-N 3.2Å; S469-C472 PolarHBondContact O-SG 3.49Å; S469-C472 PolarHBondContact OG-N 2.93Å; S469-C472 PolarHBondContact OG-SG 3.4Å; L470-C472 VanDerWaalsContact C-N 3.29Å; L470-C472 PolarHBondContact O-N 2.68Å; C472-V475 PolarHBondContact O-N 3.11Å; C472-N476 VanDerWaalsContact O-CB 3.3Å; C472-N476 WeakPolarHBondContact O-CB 3.16Å; C472-N476 PolarHBondContact O-N 2.98Å; C472-N476 PolarHBondContact O-ND2 2.85Å; C472-S588 WeakPolarHBondContact SG-CB 3.39Å; C472-S588 PolarHBondContact SG-OG 3.33Å
473	T	77.1	Confident	74.3	Confident	2 Å²	2	22 Å²	22	1%	0.012	14%	0.136	C	C	.	.	H	α-helix	trans	-60.9	-47.3	177.1	-45.8	0	0	0	0	111.1	S469 L470 N476 I477 L661 V737 H775 N791	S469-T473 PolarHBondContact O-N 3.16Å; L470-T473 WeakPolarHBondContact O-CB 3.34Å; L470-T473 PolarHBondContact O-N 3.12Å; L470-T473 VanDerWaalsContact O-N 3.13Å; T473-N476 PolarHBondContact O-N 2.68Å; T473-I477 HydrophobicContact CG2-CD1 4.28Å; T473-I477 VanDerWaalsContact O-CG1 3.27Å; T473-I477 WeakPolarHBondContact O-CG1 3.26Å; T473-I477 PolarHBondContact O-N 3.06Å; T473-L661 HydrophobicContact CG2-CD2 4.38Å; T473-V737 HydrophobicContact CG2-CG1 3.93Å; T473-H775 HydrophobicContact CG2-CB 4.11Å; T473-H775 PolarHBondContact OG1-O 3.34Å; T473-N791 PolarHBondContact OG1-ND2 3.25Å
474	V	75.3	Confident	73.9	Confident	5 Å²	5	20.9 Å²	20.9	3%	0.03	13%	0.132	C	C	.	.	H	α-helix	trans	-64.6	-44	178.5	177	0	0	0	0	112	L470 T471 N476 I477 L478 L661 M664 L665	L470-V474 WeakPolarHBondContact O-CG2 3.26Å; L470-V474 PolarHBondContact O-N 3.3Å; T471-V474 PolarHBondContact O-N 3.5Å; V474-N476 VanDerWaalsContact C-N 3.32Å; V474-N476 PolarHBondContact O-N 3.09Å; V474-I477 PolarHBondContact O-N 2.97Å; V474-L478 HydrophobicContact CG1-CD1 3.99Å; V474-L478 WeakPolarHBondContact O-CG 3.45Å; V474-L478 PolarHBondContact O-N 3.48Å; V474-L661 HydrophobicContact CG2-CD1 4.39Å; V474-M664 HydrophobicContact CG2-CE 3.92Å; V474-L665 HydrophobicContact CG1-CD2 4.1Å; V474-L665 HydrophobicContact CG2-CD1 4.45Å; V474-L665 HydrophobicContact CG2-CD2 4.01Å
475	V	74.7	Confident	72.9	Confident	25 Å²	25	26.1 Å²	26.1	15%	0.152	16%	0.16	C	C	.	.	H	α-helix	trans	-57.8	-45.1	173.4	168	0	0	0	0	110.8	A465 T471 C472 L478 R479 L484 L492	A465-V475 HydrophobicContact CB-CB 4.31Å; A465-V475 HydrophobicContact CB-CG1 3.72Å; T471-V475 WeakPolarHBondContact O-CB 3.14Å; T471-V475 WeakPolarHBondContact O-CG2 3.38Å; T471-V475 PolarHBondContact O-N 3.29Å; C472-V475 PolarHBondContact O-N 3.11Å; V475-L478 PolarHBondContact O-N 2.79Å; V475-R479 WeakPolarHBondContact O-CB 3.03Å; V475-R479 PolarHBondContact O-N 3.06Å; V475-L484 HydrophobicContact CG1-CD1 4.08Å; V475-L492 HydrophobicContact CG2-CD2 3.87Å
476	N	83.6	Confident	72	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-70.2	-34.9	-179	-70.1	-23.4	0	0	0	112.6	L464 A465 C472 T473 V474 C480 L777	L464-N476 HydrophobicContact CD2-CB 4.05Å; A465-N476 WeakPolarHBondContact CB-OD1 3.5Å; A465-N476 PolarHBondContact N-OD1 3.48Å; A465-N476 PolarHBondContact O-ND2 3.41Å; A465-N476 VanDerWaalsContact O-ND2 3.09Å; C472-N476 VanDerWaalsContact O-CB 3.3Å; C472-N476 WeakPolarHBondContact O-CB 3.16Å; C472-N476 PolarHBondContact O-N 2.98Å; C472-N476 PolarHBondContact O-ND2 2.85Å; T473-N476 PolarHBondContact O-N 2.68Å; V474-N476 VanDerWaalsContact C-N 3.32Å; V474-N476 PolarHBondContact O-N 3.09Å; N476-C480 WeakPolarHBondContact O-CB 3.29Å; N476-C480 PolarHBondContact O-N 3.16Å; N476-C480 PolarHBondContact O-SG 3.17Å; N476-L777 HydrophobicContact CB-CD1 3.93Å
477	I	84.9	Confident	71.4	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-57.8	-55	169.6	-68	163.6	0	0	0	109.5	T473 V474 R479 C480 L481 L665 L683 I735 V737 L777 F948	T473-I477 HydrophobicContact CG2-CD1 4.28Å; T473-I477 VanDerWaalsContact O-CG1 3.27Å; T473-I477 WeakPolarHBondContact O-CG1 3.26Å; T473-I477 PolarHBondContact O-N 3.06Å; V474-I477 PolarHBondContact O-N 2.97Å; I477-R479 VanDerWaalsContact C-N 3.33Å; I477-R479 PolarHBondContact O-N 2.79Å; I477-C480 PolarHBondContact O-N 2.98Å; I477-L481 HydrophobicContact CG2-CD1 4.12Å; I477-L481 WeakPolarHBondContact O-CG 3.34Å; I477-L481 PolarHBondContact O-N 2.96Å; I477-L665 HydrophobicContact CD1-CD1 4.01Å; I477-L683 HydrophobicContact CG2-CD2 4.41Å; I477-I735 HydrophobicContact CB-CD1 4.44Å; I477-I735 HydrophobicContact CG1-CG2 4.45Å; I477-I735 HydrophobicContact CG2-CD1 4.23Å; I477-I735 WeakPolarHBondContact O-CD1 3.24Å; I477-V737 HydrophobicContact CD1-CG2 4.09Å; I477-V737 HydrophobicContact CG1-CG2 4.05Å; I477-L777 HydrophobicContact CB-CD1 4.43Å; I477-L777 HydrophobicContact CG1-CD1 3.8Å; I477-F948 HydrophobicContact CD1-CD2 3.83Å; I477-F948 HydrophobicContact CD1-CE2 3.91Å; I477-F948 HydrophobicContact CG1-CD2 4.33Å; I477-F948 HydrophobicContact CG2-CB 4.14Å; I477-F948 HydrophobicContact CG2-CG 4.39Å
478	L	82.2	Confident	70.7	Confident	6 Å²	6	31 Å²	31	3%	0.031	17%	0.172	C	C	.	.	H	α-helix	trans	-68.1	-31.1	-175.9	-63.7	171.2	0	0	0	112.7	V474 V475 G482 L483 L484 L492 V679 L683	V474-L478 HydrophobicContact CG1-CD1 3.99Å; V474-L478 WeakPolarHBondContact O-CG 3.45Å; V474-L478 PolarHBondContact O-N 3.48Å; V475-L478 PolarHBondContact O-N 2.79Å; L478-G482 PolarHBondContact O-N 3.07Å; L478-L483 HydrophobicContact CB-CB 4.35Å; L478-L483 HydrophobicContact CD2-CB 4.08Å; L478-L483 HydrophobicContact CD2-CD1 3.76Å; L478-L483 PolarHBondContact O-N 3.3Å; L478-L484 HydrophobicContact CB-CD2 3.72Å; L478-L484 HydrophobicContact CB-CG 3.81Å; L478-L484 HydrophobicContact CD1-CD2 4.25Å; L478-L484 PolarHBondContact O-N 2.86Å; L478-L492 HydrophobicContact CD1-CD1 3.42Å; L478-L492 VanDerWaalsContact CD1-CD1 3.42Å; L478-V679 HydrophobicContact CD1-CG2 3.79Å; L478-V679 HydrophobicContact CD2-CG2 4.22Å; L478-L683 HydrophobicContact CD2-CD2 3.89Å
479	R	83	Confident	70.1	Confident	97 Å²	97	31.2 Å²	31.2	37%	0.366	16%	0.164	S	C	.	.	H	α-helix	trans	-67.4	-48.4	174.6	-166.1	177.3	-175.7	134.3	8	111.2	I459 E463 V475 I477 L481 G482 L484	I459-R479 HydrophobicContact CD1-CG 3.8Å; E463-R479 VanDerWaalsContact O-CD 3.24Å; E463-R479 WeakPolarHBondContact O-CD 3.46Å; E463-R479 PolarHBondContact O-NE 3.24Å; E463-R479 PolarHBondContact O-NH1 3.38Å; E463-R479 IonicContact OE2-CZ 2.75Å; E463-R479 IonicContact OE2-NE 3.16Å; E463-R479 PolarHBondContact OE2-NE 2.87Å; E463-R479 IonicContact OE2-NH2 3.99Å; E463-R479 PolarHBondContact OE2-NH2 2.85Å; V475-R479 WeakPolarHBondContact O-CB 3.03Å; V475-R479 PolarHBondContact O-N 3.06Å; I477-R479 VanDerWaalsContact C-N 3.33Å; I477-R479 PolarHBondContact O-N 2.79Å; R479-L481 VanDerWaalsContact C-N 3.33Å; R479-L481 PolarHBondContact O-N 2.85Å; R479-G482 PolarHBondContact O-N 2.74Å; R479-L484 HydrophobicContact CB-CD1 3.75Å; R479-L484 HydrophobicContact CB-CG 4.47Å; R479-L484 HydrophobicContact CG-CD1 4.3Å
480	C	86	Confident	69.6	Low	21 Å²	21	37.7 Å²	37.7	14%	0.142	19%	0.194	C	C	.	.	H	α-helix	trans	-73	-25	-176.7	-59.6	0	0	0	0	112.6	L458 N476 I477 G482 I735	L458-C480 HydrophobicContact CD1-CB 4.2Å; N476-C480 WeakPolarHBondContact O-CB 3.29Å; N476-C480 PolarHBondContact O-N 3.16Å; N476-C480 PolarHBondContact O-SG 3.17Å; I477-C480 PolarHBondContact O-N 2.98Å; C480-G482 PolarHBondContact O-N 2.87Å; C480-I735 HydrophobicContact CB-CD1 3.49Å; C480-I735 VanDerWaalsContact CB-CD1 3.49Å; C480-I735 HydrophobicContact CB-CG1 4.28Å
481	L	84.7	Confident	68.9	Low	14 Å²	14	40.7 Å²	40.7	7%	0.073	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-3.9	166.1	-68.4	179.1	0	0	0	113.5	I477 R479 L483 L683 G733 I735	I477-L481 HydrophobicContact CG2-CD1 4.12Å; I477-L481 WeakPolarHBondContact O-CG 3.34Å; I477-L481 PolarHBondContact O-N 2.96Å; R479-L481 VanDerWaalsContact C-N 3.33Å; R479-L481 PolarHBondContact O-N 2.85Å; L481-L483 HydrophobicContact CB-CD1 3.85Å; L481-L483 HydrophobicContact CB-CG 3.89Å; L481-L483 HydrophobicContact CD1-CD1 3.81Å; L481-L483 HydrophobicContact CG-CD1 4.49Å; L481-L483 PolarHBondContact O-N 3.47Å; L481-L683 HydrophobicContact CD1-CB 4.24Å; L481-G733 WeakPolarHBondContact CD2-O 3.11Å; L481-I735 HydrophobicContact CD2-CD1 3.99Å; L481-I735 HydrophobicContact CD2-CG1 4.04Å; L481-I735 HydrophobicContact CG-CD1 3.65Å; L481-I735 HydrophobicContact CG-CG1 4.26Å
482	G	78.5	Confident	68.4	Low	7 Å²	7	39.8 Å²	39.8	7%	0.072	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.9	22.9	-175.5	0	0	0	0	0	114.4	L478 R479 C480	L478-G482 PolarHBondContact O-N 3.07Å; R479-G482 PolarHBondContact O-N 2.74Å; C480-G482 PolarHBondContact O-N 2.87Å
483	L	73.7	Confident	67.3	Low	2 Å²	2	41.1 Å²	41.1	1%	0.01	21%	0.213	C	C	.	.			trans	-87	-26.6	-177.8	-72.3	174.5	0	0	0	113.2	L478 L481 D485 R486 C487 L682 E950	L478-L483 HydrophobicContact CB-CB 4.35Å; L478-L483 HydrophobicContact CD2-CB 4.08Å; L478-L483 HydrophobicContact CD2-CD1 3.76Å; L478-L483 PolarHBondContact O-N 3.3Å; L481-L483 HydrophobicContact CB-CD1 3.85Å; L481-L483 HydrophobicContact CB-CG 3.89Å; L481-L483 HydrophobicContact CD1-CD1 3.81Å; L481-L483 HydrophobicContact CG-CD1 4.49Å; L481-L483 PolarHBondContact O-N 3.47Å; L483-D485 PolarHBondContact O-N 3.15Å; L483-R486 PolarHBondContact O-N 3.15Å; L483-C487 PolarHBondContact O-N 3.11Å; L483-L682 HydrophobicContact CD1-CB 3.87Å; L483-L682 HydrophobicContact CD2-CB 4.08Å; L483-L682 HydrophobicContact CD2-CD1 4.38Å; L483-L682 HydrophobicContact CD2-CD2 4.06Å; L483-L682 HydrophobicContact CD2-CG 4.4Å; L483-E950 HydrophobicContact CD2-CG 4.06Å
484	L	69.2	Low	65.8	Low	51 Å²	51	43.2 Å²	43.2	27%	0.267	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-19.3	173	-64.8	-177	0	0	0	113.5	V475 L478 R479 R486 C487 L492	V475-L484 HydrophobicContact CG1-CD1 4.08Å; L478-L484 HydrophobicContact CB-CD2 3.72Å; L478-L484 HydrophobicContact CB-CG 3.81Å; L478-L484 HydrophobicContact CD1-CD2 4.25Å; L478-L484 PolarHBondContact O-N 2.86Å; R479-L484 HydrophobicContact CB-CD1 3.75Å; R479-L484 HydrophobicContact CB-CG 4.47Å; R479-L484 HydrophobicContact CG-CD1 4.3Å; L484-R486 PolarHBondContact O-N 2.93Å; L484-C487 VanDerWaalsContact O-O 3.1Å; L484-L492 HydrophobicContact CD2-CD2 3.92Å
485	D	60.8	Low	64.5	Low	122 Å²	122	44 Å²	44	65%	0.652	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-9.1	171.9	-59.3	-43.8	0	0	0	112	R438 L483	R438-D485 IonicContact CZ-OD2 3.72Å; R438-D485 IonicContact NH1-OD2 3.99Å; R438-D485 IonicContact NH2-OD2 2.74Å; R438-D485 PolarHBondContact NH2-OD2 2.95Å; L483-D485 PolarHBondContact O-N 3.15Å
486	R	53	Low	63.2	Low	149 Å²	149	44.1 Å²	44.1	56%	0.562	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.2	-28	-175.9	-50.9	-169.7	-157.9	160	14.9	114.3	L483 L484 E950	L483-R486 PolarHBondContact O-N 3.15Å; L484-R486 PolarHBondContact O-N 2.93Å; R486-E950 IonicContact CZ-OE1 3.17Å; R486-E950 IonicContact CZ-OE2 2.72Å; R486-E950 IonicContact NH1-OE1 3.51Å; R486-E950 PolarHBondContact NH1-OE1 3.21Å; R486-E950 IonicContact NH1-OE2 3.26Å; R486-E950 VanDerWaalsContact NH2-CD 3.35Å; R486-E950 IonicContact NH2-OE1 2.7Å; R486-E950 PolarHBondContact NH2-OE1 3.06Å; R486-E950 IonicContact NH2-OE2 2.74Å; R486-E950 PolarHBondContact NH2-OE2 3.49Å
487	C	54.4	Low	61.2	Low	22 Å²	22	49.6 Å²	49.6	15%	0.149	26%	0.256	C	S	.	.	S	Bend	trans	-111.6	129.7	171.9	-76.6	0	0	0	0	110	L483 L484 D491 L682	L483-C487 PolarHBondContact O-N 3.11Å; L484-C487 VanDerWaalsContact O-O 3.1Å; C487-D491 HydrophobicContact CB-CB 4.21Å; C487-L682 VanDerWaalsContact SG-CD1 3.53Å
488	G	47.9	Very low	59.1	Low	32 Å²	32	53.8 Å²	53.8	33%	0.33	28%	0.278	S	S	.	.			trans	-63.3	158.5	179.1	0	0	0	0	0	112.2	E490 D491 L492	G488-E490 PolarHBondContact O-N 2.97Å; G488-D491 PolarHBondContact N-OD2 3.23Å; G488-D491 WeakPolarHBondContact O-CB 3.38Å; G488-D491 PolarHBondContact O-N 3.49Å; G488-D491 VanDerWaalsContact O-N 3.09Å; G488-L492 PolarHBondContact O-N 3.35Å
489	V	47	Very low	57.2	Low	52 Å²	52	56.8 Å²	56.8	32%	0.315	29%	0.291	S	S	.	.	H	α-helix	trans	-60.2	-29.5	171.1	-176.7	0	0	0	0	110.7	L492 C493 L580 V581 L584	V489-L492 PolarHBondContact O-N 3.15Å; V489-C493 WeakPolarHBondContact O-CB 3.24Å; V489-C493 PolarHBondContact O-N 3.15Å; V489-C493 PolarHBondContact O-SG 3.38Å; V489-L580 HydrophobicContact CG1-CD2 4.46Å; V489-V581 HydrophobicContact CB-CG2 4.35Å; V489-V581 HydrophobicContact CG1-CG2 3.71Å; V489-V581 HydrophobicContact CG2-CG2 3.81Å; V489-L584 HydrophobicContact CG1-CD1 4.28Å
490	E	48.2	Very low	55	Low	140 Å²	140	57.9 Å²	57.9	65%	0.654	30%	0.295	S	S	*	.	H	α-helix	trans	-63.5	-48.7	172	-70.6	144.3	-166.1	0	0	111.6	G488 L492 C493 A494	G488-E490 PolarHBondContact O-N 2.97Å; E490-L492 VanDerWaalsContact C-N 3.32Å; E490-L492 PolarHBondContact O-N 3.43Å; E490-C493 PolarHBondContact O-N 2.92Å; E490-A494 PolarHBondContact O-N 2.95Å
491	D	50.6	Low	52.5	Low	78 Å²	78	59.9 Å²	59.9	42%	0.417	31%	0.305	S	S	.	.	H	α-helix	trans	-58.2	-45.2	172.5	-59.1	-48.2	0	0	0	110.8	C487 G488 C493 A494 I495	C487-D491 HydrophobicContact CB-CB 4.21Å; G488-D491 PolarHBondContact N-OD2 3.23Å; G488-D491 WeakPolarHBondContact O-CB 3.38Å; G488-D491 PolarHBondContact O-N 3.49Å; G488-D491 VanDerWaalsContact O-N 3.09Å; D491-C493 VanDerWaalsContact C-N 3.34Å; D491-C493 PolarHBondContact O-N 2.89Å; D491-A494 PolarHBondContact O-N 2.93Å; D491-I495 HydrophobicContact CB-CD1 4.46Å; D491-I495 WeakPolarHBondContact O-CB 3.48Å; D491-I495 VanDerWaalsContact O-CD1 3.26Å; D491-I495 WeakPolarHBondContact O-CD1 3.43Å; D491-I495 WeakPolarHBondContact O-CG1 3.16Å; D491-I495 PolarHBondContact O-N 3.3Å
492	L	51.2	Low	50.1	Low	8 Å²	8	63.2 Å²	63.2	4%	0.042	32%	0.323	C	S	.	.	H	α-helix	trans	-62	-41.7	-179.6	-174.2	67	0	0	0	112.2	V475 L478 L484 G488 V489 E490 I495 L496	V475-L492 HydrophobicContact CG2-CD2 3.87Å; L478-L492 HydrophobicContact CD1-CD1 3.42Å; L478-L492 VanDerWaalsContact CD1-CD1 3.42Å; L484-L492 HydrophobicContact CD2-CD2 3.92Å; G488-L492 PolarHBondContact O-N 3.35Å; V489-L492 PolarHBondContact O-N 3.15Å; E490-L492 VanDerWaalsContact C-N 3.32Å; E490-L492 PolarHBondContact O-N 3.43Å; L492-I495 PolarHBondContact O-N 3.36Å; L492-L496 HydrophobicContact CG-CD1 4.13Å; L492-L496 WeakPolarHBondContact O-CB 3.48Å; L492-L496 VanDerWaalsContact O-CG 3.28Å; L492-L496 WeakPolarHBondContact O-CG 3.33Å; L492-L496 PolarHBondContact O-N 3.4Å
493	C	47.4	Very low	47.9	Very low	29 Å²	29	66.9 Å²	66.9	20%	0.196	34%	0.341	C	S	.	.	H	α-helix	trans	-67	-42.3	174.9	-79.2	0	0	0	0	111.7	V489 E490 D491 L496 Y497 L580	V489-C493 WeakPolarHBondContact O-CB 3.24Å; V489-C493 PolarHBondContact O-N 3.15Å; V489-C493 PolarHBondContact O-SG 3.38Å; E490-C493 PolarHBondContact O-N 2.92Å; D491-C493 VanDerWaalsContact C-N 3.34Å; D491-C493 PolarHBondContact O-N 2.89Å; C493-L496 PolarHBondContact O-N 2.8Å; C493-Y497 VanDerWaalsContact O-CB 3.3Å; C493-Y497 WeakPolarHBondContact O-CB 3.48Å; C493-Y497 PolarHBondContact O-N 3.13Å; C493-L580 HydrophobicContact CB-CD2 4.12Å; C493-L580 VanDerWaalsContact SG-CD2 3.53Å
494	A	46.2	Very low	45.7	Very low	47 Å²	47	69.6 Å²	69.6	39%	0.388	36%	0.359	S	S	.	.	H	α-helix	trans	-58.6	-47.8	173.5	0	0	0	0	0	111.2	E490 D491 L496 Y497 D498	E490-A494 PolarHBondContact O-N 2.95Å; D491-A494 PolarHBondContact O-N 2.93Å; A494-L496 PolarHBondContact O-N 2.85Å; A494-Y497 PolarHBondContact O-N 3.3Å; A494-D498 VanDerWaalsContact O-CB 3.29Å; A494-D498 WeakPolarHBondContact O-CB 3.33Å; A494-D498 PolarHBondContact O-N 3.27Å
495	I	48.2	Very low	43.7	Very low	20 Å²	20	73.1 Å²	73.1	10%	0.103	37%	0.374	C	S	.	.	H	α-helix	trans	-56.7	-46.9	176.4	-67.7	157.8	0	0	0	111.6	D491 L492 F499 V678 V679	D491-I495 HydrophobicContact CB-CD1 4.46Å; D491-I495 WeakPolarHBondContact O-CB 3.48Å; D491-I495 VanDerWaalsContact O-CD1 3.26Å; D491-I495 WeakPolarHBondContact O-CD1 3.43Å; D491-I495 WeakPolarHBondContact O-CG1 3.16Å; D491-I495 PolarHBondContact O-N 3.3Å; L492-I495 PolarHBondContact O-N 3.36Å; I495-F499 WeakPolarHBondContact O-CB 3.41Å; I495-F499 PolarHBondContact O-N 2.97Å; I495-V678 HydrophobicContact CD1-CB 3.62Å; I495-V678 HydrophobicContact CD1-CG1 4.07Å; I495-V678 HydrophobicContact CG1-CB 3.98Å; I495-V679 HydrophobicContact CD1-CG2 4Å; I495-V679 HydrophobicContact CG2-CB 4.06Å; I495-V679 HydrophobicContact CG2-CG2 3.82Å
496	L	47.1	Very low	42	Very low	28 Å²	28	69.7 Å²	69.7	15%	0.147	36%	0.363	C	S	.	.	H	α-helix	trans	-69.3	-33.2	-179.8	-71.8	167.3	0	0	0	112.6	T471 L492 C493 A494 W500	T471-L496 HydrophobicContact CG2-CD1 3.85Å; L492-L496 HydrophobicContact CG-CD1 4.13Å; L492-L496 WeakPolarHBondContact O-CB 3.48Å; L492-L496 VanDerWaalsContact O-CG 3.28Å; L492-L496 WeakPolarHBondContact O-CG 3.33Å; L492-L496 PolarHBondContact O-N 3.4Å; C493-L496 PolarHBondContact O-N 2.8Å; A494-L496 PolarHBondContact O-N 2.85Å; L496-W500 PolarHBondContact O-N 3.34Å
497	Y	42.1	Very low	40.6	Very low	116 Å²	116	68 Å²	68	46%	0.455	37%	0.371	S	S	.	.	H	α-helix	trans	-78.6	-44.7	179.7	-147.2	-89.4	0	0	0	111.7	C493 A494 F499 W500 N501	C493-Y497 VanDerWaalsContact O-CB 3.3Å; C493-Y497 WeakPolarHBondContact O-CB 3.48Å; C493-Y497 PolarHBondContact O-N 3.13Å; A494-Y497 PolarHBondContact O-N 3.3Å; Y497-F499 VanDerWaalsContact C-N 3.33Å; Y497-F499 PolarHBondContact O-N 3.08Å; Y497-W500 WeakPolarHBondContact O-CB 3.39Å; Y497-W500 PolarHBondContact O-N 3.05Å; Y497-W500 VanDerWaalsContact O-N 3.1Å; Y497-N501 PolarHBondContact O-N 3.03Å
498	D	40.4	Very low	39.2	Very low	88 Å²	88	76.3 Å²	76.3	47%	0.471	41%	0.405	S	S	.	.	H	α-helix	trans	-63.2	-38.5	172.5	-77.1	-20.2	0	0	0	111.4	A494 W500 N501 N502	A494-D498 VanDerWaalsContact O-CB 3.29Å; A494-D498 WeakPolarHBondContact O-CB 3.33Å; A494-D498 PolarHBondContact O-N 3.27Å; D498-W500 PolarHBondContact O-N 3.38Å; D498-N501 PolarHBondContact O-N 3.43Å; D498-N502 WeakPolarHBondContact O-CB 3.37Å; D498-N502 PolarHBondContact O-N 2.98Å; D498-N502 PolarHBondContact O-ND2 3.07Å
499	F	41.1	Very low	38	Very low	70 Å²	70	84.3 Å²	84.3	31%	0.307	43%	0.427	S	S	.	.	H	α-helix	trans	-60.1	-37.1	173	-178.4	-94.3	0	0	0	111.5	I495 Y497 N503 M664	I495-F499 WeakPolarHBondContact O-CB 3.41Å; I495-F499 PolarHBondContact O-N 2.97Å; Y497-F499 VanDerWaalsContact C-N 3.33Å; Y497-F499 PolarHBondContact O-N 3.08Å; F499-N503 WeakPolarHBondContact CZ-ND2 3.37Å; F499-N503 PolarHBondContact O-ND2 3.23Å; F499-M664 HydrophobicContact CD1-CG 4.29Å; F499-M664 HydrophobicContact CD1-SD 4.17Å; F499-M664 HydrophobicContact CD2-CG 4.25Å; F499-M664 HydrophobicContact CE1-CB 4.41Å; F499-M664 HydrophobicContact CE1-CG 3.69Å; F499-M664 HydrophobicContact CE1-SD 3.63Å; F499-M664 HydrophobicContact CE2-CB 4.08Å; F499-M664 HydrophobicContact CE2-CG 3.65Å; F499-M664 WeakPolarHBondContact CE2-O 3.41Å; F499-M664 HydrophobicContact CZ-CB 3.71Å; F499-M664 HydrophobicContact CZ-CG 3.35Å; F499-M664 HydrophobicContact CZ-SD 3.92Å
500	W	37.4	Very low	37	Very low	119 Å²	119	87.9 Å²	87.9	45%	0.451	45%	0.451	S	S	.	.	H	α-helix	trans	-72.7	-43.3	175.7	-158.4	65.4	0	0	0	112.2	L496 Y497 D498 N503 C504	L496-W500 PolarHBondContact O-N 3.34Å; Y497-W500 WeakPolarHBondContact O-CB 3.39Å; Y497-W500 PolarHBondContact O-N 3.05Å; Y497-W500 VanDerWaalsContact O-N 3.1Å; D498-W500 PolarHBondContact O-N 3.38Å; W500-N503 PolarHBondContact O-N 2.82Å; W500-C504 PolarHBondContact O-N 2.91Å; W500-C504 PolarHBondContact O-SG 2.92Å; W500-C504 VanDerWaalsContact O-SG 3.34Å
501	N	34.7	Very low	35.8	Very low	64 Å²	64	85.6 Å²	85.6	34%	0.342	46%	0.455	S	S	.	.	H	α-helix	trans	-64.3	-47.2	-179.5	-127.9	16.1	0	0	0	112.1	Y497 D498 N503 C504 H505	Y497-N501 PolarHBondContact O-N 3.03Å; D498-N501 PolarHBondContact O-N 3.43Å; N501-N503 PolarHBondContact O-N 2.8Å; N501-C504 PolarHBondContact O-N 3.07Å; N501-H505 PolarHBondContact O-CD2 2.92Å; N501-H505 PolarHBondContact O-N 2.96Å; N501-H505 VanDerWaalsContact O-N 3.12Å
502	N	33.1	Very low	34.5	Very low	83 Å²	83	90.2 Å²	90.2	44%	0.444	47%	0.474	S	S	.	.	H	α-helix	trans	-65.4	-22.9	-178.5	-75.2	-70.7	0	0	0	113.5	D498	D498-N502 WeakPolarHBondContact O-CB 3.37Å; D498-N502 PolarHBondContact O-N 2.98Å; D498-N502 PolarHBondContact O-ND2 3.07Å
503	N	32.1	Very low	33.1	Very low	85 Å²	85	93.7 Å²	93.7	46%	0.455	50%	0.499	S	S	.	.	H	α-helix	trans	-85.4	-13.3	172.5	-78	-73.3	0	0	0	113.5	F499 W500 N501	F499-N503 WeakPolarHBondContact CZ-ND2 3.37Å; F499-N503 PolarHBondContact O-ND2 3.23Å; W500-N503 PolarHBondContact O-N 2.82Å; N501-N503 PolarHBondContact O-N 2.8Å
504	C	28.5	Very low	32	Very low	58 Å²	58	101.7 Å²	101.7	39%	0.392	53%	0.531	S	S	.	.	H	α-helix	trans	-97.3	-16.8	177.3	-69.8	0	0	0	0	113.3	W500 N501 A506	W500-C504 PolarHBondContact O-N 2.91Å; W500-C504 PolarHBondContact O-SG 2.92Å; W500-C504 VanDerWaalsContact O-SG 3.34Å; N501-C504 PolarHBondContact O-N 3.07Å; C504-A506 PolarHBondContact O-N 3.04Å
505	H	26.9	Very low	31	Very low	125 Å²	125	109.3 Å²	109.3	58%	0.579	56%	0.556	S	S	*	*			trans	-81.8	94	179.6	-73.6	-54.4	0	0	0	112.9	N501	N501-H505 PolarHBondContact O-CD2 2.92Å; N501-H505 PolarHBondContact O-N 2.96Å; N501-H505 VanDerWaalsContact O-N 3.12Å
506	A	24.7	Very low	29.8	Very low	51 Å²	51	116.1 Å²	116.1	42%	0.421	59%	0.592	S	S	.	*			trans	-56.1	142.5	156.8	0	0	0	0	0	110.1	C504 F508	C504-A506 PolarHBondContact O-N 3.04Å; A506-F508 PolarHBondContact O-N 2.9Å
507	P	23	Very low	28.6	Very low	112 Å²	112	119.5 Å²	119.5	73%	0.727	62%	0.619	S	S	*	*			trans	-74.3	85	-171.6	29.8	-36	0	0	0	112.1	Y509	P507-Y509 PolarHBondContact O-N 3.1Å
508	F	26.4	Very low	27.8	Very low	197 Å²	197	125 Å²	125	86%	0.864	64%	0.64	S	S	*	*			trans	-70.7	90.4	169.2	-90.5	-85	0	0	0	110.6	A506	A506-F508 PolarHBondContact O-N 2.9Å
509	Y	22.9	Very low	27	Very low	201 Å²	201	126.2 Å²	126.2	79%	0.788	65%	0.651	S	S	*	*			trans	-54.2	142.2	158.7	-86.8	-96.8	0	0	0	110	P507 A511	P507-Y509 PolarHBondContact O-N 3.1Å; Y509-A511 VanDerWaalsContact C-N 3.28Å; Y509-A511 PolarHBondContact O-N 2.94Å
510	P	24.3	Very low	26	Very low	127 Å²	127	130.7 Å²	130.7	83%	0.825	68%	0.676	S	S	*	*			trans	-74.8	77.5	-177.9	31	-35.8	0	0	0	111.6
511	A	23.9	Very low	25.2	Very low	91 Å²	91	133.3 Å²	133.3	75%	0.752	69%	0.687	S	S	*	*			trans	-95	106.9	174.1	0	0	0	0	0	110.4	Y509	Y509-A511 VanDerWaalsContact C-N 3.28Å; Y509-A511 PolarHBondContact O-N 2.94Å
512	H	23.1	Very low	24.6	Very low	175 Å²	175	135.9 Å²	135.9	81%	0.81	71%	0.708	S	S	*	*			trans	-22.2	124.5	178.5	-78.3	-91.3	0	0	0	118.2
513	S	22.7	Very low	24.1	Very low	82 Å²	82	138.1 Å²	138.1	57%	0.573	72%	0.724	S	S	*	*			trans	9.7	114.7	134.8	57.7	0	0	0	0	117.7
514	F	22.4	Very low	23.7	Very low	196 Å²	196	138.9 Å²	138.9	86%	0.86	74%	0.735	S	S	*	*				171.1	92.7	122.6	-92.3	-62.7	0	0	0	110.8
515	F	25.9	Very low	23.5	Very low	208 Å²	208	147.8 Å²	147.8	91%	0.912	76%	0.76	S	S	*	*			trans	-175.7	117.8	137.8	-104.9	-66	0	0	0	110.4
516	N	22.9	Very low	23.3	Very low	162 Å²	162	150.5 Å²	150.5	87%	0.866	77%	0.773	S	S	*	*			trans	-87.6	117.9	176.1	-82.8	-19.7	0	0	0	110.8
517	S	23.3	Very low	23.4	Very low	100 Å²	100	155.7 Å²	155.7	70%	0.699	79%	0.793	S	S	*	*			trans	-162.6	105.3	159.5	-69.1	0	0	0	0	112	V519	S517-V519 PolarHBondContact O-N 2.94Å
518	Y	23.4	Very low	23.5	Very low	230 Å²	230	155.3 Å²	155.3	90%	0.902	79%	0.793	S	S	*	*			trans	41.8	70.1	152	-57.5	-75.6	0	0	0	119.4
519	V	23.5	Very low	23.5	Very low	114 Å²	114	157.4 Å²	157.4	69%	0.691	80%	0.796	S	S	*	*			trans	-113.4	124.2	140.1	176.7	0	0	0	0	107.2	S517 Y521	S517-V519 PolarHBondContact O-N 2.94Å; V519-Y521 HydrophobicContact CG1-CD2 4.42Å; V519-Y521 HydrophobicContact CG1-CE2 4.45Å; V519-Y521 PolarHBondContact O-N 3.36Å
520	I	21.3	Very low	23.6	Very low	165 Å²	165	155.3 Å²	155.3	85%	0.846	80%	0.795	S	S	*	*			trans	-77.4	92.3	176.1	-58.5	177.1	0	0	0	107.9
521	Y	21.3	Very low	23.6	Very low	173 Å²	173	156.6 Å²	156.6	68%	0.678	79%	0.79	S	S	*	*			trans	-64.8	146.1	159.2	-80.2	-97.4	0	0	0	109.3	V519 T523	V519-Y521 HydrophobicContact CG1-CD2 4.42Å; V519-Y521 HydrophobicContact CG1-CE2 4.45Å; V519-Y521 PolarHBondContact O-N 3.36Å; Y521-T523 PolarHBondContact O-N 3.21Å
522	P	22	Very low	23.7	Very low	119 Å²	119	162 Å²	162	77%	0.773	80%	0.799	S	S	*	*			trans	-70	81.2	158.5	31.2	-32.4	0	0	0	108.5	C524	P522-C524 PolarHBondContact O-N 3.3Å
523	T	21.8	Very low	23.7	Very low	129 Å²	129	158.6 Å²	158.6	79%	0.791	80%	0.795	S	S	*	*			trans	-73.6	74.3	175.7	52	0	0	0	0	110.5	Y521	Y521-T523 PolarHBondContact O-N 3.21Å
524	C	22.7	Very low	23.9	Very low	101 Å²	101	160.4 Å²	160.4	68%	0.682	80%	0.803	S	S	*	*			trans	-136.9	151.7	166.1	-68.2	0	0	0	0	106.4	P522	P522-C524 PolarHBondContact O-N 3.3Å
525	W	24.8	Very low	24.1	Very low	245 Å²	245	157.3 Å²	157.3	93%	0.928	80%	0.8	S	S	*	*			trans	67.5	45.2	-172.4	-55.9	73.7	0	0	0	114.2	L527	W525-L527 PolarHBondContact O-N 2.77Å
526	E	23.9	Very low	24	Very low	182 Å²	182	153 Å²	153	85%	0.85	79%	0.79	S	S	*	*			trans	-60.5	110.9	149.3	-177.3	168	-136.8	0	0	108.1	S528	E526-S528 VanDerWaalsContact C-N 3.26Å; E526-S528 PolarHBondContact O-N 2.7Å
527	L	26.2	Very low	24	Very low	161 Å²	161	155.6 Å²	155.6	84%	0.843	79%	0.788	S	S	*	*			trans	-79.6	69.1	-170.8	-166.7	78.3	0	0	0	111.7	W525 R529	W525-L527 PolarHBondContact O-N 2.77Å; L527-R529 PolarHBondContact O-N 3.32Å
528	S	25.2	Very low	24.1	Very low	104 Å²	104	155.3 Å²	155.3	73%	0.727	79%	0.786	S	S	*	*			trans	-67.9	126.2	167.7	49	0	0	0	0	109.9	E526 M530	E526-S528 VanDerWaalsContact C-N 3.26Å; E526-S528 PolarHBondContact O-N 2.7Å; S528-M530 PolarHBondContact O-N 3.23Å
529	R	25.9	Very low	24	Very low	241 Å²	241	149.7 Å²	149.7	91%	0.909	78%	0.78	S	S	*	*			trans	-63	114.7	-179.3	-65.8	172.2	174.3	171.1	-4.4	110.7	L527	L527-R529 PolarHBondContact O-N 3.32Å
530	M	24.9	Very low	24.1	Very low	156 Å²	156	148.6 Å²	148.6	77%	0.768	78%	0.778	S	S	*	*			trans	-146.5	132.1	145.9	-76.5	-144.6	90.5	0	0	112.4	S528	S528-M530 PolarHBondContact O-N 3.23Å
531	E	24.5	Very low	24.3	Very low	155 Å²	155	150.3 Å²	150.3	72%	0.724	78%	0.779	S	S	*	*			trans	57.7	122.4	148.6	-65.1	177.7	153.8	0	0	121.9	S533	E531-S533 PolarHBondContact O-N 3.3Å
532	E	25.6	Very low	24.5	Very low	204 Å²	204	147.2 Å²	147.2	95%	0.953	78%	0.779	S	S	*	*			trans	-61.5	106.6	164.4	-61.6	167.8	103.5	0	0	110.3
533	S	23.8	Very low	24.5	Very low	103 Å²	103	147 Å²	147	72%	0.72	78%	0.78	S	S	*	*			trans	-137.6	109.9	172.1	50.9	0	0	0	0	113	E531	E531-S533 PolarHBondContact O-N 3.3Å
534	V	26.3	Very low	24.7	Very low	120 Å²	120	147.1 Å²	147.1	73%	0.727	79%	0.785	S	S	*	*			trans	49.9	94.1	160.6	-164.9	0	0	0	0	117	T536	V534-T536 HydrophobicContact CG1-CG2 4.01Å; V534-T536 PolarHBondContact O-N 3.07Å
535	V	26.3	Very low	24.7	Very low	132 Å²	132	148 Å²	148	80%	0.8	79%	0.787	S	S	*	*			trans	-66.3	95.4	154.9	179.9	0	0	0	0	109.1	R537	V535-R537 VanDerWaalsContact C-N 3.27Å; V535-R537 HydrophobicContact CG1-CG 4.19Å; V535-R537 PolarHBondContact O-N 2.97Å
536	T	24	Very low	24.8	Very low	116 Å²	116	144.5 Å²	144.5	71%	0.712	79%	0.786	S	S	*	*			trans	-69.9	82.7	169	28.1	0	0	0	0	110.3	V534 S538	V534-T536 HydrophobicContact CG1-CG2 4.01Å; V534-T536 PolarHBondContact O-N 3.07Å; T536-S538 PolarHBondContact O-N 2.87Å
537	R	23.6	Very low	24.8	Very low	217 Å²	217	142.1 Å²	142.1	82%	0.819	78%	0.783	S	S	*	*			trans	-54.2	108.8	172.4	-72.4	178.7	167.2	170.6	-4	110.8	V535 S539	V535-R537 VanDerWaalsContact C-N 3.27Å; V535-R537 HydrophobicContact CG1-CG 4.19Å; V535-R537 PolarHBondContact O-N 2.97Å; R537-S539 PolarHBondContact O-N 2.88Å
538	S	24.4	Very low	24.7	Very low	94 Å²	94	141.6 Å²	141.6	66%	0.657	78%	0.782	S	S	*	*			trans	-75	68.3	172.4	-66	0	0	0	0	111.8	T536 S540	T536-S538 PolarHBondContact O-N 2.87Å; S538-S540 PolarHBondContact O-N 2.82Å
539	S	22.9	Very low	24.7	Very low	112 Å²	112	141.4 Å²	141.4	78%	0.783	78%	0.78	S	S	*	*			trans	-74.7	83.9	177	59.1	0	0	0	0	111.4	R537	R537-S539 PolarHBondContact O-N 2.88Å
540	S	24.5	Very low	24.6	Very low	91 Å²	91	140.8 Å²	140.8	64%	0.636	78%	0.778	S	S	*	*			trans	-144.8	42.3	-178.4	57.2	0	0	0	0	115	S538	S538-S540 PolarHBondContact O-N 2.82Å
541	F	25.8	Very low	24.7	Very low	201 Å²	201	145.4 Å²	145.4	88%	0.882	79%	0.786	S	S	*	*			trans	-124.3	52.5	164.6	-90.2	-75.6	0	0	0	112.5
542	T	24.8	Very low	24.7	Very low	108 Å²	108	143.3 Å²	143.3	66%	0.663	79%	0.789	S	S	*	*	S	Bend	trans	-133.3	136.4	162.2	48.6	0	0	0	0	109.5	C544	T542-C544 PolarHBondContact O-N 3.29Å
543	S	23	Very low	24.7	Very low	115 Å²	115	139.9 Å²	139.9	80%	0.804	78%	0.782	S	S	*	*			trans	-69.5	111.9	-168	-51.2	0	0	0	0	113.1	T545	S543-T545 VanDerWaalsContact C-N 3.3Å; S543-T545 PolarHBondContact O-N 2.91Å
544	C	25	Very low	24.8	Very low	132 Å²	132	141 Å²	141	89%	0.892	78%	0.784	S	S	*	*			trans	-78.8	69.9	178.3	-69.4	0	0	0	0	113.6	T542	T542-C544 PolarHBondContact O-N 3.29Å
545	T	22.8	Very low	25	Very low	120 Å²	120	141.4 Å²	141.4	74%	0.736	79%	0.789	S	S	*	*			trans	-117.4	133.8	148.9	44.7	0	0	0	0	108.4	S543	S543-T545 VanDerWaalsContact C-N 3.3Å; S543-T545 PolarHBondContact O-N 2.91Å
546	L	27.5	Very low	25	Very low	171 Å²	171	138.3 Å²	138.3	90%	0.895	78%	0.784	S	S	*	*	S	Bend	trans	75.2	73.3	-174.6	-49.5	-177.8	0	0	0	116
547	V	25	Very low	25	Very low	132 Å²	132	141.6 Å²	141.6	80%	0.8	79%	0.792	S	S	*	*			trans	-0.5	124.6	136.7	-177.3	0	0	0	0	117
548	D	23.9	Very low	25.1	Very low	150 Å²	150	138 Å²	138	80%	0.802	79%	0.789	S	S	*	*				-142.6	141.1	124.8	-161.7	-4	0	0	0	110
549	S	24.5	Very low	25.2	Very low	99 Å²	99	145 Å²	145	69%	0.692	80%	0.802	S	S	*	*			trans	-126.3	61.6	-166	-66.9	0	0	0	0	112.1
550	R	24	Very low	25.2	Very low	228 Å²	228	148.4 Å²	148.4	86%	0.86	81%	0.806	S	S	*	*			trans	-157.9	87.9	168.7	-92.7	128	-169.9	-116.9	5.7	113.3
551	R	26.2	Very low	25.3	Very low	253 Å²	253	154.6 Å²	154.6	96%	0.955	82%	0.815	S	S	*	*			trans	-177.5	84	141.3	-102.9	162.8	-171.4	-129.2	-0.5	111.4
552	S	24.8	Very low	25.3	Very low	112 Å²	112	152.4 Å²	152.4	78%	0.783	81%	0.813	S	S	*	*			trans	-104.2	128.1	157.2	178.5	0	0	0	0	108.1
553	T	26.6	Very low	25.3	Very low	132 Å²	132	158.3 Å²	158.3	81%	0.81	82%	0.824	S	S	*	*			trans	-148.9	83.7	167.6	50.1	0	0	0	0	108.8
554	V	25.4	Very low	25.3	Very low	126 Å²	126	161.5 Å²	161.5	76%	0.764	83%	0.827	S	S	*	*			trans	-102.9	120.8	157.5	176.3	0	0	0	0	106.1
555	P	31.1	Very low	25.4	Very low	128 Å²	128	164.1 Å²	164.1	83%	0.831	83%	0.828	S	S	*	*			trans	-74.8	125.9	161.1	31.5	-28.6	0	0	0	107.6
556	G	24.4	Very low	25.5	Very low	67 Å²	67	166.4 Å²	166.4	69%	0.691	84%	0.835	S	S	*	*			trans	-132.2	147.9	170.9	0	0	0	0	0	108.9
557	E	24.8	Very low	25.5	Very low	186 Å²	186	164.6 Å²	164.6	87%	0.869	83%	0.825	S	S	*	*			trans	-148.8	138.9	167.5	-112.1	156.2	-144.2	0	0	108.6
558	D	25	Very low	25.4	Very low	142 Å²	142	165.8 Å²	165.8	76%	0.759	83%	0.827	S	S	*	*			trans	41.6	108.5	159.8	-57.3	-10.8	0	0	0	121
559	Y	27.5	Very low	25.5	Very low	239 Å²	239	164 Å²	164	94%	0.937	83%	0.825	S	S	*	*				-154	118.5	111.5	-113.9	-74	0	0	0	111.9
560	E	23.3	Very low	25.5	Very low	184 Å²	184	170.7 Å²	170.7	86%	0.86	84%	0.835	S	S	*	*			trans	-78.1	172.2	169.6	-78.3	-161.7	119.5	0	0	112.6
561	R	25.8	Very low	25.5	Very low	222 Å²	222	169.1 Å²	169.1	84%	0.838	84%	0.837	S	S	*	*			trans	85.5	81.8	158.6	-163.7	-170.8	-63.3	-158.5	-1.3	117.8
562	N	25.2	Very low	25.4	Very low	154 Å²	154	161.4 Å²	161.4	82%	0.824	82%	0.822	S	S	*	*				-165.1	49.1	124.9	-99.3	-28	0	0	0	114	Q564	N562-Q564 VanDerWaalsContact C-N 3.29Å; N562-Q564 PolarHBondContact O-N 3.34Å
563	Y	24.7	Very low	25.4	Very low	232 Å²	232	165.8 Å²	165.8	91%	0.91	83%	0.827	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	63.9	179.5	-110	-81	0	0	0	113.3
564	Q	24.9	Very low	25.3	Very low	182 Å²	182	164.4 Å²	164.4	85%	0.85	82%	0.82	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.8	10.1	-179	-120.8	158.5	28.6	0	0	119.1	N562	N562-Q564 VanDerWaalsContact C-N 3.29Å; N562-Q564 PolarHBondContact O-N 3.34Å
565	M	25.8	Very low	25.4	Very low	187 Å²	187	166.4 Å²	166.4	92%	0.921	83%	0.826	S	S	*	*	S	Bend	trans	-117.8	9.8	175	-85.3	-161.8	70.8	0	0	116.3
566	L	26.2	Very low	25.1	Very low	168 Å²	168	166.5 Å²	166.5	88%	0.88	82%	0.819	S	S	*	*	S	Bend	trans	-111.5	25.9	-170.7	-95.7	167.6	0	0	0	116.2
567	I	26.2	Very low	25.2	Very low	134 Å²	134	167.6 Å²	167.6	69%	0.687	83%	0.83	S	S	*	*	S	Bend	trans	-109.3	-23.1	-174.2	-65.8	179.8	0	0	0	114.1	C569	I567-C569 PolarHBondContact O-N 3.26Å
568	N	24.2	Very low	25.1	Very low	157 Å²	157	162.9 Å²	162.9	84%	0.84	82%	0.818	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	38.7	-170.5	-72.6	4.3	0	0	0	115.3
569	C	25.8	Very low	25.5	Very low	113 Å²	113	159.1 Å²	159.1	76%	0.764	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.5	22.8	171.7	-77.9	0	0	0	0	113.4	I567 E571	I567-C569 PolarHBondContact O-N 3.26Å; C569-E571 PolarHBondContact O-N 2.71Å
570	R	23.8	Very low	25.8	Very low	238 Å²	238	151.8 Å²	151.8	90%	0.898	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	42.3	-175.9	-116.8	-172.8	-179.4	-168.7	0.5	114.7
571	E	24.6	Very low	26.3	Very low	196 Å²	196	145.7 Å²	145.7	92%	0.916	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-150.5	12.3	172.7	-132.7	160.9	-132	0	0	116.8	C569	C569-E571 PolarHBondContact O-N 2.71Å
572	S	24.4	Very low	26.6	Very low	90 Å²	90	138 Å²	138	63%	0.629	73%	0.734	S	S	*	*	S	Bend	trans	-116.3	138.9	160.9	64.9	0	0	0	0	109.9	P574	S572-P574 VanDerWaalsContact O-CD 3.25Å; S572-P574 WeakPolarHBondContact O-CD 3.24Å
573	K	23.7	Very low	27	Very low	204 Å²	204	135.8 Å²	135.8	89%	0.887	72%	0.715	S	S	*	*			trans	-73.6	115.6	176.2	-72.2	179.6	179	175.8	0	108.6	L575	K573-L575 PolarHBondContact O-N 2.86Å
574	P	25.2	Very low	27.5	Very low	103 Å²	103	125.7 Å²	125.7	67%	0.669	68%	0.677	S	S	*	*			trans	-67.6	122.8	169.6	28.8	-32.6	0	0	0	108.6	S572 N576	S572-P574 VanDerWaalsContact O-CD 3.25Å; S572-P574 WeakPolarHBondContact O-CD 3.24Å; P574-N576 PolarHBondContact O-N 3.43Å
575	L	26.8	Very low	27.9	Very low	168 Å²	168	120.3 Å²	120.3	88%	0.88	65%	0.653	S	S	*	*			trans	-73.6	94.8	168.9	-100.6	162	0	0	0	108.1	K573 G577	K573-L575 PolarHBondContact O-N 2.86Å; L575-G577 PolarHBondContact O-N 3.17Å
576	N	25.6	Very low	28.3	Very low	130 Å²	130	114.5 Å²	114.5	70%	0.695	63%	0.631	S	S	*	*			trans	-55.9	122.6	-174.9	-78.3	-21.4	0	0	0	112.6	P574 S578	P574-N576 PolarHBondContact O-N 3.43Å; N576-S578 VanDerWaalsContact C-N 3.27Å; N576-S578 WeakPolarHBondContact O-CB 3.4Å; N576-S578 PolarHBondContact O-N 3.21Å; N576-S578 PolarHBondContact O-OG 3.5Å
577	G	25	Very low	28.5	Very low	90 Å²	90	107.3 Å²	107.3	93%	0.928	60%	0.595	S	S	*	*	S	Bend	trans	49.8	34.2	141	0	0	0	0	0	117.5	L575	L575-G577 PolarHBondContact O-N 3.17Å
578	S	23.4	Very low	28.9	Very low	87 Å²	87	101.1 Å²	101.1	61%	0.608	56%	0.564	S	S	*	*			trans	-128.9	100.8	-173.2	36.3	0	0	0	0	113.2	N576	N576-S578 VanDerWaalsContact C-N 3.27Å; N576-S578 WeakPolarHBondContact O-CB 3.4Å; N576-S578 PolarHBondContact O-N 3.21Å; N576-S578 PolarHBondContact O-OG 3.5Å
579	C	34.2	Very low	29.1	Very low	63 Å²	63	102.9 Å²	102.9	43%	0.426	56%	0.56	S	S	.	*			trans	75.3	80.9	139.8	-143.5	0	0	0	0	117.3	V581 S582 Y583	C579-V581 PolarHBondContact O-N 2.92Å; C579-S582 VanDerWaalsContact CB-OG 3.3Å; C579-S582 WeakPolarHBondContact CB-OG 3.47Å; C579-S582 WeakPolarHBondContact O-CA 3.23Å; C579-S582 WeakPolarHBondContact O-CB 2.99Å; C579-S582 PolarHBondContact O-N 2.93Å; C579-S582 PolarHBondContact SG-N 2.87Å; C579-S582 PolarHBondContact SG-OG 3.49Å; C579-Y583 PolarHBondContact O-N 3.18Å
580	L	33.8	Very low	29.1	Very low	86 Å²	86	104.5 Å²	104.5	45%	0.45	56%	0.558	S	S	.	*	H	α-helix	trans	-55.8	-29.7	157.1	-170.4	66.3	0	0	0	111.6	V489 C493 S582 Y583 L584	V489-L580 HydrophobicContact CG1-CD2 4.46Å; C493-L580 HydrophobicContact CB-CD2 4.12Å; C493-L580 VanDerWaalsContact SG-CD2 3.53Å; L580-S582 VanDerWaalsContact C-N 3.33Å; L580-S582 PolarHBondContact O-N 2.85Å; L580-Y583 HydrophobicContact CD1-CD1 4.5Å; L580-Y583 WeakPolarHBondContact O-CB 3.48Å; L580-Y583 PolarHBondContact O-N 3.5Å; L580-Y583 VanDerWaalsContact O-N 3.13Å; L580-L584 PolarHBondContact O-N 3.27Å
581	V	32.2	Very low	29.2	Very low	55 Å²	55	94 Å²	94	33%	0.333	52%	0.524	S	S	.	.	H	α-helix	trans	-62.6	-36.2	169.1	178.1	0	0	0	0	111.5	V489 C579 Y583 L584 L585	V489-V581 HydrophobicContact CB-CG2 4.35Å; V489-V581 HydrophobicContact CG1-CG2 3.71Å; V489-V581 HydrophobicContact CG2-CG2 3.81Å; C579-V581 PolarHBondContact O-N 2.92Å; V581-Y583 VanDerWaalsContact C-N 3.33Å; V581-L584 PolarHBondContact O-N 3.44Å; V581-L585 HydrophobicContact CG1-CD1 3.82Å; V581-L585 HydrophobicContact CG1-CG 4.17Å; V581-L585 WeakPolarHBondContact O-CB 3.36Å; V581-L585 WeakPolarHBondContact O-CG 3.45Å; V581-L585 PolarHBondContact O-N 3.3Å
582	S	32.1	Very low	29.4	Very low	60 Å²	60	87.5 Å²	87.5	42%	0.42	50%	0.498	S	S	.	.	H	α-helix	trans	-69.7	-28.4	171.9	-66.1	0	0	0	0	112.5	C579 L580 S586	C579-S582 VanDerWaalsContact CB-OG 3.3Å; C579-S582 WeakPolarHBondContact CB-OG 3.47Å; C579-S582 WeakPolarHBondContact O-CA 3.23Å; C579-S582 WeakPolarHBondContact O-CB 2.99Å; C579-S582 PolarHBondContact O-N 2.93Å; C579-S582 PolarHBondContact SG-N 2.87Å; C579-S582 PolarHBondContact SG-OG 3.49Å; L580-S582 VanDerWaalsContact C-N 3.33Å; L580-S582 PolarHBondContact O-N 2.85Å; S582-S586 VanDerWaalsContact O-CB 3.23Å; S582-S586 WeakPolarHBondContact O-CB 3.21Å; S582-S586 PolarHBondContact O-N 2.92Å; S582-S586 PolarHBondContact O-OG 2.74Å
583	Y	34.4	Very low	29.6	Very low	108 Å²	108	84.9 Å²	84.9	42%	0.424	48%	0.479	S	S	.	.	H	α-helix	trans	-68.6	-49.2	171	179.6	-101.4	0	0	0	111.1	C579 L580 V581 L585 S586 C587 L595	C579-Y583 PolarHBondContact O-N 3.18Å; L580-Y583 HydrophobicContact CD1-CD1 4.5Å; L580-Y583 WeakPolarHBondContact O-CB 3.48Å; L580-Y583 PolarHBondContact O-N 3.5Å; L580-Y583 VanDerWaalsContact O-N 3.13Å; V581-Y583 VanDerWaalsContact C-N 3.33Å; Y583-L585 PolarHBondContact O-N 2.86Å; Y583-S586 WeakPolarHBondContact O-CA 3.38Å; Y583-S586 WeakPolarHBondContact O-CB 3.3Å; Y583-S586 PolarHBondContact O-N 3.16Å; Y583-C587 PolarHBondContact O-N 2.73Å; Y583-C587 PolarHBondContact O-SG 2.89Å; Y583-L595 HydrophobicContact CE1-CD2 4.14Å
584	L	34.8	Very low	29.8	Very low	20 Å²	20	79.7 Å²	79.7	11%	0.105	46%	0.457	C	S	.	.	H	α-helix	trans	-59.1	-44	173.6	-69.1	176.6	0	0	0	112.1	T471 V489 L580 V581 S586 C587 S588	T471-L584 HydrophobicContact CG2-CD2 4.18Å; V489-L584 HydrophobicContact CG1-CD1 4.28Å; L580-L584 PolarHBondContact O-N 3.27Å; V581-L584 PolarHBondContact O-N 3.44Å; L584-S586 VanDerWaalsContact C-N 3.27Å; L584-S586 PolarHBondContact O-N 3.18Å; L584-C587 PolarHBondContact O-N 2.72Å; L584-S588 WeakPolarHBondContact O-CB 3.43Å; L584-S588 PolarHBondContact O-N 3.4Å
585	L	34.8	Very low	29.9	Very low	69 Å²	69	77.1 Å²	77.1	36%	0.361	44%	0.437	S	S	.	.	H	α-helix	trans	-65.8	-27.5	174.1	-73	172.5	0	0	0	112.2	A465 V581 Y583 S588 Y589	A465-L585 HydrophobicContact CB-CD2 4.36Å; V581-L585 HydrophobicContact CG1-CD1 3.82Å; V581-L585 HydrophobicContact CG1-CG 4.17Å; V581-L585 WeakPolarHBondContact O-CB 3.36Å; V581-L585 WeakPolarHBondContact O-CG 3.45Å; V581-L585 PolarHBondContact O-N 3.3Å; Y583-L585 PolarHBondContact O-N 2.86Å; L585-S588 WeakPolarHBondContact O-CB 3.38Å; L585-Y589 WeakPolarHBondContact O-CB 3.2Å; L585-Y589 PolarHBondContact O-N 2.81Å
586	S	32.5	Very low	29.9	Very low	65 Å²	65	70.9 Å²	70.9	46%	0.455	41%	0.41	S	S	.	.	H	α-helix	trans	-73.8	-44.2	172.7	-63.5	0	0	0	0	111.7	S582 Y583 L584 S588 Y589 M590	S582-S586 VanDerWaalsContact O-CB 3.23Å; S582-S586 WeakPolarHBondContact O-CB 3.21Å; S582-S586 PolarHBondContact O-N 2.92Å; S582-S586 PolarHBondContact O-OG 2.74Å; Y583-S586 WeakPolarHBondContact O-CA 3.38Å; Y583-S586 WeakPolarHBondContact O-CB 3.3Å; Y583-S586 PolarHBondContact O-N 3.16Å; L584-S586 VanDerWaalsContact C-N 3.27Å; L584-S586 PolarHBondContact O-N 3.18Å; S586-S588 VanDerWaalsContact C-N 3.3Å; S586-S588 PolarHBondContact O-N 3.43Å; S586-Y589 PolarHBondContact O-N 3.23Å; S586-M590 VanDerWaalsContact O-CB 3.28Å; S586-M590 WeakPolarHBondContact O-CB 3.42Å; S586-M590 WeakPolarHBondContact O-CG 3.46Å; S586-M590 PolarHBondContact O-N 2.68Å
587	C	31.9	Very low	29.9	Very low	17 Å²	17	68.6 Å²	68.6	12%	0.115	40%	0.404	C	S	.	.	H	α-helix	trans	-62.2	-39.1	172.7	-61.8	0	0	0	0	111.8	Y583 L584 G591 T592	Y583-C587 PolarHBondContact O-N 2.73Å; Y583-C587 PolarHBondContact O-SG 2.89Å; L584-C587 PolarHBondContact O-N 2.72Å; C587-G591 PolarHBondContact O-N 3.34Å; C587-G591 VanDerWaalsContact O-N 3.11Å; C587-T592 PolarHBondContact O-N 3.33Å
588	S	33	Very low	29.9	Very low	5 Å²	5	71.2 Å²	71.2	4%	0.035	39%	0.392	C	S	.	.	H	α-helix	trans	-56.2	-55.1	170.2	171.1	0	0	0	0	112	S466 G467 C472 L584 L585 S586 G591	S466-S588 PolarHBondContact O-OG 3.16Å; G467-S588 VanDerWaalsContact CA-O 3.3Å; G467-S588 WeakPolarHBondContact CA-O 3.29Å; G467-S588 WeakPolarHBondContact CA-OG 3.43Å; G467-S588 PolarHBondContact N-OG 3.26Å; C472-S588 WeakPolarHBondContact SG-CB 3.39Å; C472-S588 PolarHBondContact SG-OG 3.33Å; L584-S588 WeakPolarHBondContact O-CB 3.43Å; L584-S588 PolarHBondContact O-N 3.4Å; L585-S588 WeakPolarHBondContact O-CB 3.38Å; S586-S588 VanDerWaalsContact C-N 3.3Å; S586-S588 PolarHBondContact O-N 3.43Å; S588-G591 PolarHBondContact O-N 3.35Å; S588-G591 VanDerWaalsContact O-N 3.13Å
589	Y	29	Very low	30	Very low	194 Å²	194	72.8 Å²	72.8	76%	0.761	40%	0.4	S	S	*	.	H	α-helix	trans	-67.3	-36.8	-178.4	-174.9	-96.5	0	0	0	112.9	L585 S586 G591	L585-Y589 WeakPolarHBondContact O-CB 3.2Å; L585-Y589 PolarHBondContact O-N 2.81Å; S586-Y589 PolarHBondContact O-N 3.23Å; Y589-G591 PolarHBondContact O-N 2.93Å
590	M	26.8	Very low	29.5	Very low	146 Å²	146	75.9 Å²	75.9	72%	0.719	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-7.5	173.8	-65.3	-124.5	141.1	0	0	113.4	S586 T592	S586-M590 VanDerWaalsContact O-CB 3.28Å; S586-M590 WeakPolarHBondContact O-CB 3.42Å; S586-M590 WeakPolarHBondContact O-CG 3.46Å; S586-M590 PolarHBondContact O-N 2.68Å; M590-T592 HydrophobicContact CB-CG2 4.02Å; M590-T592 PolarHBondContact O-N 3.14Å; M590-T592 VanDerWaalsContact O-N 3.09Å
591	G	26.1	Very low	29.1	Very low	19 Å²	19	81.3 Å²	81.3	20%	0.196	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.7	15.1	177.2	0	0	0	0	0	115.1	C587 S588 Y589 R654	C587-G591 PolarHBondContact O-N 3.34Å; C587-G591 VanDerWaalsContact O-N 3.11Å; S588-G591 PolarHBondContact O-N 3.35Å; S588-G591 VanDerWaalsContact O-N 3.13Å; Y589-G591 PolarHBondContact O-N 2.93Å; G591-R654 PolarHBondContact O-NH2 2.75Å
592	T	27.4	Very low	28.7	Very low	59 Å²	59	86 Å²	86	36%	0.362	45%	0.45	S	S	.	.			trans	-68.9	138.3	-171.4	52.5	0	0	0	0	111.3	C587 M590 F594	C587-T592 PolarHBondContact O-N 3.33Å; M590-T592 HydrophobicContact CB-CG2 4.02Å; M590-T592 PolarHBondContact O-N 3.14Å; M590-T592 VanDerWaalsContact O-N 3.09Å; T592-F594 PolarHBondContact O-N 3.48Å
593	S	29.4	Very low	28.4	Very low	34 Å²	34	90.7 Å²	90.7	24%	0.238	47%	0.469	C	S	.	.	S	Bend	trans	-79.9	2.5	173.1	56.3	0	0	0	0	113.7	W653	S593-W653 PolarHBondContact O-NE1 3.25Å
594	F	26.6	Very low	27.9	Very low	96 Å²	96	91.8 Å²	91.8	42%	0.421	48%	0.483	S	S	.	.			trans	-123.4	113.7	-170.5	-79.7	-84.6	0	0	0	111.6	T592 A596 C619	T592-F594 PolarHBondContact O-N 3.48Å; F594-A596 HydrophobicContact CB-CB 3.9Å; F594-A596 HydrophobicContact CD1-CB 4.15Å; F594-A596 HydrophobicContact CG-CB 4.39Å; F594-A596 PolarHBondContact O-N 3.5Å; F594-A596 VanDerWaalsContact O-N 3.17Å; F594-C619 VanDerWaalsContact CE2-SG 3.52Å; F594-C619 WeakPolarHBondContact CZ-SG 3.46Å
595	L	28.7	Very low	27.5	Very low	49 Å²	49	97.9 Å²	97.9	26%	0.257	52%	0.515	S	S	.	.			trans	-78	57.1	144.3	-72.2	171.6	0	0	0	108.5	Y583 S597	Y583-L595 HydrophobicContact CE1-CD2 4.14Å; L595-S597 PolarHBondContact O-N 3.09Å
596	A	26.1	Very low	27.1	Very low	36 Å²	36	102 Å²	102	30%	0.298	54%	0.537	S	S	.	.			trans	-71.2	122	172.1	0	0	0	0	0	107.8	F594 H598	F594-A596 HydrophobicContact CB-CB 3.9Å; F594-A596 HydrophobicContact CD1-CB 4.15Å; F594-A596 HydrophobicContact CG-CB 4.39Å; F594-A596 PolarHBondContact O-N 3.5Å; F594-A596 VanDerWaalsContact O-N 3.17Å; A596-H598 PolarHBondContact O-N 2.84Å; A596-H598 PolarHBondContact O-ND1 2.78Å
597	S	25.3	Very low	26.7	Very low	82 Å²	82	104.3 Å²	104.3	57%	0.573	55%	0.553	S	S	*	*			trans	-53.8	103.9	169.9	42.6	0	0	0	0	109.2	L595 P599	L595-S597 PolarHBondContact O-N 3.09Å; S597-P599 WeakPolarHBondContact O-CD 3.49Å
598	H	24.7	Very low	26.3	Very low	146 Å²	146	108.7 Å²	108.7	68%	0.676	58%	0.584	S	S	*	*			trans	-72	119.1	169.9	-84.8	34.1	0	0	0	107.3	A596 I600	A596-H598 PolarHBondContact O-N 2.84Å; A596-H598 PolarHBondContact O-ND1 2.78Å; H598-I600 HydrophobicContact CB-CG1 4.17Å; H598-I600 PolarHBondContact O-N 3.25Å
599	P	26.2	Very low	26	Very low	120 Å²	120	114.4 Å²	114.4	78%	0.779	62%	0.621	S	S	*	*			trans	-71.4	79.5	164.3	31.8	-33.1	0	0	0	107.7	S597 Y601	S597-P599 WeakPolarHBondContact O-CD 3.49Å; P599-Y601 PolarHBondContact O-N 3.36Å
600	I	23.9	Very low	25.7	Very low	128 Å²	128	111 Å²	111	66%	0.656	62%	0.624	S	S	*	*			trans	-59.9	127.9	165.4	-52.4	-179.2	0	0	0	105.5	H598	H598-I600 HydrophobicContact CB-CG1 4.17Å; H598-I600 PolarHBondContact O-N 3.25Å
601	Y	24.5	Very low	25.5	Very low	200 Å²	200	110.1 Å²	110.1	78%	0.784	63%	0.631	S	S	*	*			trans	71.3	92.4	-167.2	-47.3	-74.5	0	0	0	115.8	P599	P599-Y601 PolarHBondContact O-N 3.36Å
602	N	25.3	Very low	25.4	Very low	154 Å²	154	116.3 Å²	116.3	82%	0.824	66%	0.659	S	S	*	*				-140.7	67	107.8	-156.4	-0.2	0	0	0	111.6
603	L	25.4	Very low	25.2	Very low	157 Å²	157	124.4 Å²	124.4	82%	0.822	68%	0.683	S	S	*	*			trans	-96.7	80.9	173.9	-168	88.2	0	0	0	109.5
604	N	23.8	Very low	25	Very low	132 Å²	132	127.9 Å²	127.9	71%	0.706	70%	0.698	S	S	*	*			trans	-171.4	132.7	158.3	-95.4	-31.3	0	0	0	110.9
605	N	25.5	Very low	24.8	Very low	147 Å²	147	129.3 Å²	129.3	79%	0.786	72%	0.717	S	S	*	*			trans	65.9	125.7	167.8	-55.4	-27.1	0	0	0	116.4
606	L	26.5	Very low	24.5	Very low	157 Å²	157	132.1 Å²	132.1	82%	0.822	74%	0.736	S	S	*	*			cis	-138.2	144.4	2.5	-68	93.5	0	0	0	113
607	S	24.1	Very low	24.4	Very low	113 Å²	113	136.2 Å²	136.2	79%	0.79	76%	0.763	S	S	*	*			trans	30	106.2	146.9	63.3	0	0	0	0	121.4
608	S	25.1	Very low	24.2	Very low	109 Å²	109	137.2 Å²	137.2	76%	0.762	77%	0.769	S	S	*	*				-161.5	134.9	125.7	-167.8	0	0	0	0	110.9	C610	S608-C610 PolarHBondContact O-N 2.83Å
609	P	25.2	Very low	24.1	Very low	124 Å²	124	132.8 Å²	132.8	81%	0.805	75%	0.753	S	S	*	*			trans	-87.4	99.2	-174.8	33.2	-33.3	0	0	0	112.7
610	C	24.1	Very low	23.8	Very low	123 Å²	123	136.9 Å²	136.9	83%	0.831	76%	0.755	S	S	*	*			trans	-140.1	73.4	169	-87.2	0	0	0	0	111.9	S608 L612	S608-C610 PolarHBondContact O-N 2.83Å; C610-L612 PolarHBondContact O-N 3.28Å
611	C	22.6	Very low	23.6	Very low	127 Å²	127	138.3 Å²	138.3	86%	0.858	76%	0.756	S	S	*	*			trans	-75.2	110.8	165.8	-60.4	0	0	0	0	109.7
612	L	23.3	Very low	23.5	Very low	150 Å²	150	134.4 Å²	134.4	79%	0.785	75%	0.753	S	S	*	*			trans	-179.6	110.2	154	-103	161.4	0	0	0	113.5	C610	C610-L612 PolarHBondContact O-N 3.28Å
613	R	23.7	Very low	23.3	Very low	229 Å²	229	135.3 Å²	135.3	86%	0.864	76%	0.755	S	S	*	*			trans	63.9	161	156.9	-67	174.3	170.4	179	-4.4	116.6
614	L	23.5	Very low	23.2	Very low	106 Å²	106	133.4 Å²	133.4	56%	0.555	75%	0.745	S	S	*	*			cis	-147.6	150.8	-0.8	-154.9	68.1	0	0	0	109.1	T616	L614-T616 PolarHBondContact O-N 2.68Å
615	P	23.8	Very low	23.1	Very low	126 Å²	126	138.2 Å²	138.2	82%	0.818	75%	0.754	S	S	*	*			trans	-89.4	89.3	-177.7	33.8	-35.2	0	0	0	114
616	T	22.2	Very low	23	Very low	109 Å²	109	135.4 Å²	135.4	67%	0.669	75%	0.751	S	S	*	*			trans	-141.9	79.9	174.4	53.9	0	0	0	0	113.4	L614 C618	L614-T616 PolarHBondContact O-N 2.68Å; T616-C618 PolarHBondContact O-N 2.6Å
617	S	24.3	Very low	22.8	Very low	122 Å²	122	135 Å²	135	85%	0.853	75%	0.749	S	S	*	*			trans	-87.8	72.8	169.4	-165.5	0	0	0	0	111.4
618	C	21.3	Very low	23	Very low	103 Å²	103	138.8 Å²	138.8	70%	0.696	76%	0.755	S	S	*	*			trans	-84.9	125.5	159.5	-79.3	0	0	0	0	108.5	T616 Y620	T616-C618 PolarHBondContact O-N 2.6Å; C618-Y620 PolarHBondContact O-N 3.17Å
619	C	21.3	Very low	22.9	Very low	52 Å²	52	141.4 Å²	141.4	35%	0.351	76%	0.758	S	S	.	*			trans	-69.1	87.6	-175.6	-53.8	0	0	0	0	112.3	F594 F621	F594-C619 VanDerWaalsContact CE2-SG 3.52Å; F594-C619 WeakPolarHBondContact CZ-SG 3.46Å; C619-F621 PolarHBondContact O-N 2.82Å
620	Y	19.7	Very low	23	Very low	207 Å²	207	140.4 Å²	140.4	81%	0.812	75%	0.754	S	S	*	*			trans	-71.3	112.5	162.5	-91.2	-94.8	0	0	0	109.5	C618 V622	C618-Y620 PolarHBondContact O-N 3.17Å; Y620-V622 VanDerWaalsContact C-N 3.31Å; Y620-V622 PolarHBondContact O-N 3.41Å
621	F	20.9	Very low	23.2	Very low	157 Å²	157	139.4 Å²	139.4	69%	0.689	75%	0.746	S	S	*	*			trans	-71.7	91.1	159.4	-86.8	-82.8	0	0	0	108.7	C619 M623	C619-F621 PolarHBondContact O-N 2.82Å; F621-M623 PolarHBondContact O-N 2.83Å; F621-M623 VanDerWaalsContact O-N 3.13Å
622	V	21.5	Very low	23.3	Very low	119 Å²	119	142.9 Å²	142.9	72%	0.721	74%	0.742	S	S	*	*			trans	-72.3	101.9	172	-179.8	0	0	0	0	108.6	Y620	Y620-V622 VanDerWaalsContact C-N 3.31Å; Y620-V622 PolarHBondContact O-N 3.41Å
623	M	21.7	Very low	23.3	Very low	173 Å²	173	142.3 Å²	142.3	85%	0.852	74%	0.74	S	S	*	*			trans	-108	59.5	175.3	-94.6	-73.2	-157.2	0	0	110.8	F621	F621-M623 PolarHBondContact O-N 2.83Å; F621-M623 VanDerWaalsContact O-N 3.13Å
624	D	22.6	Very low	23.4	Very low	116 Å²	116	138 Å²	138	62%	0.62	74%	0.74	S	S	*	*			trans	-147.5	121.7	162.3	-95.3	-42.4	0	0	0	107.4
625	R	22.6	Very low	23.5	Very low	234 Å²	234	139.4 Å²	139.4	88%	0.883	76%	0.755	S	S	*	*				67.7	83.9	77.8	-72.6	-168.9	171.3	170.1	-7.9	114.6
626	A	22.4	Very low	23.5	Very low	88 Å²	88	137.5 Å²	137.5	73%	0.727	75%	0.75	S	S	*	*			trans	-161.6	158.1	134.2	0	0	0	0	0	110.7
627	N	23.8	Very low	23.6	Very low	147 Å²	147	138.4 Å²	138.4	79%	0.786	76%	0.756	S	S	*	*			trans	72.6	70.4	166.3	-57.9	-12.3	0	0	0	118.9
628	Q	27.7	Very low	23.5	Very low	194 Å²	194	141.7 Å²	141.7	91%	0.907	75%	0.751	S	S	*	*				-144.8	128.5	118.8	-119.6	170.1	63.2	0	0	111
629	I	23.1	Very low	23.6	Very low	164 Å²	164	144.2 Å²	144.2	84%	0.841	75%	0.752	S	S	*	*			trans	-105.7	105.4	178.2	-61.8	171.3	0	0	0	107.6
630	S	26.7	Very low	23.7	Very low	102 Å²	102	146 Å²	146	71%	0.713	76%	0.763	S	S	*	*			trans	-153.6	134.3	156.9	57.9	0	0	0	0	110.6
631	P	27.8	Very low	23.8	Very low	102 Å²	102	142.1 Å²	142.1	66%	0.662	76%	0.756	S	S	*	*			trans	-90.4	176.5	167	33.7	-30.1	0	0	0	111.9
632	Y	25.1	Very low	23.9	Very low	200 Å²	200	141.8 Å²	141.8	78%	0.784	76%	0.761	S	S	*	*			trans	93	95.7	171.5	-61.6	-75.1	0	0	0	119.3
633	N	22.8	Very low	24	Very low	139 Å²	139	142.2 Å²	142.2	74%	0.743	76%	0.758	S	S	*	*				54.7	104.6	123.6	-58.8	-1.3	0	0	0	120.8
634	T	26.9	Very low	24	Very low	139 Å²	139	140.9 Å²	140.9	85%	0.853	75%	0.749	S	S	*	*				-161.1	131.3	123	2	0	0	0	0	111.6
635	P	25.9	Very low	24	Very low	134 Å²	134	141.8 Å²	141.8	87%	0.87	76%	0.762	S	S	*	*			trans	-106.7	79.2	-178.4	37.9	-31.9	0	0	0	114
636	A	22.8	Very low	24.1	Very low	87 Å²	87	137 Å²	137	72%	0.719	75%	0.752	S	S	*	*			trans	-163.1	144.5	161.2	0	0	0	0	0	107.5
637	T	25.7	Very low	24.2	Very low	128 Å²	128	137 Å²	137	79%	0.785	75%	0.747	S	S	*	*			cis	-141.9	133.9	20.9	-60.3	0	0	0	0	110
638	Y	21.6	Very low	24.2	Very low	190 Å²	190	137.3 Å²	137.3	75%	0.745	75%	0.749	S	S	*	*			trans	-86.3	134.9	169.7	-82.8	-98.3	0	0	0	110.5
639	H	22.6	Very low	24.3	Very low	156 Å²	156	131.4 Å²	131.4	72%	0.722	73%	0.729	S	S	*	*			trans	-123.8	114.5	168.9	-144.6	-70.5	0	0	0	110.1	N641	H639-N641 PolarHBondContact O-N 3.11Å
640	P	23.7	Very low	24.6	Very low	89 Å²	89	128.7 Å²	128.7	58%	0.578	72%	0.716	S	S	*	*			trans	-86.2	101.4	-175.6	32.2	-32.4	0	0	0	111.2
641	N	22.8	Very low	24.8	Very low	127 Å²	127	128.4 Å²	128.4	68%	0.679	70%	0.704	S	S	*	*			trans	-126.2	82	166.6	-89.3	-23.6	0	0	0	110	H639 I643	H639-N641 PolarHBondContact O-N 3.11Å; N641-I643 VanDerWaalsContact C-N 3.26Å; N641-I643 PolarHBondContact O-N 3.31Å
642	L	23.2	Very low	25	Very low	149 Å²	149	125.3 Å²	125.3	78%	0.78	68%	0.682	S	S	*	*			trans	-78.8	73.6	169.4	-85.3	166.8	0	0	0	110	Y832	L642-Y832 HydrophobicContact CD1-CE2 4.02Å
643	I	22	Very low	25.6	Very low	128 Å²	128	118.7 Å²	118.7	66%	0.656	66%	0.656	S	S	*	*			trans	-132.2	127.8	175.9	-62.8	-177.8	0	0	0	109.7	N641	N641-I643 VanDerWaalsContact C-N 3.26Å; N641-I643 PolarHBondContact O-N 3.31Å
644	Q	22.4	Very low	26.1	Very low	146 Å²	146	116.4 Å²	116.4	68%	0.682	64%	0.637	S	S	*	*			trans	62	114.7	168.8	-69.9	170.8	4.6	0	0	119.1	I646	Q644-I646 HydrophobicContact CB-CG1 4.4Å; Q644-I646 PolarHBondContact O-N 2.86Å; Q644-I646 VanDerWaalsContact O-N 3.12Å
645	P	22.9	Very low	26.5	Very low	135 Å²	135	115.1 Å²	115.1	88%	0.877	62%	0.616	S	S	*	*	S	Bend	trans	-84	57.1	164.6	36.8	-34.7	0	0	0	111.6
646	I	24.7	Very low	27.2	Very low	132 Å²	132	109 Å²	109	68%	0.677	58%	0.578	S	S	*	*			trans	-135.5	71.1	-175.9	-45	177.4	0	0	0	110.8	Q644	Q644-I646 HydrophobicContact CB-CG1 4.4Å; Q644-I646 PolarHBondContact O-N 2.86Å; Q644-I646 VanDerWaalsContact O-N 3.12Å
647	S	23.7	Very low	28.4	Very low	90 Å²	90	107.1 Å²	107.1	63%	0.629	56%	0.559	S	S	*	*	S	Bend	trans	-160.8	2.5	178.5	57.7	0	0	0	0	116.6
648	N	24.6	Very low	29.7	Very low	153 Å²	153	101 Å²	101	82%	0.818	52%	0.522	S	S	*	.			trans	-136.6	22.5	-172.7	-116.5	-33.1	0	0	0	114.5	N650	N648-N650 PolarHBondContact O-N 3.46Å
649	S	29.9	Very low	31.7	Very low	70 Å²	70	94.8 Å²	94.8	49%	0.49	50%	0.501	S	S	.	.			trans	-84.8	87.2	165.1	54.9	0	0	0	0	109.8	M651	S649-M651 PolarHBondContact O-N 3.25Å
650	N	29.3	Very low	33.5	Very low	106 Å²	106	88.7 Å²	88.7	57%	0.567	47%	0.474	S	S	*	.			trans	-60.4	92.5	153.8	-95.5	-41.5	0	0	0	107.1	N648 N652	N648-N650 PolarHBondContact O-N 3.46Å; N650-N652 PolarHBondContact O-N 2.85Å
651	M	30.2	Very low	35.6	Very low	96 Å²	96	84.6 Å²	84.6	47%	0.473	45%	0.447	S	S	.	.			trans	-68.9	71.4	-176.4	-80.8	-75.4	-158.1	0	0	110.6	S649 W653 N660	S649-M651 PolarHBondContact O-N 3.25Å; M651-W653 PolarHBondContact O-N 2.95Å; M651-N660 PolarHBondContact SD-ND2 3.04Å
652	N	32	Very low	37.6	Very low	38 Å²	38	79.1 Å²	79.1	20%	0.203	42%	0.418	C	S	.	.			trans	-65.7	89.8	160	-177.7	-6.7	0	0	0	106.4	N650 R654 R655	N650-N652 PolarHBondContact O-N 2.85Å; N652-R654 PolarHBondContact O-N 2.93Å; N652-R655 HydrophobicContact CB-CG 4.47Å; N652-R655 PolarHBondContact ND2-NE 2.89Å; N652-R655 WeakPolarHBondContact O-CA 3.22Å; N652-R655 VanDerWaalsContact O-CB 3.29Å; N652-R655 WeakPolarHBondContact O-CB 3.5Å; N652-R655 PolarHBondContact O-N 2.94Å
653	W	38.5	Very low	39.4	Very low	61 Å²	61	75.2 Å²	75.2	23%	0.231	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-55.6	-23.9	-160.9	48.7	-96.9	0	0	0	115.1	L470 S593 M651 R655 G656	L470-W653 HydrophobicContact CB-CD2 3.77Å; L470-W653 HydrophobicContact CB-CE3 3.74Å; L470-W653 HydrophobicContact CB-CG 4.46Å; L470-W653 HydrophobicContact CB-CH2 3.84Å; L470-W653 HydrophobicContact CB-CZ2 3.83Å; L470-W653 HydrophobicContact CB-CZ3 3.79Å; L470-W653 HydrophobicContact CD2-CB 3.67Å; L470-W653 HydrophobicContact CD2-CD2 3.67Å; L470-W653 HydrophobicContact CD2-CE3 3.97Å; L470-W653 HydrophobicContact CD2-CG 3.54Å; L470-W653 HydrophobicContact CG-CD2 4.36Å; L470-W653 HydrophobicContact CG-CE3 4.36Å; L470-W653 VanDerWaalsContact N-CH2 3.35Å; S593-W653 PolarHBondContact O-NE1 3.25Å; M651-W653 PolarHBondContact O-N 2.95Å; W653-R655 PolarHBondContact O-N 2.83Å; W653-R655 VanDerWaalsContact O-N 3.14Å; W653-G656 PolarHBondContact O-N 3.09Å; W653-G656 VanDerWaalsContact O-N 3.12Å
654	R	33.3	Very low	41.3	Very low	91 Å²	91	70.7 Å²	70.7	34%	0.343	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-56.2	-24.7	169	-73.1	-169.6	-179.2	-143.1	8.5	112.9	G591 N652 V772 W773	G591-R654 PolarHBondContact O-NH2 2.75Å; N652-R654 PolarHBondContact O-N 2.93Å; R654-V772 HydrophobicContact CB-CG1 4.3Å; R654-V772 CarbonylContact O-C 3.57Å; R654-V772 VanDerWaalsContact O-CA 3.28Å; R654-V772 WeakPolarHBondContact O-CA 3.46Å; R654-W773 PolarHBondContact O-N 3.45Å
655	R	34.4	Very low	43.4	Very low	111 Å²	111	64.2 Å²	64.2	42%	0.419	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-103.5	13.5	-177.6	-48.4	172.7	175.6	-137.5	-2.2	113	N652 W653 E770	N652-R655 HydrophobicContact CB-CG 4.47Å; N652-R655 PolarHBondContact ND2-NE 2.89Å; N652-R655 WeakPolarHBondContact O-CA 3.22Å; N652-R655 VanDerWaalsContact O-CB 3.29Å; N652-R655 WeakPolarHBondContact O-CB 3.5Å; N652-R655 PolarHBondContact O-N 2.94Å; W653-R655 PolarHBondContact O-N 2.83Å; W653-R655 VanDerWaalsContact O-N 3.14Å; R655-E770 HydrophobicContact CB-CG 4.43Å; R655-E770 VanDerWaalsContact CD-CD 3.41Å; R655-E770 VanDerWaalsContact CD-OE1 3.22Å; R655-E770 WeakPolarHBondContact CD-OE1 3.35Å; R655-E770 WeakPolarHBondContact CD-OE2 3.19Å; R655-E770 HydrophobicContact CG-CG 4.18Å; R655-E770 VanDerWaalsContact CZ-CD 3.46Å; R655-E770 IonicContact CZ-OE1 3.55Å; R655-E770 IonicContact CZ-OE2 2.97Å; R655-E770 IonicContact NE-OE1 3.91Å; R655-E770 IonicContact NE-OE2 2.71Å; R655-E770 PolarHBondContact NE-OE2 3.46Å; R655-E770 IonicContact NH1-OE1 2.72Å; R655-E770 PolarHBondContact NH1-OE1 3.36Å; R655-E770 IonicContact NH1-OE2 3.35Å; R655-E770 PolarHBondContact NH1-OE2 2.7Å; R655-E770 IonicContact NH2-OE2 2.98Å; R655-E770 PolarHBondContact NH2-OE2 3.1Å
656	G	40.6	Very low	45.4	Very low	6 Å²	6	59.2 Å²	59.2	6%	0.062	31%	0.311	C	S	.	.	S	Bend	trans	-80.5	175.3	-178.4	0	0	0	0	0	114.1	W653 N660 W773	W653-G656 PolarHBondContact O-N 3.09Å; W653-G656 VanDerWaalsContact O-N 3.12Å; G656-N660 VanDerWaalsContact CA-ND2 3.26Å; G656-N660 WeakPolarHBondContact CA-ND2 3.44Å; G656-W773 PolarHBondContact O-NE1 3.27Å
657	C	49.4	Very low	46.9	Very low	47 Å²	47	58.5 Å²	58.5	32%	0.318	31%	0.305	S	S	.	.			trans	-73.2	156.8	168.4	-55.1	0	0	0	0	110.9	D659 N660 Q941	C657-D659 WeakPolarHBondContact CB-OD1 3.49Å; C657-D659 PolarHBondContact O-N 3.49Å; C657-N660 WeakPolarHBondContact CB-OD1 3.39Å; C657-N660 VanDerWaalsContact N-CG 3.32Å; C657-N660 PolarHBondContact N-ND2 3Å; C657-N660 PolarHBondContact N-OD1 2.83Å; C657-N660 VanDerWaalsContact O-CB 3.23Å; C657-N660 WeakPolarHBondContact O-CB 3.4Å; C657-N660 PolarHBondContact O-N 3.32Å; C657-Q941 PolarHBondContact SG-NE2 2.74Å
658	A	52.3	Low	48	Very low	1 Å²	1	59.3 Å²	59.3	1%	0.008	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-26	-177.1	0	0	0	0	0	113.9	F687 A739 W773 L942	A658-F687 HydrophobicContact CB-CE1 4.04Å; A658-F687 HydrophobicContact CB-CE2 4.26Å; A658-F687 HydrophobicContact CB-CZ 3.53Å; A658-A739 HydrophobicContact CB-CB 4.35Å; A658-W773 HydrophobicContact CB-CD2 4.18Å; A658-W773 HydrophobicContact CB-CE3 4.09Å; A658-W773 HydrophobicContact CB-CH2 3.99Å; A658-W773 HydrophobicContact CB-CZ2 4.05Å; A658-W773 HydrophobicContact CB-CZ3 4.01Å; A658-L942 VanDerWaalsContact CB-O 3.31Å; A658-L942 WeakPolarHBondContact CB-O 3.42Å
659	D	62.8	Low	48.6	Very low	58 Å²	58	55.7 Å²	55.7	31%	0.31	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-9.8	174.9	59.2	-38.9	0	0	0	114.3	C657 L661 V662 L663 F687	C657-D659 WeakPolarHBondContact CB-OD1 3.49Å; C657-D659 PolarHBondContact O-N 3.49Å; D659-L661 PolarHBondContact O-N 3.37Å; D659-V662 PolarHBondContact O-N 2.83Å; D659-L663 PolarHBondContact O-N 3.42Å; D659-L663 VanDerWaalsContact O-N 3.15Å; D659-F687 HydrophobicContact CB-CB 4.04Å; D659-F687 HydrophobicContact CB-CD1 3.71Å; D659-F687 HydrophobicContact CB-CE1 4.33Å; D659-F687 HydrophobicContact CB-CG 3.92Å
660	N	61.8	Low	48.6	Very low	29 Å²	29	58.9 Å²	58.9	16%	0.155	30%	0.304	C	S	.	.	H	α-helix	trans	-56.8	-28.4	-175.9	-84.5	15.7	0	0	0	113.8	M651 G656 C657 V662 L663 M664	M651-N660 PolarHBondContact SD-ND2 3.04Å; G656-N660 VanDerWaalsContact CA-ND2 3.26Å; G656-N660 WeakPolarHBondContact CA-ND2 3.44Å; C657-N660 WeakPolarHBondContact CB-OD1 3.39Å; C657-N660 VanDerWaalsContact N-CG 3.32Å; C657-N660 PolarHBondContact N-ND2 3Å; C657-N660 PolarHBondContact N-OD1 2.83Å; C657-N660 VanDerWaalsContact O-CB 3.23Å; C657-N660 WeakPolarHBondContact O-CB 3.4Å; C657-N660 PolarHBondContact O-N 3.32Å; N660-V662 VanDerWaalsContact C-N 3.33Å; N660-L663 PolarHBondContact O-N 2.92Å; N660-M664 WeakPolarHBondContact O-CB 3.24Å; N660-M664 PolarHBondContact O-N 2.9Å
661	L	67.3	Low	48.8	Very low	2 Å²	2	57.4 Å²	57.4	1%	0.01	31%	0.314	C	S	.	.	H	α-helix	trans	-65.4	-36.1	175.4	177.3	60.2	0	0	0	112	L470 T473 V474 D659 M664 L665 V737 H775 F948	L470-L661 HydrophobicContact CD1-CD1 4Å; T473-L661 HydrophobicContact CG2-CD2 4.38Å; V474-L661 HydrophobicContact CG2-CD1 4.39Å; D659-L661 PolarHBondContact O-N 3.37Å; L661-M664 HydrophobicContact CD1-CE 3.41Å; L661-M664 VanDerWaalsContact CD1-CE 3.41Å; L661-L665 HydrophobicContact CD1-CD1 3.58Å; L661-L665 HydrophobicContact CD1-CG 4.18Å; L661-L665 HydrophobicContact CG-CD1 4.19Å; L661-L665 WeakPolarHBondContact O-CD1 3.14Å; L661-L665 VanDerWaalsContact O-CG 3.25Å; L661-L665 WeakPolarHBondContact O-CG 3.41Å; L661-L665 PolarHBondContact O-N 2.76Å; L661-V737 HydrophobicContact CD2-CB 4.39Å; L661-V737 HydrophobicContact CD2-CG1 3.77Å; L661-H775 HydrophobicContact CD2-CB 3.81Å; L661-F948 HydrophobicContact CD2-CE2 3.95Å; L661-F948 HydrophobicContact CD2-CZ 4.21Å; L661-F948 HydrophobicContact CG-CE2 4.08Å; L661-F948 HydrophobicContact CG-CZ 3.83Å
662	V	64.7	Low	49.3	Very low	12 Å²	12	55.2 Å²	55.2	7%	0.073	31%	0.308	C	S	.	.	H	α-helix	trans	-71.4	-50.2	173.9	-179.1	0	0	0	0	109.2	D659 N660 M664 L665 T666 F687 S946 F948	D659-V662 PolarHBondContact O-N 2.83Å; N660-V662 VanDerWaalsContact C-N 3.33Å; V662-M664 VanDerWaalsContact C-N 3.31Å; V662-M664 PolarHBondContact O-N 2.56Å; V662-L665 PolarHBondContact O-N 2.82Å; V662-T666 HydrophobicContact CG1-CG2 4.27Å; V662-T666 PolarHBondContact O-N 2.77Å; V662-T666 PolarHBondContact O-OG1 2.68Å; V662-T666 VanDerWaalsContact O-OG1 3.1Å; V662-F687 HydrophobicContact CG2-CB 4.16Å; V662-S946 WeakPolarHBondContact CG2-OG 3.47Å; V662-F948 HydrophobicContact CB-CE1 4.44Å; V662-F948 HydrophobicContact CB-CZ 4.49Å; V662-F948 HydrophobicContact CG2-CE1 3.98Å; V662-F948 HydrophobicContact CG2-CZ 3.75Å
663	L	60.6	Low	49.5	Very low	67 Å²	67	63 Å²	63	35%	0.351	34%	0.34	S	S	.	.	H	α-helix	trans	-54.4	-45.7	178.9	-58.6	177.7	0	0	0	111.9	D659 N660 L665 H667	D659-L663 PolarHBondContact O-N 3.42Å; D659-L663 VanDerWaalsContact O-N 3.15Å; N660-L663 PolarHBondContact O-N 2.92Å; L663-L665 VanDerWaalsContact C-N 3.34Å; L663-L665 PolarHBondContact O-N 3.21Å; L663-H667 WeakPolarHBondContact CD2-NE2 3.31Å; L663-H667 WeakPolarHBondContact O-CB 3.36Å; L663-H667 PolarHBondContact O-N 2.88Å; L663-H667 VanDerWaalsContact O-N 3.17Å
664	M	61.2	Low	49.5	Very low	34 Å²	34	67 Å²	67	17%	0.167	37%	0.366	C	S	.	.	H	α-helix	trans	-56.6	-43	176.1	165.2	168.1	75.4	0	0	113.4	L470 V474 F499 N660 L661 V662	L470-M664 HydrophobicContact CD1-CE 4.12Å; L470-M664 HydrophobicContact CD2-CE 3.71Å; L470-M664 HydrophobicContact CD2-SD 4.1Å; L470-M664 HydrophobicContact CG-CE 3.91Å; V474-M664 HydrophobicContact CG2-CE 3.92Å; F499-M664 HydrophobicContact CD1-CG 4.29Å; F499-M664 HydrophobicContact CD1-SD 4.17Å; F499-M664 HydrophobicContact CD2-CG 4.25Å; F499-M664 HydrophobicContact CE1-CB 4.41Å; F499-M664 HydrophobicContact CE1-CG 3.69Å; F499-M664 HydrophobicContact CE1-SD 3.63Å; F499-M664 HydrophobicContact CE2-CB 4.08Å; F499-M664 HydrophobicContact CE2-CG 3.65Å; F499-M664 WeakPolarHBondContact CE2-O 3.41Å; F499-M664 HydrophobicContact CZ-CB 3.71Å; F499-M664 HydrophobicContact CZ-CG 3.35Å; F499-M664 HydrophobicContact CZ-SD 3.92Å; N660-M664 WeakPolarHBondContact O-CB 3.24Å; N660-M664 PolarHBondContact O-N 2.9Å; L661-M664 HydrophobicContact CD1-CE 3.41Å; L661-M664 VanDerWaalsContact CD1-CE 3.41Å; V662-M664 VanDerWaalsContact C-N 3.31Å; V662-M664 PolarHBondContact O-N 2.56Å
665	L	67.7	Low	49.8	Very low	9 Å²	9	66 Å²	66	5%	0.047	37%	0.37	C	S	.	.	H	α-helix	trans	-93.3	-13.6	-170	-60	173.9	0	0	0	113.3	V474 I477 L661 V662 L663 V679 D680 L683 F948	V474-L665 HydrophobicContact CG1-CD2 4.1Å; V474-L665 HydrophobicContact CG2-CD1 4.45Å; V474-L665 HydrophobicContact CG2-CD2 4.01Å; I477-L665 HydrophobicContact CD1-CD1 4.01Å; L661-L665 HydrophobicContact CD1-CD1 3.58Å; L661-L665 HydrophobicContact CD1-CG 4.18Å; L661-L665 HydrophobicContact CG-CD1 4.19Å; L661-L665 WeakPolarHBondContact O-CD1 3.14Å; L661-L665 VanDerWaalsContact O-CG 3.25Å; L661-L665 WeakPolarHBondContact O-CG 3.41Å; L661-L665 PolarHBondContact O-N 2.76Å; V662-L665 PolarHBondContact O-N 2.82Å; L663-L665 VanDerWaalsContact C-N 3.34Å; L663-L665 PolarHBondContact O-N 3.21Å; L665-V679 HydrophobicContact CB-CG1 4.25Å; L665-V679 HydrophobicContact CD2-CG1 3.74Å; L665-D680 WeakPolarHBondContact O-CA 3.38Å; L665-L683 HydrophobicContact CB-CD1 4.06Å; L665-F948 HydrophobicContact CB-CE1 4.49Å; L665-F948 HydrophobicContact CD1-CE1 4.01Å; L665-F948 HydrophobicContact CD1-CZ 4.03Å
666	T	64.5	Low	50.4	Low	30 Å²	30	62.4 Å²	62.4	18%	0.184	36%	0.362	C	S	.	.	H	α-helix	trans	-136.1	6.7	-170.2	81.1	0	0	0	0	116	V662 L683	V662-T666 HydrophobicContact CG1-CG2 4.27Å; V662-T666 PolarHBondContact O-N 2.77Å; V662-T666 PolarHBondContact O-OG1 2.68Å; V662-T666 VanDerWaalsContact O-OG1 3.1Å; T666-L683 HydrophobicContact CG2-CD1 3.74Å
667	H	55.9	Low	50.9	Low	117 Å²	117	63.7 Å²	63.7	54%	0.542	37%	0.37	S	S	.	.			trans	-97.9	121.9	173.3	-96	-108.2	0	0	0	113.1	L663	L663-H667 WeakPolarHBondContact CD2-NE2 3.31Å; L663-H667 WeakPolarHBondContact O-CB 3.36Å; L663-H667 PolarHBondContact O-N 2.88Å; L663-H667 VanDerWaalsContact O-N 3.17Å
668	H	47.2	Very low	51.4	Low	108 Å²	108	64.3 Å²	64.3	50%	0.5	37%	0.372	S	S	.	.			trans	-70.3	122.5	155.5	-56	-10.1	0	0	0	109	P670 D680	H668-P670 VanDerWaalsContact O-CD 3.3Å; H668-P670 WeakPolarHBondContact O-CD 3.36Å; H668-D680 VanDerWaalsContact CE1-CG 3.4Å; H668-D680 IonicContact CE1-OD1 3.34Å; H668-D680 PolarHBondContact CE1-OD1 3.49Å; H668-D680 IonicContact CE1-OD2 3.38Å; H668-D680 PolarHBondContact CE1-OD2 2.89Å; H668-D680 VanDerWaalsContact CE1-OD2 3.26Å; H668-D680 IonicContact CG-OD2 3.66Å; H668-D680 PolarHBondContact N-OD2 2.97Å; H668-D680 VanDerWaalsContact ND1-CG 3.32Å; H668-D680 IonicContact ND1-OD1 2.76Å; H668-D680 IonicContact ND1-OD2 3.57Å; H668-D680 PolarHBondContact ND1-OD2 2.8Å
669	S	37.1	Very low	51.8	Low	77 Å²	77	64.5 Å²	64.5	54%	0.538	37%	0.373	S	S	.	.			trans	-68	114.6	173.2	-67.4	0	0	0	0	110.5	G671 S672	S669-G671 PolarHBondContact O-N 3.01Å; S669-S672 PolarHBondContact O-N 3.46Å; S669-S672 VanDerWaalsContact O-N 3.1Å
670	P	30.6	Very low	51.9	Low	137 Å²	137	61.8 Å²	61.8	89%	0.89	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	90.9	-172.5	29.7	-35	0	0	0	110.8	H668	H668-P670 VanDerWaalsContact O-CD 3.3Å; H668-P670 WeakPolarHBondContact O-CD 3.36Å
671	G	33.1	Very low	52.1	Low	75 Å²	75	66.5 Å²	66.5	77%	0.773	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	153.6	-30.3	-173.9	0	0	0	0	0	112.5	S669 K673	S669-G671 PolarHBondContact O-N 3.01Å; G671-K673 PolarHBondContact O-N 3.32Å
672	S	39.9	Very low	52.2	Low	49 Å²	49	68.2 Å²	68.2	34%	0.343	39%	0.387	S	S	.	.			trans	-84	106.7	170	-174.9	0	0	0	0	110.6	S669 N674 T675	S669-S672 PolarHBondContact O-N 3.46Å; S669-S672 VanDerWaalsContact O-N 3.1Å; S672-N674 PolarHBondContact O-N 3.35Å; S672-N674 PolarHBondContact OG-N 3.39Å; S672-T675 VanDerWaalsContact CB-OG1 3.26Å; S672-T675 WeakPolarHBondContact CB-OG1 3.47Å; S672-T675 WeakPolarHBondContact OG-CB 3.26Å; S672-T675 PolarHBondContact OG-N 2.85Å; S672-T675 PolarHBondContact OG-OG1 2.96Å
673	K	37.5	Very low	52.8	Low	203 Å²	203	67.7 Å²	67.7	88%	0.883	38%	0.384	S	S	*	.	S	Bend	trans	-70.5	-12	172.6	-64.8	-168.6	175.1	-169.6	0	113.3	G671	G671-K673 PolarHBondContact O-N 3.32Å
674	N	38.5	Very low	53.7	Low	145 Å²	145	65.4 Å²	65.4	78%	0.775	37%	0.372	S	S	*	.	S	Bend	trans	-122.3	-14.6	-168.8	-66.2	6.5	0	0	0	115	S672	S672-N674 PolarHBondContact O-N 3.35Å; S672-N674 PolarHBondContact OG-N 3.39Å
675	T	39	Very low	54.5	Low	68 Å²	68	64.4 Å²	64.4	42%	0.417	37%	0.371	S	S	.	.			trans	-124.8	56.2	-169.3	68.4	0	0	0	0	114.8	S672	S672-T675 VanDerWaalsContact CB-OG1 3.26Å; S672-T675 WeakPolarHBondContact CB-OG1 3.47Å; S672-T675 WeakPolarHBondContact OG-CB 3.26Å; S672-T675 PolarHBondContact OG-N 2.85Å; S672-T675 PolarHBondContact OG-OG1 2.96Å
676	S	46	Very low	55.2	Low	36 Å²	36	66.5 Å²	66.5	25%	0.252	38%	0.378	S	S	.	.			trans	-65.9	128.1	147.4	51.2	0	0	0	0	108.3	K681	S676-K681 WeakPolarHBondContact OG-CE 3.49Å
677	S	52.7	Low	56.1	Low	34 Å²	34	66.9 Å²	66.9	24%	0.238	38%	0.378	C	S	.	.			trans	-62.2	149.9	180	80.8	0	0	0	0	110.1	V679 D680 K681	S677-V679 PolarHBondContact O-N 3.36Å; S677-D680 WeakPolarHBondContact O-CB 3.42Å; S677-D680 PolarHBondContact O-N 2.66Å; S677-D680 VanDerWaalsContact O-N 3.08Å; S677-D680 WeakPolarHBondContact OG-CB 3.11Å; S677-D680 PolarHBondContact OG-N 3.45Å; S677-K681 PolarHBondContact O-N 2.95Å
678	V	58.8	Low	57.4	Low	60 Å²	60	61.5 Å²	61.5	36%	0.364	35%	0.353	S	S	.	.	H	α-helix	trans	-63.5	-32.1	178.6	171	0	0	0	0	110.7	I495 K681 L682	I495-V678 HydrophobicContact CD1-CB 3.62Å; I495-V678 HydrophobicContact CD1-CG1 4.07Å; I495-V678 HydrophobicContact CG1-CB 3.98Å; V678-K681 PolarHBondContact O-N 3.11Å; V678-L682 HydrophobicContact CG1-CD1 4.08Å; V678-L682 WeakPolarHBondContact O-CD1 3.34Å; V678-L682 VanDerWaalsContact O-CG 3.25Å; V678-L682 WeakPolarHBondContact O-CG 3.18Å; V678-L682 PolarHBondContact O-N 2.9Å
679	V	60.3	Low	59	Low	5 Å²	5	58.8 Å²	58.8	3%	0.03	34%	0.344	C	S	.	.	H	α-helix	trans	-59.3	-45.9	170.1	156	0	0	0	0	112.1	L478 I495 L665 S677 K681 L682 L683	L478-V679 HydrophobicContact CD1-CG2 3.79Å; L478-V679 HydrophobicContact CD2-CG2 4.22Å; I495-V679 HydrophobicContact CD1-CG2 4Å; I495-V679 HydrophobicContact CG2-CB 4.06Å; I495-V679 HydrophobicContact CG2-CG2 3.82Å; L665-V679 HydrophobicContact CB-CG1 4.25Å; L665-V679 HydrophobicContact CD2-CG1 3.74Å; S677-V679 PolarHBondContact O-N 3.36Å; V679-K681 VanDerWaalsContact C-N 3.32Å; V679-K681 PolarHBondContact O-N 3.34Å; V679-L682 PolarHBondContact O-N 2.75Å; V679-L683 HydrophobicContact CG1-CD2 3.73Å; V679-L683 HydrophobicContact CG1-CG 4.32Å; V679-L683 PolarHBondContact O-N 3.03Å; V679-L683 VanDerWaalsContact O-N 3.11Å
680	D	66	Low	61.1	Low	1 Å²	1	55.2 Å²	55.2	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-61	-41.6	176.8	-174.6	-19.1	0	0	0	110.6	L665 H668 S677 L682 L683 K951	L665-D680 WeakPolarHBondContact O-CA 3.38Å; H668-D680 VanDerWaalsContact CE1-CG 3.4Å; H668-D680 IonicContact CE1-OD1 3.34Å; H668-D680 PolarHBondContact CE1-OD1 3.49Å; H668-D680 IonicContact CE1-OD2 3.38Å; H668-D680 PolarHBondContact CE1-OD2 2.89Å; H668-D680 VanDerWaalsContact CE1-OD2 3.26Å; H668-D680 IonicContact CG-OD2 3.66Å; H668-D680 PolarHBondContact N-OD2 2.97Å; H668-D680 VanDerWaalsContact ND1-CG 3.32Å; H668-D680 IonicContact ND1-OD1 2.76Å; H668-D680 IonicContact ND1-OD2 3.57Å; H668-D680 PolarHBondContact ND1-OD2 2.8Å; S677-D680 WeakPolarHBondContact O-CB 3.42Å; S677-D680 PolarHBondContact O-N 2.66Å; S677-D680 VanDerWaalsContact O-N 3.08Å; S677-D680 WeakPolarHBondContact OG-CB 3.11Å; S677-D680 PolarHBondContact OG-N 3.45Å; D680-L682 PolarHBondContact O-N 2.97Å; D680-L683 PolarHBondContact O-N 3.43Å; D680-K951 VanDerWaalsContact O-CD 3.25Å; D680-K951 WeakPolarHBondContact O-CD 3.3Å; D680-K951 VanDerWaalsContact O-CE 3.31Å; D680-K951 WeakPolarHBondContact O-CE 3.41Å; D680-K951 PolarHBondContact O-NZ 3.32Å; D680-K951 IonicContact OD1-NZ 2.68Å; D680-K951 PolarHBondContact OD1-NZ 2.96Å
681	K	66.4	Low	63.7	Low	127 Å²	127	51 Å²	51	55%	0.552	29%	0.293	S	S	*	.	H	α-helix	trans	-59.3	-18.4	174	-64.1	-177.4	-175.6	179.8	0	114.1	S676 S677 V678 V679	S676-K681 WeakPolarHBondContact OG-CE 3.49Å; S677-K681 PolarHBondContact O-N 2.95Å; V678-K681 PolarHBondContact O-N 3.11Å; V679-K681 VanDerWaalsContact C-N 3.32Å; V679-K681 PolarHBondContact O-N 3.34Å
682	L	68.8	Low	66.1	Low	38 Å²	38	51.1 Å²	51.1	20%	0.199	28%	0.279	C	S	.	.	H	α-helix	trans	-106.3	-21	-173.8	-64.3	166.9	0	0	0	114.7	L483 C487 V678 V679 D680 E950 K951	L483-L682 HydrophobicContact CD1-CB 3.87Å; L483-L682 HydrophobicContact CD2-CB 4.08Å; L483-L682 HydrophobicContact CD2-CD1 4.38Å; L483-L682 HydrophobicContact CD2-CD2 4.06Å; L483-L682 HydrophobicContact CD2-CG 4.4Å; C487-L682 VanDerWaalsContact SG-CD1 3.53Å; V678-L682 HydrophobicContact CG1-CD1 4.08Å; V678-L682 WeakPolarHBondContact O-CD1 3.34Å; V678-L682 VanDerWaalsContact O-CG 3.25Å; V678-L682 WeakPolarHBondContact O-CG 3.18Å; V678-L682 PolarHBondContact O-N 2.9Å; V679-L682 PolarHBondContact O-N 2.75Å; D680-L682 PolarHBondContact O-N 2.97Å; L682-E950 WeakPolarHBondContact O-CA 3.41Å; L682-K951 PolarHBondContact O-N 3.36Å
683	L	76.1	Confident	68.1	Low	1 Å²	1	50.7 Å²	50.7	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	146.8	-176.5	74.9	91.6	0	0	0	114.5	I477 L478 L481 L665 T666 V679 D680 F948 I949 K951	I477-L683 HydrophobicContact CG2-CD2 4.41Å; L478-L683 HydrophobicContact CD2-CD2 3.89Å; L481-L683 HydrophobicContact CD1-CB 4.24Å; L665-L683 HydrophobicContact CB-CD1 4.06Å; T666-L683 HydrophobicContact CG2-CD1 3.74Å; V679-L683 HydrophobicContact CG1-CD2 3.73Å; V679-L683 HydrophobicContact CG1-CG 4.32Å; V679-L683 PolarHBondContact O-N 3.03Å; V679-L683 VanDerWaalsContact O-N 3.11Å; D680-L683 PolarHBondContact O-N 3.43Å; L683-F948 HydrophobicContact CD1-CD1 3.59Å; L683-F948 HydrophobicContact CD1-CE1 4.19Å; L683-F948 HydrophobicContact CD1-CG 4.47Å; L683-I949 CarbonylContact C-O 3.55Å; L683-I949 VanDerWaalsContact CA-O 3.27Å; L683-I949 WeakPolarHBondContact CA-O 3.35Å; L683-K951 WeakPolarHBondContact O-CE 3.38Å
684	T	79.7	Confident	70.4	Confident	19 Å²	19	41.2 Å²	41.2	12%	0.117	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	149.3	168.6	-58.9	0	0	0	0	108.3	F948 I949 K951 V957 L960	T684-F948 WeakPolarHBondContact O-CA 3.48Å; T684-I949 PolarHBondContact N-O 3.04Å; T684-I949 PolarHBondContact O-N 3.4Å; T684-K951 WeakPolarHBondContact OG1-CE 3.36Å; T684-K951 WeakPolarHBondContact OG1-CG 3.36Å; T684-V957 HydrophobicContact CG2-CG1 4.39Å; T684-L960 HydrophobicContact CG2-CD2 4.2Å
685	G	79.7	Confident	72.6	Confident	13 Å²	13	39.1 Å²	39.1	13%	0.134	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	165.5	176	0	0	0	0	0	114	L947	G685-L947 CarbonylContact C-O 3.54Å; G685-L947 WeakPolarHBondContact CA-O 3.36Å
686	R	81.9	Confident	74.5	Confident	53 Å²	53	39.3 Å²	39.3	20%	0.2	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	138.8	-179.5	178.8	174.5	175.4	175.3	-4.9	110.4	L688 S946 L947 L960 T963	R686-L688 HydrophobicContact CG-CD2 4.36Å; R686-S946 CarbonylContact O-C 3.54Å; R686-S946 WeakPolarHBondContact O-CA 3.32Å; R686-L947 PolarHBondContact N-O 3.28Å; R686-L947 PolarHBondContact O-N 2.89Å; R686-L960 HydrophobicContact CB-CD1 3.88Å; R686-L960 HydrophobicContact CB-CD2 4.05Å; R686-L960 HydrophobicContact CB-CG 3.87Å; R686-L960 WeakPolarHBondContact CD-O 3.41Å; R686-L960 PolarHBondContact NH1-O 2.85Å; R686-T963 PolarHBondContact NH1-O 3.32Å; R686-T963 VanDerWaalsContact NH1-O 3.09Å; R686-T963 PolarHBondContact NH1-OG1 3.43Å; R686-T963 PolarHBondContact NH2-O 2.81Å
687	F	82.2	Confident	76.1	Confident	39 Å²	39	37.6 Å²	37.6	17%	0.171	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	143.2	174.3	-173.6	-120.8	0	0	0	111.7	A658 D659 V662 P689 A739 L942 S946	A658-F687 HydrophobicContact CB-CE1 4.04Å; A658-F687 HydrophobicContact CB-CE2 4.26Å; A658-F687 HydrophobicContact CB-CZ 3.53Å; D659-F687 HydrophobicContact CB-CB 4.04Å; D659-F687 HydrophobicContact CB-CD1 3.71Å; D659-F687 HydrophobicContact CB-CE1 4.33Å; D659-F687 HydrophobicContact CB-CG 3.92Å; V662-F687 HydrophobicContact CG2-CB 4.16Å; F687-P689 HydrophobicContact CD1-CB 4.34Å; F687-P689 HydrophobicContact CE1-CB 3.78Å; F687-P689 HydrophobicContact CE1-CG 4.5Å; F687-P689 HydrophobicContact CZ-CB 4.41Å; F687-A739 HydrophobicContact CE2-CB 3.98Å; F687-L942 WeakPolarHBondContact CZ-O 3.21Å; F687-S946 WeakPolarHBondContact CD2-OG 3.27Å
688	L	84.7	Confident	77.6	Confident	4 Å²	4	37.5 Å²	37.5	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	93.1	-176.3	-58.8	168.1	0	0	0	108.6	R686 V697 W725 G944 I945 L947	R686-L688 HydrophobicContact CG-CD2 4.36Å; L688-V697 HydrophobicContact CD1-CG2 4.43Å; L688-V697 HydrophobicContact CD2-CG2 3.7Å; L688-W725 HydrophobicContact CD1-CH2 4.09Å; L688-W725 HydrophobicContact CD1-CZ2 3.82Å; L688-G944 CarbonylContact O-C 3.56Å; L688-G944 WeakPolarHBondContact O-CA 3.26Å; L688-I945 WeakPolarHBondContact CB-O 3.34Å; L688-I945 PolarHBondContact N-O 2.83Å; L688-I945 PolarHBondContact O-N 3.31Å; L688-L947 HydrophobicContact CD1-CD1 3.88Å; L688-L947 HydrophobicContact CD1-CG 4.26Å
689	P	81	Confident	78.6	Confident	50 Å²	50	35 Å²	35	33%	0.325	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	141	-172	28.8	-34	0	0	0	113.5	F687 S693 L942	F687-P689 HydrophobicContact CD1-CB 4.34Å; F687-P689 HydrophobicContact CE1-CB 3.78Å; F687-P689 HydrophobicContact CE1-CG 4.5Å; F687-P689 HydrophobicContact CZ-CB 4.41Å; P689-S693 WeakPolarHBondContact O-CB 3.46Å; P689-S693 PolarHBondContact O-OG 3.16Å; P689-L942 HydrophobicContact CB-CB 4.13Å
690	G	81.4	Confident	79.2	Confident	3 Å²	3	35.9 Å²	35.9	3%	0.031	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.6	-178.3	170.7	0	0	0	0	0	115.7	T692 P943	G690-T692 VanDerWaalsContact C-N 3.3Å; G690-T692 PolarHBondContact O-N 3.02Å; G690-P943 WeakPolarHBondContact CA-O 3.45Å; G690-P943 PolarHBondContact N-O 3.36Å
691	P	84.9	Confident	78.6	Confident	48 Å²	48	39.9 Å²	39.9	31%	0.312	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-5.5	-167	32.3	-36.3	0	0	0	114.7	W694 M718 L805	P691-W694 PolarHBondContact O-NE1 3.3Å; P691-M718 WeakPolarHBondContact O-CE 3.38Å; P691-L805 HydrophobicContact CB-CB 4.29Å; P691-L805 WeakPolarHBondContact CD-O 3.44Å
692	T	83.2	Confident	77.6	Confident	78 Å²	78	39.2 Å²	39.2	48%	0.479	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.2	-28.1	-174	46.3	0	0	0	0	114.6	G690 W694 R695 M718	G690-T692 VanDerWaalsContact C-N 3.3Å; G690-T692 PolarHBondContact O-N 3.02Å; T692-W694 PolarHBondContact O-N 3.29Å; T692-W694 VanDerWaalsContact O-N 3.1Å; T692-R695 VanDerWaalsContact O-CB 3.24Å; T692-R695 WeakPolarHBondContact O-CB 3.27Å; T692-R695 WeakPolarHBondContact O-CG 3.4Å; T692-R695 PolarHBondContact O-N 2.87Å; T692-M718 HydrophobicContact CG2-CE 3.97Å
693	S	82.5	Confident	76.2	Confident	40 Å²	40	47.2 Å²	47.2	28%	0.28	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-65.8	-19.1	-167.5	-52.1	0	0	0	0	114.6	P689 R695 S696	P689-S693 WeakPolarHBondContact O-CB 3.46Å; P689-S693 PolarHBondContact O-OG 3.16Å; S693-R695 PolarHBondContact O-N 2.78Å; S693-S696 PolarHBondContact O-N 3.09Å; S693-S696 PolarHBondContact O-OG 3.35Å
694	W	85.5	Confident	74.2	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.015	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-62	-26.1	171	56.1	-94	0	0	0	112.8	P691 T692 S696 V697 M718 L722 W725 L802 I945	P691-W694 PolarHBondContact O-NE1 3.3Å; T692-W694 PolarHBondContact O-N 3.29Å; T692-W694 VanDerWaalsContact O-N 3.1Å; W694-S696 PolarHBondContact O-N 3.23Å; W694-V697 PolarHBondContact O-N 2.78Å; W694-M718 HydrophobicContact CH2-SD 4.35Å; W694-M718 HydrophobicContact CZ2-CE 4.39Å; W694-M718 HydrophobicContact CZ2-SD 3.67Å; W694-L722 HydrophobicContact CD2-CD1 3.83Å; W694-L722 HydrophobicContact CE3-CD1 4.04Å; W694-L722 HydrophobicContact CG-CD1 4.25Å; W694-L722 HydrophobicContact CH2-CB 3.8Å; W694-L722 HydrophobicContact CH2-CD1 4.41Å; W694-L722 HydrophobicContact CZ2-CB 3.86Å; W694-L722 HydrophobicContact CZ2-CD1 4.23Å; W694-L722 HydrophobicContact CZ2-CG 4.47Å; W694-L722 HydrophobicContact CZ3-CB 4.32Å; W694-L722 HydrophobicContact CZ3-CD1 4.32Å; W694-W725 HydrophobicContact CB-CD2 4.34Å; W694-W725 HydrophobicContact CB-CH2 4.16Å; W694-W725 HydrophobicContact CB-CZ2 3.76Å; W694-W725 HydrophobicContact CE3-CB 3.97Å; W694-W725 AromaticContact CE3-CD1 3.74Å; W694-W725 HydrophobicContact CE3-CD2 4.05Å; W694-W725 AromaticContact CE3-CG 3.65Å; W694-W725 HydrophobicContact CE3-CG 3.65Å; W694-W725 HydrophobicContact CZ3-CB 3.92Å; W694-W725 HydrophobicContact CZ3-CG 4.09Å; W694-W725 PolarHBondContact O-NE1 3.4Å; W694-L802 HydrophobicContact CZ2-CD2 4.43Å; W694-I945 HydrophobicContact CB-CD1 4.14Å; W694-I945 HydrophobicContact CG-CD1 4.37Å
695	R	83.9	Confident	72.3	Confident	100 Å²	100	55.3 Å²	55.3	38%	0.377	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-64.8	-20	179.4	-64.6	177	167.9	-135.8	-7.1	113.9	T692 S693 M718	T692-R695 VanDerWaalsContact O-CB 3.24Å; T692-R695 WeakPolarHBondContact O-CB 3.27Å; T692-R695 WeakPolarHBondContact O-CG 3.4Å; T692-R695 PolarHBondContact O-N 2.87Å; S693-R695 PolarHBondContact O-N 2.78Å; R695-M718 PolarHBondContact NH2-SD 2.93Å
696	S	78.2	Confident	70.3	Confident	72 Å²	72	58.2 Å²	58.2	50%	0.503	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-81.8	-11.9	-179.1	67.4	0	0	0	0	114.2	S693 W694 T963	S693-S696 PolarHBondContact O-N 3.09Å; S693-S696 PolarHBondContact O-OG 3.35Å; W694-S696 PolarHBondContact O-N 3.23Å; S696-T963 WeakPolarHBondContact O-CG2 3.35Å
697	V	80.8	Confident	68.2	Low	0 Å²	0	64.5 Å²	64.5	0%	0	33%	0.331	C	S	.	.			trans	-125.6	118	-177.5	-162.9	0	0	0	0	110.1	L688 W694 W725 W729 L960 T963	L688-V697 HydrophobicContact CD1-CG2 4.43Å; L688-V697 HydrophobicContact CD2-CG2 3.7Å; W694-V697 PolarHBondContact O-N 2.78Å; V697-W725 PolarHBondContact O-NE1 3.33Å; V697-W729 HydrophobicContact CB-CZ2 4.29Å; V697-W729 HydrophobicContact CG1-CH2 4.02Å; V697-W729 HydrophobicContact CG1-CZ2 3.57Å; V697-L960 HydrophobicContact CG1-CD1 4.18Å; V697-T963 HydrophobicContact CG1-CG2 4.48Å
698	W	84.2	Confident	66.2	Low	32 Å²	32	64.3 Å²	64.3	12%	0.121	33%	0.334	C	S	.	.			trans	-132.7	141.8	-179.7	-107.6	85.1	0	0	0	109.7	I452 F700 F709 L724 W725 A728 T959	I452-W698 HydrophobicContact CD1-CH2 4.03Å; I452-W698 HydrophobicContact CD1-CZ3 4.04Å; W698-F700 AromaticContact CE3-CD2 3.78Å; W698-F700 HydrophobicContact CE3-CD2 3.78Å; W698-F700 HydrophobicContact CE3-CE2 4.32Å; W698-F700 AromaticContact CZ3-CD2 3.77Å; W698-F700 HydrophobicContact CZ3-CD2 3.77Å; W698-F700 AromaticContact CZ3-CE2 3.96Å; W698-F700 HydrophobicContact CZ3-CE2 3.96Å; W698-F700 PolarHBondContact O-N 3.21Å; W698-F700 VanDerWaalsContact O-N 3.15Å; W698-F709 HydrophobicContact CB-CE1 4.23Å; W698-F709 HydrophobicContact CG-CE1 4.3Å; W698-L724 HydrophobicContact CH2-CD2 4.1Å; W698-L724 HydrophobicContact CH2-CG 4.08Å; W698-L724 HydrophobicContact CZ2-CD2 4.44Å; W698-W725 AromaticContact CD1-CD1 3.86Å; W698-W725 AromaticContact NE1-CD1 3.63Å; W698-A728 HydrophobicContact CE3-CB 4.32Å; W698-A728 HydrophobicContact CH2-CB 4.08Å; W698-A728 HydrophobicContact CZ3-CB 3.7Å; W698-T959 WeakPolarHBondContact O-CG2 3.34Å
699	P	79.7	Confident	64.3	Low	8 Å²	8	68.3 Å²	68.3	5%	0.052	35%	0.351	C	S	.	.	S	Bend	trans	-70.3	-9.1	-174.3	27.4	-35	0	0	0	114.9	A728 W729 C732 L956	P699-A728 HydrophobicContact CG-CB 3.87Å; P699-W729 HydrophobicContact CB-CD2 4.18Å; P699-W729 HydrophobicContact CB-CE3 3.91Å; P699-W729 HydrophobicContact CB-CH2 4.22Å; P699-W729 HydrophobicContact CB-CZ2 4.43Å; P699-W729 HydrophobicContact CB-CZ3 3.94Å; P699-W729 HydrophobicContact CG-CD2 4.2Å; P699-W729 HydrophobicContact CG-CE3 4.4Å; P699-C732 HydrophobicContact CB-CB 4.33Å; P699-L956 HydrophobicContact CB-CD2 3.86Å
700	F	72.7	Confident	62.2	Low	23 Å²	23	70 Å²	70	10%	0.101	36%	0.358	C	S	.	.			trans	-110.3	99.6	-175.8	-54.2	-56.5	0	0	0	111.9	L446 I452 W698 H702 A728	L446-F700 HydrophobicContact CD2-CD1 4.33Å; I452-F700 HydrophobicContact CD1-CE2 4.24Å; I452-F700 HydrophobicContact CG1-CE2 4.32Å; W698-F700 AromaticContact CE3-CD2 3.78Å; W698-F700 HydrophobicContact CE3-CD2 3.78Å; W698-F700 HydrophobicContact CE3-CE2 4.32Å; W698-F700 AromaticContact CZ3-CD2 3.77Å; W698-F700 HydrophobicContact CZ3-CD2 3.77Å; W698-F700 AromaticContact CZ3-CE2 3.96Å; W698-F700 HydrophobicContact CZ3-CE2 3.96Å; W698-F700 PolarHBondContact O-N 3.21Å; W698-F700 VanDerWaalsContact O-N 3.15Å; F700-H702 VanDerWaalsContact C-N 3.35Å; F700-H702 PolarHBondContact O-N 3.16Å; F700-A728 HydrophobicContact CE2-CB 4.12Å
701	I	54.3	Low	60.1	Low	86 Å²	86	71.7 Å²	71.7	44%	0.441	37%	0.369	S	S	.	.			trans	-70.6	-24.5	179.7	-67.9	178.8	0	0	0	113.2	K703 T959	I701-K703 PolarHBondContact O-N 3.21Å; I701-T959 HydrophobicContact CD1-CG2 4.23Å; I701-T959 VanDerWaalsContact CD1-OG1 3.23Å; I701-T959 WeakPolarHBondContact CD1-OG1 3.37Å; I701-T959 HydrophobicContact CG1-CG2 3.9Å
702	H	44.7	Very low	57.8	Low	112 Å²	112	74.8 Å²	74.8	52%	0.519	39%	0.387	S	S	.	.			trans	-70.5	123.1	-164.5	-82.5	-73.8	0	0	0	114.9	F700 N704 H705	F700-H702 VanDerWaalsContact C-N 3.35Å; F700-H702 PolarHBondContact O-N 3.16Å; H702-N704 PolarHBondContact O-N 3.12Å; H702-H705 PolarHBondContact O-N 3.27Å
703	K	38.3	Very low	55.6	Low	206 Å²	206	77.3 Å²	77.3	90%	0.896	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-9.4	-175.3	-67.1	-179	175.7	177.8	0	117.2	I701	I701-K703 PolarHBondContact O-N 3.21Å
704	N	35.6	Very low	53.7	Low	146 Å²	146	81.9 Å²	81.9	78%	0.781	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-12.3	-177.9	-66.9	-7.7	0	0	0	113.7	H702 S706	H702-N704 PolarHBondContact O-N 3.12Å; N704-S706 VanDerWaalsContact C-N 3.25Å; N704-S706 PolarHBondContact O-N 3.28Å; N704-S706 VanDerWaalsContact O-N 3.12Å
705	H	39.6	Very low	51.6	Low	44 Å²	44	90 Å²	90	20%	0.204	46%	0.458	C	S	.	.			trans	-87	34.5	-173.2	-68.2	-92.7	0	0	0	114.5	H702 K707 C708 F709	H702-H705 PolarHBondContact O-N 3.27Å; H705-K707 PolarHBondContact O-N 2.99Å; H705-C708 PolarHBondContact O-N 3.32Å; H705-F709 HydrophobicContact CB-CE2 4.42Å; H705-F709 VanDerWaalsContact O-CD2 3.26Å; H705-F709 WeakPolarHBondContact O-CD2 3.38Å; H705-F709 PolarHBondContact O-N 3.27Å
706	S	37.8	Very low	50.3	Low	75 Å²	75	87.1 Å²	87.1	52%	0.524	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-21.9	177.1	58.2	0	0	0	0	114	N704 F709 N710	N704-S706 VanDerWaalsContact C-N 3.25Å; N704-S706 PolarHBondContact O-N 3.28Å; N704-S706 VanDerWaalsContact O-N 3.12Å; S706-F709 PolarHBondContact O-N 3.17Å; S706-N710 VanDerWaalsContact O-CG 3.27Å; S706-N710 PolarHBondContact O-N 2.7Å; S706-N710 PolarHBondContact O-ND2 3.45Å
707	K	38	Very low	50.2	Low	185 Å²	185	87.6 Å²	87.6	80%	0.804	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-33.2	171.8	-68.2	-176	178.4	179	0	113.9	H705	H705-K707 PolarHBondContact O-N 2.99Å
708	C	39.4	Very low	50.3	Low	34 Å²	34	90.3 Å²	90.3	23%	0.23	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-36.2	174	-59.5	0	0	0	0	111.2	H705 N710	H705-C708 PolarHBondContact O-N 3.32Å; C708-N710 PolarHBondContact O-N 3.03Å; C708-N710 VanDerWaalsContact O-N 3.16Å
709	F	44	Very low	50.4	Low	88 Å²	88	89.2 Å²	89.2	39%	0.386	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-69.7	-4.3	174.2	-65.2	-70.7	0	0	0	114.2	W698 H705 S706 C711 T712	W698-F709 HydrophobicContact CB-CE1 4.23Å; W698-F709 HydrophobicContact CG-CE1 4.3Å; H705-F709 HydrophobicContact CB-CE2 4.42Å; H705-F709 VanDerWaalsContact O-CD2 3.26Å; H705-F709 WeakPolarHBondContact O-CD2 3.38Å; H705-F709 PolarHBondContact O-N 3.27Å; S706-F709 PolarHBondContact O-N 3.17Å; F709-C711 PolarHBondContact O-N 3.13Å; F709-T712 WeakPolarHBondContact O-CG2 3.43Å; F709-T712 PolarHBondContact O-N 2.99Å; F709-T712 PolarHBondContact O-OG1 3.42Å
710	N	38.3	Very low	50.7	Low	87 Å²	87	92.2 Å²	92.2	47%	0.465	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-74.9	5.7	178.6	-91.4	-23.6	0	0	0	115.2	S706 C708 T712 K713	S706-N710 VanDerWaalsContact O-CG 3.27Å; S706-N710 PolarHBondContact O-N 2.7Å; S706-N710 PolarHBondContact O-ND2 3.45Å; C708-N710 PolarHBondContact O-N 3.03Å; C708-N710 VanDerWaalsContact O-N 3.16Å; N710-T712 PolarHBondContact O-N 2.85Å; N710-K713 PolarHBondContact O-N 2.91Å
711	C	37.8	Very low	51.3	Low	38 Å²	38	91.4 Å²	91.4	26%	0.257	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-65.9	7.5	157	-58.8	0	0	0	0	113.3	F709 S716	F709-C711 PolarHBondContact O-N 3.13Å; C711-S716 WeakPolarHBondContact CA-OG 3.44Å; C711-S716 PolarHBondContact O-OG 2.84Å
712	T	35.3	Very low	53	Low	113 Å²	113	87.3 Å²	87.3	69%	0.693	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-83.8	-6.3	164.1	45.3	0	0	0	0	113.4	F709 N710	F709-T712 WeakPolarHBondContact O-CG2 3.43Å; F709-T712 PolarHBondContact O-N 2.99Å; F709-T712 PolarHBondContact O-OG1 3.42Å; N710-T712 PolarHBondContact O-N 2.85Å
713	K	36.8	Very low	55.1	Low	130 Å²	130	82 Å²	82	57%	0.565	43%	0.428	S	S	*	.	S	Bend	trans	-63	132.4	163.3	-78.8	-168.9	170.9	-166.1	0	109.5	N710 E715 S716	N710-K713 PolarHBondContact O-N 2.91Å; K713-E715 PolarHBondContact O-N 3.46Å; K713-S716 PolarHBondContact O-N 2.85Å; K713-S716 PolarHBondContact O-OG 2.84Å; K713-S716 VanDerWaalsContact O-OG 3.1Å
714	P	42.7	Very low	57.5	Low	137 Å²	137	74.2 Å²	74.2	89%	0.89	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-2.5	-178.5	28.3	-35.7	0	0	0	114.6
715	E	41.9	Very low	60.1	Low	174 Å²	174	67.3 Å²	67.3	81%	0.813	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	-10	-179.4	-60.1	174.8	140.4	0	0	113.5	K713 N717	K713-E715 PolarHBondContact O-N 3.46Å; E715-N717 PolarHBondContact O-N 3.11Å
716	S	56	Low	62.6	Low	40 Å²	40	65.2 Å²	65.2	28%	0.28	35%	0.349	S	S	.	.	S	Bend	trans	-73.2	119.8	176.6	58.4	0	0	0	0	109.8	C711 K713 M718	C711-S716 WeakPolarHBondContact CA-OG 3.44Å; C711-S716 PolarHBondContact O-OG 2.84Å; K713-S716 PolarHBondContact O-N 2.85Å; K713-S716 PolarHBondContact O-OG 2.84Å; K713-S716 VanDerWaalsContact O-OG 3.1Å; S716-M718 PolarHBondContact O-N 3.3Å
717	N	75.7	Confident	65.1	Low	81 Å²	81	61.6 Å²	61.6	43%	0.433	32%	0.324	S	S	.	.			trans	-56	139.4	-175.9	-176.2	20.7	0	0	0	111.3	E715 S719 D720 S721	E715-N717 PolarHBondContact O-N 3.11Å; N717-S719 PolarHBondContact O-N 2.86Å; N717-D720 HydrophobicContact CB-CB 4.39Å; N717-D720 PolarHBondContact ND2-OD1 2.89Å; N717-D720 PolarHBondContact O-N 2.95Å; N717-S721 PolarHBondContact O-N 3.13Å; N717-S721 VanDerWaalsContact O-N 3.16Å; N717-S721 PolarHBondContact O-OG 3.49Å
718	M	83.8	Confident	67.4	Low	58 Å²	58	52.8 Å²	52.8	29%	0.286	29%	0.286	S	S	.	.	H	α-helix	trans	-59.9	-39.3	-176	-120.7	-64.4	-162.4	0	0	110.7	P691 T692 W694 R695 S716 S721 L722 L802	P691-M718 WeakPolarHBondContact O-CE 3.38Å; T692-M718 HydrophobicContact CG2-CE 3.97Å; W694-M718 HydrophobicContact CH2-SD 4.35Å; W694-M718 HydrophobicContact CZ2-CE 4.39Å; W694-M718 HydrophobicContact CZ2-SD 3.67Å; R695-M718 PolarHBondContact NH2-SD 2.93Å; S716-M718 PolarHBondContact O-N 3.3Å; M718-S721 PolarHBondContact O-N 3.43Å; M718-L722 PolarHBondContact O-N 3.41Å; M718-L722 VanDerWaalsContact O-N 3.16Å; M718-L802 HydrophobicContact CB-CD1 3.84Å; M718-L802 HydrophobicContact SD-CD2 3.93Å
719	S	87.1	Confident	69.9	Low	8 Å²	8	51.2 Å²	51.2	6%	0.056	28%	0.275	C	S	.	.	H	α-helix	trans	-66.3	-50.6	179	-66.2	0	0	0	0	112.6	N717 S721 L722 A723 V798 Q799 L802	N717-S719 PolarHBondContact O-N 2.86Å; S719-S721 PolarHBondContact O-N 3.03Å; S719-L722 PolarHBondContact O-N 3.18Å; S719-A723 PolarHBondContact O-N 3.04Å; S719-V798 WeakPolarHBondContact O-CG1 3.09Å; S719-Q799 PolarHBondContact OG-OE1 3.14Å; S719-Q799 VanDerWaalsContact OG-OE1 3.09Å; S719-L802 WeakPolarHBondContact OG-CD1 3.27Å
720	D	84.3	Confident	72.1	Confident	72 Å²	72	47 Å²	47	39%	0.385	26%	0.257	S	S	.	.	H	α-helix	trans	-56.6	-40.2	177.6	-47.2	5.1	0	0	0	111	N717 L722 A723 L724 N785	N717-D720 HydrophobicContact CB-CB 4.39Å; N717-D720 PolarHBondContact ND2-OD1 2.89Å; N717-D720 PolarHBondContact O-N 2.95Å; D720-L722 PolarHBondContact O-N 3Å; D720-A723 PolarHBondContact O-N 3.47Å; D720-L724 WeakPolarHBondContact O-CB 3.21Å; D720-L724 PolarHBondContact O-N 3.47Å; D720-N785 PolarHBondContact OD1-ND2 3.39Å
721	S	85.4	Confident	74.4	Confident	5 Å²	5	46.6 Å²	46.6	4%	0.035	25%	0.249	C	C	.	.	H	α-helix	trans	-65.3	-37	178.6	-56.5	0	0	0	0	112.6	N717 M718 S719 W725	N717-S721 PolarHBondContact O-N 3.13Å; N717-S721 VanDerWaalsContact O-N 3.16Å; N717-S721 PolarHBondContact O-OG 3.49Å; M718-S721 PolarHBondContact O-N 3.43Å; S719-S721 PolarHBondContact O-N 3.03Å; S721-W725 WeakPolarHBondContact O-CB 3.48Å; S721-W725 PolarHBondContact O-N 2.97Å; S721-W725 VanDerWaalsContact O-N 3.12Å
722	L	90.2	Very high	76.7	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-79	-33.6	176.9	179.5	58.9	0	0	0	112	W694 M718 S719 D720 W725 F726 V798 V801 L802 L805 I945	W694-L722 HydrophobicContact CD2-CD1 3.83Å; W694-L722 HydrophobicContact CE3-CD1 4.04Å; W694-L722 HydrophobicContact CG-CD1 4.25Å; W694-L722 HydrophobicContact CH2-CB 3.8Å; W694-L722 HydrophobicContact CH2-CD1 4.41Å; W694-L722 HydrophobicContact CZ2-CB 3.86Å; W694-L722 HydrophobicContact CZ2-CD1 4.23Å; W694-L722 HydrophobicContact CZ2-CG 4.47Å; W694-L722 HydrophobicContact CZ3-CB 4.32Å; W694-L722 HydrophobicContact CZ3-CD1 4.32Å; M718-L722 PolarHBondContact O-N 3.41Å; M718-L722 VanDerWaalsContact O-N 3.16Å; S719-L722 PolarHBondContact O-N 3.18Å; D720-L722 PolarHBondContact O-N 3Å; L722-W725 HydrophobicContact CD1-CB 4.5Å; L722-W725 HydrophobicContact CD1-CD2 4.44Å; L722-W725 HydrophobicContact CD1-CE3 3.94Å; L722-W725 PolarHBondContact O-N 2.86Å; L722-F726 HydrophobicContact CD1-CD2 3.99Å; L722-F726 HydrophobicContact CD1-CE1 4.41Å; L722-F726 HydrophobicContact CD1-CE2 3.68Å; L722-F726 HydrophobicContact CD1-CG 4.48Å; L722-F726 HydrophobicContact CD1-CZ 3.91Å; L722-F726 HydrophobicContact CD2-CE2 3.89Å; L722-F726 HydrophobicContact CD2-CZ 4.4Å; L722-F726 HydrophobicContact CG-CD2 3.86Å; L722-F726 HydrophobicContact CG-CE2 3.55Å; L722-F726 HydrophobicContact CG-CZ 4.23Å; L722-F726 WeakPolarHBondContact O-CD2 3.44Å; L722-F726 PolarHBondContact O-N 3.29Å; L722-V798 HydrophobicContact CB-CG1 3.77Å; L722-V798 HydrophobicContact CD2-CG1 3.81Å; L722-V798 HydrophobicContact CG-CG1 3.85Å; L722-V801 HydrophobicContact CD2-CB 4.45Å; L722-V801 HydrophobicContact CD2-CG1 4.12Å; L722-L802 HydrophobicContact CD2-CD2 3.65Å; L722-L802 HydrophobicContact CD2-CG 3.84Å; L722-L805 HydrophobicContact CD2-CD1 4.35Å; L722-I945 HydrophobicContact CD1-CD1 4.11Å
723	A	89.9	Confident	79.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.2	-45.2	171.8	0	0	0	0	0	111.4	S719 D720 W725 F726 S727 V781 N785 V798	S719-A723 PolarHBondContact O-N 3.04Å; D720-A723 PolarHBondContact O-N 3.47Å; A723-W725 VanDerWaalsContact C-N 3.34Å; A723-F726 PolarHBondContact O-N 3.11Å; A723-S727 WeakPolarHBondContact O-CB 3.3Å; A723-S727 PolarHBondContact O-N 3.39Å; A723-S727 PolarHBondContact O-OG 3.32Å; A723-V781 HydrophobicContact CB-CG1 4.11Å; A723-N785 HydrophobicContact CB-CB 4.2Å; A723-N785 WeakPolarHBondContact CB-OD1 3.36Å; A723-V798 HydrophobicContact CB-CG2 3.95Å
724	L	87.2	Confident	81.7	Confident	44 Å²	44	36.4 Å²	36.4	23%	0.23	21%	0.205	C	C	.	.	H	α-helix	trans	-65.5	-36.6	175.6	-165.3	71.5	0	0	0	112	I452 W698 D720 S727 A728	I452-L724 HydrophobicContact CB-CD1 4.22Å; I452-L724 HydrophobicContact CD1-CD1 3.73Å; I452-L724 HydrophobicContact CD1-CG 3.92Å; W698-L724 HydrophobicContact CH2-CD2 4.1Å; W698-L724 HydrophobicContact CH2-CG 4.08Å; W698-L724 HydrophobicContact CZ2-CD2 4.44Å; D720-L724 WeakPolarHBondContact O-CB 3.21Å; D720-L724 PolarHBondContact O-N 3.47Å; L724-S727 WeakPolarHBondContact CA-OG 3.32Å; L724-S727 PolarHBondContact O-OG 3.13Å; L724-S727 VanDerWaalsContact O-OG 3.11Å; L724-A728 VanDerWaalsContact O-CB 3.26Å; L724-A728 WeakPolarHBondContact O-CB 3.42Å; L724-A728 PolarHBondContact O-N 3.45Å
725	W	90.3	Very high	84	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.8	-46.7	175.8	-175.7	90.5	0	0	0	112.4	L688 W694 V697 W698 S721 L722 A723 A728 W729 P736 I945 L947	L688-W725 HydrophobicContact CD1-CH2 4.09Å; L688-W725 HydrophobicContact CD1-CZ2 3.82Å; W694-W725 HydrophobicContact CB-CD2 4.34Å; W694-W725 HydrophobicContact CB-CH2 4.16Å; W694-W725 HydrophobicContact CB-CZ2 3.76Å; W694-W725 HydrophobicContact CE3-CB 3.97Å; W694-W725 AromaticContact CE3-CD1 3.74Å; W694-W725 HydrophobicContact CE3-CD2 4.05Å; W694-W725 AromaticContact CE3-CG 3.65Å; W694-W725 HydrophobicContact CE3-CG 3.65Å; W694-W725 HydrophobicContact CZ3-CB 3.92Å; W694-W725 HydrophobicContact CZ3-CG 4.09Å; W694-W725 PolarHBondContact O-NE1 3.4Å; V697-W725 PolarHBondContact O-NE1 3.33Å; W698-W725 AromaticContact CD1-CD1 3.86Å; W698-W725 AromaticContact NE1-CD1 3.63Å; S721-W725 WeakPolarHBondContact O-CB 3.48Å; S721-W725 PolarHBondContact O-N 2.97Å; S721-W725 VanDerWaalsContact O-N 3.12Å; L722-W725 HydrophobicContact CD1-CB 4.5Å; L722-W725 HydrophobicContact CD1-CD2 4.44Å; L722-W725 HydrophobicContact CD1-CE3 3.94Å; L722-W725 PolarHBondContact O-N 2.86Å; A723-W725 VanDerWaalsContact C-N 3.34Å; W725-A728 PolarHBondContact O-N 3.43Å; W725-W729 AromaticContact CD2-CD1 3.61Å; W725-W729 AromaticContact CD2-NE1 3.89Å; W725-W729 AromaticContact CE2-CD1 3.4Å; W725-W729 AromaticContact CE2-NE1 3.19Å; W725-W729 AromaticContact CE3-CD1 3.93Å; W725-W729 AromaticContact CH2-CD1 3.9Å; W725-W729 AromaticContact CZ2-CD1 3.58Å; W725-W729 AromaticContact CZ2-NE1 3.3Å; W725-W729 VanDerWaalsContact CZ2-NE1 3.3Å; W725-W729 AromaticContact NE1-CD1 3.81Å; W725-W729 AromaticContact NE1-NE1 3.31Å; W725-W729 VanDerWaalsContact O-CD1 3.3Å; W725-W729 PolarHBondContact O-N 2.77Å; W725-W729 VanDerWaalsContact O-N 3.15Å; W725-P736 HydrophobicContact CZ3-CB 4.4Å; W725-I945 HydrophobicContact CE3-CD1 4.4Å; W725-I945 HydrophobicContact CH2-CB 4.4Å; W725-I945 HydrophobicContact CH2-CD1 4.09Å; W725-I945 HydrophobicContact CH2-CG2 3.87Å; W725-I945 HydrophobicContact CZ3-CD1 3.73Å; W725-I945 HydrophobicContact CZ3-CG2 3.99Å; W725-L947 HydrophobicContact CH2-CD1 3.97Å; W725-L947 HydrophobicContact CH2-CD2 3.82Å; W725-L947 HydrophobicContact CH2-CG 3.92Å; W725-L947 HydrophobicContact CZ2-CD1 3.88Å; W725-L947 HydrophobicContact CZ2-CD2 4.45Å; W725-L947 HydrophobicContact CZ2-CG 4.35Å; W725-L947 HydrophobicContact CZ3-CD2 4.43Å
726	F	92.6	Very high	86.4	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.3	-50.9	175.7	-78.1	-48.5	0	0	0	111.2	L722 A723 A728 W729 L730 P736 V778 V781 V787 V801 I945	L722-F726 HydrophobicContact CD1-CD2 3.99Å; L722-F726 HydrophobicContact CD1-CE1 4.41Å; L722-F726 HydrophobicContact CD1-CE2 3.68Å; L722-F726 HydrophobicContact CD1-CG 4.48Å; L722-F726 HydrophobicContact CD1-CZ 3.91Å; L722-F726 HydrophobicContact CD2-CE2 3.89Å; L722-F726 HydrophobicContact CD2-CZ 4.4Å; L722-F726 HydrophobicContact CG-CD2 3.86Å; L722-F726 HydrophobicContact CG-CE2 3.55Å; L722-F726 HydrophobicContact CG-CZ 4.23Å; L722-F726 WeakPolarHBondContact O-CD2 3.44Å; L722-F726 PolarHBondContact O-N 3.29Å; A723-F726 PolarHBondContact O-N 3.11Å; F726-A728 VanDerWaalsContact C-N 3.3Å; F726-A728 PolarHBondContact O-N 3.43Å; F726-W729 PolarHBondContact O-N 2.98Å; F726-L730 WeakPolarHBondContact O-CB 3.3Å; F726-L730 WeakPolarHBondContact O-CD1 3.43Å; F726-L730 WeakPolarHBondContact O-CG 3.35Å; F726-L730 PolarHBondContact O-N 2.82Å; F726-P736 HydrophobicContact CD1-CB 3.74Å; F726-P736 HydrophobicContact CD1-CG 3.67Å; F726-P736 HydrophobicContact CE1-CB 3.67Å; F726-P736 HydrophobicContact CE1-CG 4.15Å; F726-V778 HydrophobicContact CD1-CG1 4.12Å; F726-V778 HydrophobicContact CD1-CG2 4.36Å; F726-V778 HydrophobicContact CE1-CG1 4.46Å; F726-V778 HydrophobicContact CE1-CG2 3.87Å; F726-V778 HydrophobicContact CG-CG1 4.32Å; F726-V778 HydrophobicContact CZ-CG2 4.11Å; F726-V781 HydrophobicContact CB-CG2 3.61Å; F726-V787 HydrophobicContact CD2-CG2 4.14Å; F726-V787 HydrophobicContact CE2-CG2 4.18Å; F726-V801 HydrophobicContact CE2-CG1 4.12Å; F726-V801 HydrophobicContact CZ-CG1 4.01Å; F726-I945 HydrophobicContact CE1-CD1 3.83Å; F726-I945 HydrophobicContact CE1-CG2 4.43Å; F726-I945 HydrophobicContact CZ-CD1 3.81Å
727	S	89.6	Confident	88.1	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-60.9	-36.3	179.2	51.7	0	0	0	0	112.8	A723 L724 Y731	A723-S727 WeakPolarHBondContact O-CB 3.3Å; A723-S727 PolarHBondContact O-N 3.39Å; A723-S727 PolarHBondContact O-OG 3.32Å; L724-S727 WeakPolarHBondContact CA-OG 3.32Å; L724-S727 PolarHBondContact O-OG 3.13Å; L724-S727 VanDerWaalsContact O-OG 3.11Å; S727-Y731 WeakPolarHBondContact O-CB 2.99Å; S727-Y731 PolarHBondContact O-N 2.97Å
728	A	87.9	Confident	88.8	Confident	0 Å²	0	16 Å²	16	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-61.2	-49.4	172.9	0	0	0	0	0	112.8	I452 W698 P699 F700 L724 W725 F726 Y731 C732	I452-A728 HydrophobicContact CD1-CB 4Å; W698-A728 HydrophobicContact CE3-CB 4.32Å; W698-A728 HydrophobicContact CH2-CB 4.08Å; W698-A728 HydrophobicContact CZ3-CB 3.7Å; P699-A728 HydrophobicContact CG-CB 3.87Å; F700-A728 HydrophobicContact CE2-CB 4.12Å; L724-A728 VanDerWaalsContact O-CB 3.26Å; L724-A728 WeakPolarHBondContact O-CB 3.42Å; L724-A728 PolarHBondContact O-N 3.45Å; W725-A728 PolarHBondContact O-N 3.43Å; F726-A728 VanDerWaalsContact C-N 3.3Å; F726-A728 PolarHBondContact O-N 3.43Å; A728-Y731 PolarHBondContact O-N 2.84Å; A728-C732 PolarHBondContact O-N 3.03Å; A728-C732 VanDerWaalsContact O-N 3.15Å; A728-C732 PolarHBondContact O-SG 2.83Å; A728-C732 VanDerWaalsContact O-SG 3.38Å
729	W	90.4	Very high	88.8	Confident	0 Å²	0	13.2 Å²	13.2	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.9	-42.3	179.4	-79.8	110.8	0	0	0	112.8	V697 P699 W725 F726 C732 G733 A734 L947 I949 L956 T959 L960	V697-W729 HydrophobicContact CB-CZ2 4.29Å; V697-W729 HydrophobicContact CG1-CH2 4.02Å; V697-W729 HydrophobicContact CG1-CZ2 3.57Å; P699-W729 HydrophobicContact CB-CD2 4.18Å; P699-W729 HydrophobicContact CB-CE3 3.91Å; P699-W729 HydrophobicContact CB-CH2 4.22Å; P699-W729 HydrophobicContact CB-CZ2 4.43Å; P699-W729 HydrophobicContact CB-CZ3 3.94Å; P699-W729 HydrophobicContact CG-CD2 4.2Å; P699-W729 HydrophobicContact CG-CE3 4.4Å; W725-W729 AromaticContact CD2-CD1 3.61Å; W725-W729 AromaticContact CD2-NE1 3.89Å; W725-W729 AromaticContact CE2-CD1 3.4Å; W725-W729 AromaticContact CE2-NE1 3.19Å; W725-W729 AromaticContact CE3-CD1 3.93Å; W725-W729 AromaticContact CH2-CD1 3.9Å; W725-W729 AromaticContact CZ2-CD1 3.58Å; W725-W729 AromaticContact CZ2-NE1 3.3Å; W725-W729 VanDerWaalsContact CZ2-NE1 3.3Å; W725-W729 AromaticContact NE1-CD1 3.81Å; W725-W729 AromaticContact NE1-NE1 3.31Å; W725-W729 VanDerWaalsContact O-CD1 3.3Å; W725-W729 PolarHBondContact O-N 2.77Å; W725-W729 VanDerWaalsContact O-N 3.15Å; F726-W729 PolarHBondContact O-N 2.98Å; W729-C732 PolarHBondContact O-N 3.16Å; W729-G733 PolarHBondContact O-N 2.87Å; W729-A734 HydrophobicContact CB-CB 4.27Å; W729-A734 HydrophobicContact CD2-CB 4.4Å; W729-A734 HydrophobicContact CE3-CB 3.58Å; W729-A734 HydrophobicContact CZ3-CB 4.34Å; W729-A734 WeakPolarHBondContact O-CB 3.47Å; W729-A734 PolarHBondContact O-N 3.17Å; W729-L947 HydrophobicContact CB-CD2 4.21Å; W729-L947 HydrophobicContact CD2-CD1 3.92Å; W729-L947 HydrophobicContact CD2-CD2 3.97Å; W729-L947 VanDerWaalsContact CE2-CD1 3.49Å; W729-L947 HydrophobicContact CE3-CD1 4.39Å; W729-L947 HydrophobicContact CE3-CD2 4.48Å; W729-L947 HydrophobicContact CG-CD1 4.43Å; W729-L947 HydrophobicContact CG-CD2 3.85Å; W729-L947 HydrophobicContact CH2-CD1 4.13Å; W729-L947 HydrophobicContact CZ2-CD1 3.63Å; W729-L947 HydrophobicContact CZ3-CD1 4.48Å; W729-I949 HydrophobicContact CE3-CD1 4.41Å; W729-I949 HydrophobicContact CH2-CD1 4.48Å; W729-I949 HydrophobicContact CZ3-CD1 3.73Å; W729-L956 HydrophobicContact CZ3-CD2 4.21Å; W729-T959 HydrophobicContact CH2-CG2 4.36Å; W729-L960 HydrophobicContact CH2-CD1 4.35Å
730	L	91.1	Very high	88.6	Confident	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-62.5	-43.3	176.8	-65	166.7	0	0	0	111.4	F456 L458 F726 C732 G733 P736 V778 V781	F456-L730 HydrophobicContact CD1-CB 3.51Å; F456-L730 HydrophobicContact CD1-CD1 4.42Å; F456-L730 VanDerWaalsContact CE1-C 3.44Å; F456-L730 HydrophobicContact CE1-CB 3.67Å; F456-L730 WeakPolarHBondContact CE1-O 3.45Å; L458-L730 HydrophobicContact CD1-CD2 3.43Å; L458-L730 VanDerWaalsContact CD1-CD2 3.43Å; L458-L730 HydrophobicContact CG-CB 4.47Å; L458-L730 HydrophobicContact CG-CD2 3.88Å; F726-L730 WeakPolarHBondContact O-CB 3.3Å; F726-L730 WeakPolarHBondContact O-CD1 3.43Å; F726-L730 WeakPolarHBondContact O-CG 3.35Å; F726-L730 PolarHBondContact O-N 2.82Å; L730-C732 VanDerWaalsContact C-N 3.29Å; L730-C732 PolarHBondContact O-N 3.33Å; L730-G733 PolarHBondContact O-N 3.47Å; L730-P736 HydrophobicContact CD2-CG 4.18Å; L730-P736 HydrophobicContact CG-CG 4.38Å; L730-V778 HydrophobicContact CD1-CG1 4.13Å; L730-V778 HydrophobicContact CD2-CG1 4.42Å; L730-V781 HydrophobicContact CD1-CG2 3.89Å
731	Y	87.3	Confident	88.2	Confident	78 Å²	78	11.4 Å²	11.4	31%	0.306	7%	0.066	S	C	.	.	H	α-helix	trans	-61.4	-37.2	176.9	178.3	-103.9	0	0	0	112.5	P453 F456 S727 A728 G733	P453-Y731 HydrophobicContact CG-CD2 3.34Å; P453-Y731 HydrophobicContact CG-CE2 3.69Å; P453-Y731 HydrophobicContact CG-CG 4.09Å; F456-Y731 HydrophobicContact CD2-CD2 4.18Å; F456-Y731 AromaticContact CE2-CD2 3.84Å; F456-Y731 HydrophobicContact CE2-CD2 3.84Å; S727-Y731 WeakPolarHBondContact O-CB 2.99Å; S727-Y731 PolarHBondContact O-N 2.97Å; A728-Y731 PolarHBondContact O-N 2.84Å; Y731-G733 PolarHBondContact O-N 3.27Å
732	C	86.1	Confident	87.5	Confident	32 Å²	32	13.1 Å²	13.1	22%	0.216	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-5.6	173.5	-69.7	0	0	0	0	114	P699 A728 W729 L730 L956	P699-C732 HydrophobicContact CB-CB 4.33Å; A728-C732 PolarHBondContact O-N 3.03Å; A728-C732 VanDerWaalsContact O-N 3.15Å; A728-C732 PolarHBondContact O-SG 2.83Å; A728-C732 VanDerWaalsContact O-SG 3.38Å; W729-C732 PolarHBondContact O-N 3.16Å; L730-C732 VanDerWaalsContact C-N 3.29Å; L730-C732 PolarHBondContact O-N 3.33Å; C732-L956 HydrophobicContact CB-CD1 3.77Å; C732-L956 HydrophobicContact CB-CD2 3.99Å; C732-L956 WeakPolarHBondContact O-CD1 3.35Å
733	G	85.5	Confident	86	Confident	36 Å²	36	17.8 Å²	17.8	37%	0.371	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	84	19.1	-179.7	0	0	0	0	0	114.7	L481 W729 L730 Y731	L481-G733 WeakPolarHBondContact CD2-O 3.11Å; W729-G733 PolarHBondContact O-N 2.87Å; L730-G733 PolarHBondContact O-N 3.47Å; Y731-G733 PolarHBondContact O-N 3.27Å
734	A	90.4	Very high	83.9	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.119	C	C	.	.			trans	-92	157.6	168.5	0	0	0	0	0	111.3	W729 F948 I949	W729-A734 HydrophobicContact CB-CB 4.27Å; W729-A734 HydrophobicContact CD2-CB 4.4Å; W729-A734 HydrophobicContact CE3-CB 3.58Å; W729-A734 HydrophobicContact CZ3-CB 4.34Å; W729-A734 WeakPolarHBondContact O-CB 3.47Å; W729-A734 PolarHBondContact O-N 3.17Å; A734-F948 WeakPolarHBondContact CA-O 3.18Å; A734-I949 HydrophobicContact CB-CD1 4.17Å; A734-I949 HydrophobicContact CB-CG1 3.88Å
735	I	91.3	Very high	81.5	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	114.9	-179	-59.9	-177.9	0	0	0	110.3	L458 I477 C480 L481 V737 L777 L947 F948	L458-I735 HydrophobicContact CD1-CG1 4.13Å; I477-I735 HydrophobicContact CB-CD1 4.44Å; I477-I735 HydrophobicContact CG1-CG2 4.45Å; I477-I735 HydrophobicContact CG2-CD1 4.23Å; I477-I735 WeakPolarHBondContact O-CD1 3.24Å; C480-I735 HydrophobicContact CB-CD1 3.49Å; C480-I735 VanDerWaalsContact CB-CD1 3.49Å; C480-I735 HydrophobicContact CB-CG1 4.28Å; L481-I735 HydrophobicContact CD2-CD1 3.99Å; L481-I735 HydrophobicContact CD2-CG1 4.04Å; L481-I735 HydrophobicContact CG-CD1 3.65Å; L481-I735 HydrophobicContact CG-CG1 4.26Å; I735-V737 HydrophobicContact CG2-CG2 3.96Å; I735-L777 HydrophobicContact CD1-CD1 4.46Å; I735-L777 HydrophobicContact CG2-CD1 3.47Å; I735-L777 VanDerWaalsContact CG2-CD1 3.47Å; I735-L777 HydrophobicContact CG2-CD2 4.44Å; I735-L777 HydrophobicContact CG2-CG 3.66Å; I735-L947 CarbonylContact O-C 3.56Å; I735-L947 WeakPolarHBondContact O-CA 3.48Å; I735-F948 HydrophobicContact CB-CB 4.47Å; I735-F948 PolarHBondContact N-O 3Å; I735-F948 PolarHBondContact O-N 3.07Å
736	P	93	Very high	78.8	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	137.8	164.2	-1.4	19	0	0	0	110.9	W725 F726 L730 V778 I945 S946 L947	W725-P736 HydrophobicContact CZ3-CB 4.4Å; F726-P736 HydrophobicContact CD1-CB 3.74Å; F726-P736 HydrophobicContact CD1-CG 3.67Å; F726-P736 HydrophobicContact CE1-CB 3.67Å; F726-P736 HydrophobicContact CE1-CG 4.15Å; L730-P736 HydrophobicContact CD2-CG 4.18Å; L730-P736 HydrophobicContact CG-CG 4.38Å; P736-V778 HydrophobicContact CB-CB 3.98Å; P736-V778 HydrophobicContact CB-CG2 4.18Å; P736-V778 HydrophobicContact CG-CB 4.06Å; P736-V778 HydrophobicContact CG-CG1 4.22Å; P736-V778 WeakPolarHBondContact O-CB 3.48Å; P736-V778 PolarHBondContact O-N 3.23Å; P736-I945 HydrophobicContact CB-CG2 3.9Å; P736-S946 CarbonylContact C-O 2.95Å; P736-S946 WeakPolarHBondContact CA-O 3.5Å; P736-L947 HydrophobicContact CB-CD2 4.22Å; P736-L947 HydrophobicContact CG-CD2 4.33Å
737	V	90.7	Very high	75.8	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	117.6	172.6	-177.2	0	0	0	0	108.6	T473 I477 L661 I735 A739 H775 R776 L777 S946 F948	T473-V737 HydrophobicContact CG2-CG1 3.93Å; I477-V737 HydrophobicContact CD1-CG2 4.09Å; I477-V737 HydrophobicContact CG1-CG2 4.05Å; L661-V737 HydrophobicContact CD2-CB 4.39Å; L661-V737 HydrophobicContact CD2-CG1 3.77Å; I735-V737 HydrophobicContact CG2-CG2 3.96Å; V737-A739 PolarHBondContact O-N 3.48Å; V737-H775 HydrophobicContact CG1-CB 4.02Å; V737-R776 CarbonylContact C-O 3.58Å; V737-R776 WeakPolarHBondContact CA-O 3.37Å; V737-L777 HydrophobicContact CG2-CB 4.27Å; V737-L777 HydrophobicContact CG2-CD1 4.46Å; V737-L777 HydrophobicContact CG2-CG 4.36Å; V737-S946 PolarHBondContact N-O 3.46Å; V737-S946 PolarHBondContact O-N 3.26Å; V737-F948 HydrophobicContact CB-CE2 4.24Å; V737-F948 HydrophobicContact CG2-CD2 3.83Å; V737-F948 HydrophobicContact CG2-CE2 3.96Å
738	L	90.6	Very high	72.9	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	120.4	177.3	179.2	62.5	0	0	0	109.8	Q740 H775 R776 L789 V801 L805	L738-Q740 HydrophobicContact CD2-CB 4.48Å; L738-Q740 HydrophobicContact CG-CB 4.23Å; L738-H775 WeakPolarHBondContact O-CA 3.02Å; L738-R776 PolarHBondContact N-O 2.8Å; L738-R776 PolarHBondContact O-N 3.22Å; L738-L789 HydrophobicContact CD2-CD1 4.29Å; L738-V801 HydrophobicContact CD1-CG1 4.08Å; L738-V801 HydrophobicContact CD2-CG1 4.03Å; L738-V801 HydrophobicContact CD2-CG2 4.4Å; L738-L805 HydrophobicContact CD1-CD2 3.82Å; L738-L805 HydrophobicContact CD1-CG 4.09Å
739	A	84.2	Confident	70	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	106.5	166.1	0	0	0	0	0	108.6	A658 F687 V737 S774 H775 P943 G944	A658-A739 HydrophobicContact CB-CB 4.35Å; F687-A739 HydrophobicContact CE2-CB 3.98Å; V737-A739 PolarHBondContact O-N 3.48Å; A739-S774 WeakPolarHBondContact CA-O 3.49Å; A739-H775 WeakPolarHBondContact CB-ND1 3.42Å; A739-P943 VanDerWaalsContact O-CA 3.26Å; A739-P943 WeakPolarHBondContact O-CA 3.45Å; A739-P943 WeakPolarHBondContact O-CB 3.34Å; A739-G944 PolarHBondContact N-O 2.95Å; A739-G944 PolarHBondContact O-N 3.27Å
740	Q	83.7	Confident	67	Low	12 Å²	12	53.3 Å²	53.3	6%	0.056	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	152.4	-179.7	71.3	177.7	44.4	0	0	111.6	L738 S774 Y800 Q804	L738-Q740 HydrophobicContact CD2-CB 4.48Å; L738-Q740 HydrophobicContact CG-CB 4.23Å; Q740-S774 WeakPolarHBondContact CG-OG 3.47Å; Q740-S774 PolarHBondContact N-O 3.05Å; Q740-S774 PolarHBondContact O-N 3.27Å; Q740-S774 PolarHBondContact O-OG 3.14Å; Q740-Y800 PolarHBondContact NE2-OH 2.79Å; Q740-Q804 HydrophobicContact CB-CB 4.31Å
741	L	74.2	Confident	63.9	Low	30 Å²	30	63.8 Å²	63.8	16%	0.157	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	139.3	174.2	-139.5	77.1	0	0	0	110.2	D743 L771 W773 P809	L741-D743 PolarHBondContact O-N 3.47Å; L741-L771 HydrophobicContact CD1-CB 4.19Å; L741-L771 HydrophobicContact CD1-CD2 4.16Å; L741-L771 HydrophobicContact CD2-CD2 4.17Å; L741-W773 HydrophobicContact CD1-CD2 3.84Å; L741-W773 HydrophobicContact CD1-CE3 3.93Å; L741-W773 HydrophobicContact CD1-CH2 3.71Å; L741-W773 HydrophobicContact CD1-CZ2 3.62Å; L741-W773 HydrophobicContact CD1-CZ3 3.86Å; L741-P809 HydrophobicContact CD1-CB 4.19Å; L741-P809 HydrophobicContact CD2-CB 4.18Å
742	C	71.7	Confident	60.9	Low	41 Å²	41	68.6 Å²	68.6	28%	0.277	37%	0.368	S	S	.	.			trans	-71.6	123.2	168.2	-75.5	0	0	0	0	109.9	S744 V772	C742-S744 PolarHBondContact O-N 2.9Å; C742-V772 HydrophobicContact CB-CB 4.07Å; C742-V772 HydrophobicContact CB-CG1 3.85Å; C742-V772 WeakPolarHBondContact CB-O 3.48Å; C742-V772 PolarHBondContact N-O 2.69Å
743	D	58.9	Low	58	Low	99 Å²	99	71.1 Å²	71.1	53%	0.529	38%	0.384	S	S	.	.			trans	-73.2	29.2	175.2	-67.6	-44	0	0	0	113.2	L741 A745 K807	L741-D743 PolarHBondContact O-N 3.47Å; D743-A745 PolarHBondContact O-N 3.19Å; D743-K807 IonicContact OD1-NZ 2.73Å; D743-K807 PolarHBondContact OD1-NZ 3.28Å; D743-K807 IonicContact OD2-NZ 3.18Å; D743-K807 PolarHBondContact OD2-NZ 3.13Å
744	S	45.9	Very low	55.1	Low	48 Å²	48	75.7 Å²	75.7	34%	0.336	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	32.1	-176.9	57.8	0	0	0	0	114.2	C742 S747	C742-S744 PolarHBondContact O-N 2.9Å; S744-S747 WeakPolarHBondContact CA-OG 3.31Å; S744-S747 WeakPolarHBondContact CB-OG 3.48Å
745	A	35.3	Very low	51.9	Low	72 Å²	72	82.3 Å²	82.3	60%	0.595	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-20.8	159.9	0	0	0	0	0	111.9	D743	D743-A745 PolarHBondContact O-N 3.19Å
746	Y	34.6	Very low	48.9	Very low	205 Å²	205	89.5 Å²	89.5	80%	0.804	48%	0.479	S	S	*	.	S	Bend	trans	-118.8	-24.1	-174.5	-78	-85.8	0	0	0	115.9
747	S	28.5	Very low	45.7	Very low	80 Å²	80	98 Å²	98	56%	0.559	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-15.5	-166.2	51.7	0	0	0	0	116.9	S744	S744-S747 WeakPolarHBondContact CA-OG 3.31Å; S744-S747 WeakPolarHBondContact CB-OG 3.48Å
748	N	29	Very low	42.7	Very low	130 Å²	130	106.5 Å²	106.5	70%	0.695	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	8.2	-179.5	-81.1	-10.2	0	0	0	114.5
749	A	27.1	Very low	39.6	Very low	78 Å²	78	115.1 Å²	115.1	65%	0.645	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-13.6	-177.7	0	0	0	0	0	114.6
750	Q	27.6	Very low	36.7	Very low	177 Å²	177	120.3 Å²	120.3	83%	0.827	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	2.3	-170.7	-73.2	-176	-26.7	0	0	115.7
751	Y	26.5	Very low	33.9	Very low	219 Å²	219	125.7 Å²	125.7	86%	0.859	68%	0.678	S	S	*	*	S	Bend	trans	-110.4	17.4	179.5	-90.5	-77.4	0	0	0	115.1
752	F	24	Very low	31.5	Very low	180 Å²	180	132.3 Å²	132.3	79%	0.789	71%	0.713	S	S	*	*	S	Bend	trans	-92.9	120.1	160.3	-76.5	-82.7	0	0	0	109.5
753	P	24.5	Very low	29.3	Very low	84 Å²	84	135.4 Å²	135.4	55%	0.545	74%	0.735	S	S	.	*			trans	-65.4	136.3	171.3	27.9	-32.9	0	0	0	109.4	D755	P753-D755 PolarHBondContact O-N 2.96Å
754	P	24.6	Very low	27.9	Very low	132 Å²	132	134.5 Å²	134.5	86%	0.857	74%	0.736	S	S	*	*	S	Bend	trans	-80.4	47.8	-172.8	34.8	-37.9	0	0	0	113.1
755	D	23.6	Very low	27.3	Very low	140 Å²	140	143.8 Å²	143.8	75%	0.749	76%	0.764	S	S	*	*			trans	-130.4	89	-179.1	-89.2	-50.3	0	0	0	111.4	P753	P753-D755 PolarHBondContact O-N 2.96Å
756	I	29	Very low	27.2	Very low	152 Å²	152	147.1 Å²	147.1	78%	0.779	76%	0.762	S	S	*	*			trans	-168.9	121.6	131.6	-94.9	151.3	0	0	0	107.5	Q758	I756-Q758 HydrophobicContact CG2-CB 4.31Å; I756-Q758 PolarHBondContact O-N 3.48Å; I756-Q758 VanDerWaalsContact O-N 3.1Å
757	L	26.4	Very low	27.3	Very low	178 Å²	178	141.8 Å²	141.8	93%	0.932	76%	0.755	S	S	*	*			trans	-72.1	97.9	171.2	-78.8	156.7	0	0	0	109.6
758	Q	27.6	Very low	27.9	Very low	179 Å²	179	139.7 Å²	139.7	84%	0.836	74%	0.742	S	S	*	*			trans	-125.5	86.5	162.9	-129.3	175.4	18.8	0	0	111.4	I756	I756-Q758 HydrophobicContact CG2-CB 4.31Å; I756-Q758 PolarHBondContact O-N 3.48Å; I756-Q758 VanDerWaalsContact O-N 3.1Å
759	Q	24.9	Very low	28.9	Very low	182 Å²	182	138 Å²	138	85%	0.85	73%	0.73	S	S	*	*			trans	-67.6	150	171.5	-152.5	167.2	11.7	0	0	109.6
760	S	23.5	Very low	30.1	Very low	108 Å²	108	138.8 Å²	138.8	76%	0.755	72%	0.721	S	S	*	*			trans	70.6	96.1	-175	74.9	0	0	0	0	117
761	C	24.4	Very low	31.5	Very low	126 Å²	126	131.2 Å²	131.2	85%	0.851	69%	0.686	S	S	*	*			trans	-171	103.7	136.4	-99.9	0	0	0	0	110.1	S763	C761-S763 PolarHBondContact O-N 3.02Å
762	N	24	Very low	33.2	Very low	168 Å²	168	122.4 Å²	122.4	90%	0.898	65%	0.654	S	S	*	*			trans	-77.8	83.7	-179.9	-72.9	-7.8	0	0	0	111.6
763	S	26	Very low	35.4	Very low	106 Å²	106	114.1 Å²	114.1	74%	0.741	62%	0.618	S	S	*	*			trans	-162	117.6	158	-83.6	0	0	0	0	110.2	C761 R765	C761-S763 PolarHBondContact O-N 3.02Å; S763-R765 PolarHBondContact O-N 3.4Å
764	S	29.3	Very low	37.8	Very low	80 Å²	80	111.3 Å²	111.3	56%	0.559	60%	0.601	S	S	*	*			trans	-64.9	119.4	176.3	44.9	0	0	0	0	110.2	Y766	S764-Y766 VanDerWaalsContact CB-CE2 3.44Å; S764-Y766 PolarHBondContact O-N 3.33Å; S764-Y766 WeakPolarHBondContact OG-CD2 3.47Å; S764-Y766 WeakPolarHBondContact OG-CE2 3.23Å
765	R	32.3	Very low	40.5	Very low	243 Å²	243	105.9 Å²	105.9	92%	0.917	56%	0.564	S	S	*	*			trans	-74	56.1	-179.1	-62.7	-175.2	-175.6	173.2	2.4	112.3	S763 S767	S763-R765 PolarHBondContact O-N 3.4Å; R765-S767 PolarHBondContact O-N 2.87Å
766	Y	34.8	Very low	43.5	Very low	143 Å²	143	99.5 Å²	99.5	56%	0.561	53%	0.529	S	S	*	.			trans	-74.1	77.9	168.7	-64.6	-58.8	0	0	0	109.7	S764	S764-Y766 VanDerWaalsContact CB-CE2 3.44Å; S764-Y766 PolarHBondContact O-N 3.33Å; S764-Y766 WeakPolarHBondContact OG-CD2 3.47Å; S764-Y766 WeakPolarHBondContact OG-CE2 3.23Å
767	S	36.2	Very low	46.4	Very low	93 Å²	93	92.3 Å²	92.3	65%	0.65	49%	0.492	S	S	*	.			trans	-52	146.5	159.2	51.5	0	0	0	0	109.6	R765 Q769	R765-S767 PolarHBondContact O-N 2.87Å; S767-Q769 PolarHBondContact O-N 2.69Å
768	A	41	Very low	49.6	Very low	35 Å²	35	83.8 Å²	83.8	29%	0.289	45%	0.448	S	S	.	.			trans	-48.4	128.1	-177.9	0	0	0	0	0	112	E770 R812	A768-E770 PolarHBondContact O-N 2.92Å; A768-E770 VanDerWaalsContact O-N 3.14Å; A768-R812 WeakPolarHBondContact CA-O 3.36Å; A768-R812 VanDerWaalsContact CB-O 3.31Å; A768-R812 WeakPolarHBondContact CB-O 3.25Å
769	Q	50.3	Low	52.7	Low	95 Å²	95	75.4 Å²	75.4	44%	0.444	41%	0.408	S	S	.	.	B	Isolated β-bridge	trans	-77.9	104.8	179.4	-77.4	175.9	-68.6	0	0	108.5	S767 R812	S767-Q769 PolarHBondContact O-N 2.69Å; Q769-R812 HydrophobicContact CB-CB 4.41Å; Q769-R812 PolarHBondContact N-O 2.87Å
770	E	51.2	Low	55.9	Low	95 Å²	95	66.8 Å²	66.8	44%	0.444	37%	0.368	S	S	.	.			trans	-77.7	134.4	178.2	-170.9	171	-123.6	0	0	109.9	R655 A768 V772	R655-E770 HydrophobicContact CB-CG 4.43Å; R655-E770 VanDerWaalsContact CD-CD 3.41Å; R655-E770 VanDerWaalsContact CD-OE1 3.22Å; R655-E770 WeakPolarHBondContact CD-OE1 3.35Å; R655-E770 WeakPolarHBondContact CD-OE2 3.19Å; R655-E770 HydrophobicContact CG-CG 4.18Å; R655-E770 VanDerWaalsContact CZ-CD 3.46Å; R655-E770 IonicContact CZ-OE1 3.55Å; R655-E770 IonicContact CZ-OE2 2.97Å; R655-E770 IonicContact NE-OE1 3.91Å; R655-E770 IonicContact NE-OE2 2.71Å; R655-E770 PolarHBondContact NE-OE2 3.46Å; R655-E770 IonicContact NH1-OE1 2.72Å; R655-E770 PolarHBondContact NH1-OE1 3.36Å; R655-E770 IonicContact NH1-OE2 3.35Å; R655-E770 PolarHBondContact NH1-OE2 2.7Å; R655-E770 IonicContact NH2-OE2 2.98Å; R655-E770 PolarHBondContact NH2-OE2 3.1Å; A768-E770 PolarHBondContact O-N 2.92Å; A768-E770 VanDerWaalsContact O-N 3.14Å; E770-V772 PolarHBondContact O-N 2.75Å; E770-V772 VanDerWaalsContact O-N 3.13Å
771	L	57.3	Low	59.2	Low	18 Å²	18	61.6 Å²	61.6	9%	0.094	33%	0.332	C	S	.	.			trans	-69.8	110.6	179.3	-61.3	-178.2	0	0	0	109.2	L741 P809 I811	L741-L771 HydrophobicContact CD1-CB 4.19Å; L741-L771 HydrophobicContact CD1-CD2 4.16Å; L741-L771 HydrophobicContact CD2-CD2 4.17Å; L771-P809 HydrophobicContact CD1-CB 4.33Å; L771-P809 HydrophobicContact CD2-CB 4.1Å; L771-I811 HydrophobicContact CD1-CD1 4.08Å; L771-I811 HydrophobicContact CD1-CG1 3.85Å; L771-I811 HydrophobicContact CD2-CG1 4.32Å; L771-I811 HydrophobicContact CG-CG1 3.99Å
772	V	62.6	Low	62.3	Low	33 Å²	33	56.2 Å²	56.2	20%	0.2	30%	0.295	C	S	.	.			trans	-95.9	114.9	174.6	178.9	0	0	0	0	108.8	R654 C742 E770	R654-V772 HydrophobicContact CB-CG1 4.3Å; R654-V772 CarbonylContact O-C 3.57Å; R654-V772 VanDerWaalsContact O-CA 3.28Å; R654-V772 WeakPolarHBondContact O-CA 3.46Å; C742-V772 HydrophobicContact CB-CB 4.07Å; C742-V772 HydrophobicContact CB-CG1 3.85Å; C742-V772 WeakPolarHBondContact CB-O 3.48Å; C742-V772 PolarHBondContact N-O 2.69Å; E770-V772 PolarHBondContact O-N 2.75Å; E770-V772 VanDerWaalsContact O-N 3.13Å
773	W	69	Low	65.2	Low	6 Å²	6	55 Å²	55	2%	0.023	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	148.9	178.8	-67.4	95.6	0	0	0	112.2	R654 G656 A658 L741 P809 Q941 P943	R654-W773 PolarHBondContact O-N 3.45Å; G656-W773 PolarHBondContact O-NE1 3.27Å; A658-W773 HydrophobicContact CB-CD2 4.18Å; A658-W773 HydrophobicContact CB-CE3 4.09Å; A658-W773 HydrophobicContact CB-CH2 3.99Å; A658-W773 HydrophobicContact CB-CZ2 4.05Å; A658-W773 HydrophobicContact CB-CZ3 4.01Å; L741-W773 HydrophobicContact CD1-CD2 3.84Å; L741-W773 HydrophobicContact CD1-CE3 3.93Å; L741-W773 HydrophobicContact CD1-CH2 3.71Å; L741-W773 HydrophobicContact CD1-CZ2 3.62Å; L741-W773 HydrophobicContact CD1-CZ3 3.86Å; W773-P809 HydrophobicContact CH2-CG 4.34Å; W773-P809 HydrophobicContact CZ2-CG 4.46Å; W773-Q941 HydrophobicContact CZ2-CB 3.86Å; W773-P943 HydrophobicContact CH2-CB 4.48Å; W773-P943 HydrophobicContact CH2-CG 4.01Å; W773-P943 HydrophobicContact CZ3-CB 4.05Å; W773-P943 HydrophobicContact CZ3-CG 3.93Å
774	S	76	Confident	68.1	Low	26 Å²	26	55.9 Å²	55.9	18%	0.182	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	141.7	171.8	59	0	0	0	0	110.3	A739 Q740	A739-S774 WeakPolarHBondContact CA-O 3.49Å; Q740-S774 WeakPolarHBondContact CG-OG 3.47Å; Q740-S774 PolarHBondContact N-O 3.05Å; Q740-S774 PolarHBondContact O-N 3.27Å; Q740-S774 PolarHBondContact O-OG 3.14Å
775	H	80.1	Confident	70.8	Confident	17 Å²	17	54 Å²	54	8%	0.079	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	111.7	-179.7	-62.2	-58.4	0	0	0	110	T473 L661 V737 L738 A739	T473-H775 HydrophobicContact CG2-CB 4.11Å; T473-H775 PolarHBondContact OG1-O 3.34Å; L661-H775 HydrophobicContact CD2-CB 3.81Å; V737-H775 HydrophobicContact CG1-CB 4.02Å; L738-H775 WeakPolarHBondContact O-CA 3.02Å; A739-H775 WeakPolarHBondContact CB-ND1 3.42Å
776	R	86.6	Confident	73.7	Confident	7 Å²	7	45 Å²	45	3%	0.026	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	119.7	-170.8	-56.4	-170.4	67.9	-168.9	1.4	109.5	V737 L738 T790 N791 P792 E794	V737-R776 CarbonylContact C-O 3.58Å; V737-R776 WeakPolarHBondContact CA-O 3.37Å; L738-R776 PolarHBondContact N-O 2.8Å; L738-R776 PolarHBondContact O-N 3.22Å; R776-T790 WeakPolarHBondContact CB-O 3.45Å; R776-T790 PolarHBondContact NE-O 3.4Å; R776-T790 PolarHBondContact NH2-O 2.97Å; R776-N791 PolarHBondContact NE-O 2.92Å; R776-P792 PolarHBondContact NH2-O 2.93Å; R776-E794 IonicContact CZ-OE1 2.75Å; R776-E794 IonicContact NH1-OE1 2.72Å; R776-E794 PolarHBondContact NH1-OE1 3.22Å; R776-E794 VanDerWaalsContact NH2-CG 3.32Å; R776-E794 IonicContact NH2-OE1 2.66Å; R776-E794 PolarHBondContact NH2-OE1 3.47Å; R776-E794 IonicContact NH2-OE2 2.68Å
777	L	91.3	Very high	76.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	135.6	-176.5	177.8	150.5	0	0	0	110	N476 I477 I735 V737 Y779 L789 T790	N476-L777 HydrophobicContact CB-CD1 3.93Å; I477-L777 HydrophobicContact CB-CD1 4.43Å; I477-L777 HydrophobicContact CG1-CD1 3.8Å; I735-L777 HydrophobicContact CD1-CD1 4.46Å; I735-L777 HydrophobicContact CG2-CD1 3.47Å; I735-L777 VanDerWaalsContact CG2-CD1 3.47Å; I735-L777 HydrophobicContact CG2-CD2 4.44Å; I735-L777 HydrophobicContact CG2-CG 3.66Å; V737-L777 HydrophobicContact CG2-CB 4.27Å; V737-L777 HydrophobicContact CG2-CD1 4.46Å; V737-L777 HydrophobicContact CG2-CG 4.36Å; L777-Y779 HydrophobicContact CD2-CD1 4.39Å; L777-Y779 HydrophobicContact CD2-CG 4.5Å; L777-L789 CarbonylContact O-C 3.58Å; L777-L789 WeakPolarHBondContact O-CA 3.35Å; L777-T790 HydrophobicContact CB-CG2 3.9Å; L777-T790 HydrophobicContact CD2-CG2 3.91Å; L777-T790 PolarHBondContact N-OG1 3.37Å; L777-T790 VanDerWaalsContact N-OG1 3.11Å; L777-T790 PolarHBondContact O-N 3.02Å
778	V	93.7	Very high	79.2	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	119.7	170.4	174.5	0	0	0	0	107.5	F726 L730 P736 V787 Y788 L789	F726-V778 HydrophobicContact CD1-CG1 4.12Å; F726-V778 HydrophobicContact CD1-CG2 4.36Å; F726-V778 HydrophobicContact CE1-CG1 4.46Å; F726-V778 HydrophobicContact CE1-CG2 3.87Å; F726-V778 HydrophobicContact CG-CG1 4.32Å; F726-V778 HydrophobicContact CZ-CG2 4.11Å; L730-V778 HydrophobicContact CD1-CG1 4.13Å; L730-V778 HydrophobicContact CD2-CG1 4.42Å; P736-V778 HydrophobicContact CB-CB 3.98Å; P736-V778 HydrophobicContact CB-CG2 4.18Å; P736-V778 HydrophobicContact CG-CB 4.06Å; P736-V778 HydrophobicContact CG-CG1 4.22Å; P736-V778 WeakPolarHBondContact O-CB 3.48Å; P736-V778 PolarHBondContact O-N 3.23Å; V778-V787 HydrophobicContact CB-CG1 4.29Å; V778-V787 HydrophobicContact CG1-CG1 3.54Å; V778-V787 HydrophobicContact CG2-CG1 3.96Å; V778-Y788 WeakPolarHBondContact CA-O 3.49Å; V778-L789 HydrophobicContact CG2-CD2 3.64Å
779	Y	92.6	Very high	81.6	Confident	3 Å²	3	35.3 Å²	35.3	1%	0.012	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	-2.9	178.9	66.7	-83.4	0	0	0	114.6	M457 L458 T461 L464 L777 Y788 T790	M457-Y779 CarbonylContact C-O 3.47Å; M457-Y779 WeakPolarHBondContact CA-O 3.41Å; M457-Y779 HydrophobicContact CG-CD2 3.91Å; M457-Y779 HydrophobicContact CG-CE2 4.29Å; M457-Y779 HydrophobicContact SD-CD2 4.25Å; M457-Y779 HydrophobicContact SD-CE2 4.01Å; L458-Y779 PolarHBondContact N-O 2.97Å; T461-Y779 VanDerWaalsContact CG2-OH 3.24Å; T461-Y779 WeakPolarHBondContact CG2-OH 3.37Å; T461-Y779 WeakPolarHBondContact OG1-CE2 3.23Å; T461-Y779 PolarHBondContact OG1-OH 3.05Å; L464-Y779 HydrophobicContact CD1-CD1 3.67Å; L464-Y779 HydrophobicContact CD1-CD2 3.9Å; L464-Y779 HydrophobicContact CD1-CE1 3.53Å; L464-Y779 HydrophobicContact CD1-CE2 3.78Å; L464-Y779 HydrophobicContact CD1-CG 3.84Å; L777-Y779 HydrophobicContact CD2-CD1 4.39Å; L777-Y779 HydrophobicContact CD2-CG 4.5Å; Y779-Y788 WeakPolarHBondContact CD1-O 3.3Å; Y779-Y788 HydrophobicContact CE2-CD1 4.41Å; Y779-Y788 HydrophobicContact CE2-CG 4.21Å; Y779-Y788 PolarHBondContact N-O 3.01Å; Y779-Y788 VanDerWaalsContact N-O 3.07Å; Y779-T790 HydrophobicContact CD1-CG2 3.7Å; Y779-T790 HydrophobicContact CE1-CG2 3.95Å
780	G	92.1	Very high	83.3	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.7	166.2	175.7	0	0	0	0	0	114.3	F456 Y788	F456-G780 CarbonylContact O-C 3.43Å; F456-G780 WeakPolarHBondContact O-CA 3.4Å; G780-Y788 PolarHBondContact O-N 3.15Å
781	V	92.3	Very high	84.4	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	135.2	178.3	-173.8	0	0	0	0	109.5	L454 P455 F456 A723 F726 L730 E786	L454-V781 HydrophobicContact CD2-CB 4.03Å; L454-V781 HydrophobicContact CD2-CG1 3.67Å; P455-V781 CarbonylContact C-O 3.59Å; P455-V781 VanDerWaalsContact CA-O 3.27Å; P455-V781 WeakPolarHBondContact CA-O 3.37Å; P455-V781 WeakPolarHBondContact CB-O 3.08Å; F456-V781 PolarHBondContact N-O 3.18Å; F456-V781 PolarHBondContact O-N 2.89Å; A723-V781 HydrophobicContact CB-CG1 4.11Å; F726-V781 HydrophobicContact CB-CG2 3.61Å; L730-V781 HydrophobicContact CD1-CG2 3.89Å; V781-E786 CarbonylContact C-O 3.52Å; V781-E786 VanDerWaalsContact CA-O 3.26Å; V781-E786 WeakPolarHBondContact CA-O 3.21Å
782	T	90.3	Very high	85.2	Confident	13 Å²	13	30.3 Å²	30.3	8%	0.08	16%	0.158	C	C	.	.			trans	-89.4	165.4	177.3	71.8	0	0	0	0	112.4	N784 N785 E786 Y788 L795	T782-N784 PolarHBondContact O-N 3.28Å; T782-N784 PolarHBondContact OG1-N 2.83Å; T782-N785 PolarHBondContact O-N 3.46Å; T782-E786 HydrophobicContact CG2-CB 4.2Å; T782-E786 PolarHBondContact N-O 3.38Å; T782-E786 VanDerWaalsContact OG1-CB 3.29Å; T782-E786 WeakPolarHBondContact OG1-CB 3.21Å; T782-E786 PolarHBondContact OG1-N 3.06Å; T782-E786 PolarHBondContact OG1-OE2 3.39Å; T782-Y788 HydrophobicContact CG2-CD2 4.5Å; T782-Y788 HydrophobicContact CG2-CE2 3.69Å; T782-L795 HydrophobicContact CG2-CD1 3.9Å; T782-L795 HydrophobicContact CG2-CD2 4.21Å
783	E	85	Confident	86.2	Confident	141 Å²	141	31.6 Å²	31.6	66%	0.659	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-23.6	170.4	-60.2	-177.7	170.1	0	0	112.9	P455 N785	P455-E783 HydrophobicContact CB-CG 4.34Å; P455-E783 WeakPolarHBondContact CD-OE1 3.12Å; P455-E783 HydrophobicContact CG-CG 4.31Å; E783-N785 VanDerWaalsContact C-N 3.29Å; E783-N785 PolarHBondContact O-N 2.96Å
784	N	85.2	Confident	87.2	Confident	125 Å²	125	34.6 Å²	34.6	67%	0.668	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	12.1	-176.4	-58.5	-35.6	0	0	0	113.9	T782 E786	T782-N784 PolarHBondContact O-N 3.28Å; T782-N784 PolarHBondContact OG1-N 2.83Å; N784-E786 HydrophobicContact CB-CG 4.18Å; N784-E786 WeakPolarHBondContact CB-OE2 3.1Å; N784-E786 PolarHBondContact ND2-OE2 3.42Å
785	N	87.6	Confident	87.9	Confident	42 Å²	42	36.6 Å²	36.6	23%	0.225	19%	0.186	C	C	.	.	S	Bend	trans	57.1	48.9	-169	-60	-40.2	0	0	0	113	D720 A723 T782 E783 V798	D720-N785 PolarHBondContact OD1-ND2 3.39Å; A723-N785 HydrophobicContact CB-CB 4.2Å; A723-N785 WeakPolarHBondContact CB-OD1 3.36Å; T782-N785 PolarHBondContact O-N 3.46Å; E783-N785 VanDerWaalsContact C-N 3.29Å; E783-N785 PolarHBondContact O-N 2.96Å; N785-V798 HydrophobicContact CB-CB 4.49Å; N785-V798 HydrophobicContact CB-CG2 4.17Å; N785-V798 WeakPolarHBondContact O-CB 3.31Å; N785-V798 WeakPolarHBondContact O-CG2 3.46Å; N785-V798 PolarHBondContact O-N 3.48Å
786	E	92.5	Very high	88.5	Confident	53 Å²	53	36.4 Å²	36.4	25%	0.248	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	148.3	169.2	-50.4	158.2	113.5	0	0	110.1	V781 T782 N784 L795 V796	V781-E786 CarbonylContact C-O 3.52Å; V781-E786 VanDerWaalsContact CA-O 3.26Å; V781-E786 WeakPolarHBondContact CA-O 3.21Å; T782-E786 HydrophobicContact CG2-CB 4.2Å; T782-E786 PolarHBondContact N-O 3.38Å; T782-E786 VanDerWaalsContact OG1-CB 3.29Å; T782-E786 WeakPolarHBondContact OG1-CB 3.21Å; T782-E786 PolarHBondContact OG1-N 3.06Å; T782-E786 PolarHBondContact OG1-OE2 3.39Å; N784-E786 HydrophobicContact CB-CG 4.18Å; N784-E786 WeakPolarHBondContact CB-OE2 3.1Å; N784-E786 PolarHBondContact ND2-OE2 3.42Å; E786-L795 HydrophobicContact CB-CD1 3.48Å; E786-L795 VanDerWaalsContact CB-CD1 3.48Å; E786-L795 HydrophobicContact CB-CD2 4.35Å; E786-L795 HydrophobicContact CB-CG 3.82Å; E786-V796 CarbonylContact C-O 3.54Å; E786-V796 VanDerWaalsContact CA-O 3.29Å; E786-V796 WeakPolarHBondContact CA-O 3.2Å
787	V	93.5	Very high	88.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	130.3	-175.3	-168.5	0	0	0	0	110	F726 V778 L789 V796 V798 V801	F726-V787 HydrophobicContact CD2-CG2 4.14Å; F726-V787 HydrophobicContact CE2-CG2 4.18Å; V778-V787 HydrophobicContact CB-CG1 4.29Å; V778-V787 HydrophobicContact CG1-CG1 3.54Å; V778-V787 HydrophobicContact CG2-CG1 3.96Å; V787-L789 HydrophobicContact CG1-CD2 4.14Å; V787-L789 HydrophobicContact CG1-CG 4.47Å; V787-L789 PolarHBondContact O-N 3.28Å; V787-V796 PolarHBondContact N-O 3.07Å; V787-V796 PolarHBondContact O-N 2.84Å; V787-V798 HydrophobicContact CG2-CB 4.25Å; V787-V798 HydrophobicContact CG2-CG2 3.33Å; V787-V801 HydrophobicContact CG2-CG2 4.23Å
788	Y	93.7	Very high	88.9	Confident	67 Å²	67	39.5 Å²	39.5	26%	0.263	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	110.8	168.9	-70.9	-78.3	0	0	0	109.9	M457 V778 Y779 G780 T782 L795	M457-Y788 HydrophobicContact SD-CD2 4.39Å; M457-Y788 HydrophobicContact SD-CE2 4.36Å; V778-Y788 WeakPolarHBondContact CA-O 3.49Å; Y779-Y788 WeakPolarHBondContact CD1-O 3.3Å; Y779-Y788 HydrophobicContact CE2-CD1 4.41Å; Y779-Y788 HydrophobicContact CE2-CG 4.21Å; Y779-Y788 PolarHBondContact N-O 3.01Å; Y779-Y788 VanDerWaalsContact N-O 3.07Å; G780-Y788 PolarHBondContact O-N 3.15Å; T782-Y788 HydrophobicContact CG2-CD2 4.5Å; T782-Y788 HydrophobicContact CG2-CE2 3.69Å; Y788-L795 HydrophobicContact CD1-CB 4.27Å; Y788-L795 HydrophobicContact CD1-CD1 3.87Å; Y788-L795 HydrophobicContact CD2-CD1 4.04Å; Y788-L795 HydrophobicContact CE1-CB 4.16Å; Y788-L795 HydrophobicContact CE1-CD1 3.84Å; Y788-L795 HydrophobicContact CE1-CD2 4.21Å; Y788-L795 HydrophobicContact CE1-CG 4.3Å; Y788-L795 HydrophobicContact CE2-CD1 4.02Å; Y788-L795 HydrophobicContact CG-CD1 3.98Å
789	L	91.6	Very high	88.8	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	149.4	176.4	-68.1	-178.5	0	0	0	111.1	L738 L777 V778 V787 N793 E794 V796 Y800	L738-L789 HydrophobicContact CD2-CD1 4.29Å; L777-L789 CarbonylContact O-C 3.58Å; L777-L789 WeakPolarHBondContact O-CA 3.35Å; V778-L789 HydrophobicContact CG2-CD2 3.64Å; V787-L789 HydrophobicContact CG1-CD2 4.14Å; V787-L789 HydrophobicContact CG1-CG 4.47Å; V787-L789 PolarHBondContact O-N 3.28Å; L789-N793 VanDerWaalsContact O-CA 3.31Å; L789-N793 WeakPolarHBondContact O-CA 3.41Å; L789-E794 PolarHBondContact N-O 3.08Å; L789-E794 PolarHBondContact O-N 2.89Å; L789-E794 VanDerWaalsContact O-N 3.07Å; L789-V796 HydrophobicContact CD1-CG2 3.56Å; L789-V796 HydrophobicContact CG-CG2 3.96Å; L789-Y800 HydrophobicContact CD1-CE1 4.27Å
790	T	85.7	Confident	88.8	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	167.4	166.8	79.4	0	0	0	0	112.6	L464 R776 L777 Y779 P792 N793	L464-T790 HydrophobicContact CD1-CG2 3.96Å; L464-T790 HydrophobicContact CD2-CG2 4.43Å; R776-T790 WeakPolarHBondContact CB-O 3.45Å; R776-T790 PolarHBondContact NE-O 3.4Å; R776-T790 PolarHBondContact NH2-O 2.97Å; L777-T790 HydrophobicContact CB-CG2 3.9Å; L777-T790 HydrophobicContact CD2-CG2 3.91Å; L777-T790 PolarHBondContact N-OG1 3.37Å; L777-T790 VanDerWaalsContact N-OG1 3.11Å; L777-T790 PolarHBondContact O-N 3.02Å; Y779-T790 HydrophobicContact CD1-CG2 3.7Å; Y779-T790 HydrophobicContact CE1-CG2 3.95Å; T790-P792 VanDerWaalsContact C-C 3.43Å; T790-P792 CarbonylContact C-O 3.55Å; T790-N793 WeakPolarHBondContact CA-OD1 3.31Å
791	N	73.5	Confident	88.8	Confident	22 Å²	22	46.6 Å²	46.6	12%	0.118	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	65.8	167.8	-48.9	4.7	0	0	0	114.8	G467 T473 R776	G467-N791 PolarHBondContact O-OD1 3.49Å; T473-N791 PolarHBondContact OG1-ND2 3.25Å; R776-N791 PolarHBondContact NE-O 2.92Å
792	P	74.9	Confident	88.7	Confident	82 Å²	82	47.1 Å²	47.1	53%	0.532	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	cis	-77.1	163.3	-1.6	33.8	-37.8	0	0	0	112.5	R776 T790 E794	R776-P792 PolarHBondContact NH2-O 2.93Å; T790-P792 VanDerWaalsContact C-C 3.43Å; T790-P792 CarbonylContact C-O 3.55Å; P792-E794 PolarHBondContact O-N 3.31Å
793	N	82.9	Confident	88.7	Confident	60 Å²	60	50.2 Å²	50.2	32%	0.321	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	106.2	174.9	-69.9	5.8	0	0	0	109.1	T461 L789 T790	T461-N793 HydrophobicContact CG2-CB 4.1Å; L789-N793 VanDerWaalsContact O-CA 3.31Å; L789-N793 WeakPolarHBondContact O-CA 3.41Å; T790-N793 WeakPolarHBondContact CA-OD1 3.31Å
794	E	89.6	Confident	88.9	Confident	68 Å²	68	43.9 Å²	43.9	32%	0.318	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	165.8	-176.7	68.4	-173.9	-175.6	0	0	111.4	R776 L789 P792 V796	R776-E794 IonicContact CZ-OE1 2.75Å; R776-E794 IonicContact NH1-OE1 2.72Å; R776-E794 PolarHBondContact NH1-OE1 3.22Å; R776-E794 VanDerWaalsContact NH2-CG 3.32Å; R776-E794 IonicContact NH2-OE1 2.66Å; R776-E794 PolarHBondContact NH2-OE1 3.47Å; R776-E794 IonicContact NH2-OE2 2.68Å; L789-E794 PolarHBondContact N-O 3.08Å; L789-E794 PolarHBondContact O-N 2.89Å; L789-E794 VanDerWaalsContact O-N 3.07Å; P792-E794 PolarHBondContact O-N 3.31Å; E794-V796 HydrophobicContact CG-CG1 4.01Å
795	L	91.8	Very high	89.1	Confident	68 Å²	68	38 Å²	38	36%	0.356	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	123.2	173.1	-177.4	59.9	0	0	0	108.2	T782 E786 Y788	T782-L795 HydrophobicContact CG2-CD1 3.9Å; T782-L795 HydrophobicContact CG2-CD2 4.21Å; E786-L795 HydrophobicContact CB-CD1 3.48Å; E786-L795 VanDerWaalsContact CB-CD1 3.48Å; E786-L795 HydrophobicContact CB-CD2 4.35Å; E786-L795 HydrophobicContact CB-CG 3.82Å; Y788-L795 HydrophobicContact CD1-CB 4.27Å; Y788-L795 HydrophobicContact CD1-CD1 3.87Å; Y788-L795 HydrophobicContact CD2-CD1 4.04Å; Y788-L795 HydrophobicContact CE1-CB 4.16Å; Y788-L795 HydrophobicContact CE1-CD1 3.84Å; Y788-L795 HydrophobicContact CE1-CD2 4.21Å; Y788-L795 HydrophobicContact CE1-CG 4.3Å; Y788-L795 HydrophobicContact CE2-CD1 4.02Å; Y788-L795 HydrophobicContact CG-CD1 3.98Å
796	V	92.7	Very high	89.1	Confident	13 Å²	13	39.1 Å²	39.1	8%	0.079	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	145	-179.5	-69.5	0	0	0	0	111.5	E786 V787 L789 E794 Y800 V801	E786-V796 CarbonylContact C-O 3.54Å; E786-V796 VanDerWaalsContact CA-O 3.29Å; E786-V796 WeakPolarHBondContact CA-O 3.2Å; V787-V796 PolarHBondContact N-O 3.07Å; V787-V796 PolarHBondContact O-N 2.84Å; L789-V796 HydrophobicContact CD1-CG2 3.56Å; L789-V796 HydrophobicContact CG-CG2 3.96Å; E794-V796 HydrophobicContact CG-CG1 4.01Å; V796-Y800 HydrophobicContact CB-CD1 4.08Å; V796-Y800 HydrophobicContact CB-CG 4.29Å; V796-Y800 HydrophobicContact CG1-CD1 4.26Å; V796-Y800 HydrophobicContact CG1-CG 4.49Å; V796-Y800 HydrophobicContact CG2-CD1 3.87Å; V796-Y800 HydrophobicContact CG2-CE1 4.46Å; V796-V801 HydrophobicContact CG2-CG2 4.38Å
797	P	93.1	Very high	88.7	Confident	73 Å²	73	39.4 Å²	39.4	47%	0.474	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	143.3	170.8	-23.9	34.3	0	0	0	111.4	Q799 Y800	P797-Q799 PolarHBondContact O-N 3.29Å; P797-Y800 WeakPolarHBondContact O-CB 3.47Å; P797-Y800 PolarHBondContact O-N 3.13Å
798	V	92.1	Very high	88.1	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-56.6	-27.4	176.5	174.7	0	0	0	0	111.8	S719 L722 A723 N785 V787 Y800 V801 L802	S719-V798 WeakPolarHBondContact O-CG1 3.09Å; L722-V798 HydrophobicContact CB-CG1 3.77Å; L722-V798 HydrophobicContact CD2-CG1 3.81Å; L722-V798 HydrophobicContact CG-CG1 3.85Å; A723-V798 HydrophobicContact CB-CG2 3.95Å; N785-V798 HydrophobicContact CB-CB 4.49Å; N785-V798 HydrophobicContact CB-CG2 4.17Å; N785-V798 WeakPolarHBondContact O-CB 3.31Å; N785-V798 WeakPolarHBondContact O-CG2 3.46Å; N785-V798 PolarHBondContact O-N 3.48Å; V787-V798 HydrophobicContact CG2-CB 4.25Å; V787-V798 HydrophobicContact CG2-CG2 3.33Å; V798-Y800 VanDerWaalsContact C-N 3.32Å; V798-Y800 PolarHBondContact O-N 2.93Å; V798-V801 WeakPolarHBondContact O-CB 3.29Å; V798-V801 PolarHBondContact O-N 3.14Å; V798-L802 PolarHBondContact O-N 2.98Å; V798-L802 VanDerWaalsContact O-N 3.08Å
799	Q	91.6	Very high	86.9	Confident	84 Å²	84	45 Å²	45	39%	0.393	23%	0.233	S	C	.	.	H	α-helix	trans	-56.3	-41.4	172.5	-171.2	60.6	52	0	0	112.7	S719 P797 V801 L802 D803	S719-Q799 PolarHBondContact OG-OE1 3.14Å; S719-Q799 VanDerWaalsContact OG-OE1 3.09Å; P797-Q799 PolarHBondContact O-N 3.29Å; Q799-V801 PolarHBondContact O-N 3.27Å; Q799-L802 WeakPolarHBondContact O-CB 3.48Å; Q799-L802 PolarHBondContact O-N 3.17Å; Q799-L802 VanDerWaalsContact O-N 3.13Å; Q799-D803 PolarHBondContact NE2-OD1 3.3Å; Q799-D803 PolarHBondContact O-N 2.94Å
800	Y	92.7	Very high	85.6	Confident	68 Å²	68	50.5 Å²	50.5	27%	0.267	26%	0.26	S	S	.	.	H	α-helix	trans	-58.9	-39.2	175.4	168.4	-87.2	0	0	0	111.2	Q740 L789 V796 P797 V798 D803 Q804	Q740-Y800 PolarHBondContact NE2-OH 2.79Å; L789-Y800 HydrophobicContact CD1-CE1 4.27Å; V796-Y800 HydrophobicContact CB-CD1 4.08Å; V796-Y800 HydrophobicContact CB-CG 4.29Å; V796-Y800 HydrophobicContact CG1-CD1 4.26Å; V796-Y800 HydrophobicContact CG1-CG 4.49Å; V796-Y800 HydrophobicContact CG2-CD1 3.87Å; V796-Y800 HydrophobicContact CG2-CE1 4.46Å; P797-Y800 WeakPolarHBondContact O-CB 3.47Å; P797-Y800 PolarHBondContact O-N 3.13Å; V798-Y800 VanDerWaalsContact C-N 3.32Å; V798-Y800 PolarHBondContact O-N 2.93Å; Y800-D803 PolarHBondContact O-N 2.79Å; Y800-Q804 HydrophobicContact CD1-CG 4.08Å; Y800-Q804 HydrophobicContact CE1-CG 3.71Å; Y800-Q804 HydrophobicContact CE2-CG 4.22Å; Y800-Q804 HydrophobicContact CG-CG 4.48Å; Y800-Q804 VanDerWaalsContact CZ-NE2 3.33Å; Y800-Q804 WeakPolarHBondContact O-CB 3.31Å; Y800-Q804 VanDerWaalsContact O-CG 3.22Å; Y800-Q804 WeakPolarHBondContact O-CG 3.25Å; Y800-Q804 PolarHBondContact O-N 3.23Å; Y800-Q804 PolarHBondContact OH-NE2 2.94Å
801	V	92.1	Very high	84.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-66.3	-41.7	177.9	-178.3	0	0	0	0	110.8	L722 F726 L738 V787 V796 V798 Q799 Q804 L805	L722-V801 HydrophobicContact CD2-CB 4.45Å; L722-V801 HydrophobicContact CD2-CG1 4.12Å; F726-V801 HydrophobicContact CE2-CG1 4.12Å; F726-V801 HydrophobicContact CZ-CG1 4.01Å; L738-V801 HydrophobicContact CD1-CG1 4.08Å; L738-V801 HydrophobicContact CD2-CG1 4.03Å; L738-V801 HydrophobicContact CD2-CG2 4.4Å; V787-V801 HydrophobicContact CG2-CG2 4.23Å; V796-V801 HydrophobicContact CG2-CG2 4.38Å; V798-V801 WeakPolarHBondContact O-CB 3.29Å; V798-V801 PolarHBondContact O-N 3.14Å; Q799-V801 PolarHBondContact O-N 3.27Å; V801-Q804 PolarHBondContact O-N 3.48Å; V801-L805 HydrophobicContact CG1-CD1 4.04Å; V801-L805 HydrophobicContact CG1-CG 4.46Å; V801-L805 WeakPolarHBondContact O-CB 3.43Å; V801-L805 WeakPolarHBondContact O-CG 3.18Å; V801-L805 PolarHBondContact O-N 3.09Å
802	L	91.5	Very high	83.9	Confident	11 Å²	11	54.6 Å²	54.6	6%	0.058	28%	0.275	C	S	.	.	H	α-helix	trans	-63.2	-42.1	173.5	-71	169.2	0	0	0	112.4	W694 M718 S719 L722 V798 Q799 Q804 L805 S806	W694-L802 HydrophobicContact CZ2-CD2 4.43Å; M718-L802 HydrophobicContact CB-CD1 3.84Å; M718-L802 HydrophobicContact SD-CD2 3.93Å; S719-L802 WeakPolarHBondContact OG-CD1 3.27Å; L722-L802 HydrophobicContact CD2-CD2 3.65Å; L722-L802 HydrophobicContact CD2-CG 3.84Å; V798-L802 PolarHBondContact O-N 2.98Å; V798-L802 VanDerWaalsContact O-N 3.08Å; Q799-L802 WeakPolarHBondContact O-CB 3.48Å; Q799-L802 PolarHBondContact O-N 3.17Å; Q799-L802 VanDerWaalsContact O-N 3.13Å; L802-Q804 PolarHBondContact O-N 3.44Å; L802-L805 CarbonylContact O-C 3.51Å; L802-L805 PolarHBondContact O-N 3.43Å; L802-S806 WeakPolarHBondContact O-CB 3.39Å; L802-S806 PolarHBondContact O-N 3.09Å
803	D	90.2	Very high	83.2	Confident	78 Å²	78	51.4 Å²	51.4	42%	0.417	25%	0.254	S	S	.	.	H	α-helix	trans	-62.1	-45.1	178.2	-61.4	-18.2	0	0	0	110.2	Q799 Y800 L805 S806 K807	Q799-D803 PolarHBondContact NE2-OD1 3.3Å; Q799-D803 PolarHBondContact O-N 2.94Å; Y800-D803 PolarHBondContact O-N 2.79Å; D803-L805 PolarHBondContact O-N 2.9Å; D803-S806 PolarHBondContact O-N 3.36Å; D803-S806 PolarHBondContact O-OG 3.36Å; D803-K807 PolarHBondContact O-N 3.43Å
804	Q	89.2	Confident	82.3	Confident	8 Å²	8	49.7 Å²	49.7	4%	0.037	25%	0.246	C	C	.	.	H	α-helix	trans	-61.4	-41.6	173.3	-67	-70.5	-15.5	0	0	112.4	Q740 Y800 V801 L802 S806 K807 P943	Q740-Q804 HydrophobicContact CB-CB 4.31Å; Y800-Q804 HydrophobicContact CD1-CG 4.08Å; Y800-Q804 HydrophobicContact CE1-CG 3.71Å; Y800-Q804 HydrophobicContact CE2-CG 4.22Å; Y800-Q804 HydrophobicContact CG-CG 4.48Å; Y800-Q804 VanDerWaalsContact CZ-NE2 3.33Å; Y800-Q804 WeakPolarHBondContact O-CB 3.31Å; Y800-Q804 VanDerWaalsContact O-CG 3.22Å; Y800-Q804 WeakPolarHBondContact O-CG 3.25Å; Y800-Q804 PolarHBondContact O-N 3.23Å; Y800-Q804 PolarHBondContact OH-NE2 2.94Å; V801-Q804 PolarHBondContact O-N 3.48Å; L802-Q804 PolarHBondContact O-N 3.44Å; Q804-S806 VanDerWaalsContact C-N 3.27Å; Q804-S806 PolarHBondContact O-N 3.36Å; Q804-K807 VanDerWaalsContact CD-NZ 3.32Å; Q804-K807 PolarHBondContact O-N 2.93Å; Q804-K807 VanDerWaalsContact OE1-CE 3.28Å; Q804-P943 WeakPolarHBondContact O-CB 3.16Å; Q804-P943 WeakPolarHBondContact O-CG 3.24Å
805	L	89	Confident	81.2	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-68.2	-23.9	175.4	-70.3	170	0	0	0	113.3	P691 L722 L738 V801 L802 D803 G944 I945	P691-L805 HydrophobicContact CB-CB 4.29Å; P691-L805 WeakPolarHBondContact CD-O 3.44Å; L722-L805 HydrophobicContact CD2-CD1 4.35Å; L738-L805 HydrophobicContact CD1-CD2 3.82Å; L738-L805 HydrophobicContact CD1-CG 4.09Å; V801-L805 HydrophobicContact CG1-CD1 4.04Å; V801-L805 HydrophobicContact CG1-CG 4.46Å; V801-L805 WeakPolarHBondContact O-CB 3.43Å; V801-L805 WeakPolarHBondContact O-CG 3.18Å; V801-L805 PolarHBondContact O-N 3.09Å; L802-L805 CarbonylContact O-C 3.51Å; L802-L805 PolarHBondContact O-N 3.43Å; D803-L805 PolarHBondContact O-N 2.9Å; L805-G944 VanDerWaalsContact CD2-CA 3.41Å; L805-I945 HydrophobicContact CD1-CD1 4.14Å; L805-I945 HydrophobicContact CD1-CG1 4.25Å; L805-I945 HydrophobicContact CD2-CG1 4.15Å
806	S	88.1	Confident	79.8	Confident	66 Å²	66	47.6 Å²	47.6	46%	0.462	25%	0.247	S	C	.	.	H	α-helix	trans	-82.7	-16.8	178.6	81	0	0	0	0	114.1	L802 D803 Q804 K808	L802-S806 WeakPolarHBondContact O-CB 3.39Å; L802-S806 PolarHBondContact O-N 3.09Å; D803-S806 PolarHBondContact O-N 3.36Å; D803-S806 PolarHBondContact O-OG 3.36Å; Q804-S806 VanDerWaalsContact C-N 3.27Å; Q804-S806 PolarHBondContact O-N 3.36Å; S806-K808 PolarHBondContact O-N 3.44Å
807	K	83.4	Confident	78.2	Confident	59 Å²	59	50.9 Å²	50.9	26%	0.257	26%	0.262	S	S	.	.			trans	-59.1	123.8	-179.5	-72.8	179.6	177.1	176.9	0	110.7	D743 D803 Q804 P809 P943	D743-K807 IonicContact OD1-NZ 2.73Å; D743-K807 PolarHBondContact OD1-NZ 3.28Å; D743-K807 IonicContact OD2-NZ 3.18Å; D743-K807 PolarHBondContact OD2-NZ 3.13Å; D803-K807 PolarHBondContact O-N 3.43Å; Q804-K807 VanDerWaalsContact CD-NZ 3.32Å; Q804-K807 PolarHBondContact O-N 2.93Å; Q804-K807 VanDerWaalsContact OE1-CE 3.28Å; K807-P809 WeakPolarHBondContact O-CD 3.39Å; K807-P943 HydrophobicContact CB-CG 4.24Å; K807-P943 VanDerWaalsContact O-CD 3.27Å; K807-P943 WeakPolarHBondContact O-CD 3.48Å
808	K	80	Confident	76.7	Confident	176 Å²	176	47.4 Å²	47.4	77%	0.765	24%	0.239	S	C	*	.			trans	-87.3	110	167.2	-63.3	-178.8	-179.3	-179.2	0	108.1	S806	S806-K808 PolarHBondContact O-N 3.44Å
809	P	68.6	Low	75.2	Confident	7 Å²	7	48.9 Å²	48.9	5%	0.045	25%	0.25	C	C	.	.			trans	-79.6	138.3	-178.8	29.4	-28.7	0	0	0	110.8	L741 L771 W773 K807 S939 Q941	L741-P809 HydrophobicContact CD1-CB 4.19Å; L741-P809 HydrophobicContact CD2-CB 4.18Å; L771-P809 HydrophobicContact CD1-CB 4.33Å; L771-P809 HydrophobicContact CD2-CB 4.1Å; W773-P809 HydrophobicContact CH2-CG 4.34Å; W773-P809 HydrophobicContact CZ2-CG 4.46Å; K807-P809 WeakPolarHBondContact O-CD 3.39Å; P809-S939 VanDerWaalsContact O-CB 3.24Å; P809-S939 WeakPolarHBondContact O-CB 2.97Å; P809-S939 PolarHBondContact O-N 3.5Å; P809-Q941 WeakPolarHBondContact CD-O 3.26Å; P809-Q941 WeakPolarHBondContact CG-O 3.22Å
810	E	65.6	Low	73.6	Confident	117 Å²	117	49 Å²	49	55%	0.547	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.8	-177.4	-61.9	-176.9	161.1	0	0	110.5	T936 I937	E810-T936 HydrophobicContact CB-CG2 3.68Å; E810-T936 HydrophobicContact CG-CG2 4.27Å; E810-T936 WeakPolarHBondContact OE2-CG2 3.33Å; E810-I937 CarbonylContact C-O 3.52Å; E810-I937 WeakPolarHBondContact CA-O 3.3Å
811	I	62.5	Low	71.9	Confident	36 Å²	36	49.5 Å²	49.5	19%	0.185	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	117.8	178.8	-53.7	177.1	0	0	0	108.1	L771 I813 I937	L771-I811 HydrophobicContact CD1-CD1 4.08Å; L771-I811 HydrophobicContact CD1-CG1 3.85Å; L771-I811 HydrophobicContact CD2-CG1 4.32Å; L771-I811 HydrophobicContact CG-CG1 3.99Å; I811-I813 HydrophobicContact CG2-CD1 4.14Å; I811-I813 HydrophobicContact CG2-CG1 3.77Å; I811-I937 PolarHBondContact N-O 3.37Å; I811-I937 PolarHBondContact O-N 3.22Å
812	R	60.2	Low	70.2	Confident	71 Å²	71	51.4 Å²	51.4	27%	0.268	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	116.3	175.8	-164	176.3	-173.1	-162.3	1.6	110	A768 Q769 A934 I935	A768-R812 WeakPolarHBondContact CA-O 3.36Å; A768-R812 VanDerWaalsContact CB-O 3.31Å; A768-R812 WeakPolarHBondContact CB-O 3.25Å; Q769-R812 HydrophobicContact CB-CB 4.41Å; Q769-R812 PolarHBondContact N-O 2.87Å; R812-A934 HydrophobicContact CG-CB 4.01Å; R812-I935 CarbonylContact C-O 3.58Å; R812-I935 WeakPolarHBondContact CA-O 3.41Å
813	I	60.5	Low	68.5	Low	16 Å²	16	54.1 Å²	54.1	8%	0.082	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	129.8	-176.4	-48.4	-177.5	0	0	0	109.8	I811 Q817 I818 I873 V877 A934 I935 I937	I811-I813 HydrophobicContact CG2-CD1 4.14Å; I811-I813 HydrophobicContact CG2-CG1 3.77Å; I813-Q817 HydrophobicContact CG2-CB 4.28Å; I813-I818 HydrophobicContact CB-CD1 4.33Å; I813-I818 HydrophobicContact CG2-CD1 4.07Å; I813-I818 HydrophobicContact CG2-CG1 3.77Å; I813-I873 HydrophobicContact CD1-CG2 3.69Å; I813-V877 HydrophobicContact CD1-CG2 4.16Å; I813-A934 CarbonylContact O-C 3.5Å; I813-A934 VanDerWaalsContact O-CA 3.27Å; I813-A934 WeakPolarHBondContact O-CA 3.36Å; I813-A934 WeakPolarHBondContact O-CB 3.11Å; I813-I935 PolarHBondContact N-O 3.08Å; I813-I935 PolarHBondContact O-N 2.68Å; I813-I937 HydrophobicContact CD1-CD1 3.84Å; I813-I937 HydrophobicContact CG1-CD1 4.28Å
814	S	64.2	Low	66.8	Low	23 Å²	23	56.2 Å²	56.2	16%	0.161	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	144.3	176.8	71.5	0	0	0	0	112.3	A816 Q817 I818 P933	S814-A816 PolarHBondContact O-N 3.02Å; S814-Q817 PolarHBondContact O-N 2.92Å; S814-Q817 VanDerWaalsContact O-N 3.08Å; S814-Q817 WeakPolarHBondContact OG-CB 3.23Å; S814-Q817 VanDerWaalsContact OG-CD 3.29Å; S814-Q817 VanDerWaalsContact OG-CG 3.24Å; S814-Q817 WeakPolarHBondContact OG-CG 3.25Å; S814-Q817 PolarHBondContact OG-N 2.86Å; S814-Q817 PolarHBondContact OG-OE1 3.04Å; S814-I818 PolarHBondContact O-N 2.65Å; S814-I818 VanDerWaalsContact O-N 3.16Å; S814-P933 WeakPolarHBondContact CA-O 3.14Å
815	K	66.2	Low	65	Low	19 Å²	19	58.3 Å²	58.3	8%	0.083	30%	0.299	C	S	.	.	H	α-helix	trans	-58.4	-33.6	174.8	-66.8	-174.1	179.1	173.7	0	111.8	I818 S819 G854 E855 L857 F929 S930 S932 P933	K815-I818 PolarHBondContact O-N 2.74Å; K815-S819 WeakPolarHBondContact O-CB 3.49Å; K815-S819 PolarHBondContact O-N 2.89Å; K815-G854 WeakPolarHBondContact CD-O 3.23Å; K815-E855 PolarHBondContact NZ-O 3.27Å; K815-L857 HydrophobicContact CD-CD1 4.09Å; K815-L857 HydrophobicContact CG-CD1 4.15Å; K815-F929 WeakPolarHBondContact CE-O 3.47Å; K815-F929 PolarHBondContact NZ-O 3.03Å; K815-S930 VanDerWaalsContact NZ-C 3.34Å; K815-S930 PolarHBondContact NZ-O 3.42Å; K815-S932 WeakPolarHBondContact CD-O 3.26Å; K815-S932 WeakPolarHBondContact CE-O 3.35Å; K815-S932 PolarHBondContact NZ-O 3.18Å; K815-P933 PolarHBondContact N-O 3.2Å
816	A	62.8	Low	63.1	Low	74 Å²	74	62 Å²	62	61%	0.612	31%	0.313	S	S	*	.	H	α-helix	trans	-62.8	-41.6	174.8	0	0	0	0	0	112.9	S814 S819 N820	S814-A816 PolarHBondContact O-N 3.02Å; A816-S819 PolarHBondContact O-N 3.44Å; A816-N820 WeakPolarHBondContact O-CB 3.39Å; A816-N820 PolarHBondContact O-N 3.49Å
817	Q	59.7	Low	60.9	Low	81 Å²	81	64.2 Å²	64.2	38%	0.379	32%	0.32	S	S	.	.	H	α-helix	trans	-66.7	-39	174.8	-74.7	163.9	-61.7	0	0	111.9	I813 S814 N820 L821	I813-Q817 HydrophobicContact CG2-CB 4.28Å; S814-Q817 PolarHBondContact O-N 2.92Å; S814-Q817 VanDerWaalsContact O-N 3.08Å; S814-Q817 WeakPolarHBondContact OG-CB 3.23Å; S814-Q817 VanDerWaalsContact OG-CD 3.29Å; S814-Q817 VanDerWaalsContact OG-CG 3.24Å; S814-Q817 WeakPolarHBondContact OG-CG 3.25Å; S814-Q817 PolarHBondContact OG-N 2.86Å; S814-Q817 PolarHBondContact OG-OE1 3.04Å; Q817-N820 PolarHBondContact O-N 3.18Å; Q817-L821 WeakPolarHBondContact O-CG 3.18Å; Q817-L821 PolarHBondContact O-N 2.87Å
818	I	61.6	Low	59	Low	0 Å²	0	67.9 Å²	67.9	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-63.6	-46.3	176.1	-66.1	169.6	0	0	0	110.7	I813 S814 K815 N820 L821 W822 L857 L860 M874 V877 I935	I813-I818 HydrophobicContact CB-CD1 4.33Å; I813-I818 HydrophobicContact CG2-CD1 4.07Å; I813-I818 HydrophobicContact CG2-CG1 3.77Å; S814-I818 PolarHBondContact O-N 2.65Å; S814-I818 VanDerWaalsContact O-N 3.16Å; K815-I818 PolarHBondContact O-N 2.74Å; I818-N820 VanDerWaalsContact C-N 3.33Å; I818-N820 PolarHBondContact O-N 2.96Å; I818-L821 PolarHBondContact O-N 3.43Å; I818-W822 WeakPolarHBondContact O-CB 3.26Å; I818-W822 PolarHBondContact O-N 3.37Å; I818-L857 HydrophobicContact CG2-CD2 4.26Å; I818-L860 HydrophobicContact CG2-CD1 4.36Å; I818-L860 HydrophobicContact CG2-CD2 4.01Å; I818-M874 HydrophobicContact CB-CE 4.27Å; I818-M874 HydrophobicContact CG1-CE 4.11Å; I818-M874 HydrophobicContact CG2-CE 3.93Å; I818-V877 HydrophobicContact CD1-CG1 4.17Å; I818-V877 HydrophobicContact CD1-CG2 4.47Å; I818-I935 HydrophobicContact CD1-CD1 3.32Å; I818-I935 HydrophobicContact CD1-CG1 3.93Å
819	S	58.6	Low	57.3	Low	32 Å²	32	61.8 Å²	61.8	22%	0.224	32%	0.317	C	S	.	.	H	α-helix	trans	-61.5	-37.5	175.4	-178.7	0	0	0	0	112.7	K815 A816 T823	K815-S819 WeakPolarHBondContact O-CB 3.49Å; K815-S819 PolarHBondContact O-N 2.89Å; A816-S819 PolarHBondContact O-N 3.44Å; S819-T823 VanDerWaalsContact O-CB 3.3Å; S819-T823 WeakPolarHBondContact O-CB 3.4Å; S819-T823 PolarHBondContact O-N 2.72Å; S819-T823 PolarHBondContact O-OG1 2.74Å
820	N	58.3	Low	56.1	Low	85 Å²	85	66.1 Å²	66.1	46%	0.455	34%	0.335	S	S	.	.	H	α-helix	trans	-67	-45.2	175.4	-167.9	-47.3	0	0	0	112	A816 Q817 I818 T823 K824	A816-N820 WeakPolarHBondContact O-CB 3.39Å; A816-N820 PolarHBondContact O-N 3.49Å; Q817-N820 PolarHBondContact O-N 3.18Å; I818-N820 VanDerWaalsContact C-N 3.33Å; I818-N820 PolarHBondContact O-N 2.96Å; N820-T823 PolarHBondContact O-N 2.85Å; N820-K824 WeakPolarHBondContact O-CG 3.28Å; N820-K824 PolarHBondContact O-N 3.43Å; N820-K824 WeakPolarHBondContact OD1-CD 3.4Å; N820-K824 WeakPolarHBondContact OD1-CE 3.28Å; N820-K824 PolarHBondContact OD1-NZ 3.41Å
821	L	57.2	Low	54.8	Low	80 Å²	80	65.3 Å²	65.3	42%	0.419	33%	0.334	S	S	.	.	H	α-helix	trans	-59.5	-46.9	173.6	-77.1	164.8	0	0	0	111.6	Q817 I818 K824 H825 M874	Q817-L821 WeakPolarHBondContact O-CG 3.18Å; Q817-L821 PolarHBondContact O-N 2.87Å; I818-L821 PolarHBondContact O-N 3.43Å; L821-K824 PolarHBondContact O-N 2.89Å; L821-H825 PolarHBondContact O-N 3.44Å; L821-M874 HydrophobicContact CB-CE 4.01Å; L821-M874 HydrophobicContact CB-SD 4.14Å; L821-M874 HydrophobicContact CD1-CE 3.71Å
822	W	56.9	Low	53.4	Low	39 Å²	39	70 Å²	70	15%	0.148	35%	0.35	C	S	.	.	H	α-helix	trans	-58.8	-49.3	176.3	-176.7	-93.5	0	0	0	112.2	I818 K824 H825 Y826 F852 L860 H863 W868	I818-W822 WeakPolarHBondContact O-CB 3.26Å; I818-W822 PolarHBondContact O-N 3.37Å; W822-K824 VanDerWaalsContact C-N 3.33Å; W822-K824 PolarHBondContact O-N 2.91Å; W822-H825 PolarHBondContact O-N 3.3Å; W822-H825 VanDerWaalsContact O-N 3.17Å; W822-Y826 PolarHBondContact O-N 3.03Å; W822-F852 HydrophobicContact CG-CE2 4.33Å; W822-L860 HydrophobicContact CB-CD1 4.4Å; W822-L860 HydrophobicContact CD2-CD1 3.62Å; W822-L860 HydrophobicContact CE3-CD1 3.29Å; W822-L860 HydrophobicContact CE3-CG 3.98Å; W822-L860 HydrophobicContact CG-CD1 4.1Å; W822-L860 HydrophobicContact CZ3-CD1 3.8Å; W822-L860 HydrophobicContact CZ3-CG 4.02Å; W822-H863 HydrophobicContact CH2-CB 3.96Å; W822-H863 AromaticContact CH2-CD2 3.68Å; W822-H863 AromaticContact CH2-CG 3.58Å; W822-H863 AromaticContact CH2-ND1 3.84Å; W822-H863 AromaticContact CH2-NE2 3.99Å; W822-W868 AromaticContact CD2-CH2 3.92Å; W822-W868 HydrophobicContact CD2-CH2 3.92Å; W822-W868 HydrophobicContact CE3-CE3 4.31Å; W822-W868 AromaticContact CE3-CH2 3.12Å; W822-W868 HydrophobicContact CE3-CH2 3.12Å; W822-W868 AromaticContact CE3-CZ2 3.79Å; W822-W868 HydrophobicContact CE3-CZ2 3.79Å; W822-W868 AromaticContact CE3-CZ3 3.45Å; W822-W868 HydrophobicContact CE3-CZ3 3.45Å; W822-W868 VanDerWaalsContact CE3-CZ3 3.45Å; W822-W868 HydrophobicContact CH2-CH2 4.05Å; W822-W868 AromaticContact CH2-CZ2 3.82Å; W822-W868 HydrophobicContact CH2-CZ2 3.82Å; W822-W868 HydrophobicContact CZ3-CD2 4.15Å; W822-W868 AromaticContact CZ3-CE2 3.88Å; W822-W868 AromaticContact CZ3-CE3 3.99Å; W822-W868 HydrophobicContact CZ3-CE3 3.99Å; W822-W868 AromaticContact CZ3-CH2 3.22Å; W822-W868 HydrophobicContact CZ3-CH2 3.22Å; W822-W868 AromaticContact CZ3-CZ2 3.4Å; W822-W868 HydrophobicContact CZ3-CZ2 3.4Å; W822-W868 VanDerWaalsContact CZ3-CZ2 3.4Å; W822-W868 AromaticContact CZ3-CZ3 3.55Å; W822-W868 HydrophobicContact CZ3-CZ3 3.55Å
823	T	56.3	Low	52.2	Low	68 Å²	68	72.4 Å²	72.4	42%	0.417	38%	0.375	S	S	.	.	H	α-helix	trans	-60.9	-41.8	-179.5	-59	0	0	0	0	111.5	S819 N820 Y826 L827	S819-T823 VanDerWaalsContact O-CB 3.3Å; S819-T823 WeakPolarHBondContact O-CB 3.4Å; S819-T823 PolarHBondContact O-N 2.72Å; S819-T823 PolarHBondContact O-OG1 2.74Å; N820-T823 PolarHBondContact O-N 2.85Å; T823-Y826 PolarHBondContact O-N 3.28Å; T823-L827 HydrophobicContact CG2-CD1 4.19Å; T823-L827 WeakPolarHBondContact O-CB 3.42Å; T823-L827 VanDerWaalsContact O-CG 3.29Å; T823-L827 WeakPolarHBondContact O-CG 3.42Å; T823-L827 PolarHBondContact O-N 3.26Å
824	K	53.6	Low	50.9	Low	122 Å²	122	78.2 Å²	78.2	53%	0.53	41%	0.406	S	S	.	.	H	α-helix	trans	-60.8	-47.5	173.7	-76.6	169.3	173.3	161.9	0	111.8	N820 L821 W822 Y826 L827 H828	N820-K824 WeakPolarHBondContact O-CG 3.28Å; N820-K824 PolarHBondContact O-N 3.43Å; N820-K824 WeakPolarHBondContact OD1-CD 3.4Å; N820-K824 WeakPolarHBondContact OD1-CE 3.28Å; N820-K824 PolarHBondContact OD1-NZ 3.41Å; L821-K824 PolarHBondContact O-N 2.89Å; W822-K824 VanDerWaalsContact C-N 3.33Å; W822-K824 PolarHBondContact O-N 2.91Å; K824-Y826 PolarHBondContact O-N 3.29Å; K824-L827 PolarHBondContact O-N 3.17Å; K824-H828 PolarHBondContact O-CD2 2.88Å; K824-H828 VanDerWaalsContact O-CD2 3.32Å; K824-H828 PolarHBondContact O-N 3.43Å
825	H	51.2	Low	49.4	Very low	52 Å²	52	87.7 Å²	87.7	24%	0.241	44%	0.439	C	S	.	.	H	α-helix	trans	-64.9	-40.7	179.4	-168.1	-81.2	0	0	0	112.5	L821 W822 L827 H828 S829 W868 M871	L821-H825 PolarHBondContact O-N 3.44Å; W822-H825 PolarHBondContact O-N 3.3Å; W822-H825 VanDerWaalsContact O-N 3.17Å; H825-L827 PolarHBondContact O-N 2.7Å; H825-H828 PolarHBondContact O-N 3.17Å; H825-S829 PolarHBondContact O-N 3.22Å; H825-W868 HydrophobicContact CB-CH2 3.75Å; H825-W868 HydrophobicContact CB-CZ2 4.26Å; H825-W868 AromaticContact CE1-CE2 3.97Å; H825-W868 AromaticContact CE1-CZ2 3.71Å; H825-W868 AromaticContact CG-CH2 3.65Å; H825-W868 AromaticContact CG-CZ2 3.76Å; H825-W868 AromaticContact ND1-CE2 3.93Å; H825-W868 AromaticContact ND1-CH2 3.62Å; H825-W868 AromaticContact ND1-CZ2 3.21Å; H825-W868 WeakPolarHBondContact ND1-CZ2 3.44Å; H825-M871 PolarHBondContact CD2-SD 2.86Å
826	Y	49.3	Very low	47.8	Very low	78 Å²	78	93.6 Å²	93.6	31%	0.306	47%	0.471	S	S	.	.	H	α-helix	trans	-63.6	-40.7	176.6	-170.9	-108.4	0	0	0	111.9	W822 T823 K824 H828 S829 K830	W822-Y826 PolarHBondContact O-N 3.03Å; T823-Y826 PolarHBondContact O-N 3.28Å; K824-Y826 PolarHBondContact O-N 3.29Å; Y826-H828 PolarHBondContact O-N 3.31Å; Y826-S829 PolarHBondContact O-N 2.78Å; Y826-S829 PolarHBondContact O-OG 2.87Å; Y826-K830 PolarHBondContact O-N 2.69Å; Y826-K830 WeakPolarHBondContact OH-CE 3.39Å
827	L	43	Very low	46.5	Very low	114 Å²	114	96 Å²	96	60%	0.597	47%	0.47	S	S	*	.	H	α-helix	trans	-62.1	-39	172.5	-72.3	168.3	0	0	0	112.7	T823 K824 H825	T823-L827 HydrophobicContact CG2-CD1 4.19Å; T823-L827 WeakPolarHBondContact O-CB 3.42Å; T823-L827 VanDerWaalsContact O-CG 3.29Å; T823-L827 WeakPolarHBondContact O-CG 3.42Å; T823-L827 PolarHBondContact O-N 3.26Å; K824-L827 PolarHBondContact O-N 3.17Å; H825-L827 PolarHBondContact O-N 2.7Å
828	H	42.3	Very low	45.2	Very low	136 Å²	136	97.4 Å²	97.4	63%	0.63	48%	0.484	S	S	*	.	H	α-helix	trans	-66.6	-37.5	174	-86.9	-79.5	0	0	0	113.2	K824 H825 Y826 K830 L831	K824-H828 PolarHBondContact O-CD2 2.88Å; K824-H828 VanDerWaalsContact O-CD2 3.32Å; K824-H828 PolarHBondContact O-N 3.43Å; H825-H828 PolarHBondContact O-N 3.17Å; Y826-H828 PolarHBondContact O-N 3.31Å; H828-K830 PolarHBondContact O-N 2.73Å; H828-L831 PolarHBondContact O-N 2.99Å
829	S	44.4	Very low	44	Very low	48 Å²	48	104.2 Å²	104.2	34%	0.336	52%	0.519	S	S	.	.	H	α-helix	trans	-64.5	-36.6	179.2	67.9	0	0	0	0	113.7	H825 Y826 L831 Y832	H825-S829 PolarHBondContact O-N 3.22Å; Y826-S829 PolarHBondContact O-N 2.78Å; Y826-S829 PolarHBondContact O-OG 2.87Å; S829-L831 PolarHBondContact O-N 2.86Å; S829-Y832 PolarHBondContact O-N 2.79Å
830	K	43.8	Very low	42.9	Very low	98 Å²	98	110.6 Å²	110.6	43%	0.426	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	2.2	178.8	-69.2	-109.1	173.4	-158.8	0	113.8	Y826 H828 D841	Y826-K830 PolarHBondContact O-N 2.69Å; Y826-K830 WeakPolarHBondContact OH-CE 3.39Å; H828-K830 PolarHBondContact O-N 2.73Å; K830-D841 IonicContact NZ-OD1 3.13Å; K830-D841 PolarHBondContact NZ-OD1 2.74Å; K830-D841 VanDerWaalsContact NZ-OD1 3.13Å
831	L	39.2	Very low	41.9	Very low	100 Å²	100	108.5 Å²	108.5	52%	0.524	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-4	171.5	-73.1	170.7	0	0	0	113.9	H828 S829 P833	H828-L831 PolarHBondContact O-N 2.99Å; S829-L831 PolarHBondContact O-N 2.86Å; L831-P833 WeakPolarHBondContact O-CD 3.44Å
832	Y	31.7	Very low	40.8	Very low	134 Å²	134	112.8 Å²	112.8	53%	0.525	55%	0.549	S	S	.	.	S	Bend	trans	-88.8	111.8	160.8	-95.1	-97.9	0	0	0	109.1	L642 S829 D834	L642-Y832 HydrophobicContact CD1-CE2 4.02Å; S829-Y832 PolarHBondContact O-N 2.79Å; Y832-D834 PolarHBondContact O-N 3.12Å
833	P	35.3	Very low	39.8	Very low	121 Å²	121	118.6 Å²	118.6	79%	0.786	58%	0.578	S	S	*	*			trans	-81.8	61.1	175.1	36.2	-35.7	0	0	0	109.5	L831 R835	L831-P833 WeakPolarHBondContact O-CD 3.44Å; P833-R835 PolarHBondContact O-N 3.48Å
834	D	34.4	Very low	38.8	Very low	138 Å²	138	120.4 Å²	120.4	74%	0.738	58%	0.581	S	S	*	*			trans	-68.2	131.9	177.2	-149.9	-9.8	0	0	0	109.6	Y832 D836	Y832-D834 PolarHBondContact O-N 3.12Å; D834-D836 PolarHBondContact O-N 3.21Å
835	R	31.2	Very low	37.8	Very low	223 Å²	223	119.6 Å²	119.6	84%	0.842	58%	0.582	S	S	*	*	S	Bend	trans	-87.1	95.4	-171.5	-72.2	176.2	171.5	179.1	-3.7	108.6	P833	P833-R835 PolarHBondContact O-N 3.48Å
836	D	33.4	Very low	37	Very low	143 Å²	143	121 Å²	121	77%	0.765	60%	0.597	S	S	*	*			trans	169.4	66.8	136	-81.4	-18.2	0	0	0	111.3	D834 T838	D834-D836 PolarHBondContact O-N 3.21Å; D836-T838 VanDerWaalsContact C-N 3.32Å; D836-T838 PolarHBondContact O-N 3.24Å
837	Q	35.5	Very low	36.3	Very low	124 Å²	124	118.3 Å²	118.3	58%	0.579	59%	0.59	S	S	*	*			trans	-78.7	80.2	168.3	-65.7	-145.4	-54	0	0	110.6	I839 D841	Q837-I839 PolarHBondContact O-N 3.37Å; Q837-D841 PolarHBondContact NE2-OD1 3.29Å; Q837-D841 PolarHBondContact NE2-OD2 2.92Å; Q837-D841 PolarHBondContact OE1-OD1 3.2Å
838	T	31.2	Very low	36.1	Very low	110 Å²	110	121.2 Å²	121.2	68%	0.675	60%	0.598	S	S	*	*			trans	-73.6	80.2	-178.3	43	0	0	0	0	113.2	D836 E840	D836-T838 VanDerWaalsContact C-N 3.32Å; D836-T838 PolarHBondContact O-N 3.24Å; T838-E840 PolarHBondContact O-N 2.97Å
839	I	37.9	Very low	35.8	Very low	143 Å²	143	119.8 Å²	119.8	73%	0.733	60%	0.603	S	S	*	*	S	Bend	trans	69.5	-36.5	158.6	-61.5	177	0	0	0	117	Q837 D841	Q837-I839 PolarHBondContact O-N 3.37Å; I839-D841 VanDerWaalsContact C-N 3.35Å; I839-D841 PolarHBondContact O-N 2.86Å
840	E	35.6	Very low	35.3	Very low	166 Å²	166	121 Å²	121	78%	0.776	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-24.6	-174.9	-61.4	-168.4	148.4	0	0	114	T838 K842 Q843	T838-E840 PolarHBondContact O-N 2.97Å; E840-K842 PolarHBondContact O-N 2.98Å; E840-Q843 PolarHBondContact O-N 2.71Å
841	D	35.9	Very low	35.1	Very low	42 Å²	42	120.4 Å²	120.4	23%	0.225	61%	0.606	C	S	.	*	H	α-helix	trans	-52.7	-17.1	176.9	-104.2	-92.1	0	0	0	114.7	K830 Q837 I839 Q843 H844 I845	K830-D841 IonicContact NZ-OD1 3.13Å; K830-D841 PolarHBondContact NZ-OD1 2.74Å; K830-D841 VanDerWaalsContact NZ-OD1 3.13Å; Q837-D841 PolarHBondContact NE2-OD1 3.29Å; Q837-D841 PolarHBondContact NE2-OD2 2.92Å; Q837-D841 PolarHBondContact OE1-OD1 3.2Å; I839-D841 VanDerWaalsContact C-N 3.35Å; I839-D841 PolarHBondContact O-N 2.86Å; D841-Q843 PolarHBondContact O-N 3.38Å; D841-H844 PolarHBondContact O-N 2.9Å; D841-I845 PolarHBondContact O-N 2.82Å
842	K	35.2	Very low	35.2	Very low	169 Å²	169	118.1 Å²	118.1	74%	0.735	59%	0.592	S	S	*	*	H	α-helix	trans	-60.1	-28.4	174.3	-75.5	-177.3	176.8	176.3	0	113.3	E840	E840-K842 PolarHBondContact O-N 2.98Å
843	Q	36.2	Very low	35.6	Very low	161 Å²	161	116.9 Å²	116.9	75%	0.752	60%	0.598	S	S	*	*	H	α-helix	trans	-73.1	-38.6	170.7	-67.8	-166.8	1.1	0	0	111.5	E840 D841 I845 S846	E840-Q843 PolarHBondContact O-N 2.71Å; D841-Q843 PolarHBondContact O-N 3.38Å; Q843-I845 PolarHBondContact O-N 2.99Å; Q843-S846 WeakPolarHBondContact O-CB 3.41Å; Q843-S846 PolarHBondContact O-N 3.33Å; Q843-S846 VanDerWaalsContact O-N 3.08Å; Q843-S846 PolarHBondContact O-OG 3.24Å
844	H	34.5	Very low	35.9	Very low	106 Å²	106	113.5 Å²	113.5	49%	0.491	59%	0.586	S	S	.	*	H	α-helix	trans	-70	-11.3	178.9	-82	-58	0	0	0	115.4	D841 S846 C847	D841-H844 PolarHBondContact O-N 2.9Å; H844-S846 VanDerWaalsContact C-N 3.32Å; H844-C847 PolarHBondContact ND1-SG 2.89Å; H844-C847 VanDerWaalsContact ND1-SG 3.37Å; H844-C847 WeakPolarHBondContact O-CB 3.19Å; H844-C847 PolarHBondContact O-N 3.49Å
845	I	33.6	Very low	36.4	Very low	106 Å²	106	113 Å²	113	54%	0.544	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.9	-28.9	169.6	-66.1	170.8	0	0	0	111.5	D841 Q843 C847	D841-I845 PolarHBondContact O-N 2.82Å; Q843-I845 PolarHBondContact O-N 2.99Å; I845-C847 VanDerWaalsContact C-N 3.26Å; I845-C847 PolarHBondContact O-N 3.43Å
846	S	34.1	Very low	37.3	Very low	80 Å²	80	105.2 Å²	105.2	56%	0.559	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-69.1	-22.6	175.2	74.1	0	0	0	0	113.3	Q843 H844 K848	Q843-S846 WeakPolarHBondContact O-CB 3.41Å; Q843-S846 PolarHBondContact O-N 3.33Å; Q843-S846 VanDerWaalsContact O-N 3.08Å; Q843-S846 PolarHBondContact O-OG 3.24Å; H844-S846 VanDerWaalsContact C-N 3.32Å; S846-K848 PolarHBondContact O-N 2.79Å
847	C	34.7	Very low	38.4	Very low	22 Å²	22	99.3 Å²	99.3	15%	0.149	53%	0.527	C	S	.	.	G	3₁₀ helix	trans	-65.9	-7.5	-179.2	-56.5	0	0	0	0	114.5	H844 I845 S849 F851	H844-C847 PolarHBondContact ND1-SG 2.89Å; H844-C847 VanDerWaalsContact ND1-SG 3.37Å; H844-C847 WeakPolarHBondContact O-CB 3.19Å; H844-C847 PolarHBondContact O-N 3.49Å; I845-C847 VanDerWaalsContact C-N 3.26Å; I845-C847 PolarHBondContact O-N 3.43Å; C847-S849 VanDerWaalsContact C-N 3.25Å; C847-S849 PolarHBondContact O-N 2.8Å; C847-F851 HydrophobicContact CB-CD2 3.65Å; C847-F851 HydrophobicContact CB-CE2 3.71Å; C847-F851 HydrophobicContact CB-CG 4.15Å; C847-F851 HydrophobicContact CB-CZ 4.22Å; C847-F851 WeakPolarHBondContact SG-CE2 3.28Å; C847-F851 WeakPolarHBondContact SG-CZ 3.41Å
848	K	37.2	Very low	39.2	Very low	175 Å²	175	96.5 Å²	96.5	76%	0.761	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-64.8	-15.1	-173.7	-86.8	-172.8	170.8	-176.1	0	116	S846	S846-K848 PolarHBondContact O-N 2.79Å
849	S	36.8	Very low	40.1	Very low	106 Å²	106	95.8 Å²	95.8	74%	0.741	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137	-9.9	-175.6	57.3	0	0	0	0	116.2	C847	C847-S849 VanDerWaalsContact C-N 3.25Å; C847-S849 PolarHBondContact O-N 2.8Å
850	T	34.9	Very low	41	Very low	74 Å²	74	89 Å²	89	45%	0.454	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-14.6	-167.3	46.6	0	0	0	0	115.3	F852	T850-F852 VanDerWaalsContact C-N 3.31Å; T850-F852 PolarHBondContact O-N 3.33Å
851	F	38.1	Very low	41.8	Very low	85 Å²	85	81.2 Å²	81.2	37%	0.373	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-5.3	-165.7	-88	-117.6	0	0	0	115.5	C847 L859	C847-F851 HydrophobicContact CB-CD2 3.65Å; C847-F851 HydrophobicContact CB-CE2 3.71Å; C847-F851 HydrophobicContact CB-CG 4.15Å; C847-F851 HydrophobicContact CB-CZ 4.22Å; C847-F851 WeakPolarHBondContact SG-CE2 3.28Å; C847-F851 WeakPolarHBondContact SG-CZ 3.41Å; F851-L859 HydrophobicContact CD1-CD1 3.81Å; F851-L859 HydrophobicContact CE1-CD1 4.07Å; F851-L859 HydrophobicContact CE1-CD2 4.16Å; F851-L859 HydrophobicContact CG-CD1 4.49Å
852	F	42.3	Very low	42.6	Very low	53 Å²	53	87.4 Å²	87.4	23%	0.232	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-138.5	64.7	171.9	-81.7	-67.9	0	0	0	112.4	W822 T850 G854 L857 L860	W822-F852 HydrophobicContact CG-CE2 4.33Å; T850-F852 VanDerWaalsContact C-N 3.31Å; T850-F852 PolarHBondContact O-N 3.33Å; F852-G854 PolarHBondContact O-N 3.18Å; F852-L857 HydrophobicContact CE1-CD2 4.05Å; F852-L860 HydrophobicContact CE1-CD1 4.48Å; F852-L860 HydrophobicContact CE2-CD1 3.93Å; F852-L860 HydrophobicContact CZ-CB 4.23Å; F852-L860 HydrophobicContact CZ-CD1 3.48Å; F852-L860 VanDerWaalsContact CZ-CD1 3.48Å; F852-L860 HydrophobicContact CZ-CG 4.48Å
853	T	39.8	Very low	43.5	Very low	107 Å²	107	82.1 Å²	82.1	66%	0.656	44%	0.438	S	S	*	.			trans	-72.5	58.9	163.9	52.8	0	0	0	0	111.4	E855	T853-E855 PolarHBondContact O-N 2.91Å
854	G	41.3	Very low	44	Very low	51 Å²	51	79.8 Å²	79.8	53%	0.526	44%	0.437	S	S	.	.	S	Bend	trans	69.9	-40.6	168.3	0	0	0	0	0	118.5	K815 F852	K815-G854 WeakPolarHBondContact CD-O 3.23Å; F852-G854 PolarHBondContact O-N 3.18Å
855	E	45.7	Very low	44.4	Very low	127 Å²	127	76.1 Å²	76.1	59%	0.593	42%	0.421	S	S	*	.	S	Bend	trans	-100.7	-53.3	-151.9	-66.6	163.3	175.9	0	0	113.2	K815 T853	K815-E855 PolarHBondContact NZ-O 3.27Å; T853-E855 PolarHBondContact O-N 2.91Å
856	S	49.7	Very low	44.8	Very low	60 Å²	60	76.2 Å²	76.2	42%	0.42	43%	0.428	S	S	.	.			trans	-99.4	141.3	-174	-171	0	0	0	0	114.3	T858	S856-T858 PolarHBondContact OG-N 2.99Å; S856-T858 PolarHBondContact OG-OG1 3.21Å; S856-T858 VanDerWaalsContact OG-OG1 3.11Å
857	L	55.5	Low	45	Very low	18 Å²	18	79.8 Å²	79.8	9%	0.094	43%	0.429	C	S	.	.			trans	-114.7	2.9	177.3	-71.9	146	0	0	0	113	K815 I818 F852 L859 L860 A861 L881 I935	K815-L857 HydrophobicContact CD-CD1 4.09Å; K815-L857 HydrophobicContact CG-CD1 4.15Å; I818-L857 HydrophobicContact CG2-CD2 4.26Å; F852-L857 HydrophobicContact CE1-CD2 4.05Å; L857-L859 PolarHBondContact O-N 3.3Å; L857-L860 WeakPolarHBondContact O-CA 3.47Å; L857-L860 VanDerWaalsContact O-CB 3.23Å; L857-L860 WeakPolarHBondContact O-CB 3.46Å; L857-L860 PolarHBondContact O-N 3.32Å; L857-A861 PolarHBondContact O-N 2.89Å; L857-L881 HydrophobicContact CB-CD1 4.05Å; L857-L881 HydrophobicContact CB-CD2 4Å; L857-L881 HydrophobicContact CD1-CD2 4.3Å; L857-I935 HydrophobicContact CD1-CD1 3.45Å; L857-I935 VanDerWaalsContact CD1-CD1 3.45Å; L857-I935 HydrophobicContact CD1-CG1 3.74Å; L857-I935 HydrophobicContact CD2-CD1 4.14Å; L857-I935 HydrophobicContact CG-CD1 4.41Å
858	T	52.9	Low	45.5	Very low	66 Å²	66	79.1 Å²	79.1	41%	0.405	42%	0.424	S	S	.	.	H	α-helix	trans	-61.1	-32.9	-176.2	55.1	0	0	0	0	112.6	S856 L860 A861 R862	S856-T858 PolarHBondContact OG-N 2.99Å; S856-T858 PolarHBondContact OG-OG1 3.21Å; S856-T858 VanDerWaalsContact OG-OG1 3.11Å; T858-L860 VanDerWaalsContact C-N 3.27Å; T858-L860 PolarHBondContact O-N 3.26Å; T858-A861 PolarHBondContact O-N 3.17Å; T858-R862 WeakPolarHBondContact O-CG 3.45Å; T858-R862 PolarHBondContact O-N 3.28Å; T858-R862 VanDerWaalsContact O-N 3.09Å
859	L	51.3	Low	45.4	Very low	94 Å²	94	74.5 Å²	74.5	49%	0.492	42%	0.418	S	S	.	.	H	α-helix	trans	-64.3	-28.5	173.1	-71.2	165.6	0	0	0	113.2	F851 L857	F851-L859 HydrophobicContact CD1-CD1 3.81Å; F851-L859 HydrophobicContact CE1-CD1 4.07Å; F851-L859 HydrophobicContact CE1-CD2 4.16Å; F851-L859 HydrophobicContact CG-CD1 4.49Å; L857-L859 PolarHBondContact O-N 3.3Å
860	L	55.2	Low	45.3	Very low	0 Å²	0	73.7 Å²	73.7	0%	0	41%	0.412	C	S	.	.	H	α-helix	trans	-72.7	-50.7	171.8	-147.2	99.6	0	0	0	109.6	I818 W822 F852 L857 T858 R862 H863 V877 L878 L881	I818-L860 HydrophobicContact CG2-CD1 4.36Å; I818-L860 HydrophobicContact CG2-CD2 4.01Å; W822-L860 HydrophobicContact CB-CD1 4.4Å; W822-L860 HydrophobicContact CD2-CD1 3.62Å; W822-L860 HydrophobicContact CE3-CD1 3.29Å; W822-L860 HydrophobicContact CE3-CG 3.98Å; W822-L860 HydrophobicContact CG-CD1 4.1Å; W822-L860 HydrophobicContact CZ3-CD1 3.8Å; W822-L860 HydrophobicContact CZ3-CG 4.02Å; F852-L860 HydrophobicContact CE1-CD1 4.48Å; F852-L860 HydrophobicContact CE2-CD1 3.93Å; F852-L860 HydrophobicContact CZ-CB 4.23Å; F852-L860 HydrophobicContact CZ-CD1 3.48Å; F852-L860 VanDerWaalsContact CZ-CD1 3.48Å; F852-L860 HydrophobicContact CZ-CG 4.48Å; L857-L860 WeakPolarHBondContact O-CA 3.47Å; L857-L860 VanDerWaalsContact O-CB 3.23Å; L857-L860 WeakPolarHBondContact O-CB 3.46Å; L857-L860 PolarHBondContact O-N 3.32Å; T858-L860 VanDerWaalsContact C-N 3.27Å; T858-L860 PolarHBondContact O-N 3.26Å; L860-R862 VanDerWaalsContact C-N 3.27Å; L860-R862 PolarHBondContact O-N 3.09Å; L860-H863 WeakPolarHBondContact O-CB 3.44Å; L860-H863 PolarHBondContact O-N 3.24Å; L860-H863 VanDerWaalsContact O-N 3.09Å; L860-V877 HydrophobicContact CD2-CG1 4.07Å; L860-L878 VanDerWaalsContact C-CD2 3.49Å; L860-L878 HydrophobicContact CB-CD2 4.28Å; L860-L878 HydrophobicContact CD2-CD2 3.76Å; L860-L878 HydrophobicContact CD2-CG 4.26Å; L860-L878 HydrophobicContact CG-CD2 3.92Å; L860-L878 WeakPolarHBondContact O-CD2 3.27Å; L860-L881 HydrophobicContact CB-CD1 4.38Å; L860-L881 HydrophobicContact CD2-CD1 3.98Å
861	A	53.6	Low	45.3	Very low	4 Å²	4	73.5 Å²	73.5	3%	0.033	41%	0.407	C	S	.	.	H	α-helix	trans	-54.9	-41.2	-176.6	0	0	0	0	0	113	L857 T858 H863 L881 R882	L857-A861 PolarHBondContact O-N 2.89Å; T858-A861 PolarHBondContact O-N 3.17Å; A861-H863 VanDerWaalsContact C-N 3.33Å; A861-H863 PolarHBondContact O-N 3.1Å; A861-L881 HydrophobicContact CB-CB 3.9Å; A861-R882 HydrophobicContact CB-CG 4.38Å; A861-R882 WeakPolarHBondContact O-CG 3.31Å; A861-R882 PolarHBondContact O-NE 3.42Å
862	R	51.8	Low	45.7	Very low	171 Å²	171	75.4 Å²	75.4	65%	0.645	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-2.9	-178	-65.6	177.4	-175.9	-166.5	-0.9	114.9	T858 L860 E885	T858-R862 WeakPolarHBondContact O-CG 3.45Å; T858-R862 PolarHBondContact O-N 3.28Å; T858-R862 VanDerWaalsContact O-N 3.09Å; L860-R862 VanDerWaalsContact C-N 3.27Å; L860-R862 PolarHBondContact O-N 3.09Å; R862-E885 IonicContact CZ-OE1 3.87Å; R862-E885 IonicContact NE-OE1 3.37Å; R862-E885 PolarHBondContact NE-OE1 3.1Å; R862-E885 IonicContact NH2-OE1 2.82Å; R862-E885 PolarHBondContact NH2-OE1 3.49Å
863	H	54.7	Low	45.9	Very low	59 Å²	59	77.5 Å²	77.5	27%	0.273	43%	0.434	S	S	.	.			trans	-66.8	129.1	-178.9	-168.1	-104.2	0	0	0	111.7	W822 L860 A861 D865 W868 R882	W822-H863 HydrophobicContact CH2-CB 3.96Å; W822-H863 AromaticContact CH2-CD2 3.68Å; W822-H863 AromaticContact CH2-CG 3.58Å; W822-H863 AromaticContact CH2-ND1 3.84Å; W822-H863 AromaticContact CH2-NE2 3.99Å; L860-H863 WeakPolarHBondContact O-CB 3.44Å; L860-H863 PolarHBondContact O-N 3.24Å; L860-H863 VanDerWaalsContact O-N 3.09Å; A861-H863 VanDerWaalsContact C-N 3.33Å; A861-H863 PolarHBondContact O-N 3.1Å; H863-D865 VanDerWaalsContact CE1-CB 3.47Å; H863-D865 WeakPolarHBondContact CE1-CB 3.36Å; H863-W868 AromaticContact CE1-NE1 3.57Å; H863-W868 AromaticContact ND1-CD1 3.9Å; H863-W868 AromaticContact ND1-NE1 3.61Å; H863-R882 PolarHBondContact O-NH2 3.23Å
864	P	45.8	Very low	46.4	Very low	112 Å²	112	72.7 Å²	72.7	73%	0.727	40%	0.404	S	S	*	.			trans	-86.6	-17.3	-166.8	32.3	-36.8	0	0	0	115.6	P866	P864-P866 WeakPolarHBondContact O-CD 3.4Å
865	D	44.3	Very low	46.8	Very low	29 Å²	29	70.6 Å²	70.6	16%	0.155	38%	0.382	C	S	.	.			trans	-61.1	119.2	-171.9	176.7	-4.8	0	0	0	112.2	H863 R867 W868	H863-D865 VanDerWaalsContact CE1-CB 3.47Å; H863-D865 WeakPolarHBondContact CE1-CB 3.36Å; D865-R867 VanDerWaalsContact C-N 3.29Å; D865-R867 PolarHBondContact O-N 2.72Å; D865-R867 VanDerWaalsContact OD1-CB 3.26Å; D865-R867 WeakPolarHBondContact OD1-CB 3.2Å; D865-R867 WeakPolarHBondContact OD1-CG 3.31Å; D865-R867 IonicContact OD1-CZ 3.9Å; D865-R867 PolarHBondContact OD1-N 3.37Å; D865-R867 IonicContact OD1-NE 3.03Å; D865-R867 PolarHBondContact OD1-NE 2.86Å; D865-R867 IonicContact OD1-NH2 3.21Å; D865-R867 IonicContact OD2-CZ 3.34Å; D865-R867 IonicContact OD2-NE 3.1Å; D865-R867 PolarHBondContact OD2-NE 3.45Å; D865-R867 VanDerWaalsContact OD2-NE 3.1Å; D865-R867 IonicContact OD2-NH2 3.37Å; D865-R867 PolarHBondContact OD2-NH2 3.05Å; D865-W868 VanDerWaalsContact CG-CD1 3.47Å; D865-W868 VanDerWaalsContact O-CD1 3.27Å; D865-W868 PolarHBondContact OD2-NE1 2.94Å
866	P	41.6	Very low	47.1	Very low	108 Å²	108	67.5 Å²	67.5	70%	0.701	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-71.5	-19.1	-175.3	29.5	-36.1	0	0	0	113.4	P864 W868 A869	P864-P866 WeakPolarHBondContact O-CD 3.4Å; P866-W868 PolarHBondContact O-N 3.11Å; P866-W868 VanDerWaalsContact O-N 3.12Å; P866-A869 WeakPolarHBondContact O-CB 3.26Å; P866-A869 PolarHBondContact O-N 3.39Å
867	R	39	Very low	47.3	Very low	154 Å²	154	64.6 Å²	64.6	58%	0.581	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-60.9	-25.2	-179.4	-64.3	176.3	-65.7	-172.4	1.3	112.5	D865 A869 S870	D865-R867 VanDerWaalsContact C-N 3.29Å; D865-R867 PolarHBondContact O-N 2.72Å; D865-R867 VanDerWaalsContact OD1-CB 3.26Å; D865-R867 WeakPolarHBondContact OD1-CB 3.2Å; D865-R867 WeakPolarHBondContact OD1-CG 3.31Å; D865-R867 IonicContact OD1-CZ 3.9Å; D865-R867 PolarHBondContact OD1-N 3.37Å; D865-R867 IonicContact OD1-NE 3.03Å; D865-R867 PolarHBondContact OD1-NE 2.86Å; D865-R867 IonicContact OD1-NH2 3.21Å; D865-R867 IonicContact OD2-CZ 3.34Å; D865-R867 IonicContact OD2-NE 3.1Å; D865-R867 PolarHBondContact OD2-NE 3.45Å; D865-R867 VanDerWaalsContact OD2-NE 3.1Å; D865-R867 IonicContact OD2-NH2 3.37Å; D865-R867 PolarHBondContact OD2-NH2 3.05Å; R867-A869 PolarHBondContact O-N 3.27Å; R867-S870 WeakPolarHBondContact O-CB 3.31Å; R867-S870 PolarHBondContact O-N 3.43Å; R867-S870 PolarHBondContact O-OG 3.25Å
868	W	43.3	Very low	47.3	Very low	9 Å²	9	63.9 Å²	63.9	3%	0.034	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-64.6	-21.7	177.2	-66.8	78.4	0	0	0	113.7	W822 H825 H863 D865 P866 S870 M871 M874 G875 L878	W822-W868 AromaticContact CD2-CH2 3.92Å; W822-W868 HydrophobicContact CD2-CH2 3.92Å; W822-W868 HydrophobicContact CE3-CE3 4.31Å; W822-W868 AromaticContact CE3-CH2 3.12Å; W822-W868 HydrophobicContact CE3-CH2 3.12Å; W822-W868 AromaticContact CE3-CZ2 3.79Å; W822-W868 HydrophobicContact CE3-CZ2 3.79Å; W822-W868 AromaticContact CE3-CZ3 3.45Å; W822-W868 HydrophobicContact CE3-CZ3 3.45Å; W822-W868 VanDerWaalsContact CE3-CZ3 3.45Å; W822-W868 HydrophobicContact CH2-CH2 4.05Å; W822-W868 AromaticContact CH2-CZ2 3.82Å; W822-W868 HydrophobicContact CH2-CZ2 3.82Å; W822-W868 HydrophobicContact CZ3-CD2 4.15Å; W822-W868 AromaticContact CZ3-CE2 3.88Å; W822-W868 AromaticContact CZ3-CE3 3.99Å; W822-W868 HydrophobicContact CZ3-CE3 3.99Å; W822-W868 AromaticContact CZ3-CH2 3.22Å; W822-W868 HydrophobicContact CZ3-CH2 3.22Å; W822-W868 AromaticContact CZ3-CZ2 3.4Å; W822-W868 HydrophobicContact CZ3-CZ2 3.4Å; W822-W868 VanDerWaalsContact CZ3-CZ2 3.4Å; W822-W868 AromaticContact CZ3-CZ3 3.55Å; W822-W868 HydrophobicContact CZ3-CZ3 3.55Å; H825-W868 HydrophobicContact CB-CH2 3.75Å; H825-W868 HydrophobicContact CB-CZ2 4.26Å; H825-W868 AromaticContact CE1-CE2 3.97Å; H825-W868 AromaticContact CE1-CZ2 3.71Å; H825-W868 AromaticContact CG-CH2 3.65Å; H825-W868 AromaticContact CG-CZ2 3.76Å; H825-W868 AromaticContact ND1-CE2 3.93Å; H825-W868 AromaticContact ND1-CH2 3.62Å; H825-W868 AromaticContact ND1-CZ2 3.21Å; H825-W868 WeakPolarHBondContact ND1-CZ2 3.44Å; H863-W868 AromaticContact CE1-NE1 3.57Å; H863-W868 AromaticContact ND1-CD1 3.9Å; H863-W868 AromaticContact ND1-NE1 3.61Å; D865-W868 VanDerWaalsContact CG-CD1 3.47Å; D865-W868 VanDerWaalsContact O-CD1 3.27Å; D865-W868 PolarHBondContact OD2-NE1 2.94Å; P866-W868 PolarHBondContact O-N 3.11Å; P866-W868 VanDerWaalsContact O-N 3.12Å; W868-S870 PolarHBondContact O-N 2.93Å; W868-M871 HydrophobicContact CE3-SD 4.4Å; W868-M871 HydrophobicContact CZ3-SD 4.45Å; W868-M871 PolarHBondContact O-N 3.26Å; W868-M874 HydrophobicContact CE3-CB 4.35Å; W868-M874 HydrophobicContact CE3-CG 3.83Å; W868-M874 HydrophobicContact CE3-SD 4.48Å; W868-M874 HydrophobicContact CZ3-CG 3.84Å; W868-M874 HydrophobicContact CZ3-SD 3.88Å; W868-G875 WeakPolarHBondContact O-CA 3.48Å; W868-G875 PolarHBondContact O-N 2.78Å; W868-L878 HydrophobicContact CB-CD1 3.57Å; W868-L878 HydrophobicContact CD2-CD1 4.25Å; W868-L878 HydrophobicContact CE3-CD1 4.03Å; W868-L878 HydrophobicContact CG-CD1 4.11Å
869	A	36.7	Very low	47.4	Very low	77 Å²	77	64 Å²	64	64%	0.636	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-64.8	-25.8	169.5	0	0	0	0	0	112.6	P866 R867	P866-A869 WeakPolarHBondContact O-CB 3.26Å; P866-A869 PolarHBondContact O-N 3.39Å; R867-A869 PolarHBondContact O-N 3.27Å
870	S	33.9	Very low	47.7	Very low	89 Å²	89	60.7 Å²	60.7	62%	0.622	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-86.3	-13.9	-179.6	76.1	0	0	0	0	114.2	R867 W868 N872	R867-S870 WeakPolarHBondContact O-CB 3.31Å; R867-S870 PolarHBondContact O-N 3.43Å; R867-S870 PolarHBondContact O-OG 3.25Å; W868-S870 PolarHBondContact O-N 2.93Å; S870-N872 VanDerWaalsContact C-N 3.33Å; S870-N872 PolarHBondContact O-N 3.29Å; S870-N872 VanDerWaalsContact O-N 3.1Å
871	M	34.9	Very low	47.7	Very low	71 Å²	71	61.7 Å²	61.7	35%	0.35	34%	0.335	S	S	.	.	S	Bend	trans	-82.8	74.5	171.4	-73	-168.7	72.9	0	0	110.3	H825 W868 I873 M874 G875	H825-M871 PolarHBondContact CD2-SD 2.86Å; W868-M871 HydrophobicContact CE3-SD 4.4Å; W868-M871 HydrophobicContact CZ3-SD 4.45Å; W868-M871 PolarHBondContact O-N 3.26Å; M871-I873 CarbonylContact O-C 3.59Å; M871-I873 PolarHBondContact O-N 3.17Å; M871-M874 HydrophobicContact CB-CB 4.3Å; M871-M874 PolarHBondContact O-N 2.9Å; M871-G875 PolarHBondContact O-N 2.89Å
872	N	46.9	Very low	48	Very low	124 Å²	124	65.8 Å²	65.8	66%	0.663	35%	0.35	S	S	*	.	H	α-helix	trans	-14.5	-66.4	-174.3	-71	-5.4	0	0	0	116.4	S870 Q876	S870-N872 VanDerWaalsContact C-N 3.33Å; S870-N872 PolarHBondContact O-N 3.29Å; S870-N872 VanDerWaalsContact O-N 3.1Å; N872-Q876 WeakPolarHBondContact O-CB 3.37Å; N872-Q876 VanDerWaalsContact O-CG 3.26Å; N872-Q876 WeakPolarHBondContact O-CG 3.06Å; N872-Q876 PolarHBondContact O-N 3.1Å
873	I	46.8	Very low	48.4	Very low	97 Å²	97	60.6 Å²	60.6	50%	0.497	34%	0.34	S	S	.	.	H	α-helix	trans	-67.7	-46.7	-178.4	-61.3	174.2	0	0	0	112.3	I813 M871 Q876 V877	I813-I873 HydrophobicContact CD1-CG2 3.69Å; M871-I873 CarbonylContact O-C 3.59Å; M871-I873 PolarHBondContact O-N 3.17Å; I873-Q876 PolarHBondContact O-N 2.84Å; I873-V877 HydrophobicContact CG2-CG2 4.49Å; I873-V877 VanDerWaalsContact O-CG2 3.22Å; I873-V877 WeakPolarHBondContact O-CG2 2.97Å; I873-V877 PolarHBondContact O-N 3.33Å
874	M	49.4	Very low	48.5	Very low	7 Å²	7	61.1 Å²	61.1	3%	0.034	34%	0.344	C	S	.	.	H	α-helix	trans	-74.8	-27.3	-178.7	-155.4	125.1	-70.7	0	0	112.5	I818 L821 W868 M871 V877 L878	I818-M874 HydrophobicContact CB-CE 4.27Å; I818-M874 HydrophobicContact CG1-CE 4.11Å; I818-M874 HydrophobicContact CG2-CE 3.93Å; L821-M874 HydrophobicContact CB-CE 4.01Å; L821-M874 HydrophobicContact CB-SD 4.14Å; L821-M874 HydrophobicContact CD1-CE 3.71Å; W868-M874 HydrophobicContact CE3-CB 4.35Å; W868-M874 HydrophobicContact CE3-CG 3.83Å; W868-M874 HydrophobicContact CE3-SD 4.48Å; W868-M874 HydrophobicContact CZ3-CG 3.84Å; W868-M874 HydrophobicContact CZ3-SD 3.88Å; M871-M874 HydrophobicContact CB-CB 4.3Å; M871-M874 PolarHBondContact O-N 2.9Å; M874-V877 HydrophobicContact CE-CG2 4.28Å; M874-V877 PolarHBondContact O-N 2.62Å; M874-L878 HydrophobicContact CG-CD1 4.43Å; M874-L878 WeakPolarHBondContact O-CB 3.46Å; M874-L878 WeakPolarHBondContact O-CD1 3.4Å; M874-L878 VanDerWaalsContact O-CG 3.26Å; M874-L878 WeakPolarHBondContact O-CG 3.39Å; M874-L878 PolarHBondContact O-N 2.98Å
875	G	50.7	Low	48.9	Very low	6 Å²	6	57.5 Å²	57.5	6%	0.062	32%	0.318	C	S	.	.	H	α-helix	trans	-62.3	-45.2	166.8	0	0	0	0	0	111.6	W868 M871 L878 C879	W868-G875 WeakPolarHBondContact O-CA 3.48Å; W868-G875 PolarHBondContact O-N 2.78Å; M871-G875 PolarHBondContact O-N 2.89Å; G875-L878 PolarHBondContact O-N 3.41Å; G875-C879 WeakPolarHBondContact O-CB 3.26Å; G875-C879 PolarHBondContact O-N 2.78Å; G875-C879 PolarHBondContact O-SG 2.9Å; G875-C879 VanDerWaalsContact O-SG 3.41Å
876	Q	52.2	Low	49.2	Very low	62 Å²	62	65.1 Å²	65.1	29%	0.29	34%	0.344	S	S	.	.	H	α-helix	trans	-63.4	-42.8	172.9	-73	168.3	5.8	0	0	112.3	N872 I873 L878 T880 I937	N872-Q876 WeakPolarHBondContact O-CB 3.37Å; N872-Q876 VanDerWaalsContact O-CG 3.26Å; N872-Q876 WeakPolarHBondContact O-CG 3.06Å; N872-Q876 PolarHBondContact O-N 3.1Å; I873-Q876 PolarHBondContact O-N 2.84Å; Q876-L878 VanDerWaalsContact C-N 3.34Å; Q876-L878 PolarHBondContact O-N 3.1Å; Q876-T880 VanDerWaalsContact O-CB 3.29Å; Q876-T880 WeakPolarHBondContact O-CB 3.35Å; Q876-T880 PolarHBondContact O-N 3.32Å; Q876-T880 PolarHBondContact O-OG1 3.08Å; Q876-I937 HydrophobicContact CB-CG2 4.4Å
877	V	53.8	Low	49.6	Very low	0 Å²	0	69 Å²	69	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-54.4	-50.1	171.8	173.1	0	0	0	0	110.4	I813 I818 L860 I873 M874 T880 L881 I935 I937	I813-V877 HydrophobicContact CD1-CG2 4.16Å; I818-V877 HydrophobicContact CD1-CG1 4.17Å; I818-V877 HydrophobicContact CD1-CG2 4.47Å; L860-V877 HydrophobicContact CD2-CG1 4.07Å; I873-V877 HydrophobicContact CG2-CG2 4.49Å; I873-V877 VanDerWaalsContact O-CG2 3.22Å; I873-V877 WeakPolarHBondContact O-CG2 2.97Å; I873-V877 PolarHBondContact O-N 3.33Å; M874-V877 HydrophobicContact CE-CG2 4.28Å; M874-V877 PolarHBondContact O-N 2.62Å; V877-T880 PolarHBondContact O-N 2.85Å; V877-L881 HydrophobicContact CG1-CD1 3.82Å; V877-L881 HydrophobicContact CG1-CG 4.42Å; V877-L881 WeakPolarHBondContact O-CB 3.49Å; V877-L881 VanDerWaalsContact O-CG 3.31Å; V877-L881 WeakPolarHBondContact O-CG 3.44Å; V877-L881 PolarHBondContact O-N 3.16Å; V877-I935 HydrophobicContact CG1-CD1 4.25Å; V877-I937 HydrophobicContact CB-CD1 4.13Å; V877-I937 HydrophobicContact CG1-CD1 4.5Å; V877-I937 HydrophobicContact CG2-CD1 3.44Å; V877-I937 VanDerWaalsContact CG2-CD1 3.44Å
878	L	54.5	Low	49.7	Very low	3 Å²	3	63.1 Å²	63.1	2%	0.016	33%	0.329	C	S	.	.	H	α-helix	trans	-70	-41.2	-176.4	-75.1	165.3	0	0	0	113	L860 W868 M874 G875 Q876 T880 L881 R882	L860-L878 VanDerWaalsContact C-CD2 3.49Å; L860-L878 HydrophobicContact CB-CD2 4.28Å; L860-L878 HydrophobicContact CD2-CD2 3.76Å; L860-L878 HydrophobicContact CD2-CG 4.26Å; L860-L878 HydrophobicContact CG-CD2 3.92Å; L860-L878 WeakPolarHBondContact O-CD2 3.27Å; W868-L878 HydrophobicContact CB-CD1 3.57Å; W868-L878 HydrophobicContact CD2-CD1 4.25Å; W868-L878 HydrophobicContact CE3-CD1 4.03Å; W868-L878 HydrophobicContact CG-CD1 4.11Å; M874-L878 HydrophobicContact CG-CD1 4.43Å; M874-L878 WeakPolarHBondContact O-CB 3.46Å; M874-L878 WeakPolarHBondContact O-CD1 3.4Å; M874-L878 VanDerWaalsContact O-CG 3.26Å; M874-L878 WeakPolarHBondContact O-CG 3.39Å; M874-L878 PolarHBondContact O-N 2.98Å; G875-L878 PolarHBondContact O-N 3.41Å; Q876-L878 VanDerWaalsContact C-N 3.34Å; Q876-L878 PolarHBondContact O-N 3.1Å; L878-T880 VanDerWaalsContact C-N 3.32Å; L878-L881 PolarHBondContact O-N 2.82Å; L878-R882 VanDerWaalsContact O-CB 3.31Å; L878-R882 WeakPolarHBondContact O-CB 3.14Å; L878-R882 WeakPolarHBondContact O-CD 3.22Å; L878-R882 WeakPolarHBondContact O-CG 3.35Å; L878-R882 PolarHBondContact O-N 2.79Å
879	C	55.9	Low	49.4	Very low	67 Å²	67	67 Å²	67	45%	0.453	35%	0.351	S	S	.	.	H	α-helix	trans	-64.1	-38.2	173.4	-72.8	0	0	0	0	111.6	G875 S883	G875-C879 WeakPolarHBondContact O-CB 3.26Å; G875-C879 PolarHBondContact O-N 2.78Å; G875-C879 PolarHBondContact O-SG 2.9Å; G875-C879 VanDerWaalsContact O-SG 3.41Å; C879-S883 VanDerWaalsContact O-CB 3.31Å; C879-S883 WeakPolarHBondContact O-CB 3.29Å; C879-S883 PolarHBondContact O-N 2.78Å; C879-S883 PolarHBondContact O-OG 3.34Å
880	T	56	Low	49.7	Very low	26 Å²	26	68.1 Å²	68.1	16%	0.16	35%	0.35	C	S	.	.	H	α-helix	trans	-64.4	-49.6	174.5	-55.2	0	0	0	0	110.9	Q876 V877 L878 R882 S883 L884 I937	Q876-T880 VanDerWaalsContact O-CB 3.29Å; Q876-T880 WeakPolarHBondContact O-CB 3.35Å; Q876-T880 PolarHBondContact O-N 3.32Å; Q876-T880 PolarHBondContact O-OG1 3.08Å; V877-T880 PolarHBondContact O-N 2.85Å; L878-T880 VanDerWaalsContact C-N 3.32Å; T880-R882 PolarHBondContact O-N 3.25Å; T880-S883 PolarHBondContact O-N 2.67Å; T880-L884 HydrophobicContact CG2-CD1 4.09Å; T880-L884 WeakPolarHBondContact O-CG 3.47Å; T880-L884 PolarHBondContact O-N 3.37Å; T880-I937 HydrophobicContact CG2-CG1 4.23Å
881	L	56.9	Low	49.9	Very low	21 Å²	21	68.3 Å²	68.3	11%	0.11	34%	0.343	C	S	.	.	H	α-helix	trans	-61.1	-42.7	177.7	-74.2	172	0	0	0	112.8	L857 L860 A861 V877 L878 S883 L884 E885 I935	L857-L881 HydrophobicContact CB-CD1 4.05Å; L857-L881 HydrophobicContact CB-CD2 4Å; L857-L881 HydrophobicContact CD1-CD2 4.3Å; L860-L881 HydrophobicContact CB-CD1 4.38Å; L860-L881 HydrophobicContact CD2-CD1 3.98Å; A861-L881 HydrophobicContact CB-CB 3.9Å; V877-L881 HydrophobicContact CG1-CD1 3.82Å; V877-L881 HydrophobicContact CG1-CG 4.42Å; V877-L881 WeakPolarHBondContact O-CB 3.49Å; V877-L881 VanDerWaalsContact O-CG 3.31Å; V877-L881 WeakPolarHBondContact O-CG 3.44Å; V877-L881 PolarHBondContact O-N 3.16Å; L878-L881 PolarHBondContact O-N 2.82Å; L881-S883 VanDerWaalsContact C-N 3.32Å; L881-S883 PolarHBondContact O-N 3.21Å; L881-L884 PolarHBondContact O-N 3.32Å; L881-E885 WeakPolarHBondContact O-CB 3.1Å; L881-E885 PolarHBondContact O-N 2.88Å; L881-I935 HydrophobicContact CD1-CD1 4.48Å; L881-I935 HydrophobicContact CD2-CD1 4.31Å
882	R	59.9	Low	50	Low	89 Å²	89	71.8 Å²	71.8	34%	0.336	36%	0.359	S	S	.	.	H	α-helix	trans	-67.6	-31.1	175.8	-71.3	168	179.8	171.3	-1.9	112.6	A861 H863 L878 T880 R886	A861-R882 HydrophobicContact CB-CG 4.38Å; A861-R882 WeakPolarHBondContact O-CG 3.31Å; A861-R882 PolarHBondContact O-NE 3.42Å; H863-R882 PolarHBondContact O-NH2 3.23Å; L878-R882 VanDerWaalsContact O-CB 3.31Å; L878-R882 WeakPolarHBondContact O-CB 3.14Å; L878-R882 WeakPolarHBondContact O-CD 3.22Å; L878-R882 WeakPolarHBondContact O-CG 3.35Å; L878-R882 PolarHBondContact O-N 2.79Å; T880-R882 PolarHBondContact O-N 3.25Å; R882-R886 WeakPolarHBondContact O-CB 3.47Å; R882-R886 VanDerWaalsContact O-CG 3.31Å; R882-R886 WeakPolarHBondContact O-CG 3.11Å; R882-R886 PolarHBondContact O-N 3.37Å
883	S	58.4	Low	49.4	Very low	62 Å²	62	72.2 Å²	72.2	43%	0.434	36%	0.36	S	S	.	.	H	α-helix	trans	-71.4	-41.1	174.5	-58.5	0	0	0	0	111.2	C879 T880 L881 R886 W887	C879-S883 VanDerWaalsContact O-CB 3.31Å; C879-S883 WeakPolarHBondContact O-CB 3.29Å; C879-S883 PolarHBondContact O-N 2.78Å; C879-S883 PolarHBondContact O-OG 3.34Å; T880-S883 PolarHBondContact O-N 2.67Å; L881-S883 VanDerWaalsContact C-N 3.32Å; L881-S883 PolarHBondContact O-N 3.21Å; S883-R886 PolarHBondContact O-N 2.83Å; S883-W887 PolarHBondContact O-N 3.26Å
884	L	56.8	Low	48.8	Very low	71 Å²	71	71.7 Å²	71.7	37%	0.372	37%	0.365	S	S	.	.	H	α-helix	trans	-62.5	-44.1	171.9	-75.4	161.9	0	0	0	112	T880 L881 R886 W887 A888	T880-L884 HydrophobicContact CG2-CD1 4.09Å; T880-L884 WeakPolarHBondContact O-CG 3.47Å; T880-L884 PolarHBondContact O-N 3.37Å; L881-L884 PolarHBondContact O-N 3.32Å; L884-R886 PolarHBondContact O-N 3.36Å; L884-W887 PolarHBondContact O-N 2.87Å; L884-A888 PolarHBondContact O-N 2.98Å
885	E	54.2	Low	48	Very low	36 Å²	36	78.1 Å²	78.1	17%	0.168	40%	0.4	C	S	.	.	H	α-helix	trans	-64.2	-38.7	176.7	-172.6	168.1	-153.7	0	0	111.8	R862 L881 A888 N889	R862-E885 IonicContact CZ-OE1 3.87Å; R862-E885 IonicContact NE-OE1 3.37Å; R862-E885 PolarHBondContact NE-OE1 3.1Å; R862-E885 IonicContact NH2-OE1 2.82Å; R862-E885 PolarHBondContact NH2-OE1 3.49Å; L881-E885 WeakPolarHBondContact O-CB 3.1Å; L881-E885 PolarHBondContact O-N 2.88Å; E885-A888 PolarHBondContact O-N 2.81Å; E885-N889 PolarHBondContact O-N 3.41Å; E885-N889 PolarHBondContact O-ND2 3.33Å; E885-N889 PolarHBondContact O-OD1 3.37Å
886	R	52.3	Low	47	Very low	188 Å²	188	82.6 Å²	82.6	71%	0.709	43%	0.426	S	S	*	.	H	α-helix	trans	-63.2	-41.6	170.9	-76.5	175.3	175.6	-165.9	-2.5	112.5	R882 S883 L884 N889 T890	R882-R886 WeakPolarHBondContact O-CB 3.47Å; R882-R886 VanDerWaalsContact O-CG 3.31Å; R882-R886 WeakPolarHBondContact O-CG 3.11Å; R882-R886 PolarHBondContact O-N 3.37Å; S883-R886 PolarHBondContact O-N 2.83Å; L884-R886 PolarHBondContact O-N 3.36Å; R886-N889 PolarHBondContact O-N 3.09Å; R886-T890 WeakPolarHBondContact O-CB 3.42Å; R886-T890 PolarHBondContact O-N 3.12Å; R886-T890 PolarHBondContact O-OG1 3.48Å
887	W	48.8	Very low	45.8	Very low	191 Å²	191	86.1 Å²	86.1	72%	0.723	45%	0.451	S	S	*	.	H	α-helix	trans	-64	-43.4	176.4	-96.6	75.2	0	0	0	112.3	S883 L884 T890 L891	S883-W887 PolarHBondContact O-N 3.26Å; L884-W887 PolarHBondContact O-N 2.87Å; W887-T890 PolarHBondContact O-N 2.64Å; W887-L891 PolarHBondContact O-N 3.36Å
888	A	40.8	Very low	44.4	Very low	30 Å²	30	91.5 Å²	91.5	25%	0.248	49%	0.489	C	S	.	.	H	α-helix	trans	-58.7	-50	174.9	0	0	0	0	0	111.7	L884 E885 T890 L891 E892	L884-A888 PolarHBondContact O-N 2.98Å; E885-A888 PolarHBondContact O-N 2.81Å; A888-T890 PolarHBondContact O-N 2.95Å; A888-L891 PolarHBondContact O-N 2.88Å; A888-L891 VanDerWaalsContact O-N 3.13Å; A888-E892 PolarHBondContact O-N 3.44Å
889	N	38.6	Very low	43.1	Very low	91 Å²	91	98.1 Å²	98.1	49%	0.487	52%	0.523	S	S	.	.	H	α-helix	trans	-61.2	-33.3	177.5	-63.6	-8.4	0	0	0	112.5	E885 R886 L893	E885-N889 PolarHBondContact O-N 3.41Å; E885-N889 PolarHBondContact O-ND2 3.33Å; E885-N889 PolarHBondContact O-OD1 3.37Å; R886-N889 PolarHBondContact O-N 3.09Å; N889-L893 WeakPolarHBondContact O-CB 3.29Å; N889-L893 PolarHBondContact O-N 2.89Å
890	T	43.1	Very low	41.6	Very low	99 Å²	99	101.2 Å²	101.2	61%	0.607	54%	0.536	S	S	*	.	H	α-helix	trans	-71.8	-35.8	177.5	-52.7	0	0	0	0	111.6	R886 W887 A888 S894	R886-T890 WeakPolarHBondContact O-CB 3.42Å; R886-T890 PolarHBondContact O-N 3.12Å; R886-T890 PolarHBondContact O-OG1 3.48Å; W887-T890 PolarHBondContact O-N 2.64Å; A888-T890 PolarHBondContact O-N 2.95Å; T890-S894 PolarHBondContact O-N 2.73Å
891	L	38.1	Very low	40.2	Very low	93 Å²	93	105.8 Å²	105.8	49%	0.487	57%	0.567	S	S	.	*	H	α-helix	trans	-69.9	-41.1	175	-80.2	162.3	0	0	0	112.4	W887 A888 S894	W887-L891 PolarHBondContact O-N 3.36Å; A888-L891 PolarHBondContact O-N 2.88Å; A888-L891 VanDerWaalsContact O-N 3.13Å; L891-S894 PolarHBondContact O-N 2.89Å; L891-S894 PolarHBondContact O-OG 3.32Å
892	E	35.2	Very low	38.6	Very low	145 Å²	145	110.2 Å²	110.2	68%	0.678	60%	0.595	S	S	*	*	H	α-helix	trans	-64.2	-42.6	175.4	-70.3	-168.4	163.3	0	0	112	A888 S894 N895	A888-E892 PolarHBondContact O-N 3.44Å; E892-S894 PolarHBondContact O-N 3.5Å; E892-N895 PolarHBondContact O-N 2.95Å
893	L	35.3	Very low	37	Very low	132 Å²	132	112.7 Å²	112.7	69%	0.691	62%	0.615	S	S	*	*	H	α-helix	trans	-63.2	-28.8	178	-156.1	73	0	0	0	112.7	N889 N895 V896	N889-L893 WeakPolarHBondContact O-CB 3.29Å; N889-L893 PolarHBondContact O-N 2.89Å; L893-N895 PolarHBondContact O-N 3.41Å; L893-N895 VanDerWaalsContact O-N 3.12Å; L893-V896 PolarHBondContact O-N 3.34Å
894	S	34.3	Very low	35.4	Very low	87 Å²	87	121.5 Å²	121.5	61%	0.608	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-13.6	179.7	76.8	0	0	0	0	115.1	T890 L891 E892	T890-S894 PolarHBondContact O-N 2.73Å; L891-S894 PolarHBondContact O-N 2.89Å; L891-S894 PolarHBondContact O-OG 3.32Å; E892-S894 PolarHBondContact O-N 3.5Å
895	N	31.8	Very low	33.9	Very low	141 Å²	141	126.8 Å²	126.8	75%	0.754	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-1.2	178.4	-73	-59.5	0	0	0	114.2	E892 L893	E892-N895 PolarHBondContact O-N 2.95Å; L893-N895 PolarHBondContact O-N 3.41Å; L893-N895 VanDerWaalsContact O-N 3.12Å
896	V	30	Very low	32.6	Very low	101 Å²	101	130.7 Å²	130.7	61%	0.612	69%	0.694	S	S	*	*	S	Bend	trans	-134.3	116.8	-172.7	-162.8	0	0	0	0	111.9	L893	L893-V896 PolarHBondContact O-N 3.34Å
897	V	26.7	Very low	31.3	Very low	136 Å²	136	126.5 Å²	126.5	82%	0.824	70%	0.7	S	S	*	*			trans	74.9	118.5	-178.6	-166.7	0	0	0	0	116.2
898	S	25.9	Very low	30.3	Very low	112 Å²	112	124.7 Å²	124.7	78%	0.783	70%	0.703	S	S	*	*			trans	-100.5	113.9	155.2	174.8	0	0	0	0	108.5
899	L	26.9	Very low	29.6	Very low	143 Å²	143	132.7 Å²	132.7	75%	0.749	73%	0.733	S	S	*	*			trans	-168.1	127.9	142.7	-131.5	68.9	0	0	0	112.2
900	D	24.5	Very low	29	Very low	132 Å²	132	134 Å²	134	71%	0.706	75%	0.747	S	S	*	*			trans	28.2	123.3	150.2	-56.9	-20.3	0	0	0	122.8
901	C	25.2	Very low	28.1	Very low	122 Å²	122	136.1 Å²	136.1	82%	0.824	75%	0.754	S	S	*	*			trans	72.5	152.6	143.2	-68.7	0	0	0	0	119.6
902	V	24.6	Very low	27.6	Very low	114 Å²	114	138 Å²	138	69%	0.691	77%	0.769	S	S	*	*			cis	-159.7	151.7	-22.4	121.4	0	0	0	0	107.4
903	N	24.7	Very low	27.1	Very low	141 Å²	141	137.4 Å²	137.4	75%	0.754	78%	0.776	S	S	*	*			trans	41.1	107.2	166.8	-65.3	-8.5	0	0	0	118.9
904	Y	26.7	Very low	26.7	Very low	246 Å²	246	135.6 Å²	135.6	97%	0.965	78%	0.775	S	S	*	*			trans	-132.3	136.9	130.7	-106.6	-78.3	0	0	0	111.4
905	Q	24.2	Very low	26.2	Very low	182 Å²	182	137.3 Å²	137.3	85%	0.85	79%	0.786	S	S	*	*			trans	-97.1	125	-166.7	-166.4	170.2	1.1	0	0	109.7
906	S	27.4	Very low	26.1	Very low	119 Å²	119	137.1 Å²	137.1	83%	0.832	78%	0.784	S	S	*	*			trans	-148.8	83.4	175.3	-78.5	0	0	0	0	110.1	L908	S906-L908 PolarHBondContact O-N 3Å; S906-L908 VanDerWaalsContact O-N 3.16Å
907	A	24.5	Very low	25.7	Very low	99 Å²	99	137.5 Å²	137.5	82%	0.818	79%	0.791	S	S	*	*			trans	-74.8	98.8	177.5	0	0	0	0	0	110.3
908	L	26.9	Very low	25.6	Very low	153 Å²	153	135.8 Å²	135.8	80%	0.801	78%	0.784	S	S	*	*			trans	-153.9	29.9	170.2	-125.5	162.7	0	0	0	114.9	S906	S906-L908 PolarHBondContact O-N 3Å; S906-L908 VanDerWaalsContact O-N 3.16Å
909	F	27.8	Very low	25.6	Very low	199 Å²	199	135.5 Å²	135.5	87%	0.873	78%	0.782	S	S	*	*			trans	-155.2	121.8	154.9	-77.5	-63.6	0	0	0	108.5
910	P	26.3	Very low	25.5	Very low	119 Å²	119	139.6 Å²	139.6	77%	0.773	79%	0.788	S	S	*	*			trans	-77.8	149.1	169.8	32.3	-33.2	0	0	0	110.9	T912	P910-T912 PolarHBondContact O-N 3.29Å
911	D	23.1	Very low	25.8	Very low	143 Å²	143	137 Å²	137	77%	0.765	78%	0.776	S	S	*	*			trans	-61.7	132.2	-170.1	-60.3	-87.1	0	0	0	114.4
912	T	28.2	Very low	25.9	Very low	131 Å²	131	137.3 Å²	137.3	80%	0.804	77%	0.77	S	S	*	*			trans	-123.8	75.2	153.4	21.9	0	0	0	0	109.5	P910 S914	P910-T912 PolarHBondContact O-N 3.29Å; T912-S914 PolarHBondContact O-N 3.12Å
913	T	25	Very low	26.2	Very low	133 Å²	133	135.9 Å²	135.9	82%	0.816	77%	0.765	S	S	*	*			trans	-70.9	72	170.2	42.9	0	0	0	0	111.3
914	S	26.1	Very low	26.6	Very low	95 Å²	95	131.9 Å²	131.9	66%	0.664	75%	0.746	S	S	*	*			trans	-98.5	127.2	157	57.7	0	0	0	0	109.4	T912 I916	T912-S914 PolarHBondContact O-N 3.12Å; S914-I916 PolarHBondContact O-N 2.89Å
915	S	24.6	Very low	26.9	Very low	122 Å²	122	125.7 Å²	125.7	85%	0.853	73%	0.726	S	S	*	*			trans	-75.6	85.8	-171.4	55.7	0	0	0	0	111.8	S917	S915-S917 PolarHBondContact O-N 2.96Å; S915-S917 VanDerWaalsContact O-N 3.11Å
916	I	28.3	Very low	27.4	Very low	137 Å²	137	121.4 Å²	121.4	70%	0.703	71%	0.712	S	S	*	*			trans	-69.2	106.5	164.4	-52.6	-179.2	0	0	0	107.5	S914 C918	S914-I916 PolarHBondContact O-N 2.89Å; I916-C918 VanDerWaalsContact CG2-SG 3.51Å; I916-C918 PolarHBondContact O-N 3.13Å
917	S	22.8	Very low	27.6	Very low	110 Å²	110	121.6 Å²	121.6	77%	0.769	70%	0.7	S	S	*	*			trans	-74	71.8	172.1	57.1	0	0	0	0	110.2	S915 S919	S915-S917 PolarHBondContact O-N 2.96Å; S915-S917 VanDerWaalsContact O-N 3.11Å; S917-S919 PolarHBondContact O-N 3.1Å
918	C	24.6	Very low	28.2	Very low	100 Å²	100	122.7 Å²	122.7	68%	0.676	69%	0.688	S	S	*	*			trans	-59.9	105.8	177.7	-72.9	0	0	0	0	110.4	I916 R920	I916-C918 VanDerWaalsContact CG2-SG 3.51Å; I916-C918 PolarHBondContact O-N 3.13Å; C918-R920 PolarHBondContact O-N 3.18Å
919	S	25	Very low	28.9	Very low	106 Å²	106	119.7 Å²	119.7	74%	0.741	67%	0.669	S	S	*	*			trans	-78.5	63.5	-177.9	57.5	0	0	0	0	112.5	S917 T921	S917-S919 PolarHBondContact O-N 3.1Å; S919-T921 PolarHBondContact O-N 3.03Å
920	R	25.8	Very low	29.7	Very low	229 Å²	229	112.2 Å²	112.2	86%	0.864	64%	0.641	S	S	*	*	S	Bend	trans	51.5	56.6	153.8	-166.8	177.4	158.5	-172	-6.8	115.3	C918 N922	C918-R920 PolarHBondContact O-N 3.18Å; R920-N922 WeakPolarHBondContact CA-OD1 3.3Å
921	T	29.9	Very low	30.6	Very low	76 Å²	76	112.3 Å²	112.3	47%	0.466	64%	0.635	S	S	.	*			trans	-107.3	32.8	166.9	42.8	0	0	0	0	111.8	S919 S923 T924	S919-T921 PolarHBondContact O-N 3.03Å; T921-S923 VanDerWaalsContact C-N 3.28Å; T921-S923 PolarHBondContact O-N 3.3Å; T921-T924 PolarHBondContact O-N 2.94Å; T921-T924 PolarHBondContact O-OG1 3.32Å
922	N	28.3	Very low	32	Very low	130 Å²	130	107 Å²	107	70%	0.695	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	65	-167.2	-58.7	35.7	0	0	0	113.6	R920	R920-N922 WeakPolarHBondContact CA-OD1 3.3Å
923	S	29.9	Very low	33.7	Very low	84 Å²	84	105 Å²	105	59%	0.587	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-164.4	-28.7	159.9	60.6	0	0	0	0	112.5	T921 T926	T921-S923 VanDerWaalsContact C-N 3.28Å; T921-S923 PolarHBondContact O-N 3.3Å; S923-T926 PolarHBondContact O-OG1 2.72Å
924	T	32.9	Very low	35.5	Very low	56 Å²	56	99 Å²	99	34%	0.344	56%	0.562	S	S	.	*	H	α-helix	trans	-82.3	-18.9	-169	48.4	0	0	0	0	115	T921 E927 Q928	T921-T924 PolarHBondContact O-N 2.94Å; T921-T924 PolarHBondContact O-OG1 3.32Å; T924-E927 PolarHBondContact O-N 2.88Å; T924-Q928 WeakPolarHBondContact O-CB 3.25Å; T924-Q928 VanDerWaalsContact O-CG 3.23Å; T924-Q928 WeakPolarHBondContact O-CG 3.38Å; T924-Q928 PolarHBondContact O-N 3.28Å
925	E	34.1	Very low	37.2	Very low	117 Å²	117	94.7 Å²	94.7	55%	0.547	53%	0.532	S	S	.	.	H	α-helix	trans	-69.6	-40.7	-172.8	-67.3	178.3	-179.6	0	0	112.3	Q928 F929	E925-Q928 PolarHBondContact O-N 3.1Å; E925-F929 WeakPolarHBondContact O-CD2 3.23Å; E925-F929 PolarHBondContact O-N 3.03Å; E925-F929 VanDerWaalsContact O-N 3.14Å
926	T	34.7	Very low	39.1	Very low	92 Å²	92	91.1 Å²	91.1	56%	0.564	51%	0.505	S	S	*	.	H	α-helix	trans	-64.7	-42.3	174	36.7	0	0	0	0	112.2	S923 F929 S930	S923-T926 PolarHBondContact O-OG1 2.72Å; T926-F929 PolarHBondContact O-N 3.12Å; T926-S930 PolarHBondContact O-N 3.26Å
927	E	30.7	Very low	40.7	Very low	123 Å²	123	84.8 Å²	84.8	58%	0.575	47%	0.472	S	S	*	.	H	α-helix	trans	-68.6	-31.8	174.6	-68.4	-167.1	145.4	0	0	113	T924 F929 S930 N931	T924-E927 PolarHBondContact O-N 2.88Å; E927-F929 VanDerWaalsContact C-N 3.3Å; E927-F929 PolarHBondContact O-N 3.5Å; E927-S930 WeakPolarHBondContact CA-OG 3.38Å; E927-S930 PolarHBondContact O-N 3.48Å; E927-S930 PolarHBondContact O-OG 3.17Å; E927-N931 WeakPolarHBondContact O-CB 3.48Å; E927-N931 VanDerWaalsContact O-CG 3.27Å; E927-N931 PolarHBondContact O-N 3.05Å; E927-N931 PolarHBondContact O-ND2 2.84Å
928	Q	37.8	Very low	42.4	Very low	122 Å²	122	83.4 Å²	83.4	57%	0.57	46%	0.461	S	S	*	.	H	α-helix	trans	-65.6	-33.8	172.7	-79	176	15.6	0	0	111.7	T924 E925 N931 S932	T924-Q928 WeakPolarHBondContact O-CB 3.25Å; T924-Q928 VanDerWaalsContact O-CG 3.23Å; T924-Q928 WeakPolarHBondContact O-CG 3.38Å; T924-Q928 PolarHBondContact O-N 3.28Å; E925-Q928 PolarHBondContact O-N 3.1Å; Q928-N931 PolarHBondContact O-N 3.4Å; Q928-S932 WeakPolarHBondContact O-CB 3.04Å; Q928-S932 PolarHBondContact O-N 3.4Å
929	F	40.4	Very low	44.3	Very low	90 Å²	90	79.4 Å²	79.4	40%	0.395	43%	0.434	S	S	.	.	H	α-helix	trans	-72.2	-30	173.5	-78.7	-66.3	0	0	0	113.7	K815 E925 T926 E927	K815-F929 WeakPolarHBondContact CE-O 3.47Å; K815-F929 PolarHBondContact NZ-O 3.03Å; E925-F929 WeakPolarHBondContact O-CD2 3.23Å; E925-F929 PolarHBondContact O-N 3.03Å; E925-F929 VanDerWaalsContact O-N 3.14Å; T926-F929 PolarHBondContact O-N 3.12Å; E927-F929 VanDerWaalsContact C-N 3.3Å; E927-F929 PolarHBondContact O-N 3.5Å
930	S	44.9	Very low	45.9	Very low	42 Å²	42	78.3 Å²	78.3	29%	0.294	43%	0.431	S	S	.	.	H	α-helix	trans	-73.2	-37.8	169.9	53.1	0	0	0	0	112.4	K815 T926 E927	K815-S930 VanDerWaalsContact NZ-C 3.34Å; K815-S930 PolarHBondContact NZ-O 3.42Å; T926-S930 PolarHBondContact O-N 3.26Å; E927-S930 WeakPolarHBondContact CA-OG 3.38Å; E927-S930 PolarHBondContact O-N 3.48Å; E927-S930 PolarHBondContact O-OG 3.17Å
931	N	45.1	Very low	47.8	Very low	120 Å²	120	69.7 Å²	69.7	64%	0.642	40%	0.401	S	S	*	.	H	α-helix	trans	-89.1	-18.9	-174.2	-62.2	-10.9	0	0	0	113.9	E927 Q928	E927-N931 WeakPolarHBondContact O-CB 3.48Å; E927-N931 VanDerWaalsContact O-CG 3.27Å; E927-N931 PolarHBondContact O-N 3.05Å; E927-N931 PolarHBondContact O-ND2 2.84Å; Q928-N931 PolarHBondContact O-N 3.4Å
932	S	53.9	Low	49.8	Very low	31 Å²	31	69.3 Å²	69.3	22%	0.217	40%	0.396	C	S	.	.	S	Bend	trans	-68.5	135.4	173	174.8	0	0	0	0	111.5	K815 Q928 A934	K815-S932 WeakPolarHBondContact CD-O 3.26Å; K815-S932 WeakPolarHBondContact CE-O 3.35Å; K815-S932 PolarHBondContact NZ-O 3.18Å; Q928-S932 WeakPolarHBondContact O-CB 3.04Å; Q928-S932 PolarHBondContact O-N 3.4Å; S932-A934 WeakPolarHBondContact CB-O 3.46Å; S932-A934 PolarHBondContact O-N 2.94Å; S932-A934 PolarHBondContact OG-N 2.92Å; S932-A934 PolarHBondContact OG-O 3.35Å
933	P	62.9	Low	52.4	Low	90 Å²	90	63.1 Å²	63.1	58%	0.584	36%	0.363	S	S	*	.	S	Bend	trans	-73.5	-1.2	173.1	31.5	-36	0	0	0	113.7	S814 K815	S814-P933 WeakPolarHBondContact CA-O 3.14Å; K815-P933 PolarHBondContact N-O 3.2Å
934	A	62.2	Low	55.1	Low	7 Å²	7	59.1 Å²	59.1	6%	0.058	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	147.9	-179.9	0	0	0	0	0	112.9	R812 I813 S932	R812-A934 HydrophobicContact CG-CB 4.01Å; I813-A934 CarbonylContact O-C 3.5Å; I813-A934 VanDerWaalsContact O-CA 3.27Å; I813-A934 WeakPolarHBondContact O-CA 3.36Å; I813-A934 WeakPolarHBondContact O-CB 3.11Å; S932-A934 WeakPolarHBondContact CB-O 3.46Å; S932-A934 PolarHBondContact O-N 2.94Å; S932-A934 PolarHBondContact OG-N 2.92Å; S932-A934 PolarHBondContact OG-O 3.35Å
935	I	62.5	Low	57.8	Low	4 Å²	4	56.5 Å²	56.5	2%	0.021	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	143.6	168.9	-38.5	177.3	0	0	0	108.2	R812 I813 I818 L857 V877 L881 I937	R812-I935 CarbonylContact C-O 3.58Å; R812-I935 WeakPolarHBondContact CA-O 3.41Å; I813-I935 PolarHBondContact N-O 3.08Å; I813-I935 PolarHBondContact O-N 2.68Å; I818-I935 HydrophobicContact CD1-CD1 3.32Å; I818-I935 HydrophobicContact CD1-CG1 3.93Å; L857-I935 HydrophobicContact CD1-CD1 3.45Å; L857-I935 VanDerWaalsContact CD1-CD1 3.45Å; L857-I935 HydrophobicContact CD1-CG1 3.74Å; L857-I935 HydrophobicContact CD2-CD1 4.14Å; L857-I935 HydrophobicContact CG-CD1 4.41Å; V877-I935 HydrophobicContact CG1-CD1 4.25Å; L881-I935 HydrophobicContact CD1-CD1 4.48Å; L881-I935 HydrophobicContact CD2-CD1 4.31Å; I935-I937 HydrophobicContact CB-CD1 4.42Å; I935-I937 HydrophobicContact CG2-CD1 4.38Å; I935-I937 HydrophobicContact CG2-CG1 4.05Å
936	T	64.8	Low	60.3	Low	48 Å²	48	51 Å²	51	29%	0.294	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	131.3	165	-56	0	0	0	0	108.6	E810	E810-T936 HydrophobicContact CB-CG2 3.68Å; E810-T936 HydrophobicContact CG-CG2 4.27Å; E810-T936 WeakPolarHBondContact OE2-CG2 3.33Å
937	I	60.9	Low	63	Low	3 Å²	3	46.6 Å²	46.6	2%	0.015	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	129.3	-173.1	-70.8	153.4	0	0	0	108.9	E810 I811 I813 Q876 V877 T880 I935 S939	E810-I937 CarbonylContact C-O 3.52Å; E810-I937 WeakPolarHBondContact CA-O 3.3Å; I811-I937 PolarHBondContact N-O 3.37Å; I811-I937 PolarHBondContact O-N 3.22Å; I813-I937 HydrophobicContact CD1-CD1 3.84Å; I813-I937 HydrophobicContact CG1-CD1 4.28Å; Q876-I937 HydrophobicContact CB-CG2 4.4Å; V877-I937 HydrophobicContact CB-CD1 4.13Å; V877-I937 HydrophobicContact CG1-CD1 4.5Å; V877-I937 HydrophobicContact CG2-CD1 3.44Å; V877-I937 VanDerWaalsContact CG2-CD1 3.44Å; T880-I937 HydrophobicContact CG2-CG1 4.23Å; I935-I937 HydrophobicContact CB-CD1 4.42Å; I935-I937 HydrophobicContact CG2-CD1 4.38Å; I935-I937 HydrophobicContact CG2-CG1 4.05Å; I937-S939 PolarHBondContact O-N 3.42Å
938	P	59.3	Low	65.7	Low	81 Å²	81	40.7 Å²	40.7	53%	0.526	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	130.1	174.2	27.8	-33.9	0	0	0	110.1
939	S	63.7	Low	68.2	Low	17 Å²	17	35 Å²	35	12%	0.119	21%	0.211	C	C	.	.			trans	-77.7	145.7	175.6	-172.3	0	0	0	0	110.8	P809 I937 Q941	P809-S939 VanDerWaalsContact O-CB 3.24Å; P809-S939 WeakPolarHBondContact O-CB 2.97Å; P809-S939 PolarHBondContact O-N 3.5Å; I937-S939 PolarHBondContact O-N 3.42Å; S939-Q941 VanDerWaalsContact C-N 3.26Å; S939-Q941 PolarHBondContact OG-N 3.02Å
940	A	59.9	Low	70.4	Confident	82 Å²	82	32 Å²	32	68%	0.678	20%	0.199	S	C	*	.	S	Bend	trans	-77.5	-11.8	170	0	0	0	0	0	113.1
941	Q	64.7	Low	72.2	Confident	49 Å²	49	33.6 Å²	33.6	23%	0.229	20%	0.2	C	C	.	.			trans	-77.6	144.5	171.9	-61.1	171.9	-3.5	0	0	109.6	C657 W773 P809 S939	C657-Q941 PolarHBondContact SG-NE2 2.74Å; W773-Q941 HydrophobicContact CZ2-CB 3.86Å; P809-Q941 WeakPolarHBondContact CD-O 3.26Å; P809-Q941 WeakPolarHBondContact CG-O 3.22Å; S939-Q941 VanDerWaalsContact C-N 3.26Å; S939-Q941 PolarHBondContact OG-N 3.02Å
942	L	72.2	Confident	74	Confident	68 Å²	68	31.6 Å²	31.6	36%	0.356	20%	0.196	S	C	.	.			trans	-128.6	148.2	173	-69.8	173.9	0	0	0	110.1	A658 F687 P689	A658-L942 VanDerWaalsContact CB-O 3.31Å; A658-L942 WeakPolarHBondContact CB-O 3.42Å; F687-L942 WeakPolarHBondContact CZ-O 3.21Å; P689-L942 HydrophobicContact CB-CB 4.13Å
943	P	82.3	Confident	75.4	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.2	C	C	.	.			trans	-56.5	151	163.8	-20	33	0	0	0	110.3	G690 A739 W773 Q804 K807	G690-P943 WeakPolarHBondContact CA-O 3.45Å; G690-P943 PolarHBondContact N-O 3.36Å; A739-P943 VanDerWaalsContact O-CA 3.26Å; A739-P943 WeakPolarHBondContact O-CA 3.45Å; A739-P943 WeakPolarHBondContact O-CB 3.34Å; W773-P943 HydrophobicContact CH2-CB 4.48Å; W773-P943 HydrophobicContact CH2-CG 4.01Å; W773-P943 HydrophobicContact CZ3-CB 4.05Å; W773-P943 HydrophobicContact CZ3-CG 3.93Å; Q804-P943 WeakPolarHBondContact O-CB 3.16Å; Q804-P943 WeakPolarHBondContact O-CG 3.24Å; K807-P943 HydrophobicContact CB-CG 4.24Å; K807-P943 VanDerWaalsContact O-CD 3.27Å; K807-P943 WeakPolarHBondContact O-CD 3.48Å
944	G	86.2	Confident	76.2	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169	178.6	-172.1	0	0	0	0	0	113.8	L688 A739 L805	L688-G944 CarbonylContact O-C 3.56Å; L688-G944 WeakPolarHBondContact O-CA 3.26Å; A739-G944 PolarHBondContact N-O 2.95Å; A739-G944 PolarHBondContact O-N 3.27Å; L805-G944 VanDerWaalsContact CD2-CA 3.41Å
945	I	89.9	Confident	77.2	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	123.7	176.6	-52.8	174.6	0	0	0	109	L688 W694 L722 W725 F726 P736 L805	L688-I945 WeakPolarHBondContact CB-O 3.34Å; L688-I945 PolarHBondContact N-O 2.83Å; L688-I945 PolarHBondContact O-N 3.31Å; W694-I945 HydrophobicContact CB-CD1 4.14Å; W694-I945 HydrophobicContact CG-CD1 4.37Å; L722-I945 HydrophobicContact CD1-CD1 4.11Å; W725-I945 HydrophobicContact CE3-CD1 4.4Å; W725-I945 HydrophobicContact CH2-CB 4.4Å; W725-I945 HydrophobicContact CH2-CD1 4.09Å; W725-I945 HydrophobicContact CH2-CG2 3.87Å; W725-I945 HydrophobicContact CZ3-CD1 3.73Å; W725-I945 HydrophobicContact CZ3-CG2 3.99Å; F726-I945 HydrophobicContact CE1-CD1 3.83Å; F726-I945 HydrophobicContact CE1-CG2 4.43Å; F726-I945 HydrophobicContact CZ-CD1 3.81Å; P736-I945 HydrophobicContact CB-CG2 3.9Å; L805-I945 HydrophobicContact CD1-CD1 4.14Å; L805-I945 HydrophobicContact CD1-CG1 4.25Å; L805-I945 HydrophobicContact CD2-CG1 4.15Å
946	S	88	Confident	78.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	124.4	164.4	-60.3	0	0	0	0	109.1	V662 R686 F687 P736 V737	V662-S946 WeakPolarHBondContact CG2-OG 3.47Å; R686-S946 CarbonylContact O-C 3.54Å; R686-S946 WeakPolarHBondContact O-CA 3.32Å; F687-S946 WeakPolarHBondContact CD2-OG 3.27Å; P736-S946 CarbonylContact C-O 2.95Å; P736-S946 WeakPolarHBondContact CA-O 3.5Å; V737-S946 PolarHBondContact N-O 3.46Å; V737-S946 PolarHBondContact O-N 3.26Å
947	L	89.7	Confident	79.2	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	139.7	166.4	-76.4	171.7	0	0	0	109.8	G685 R686 L688 W725 W729 I735 P736 L960	G685-L947 CarbonylContact C-O 3.54Å; G685-L947 WeakPolarHBondContact CA-O 3.36Å; R686-L947 PolarHBondContact N-O 3.28Å; R686-L947 PolarHBondContact O-N 2.89Å; L688-L947 HydrophobicContact CD1-CD1 3.88Å; L688-L947 HydrophobicContact CD1-CG 4.26Å; W725-L947 HydrophobicContact CH2-CD1 3.97Å; W725-L947 HydrophobicContact CH2-CD2 3.82Å; W725-L947 HydrophobicContact CH2-CG 3.92Å; W725-L947 HydrophobicContact CZ2-CD1 3.88Å; W725-L947 HydrophobicContact CZ2-CD2 4.45Å; W725-L947 HydrophobicContact CZ2-CG 4.35Å; W725-L947 HydrophobicContact CZ3-CD2 4.43Å; W729-L947 HydrophobicContact CB-CD2 4.21Å; W729-L947 HydrophobicContact CD2-CD1 3.92Å; W729-L947 HydrophobicContact CD2-CD2 3.97Å; W729-L947 VanDerWaalsContact CE2-CD1 3.49Å; W729-L947 HydrophobicContact CE3-CD1 4.39Å; W729-L947 HydrophobicContact CE3-CD2 4.48Å; W729-L947 HydrophobicContact CG-CD1 4.43Å; W729-L947 HydrophobicContact CG-CD2 3.85Å; W729-L947 HydrophobicContact CH2-CD1 4.13Å; W729-L947 HydrophobicContact CZ2-CD1 3.63Å; W729-L947 HydrophobicContact CZ3-CD1 4.48Å; I735-L947 CarbonylContact O-C 3.56Å; I735-L947 WeakPolarHBondContact O-CA 3.48Å; P736-L947 HydrophobicContact CB-CD2 4.22Å; P736-L947 HydrophobicContact CG-CD2 4.33Å; L947-L960 HydrophobicContact CB-CD1 3.91Å; L947-L960 HydrophobicContact CD1-CD1 3.69Å; L947-L960 HydrophobicContact CG-CD1 4.48Å
948	F	88.9	Confident	80.1	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	138.5	173.4	-64.3	-68.7	0	0	0	111.5	I477 L661 V662 L665 L683 T684 A734 I735 V737	I477-F948 HydrophobicContact CD1-CD2 3.83Å; I477-F948 HydrophobicContact CD1-CE2 3.91Å; I477-F948 HydrophobicContact CG1-CD2 4.33Å; I477-F948 HydrophobicContact CG2-CB 4.14Å; I477-F948 HydrophobicContact CG2-CG 4.39Å; L661-F948 HydrophobicContact CD2-CE2 3.95Å; L661-F948 HydrophobicContact CD2-CZ 4.21Å; L661-F948 HydrophobicContact CG-CE2 4.08Å; L661-F948 HydrophobicContact CG-CZ 3.83Å; V662-F948 HydrophobicContact CB-CE1 4.44Å; V662-F948 HydrophobicContact CB-CZ 4.49Å; V662-F948 HydrophobicContact CG2-CE1 3.98Å; V662-F948 HydrophobicContact CG2-CZ 3.75Å; L665-F948 HydrophobicContact CB-CE1 4.49Å; L665-F948 HydrophobicContact CD1-CE1 4.01Å; L665-F948 HydrophobicContact CD1-CZ 4.03Å; L683-F948 HydrophobicContact CD1-CD1 3.59Å; L683-F948 HydrophobicContact CD1-CE1 4.19Å; L683-F948 HydrophobicContact CD1-CG 4.47Å; T684-F948 WeakPolarHBondContact O-CA 3.48Å; A734-F948 WeakPolarHBondContact CA-O 3.18Å; I735-F948 HydrophobicContact CB-CB 4.47Å; I735-F948 PolarHBondContact N-O 3Å; I735-F948 PolarHBondContact O-N 3.07Å; V737-F948 HydrophobicContact CB-CE2 4.24Å; V737-F948 HydrophobicContact CG2-CD2 3.83Å; V737-F948 HydrophobicContact CG2-CE2 3.96Å
949	I	89.5	Confident	81.1	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	141.1	-170.9	-45	-170.7	0	0	0	109	L683 T684 W729 A734 K951 N953 L956 V957 L960	L683-I949 CarbonylContact C-O 3.55Å; L683-I949 VanDerWaalsContact CA-O 3.27Å; L683-I949 WeakPolarHBondContact CA-O 3.35Å; T684-I949 PolarHBondContact N-O 3.04Å; T684-I949 PolarHBondContact O-N 3.4Å; W729-I949 HydrophobicContact CE3-CD1 4.41Å; W729-I949 HydrophobicContact CH2-CD1 4.48Å; W729-I949 HydrophobicContact CZ3-CD1 3.73Å; A734-I949 HydrophobicContact CB-CD1 4.17Å; A734-I949 HydrophobicContact CB-CG1 3.88Å; I949-K951 PolarHBondContact O-N 3.03Å; I949-N953 HydrophobicContact CG2-CB 4.29Å; I949-L956 HydrophobicContact CD1-CB 3.94Å; I949-L956 HydrophobicContact CG2-CB 3.79Å; I949-L956 HydrophobicContact CG2-CD1 4.18Å; I949-V957 HydrophobicContact CG2-CG2 4.43Å; I949-L960 HydrophobicContact CD1-CB 4.07Å; I949-L960 HydrophobicContact CD1-CD1 4.34Å; I949-L960 HydrophobicContact CD1-CD2 3.82Å; I949-L960 HydrophobicContact CD1-CG 4.3Å; I949-L960 HydrophobicContact CG1-CD2 4.13Å
950	E	86.6	Confident	82	Confident	29 Å²	29	38.5 Å²	38.5	14%	0.136	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	131.6	172.5	-166.7	-172	142.4	0	0	110.8	L483 R486 L682 S952 N953	L483-E950 HydrophobicContact CD2-CG 4.06Å; R486-E950 IonicContact CZ-OE1 3.17Å; R486-E950 IonicContact CZ-OE2 2.72Å; R486-E950 IonicContact NH1-OE1 3.51Å; R486-E950 PolarHBondContact NH1-OE1 3.21Å; R486-E950 IonicContact NH1-OE2 3.26Å; R486-E950 VanDerWaalsContact NH2-CD 3.35Å; R486-E950 IonicContact NH2-OE1 2.7Å; R486-E950 PolarHBondContact NH2-OE1 3.06Å; R486-E950 IonicContact NH2-OE2 2.74Å; R486-E950 PolarHBondContact NH2-OE2 3.49Å; L682-E950 WeakPolarHBondContact O-CA 3.41Å; E950-S952 PolarHBondContact O-N 3.18Å; E950-S952 VanDerWaalsContact O-N 3.09Å; E950-S952 VanDerWaalsContact OE1-CB 3.32Å; E950-S952 WeakPolarHBondContact OE1-CB 3.21Å; E950-S952 PolarHBondContact OE1-OG 3.21Å; E950-N953 PolarHBondContact O-N 3.47Å
951	K	83.2	Confident	82.7	Confident	74 Å²	74	39.5 Å²	39.5	32%	0.322	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-18	-178.5	-97.8	175.3	-179.8	171.1	0	114.6	D680 L682 L683 T684 I949	D680-K951 VanDerWaalsContact O-CD 3.25Å; D680-K951 WeakPolarHBondContact O-CD 3.3Å; D680-K951 VanDerWaalsContact O-CE 3.31Å; D680-K951 WeakPolarHBondContact O-CE 3.41Å; D680-K951 PolarHBondContact O-NZ 3.32Å; D680-K951 IonicContact OD1-NZ 2.68Å; D680-K951 PolarHBondContact OD1-NZ 2.96Å; L682-K951 PolarHBondContact O-N 3.36Å; L683-K951 WeakPolarHBondContact O-CE 3.38Å; T684-K951 WeakPolarHBondContact OG1-CE 3.36Å; T684-K951 WeakPolarHBondContact OG1-CG 3.36Å; I949-K951 PolarHBondContact O-N 3.03Å
952	S	82	Confident	82.6	Confident	79 Å²	79	41.9 Å²	41.9	55%	0.552	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-23.1	174.2	69.4	0	0	0	0	113.6	E950 W954	E950-S952 PolarHBondContact O-N 3.18Å; E950-S952 VanDerWaalsContact O-N 3.09Å; E950-S952 VanDerWaalsContact OE1-CB 3.32Å; E950-S952 WeakPolarHBondContact OE1-CB 3.21Å; E950-S952 PolarHBondContact OE1-OG 3.21Å; S952-W954 PolarHBondContact O-N 2.89Å
953	N	84.9	Confident	81.7	Confident	57 Å²	57	40.4 Å²	40.4	31%	0.305	20%	0.198	S	C	.	.			trans	-82	74	179.1	-167.6	-31.9	0	0	0	110	I949 E950 E955 L956 V957	I949-N953 HydrophobicContact CG2-CB 4.29Å; E950-N953 PolarHBondContact O-N 3.47Å; N953-E955 VanDerWaalsContact C-N 3.26Å; N953-E955 PolarHBondContact O-N 3.46Å; N953-L956 VanDerWaalsContact ND2-CD1 3.3Å; N953-L956 WeakPolarHBondContact ND2-CD1 3.26Å; N953-L956 PolarHBondContact O-N 2.88Å; N953-L956 WeakPolarHBondContact OD1-CG 3.47Å; N953-L956 PolarHBondContact OD1-N 3.03Å; N953-V957 WeakPolarHBondContact O-CG2 3.42Å; N953-V957 PolarHBondContact O-N 2.84Å
954	W	79.8	Confident	79.6	Confident	175 Å²	175	48.6 Å²	48.6	66%	0.663	23%	0.234	S	C	*	.	H	α-helix	trans	-58.9	-33.7	-172.6	72.2	-88.3	0	0	0	113.1	S952 H958	S952-W954 PolarHBondContact O-N 2.89Å; W954-H958 WeakPolarHBondContact O-CB 3.46Å; W954-H958 PolarHBondContact O-N 2.78Å
955	E	82.3	Confident	76.9	Confident	70 Å²	70	53.9 Å²	53.9	33%	0.327	27%	0.27	S	S	.	.	H	α-helix	trans	-62.6	-48.5	178.1	-64	-173.7	174.1	0	0	111.1	N953 T959	N953-E955 VanDerWaalsContact C-N 3.26Å; N953-E955 PolarHBondContact O-N 3.46Å; E955-T959 WeakPolarHBondContact O-CB 3.11Å; E955-T959 PolarHBondContact O-N 3.19Å; E955-T959 PolarHBondContact O-OG1 3.41Å
956	L	85.8	Confident	73.8	Confident	11 Å²	11	61.3 Å²	61.3	6%	0.058	31%	0.308	C	S	.	.	H	α-helix	trans	-73.4	-36.3	178.3	-67.1	-178.6	0	0	0	112.8	P699 W729 C732 I949 N953 H958 T959 L960	P699-L956 HydrophobicContact CB-CD2 3.86Å; W729-L956 HydrophobicContact CZ3-CD2 4.21Å; C732-L956 HydrophobicContact CB-CD1 3.77Å; C732-L956 HydrophobicContact CB-CD2 3.99Å; C732-L956 WeakPolarHBondContact O-CD1 3.35Å; I949-L956 HydrophobicContact CD1-CB 3.94Å; I949-L956 HydrophobicContact CG2-CB 3.79Å; I949-L956 HydrophobicContact CG2-CD1 4.18Å; N953-L956 VanDerWaalsContact ND2-CD1 3.3Å; N953-L956 WeakPolarHBondContact ND2-CD1 3.26Å; N953-L956 PolarHBondContact O-N 2.88Å; N953-L956 WeakPolarHBondContact OD1-CG 3.47Å; N953-L956 PolarHBondContact OD1-N 3.03Å; L956-H958 VanDerWaalsContact C-N 3.35Å; L956-T959 WeakPolarHBondContact O-CB 3.42Å; L956-T959 PolarHBondContact O-N 3.05Å; L956-L960 WeakPolarHBondContact O-CB 3.4Å; L956-L960 PolarHBondContact O-N 2.81Å
957	V	83.4	Confident	70.8	Confident	21 Å²	21	73.7 Å²	73.7	13%	0.127	37%	0.365	C	S	.	.	H	α-helix	trans	-60.7	-45.7	173	169.6	0	0	0	0	110.4	T684 I949 N953 T959 L960 L961	T684-V957 HydrophobicContact CG2-CG1 4.39Å; I949-V957 HydrophobicContact CG2-CG2 4.43Å; N953-V957 WeakPolarHBondContact O-CG2 3.42Å; N953-V957 PolarHBondContact O-N 2.84Å; V957-T959 VanDerWaalsContact C-N 3.33Å; V957-T959 PolarHBondContact O-N 2.86Å; V957-L960 PolarHBondContact O-N 3.43Å; V957-L961 HydrophobicContact CG1-CD1 3.83Å; V957-L961 WeakPolarHBondContact O-CB 3.4Å; V957-L961 VanDerWaalsContact O-CG 3.26Å; V957-L961 WeakPolarHBondContact O-CG 3.21Å; V957-L961 PolarHBondContact O-N 3.13Å; V957-L961 VanDerWaalsContact O-N 3.11Å
958	H	80.9	Confident	69.8	Low	85 Å²	85	77.4 Å²	77.4	39%	0.394	38%	0.384	S	S	.	.	H	α-helix	trans	-61.7	-41.3	175.2	-174.7	-110.9	0	0	0	111.4	W954 L956 L961 Q962	W954-H958 WeakPolarHBondContact O-CB 3.46Å; W954-H958 PolarHBondContact O-N 2.78Å; L956-H958 VanDerWaalsContact C-N 3.35Å; H958-L961 PolarHBondContact O-N 3.03Å; H958-Q962 PolarHBondContact CE1-NE2 3.17Å; H958-Q962 PolarHBondContact CE1-OE1 3.33Å; H958-Q962 PolarHBondContact NE2-NE2 3.18Å; H958-Q962 WeakPolarHBondContact O-CB 3.5Å; H958-Q962 WeakPolarHBondContact O-CG 3.29Å; H958-Q962 PolarHBondContact O-N 3.28Å
959	T	80.4	Confident	68.8	Low	7 Å²	7	81.4 Å²	81.4	4%	0.043	40%	0.404	C	S	.	.	H	α-helix	trans	-62.6	-41.9	175.5	-54.2	0	0	0	0	113.1	W698 I701 W729 E955 L956 V957 L961 T963	W698-T959 WeakPolarHBondContact O-CG2 3.34Å; I701-T959 HydrophobicContact CD1-CG2 4.23Å; I701-T959 VanDerWaalsContact CD1-OG1 3.23Å; I701-T959 WeakPolarHBondContact CD1-OG1 3.37Å; I701-T959 HydrophobicContact CG1-CG2 3.9Å; W729-T959 HydrophobicContact CH2-CG2 4.36Å; E955-T959 WeakPolarHBondContact O-CB 3.11Å; E955-T959 PolarHBondContact O-N 3.19Å; E955-T959 PolarHBondContact O-OG1 3.41Å; L956-T959 WeakPolarHBondContact O-CB 3.42Å; L956-T959 PolarHBondContact O-N 3.05Å; V957-T959 VanDerWaalsContact C-N 3.33Å; V957-T959 PolarHBondContact O-N 2.86Å; T959-L961 VanDerWaalsContact C-N 3.27Å; T959-L961 PolarHBondContact O-N 2.95Å; T959-T963 PolarHBondContact O-OG1 2.95Å
960	L	81.7	Confident	67.7	Low	0 Å²	0	85.9 Å²	85.9	0%	0	43%	0.426	C	S	.	.	H	α-helix	trans	-66.9	-28.4	178.2	-167.6	68.3	0	0	0	112.5	T684 R686 V697 W729 L947 I949 L956 V957	T684-L960 HydrophobicContact CG2-CD2 4.2Å; R686-L960 HydrophobicContact CB-CD1 3.88Å; R686-L960 HydrophobicContact CB-CD2 4.05Å; R686-L960 HydrophobicContact CB-CG 3.87Å; R686-L960 WeakPolarHBondContact CD-O 3.41Å; R686-L960 PolarHBondContact NH1-O 2.85Å; V697-L960 HydrophobicContact CG1-CD1 4.18Å; W729-L960 HydrophobicContact CH2-CD1 4.35Å; L947-L960 HydrophobicContact CB-CD1 3.91Å; L947-L960 HydrophobicContact CD1-CD1 3.69Å; L947-L960 HydrophobicContact CG-CD1 4.48Å; I949-L960 HydrophobicContact CD1-CB 4.07Å; I949-L960 HydrophobicContact CD1-CD1 4.34Å; I949-L960 HydrophobicContact CD1-CD2 3.82Å; I949-L960 HydrophobicContact CD1-CG 4.3Å; I949-L960 HydrophobicContact CG1-CD2 4.13Å; L956-L960 WeakPolarHBondContact O-CB 3.4Å; L956-L960 PolarHBondContact O-N 2.81Å; V957-L960 PolarHBondContact O-N 3.43Å
961	L	74	Confident	66.6	Low	103 Å²	103	89.2 Å²	89.2	54%	0.539	44%	0.443	S	S	.	.	H	α-helix	trans	-95.2	-38.1	-177	-66.8	173.3	0	0	0	114	V957 H958 T959 T963	V957-L961 HydrophobicContact CG1-CD1 3.83Å; V957-L961 WeakPolarHBondContact O-CB 3.4Å; V957-L961 VanDerWaalsContact O-CG 3.26Å; V957-L961 WeakPolarHBondContact O-CG 3.21Å; V957-L961 PolarHBondContact O-N 3.13Å; V957-L961 VanDerWaalsContact O-N 3.11Å; H958-L961 PolarHBondContact O-N 3.03Å; T959-L961 VanDerWaalsContact C-N 3.27Å; T959-L961 PolarHBondContact O-N 2.95Å; L961-T963 PolarHBondContact O-N 3.28Å
962	Q	63.2	Low	65.5	Low	98 Å²	98	90.2 Å²	90.2	46%	0.458	45%	0.451	S	S	.	.	H	α-helix	trans	-63.2	-27.5	-177.7	-83.9	-157.1	-42.2	0	0	113.9	H958 K964 C965	H958-Q962 PolarHBondContact CE1-NE2 3.17Å; H958-Q962 PolarHBondContact CE1-OE1 3.33Å; H958-Q962 PolarHBondContact NE2-NE2 3.18Å; H958-Q962 WeakPolarHBondContact O-CB 3.5Å; H958-Q962 WeakPolarHBondContact O-CG 3.29Å; H958-Q962 PolarHBondContact O-N 3.28Å; Q962-K964 PolarHBondContact O-N 3.2Å; Q962-C965 PolarHBondContact O-N 3.43Å
963	T	53.8	Low	64.4	Low	38 Å²	38	90.9 Å²	90.9	23%	0.233	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	36.5	179.3	45	0	0	0	0	112.6	R686 S696 V697 T959 L961	R686-T963 PolarHBondContact NH1-O 3.32Å; R686-T963 VanDerWaalsContact NH1-O 3.09Å; R686-T963 PolarHBondContact NH1-OG1 3.43Å; R686-T963 PolarHBondContact NH2-O 2.81Å; S696-T963 WeakPolarHBondContact O-CG2 3.35Å; V697-T963 HydrophobicContact CG1-CG2 4.48Å; T959-T963 PolarHBondContact O-OG1 2.95Å; L961-T963 PolarHBondContact O-N 3.28Å
964	K	38.3	Very low	63	Low	171 Å²	171	93.4 Å²	93.4	74%	0.743	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	4.2	173.2	-138.4	-177	-174.8	-173.7	0	112.5	Q962	Q962-K964 PolarHBondContact O-N 3.2Å
965	C	28.1	Very low	61.7	Low	111 Å²	111	87.1 Å²	87.1	75%	0.75	44%	0.438	S	S	*	.	S	Bend	trans	-109	20.8	-177.4	-57.8	0	0	0	0	113.6	Q962	Q962-C965 PolarHBondContact O-N 3.43Å
966	I	25.8	Very low	60	Low	158 Å²	158	88.5 Å²	88.5	81%	0.81	45%	0.447	S	S	*	.			trans	-139.8	48.3	178.8	-38.4	179.1	0	0	0	110.6
967	E	24.1	Very low	57.6	Low	259 Å²	259	95.5 Å²	95.5	100%	1.21	48%	0.483	S	S	*	.			trans	-137.2	0	154.3	-75.1	-171.2	144.2	0	0	107.5

Retrieved 967 of 967 residues in 582.4 ms (Link to these results)

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