A0A087Y450_POEFO Loading...

Si:dkey-156n14.3

AlphaFold DB , UniProt , Accession A0A087Y450, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,216 aa.

						>A0A087Y450_POEFO|A0A087Y450
MEIQGLSDAQNIHSQHGALHRTASSALRSTVASLPQFISIENEADELQSDSNNNARPKTAQFRLLGENGSELARSPVTKQVSASSSITPEDRTILGLHNMINAEKENVFNSLLGSHDFSRTEWRYEENGEVMQMALPLFEGEAEAMPQRQLTLSSPVLRQQQTDRQTQELYVVFNTAREDGAVTASRNRADGSFDSGGKVKGKEAEGCGSMEAGSGGVAFCENADILSCPDTQTPKRAEHVFSLLTDNPAVLSAKTAADHHTVEDVVLTNKYGDKLCGQICTENGDDRLLRGRPNHDAALTSGAVEAMEKPAYSSETAGLQDGSHPVTSSSSPPAAETFSGTITINNQSIIVTIENGVLTLAAPPEGYVHKEDDMVSLKEHLGMKDHEDIVLLNYDSGTKSIGKISTLAVASSSHQEEPRPGVSVSDSELALVDDCSLSELGTSLDSCSVAKQEAGVLCAVTEADLIAPSPKAPVGGCSNEDLNSLSLIRSKKDTAATFACPEPGCSSAFDSRQKLKVHLLYHAEEPRPYQCKVEGCGWAFATSYKLKRHLQSHDKQRPHTCEFEGCGRRFTTVYNLKAHVKVHEQDHAFVCEVCNEKFRSATRLANHQRVHFAPQRPHKCEFPGCEKTFITFSALFSHNRTHFRETGQFSCTFPGCDKTYDKACRLKIHMRSHTGERPFVCDSEGCGWSFTSMSKLLRHKRKHDDDRRFVCPEEGCGKSFTRAEHLKGHSITHLGTKPFQCHAEGCYAKFSARSSLYIHSKKHKQDASTLRTRCPVANCSKHFSSRSNLKSHMLKHHHLSPDVLCQMETTPTLTPSSELISSTPTSVAGSVVGGTEQLSSLDLSSLFSSVPGGAAPTAGIEVGIPVAGGTSNGSFTMDLSLVSSGILTIDPSSVGATLVASAGATLAKPLEPLVMATGADLAHQHGLEGTVGDVLPPQGTLNLDDVQSVTPEALGTLAALSMQGAGVGAAVDPALQHSLSSSGGLGVESAASLAVAPVSELLASPSKVVEVGAQAGAGHLLGCVEVLGPQEGGKIVTSQFVFPGSGGGGFSPQKELDLAVSPSSFLDTGGSARTDYRAIQLAKKKKQRGSSAGAGTSGSCQRKTKASKVSVATIPLTSSGARYSDGAVTASGGLTLRDPVTGTQYVQIQLLQQDDPASDGDLAFQLSSQPSTSDSQLTVDLPVNILQEPSVMTEEDNGSDNSQFTGSTINLQDLE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.1	Very low	35.7	Very low	215 Å²	215	139.4 Å²	139.4	100%	1.059	77%	0.771	S	S	*	*				0	82.9	0	-52.3	-175	86.4	0	0	108.2
2	E	30.5	Very low	35.8	Very low	168 Å²	168	138.5 Å²	138.5	79%	0.785	76%	0.762	S	S	*	*			cis	66.1	141.5	22.2	-56	166	112.2	0	0	112.8
3	I	38.6	Very low	35.5	Very low	133 Å²	133	140.7 Å²	140.7	68%	0.682	76%	0.763	S	S	*	*			cis	-158.2	156.2	10.1	-134.6	161.6	0	0	0	114.1
4	Q	38.7	Very low	35.5	Very low	149 Å²	149	136.3 Å²	136.3	70%	0.696	75%	0.748	S	S	*	*			trans	36.5	152	150.4	-108.9	66	-6.5	0	0	127.1	L6	Q4-L6 HydrophobicContact CB-CD1 4.36Å; Q4-L6 HydrophobicContact CG-CD1 3.62Å; Q4-L6 HydrophobicContact CG-CG 3.95Å
5	G	37.6	Very low	35.6	Very low	72 Å²	72	137.7 Å²	137.7	74%	0.742	75%	0.747	S	S	*	*			trans	153.6	88.2	152.1	0	0	0	0	0	112.5
6	L	40.7	Very low	35.8	Very low	143 Å²	143	140.1 Å²	140.1	75%	0.749	75%	0.751	S	S	*	*				67.1	135.7	58.2	-59.6	175.5	0	0	0	114.1	Q4	Q4-L6 HydrophobicContact CB-CD1 4.36Å; Q4-L6 HydrophobicContact CG-CD1 3.62Å; Q4-L6 HydrophobicContact CG-CG 3.95Å
7	S	41.1	Very low	35.7	Very low	85 Å²	85	135.9 Å²	135.9	59%	0.594	75%	0.749	S	S	*	*			cis	-169.3	-178.4	-7.2	44.2	0	0	0	0	113.1
8	D	33.3	Very low	35.7	Very low	155 Å²	155	133.9 Å²	133.9	83%	0.829	75%	0.753	S	S	*	*			trans	93.6	150.9	152.9	-58.9	-57.5	0	0	0	122
9	A	39.6	Very low	35.6	Very low	90 Å²	90	135.1 Å²	135.1	74%	0.744	76%	0.757	S	S	*	*			trans	-165.9	168.5	-159.7	0	0	0	0	0	113.7
10	Q	35.8	Very low	35.6	Very low	185 Å²	185	135.1 Å²	135.1	86%	0.864	75%	0.75	S	S	*	*			trans	-156.2	124.9	158.8	-99.8	146.6	45.7	0	0	108.9
11	N	28.1	Very low	35.5	Very low	138 Å²	138	138 Å²	138	74%	0.738	75%	0.749	S	S	*	*				82.7	140.2	76	-147.5	22.7	0	0	0	111.5
12	I	36.8	Very low	35.8	Very low	129 Å²	129	133.8 Å²	133.8	66%	0.662	74%	0.736	S	S	*	*			cis	-154.9	166.4	25.9	-16.6	177.1	0	0	0	112.1
13	H	31.8	Very low	35.7	Very low	167 Å²	167	130.8 Å²	130.8	77%	0.773	74%	0.74	S	S	*	*			trans	73.8	139.7	152.6	-90.2	46.1	0	0	0	121
14	S	35	Very low	35.4	Very low	79 Å²	79	129.8 Å²	129.8	55%	0.552	75%	0.745	S	S	*	*			cis	-160.9	142.5	-9.8	-139.5	0	0	0	0	116.7
15	Q	37.8	Very low	35.1	Very low	157 Å²	157	128.7 Å²	128.7	73%	0.734	75%	0.753	S	S	*	*			trans	73.5	127.1	141.6	-81.9	179	15.1	0	0	126.7
16	H	38.5	Very low	35	Very low	177 Å²	177	129 Å²	129	82%	0.819	75%	0.749	S	S	*	*			trans	61.2	134.1	150.5	-64.3	-66.5	0	0	0	122.3
17	G	33.6	Very low	34.6	Very low	69 Å²	69	129.3 Å²	129.3	71%	0.711	75%	0.751	S	S	*	*			cis	165.5	161.9	-11.5	0	0	0	0	0	116.1
18	A	35.5	Very low	34.1	Very low	99 Å²	99	136.1 Å²	136.1	82%	0.818	76%	0.763	S	S	*	*			trans	71.7	150.5	169.7	0	0	0	0	0	119.3
19	L	35	Very low	34	Very low	157 Å²	157	133.4 Å²	133.4	82%	0.822	76%	0.756	S	S	*	*			cis	-169.9	165.4	-17.4	-91.3	174.1	0	0	0	106.9
20	H	35.4	Very low	33.6	Very low	134 Å²	134	134.9 Å²	134.9	62%	0.62	76%	0.756	S	S	*	*			cis	179.9	123.3	-25.2	-175.9	-124.1	0	0	0	114.7
21	R	33.9	Very low	33.4	Very low	197 Å²	197	132.5 Å²	132.5	74%	0.743	75%	0.754	S	S	*	*			trans	78.6	139.8	147.2	-83.4	-169.1	-162.3	-154.7	0.4	126.9
22	T	34.2	Very low	33.4	Very low	127 Å²	127	130.1 Å²	130.1	78%	0.779	75%	0.754	S	S	*	*			trans	70.1	126.5	135.8	53.2	0	0	0	0	125.8
23	A	29	Very low	33.1	Very low	105 Å²	105	129.9 Å²	129.9	87%	0.868	76%	0.763	S	S	*	*			trans	-174.8	172	131.8	0	0	0	0	0	112.5
24	S	32.7	Very low	32.7	Very low	112 Å²	112	129.7 Å²	129.7	78%	0.783	77%	0.767	S	S	*	*			trans	-149.5	152.9	-172.7	-53.8	0	0	0	0	115.5
25	S	31.6	Very low	33.4	Very low	125 Å²	125	130.3 Å²	130.3	87%	0.874	77%	0.769	S	S	*	*			trans	61.3	170.7	155.9	79.8	0	0	0	0	119.1
26	A	35.3	Very low	33	Very low	79 Å²	79	130.2 Å²	130.2	65%	0.653	77%	0.769	S	S	*	*			cis	-164.7	160	-6.2	0	0	0	0	0	115
27	L	32	Very low	32.4	Very low	149 Å²	149	129.7 Å²	129.7	78%	0.78	77%	0.765	S	S	*	*			trans	66	126	141.4	-64.1	166.9	0	0	0	127.3
28	R	31.8	Very low	32.1	Very low	229 Å²	229	133 Å²	133	86%	0.864	76%	0.764	S	S	*	*			trans	72	136.5	130.2	-72.9	-176.1	179.7	-164	1.3	127.1
29	S	29.8	Very low	31.7	Very low	97 Å²	97	132.9 Å²	132.9	68%	0.678	76%	0.758	S	S	*	*				110	101.7	126.4	-104.8	0	0	0	0	125.2
30	T	31.6	Very low	31.2	Very low	121 Å²	121	132.1 Å²	132.1	74%	0.742	75%	0.753	S	S	*	*				37.5	135.9	119.4	60.8	0	0	0	0	125.2
31	V	31.6	Very low	30.9	Very low	136 Å²	136	133.3 Å²	133.3	82%	0.824	76%	0.759	S	S	*	*				142.4	115.5	127.3	173.2	0	0	0	0	117.1
32	A	28	Very low	30.6	Very low	88 Å²	88	131.1 Å²	131.1	73%	0.727	76%	0.762	S	S	*	*			trans	37.5	152.4	141.7	0	0	0	0	0	128.5
33	S	30	Very low	30.4	Very low	123 Å²	123	134.5 Å²	134.5	86%	0.86	77%	0.769	S	S	*	*			trans	109.2	144.7	139.5	-65.3	0	0	0	0	123
34	L	23.4	Very low	30.3	Very low	163 Å²	163	134.4 Å²	134.4	85%	0.853	77%	0.768	S	S	*	*			trans	-94.1	-173	173.5	-88	110.2	0	0	0	111.5
35	P	49.8	Very low	30.1	Very low	93 Å²	93	136.5 Å²	136.5	60%	0.604	77%	0.77	S	S	*	*			cis	-135.8	177.9	-5.3	19.2	7.6	0	0	0	116.9
36	Q	30.3	Very low	29.9	Very low	155 Å²	155	138.1 Å²	138.1	72%	0.724	76%	0.764	S	S	*	*			trans	43	140.5	145.9	-58.6	160.8	-62.5	0	0	121.2
37	F	26.8	Very low	29.5	Very low	166 Å²	166	140 Å²	140	73%	0.728	76%	0.763	S	S	*	*				-171.2	137	64.7	-112.4	-89.9	0	0	0	113.7
38	I	26.9	Very low	29.2	Very low	137 Å²	137	141.1 Å²	141.1	70%	0.703	76%	0.764	S	S	*	*			trans	39.9	132.9	139.9	-63.7	-175.4	0	0	0	123.6
39	S	25.8	Very low	28.9	Very low	97 Å²	97	134.3 Å²	134.3	68%	0.678	75%	0.751	S	S	*	*			trans	110.5	128.4	139.6	-93.1	0	0	0	0	124
40	I	26.3	Very low	28.8	Very low	141 Å²	141	136.7 Å²	136.7	72%	0.723	76%	0.756	S	S	*	*			trans	79.1	108.2	134.1	-66.6	167.4	0	0	0	121.3
41	E	27.4	Very low	28.8	Very low	160 Å²	160	135 Å²	135	75%	0.748	75%	0.749	S	S	*	*			trans	52.4	140.2	132.1	-55.3	-172.1	152	0	0	125.5
42	N	28.2	Very low	28.7	Very low	151 Å²	151	135 Å²	135	81%	0.807	75%	0.745	S	S	*	*			trans	82.9	148.9	149.2	-62.7	-32	0	0	0	120.8
43	E	29.8	Very low	28.7	Very low	198 Å²	198	136.7 Å²	136.7	93%	0.925	74%	0.742	S	S	*	*			trans	-88.2	147.9	-162.9	-53.4	-178	121.3	0	0	113.5
44	A	27.9	Very low	28.6	Very low	102 Å²	102	137.8 Å²	137.8	84%	0.843	74%	0.738	S	S	*	*			trans	-152.3	159.9	157.2	0	0	0	0	0	110.3
45	D	28.2	Very low	28.8	Very low	156 Å²	156	134.5 Å²	134.5	83%	0.834	73%	0.734	S	S	*	*			trans	-74.6	165.6	-159.8	-87.6	-69	0	0	0	119.2
46	E	26.1	Very low	27.7	Very low	160 Å²	160	141.5 Å²	141.5	75%	0.748	75%	0.749	S	S	*	*			trans	65.7	123	147.2	-76.4	-167.8	128.5	0	0	124.2
47	L	27.3	Very low	28.3	Very low	118 Å²	118	138.9 Å²	138.9	62%	0.618	75%	0.745	S	S	*	*				64	120.1	130	-61.7	172.5	0	0	0	122.8
48	Q	25.3	Very low	28.3	Very low	172 Å²	172	140.9 Å²	140.9	80%	0.804	75%	0.753	S	S	*	*			trans	69.9	142.3	134.8	-66.7	172.7	-10.5	0	0	119.2
49	S	26.2	Very low	28.5	Very low	87 Å²	87	141 Å²	141	61%	0.608	76%	0.76	S	S	*	*			cis	-158.5	170.4	-13.1	59.8	0	0	0	0	111.2
50	D	27.3	Very low	28.5	Very low	146 Å²	146	140.7 Å²	140.7	78%	0.781	76%	0.764	S	S	*	*			trans	65	152.9	156.2	-54.1	-48.1	0	0	0	120.2
51	S	31.3	Very low	28.6	Very low	85 Å²	85	141.7 Å²	141.7	59%	0.594	77%	0.766	S	S	*	*			cis	-164.7	155.2	-30.1	62	0	0	0	0	110.5
52	N	29.5	Very low	28.7	Very low	138 Å²	138	142.6 Å²	142.6	74%	0.738	77%	0.767	S	S	*	*			trans	65.2	154.6	154.2	-63.9	-32.2	0	0	0	118.8
53	N	28.5	Very low	28.6	Very low	123 Å²	123	145.9 Å²	145.9	66%	0.658	77%	0.769	S	S	*	*			cis	-154.1	138.6	8.5	-128.3	-22	0	0	0	113.7
54	N	27.6	Very low	28.5	Very low	146 Å²	146	142.4 Å²	142.4	78%	0.781	76%	0.756	S	S	*	*			trans	55.9	139.7	148.4	-70.5	-32.1	0	0	0	126.3
55	A	28.2	Very low	28.5	Very low	93 Å²	93	145 Å²	145	77%	0.769	75%	0.754	S	S	*	*			trans	100.2	86.1	139	0	0	0	0	0	123.7
56	R	27.6	Very low	28.3	Very low	241 Å²	241	140.4 Å²	140.4	91%	0.909	74%	0.744	S	S	*	*			trans	67.2	-176.5	137	-127.9	-163.3	178.4	-174.5	0.1	118
57	P	41.5	Very low	28.5	Very low	99 Å²	99	141 Å²	141	64%	0.643	75%	0.747	S	S	*	*				-104.5	169.9	-85.4	33.5	-18.8	0	0	0	115.5
58	K	26.8	Very low	28.6	Very low	208 Å²	208	142.1 Å²	142.1	90%	0.904	75%	0.753	S	S	*	*				178.4	166.4	128.6	-102.2	168	-177	-179.2	0	114.2
59	T	30.7	Very low	28.6	Very low	139 Å²	139	137.8 Å²	137.8	85%	0.853	75%	0.754	S	S	*	*			trans	-127.2	137.9	174.4	-28.8	0	0	0	0	109.6
60	A	27.3	Very low	28.6	Very low	91 Å²	91	138.6 Å²	138.6	75%	0.752	76%	0.76	S	S	*	*			trans	63.4	167.8	178.2	0	0	0	0	0	114.7
61	Q	28.8	Very low	28.5	Very low	163 Å²	163	139.7 Å²	139.7	76%	0.762	76%	0.761	S	S	*	*			cis	-149.3	164.9	20.8	-94.6	-165.4	-8.2	0	0	113.5
62	F	27.9	Very low	28.3	Very low	179 Å²	179	142.7 Å²	142.7	79%	0.785	77%	0.769	S	S	*	*			trans	35	143.5	146.3	-78.5	-97.4	0	0	0	124.7
63	R	25.9	Very low	28.1	Very low	220 Å²	220	140.1 Å²	140.1	83%	0.83	77%	0.767	S	S	*	*			trans	-147.9	130.5	132.5	-96	-156.3	157.8	88.5	0.7	109.6
64	L	27.9	Very low	27.9	Very low	125 Å²	125	145.5 Å²	145.5	65%	0.654	78%	0.778	S	S	*	*				68	138.9	79.1	-64.8	-172.1	0	0	0	113
65	L	27.8	Very low	27.7	Very low	155 Å²	155	143.9 Å²	143.9	81%	0.812	78%	0.778	S	S	*	*			cis	-152.1	169.8	-1.6	-95.1	148.7	0	0	0	106.8
66	G	26.1	Very low	28.1	Very low	60 Å²	60	144.7 Å²	144.7	62%	0.619	78%	0.776	S	S	*	*			cis	119.7	128.4	2.8	0	0	0	0	0	112.4
67	E	28.7	Very low	27.9	Very low	174 Å²	174	138.9 Å²	138.9	81%	0.813	77%	0.767	S	S	*	*			trans	-172.3	140.1	157.5	-111.7	-172.5	166	0	0	115
68	N	29.5	Very low	27.1	Very low	141 Å²	141	139.8 Å²	139.8	75%	0.754	77%	0.77	S	S	*	*			trans	57.3	126.6	148	-54	-30.3	0	0	0	122.6
69	G	26	Very low	27	Very low	80 Å²	80	138.5 Å²	138.5	83%	0.825	77%	0.765	S	S	*	*			trans	160.5	63.8	165	0	0	0	0	0	119.4
70	S	26.3	Very low	26.7	Very low	105 Å²	105	140.3 Å²	140.3	73%	0.734	76%	0.764	S	S	*	*			trans	0.8	136.8	162	-53.9	0	0	0	0	124.1
71	E	24.1	Very low	26.5	Very low	169 Å²	169	141.6 Å²	141.6	79%	0.79	76%	0.762	S	S	*	*			trans	78	129.4	131.1	-72.1	-175	105.2	0	0	125.1
72	L	27.2	Very low	26.2	Very low	148 Å²	148	139 Å²	139	78%	0.775	76%	0.762	S	S	*	*			trans	58.4	113.3	140.4	-88.1	76.5	0	0	0	123.2
73	A	25.1	Very low	25.9	Very low	83 Å²	83	134.8 Å²	134.8	69%	0.686	76%	0.76	S	S	*	*				90.2	129.5	116.2	0	0	0	0	0	121.6
74	R	24.5	Very low	25.9	Very low	237 Å²	237	130 Å²	130	89%	0.894	76%	0.76	S	S	*	*			trans	55.1	98.9	143.2	-76.4	-178.5	170.3	151	-2.1	119
75	S	24.1	Very low	25.9	Very low	111 Å²	111	128.6 Å²	128.6	78%	0.776	76%	0.761	S	S	*	*				-41.9	152.7	124.9	-21	0	0	0	0	110.8
76	P	36.8	Very low	25.9	Very low	111 Å²	111	126.1 Å²	126.1	72%	0.721	76%	0.756	S	S	*	*				-157.4	163	70.7	44.7	-25.2	0	0	0	118.6
77	V	23.6	Very low	25.9	Very low	118 Å²	118	130.6 Å²	130.6	72%	0.715	77%	0.765	S	S	*	*			trans	58.1	95.3	131	175.6	0	0	0	0	119.9
78	T	23.6	Very low	25.6	Very low	118 Å²	118	128.2 Å²	128.2	72%	0.724	76%	0.762	S	S	*	*			trans	76.5	162.9	131.6	70	0	0	0	0	122.8
79	K	25.6	Very low	26	Very low	182 Å²	182	126.4 Å²	126.4	79%	0.791	76%	0.758	S	S	*	*			trans	100.4	148.1	149.9	-83.3	-178.9	179.3	176.4	0	118.8
80	Q	25	Very low	26	Very low	176 Å²	176	130.2 Å²	130.2	82%	0.822	75%	0.754	S	S	*	*			trans	71.3	154.9	162	-73.8	172.1	-50.4	0	0	117.7
81	V	21.4	Very low	26.2	Very low	118 Å²	118	130.3 Å²	130.3	72%	0.715	75%	0.747	S	S	*	*			cis	173	176.2	-35.3	131	0	0	0	0	106.2
82	S	23.4	Very low	26.6	Very low	110 Å²	110	131.9 Å²	131.9	77%	0.769	75%	0.745	S	S	*	*			trans	67.2	114.5	163.3	47.6	0	0	0	0	117.3
83	A	21.8	Very low	26.7	Very low	89 Å²	89	129.5 Å²	129.5	74%	0.736	74%	0.737	S	S	*	*			trans	-80	-178	158.2	0	0	0	0	0	111.2
84	S	26	Very low	26.8	Very low	120 Å²	120	132.6 Å²	132.6	84%	0.839	74%	0.741	S	S	*	*			trans	77	157.8	167.3	86.9	0	0	0	0	115.8
85	S	28.1	Very low	26.8	Very low	95 Å²	95	129 Å²	129	66%	0.664	74%	0.738	S	S	*	*			cis	-153.5	167.8	16.7	63.4	0	0	0	0	114.7
86	S	26.1	Very low	26.8	Very low	103 Å²	103	126.6 Å²	126.6	72%	0.72	73%	0.732	S	S	*	*			trans	74.5	159	153.3	82.4	0	0	0	0	117.3
87	I	26	Very low	26.3	Very low	155 Å²	155	128.9 Å²	128.9	80%	0.795	74%	0.737	S	S	*	*			cis	-123.4	153.5	8.4	-56.3	170.5	0	0	0	110.9
88	T	23.4	Very low	26.4	Very low	123 Å²	123	130.4 Å²	130.4	76%	0.755	74%	0.736	S	S	*	*			trans	-85.7	-148.3	176	49.9	0	0	0	0	109.6
89	P	37.2	Very low	26.4	Very low	104 Å²	104	131.4 Å²	131.4	68%	0.675	74%	0.737	S	S	*	*			cis	-132.1	-158.2	-8.4	31.5	-3.3	0	0	0	111.4
90	E	27.2	Very low	26.4	Very low	159 Å²	159	130 Å²	130	74%	0.743	74%	0.735	S	S	*	*			cis	-142.8	150.5	14.9	-67.6	-176	145.9	0	0	112.9
91	D	29.6	Very low	26.8	Very low	107 Å²	107	129.4 Å²	129.4	57%	0.572	74%	0.735	S	S	*	*			trans	66.1	147.9	132.9	-72.7	9.8	0	0	0	124.2
92	R	32.6	Very low	26.9	Very low	202 Å²	202	130.9 Å²	130.9	76%	0.762	74%	0.739	S	S	*	*			cis	-149.4	136.5	-6.3	-130	166.9	172.7	127.5	-7	113.9
93	T	29.1	Very low	27	Very low	99 Å²	99	129.3 Å²	129.3	61%	0.607	73%	0.733	S	S	*	*			trans	5.1	139.5	146.9	65.3	0	0	0	0	121.2
94	I	27.5	Very low	27.4	Very low	148 Å²	148	132.5 Å²	132.5	76%	0.759	73%	0.733	S	S	*	*				178.5	114.1	103.8	-92.8	154.3	0	0	0	107.2
95	L	25.4	Very low	27.8	Very low	160 Å²	160	133.3 Å²	133.3	84%	0.838	72%	0.721	S	S	*	*				65.6	119.4	74.1	-80.7	172.3	0	0	0	114.9
96	G	24	Very low	27.9	Very low	62 Å²	62	135.6 Å²	135.6	64%	0.639	72%	0.722	S	S	*	*			trans	134.5	119.1	137.7	0	0	0	0	0	119
97	L	24.6	Very low	27.8	Very low	158 Å²	158	136.5 Å²	136.5	83%	0.827	72%	0.718	S	S	*	*			trans	75.9	149.3	130.3	-67.6	161.5	0	0	0	121.3
98	H	26.3	Very low	27.8	Very low	150 Å²	150	134.1 Å²	134.1	69%	0.694	71%	0.711	S	S	*	*			trans	64.6	121.4	166.3	-76.1	95.3	0	0	0	117
99	N	24.5	Very low	27.9	Very low	139 Å²	139	138.1 Å²	138.1	74%	0.743	72%	0.718	S	S	*	*			cis	67	136.2	25.3	-158.8	21.9	0	0	0	113.9
100	M	24.8	Very low	27.3	Very low	153 Å²	153	139 Å²	139	75%	0.754	72%	0.717	S	S	*	*			trans	68	150.6	-165.6	-46.1	-179	74	0	0	112.2
101	I	32.7	Very low	27.3	Very low	163 Å²	163	135.2 Å²	135.2	84%	0.836	71%	0.708	S	S	*	*			cis	-103.8	133.2	10.2	-66.3	172	0	0	0	111.8
102	N	24.6	Very low	27.2	Very low	149 Å²	149	138.9 Å²	138.9	80%	0.797	73%	0.727	S	S	*	*			trans	-110.2	149.2	169.2	-172	15.1	0	0	0	107.7
103	A	25.6	Very low	26.9	Very low	78 Å²	78	136.1 Å²	136.1	65%	0.645	73%	0.727	S	S	*	*			trans	57.8	130.2	173.5	0	0	0	0	0	118.6
104	E	30.7	Very low	26.7	Very low	156 Å²	156	134.5 Å²	134.5	73%	0.729	73%	0.73	S	S	*	*				-166.4	147.3	105.1	-74.7	-141.8	160.9	0	0	106.9
105	K	33.7	Very low	26.8	Very low	136 Å²	136	132.7 Å²	132.7	59%	0.591	73%	0.73	S	S	*	*			cis	-146	126.3	-13.8	-112.1	176.4	-175.3	131.8	0	106.5
106	E	29.3	Very low	26.9	Very low	144 Å²	144	131.6 Å²	131.6	67%	0.673	72%	0.72	S	S	*	*				68.8	118.9	99.6	-75	-157.2	93.9	0	0	116.6
107	N	24.8	Very low	26.9	Very low	122 Å²	122	135.6 Å²	135.6	65%	0.652	73%	0.727	S	S	*	*				56.3	101.5	124.7	-57.9	-33.5	0	0	0	117.9
108	V	25.9	Very low	26.9	Very low	105 Å²	105	135.7 Å²	135.7	64%	0.636	72%	0.721	S	S	*	*				73.6	112.2	80	169.1	0	0	0	0	112.1	N110	V108-N110 HydrophobicContact CG1-CB 4.43Å
109	F	25.9	Very low	26.8	Very low	207 Å²	207	133.2 Å²	133.2	91%	0.908	72%	0.72	S	S	*	*			trans	-125	88.4	144.7	-146.9	-90.8	0	0	0	109.3
110	N	23.5	Very low	26.8	Very low	121 Å²	121	135.8 Å²	135.8	65%	0.647	72%	0.72	S	S	*	*			trans	-62.1	145	158.2	-75	-49.8	0	0	0	108.4	V108	V108-N110 HydrophobicContact CG1-CB 4.43Å
111	S	28.2	Very low	26.7	Very low	81 Å²	81	134.3 Å²	134.3	57%	0.566	72%	0.719	S	S	*	*				161.3	114.7	119.3	-74.1	0	0	0	0	112.9
112	L	26.6	Very low	26.3	Very low	183 Å²	183	132.8 Å²	132.8	96%	0.958	71%	0.709	S	S	*	*	S	Bend	trans	-177.3	61.3	142.4	-100.8	161.1	0	0	0	106.2
113	L	27.8	Very low	26.2	Very low	145 Å²	145	136.3 Å²	136.3	76%	0.759	71%	0.711	S	S	*	*			cis	89.9	109.8	48.4	-162.7	171.1	0	0	0	112.1
114	G	24.3	Very low	26.1	Very low	65 Å²	65	143.5 Å²	143.5	67%	0.67	72%	0.722	S	S	*	*			trans	105.2	133.5	164.6	0	0	0	0	0	114.6
115	S	30	Very low	25.7	Very low	110 Å²	110	144.7 Å²	144.7	77%	0.769	72%	0.721	S	S	*	*			cis	-151.6	145.8	-11.8	-74.7	0	0	0	0	107.3
116	H	27.4	Very low	25.2	Very low	137 Å²	137	145.5 Å²	145.5	63%	0.634	73%	0.727	S	S	*	*				53.7	134.6	75.5	-98.5	-97.1	0	0	0	113.8	F118	H116-F118 AromaticContact CE1-CD2 3.86Å; H116-F118 AromaticContact CE1-CG 3.83Å
117	D	24.1	Very low	25.1	Very low	146 Å²	146	145.7 Å²	145.7	78%	0.781	73%	0.727	S	S	*	*			cis	-121.9	166.2	13.6	-66.6	-70.2	0	0	0	113.4
118	F	24.2	Very low	25.4	Very low	160 Å²	160	146.2 Å²	146.2	70%	0.702	73%	0.73	S	S	*	*			cis	104.8	95.2	9.5	-131.4	-93.4	0	0	0	118.6	H116	H116-F118 AromaticContact CE1-CD2 3.86Å; H116-F118 AromaticContact CE1-CG 3.83Å
119	S	24.9	Very low	25.5	Very low	97 Å²	97	144.1 Å²	144.1	68%	0.678	73%	0.73	S	S	*	*			trans	87.3	170.1	136.9	81.2	0	0	0	0	123.9
120	R	23.9	Very low	25.8	Very low	194 Å²	194	138.9 Å²	138.9	73%	0.732	71%	0.708	S	S	*	*			trans	67.7	127.7	176.7	-83.4	-172.9	142.1	112.7	-4	116.5	E122	R120-E122 IonicContact CZ-OE2 3.16Å; R120-E122 IonicContact NE-OE2 2.78Å; R120-E122 PolarHBondContact NE-OE2 2.74Å; R120-E122 IonicContact NH2-OE2 2.69Å; R120-E122 PolarHBondContact NH2-OE2 3.31Å
121	T	23	Very low	26	Very low	121 Å²	121	138.1 Å²	138.1	74%	0.742	71%	0.708	S	S	*	*			cis	58.9	112.4	27	83.1	0	0	0	0	115.9
122	E	23.1	Very low	26.2	Very low	132 Å²	132	139.2 Å²	139.2	62%	0.617	71%	0.705	S	S	*	*				-170.8	168.6	118.6	-107.2	171.5	91.7	0	0	113.7	R120	R120-E122 IonicContact CZ-OE2 3.16Å; R120-E122 IonicContact NE-OE2 2.78Å; R120-E122 PolarHBondContact NE-OE2 2.74Å; R120-E122 IonicContact NH2-OE2 2.69Å; R120-E122 PolarHBondContact NH2-OE2 3.31Å
123	W	24.3	Very low	26.4	Very low	222 Å²	222	137.9 Å²	137.9	84%	0.841	69%	0.694	S	S	*	*			trans	-89.8	154.7	-172.3	-57.6	66.6	0	0	0	112.8
124	R	22.3	Very low	26.5	Very low	230 Å²	230	138.3 Å²	138.3	87%	0.868	69%	0.694	S	S	*	*				-170.5	143	127.6	-90.4	142.3	-148.8	-158.2	6.9	109.3
125	Y	22.4	Very low	26.7	Very low	180 Å²	180	139.7 Å²	139.7	71%	0.706	70%	0.699	S	S	*	*			cis	91.6	114.3	37	-115.9	-93.3	0	0	0	115.2
126	E	24.3	Very low	26.7	Very low	154 Å²	154	141.9 Å²	141.9	72%	0.72	70%	0.701	S	S	*	*			trans	63	164.6	159.2	-80.8	165.1	178.6	0	0	118.9
127	E	26.4	Very low	27.4	Very low	147 Å²	147	140.4 Å²	140.4	69%	0.687	70%	0.704	S	S	*	*			cis	-143.8	-162.7	19.1	-146.8	-163.8	143.2	0	0	114.5
128	N	31.3	Very low	27.4	Very low	133 Å²	133	140.7 Å²	140.7	71%	0.711	71%	0.705	S	S	*	*			trans	-118.5	173.9	-156.3	-57.3	-76.8	0	0	0	116.2
129	G	28.1	Very low	27.6	Very low	61 Å²	61	140.7 Å²	140.7	63%	0.629	71%	0.705	S	S	*	*			trans	151.8	102.3	159.7	0	0	0	0	0	112.8
130	E	31.8	Very low	27.7	Very low	98 Å²	98	144.5 Å²	144.5	46%	0.458	71%	0.712	S	S	.	*				64.1	138.8	75.2	-67.3	-157.9	-152.4	0	0	114.4	Q233 T234	E130-Q233 WeakPolarHBondContact OE1-CG 3.36Å; E130-Q233 WeakPolarHBondContact OE2-CG 2.99Å; E130-Q233 PolarHBondContact OE2-NE2 3.08Å; E130-T234 HydrophobicContact CG-CG2 4.17Å; E130-T234 VanDerWaalsContact OE1-CG2 3.3Å; E130-T234 WeakPolarHBondContact OE1-CG2 3.18Å
131	V	27.5	Very low	27.8	Very low	105 Å²	105	139.1 Å²	139.1	64%	0.636	72%	0.717	S	S	*	*				-158	154.9	57.1	163.6	0	0	0	0	112.7
132	M	32	Very low	28	Very low	104 Å²	104	142.6 Å²	142.6	51%	0.512	72%	0.724	S	S	.	*			trans	-9.8	171.5	154.9	-50.7	-170.6	177.6	0	0	121.3	T232	M132-T232 HydrophobicContact CE-CG2 3.27Å
133	Q	31.4	Very low	28.4	Very low	155 Å²	155	140.7 Å²	140.7	72%	0.724	73%	0.732	S	S	*	*			cis	-164.6	169	32.2	-151.1	152.9	38.1	0	0	116.7
134	M	29.8	Very low	28.6	Very low	154 Å²	154	138.8 Å²	138.8	76%	0.759	73%	0.732	S	S	*	*			trans	-36.9	157.4	174.7	-52.1	180	-66.6	0	0	116.8
135	A	28	Very low	28.9	Very low	94 Å²	94	132 Å²	132	78%	0.777	73%	0.725	S	S	*	*				-175.5	160.6	60.7	0	0	0	0	0	115.5
136	L	30.9	Very low	29.3	Very low	156 Å²	156	131 Å²	131	82%	0.817	73%	0.729	S	S	*	*			trans	-88	158.1	161.1	-63.1	169	0	0	0	109.8
137	P	40.8	Very low	30.5	Very low	106 Å²	106	129.2 Å²	129.2	69%	0.688	73%	0.731	S	S	*	*				-160.7	166.5	89.3	43.1	-23.9	0	0	0	118.8
138	L	25.2	Very low	30.7	Very low	151 Å²	151	128.6 Å²	128.6	79%	0.791	73%	0.728	S	S	*	*			trans	64.7	154.2	150.3	-67.1	156.5	0	0	0	119.7
139	F	27.6	Very low	30.6	Very low	160 Å²	160	131.4 Å²	131.4	70%	0.702	73%	0.728	S	S	*	*			cis	-174.4	153	-33	-136.9	-125.9	0	0	0	109.6
140	E	26.7	Very low	30.6	Very low	178 Å²	178	135 Å²	135	83%	0.832	73%	0.729	S	S	*	*			trans	54.9	151.9	158.7	-75	167.6	176.9	0	0	122.2
141	G	27	Very low	30.4	Very low	81 Å²	81	136.5 Å²	136.5	84%	0.835	74%	0.739	S	S	*	*			trans	153.5	105.4	168.1	0	0	0	0	0	115.6
142	E	27.8	Very low	30.3	Very low	193 Å²	193	136.6 Å²	136.6	90%	0.902	74%	0.74	S	S	*	*			trans	-93.5	156.3	-166.1	-52.4	174.1	107.5	0	0	117.2
143	A	29.9	Very low	30	Very low	93 Å²	93	138.7 Å²	138.7	77%	0.769	75%	0.753	S	S	*	*			trans	81.4	139	132.6	0	0	0	0	0	125.5
144	E	29.3	Very low	29.6	Very low	181 Å²	181	136.5 Å²	136.5	85%	0.846	75%	0.754	S	S	*	*			trans	89.9	147.8	140.6	-85.4	-62.1	149.9	0	0	125.1
145	A	29	Very low	29.6	Very low	89 Å²	89	134.4 Å²	134.4	74%	0.736	76%	0.755	S	S	*	*			trans	73.3	134.6	161.3	0	0	0	0	0	122.9
146	M	31.4	Very low	31	Very low	159 Å²	159	135.3 Å²	135.3	78%	0.783	75%	0.753	S	S	*	*			trans	-93.8	163.7	172.9	-156.8	-143.9	-60.1	0	0	111	Q148	M146-Q148 HydrophobicContact SD-CG 4.34Å; M146-Q148 PolarHBondContact SD-N 2.87Å; M146-Q148 VanDerWaalsContact SD-N 3.45Å
147	P	48.2	Very low	30.8	Very low	116 Å²	116	133.5 Å²	133.5	75%	0.753	75%	0.748	S	S	*	*				-154.6	141.3	94.5	38.5	-19.3	0	0	0	118.4
148	Q	30.3	Very low	30.2	Very low	133 Å²	133	135 Å²	135	62%	0.621	75%	0.749	S	S	*	*			trans	48.9	125.4	131.3	-68.2	-164.8	7.6	0	0	124.5	M146	M146-Q148 HydrophobicContact SD-CG 4.34Å; M146-Q148 PolarHBondContact SD-N 2.87Å; M146-Q148 VanDerWaalsContact SD-N 3.45Å
149	R	30.3	Very low	30.5	Very low	192 Å²	192	136.5 Å²	136.5	73%	0.725	75%	0.745	S	S	*	*				94.2	121.5	120.5	-79.6	177.2	171.1	-165.3	1.7	123.3
150	Q	28.1	Very low	30.7	Very low	137 Å²	137	135.2 Å²	135.2	64%	0.64	74%	0.741	S	S	*	*				94.6	115.5	123.1	-77	-176.9	-84.6	0	0	123.1
151	L	27.4	Very low	30.9	Very low	129 Å²	129	133 Å²	133	68%	0.675	73%	0.731	S	S	*	*				86.4	124.9	124.7	-68.9	176.1	0	0	0	122.7
152	T	25.1	Very low	31.2	Very low	107 Å²	107	136.2 Å²	136.2	66%	0.656	72%	0.724	S	S	*	*				87.5	127.7	127.1	50.3	0	0	0	0	124.2
153	L	26.5	Very low	31.1	Very low	149 Å²	149	133 Å²	133	78%	0.78	72%	0.718	S	S	*	*			trans	73	121.2	131.2	-68.6	166.3	0	0	0	121.2
154	S	22.9	Very low	31.1	Very low	108 Å²	108	134.7 Å²	134.7	76%	0.755	71%	0.714	S	S	*	*				63.8	119.1	129.8	-55.6	0	0	0	0	121.4
155	S	29.5	Very low	31.2	Very low	111 Å²	111	134.4 Å²	134.4	78%	0.776	71%	0.705	S	S	*	*			trans	-57.9	-171.8	155	-22.3	0	0	0	0	113.3
156	P	56.6	Low	31.3	Very low	113 Å²	113	136.4 Å²	136.4	73%	0.734	70%	0.699	S	S	*	*			cis	-142.6	-153.7	-4.1	27	0.8	0	0	0	113.9
157	V	27.8	Very low	31.2	Very low	117 Å²	117	132.7 Å²	132.7	71%	0.709	69%	0.685	S	S	*	*			trans	96.8	135.6	138.7	160.8	0	0	0	0	121.7
158	L	27.6	Very low	30.3	Very low	137 Å²	137	131.6 Å²	131.6	72%	0.717	67%	0.67	S	S	*	*			trans	76.2	151.9	157.8	-81.5	171.1	0	0	0	120.6
159	R	30.7	Very low	30.3	Very low	183 Å²	183	130 Å²	130	69%	0.691	66%	0.662	S	S	*	*			cis	-168.5	137.4	-4.6	-169.5	176.4	-166.3	119.4	7.8	114.6
160	Q	32	Very low	30.2	Very low	134 Å²	134	125.2 Å²	125.2	63%	0.626	65%	0.651	S	S	*	*			trans	52.7	171.9	151.6	-67.3	179.8	-65.2	0	0	119.8
161	Q	31.1	Very low	30	Very low	131 Å²	131	127.5 Å²	127.5	61%	0.612	66%	0.655	S	S	*	*			cis	-152.8	167.6	1.9	-138.7	156.2	-42.7	0	0	113
162	Q	32.8	Very low	30	Very low	149 Å²	149	127 Å²	127	70%	0.696	66%	0.657	S	S	*	*			trans	7	144.9	147.7	-68.8	168.5	-53.7	0	0	119.1
163	T	26.7	Very low	29.9	Very low	126 Å²	126	126 Å²	126	77%	0.773	65%	0.65	S	S	*	*			cis	-175.3	177.7	26.8	-1.4	0	0	0	0	108.4
164	D	29.2	Very low	29.8	Very low	128 Å²	128	127.8 Å²	127.8	68%	0.684	65%	0.652	S	S	*	*			cis	-162	173.8	-3.7	-170.5	18.8	0	0	0	109.9
165	R	32.2	Very low	30	Very low	175 Å²	175	128.7 Å²	128.7	66%	0.66	65%	0.649	S	S	*	*			trans	41.5	119.3	149.9	-85.3	176.1	66.7	157.2	4.7	123
166	Q	32	Very low	29.8	Very low	131 Å²	131	130.1 Å²	130.1	61%	0.612	65%	0.653	S	S	*	*				68.4	158.7	123.3	-61.1	175.6	-10.5	0	0	122.8
167	T	28.2	Very low	28.3	Very low	80 Å²	80	129.5 Å²	129.5	49%	0.491	66%	0.657	S	S	.	*			cis	-163.2	156.5	-23	32.7	0	0	0	0	111.8	Y272	T167-Y272 HydrophobicContact CG2-CD1 3.32Å; T167-Y272 HydrophobicContact CG2-CE1 3.81Å; T167-Y272 HydrophobicContact CG2-CG 4.34Å
168	Q	30	Very low	28.2	Very low	93 Å²	93	133.4 Å²	133.4	44%	0.435	66%	0.659	S	S	.	*			cis	130.2	116.7	-18.4	-175.5	-178.4	6.1	0	0	114.9	Y272 G273 D274	Q168-Y272 WeakPolarHBondContact O-CB 3.45Å; Q168-Y272 WeakPolarHBondContact O-CD2 3.5Å; Q168-G273 VanDerWaalsContact CG-CA 3.4Å; Q168-G273 WeakPolarHBondContact CG-O 3.35Å; Q168-G273 PolarHBondContact NE2-O 3.27Å; Q168-D274 WeakPolarHBondContact CA-O 3.39Å
169	E	29.6	Very low	28	Very low	99 Å²	99	135.4 Å²	135.4	46%	0.463	67%	0.665	S	S	.	*			trans	165.1	121.9	160.8	-175.6	156	-98.8	0	0	121.5	Y272 G273	E169-Y272 HydrophobicContact CB-CD2 3.65Å; E169-Y272 HydrophobicContact CB-CE2 4.36Å; E169-Y272 HydrophobicContact CB-CG 4.27Å; E169-Y272 VanDerWaalsContact CD-CD2 3.43Å; E169-Y272 HydrophobicContact CG-CD2 4.12Å; E169-Y272 WeakPolarHBondContact OE1-CA 2.98Å; E169-Y272 WeakPolarHBondContact OE1-CD2 3.22Å; E169-Y272 PolarHBondContact OE1-N 2.69Å; E169-Y272 WeakPolarHBondContact OE2-CD2 3.3Å; E169-G273 VanDerWaalsContact CA-CA 3.49Å
170	L	28.2	Very low	27.8	Very low	92 Å²	92	132 Å²	132	48%	0.482	66%	0.66	S	S	.	*			trans	47.7	170	138.7	-66.8	166.3	0	0	0	123.1	D274	L170-D274 PolarHBondContact N-OD2 2.78Å
171	Y	25.1	Very low	27.4	Very low	185 Å²	185	129.6 Å²	129.6	73%	0.725	67%	0.672	S	S	*	*			cis	-148.1	123.5	14.1	-148.9	-78.8	0	0	0	116.5	V173	Y171-V173 HydrophobicContact CD1-CG2 4.26Å
172	V	25.7	Very low	27.1	Very low	118 Å²	118	127.9 Å²	127.9	72%	0.715	68%	0.68	S	S	*	*			trans	30.9	-147.7	154.4	-149.8	0	0	0	0	118
173	V	24	Very low	26.9	Very low	86 Å²	86	126.7 Å²	126.7	52%	0.521	68%	0.683	S	S	.	*			cis	-142.7	140.2	2.5	178.5	0	0	0	0	108.2	Y171	Y171-V173 HydrophobicContact CD1-CG2 4.26Å
174	F	24.5	Very low	26.8	Very low	187 Å²	187	127.6 Å²	127.6	82%	0.82	69%	0.688	S	S	*	*				170.4	146.8	108.5	-98.5	-96.6	0	0	0	107.5
175	N	26.2	Very low	26.7	Very low	127 Å²	127	125.1 Å²	125.1	68%	0.679	69%	0.686	S	S	*	*			cis	-162.7	169.1	-20.4	-124.5	17.6	0	0	0	110.1
176	T	25.4	Very low	26.5	Very low	142 Å²	142	123 Å²	123	87%	0.871	70%	0.698	S	S	*	*			trans	-139	137.5	178.1	47.8	0	0	0	0	114.7
177	A	24.9	Very low	26.2	Very low	99 Å²	99	124.4 Å²	124.4	82%	0.818	70%	0.697	S	S	*	*			trans	-163.3	132.4	155.2	0	0	0	0	0	107.1
178	R	26.6	Very low	26.1	Very low	200 Å²	200	126.8 Å²	126.8	76%	0.755	71%	0.707	S	S	*	*			cis	94.7	113.3	23.8	-174.6	-178.6	174.6	-179.8	-0.7	114.2	D180	R178-D180 IonicContact CZ-OD2 2.81Å; R178-D180 IonicContact NE-OD2 2.69Å; R178-D180 PolarHBondContact NE-OD2 3.35Å; R178-D180 IonicContact NH2-OD1 3.12Å; R178-D180 PolarHBondContact NH2-OD1 2.93Å; R178-D180 IonicContact NH2-OD2 3.82Å; R178-D180 PolarHBondContact NH2-OD2 3.19Å
179	E	23.8	Very low	25.7	Very low	178 Å²	178	133.2 Å²	133.2	83%	0.832	73%	0.727	S	S	*	*				-161	118.8	121.4	-74	-137.2	132.1	0	0	105.8
180	D	24.7	Very low	25.5	Very low	112 Å²	112	133.4 Å²	133.4	60%	0.599	75%	0.746	S	S	*	*				74.9	124	83.1	-75.5	-68.2	0	0	0	115.4	R178	R178-D180 IonicContact CZ-OD2 2.81Å; R178-D180 IonicContact NE-OD2 2.69Å; R178-D180 PolarHBondContact NE-OD2 3.35Å; R178-D180 IonicContact NH2-OD1 3.12Å; R178-D180 PolarHBondContact NH2-OD1 2.93Å; R178-D180 IonicContact NH2-OD2 3.82Å; R178-D180 PolarHBondContact NH2-OD2 3.19Å
181	G	25	Very low	25.4	Very low	84 Å²	84	137.5 Å²	137.5	87%	0.866	77%	0.768	S	S	*	*			trans	168.8	98	-176.1	0	0	0	0	0	114.6
182	A	24.7	Very low	25.4	Very low	94 Å²	94	131.9 Å²	131.9	78%	0.777	77%	0.766	S	S	*	*			trans	-85.2	147.7	-160.8	0	0	0	0	0	117.9
183	V	27.5	Very low	25.3	Very low	125 Å²	125	132.2 Å²	132.2	76%	0.758	77%	0.774	S	S	*	*			trans	65.8	109.9	133.9	170.9	0	0	0	0	120.7
184	T	26.1	Very low	25.6	Very low	145 Å²	145	138 Å²	138	89%	0.89	79%	0.793	S	S	*	*				-179.9	159.1	110.8	29.1	0	0	0	0	112
185	A	27.1	Very low	25.6	Very low	76 Å²	76	135.6 Å²	135.6	63%	0.628	79%	0.788	S	S	*	*			trans	-132.4	142.9	172.7	0	0	0	0	0	111.9
186	S	26.7	Very low	25.9	Very low	131 Å²	131	134.5 Å²	134.5	92%	0.916	79%	0.791	S	S	*	*			trans	-146.6	161.5	169.7	-95.3	0	0	0	0	113.2
187	R	25.5	Very low	25.9	Very low	160 Å²	160	131.9 Å²	131.9	60%	0.604	79%	0.792	S	S	*	*			trans	-120.3	164.4	-162.4	-116.7	-175.9	-173.6	168	-1.1	111.6
188	N	25.9	Very low	25.9	Very low	129 Å²	129	130.7 Å²	130.7	69%	0.69	79%	0.789	S	S	*	*			trans	87	113.8	152	-64.3	-15.1	0	0	0	121.7
189	R	23.5	Very low	25.9	Very low	229 Å²	229	130.5 Å²	130.5	86%	0.864	79%	0.793	S	S	*	*				52.2	97.9	121.8	-61.7	-176.9	177.4	179.2	-0.1	119.3
190	A	24.9	Very low	26.1	Very low	103 Å²	103	127.4 Å²	127.4	85%	0.851	79%	0.787	S	S	*	*				30.7	121.3	117.7	0	0	0	0	0	120.3
191	D	25	Very low	26.2	Very low	177 Å²	177	131.8 Å²	131.8	95%	0.947	80%	0.8	S	S	*	*				-133.6	164.1	119.7	-156.6	-6.5	0	0	0	109
192	G	24.8	Very low	26.2	Very low	67 Å²	67	130.9 Å²	130.9	69%	0.691	79%	0.791	S	S	*	*			trans	-106.5	152.3	-160.5	0	0	0	0	0	117
193	S	25.4	Very low	26.4	Very low	126 Å²	126	134.8 Å²	134.8	88%	0.881	79%	0.79	S	S	*	*			trans	-149.9	138.8	154.3	-163.7	0	0	0	0	109.4
194	F	29	Very low	26.2	Very low	207 Å²	207	135.7 Å²	135.7	91%	0.908	79%	0.786	S	S	*	*			trans	-128.5	139.7	-177.4	-102.2	-83.6	0	0	0	109.3
195	D	25.7	Very low	26.2	Very low	136 Å²	136	132.3 Å²	132.3	73%	0.727	77%	0.774	S	S	*	*			trans	-149.7	148.1	145.5	-144	-29.5	0	0	0	112.1
196	S	31.1	Very low	26.2	Very low	105 Å²	105	138 Å²	138	73%	0.734	79%	0.787	S	S	*	*			trans	29.2	120.4	161.5	18.3	0	0	0	0	123.9
197	G	25.4	Very low	26.3	Very low	87 Å²	87	134.6 Å²	134.6	90%	0.897	77%	0.773	S	S	*	*			trans	94.5	127.3	136	0	0	0	0	0	118.9
198	G	25.1	Very low	26.4	Very low	73 Å²	73	133.8 Å²	133.8	75%	0.753	79%	0.79	S	S	*	*			cis	157.3	152.8	-17.3	0	0	0	0	0	115.4
199	K	27.2	Very low	26.5	Very low	196 Å²	196	130.9 Å²	130.9	85%	0.852	79%	0.791	S	S	*	*			trans	68.7	140.8	173.2	-114	-174.3	177.7	-175.9	0	113.8
200	V	27.5	Very low	26.6	Very low	114 Å²	114	125.8 Å²	125.8	69%	0.691	79%	0.79	S	S	*	*			cis	-143.6	177.1	27.5	174.1	0	0	0	0	112.3
201	K	26.2	Very low	26.5	Very low	203 Å²	203	128.5 Å²	128.5	88%	0.883	79%	0.787	S	S	*	*			trans	-30.7	159.1	173.5	-55.5	163.8	178.8	177	0	117.8
202	G	25.9	Very low	26.6	Very low	65 Å²	65	127.8 Å²	127.8	67%	0.67	78%	0.778	S	S	*	*			cis	140.7	174.4	-4.1	0	0	0	0	0	114.6
203	K	28	Very low	26.8	Very low	176 Å²	176	128.6 Å²	128.6	77%	0.765	78%	0.779	S	S	*	*			trans	72.9	147.9	174.7	-74.4	-173.3	166.9	-78.3	0	116.2
204	E	24.6	Very low	26.7	Very low	144 Å²	144	125.9 Å²	125.9	67%	0.673	77%	0.77	S	S	*	*			cis	-161.1	-160.9	-17.6	-139.7	143.6	-137	0	0	112
205	A	25.5	Very low	26.6	Very low	75 Å²	75	122.2 Å²	122.2	62%	0.62	77%	0.77	S	S	*	*			trans	79.1	146.4	158.8	0	0	0	0	0	121.5
206	E	28	Very low	26.6	Very low	194 Å²	194	119.7 Å²	119.7	91%	0.907	78%	0.777	S	S	*	*			cis	-172.8	173.3	-26.2	-103.2	-107.6	131.4	0	0	111.1
207	G	29	Very low	26.4	Very low	60 Å²	60	117.8 Å²	117.8	62%	0.619	77%	0.773	S	S	*	*			trans	97.2	151.2	163.1	0	0	0	0	0	116.2
208	C	27.8	Very low	26.4	Very low	143 Å²	143	121 Å²	121	97%	0.966	78%	0.775	S	S	*	*			cis	-157.3	169.2	-7.2	-149	0	0	0	0	107.6
209	G	26.6	Very low	26.4	Very low	69 Å²	69	121.2 Å²	121.2	71%	0.711	77%	0.77	S	S	*	*			cis	-176	-174.5	4.4	0	0	0	0	0	110.3
210	S	25.3	Very low	26.2	Very low	122 Å²	122	121.2 Å²	121.2	85%	0.853	77%	0.77	S	S	*	*			trans	-139.1	168	-178.2	-165.9	0	0	0	0	113.1
211	M	23.3	Very low	26	Very low	159 Å²	159	119.7 Å²	119.7	78%	0.783	76%	0.764	S	S	*	*			trans	-154.2	159	-173.8	-72.1	175.7	144.1	0	0	109.2
212	E	27.5	Very low	25.9	Very low	162 Å²	162	117 Å²	117	76%	0.757	76%	0.755	S	S	*	*			cis	-169.4	161.1	-19.1	-101.7	-162.4	75.8	0	0	106.2
213	A	28	Very low	25.9	Very low	85 Å²	85	120.2 Å²	120.2	70%	0.702	76%	0.756	S	S	*	*			cis	-165.1	164.4	-15.2	0	0	0	0	0	109.9
214	G	25.1	Very low	25.9	Very low	68 Å²	68	116.4 Å²	116.4	70%	0.701	76%	0.758	S	S	*	*			trans	98.4	170.6	154.1	0	0	0	0	0	118.2
215	S	26.9	Very low	26.1	Very low	130 Å²	130	116.4 Å²	116.4	91%	0.909	76%	0.762	S	S	*	*			cis	-167.6	139.2	-13.5	-116.5	0	0	0	0	113.5
216	G	25.2	Very low	26.3	Very low	84 Å²	84	118.8 Å²	118.8	87%	0.866	76%	0.763	S	S	*	*			trans	84.7	143.2	162.8	0	0	0	0	0	117
217	G	26.1	Very low	26.3	Very low	64 Å²	64	116 Å²	116	66%	0.66	75%	0.754	S	S	*	*			cis	153	151.7	-14.9	0	0	0	0	0	115.4
218	V	25.1	Very low	26.2	Very low	154 Å²	154	117.9 Å²	117.9	93%	0.933	76%	0.757	S	S	*	*			trans	55.5	137.7	158.4	-80.9	0	0	0	0	119.5
219	A	25.1	Very low	26.2	Very low	78 Å²	78	116.8 Å²	116.8	65%	0.645	75%	0.75	S	S	*	*			cis	-159.9	-161.4	-5.2	0	0	0	0	0	108.9
220	F	23.8	Very low	27.4	Very low	197 Å²	197	118.6 Å²	118.6	86%	0.864	75%	0.749	S	S	*	*			cis	-161.4	-168.7	6.1	-133.8	-20.7	0	0	0	112.5
221	C	23.6	Very low	27.4	Very low	82 Å²	82	118.8 Å²	118.8	55%	0.554	74%	0.741	S	S	*	*			trans	-2.1	151.5	154.1	-63.4	0	0	0	0	122.4
222	E	24.6	Very low	27.9	Very low	147 Å²	147	114.6 Å²	114.6	69%	0.687	72%	0.724	S	S	*	*			cis	-170.8	156.4	-14.5	-122.3	175.9	107.6	0	0	112.7
223	N	25.1	Very low	28.2	Very low	132 Å²	132	111.9 Å²	111.9	71%	0.706	71%	0.711	S	S	*	*			trans	62.6	134.6	150.8	-57.4	-32.5	0	0	0	124.3
224	A	27.2	Very low	28.2	Very low	96 Å²	96	110.9 Å²	110.9	79%	0.793	70%	0.697	S	S	*	*			trans	48.2	122.8	155.7	0	0	0	0	0	120.5
225	D	28.8	Very low	29.4	Very low	143 Å²	143	111.4 Å²	111.4	77%	0.765	69%	0.688	S	S	*	*				71.4	139.5	52.1	-151.8	34.9	0	0	0	112
226	I	29.9	Very low	29.8	Very low	125 Å²	125	113.3 Å²	113.3	64%	0.641	68%	0.68	S	S	*	*			cis	-158.4	177.4	35.9	-20.8	175.6	0	0	0	112
227	L	27.3	Very low	30	Very low	137 Å²	137	120.2 Å²	120.2	72%	0.717	68%	0.679	S	S	*	*			trans	93.1	158.5	160.7	-59.8	162.5	0	0	0	119.7
228	S	27.6	Very low	30.3	Very low	98 Å²	98	121.6 Å²	121.6	69%	0.685	69%	0.685	S	S	*	*			cis	156.1	168.8	-38.6	-85.6	0	0	0	0	113
229	C	28.6	Very low	30.6	Very low	120 Å²	120	122.4 Å²	122.4	81%	0.811	68%	0.678	S	S	*	*			trans	83.3	166.1	155.4	-69.9	0	0	0	0	119.8
230	P	51.8	Low	31	Very low	107 Å²	107	126.7 Å²	126.7	70%	0.695	69%	0.685	S	S	*	*			cis	-113.4	-156.6	3.6	46.6	-36.2	0	0	0	113.6
231	D	24.2	Very low	31.1	Very low	127 Å²	127	124.4 Å²	124.4	68%	0.679	69%	0.687	S	S	*	*			cis	-144.3	165.3	5.7	-100.2	-45.2	0	0	0	109
232	T	34.4	Very low	31.4	Very low	71 Å²	71	129.9 Å²	129.9	44%	0.436	70%	0.701	S	S	.	*			cis	89.1	144.7	29.8	90.9	0	0	0	0	117	M132	M132-T232 HydrophobicContact CE-CG2 3.27Å
233	Q	34	Very low	31.5	Very low	105 Å²	105	127.8 Å²	127.8	49%	0.491	70%	0.703	S	S	.	*			cis	-159.4	107.5	-12.5	-121.1	178.5	14.8	0	0	116.8	E130	E130-Q233 WeakPolarHBondContact OE1-CG 3.36Å; E130-Q233 WeakPolarHBondContact OE2-CG 2.99Å; E130-Q233 PolarHBondContact OE2-NE2 3.08Å
234	T	28.1	Very low	31.6	Very low	64 Å²	64	128.8 Å²	128.8	39%	0.393	71%	0.708	S	S	.	*			trans	56.3	-156.5	130.8	74.4	0	0	0	0	120.9	E130	E130-T234 HydrophobicContact CG-CG2 4.17Å; E130-T234 VanDerWaalsContact OE1-CG2 3.3Å; E130-T234 WeakPolarHBondContact OE1-CG2 3.18Å
235	P	50.5	Low	31.6	Very low	79 Å²	79	131.5 Å²	131.5	51%	0.513	71%	0.708	S	S	.	*			cis	-143.9	175.6	-29.1	37	-17.9	0	0	0	119.3
236	K	34.8	Very low	31.4	Very low	170 Å²	170	130.1 Å²	130.1	74%	0.739	71%	0.705	S	S	*	*			trans	80.7	155.5	132.9	-89.3	155.5	-150.4	150.6	0	121.6
237	R	30.3	Very low	31.2	Very low	228 Å²	228	130.8 Å²	130.8	86%	0.86	71%	0.71	S	S	*	*			cis	-168.8	168.2	-2	-153.8	-179.3	177.4	152.1	1.4	114.3
238	A	30.7	Very low	31.1	Very low	94 Å²	94	131 Å²	131	78%	0.777	71%	0.711	S	S	*	*			trans	105.3	158.4	134.2	0	0	0	0	0	122
239	E	32	Very low	31.9	Very low	170 Å²	170	131.9 Å²	131.9	79%	0.794	72%	0.715	S	S	*	*			trans	-128.3	167.8	-150	-49.7	164.4	139.2	0	0	116.5
240	H	34.4	Very low	31.9	Very low	169 Å²	169	130 Å²	130	78%	0.782	71%	0.708	S	S	*	*			trans	61.3	127	147	-73.8	-55.1	0	0	0	124.4
241	V	26.2	Very low	30.7	Very low	149 Å²	149	131.2 Å²	131.2	90%	0.903	71%	0.713	S	S	*	*				-177.1	170.9	125.3	145.6	0	0	0	0	109.7
242	F	29.7	Very low	30.9	Very low	197 Å²	197	131.9 Å²	131.9	86%	0.864	72%	0.716	S	S	*	*			trans	-130.8	153.6	-161.9	-141.3	-88.8	0	0	0	114.6
243	S	26.9	Very low	30.5	Very low	102 Å²	102	133.5 Å²	133.5	71%	0.713	73%	0.73	S	S	*	*			trans	122	142.9	147.7	-56.7	0	0	0	0	120.7
244	L	25.7	Very low	30.2	Very low	154 Å²	154	132.2 Å²	132.2	81%	0.806	74%	0.737	S	S	*	*			trans	81.5	115.2	158.6	-68	169.9	0	0	0	122
245	L	28	Very low	30.2	Very low	152 Å²	152	138 Å²	138	80%	0.796	76%	0.757	S	S	*	*				23.1	149.7	128.9	-63.8	174.2	0	0	0	120.9
246	T	24.8	Very low	28.9	Very low	114 Å²	114	139.7 Å²	139.7	70%	0.699	77%	0.766	S	S	*	*			cis	-115.9	-147.7	11.3	48.7	0	0	0	0	111.3
247	D	25.1	Very low	28.4	Very low	140 Å²	140	136.3 Å²	136.3	75%	0.749	77%	0.77	S	S	*	*			cis	-158.9	-167.3	2.7	-137.1	-52.3	0	0	0	113.2
248	N	24.6	Very low	28.2	Very low	140 Å²	140	129.3 Å²	129.3	75%	0.749	76%	0.761	S	S	*	*			trans	-131.5	-177.9	176.1	-124.7	-41.8	0	0	0	109.7
249	P	45.2	Very low	28	Very low	117 Å²	117	131.3 Å²	131.3	76%	0.76	76%	0.759	S	S	*	*			cis	-142.8	-171.7	34.4	44	-23.7	0	0	0	117.3
250	A	28.4	Very low	27.6	Very low	81 Å²	81	130.2 Å²	130.2	67%	0.669	75%	0.753	S	S	*	*			trans	85.5	100.9	162.4	0	0	0	0	0	116.7
251	V	27.8	Very low	27.2	Very low	132 Å²	132	129.6 Å²	129.6	80%	0.8	75%	0.75	S	S	*	*				85.3	121.7	77.6	154.8	0	0	0	0	111.1
252	L	28.1	Very low	27.1	Very low	142 Å²	142	128 Å²	128	74%	0.743	74%	0.741	S	S	*	*			cis	-155.7	151.9	5.8	-116.1	170.8	0	0	0	110.8
253	S	25	Very low	26.8	Very low	105 Å²	105	124 Å²	124	73%	0.734	73%	0.732	S	S	*	*			trans	48.5	149.5	140	-79.1	0	0	0	0	123.2
254	A	28.5	Very low	26.7	Very low	77 Å²	77	127.2 Å²	127.2	64%	0.636	74%	0.736	S	S	*	*			cis	-171.5	158	-7.4	0	0	0	0	0	112.7
255	K	27.6	Very low	26.7	Very low	185 Å²	185	126.3 Å²	126.3	80%	0.804	73%	0.732	S	S	*	*			trans	56.3	115.7	141.3	-70.6	-170.2	173.2	-169.6	0	118.7
256	T	23.4	Very low	26.5	Very low	115 Å²	115	124.4 Å²	124.4	71%	0.706	73%	0.727	S	S	*	*				52.3	110.2	77.3	72.2	0	0	0	0	112.4
257	A	24.5	Very low	26.5	Very low	99 Å²	99	124.6 Å²	124.6	82%	0.818	73%	0.727	S	S	*	*			cis	71.7	164.1	49.9	0	0	0	0	0	114.5
258	A	26.3	Very low	26.4	Very low	81 Å²	81	124.7 Å²	124.7	67%	0.669	73%	0.727	S	S	*	*			trans	87.7	156.1	165	0	0	0	0	0	118.6
259	D	24.8	Very low	26.6	Very low	137 Å²	137	123.9 Å²	123.9	73%	0.733	73%	0.727	S	S	*	*			trans	78.1	136.7	156.2	-53.6	-29	0	0	0	122.1
260	H	24.5	Very low	25.9	Very low	146 Å²	146	122.3 Å²	122.3	68%	0.676	71%	0.713	S	S	*	*			cis	177.4	176.7	-36.5	-122.6	-105.7	0	0	0	107
261	H	25.4	Very low	26	Very low	156 Å²	156	125.2 Å²	125.2	72%	0.722	71%	0.71	S	S	*	*			trans	72.1	148.6	155.8	-60.3	-47.7	0	0	0	117.3
262	T	24	Very low	26.3	Very low	115 Å²	115	123.9 Å²	123.9	71%	0.706	69%	0.691	S	S	*	*			cis	-165.9	176.8	-6.2	19.9	0	0	0	0	110.7
263	V	24.2	Very low	26.4	Very low	113 Å²	113	118.5 Å²	118.5	69%	0.685	67%	0.671	S	S	*	*			trans	91	110	156.2	-169.5	0	0	0	0	117.2
264	E	25.5	Very low	26.8	Very low	171 Å²	171	117.7 Å²	117.7	80%	0.799	66%	0.658	S	S	*	*				40.6	153.2	127.3	-48.8	166.8	166.6	0	0	120.1
265	D	24	Very low	26.8	Very low	135 Å²	135	122.9 Å²	122.9	72%	0.722	67%	0.666	S	S	*	*			cis	-160.1	154.2	18.5	-155	16.3	0	0	0	115.7
266	V	25	Very low	26.6	Very low	112 Å²	112	122 Å²	122	68%	0.679	67%	0.669	S	S	*	*			trans	57.4	161.2	143.8	150.7	0	0	0	0	124.4
267	V	23.7	Very low	26.7	Very low	117 Å²	117	122.6 Å²	122.6	71%	0.709	68%	0.677	S	S	*	*			trans	83.3	94.5	176	-164.7	0	0	0	0	116
268	L	23.8	Very low	26.7	Very low	142 Å²	142	121.2 Å²	121.2	74%	0.743	67%	0.672	S	S	*	*				58.8	120.1	74.3	-60.2	166	0	0	0	113.4
269	T	29.5	Very low	26.6	Very low	123 Å²	123	125.7 Å²	125.7	76%	0.755	68%	0.679	S	S	*	*			cis	-147.9	135.3	28.2	50	0	0	0	0	111.2
270	N	29.5	Very low	26.6	Very low	85 Å²	85	125.8 Å²	125.8	46%	0.455	68%	0.678	S	S	.	*				69.1	123.5	62.9	-144.1	-30.4	0	0	0	110.6
271	K	31.4	Very low	26.5	Very low	142 Å²	142	124.1 Å²	124.1	62%	0.617	68%	0.682	S	S	*	*			cis	-155.5	132.9	21.7	-7.3	-168.4	147.3	-91.1	0	115.2
272	Y	34.5	Very low	26.5	Very low	103 Å²	103	122.4 Å²	122.4	40%	0.404	68%	0.683	S	S	.	*			trans	73.5	152.8	131.9	-46.1	161.6	0	0	0	119.6	T167 Q168 E169	T167-Y272 HydrophobicContact CG2-CD1 3.32Å; T167-Y272 HydrophobicContact CG2-CE1 3.81Å; T167-Y272 HydrophobicContact CG2-CG 4.34Å; Q168-Y272 WeakPolarHBondContact O-CB 3.45Å; Q168-Y272 WeakPolarHBondContact O-CD2 3.5Å; E169-Y272 HydrophobicContact CB-CD2 3.65Å; E169-Y272 HydrophobicContact CB-CE2 4.36Å; E169-Y272 HydrophobicContact CB-CG 4.27Å; E169-Y272 VanDerWaalsContact CD-CD2 3.43Å; E169-Y272 HydrophobicContact CG-CD2 4.12Å; E169-Y272 WeakPolarHBondContact OE1-CA 2.98Å; E169-Y272 WeakPolarHBondContact OE1-CD2 3.22Å; E169-Y272 PolarHBondContact OE1-N 2.69Å; E169-Y272 WeakPolarHBondContact OE2-CD2 3.3Å
273	G	30	Very low	26.5	Very low	30 Å²	30	125.2 Å²	125.2	31%	0.309	69%	0.688	S	S	.	*			cis	153.4	-165.8	-9.7	0	0	0	0	0	116.2	Q168 E169	Q168-G273 VanDerWaalsContact CG-CA 3.4Å; Q168-G273 WeakPolarHBondContact CG-O 3.35Å; Q168-G273 PolarHBondContact NE2-O 3.27Å; E169-G273 VanDerWaalsContact CA-CA 3.49Å
274	D	31.8	Very low	26.5	Very low	87 Å²	87	127.6 Å²	127.6	47%	0.465	70%	0.697	S	S	.	*			trans	-126.3	165.7	-165.5	-28.9	-106.2	0	0	0	118.6	Q168 L170	Q168-D274 WeakPolarHBondContact CA-O 3.39Å; L170-D274 PolarHBondContact N-OD2 2.78Å
275	K	29.2	Very low	26.6	Very low	187 Å²	187	122.6 Å²	122.6	81%	0.813	69%	0.691	S	S	*	*				167.3	145.5	121.1	-94.5	175.8	-178.4	175.6	0	119.4
276	L	24.6	Very low	26.8	Very low	165 Å²	165	124.1 Å²	124.1	86%	0.864	70%	0.7	S	S	*	*			trans	74.5	160.7	145.5	-103.2	81.6	0	0	0	125.8
277	C	24.5	Very low	26.9	Very low	128 Å²	128	125 Å²	125	87%	0.865	70%	0.7	S	S	*	*			trans	-88.1	164.7	-174	178.9	0	0	0	0	113.9
278	G	24.3	Very low	27.1	Very low	71 Å²	71	129 Å²	129	73%	0.732	70%	0.702	S	S	*	*			trans	-178.2	151.2	166.5	0	0	0	0	0	114.2
279	Q	25.3	Very low	27.2	Very low	174 Å²	174	128.6 Å²	128.6	81%	0.813	70%	0.701	S	S	*	*			trans	-148	122.2	-174.8	-176.7	176.3	-8.7	0	0	113.2
280	I	23.5	Very low	27	Very low	139 Å²	139	129 Å²	129	71%	0.713	70%	0.698	S	S	*	*			trans	70.9	115.8	151.8	-68.1	174.4	0	0	0	121.1
281	C	22.8	Very low	26.8	Very low	111 Å²	111	136 Å²	136	75%	0.75	72%	0.718	S	S	*	*			trans	78.6	155.4	142.7	-76.8	0	0	0	0	125.7
282	T	25.1	Very low	26.4	Very low	120 Å²	120	132.9 Å²	132.9	74%	0.736	73%	0.726	S	S	*	*			trans	62.1	151	169	69.4	0	0	0	0	118.9
283	E	24	Very low	26.3	Very low	174 Å²	174	139.4 Å²	139.4	81%	0.813	75%	0.75	S	S	*	*			cis	-154.3	-173.8	-2.8	36.2	-142.5	100.2	0	0	113.3
284	N	25.2	Very low	26.7	Very low	163 Å²	163	142.5 Å²	142.5	87%	0.872	76%	0.764	S	S	*	*			trans	-77.6	160.9	-160.6	-54.7	-43.6	0	0	0	118.7
285	G	26.7	Very low	26.4	Very low	67 Å²	67	144.8 Å²	144.8	69%	0.691	78%	0.776	S	S	*	*			trans	86.3	163.1	141.7	0	0	0	0	0	117.6
286	D	29.2	Very low	26.4	Very low	167 Å²	167	142.6 Å²	142.6	89%	0.893	77%	0.768	S	S	*	*			cis	-173.9	140.7	-13.5	-119.2	-34.2	0	0	0	108.2
287	D	26.7	Very low	26.3	Very low	129 Å²	129	141.4 Å²	141.4	69%	0.69	76%	0.763	S	S	*	*			trans	-173	157.9	141.8	-143.3	-6.2	0	0	0	116.4
288	R	27.5	Very low	26.4	Very low	201 Å²	201	139.1 Å²	139.1	76%	0.758	75%	0.753	S	S	*	*			trans	81.1	81.3	147.4	-85.8	161	-164.8	-119.7	-6.3	124.1
289	L	26.3	Very low	26.3	Very low	135 Å²	135	139.6 Å²	139.6	71%	0.707	75%	0.751	S	S	*	*				67.8	120.4	105.4	-73.7	-179.9	0	0	0	123.2
290	L	25.8	Very low	26.2	Very low	132 Å²	132	138.9 Å²	138.9	69%	0.691	75%	0.752	S	S	*	*			trans	76.8	148.9	141.4	-57.5	164.5	0	0	0	119.8
291	R	25.2	Very low	26.1	Very low	232 Å²	232	137.9 Å²	137.9	88%	0.875	75%	0.752	S	S	*	*			cis	-175.4	125	-25.5	170.6	-177	-72.5	-129.8	0.4	108.1
292	G	22.7	Very low	26.1	Very low	76 Å²	76	138.1 Å²	138.1	78%	0.784	76%	0.755	S	S	*	*			trans	-175.4	97	175.9	0	0	0	0	0	118.2
293	R	30.8	Very low	26	Very low	240 Å²	240	136.1 Å²	136.1	91%	0.906	76%	0.759	S	S	*	*			trans	-60.6	172.9	158.1	-105.6	176.5	141	-168.8	-4.8	112.3
294	P	39.6	Very low	26	Very low	94 Å²	94	132.1 Å²	132.1	61%	0.61	76%	0.755	S	S	*	*			cis	-141.4	-178.9	-14.7	39.6	-21.6	0	0	0	115.6
295	N	25.8	Very low	26	Very low	136 Å²	136	129.7 Å²	129.7	73%	0.727	75%	0.746	S	S	*	*			trans	67.4	154.1	145.1	-77.3	22	0	0	0	120.7
296	H	28.6	Very low	25.9	Very low	140 Å²	140	135 Å²	135	65%	0.648	75%	0.753	S	S	*	*			cis	-170.5	158.6	-32.8	-135	-100.5	0	0	0	107.5
297	D	23.1	Very low	25.8	Very low	140 Å²	140	130.7 Å²	130.7	75%	0.749	74%	0.741	S	S	*	*			trans	63.2	164.6	157.5	-60.1	-33	0	0	0	119.2
298	A	25.2	Very low	25.7	Very low	80 Å²	80	132 Å²	132	66%	0.661	75%	0.745	S	S	*	*			cis	-173.2	-176.4	-35.5	0	0	0	0	0	108.4
299	A	23.7	Very low	25.6	Very low	82 Å²	82	130.5 Å²	130.5	68%	0.678	75%	0.746	S	S	*	*			trans	71.6	135	154	0	0	0	0	0	116.7
300	L	22.4	Very low	25.7	Very low	159 Å²	159	133.4 Å²	133.4	83%	0.832	75%	0.753	S	S	*	*				63.2	136.9	60.5	-56.2	167.4	0	0	0	111.2
301	T	21.3	Very low	26.5	Very low	117 Å²	117	133.1 Å²	133.1	72%	0.718	76%	0.759	S	S	*	*			cis	-158.9	175.3	21.2	-17.6	0	0	0	0	111.9
302	S	22.5	Very low	26.4	Very low	116 Å²	116	126.4 Å²	126.4	81%	0.811	75%	0.753	S	S	*	*			trans	14.2	132.3	146.1	-55.3	0	0	0	0	120.8
303	G	23.8	Very low	26.7	Very low	79 Å²	79	133 Å²	133	81%	0.814	76%	0.756	S	S	*	*			trans	-159.4	89.4	162.9	0	0	0	0	0	112.7
304	A	24.1	Very low	26.3	Very low	90 Å²	90	127 Å²	127	74%	0.744	75%	0.75	S	S	*	*			trans	-70	171.9	154.7	0	0	0	0	0	108.5
305	V	25.4	Very low	25.6	Very low	112 Å²	112	126.9 Å²	126.9	68%	0.679	75%	0.752	S	S	*	*			cis	-161.5	159.7	35.7	-119	0	0	0	0	109.4
306	E	24.9	Very low	25.6	Very low	177 Å²	177	129 Å²	129	83%	0.827	76%	0.758	S	S	*	*			trans	61.1	153.5	141.7	-68.4	170.7	144.5	0	0	120
307	A	26.5	Very low	25.5	Very low	78 Å²	78	128 Å²	128	65%	0.645	76%	0.761	S	S	*	*			cis	-165.2	-173.7	-19.2	0	0	0	0	0	109.5
308	M	24.7	Very low	25.7	Very low	157 Å²	157	126.6 Å²	126.6	77%	0.773	77%	0.769	S	S	*	*			trans	74.3	106.7	148.1	-82.7	170	153.6	0	0	120.6
309	E	25.3	Very low	25.6	Very low	168 Å²	168	125.8 Å²	125.8	79%	0.785	77%	0.769	S	S	*	*				74.6	110.2	116.4	-68.9	180	162.2	0	0	121.6
310	K	27.9	Very low	25.7	Very low	197 Å²	197	129.1 Å²	129.1	86%	0.857	77%	0.774	S	S	*	*			trans	-45.1	160.8	138.9	-64.6	179.8	178.7	179.9	0	111.1
311	P	43.6	Very low	25.9	Very low	125 Å²	125	129.5 Å²	129.5	81%	0.812	77%	0.772	S	S	*	*			cis	-154.7	-155	40.6	44.8	-22.2	0	0	0	116.5
312	A	23.5	Very low	26.1	Very low	92 Å²	92	131.7 Å²	131.7	76%	0.76	78%	0.779	S	S	*	*			trans	74.7	127.2	174	0	0	0	0	0	116
313	Y	27.2	Very low	26.2	Very low	215 Å²	215	129.4 Å²	129.4	84%	0.843	77%	0.774	S	S	*	*			cis	88.4	99.9	25	-163.3	-76.3	0	0	0	114.7
314	S	23.1	Very low	26.3	Very low	112 Å²	112	131.2 Å²	131.2	78%	0.783	77%	0.774	S	S	*	*			trans	-168.2	166.5	144.1	43.2	0	0	0	0	109.6
315	S	25.7	Very low	26.4	Very low	92 Å²	92	135.5 Å²	135.5	64%	0.643	78%	0.779	S	S	*	*			trans	-129.7	-168.1	-168.8	-59.1	0	0	0	0	110.7
316	E	26.2	Very low	27.2	Very low	181 Å²	181	135.8 Å²	135.8	85%	0.846	78%	0.783	S	S	*	*			trans	73.4	156.8	158.6	-67.5	-179.5	127.2	0	0	117.2
317	T	26.3	Very low	27.3	Very low	119 Å²	119	133.2 Å²	133.2	73%	0.73	78%	0.779	S	S	*	*				-173.1	146.1	-54.3	21.8	0	0	0	0	107.1
318	A	26.1	Very low	27.1	Very low	110 Å²	110	136.5 Å²	136.5	91%	0.909	79%	0.791	S	S	*	*			trans	61.5	161.3	176.2	0	0	0	0	0	115.5
319	G	23.4	Very low	27.3	Very low	64 Å²	64	134.2 Å²	134.2	66%	0.66	79%	0.791	S	S	*	*			cis	158.3	162.6	-14.3	0	0	0	0	0	113.7
320	L	25.7	Very low	27.5	Very low	151 Å²	151	131.9 Å²	131.9	79%	0.791	79%	0.793	S	S	*	*			trans	70	121.7	159.8	-64.4	170.6	0	0	0	120.8
321	Q	26.7	Very low	27.4	Very low	167 Å²	167	127.2 Å²	127.2	78%	0.78	79%	0.785	S	S	*	*			trans	71.1	159.7	143.2	-57.2	169.4	127.2	0	0	116.4
322	D	24.7	Very low	26.6	Very low	163 Å²	163	126.6 Å²	126.6	87%	0.872	78%	0.783	S	S	*	*			cis	-150	-178.4	6.4	-156	-10.7	0	0	0	110.5
323	G	26	Very low	27.1	Very low	68 Å²	68	127.7 Å²	127.7	70%	0.701	78%	0.783	S	S	*	*			trans	129.4	90.5	152.3	0	0	0	0	0	118.5
324	S	26	Very low	27.5	Very low	117 Å²	117	123.5 Å²	123.5	82%	0.818	78%	0.782	S	S	*	*			trans	-52.3	152.1	175.7	52.9	0	0	0	0	119.9
325	H	25.1	Very low	28	Very low	181 Å²	181	123 Å²	123	84%	0.838	78%	0.784	S	S	*	*			trans	-55.3	-178.2	157.2	-63.6	-78.8	0	0	0	114.1
326	P	42.9	Very low	28.5	Very low	118 Å²	118	121.4 Å²	121.4	77%	0.766	78%	0.777	S	S	*	*			cis	-132.1	-156.5	7.5	28.7	-0.6	0	0	0	112.7
327	V	26.3	Very low	29.2	Very low	122 Å²	122	120.3 Å²	120.3	74%	0.739	77%	0.772	S	S	*	*			cis	-151	137.5	8.8	-166.1	0	0	0	0	111.1
328	T	22.9	Very low	30	Very low	148 Å²	148	118 Å²	118	91%	0.908	76%	0.758	S	S	*	*			trans	-178.4	161.1	139.6	15.6	0	0	0	0	110.2
329	S	27.9	Very low	30.9	Very low	109 Å²	109	119.2 Å²	119.2	76%	0.762	74%	0.743	S	S	*	*			trans	-145.5	155.4	-165.7	54.7	0	0	0	0	116.5
330	S	30.7	Very low	32.2	Very low	118 Å²	118	120.1 Å²	120.1	83%	0.825	74%	0.739	S	S	*	*			trans	75.7	143.3	166.3	78	0	0	0	0	117.6
331	S	25.4	Very low	33.5	Very low	99 Å²	99	114.6 Å²	114.6	69%	0.692	72%	0.719	S	S	*	*			cis	-159	134.5	-2.4	47.4	0	0	0	0	115.2
332	S	27	Very low	34.7	Very low	112 Å²	112	110.9 Å²	110.9	78%	0.783	71%	0.708	S	S	*	*			trans	62.3	163.1	150	70.1	0	0	0	0	120.3
333	P	34.3	Very low	36.1	Very low	115 Å²	115	107.5 Å²	107.5	75%	0.747	69%	0.689	S	S	*	*			cis	-116.5	169.3	-8.8	40.6	-29.1	0	0	0	113.9
334	P	35.8	Very low	37	Very low	127 Å²	127	109 Å²	109	83%	0.825	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-84.5	159.4	175.9	34.8	-35.1	0	0	0	113.9
335	A	32.3	Very low	38.5	Very low	101 Å²	101	107.7 Å²	107.7	84%	0.835	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-90.1	173.1	178.2	0	0	0	0	0	113.3
336	A	36.1	Very low	39	Very low	60 Å²	60	105.7 Å²	105.7	50%	0.496	66%	0.663	S	S	.	*	P	Polyproline II helix	trans	-74.2	152.3	-178.3	0	0	0	0	0	113.6	T338	A336-T338 PolarHBondContact O-N 2.75Å
337	E	40.8	Very low	39.1	Very low	157 Å²	157	108.1 Å²	108.1	73%	0.734	67%	0.669	S	S	*	*			trans	-85.5	103.7	171.6	-66	-173.4	150.6	0	0	110.9	F339	E337-F339 HydrophobicContact CB-CD2 4.35Å; E337-F339 HydrophobicContact CB-CE2 4.03Å
338	T	42.9	Very low	39.9	Very low	70 Å²	70	108.7 Å²	108.7	43%	0.429	66%	0.664	S	S	.	*			trans	-91.6	113.7	169.3	-54.6	0	0	0	0	109.5	A336 E355	A336-T338 PolarHBondContact O-N 2.75Å; T338-E355 HydrophobicContact CG2-CB 4.11Å; T338-E355 HydrophobicContact CG2-CG 4.32Å; T338-E355 VanDerWaalsContact CG2-OE2 3.31Å; T338-E355 WeakPolarHBondContact CG2-OE2 3.43Å; T338-E355 WeakPolarHBondContact OG1-CG 3.47Å; T338-E355 PolarHBondContact OG1-OE2 3.03Å
339	F	46.1	Very low	40.8	Very low	136 Å²	136	104.6 Å²	104.6	60%	0.596	64%	0.641	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.3	130.9	173.9	-82.7	-92.1	0	0	0	110.4	E337 T353 I354	E337-F339 HydrophobicContact CB-CD2 4.35Å; E337-F339 HydrophobicContact CB-CE2 4.03Å; F339-T353 CarbonylContact O-C 3.57Å; F339-T353 WeakPolarHBondContact O-CA 3.33Å; F339-I354 PolarHBondContact N-O 2.87Å; F339-I354 PolarHBondContact O-N 3.35Å
340	S	50.1	Low	42.6	Very low	83 Å²	83	101.8 Å²	101.8	58%	0.58	62%	0.617	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-126.3	133.9	177.1	-171.6	0	0	0	0	110.4	V352 T353	S340-V352 WeakPolarHBondContact CA-O 3.24Å; S340-T353 WeakPolarHBondContact OG-CG2 3.37Å
341	G	52.6	Low	43.8	Very low	36 Å²	36	98.9 Å²	98.9	37%	0.371	59%	0.592	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-157.4	138.5	178.2	0	0	0	0	0	112.4	V352	G341-V352 PolarHBondContact N-O 2.89Å; G341-V352 WeakPolarHBondContact O-CA 3.23Å; G341-V352 WeakPolarHBondContact O-CB 3.4Å; G341-V352 PolarHBondContact O-N 2.91Å
342	T	52.5	Low	45.6	Very low	88 Å²	88	95 Å²	95	54%	0.54	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.5	128.1	-178.2	-44.9	0	0	0	0	110.8	I350 I351	T342-I350 CarbonylContact C-O 3.42Å; T342-I350 WeakPolarHBondContact CA-O 3.38Å; T342-I351 HydrophobicContact CG2-CG1 4.3Å
343	I	54.9	Low	46.8	Very low	93 Å²	93	91.5 Å²	91.5	48%	0.477	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	123.5	174.7	-55.6	-175.8	0	0	0	108.6	I345 I350 V352	I343-I345 HydrophobicContact CG2-CD1 4.39Å; I343-I345 HydrophobicContact CG2-CG1 4.04Å; I343-I350 PolarHBondContact N-O 2.8Å; I343-I350 PolarHBondContact O-N 3.05Å; I343-V352 HydrophobicContact CB-CG2 4.21Å; I343-V352 HydrophobicContact CD1-CG2 3.8Å; I343-V352 HydrophobicContact CG1-CG2 3.79Å
344	T	44.1	Very low	48.3	Very low	98 Å²	98	89.9 Å²	89.9	60%	0.601	52%	0.522	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	123.7	173.1	29.5	0	0	0	0	111.2	Q348 S349	T344-Q348 VanDerWaalsContact CA-O 3.3Å; T344-Q348 WeakPolarHBondContact CA-O 3.15Å; T344-S349 VanDerWaalsContact CG2-OG 3.26Å; T344-S349 WeakPolarHBondContact CG2-OG 3.49Å
345	I	57.2	Low	48.8	Very low	90 Å²	90	88.1 Å²	88.1	46%	0.462	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	130.6	173.9	-53.9	-178.9	0	0	0	107.3	I343 N347 Q348	I343-I345 HydrophobicContact CG2-CD1 4.39Å; I343-I345 HydrophobicContact CG2-CG1 4.04Å; I345-N347 VanDerWaalsContact C-N 3.25Å; I345-N347 PolarHBondContact O-N 3.19Å; I345-N347 VanDerWaalsContact O-N 3.17Å; I345-Q348 PolarHBondContact N-O 3.3Å; I345-Q348 PolarHBondContact O-N 3.2Å
346	N	36.6	Very low	49.4	Very low	139 Å²	139	89.5 Å²	89.5	74%	0.743	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.2	45.3	-179.3	-61.8	-13.8	0	0	0	113.8	Q348	N346-Q348 PolarHBondContact O-N 3.03Å
347	N	44.8	Very low	50	Low	170 Å²	170	90 Å²	90	91%	0.909	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.2	11.6	-176.5	-62.4	-8	0	0	0	116.5	I345	I345-N347 VanDerWaalsContact C-N 3.25Å; I345-N347 PolarHBondContact O-N 3.19Å; I345-N347 VanDerWaalsContact O-N 3.17Å
348	Q	42.8	Very low	50	Low	134 Å²	134	87 Å²	87	63%	0.626	50%	0.5	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.8	170	-65.8	-172.8	1	0	0	111.5	T344 I345 N346	T344-Q348 VanDerWaalsContact CA-O 3.3Å; T344-Q348 WeakPolarHBondContact CA-O 3.15Å; I345-Q348 PolarHBondContact N-O 3.3Å; I345-Q348 PolarHBondContact O-N 3.2Å; N346-Q348 PolarHBondContact O-N 3.03Å
349	S	42.2	Very low	50.3	Low	61 Å²	61	88.5 Å²	88.5	43%	0.427	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	102.8	-178.7	-66.4	0	0	0	0	111	T344	T344-S349 VanDerWaalsContact CG2-OG 3.26Å; T344-S349 WeakPolarHBondContact CG2-OG 3.49Å
350	I	66.1	Low	50.8	Low	51 Å²	51	85.5 Å²	85.5	26%	0.262	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	124.7	177.5	-55	175.1	0	0	0	108.6	T342 I343 L361	T342-I350 CarbonylContact C-O 3.42Å; T342-I350 WeakPolarHBondContact CA-O 3.38Å; I343-I350 PolarHBondContact N-O 2.8Å; I343-I350 PolarHBondContact O-N 3.05Å; I350-L361 HydrophobicContact CG2-CB 3.99Å; I350-L361 HydrophobicContact CG2-CD2 4Å
351	I	54.9	Low	50.8	Low	57 Å²	57	86 Å²	86	29%	0.292	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	124.9	174.8	-56	175.6	0	0	0	108	T342 A362	T342-I351 HydrophobicContact CG2-CG1 4.3Å; I351-A362 WeakPolarHBondContact CB-O 3.47Å; I351-A362 PolarHBondContact N-O 2.85Å; I351-A362 PolarHBondContact O-N 3.06Å
352	V	63.8	Low	50.3	Low	16 Å²	16	86.4 Å²	86.4	10%	0.097	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	112.8	179.6	-170	0	0	0	0	108.5	S340 G341 I343 I354 L359 T360 L361	S340-V352 WeakPolarHBondContact CA-O 3.24Å; G341-V352 PolarHBondContact N-O 2.89Å; G341-V352 WeakPolarHBondContact O-CA 3.23Å; G341-V352 WeakPolarHBondContact O-CB 3.4Å; G341-V352 PolarHBondContact O-N 2.91Å; I343-V352 HydrophobicContact CB-CG2 4.21Å; I343-V352 HydrophobicContact CD1-CG2 3.8Å; I343-V352 HydrophobicContact CG1-CG2 3.79Å; V352-I354 HydrophobicContact CG1-CG1 4.47Å; V352-L359 HydrophobicContact CG1-CD1 3.86Å; V352-L359 HydrophobicContact CG1-CD2 4.03Å; V352-L359 HydrophobicContact CG1-CG 3.75Å; V352-T360 WeakPolarHBondContact CA-O 3.25Å; V352-L361 HydrophobicContact CB-CD2 4.17Å; V352-L361 HydrophobicContact CG1-CD2 3.92Å; V352-L361 HydrophobicContact CG2-CD2 3.59Å
353	T	52.4	Low	50.1	Low	40 Å²	40	86 Å²	86	25%	0.245	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	133	170.6	46.7	0	0	0	0	110.2	F339 S340 T360	F339-T353 CarbonylContact O-C 3.57Å; F339-T353 WeakPolarHBondContact O-CA 3.33Å; S340-T353 WeakPolarHBondContact OG-CG2 3.37Å; T353-T360 PolarHBondContact N-O 3.23Å; T353-T360 PolarHBondContact O-N 2.76Å
354	I	65.3	Low	49.2	Very low	80 Å²	80	85.5 Å²	85.5	41%	0.41	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	111.4	173.9	-56.1	178.1	0	0	0	106.8	F339 V352 V358 L359	F339-I354 PolarHBondContact N-O 2.87Å; F339-I354 PolarHBondContact O-N 3.35Å; V352-I354 HydrophobicContact CG1-CG1 4.47Å; I354-V358 WeakPolarHBondContact CA-O 3.29Å; I354-L359 HydrophobicContact CD1-CD1 4.13Å; I354-L359 HydrophobicContact CG1-CB 4.49Å; I354-L359 HydrophobicContact CG1-CD1 4.13Å; I354-L359 HydrophobicContact CG1-CG 4.26Å
355	E	46.8	Very low	48.9	Very low	90 Å²	90	87.1 Å²	87.1	42%	0.421	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	129.7	177.2	-168.3	173.4	130	0	0	109.2	T338 G357 V358	T338-E355 HydrophobicContact CG2-CB 4.11Å; T338-E355 HydrophobicContact CG2-CG 4.32Å; T338-E355 VanDerWaalsContact CG2-OE2 3.31Å; T338-E355 WeakPolarHBondContact CG2-OE2 3.43Å; T338-E355 WeakPolarHBondContact OG1-CG 3.47Å; T338-E355 PolarHBondContact OG1-OE2 3.03Å; E355-G357 PolarHBondContact O-N 2.66Å; E355-V358 PolarHBondContact N-O 3.12Å; E355-V358 VanDerWaalsContact N-O 3.12Å; E355-V358 PolarHBondContact O-N 3.44Å
356	N	43.7	Very low	47.8	Very low	130 Å²	130	91.9 Å²	91.9	70%	0.695	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	27	178.4	-62.4	-50.6	0	0	0	115
357	G	49.1	Very low	47.6	Very low	72 Å²	72	88.8 Å²	88.8	74%	0.742	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	1.7	-178.2	0	0	0	0	0	115.4	E355	E355-G357 PolarHBondContact O-N 2.66Å
358	V	41.5	Very low	46.9	Very low	94 Å²	94	91.6 Å²	91.6	57%	0.57	53%	0.534	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	125.8	170.7	-177	0	0	0	0	108.8	I354 E355	I354-V358 WeakPolarHBondContact CA-O 3.29Å; E355-V358 PolarHBondContact N-O 3.12Å; E355-V358 VanDerWaalsContact N-O 3.12Å; E355-V358 PolarHBondContact O-N 3.44Å
359	L	49	Very low	46.2	Very low	100 Å²	100	91.5 Å²	91.5	52%	0.524	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	118.9	175.7	-176.1	147.3	0	0	0	109.2	V352 I354 L361	V352-L359 HydrophobicContact CG1-CD1 3.86Å; V352-L359 HydrophobicContact CG1-CD2 4.03Å; V352-L359 HydrophobicContact CG1-CG 3.75Å; I354-L359 HydrophobicContact CD1-CD1 4.13Å; I354-L359 HydrophobicContact CG1-CB 4.49Å; I354-L359 HydrophobicContact CG1-CD1 4.13Å; I354-L359 HydrophobicContact CG1-CG 4.26Å; L359-L361 HydrophobicContact CD2-CD2 3.82Å; L359-L361 HydrophobicContact CD2-CG 3.96Å
360	T	55.5	Low	46.1	Very low	73 Å²	73	96.7 Å²	96.7	45%	0.448	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.7	136.7	-178.8	-50.4	0	0	0	0	109.3	V352 T353	V352-T360 WeakPolarHBondContact CA-O 3.25Å; T353-T360 PolarHBondContact N-O 3.23Å; T353-T360 PolarHBondContact O-N 2.76Å
361	L	50.4	Low	44.4	Very low	93 Å²	93	103.5 Å²	103.5	49%	0.487	59%	0.587	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.9	124.5	179.2	-62	177.3	0	0	0	109.1	I350 V352 L359	I350-L361 HydrophobicContact CG2-CB 3.99Å; I350-L361 HydrophobicContact CG2-CD2 4Å; V352-L361 HydrophobicContact CB-CD2 4.17Å; V352-L361 HydrophobicContact CG1-CD2 3.92Å; V352-L361 HydrophobicContact CG2-CD2 3.59Å; L359-L361 HydrophobicContact CD2-CD2 3.82Å; L359-L361 HydrophobicContact CD2-CG 3.96Å
362	A	43.6	Very low	43.7	Very low	45 Å²	45	108.3 Å²	108.3	37%	0.372	61%	0.608	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.1	134	179.6	0	0	0	0	0	111.3	I351	I351-A362 WeakPolarHBondContact CB-O 3.47Å; I351-A362 PolarHBondContact N-O 2.85Å; I351-A362 PolarHBondContact O-N 3.06Å
363	A	47.3	Very low	42.6	Very low	80 Å²	80	114.7 Å²	114.7	66%	0.661	64%	0.642	S	S	*	*			trans	-84.8	153.2	164.4	0	0	0	0	0	110
364	P	35.6	Very low	41.7	Very low	82 Å²	82	120.3 Å²	120.3	53%	0.532	67%	0.671	S	S	.	*			trans	-63.2	138.5	174.2	-19.9	32.7	0	0	0	111.7
365	P	38.1	Very low	40.1	Very low	132 Å²	132	125.7 Å²	125.7	86%	0.857	70%	0.697	S	S	*	*			trans	-85.3	113.7	179.2	32.1	-32.6	0	0	0	111.9
366	E	34	Very low	39.7	Very low	191 Å²	191	125.4 Å²	125.4	89%	0.893	70%	0.701	S	S	*	*			trans	-116.8	130.8	161.5	-68.3	-159.3	172.3	0	0	110.9
367	G	32	Very low	39.8	Very low	74 Å²	74	122.3 Å²	122.3	76%	0.763	69%	0.689	S	S	*	*			trans	46.5	103.9	158	0	0	0	0	0	120.5
368	Y	30.5	Very low	39.5	Very low	229 Å²	229	123.9 Å²	123.9	90%	0.898	68%	0.68	S	S	*	*			trans	1	135.6	144.2	-91	-106.1	0	0	0	117.4
369	V	29.2	Very low	39.9	Very low	131 Å²	131	121.3 Å²	121.3	79%	0.794	66%	0.661	S	S	*	*			cis	-148.1	148.8	49.3	175.9	0	0	0	0	111.8
370	H	39.5	Very low	39.9	Very low	170 Å²	170	122.9 Å²	122.9	79%	0.787	67%	0.666	S	S	*	*			trans	-56.7	137	172.5	-101.9	-49.7	0	0	0	114.7
371	K	30.2	Very low	39.5	Very low	194 Å²	194	126.1 Å²	126.1	84%	0.843	68%	0.676	S	S	*	*				-153	168.9	114.7	-111.2	170.6	-176.6	-176.1	0	111.7
372	E	41.1	Very low	39.5	Very low	158 Å²	158	126 Å²	126	74%	0.738	68%	0.675	S	S	*	*			trans	-85.1	168.2	-161	-66.4	135.1	130.4	0	0	114.7
373	D	39.9	Very low	39.7	Very low	150 Å²	150	127.1 Å²	127.1	80%	0.802	69%	0.691	S	S	*	*			trans	59.9	88.1	163.8	-56.7	-28.4	0	0	0	118.7
374	D	32.9	Very low	40.1	Very low	159 Å²	159	126 Å²	126	85%	0.85	67%	0.673	S	S	*	*				-163.6	114.3	121.5	-104.2	-29.1	0	0	0	111.6	V376	D374-V376 PolarHBondContact O-N 2.96Å
375	M	33.3	Very low	41.3	Very low	193 Å²	193	129.6 Å²	129.6	95%	0.951	68%	0.68	S	S	*	*			trans	-84.7	84.6	172	-88.2	-177	55.8	0	0	110.4	S377	M375-S377 PolarHBondContact O-N 3.31Å
376	V	37.7	Very low	41.5	Very low	84 Å²	84	129.9 Å²	129.9	51%	0.509	67%	0.674	S	S	.	*			trans	-55.7	126.6	173.1	179.8	0	0	0	0	110	D374 E380	D374-V376 PolarHBondContact O-N 2.96Å; V376-E380 HydrophobicContact CG1-CB 4.44Å; V376-E380 HydrophobicContact CG1-CG 4.5Å
377	S	44.7	Very low	42.2	Very low	64 Å²	64	129.7 Å²	129.7	45%	0.448	67%	0.673	S	S	.	*			trans	-70.1	138.5	-175.1	-178	0	0	0	0	111.2	M375 K379 E380 H381	M375-S377 PolarHBondContact O-N 3.31Å; S377-K379 PolarHBondContact O-N 3.49Å; S377-K379 VanDerWaalsContact O-N 3.07Å; S377-K379 PolarHBondContact OG-N 3.36Å; S377-E380 WeakPolarHBondContact O-CA 3.01Å; S377-E380 WeakPolarHBondContact O-CB 3.31Å; S377-E380 PolarHBondContact O-N 3.45Å; S377-H381 PolarHBondContact O-N 3.24Å
378	L	43.3	Very low	42.7	Very low	106 Å²	106	131 Å²	131	56%	0.555	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-23.5	176.4	-163	146.2	0	0	0	111.9	L382 I390	L378-L382 HydrophobicContact CD2-CD1 3.77Å; L378-L382 HydrophobicContact CD2-CG 4.49Å; L378-L382 VanDerWaalsContact O-CG 3.3Å; L378-L382 WeakPolarHBondContact O-CG 3.39Å; L378-L382 PolarHBondContact O-N 3.21Å; L378-I390 HydrophobicContact CD2-CD1 4.46Å
379	K	50.7	Low	43.4	Very low	39 Å²	39	126.7 Å²	126.7	17%	0.17	65%	0.651	C	S	.	*	T	Hydrogen-bonded Turn	trans	-69.4	-36.5	172.5	-170.7	172.7	176	162.4	0	113.1	S377 L382 G383 M384 K385 D386 E388 I390	S377-K379 PolarHBondContact O-N 3.49Å; S377-K379 VanDerWaalsContact O-N 3.07Å; S377-K379 PolarHBondContact OG-N 3.36Å; K379-L382 PolarHBondContact O-N 3.24Å; K379-G383 PolarHBondContact O-N 3.3Å; K379-M384 HydrophobicContact CG-CB 3.8Å; K379-M384 PolarHBondContact O-N 3.45Å; K379-M384 VanDerWaalsContact O-N 3.13Å; K379-K385 WeakPolarHBondContact CE-O 3.48Å; K379-K385 PolarHBondContact NZ-O 3.3Å; K379-D386 VanDerWaalsContact NZ-C 3.29Å; K379-D386 PolarHBondContact NZ-O 2.96Å; K379-E388 WeakPolarHBondContact CE-O 3.36Å; K379-E388 PolarHBondContact NZ-O 3.34Å; K379-I390 HydrophobicContact CB-CD1 4.45Å
380	E	47.7	Very low	43.9	Very low	133 Å²	133	124.7 Å²	124.7	62%	0.621	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-41.4	179.7	-172.6	173.5	-154.6	0	0	111	V376 S377 L382 G383	V376-E380 HydrophobicContact CG1-CB 4.44Å; V376-E380 HydrophobicContact CG1-CG 4.5Å; S377-E380 WeakPolarHBondContact O-CA 3.01Å; S377-E380 WeakPolarHBondContact O-CB 3.31Å; S377-E380 PolarHBondContact O-N 3.45Å; E380-L382 PolarHBondContact O-N 3.33Å; E380-L382 VanDerWaalsContact O-N 3.13Å; E380-G383 PolarHBondContact O-N 3.29Å
381	H	47.3	Very low	44	Very low	142 Å²	142	121.6 Å²	121.6	66%	0.657	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-16.2	171	-118.7	72.6	0	0	0	114.1	S377	S377-H381 PolarHBondContact O-N 3.24Å
382	L	51.8	Low	44.1	Very low	91 Å²	91	120.3 Å²	120.3	48%	0.476	63%	0.63	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.2	-0.6	173.4	-68	175.4	0	0	0	113.6	L378 K379 E380 M384	L378-L382 HydrophobicContact CD2-CD1 3.77Å; L378-L382 HydrophobicContact CD2-CG 4.49Å; L378-L382 VanDerWaalsContact O-CG 3.3Å; L378-L382 WeakPolarHBondContact O-CG 3.39Å; L378-L382 PolarHBondContact O-N 3.21Å; K379-L382 PolarHBondContact O-N 3.24Å; E380-L382 PolarHBondContact O-N 3.33Å; E380-L382 VanDerWaalsContact O-N 3.13Å; L382-M384 VanDerWaalsContact C-N 3.26Å; L382-M384 HydrophobicContact CB-CG 4.12Å; L382-M384 HydrophobicContact CB-SD 4.38Å; L382-M384 HydrophobicContact CD1-SD 4.44Å; L382-M384 PolarHBondContact O-N 2.91Å
383	G	47.5	Very low	43.6	Very low	68 Å²	68	118.7 Å²	118.7	70%	0.701	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	65	23	179	0	0	0	0	0	115.1	K379 E380	K379-G383 PolarHBondContact O-N 3.3Å; E380-G383 PolarHBondContact O-N 3.29Å
384	M	55.4	Low	43.3	Very low	57 Å²	57	118.9 Å²	118.9	28%	0.281	63%	0.626	S	S	.	*			trans	-81.7	144.8	-178.5	-66.2	-179.7	63.3	0	0	111.7	K379 L382 E388 I390	K379-M384 HydrophobicContact CG-CB 3.8Å; K379-M384 PolarHBondContact O-N 3.45Å; K379-M384 VanDerWaalsContact O-N 3.13Å; L382-M384 VanDerWaalsContact C-N 3.26Å; L382-M384 HydrophobicContact CB-CG 4.12Å; L382-M384 HydrophobicContact CB-SD 4.38Å; L382-M384 HydrophobicContact CD1-SD 4.44Å; L382-M384 PolarHBondContact O-N 2.91Å; M384-E388 HydrophobicContact CE-CB 3.85Å; M384-I390 HydrophobicContact CE-CG1 3.95Å; M384-I390 HydrophobicContact SD-CD1 4.27Å; M384-I390 HydrophobicContact SD-CG1 3.87Å
385	K	59.6	Low	43.2	Very low	157 Å²	157	120.9 Å²	120.9	68%	0.683	62%	0.623	S	S	*	*			trans	-77.6	153.1	178.4	-72.6	-174.5	175.4	-176.8	0	111.9	K379 H387 E388	K379-K385 WeakPolarHBondContact CE-O 3.48Å; K379-K385 PolarHBondContact NZ-O 3.3Å; K385-H387 PolarHBondContact O-N 2.81Å; K385-E388 HydrophobicContact CB-CG 4.42Å; K385-E388 PolarHBondContact N-OE2 3.16Å; K385-E388 WeakPolarHBondContact O-CB 3.45Å; K385-E388 PolarHBondContact O-N 3.27Å
386	D	43.8	Very low	43.1	Very low	137 Å²	137	118.1 Å²	118.1	73%	0.733	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-26.7	-173.3	-63.1	-64.6	0	0	0	114.8	K379 E388	K379-D386 VanDerWaalsContact NZ-C 3.29Å; K379-D386 PolarHBondContact NZ-O 2.96Å; D386-E388 VanDerWaalsContact C-N 3.34Å; D386-E388 PolarHBondContact O-N 3.31Å
387	H	47.1	Very low	43	Very low	188 Å²	188	118.6 Å²	118.6	87%	0.87	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	6.4	177.6	-53.2	-38.7	0	0	0	115	K385	K385-H387 PolarHBondContact O-N 2.81Å
388	E	43.6	Very low	42.8	Very low	101 Å²	101	118.4 Å²	118.4	47%	0.472	63%	0.628	S	S	.	*			trans	-105.2	119.6	179.7	-59.9	179.1	137.9	0	0	111.7	K379 M384 K385 D386	K379-E388 WeakPolarHBondContact CE-O 3.36Å; K379-E388 PolarHBondContact NZ-O 3.34Å; M384-E388 HydrophobicContact CE-CB 3.85Å; K385-E388 HydrophobicContact CB-CG 4.42Å; K385-E388 PolarHBondContact N-OE2 3.16Å; K385-E388 WeakPolarHBondContact O-CB 3.45Å; K385-E388 PolarHBondContact O-N 3.27Å; D386-E388 VanDerWaalsContact C-N 3.34Å; D386-E388 PolarHBondContact O-N 3.31Å
389	D	44.1	Very low	42.4	Very low	138 Å²	138	119.3 Å²	119.3	74%	0.738	64%	0.638	S	S	*	*			trans	-87.3	138.1	179.9	-74.7	-29.9	0	0	0	112.5	V391	D389-V391 HydrophobicContact CB-CG2 4.33Å; D389-V391 PolarHBondContact O-N 3.32Å
390	I	41.3	Very low	41.8	Very low	89 Å²	89	123.6 Å²	123.6	46%	0.456	66%	0.656	S	S	.	*			trans	-81.1	97.6	173.6	-58.5	176.6	0	0	0	109.3	L378 K379 M384 L392	L378-I390 HydrophobicContact CD2-CD1 4.46Å; K379-I390 HydrophobicContact CB-CD1 4.45Å; M384-I390 HydrophobicContact CE-CG1 3.95Å; M384-I390 HydrophobicContact SD-CD1 4.27Å; M384-I390 HydrophobicContact SD-CG1 3.87Å; I390-L392 PolarHBondContact O-N 3.26Å
391	V	40.5	Very low	40.9	Very low	105 Å²	105	122.6 Å²	122.6	64%	0.636	66%	0.664	S	S	*	*			trans	-94.6	95.5	-178.5	-172.9	0	0	0	0	111.5	D389 L393	D389-V391 HydrophobicContact CB-CG2 4.33Å; D389-V391 PolarHBondContact O-N 3.32Å; V391-L393 HydrophobicContact CG1-CD2 3.76Å; V391-L393 HydrophobicContact CG1-CG 4.07Å; V391-L393 PolarHBondContact O-N 3.39Å
392	L	33.5	Very low	40.3	Very low	167 Å²	167	124.1 Å²	124.1	87%	0.874	68%	0.676	S	S	*	*			trans	-71.1	106	169.5	-74.4	170.4	0	0	0	110.8	I390 N394	I390-L392 PolarHBondContact O-N 3.26Å; L392-N394 PolarHBondContact O-N 3.47Å
393	L	30.6	Very low	39.2	Very low	124 Å²	124	123.1 Å²	123.1	65%	0.649	69%	0.687	S	S	*	*			trans	-93	94.4	178.3	-67.2	177	0	0	0	111.5	V391 Y395	V391-L393 HydrophobicContact CG1-CD2 3.76Å; V391-L393 HydrophobicContact CG1-CG 4.07Å; V391-L393 PolarHBondContact O-N 3.39Å; L393-Y395 HydrophobicContact CB-CD2 4.17Å; L393-Y395 HydrophobicContact CB-CE2 4.35Å; L393-Y395 HydrophobicContact CD1-CE2 4.34Å; L393-Y395 PolarHBondContact O-N 3.36Å
394	N	33	Very low	38.3	Very low	154 Å²	154	129.5 Å²	129.5	82%	0.824	70%	0.696	S	S	*	*			trans	-66.6	129.5	164.9	-168.7	5	0	0	0	109.7	L392	L392-N394 PolarHBondContact O-N 3.47Å
395	Y	29.7	Very low	36.8	Very low	201 Å²	201	134.6 Å²	134.6	79%	0.788	72%	0.722	S	S	*	*			trans	-112.2	46.3	-159.9	-125.7	-71.4	0	0	0	114.5	L393	L393-Y395 HydrophobicContact CB-CD2 4.17Å; L393-Y395 HydrophobicContact CB-CE2 4.35Å; L393-Y395 HydrophobicContact CD1-CE2 4.34Å; L393-Y395 PolarHBondContact O-N 3.36Å
396	D	32.3	Very low	35.3	Very low	135 Å²	135	132.4 Å²	132.4	72%	0.722	73%	0.727	S	S	*	*			trans	-88.5	164	176.2	-123.7	-44.9	0	0	0	114.4	G398	D396-G398 PolarHBondContact O-N 3.38Å
397	S	34.7	Very low	34.4	Very low	95 Å²	95	132.6 Å²	132.6	66%	0.664	73%	0.733	S	S	*	*	S	Bend	trans	-79.6	60	-149.7	65.1	0	0	0	0	118.8
398	G	41.3	Very low	33.4	Very low	59 Å²	59	132.1 Å²	132.1	61%	0.608	74%	0.736	S	S	*	*			trans	95.6	74.6	130.4	0	0	0	0	0	119.8	D396	D396-G398 PolarHBondContact O-N 3.38Å
399	T	34	Very low	32.5	Very low	125 Å²	125	131.3 Å²	131.3	77%	0.767	75%	0.747	S	S	*	*			trans	-125.8	-176.7	147.6	41.5	0	0	0	0	110
400	K	37.7	Very low	31.7	Very low	129 Å²	129	131.7 Å²	131.7	56%	0.561	75%	0.753	S	S	*	*			trans	-116.9	121.3	171.8	-79.7	-171.7	177.3	-174.5	0	109.4
401	S	30.8	Very low	30.9	Very low	113 Å²	113	132.2 Å²	132.2	79%	0.79	77%	0.771	S	S	*	*			trans	-143.2	128.1	157.8	44.9	0	0	0	0	107.8
402	I	33.2	Very low	30.2	Very low	174 Å²	174	132.5 Å²	132.5	89%	0.892	78%	0.778	S	S	*	*			trans	-109.5	98.2	170.6	-63.4	174.8	0	0	0	105.4
403	G	28.3	Very low	29.7	Very low	70 Å²	70	129.7 Å²	129.7	72%	0.722	77%	0.772	S	S	*	*			trans	-94.4	113.9	171	0	0	0	0	0	109.4
404	K	29.5	Very low	29.4	Very low	202 Å²	202	128.7 Å²	128.7	88%	0.878	78%	0.775	S	S	*	*			trans	-77.7	133.2	160.2	-68.6	-173.2	176.2	-170.6	0	107.9
405	I	25	Very low	29.1	Very low	164 Å²	164	128.5 Å²	128.5	84%	0.841	77%	0.769	S	S	*	*			trans	-132.1	118.8	163	-58	-178.9	0	0	0	106.4
406	S	27.1	Very low	28.8	Very low	111 Å²	111	125.1 Å²	125.1	78%	0.776	76%	0.761	S	S	*	*			trans	-73.9	150.3	173.4	-57.8	0	0	0	0	110.4
407	T	25.2	Very low	28.4	Very low	140 Å²	140	125.5 Å²	125.5	86%	0.859	76%	0.758	S	S	*	*			trans	-61.2	134.7	170.1	36	0	0	0	0	111.6
408	L	26.4	Very low	27.9	Very low	179 Å²	179	125.6 Å²	125.6	94%	0.937	75%	0.748	S	S	*	*			trans	-150.7	146	156.4	-114.3	173.1	0	0	0	108.8
409	A	25	Very low	27.8	Very low	84 Å²	84	126.8 Å²	126.8	69%	0.694	75%	0.745	S	S	*	*			trans	-107.9	152.4	-164.2	0	0	0	0	0	113.8
410	V	26.9	Very low	27.5	Very low	145 Å²	145	128.6 Å²	128.6	88%	0.879	74%	0.738	S	S	*	*			trans	23.4	112	148.3	-173	0	0	0	0	118
411	A	24.6	Very low	27.7	Very low	100 Å²	100	127.9 Å²	127.9	83%	0.826	75%	0.746	S	S	*	*			trans	-152.1	158.1	148.2	0	0	0	0	0	110.7
412	S	24.3	Very low	27.6	Very low	111 Å²	111	125.8 Å²	125.8	78%	0.776	74%	0.742	S	S	*	*			trans	-100.5	179.9	-169.2	-51.9	0	0	0	0	114
413	S	24.6	Very low	27.2	Very low	109 Å²	109	124 Å²	124	76%	0.762	74%	0.74	S	S	*	*			trans	85.5	109	158.1	71	0	0	0	0	120.8
414	S	24.2	Very low	27.4	Very low	102 Å²	102	126.3 Å²	126.3	71%	0.713	74%	0.744	S	S	*	*				46	157.4	128.2	58.8	0	0	0	0	125.5
415	H	25.7	Very low	27.4	Very low	150 Å²	150	122.9 Å²	122.9	69%	0.694	74%	0.74	S	S	*	*			trans	80.4	114.7	163.2	-69.3	-81	0	0	0	122.7
416	Q	24.7	Very low	27.7	Very low	130 Å²	130	119.4 Å²	119.4	61%	0.607	73%	0.73	S	S	*	*			trans	60.9	138.2	130.2	-83.9	164.1	-82.7	0	0	125.3	R490	Q416-R490 PolarHBondContact O-NH1 3.38Å
417	E	23.8	Very low	27.9	Very low	144 Å²	144	120.3 Å²	120.3	67%	0.673	73%	0.726	S	S	*	*			trans	64.6	172.1	136	-76.7	172.7	79.7	0	0	124.8
418	E	23.6	Very low	28.7	Very low	97 Å²	97	118.1 Å²	118.1	45%	0.453	72%	0.717	S	S	.	*			trans	-90.9	-149	-177	-73.2	-152.9	68.6	0	0	113.1	L488 I489	E418-L488 PolarHBondContact OE1-N 2.88Å; E418-I489 HydrophobicContact CB-CB 4.03Å; E418-I489 HydrophobicContact CB-CG2 4.34Å; E418-I489 HydrophobicContact CG-CB 4.04Å; E418-I489 HydrophobicContact CG-CG2 4.36Å; E418-I489 PolarHBondContact OE1-N 2.81Å
419	P	39.2	Very low	29.3	Very low	84 Å²	84	117.7 Å²	117.7	55%	0.545	71%	0.71	S	S	.	*				-112.5	174	-51.2	8.8	13.5	0	0	0	114.8	L488	P419-L488 HydrophobicContact CB-CB 4.21Å
420	R	27.9	Very low	29.7	Very low	163 Å²	163	120.7 Å²	120.7	62%	0.615	71%	0.714	S	S	*	*			trans	-84	178.2	168.1	-31.6	172	-147.8	140.2	7.8	110.2	L488 I489	R420-L488 HydrophobicContact CB-CB 4.23Å; R420-L488 HydrophobicContact CB-CD1 4.21Å; R420-L488 HydrophobicContact CG-CB 4.04Å; R420-L488 PolarHBondContact NE-O 3.48Å; R420-L488 PolarHBondContact NH2-O 3.17Å; R420-L488 WeakPolarHBondContact O-CD1 3.21Å; R420-I489 HydrophobicContact CG-CD1 3.78Å; R420-I489 HydrophobicContact CG-CG1 3.6Å
421	P	42.4	Very low	29.9	Very low	114 Å²	114	117 Å²	117	74%	0.74	70%	0.698	S	S	*	*				-154.4	-175.3	51.9	40.7	-17.4	0	0	0	118.5	L488	P421-L488 HydrophobicContact CB-CD1 4.03Å; P421-L488 HydrophobicContact CG-CD1 4.3Å
422	G	27.2	Very low	30	Very low	68 Å²	68	120.8 Å²	120.8	70%	0.701	70%	0.704	S	S	*	*			trans	85.8	162.9	156.1	0	0	0	0	0	117.6
423	V	25.1	Very low	30.4	Very low	138 Å²	138	120.3 Å²	120.3	84%	0.836	70%	0.696	S	S	*	*			cis	-151.3	156	-4.4	175.6	0	0	0	0	108.9	V425	V423-V425 HydrophobicContact CG1-CG2 3.96Å
424	S	33.3	Very low	30.4	Very low	118 Å²	118	122.3 Å²	122.3	83%	0.825	70%	0.698	S	S	*	*			trans	-145.4	132.1	161.3	59.9	0	0	0	0	111.7
425	V	29.3	Very low	30.7	Very low	130 Å²	130	124.5 Å²	124.5	79%	0.788	70%	0.702	S	S	*	*			trans	-154.1	145.2	-170.8	162.5	0	0	0	0	106.7	V423	V423-V425 HydrophobicContact CG1-CG2 3.96Å
426	S	31.1	Very low	30.8	Very low	90 Å²	90	122.2 Å²	122.2	63%	0.629	70%	0.702	S	S	*	*			cis	-137.7	-151	5.3	-145.2	0	0	0	0	109.4
427	D	30.9	Very low	30.9	Very low	130 Å²	130	121.4 Å²	121.4	70%	0.695	71%	0.71	S	S	*	*			cis	-147.9	179.4	0.1	-107.6	-33.2	0	0	0	107.8
428	S	42.2	Very low	30.8	Very low	95 Å²	95	122.7 Å²	122.7	66%	0.664	72%	0.721	S	S	*	*			cis	70.4	149.1	38.5	-23.3	0	0	0	0	113.2
429	E	39	Very low	31	Very low	170 Å²	170	122.9 Å²	122.9	79%	0.794	73%	0.733	S	S	*	*			cis	-147.6	-178.3	2.4	-82.2	-154.8	125.8	0	0	107.8
430	L	33.1	Very low	31.2	Very low	146 Å²	146	127.3 Å²	127.3	76%	0.764	75%	0.746	S	S	*	*			cis	-174	165	-38.4	-87.9	-164.6	0	0	0	105.9
431	A	32.5	Very low	31.1	Very low	67 Å²	67	127.8 Å²	127.8	55%	0.554	76%	0.76	S	S	*	*			cis	-163.1	142.8	-17.9	0	0	0	0	0	110.3	V433	A431-V433 HydrophobicContact CB-CG2 3.96Å
432	L	26.7	Very low	30.2	Very low	181 Å²	181	125.5 Å²	125.5	95%	0.948	76%	0.757	S	S	*	*			trans	-155.7	113	153.4	-83.8	-170	0	0	0	107.8
433	V	33.2	Very low	30.1	Very low	101 Å²	101	128.2 Å²	128.2	61%	0.612	76%	0.76	S	S	*	*			cis	169.5	162.7	-24.9	149	0	0	0	0	104.3	A431	A431-V433 HydrophobicContact CB-CG2 3.96Å
434	D	24.7	Very low	29.9	Very low	150 Å²	150	126.4 Å²	126.4	80%	0.802	75%	0.754	S	S	*	*			trans	65.1	94.3	-178.2	-55.3	-32.6	0	0	0	114.9
435	D	28.7	Very low	29.5	Very low	148 Å²	148	128.2 Å²	128.2	79%	0.791	75%	0.753	S	S	*	*			cis	85.2	143.4	12.7	-140.8	-17.7	0	0	0	117.5
436	C	28	Very low	29.3	Very low	103 Å²	103	129.3 Å²	129.3	70%	0.696	76%	0.755	S	S	*	*			trans	63.6	119.9	168.5	-77.2	0	0	0	0	122.8
437	S	26.3	Very low	29.1	Very low	112 Å²	112	129.7 Å²	129.7	78%	0.783	76%	0.758	S	S	*	*				69.8	121.9	128.3	-57.8	0	0	0	0	122.2
438	L	23.5	Very low	28.9	Very low	172 Å²	172	129.1 Å²	129.1	90%	0.901	76%	0.762	S	S	*	*			trans	-119.2	81.4	160.8	-157.8	-177	0	0	0	109.6
439	S	27.7	Very low	28.1	Very low	100 Å²	100	129.3 Å²	129.3	70%	0.699	76%	0.764	S	S	*	*			trans	172.3	134.6	171.1	-92.5	0	0	0	0	107.6
440	E	41.9	Very low	27.4	Very low	177 Å²	177	127.7 Å²	127.7	83%	0.827	77%	0.765	S	S	*	*			cis	-151.9	170.7	-16	-72.3	-175.4	126.3	0	0	106.6
441	L	26.4	Very low	27	Very low	174 Å²	174	125 Å²	125	91%	0.911	76%	0.764	S	S	*	*			trans	163.7	148.5	139.6	-90.3	161.9	0	0	0	110.5
442	G	23.1	Very low	26.8	Very low	66 Å²	66	130.9 Å²	130.9	68%	0.68	78%	0.777	S	S	*	*			trans	161.1	-0.8	178.7	0	0	0	0	0	119.2
443	T	25.2	Very low	26.7	Very low	125 Å²	125	128.6 Å²	128.6	77%	0.767	76%	0.762	S	S	*	*			trans	37.1	125	150.6	58.5	0	0	0	0	120.9
444	S	22.3	Very low	26.2	Very low	100 Å²	100	131.6 Å²	131.6	70%	0.699	77%	0.769	S	S	*	*				146.8	114.5	116.8	-173.9	0	0	0	0	115.5
445	L	23.9	Very low	26.4	Very low	155 Å²	155	129.3 Å²	129.3	81%	0.812	77%	0.77	S	S	*	*			trans	46.7	96.3	141.2	-56.7	173.2	0	0	0	120.2
446	D	26.1	Very low	26.3	Very low	153 Å²	153	125.6 Å²	125.6	82%	0.818	77%	0.768	S	S	*	*				-175.1	146.7	111.9	-107.1	-32.4	0	0	0	109.7
447	S	26.8	Very low	26.3	Very low	99 Å²	99	126 Å²	126	69%	0.692	77%	0.767	S	S	*	*			cis	-154.9	-173.8	-6.6	-143.3	0	0	0	0	112.1
448	C	25.8	Very low	26.3	Very low	117 Å²	117	128.4 Å²	128.4	79%	0.791	77%	0.77	S	S	*	*			trans	-39.5	161.6	175.2	-66.6	0	0	0	0	117.4
449	S	25.3	Very low	26.3	Very low	100 Å²	100	125.2 Å²	125.2	70%	0.699	76%	0.761	S	S	*	*			cis	-165.7	139.6	-0.3	36	0	0	0	0	108
450	V	24.5	Very low	26.1	Very low	135 Å²	135	124.3 Å²	124.3	82%	0.818	76%	0.759	S	S	*	*				60.7	115.2	67.7	-180	0	0	0	0	114
451	A	25.3	Very low	25.2	Very low	89 Å²	89	122.3 Å²	122.3	74%	0.736	76%	0.759	S	S	*	*			trans	47.8	108	159.6	0	0	0	0	0	119.8
452	K	27.6	Very low	25.1	Very low	191 Å²	191	119.8 Å²	119.8	83%	0.83	75%	0.751	S	S	*	*				-172.7	131.5	127.7	-101.1	171.4	176.5	-178.4	0	108.4
453	Q	25	Very low	25.4	Very low	134 Å²	134	125 Å²	125	63%	0.626	76%	0.757	S	S	*	*				97.1	113.4	60.4	-173.7	173.8	19.3	0	0	111.5
454	E	23.3	Very low	25.4	Very low	164 Å²	164	123.4 Å²	123.4	77%	0.766	76%	0.757	S	S	*	*			trans	25.7	125.6	140.5	-46.8	168.3	120.1	0	0	120.2
455	A	28	Very low	25.6	Very low	101 Å²	101	125.7 Å²	125.7	84%	0.835	76%	0.761	S	S	*	*				-163.7	140.1	128.6	0	0	0	0	0	110.8
456	G	27	Very low	25.7	Very low	71 Å²	71	125.5 Å²	125.5	73%	0.732	76%	0.76	S	S	*	*			trans	84	83.4	179.7	0	0	0	0	0	113.7
457	V	28.3	Very low	25.6	Very low	112 Å²	112	126 Å²	126	68%	0.679	76%	0.761	S	S	*	*			cis	60.2	99.9	27.9	-174.5	0	0	0	0	110.2
458	L	25.5	Very low	25.5	Very low	162 Å²	162	125.2 Å²	125.2	85%	0.848	76%	0.761	S	S	*	*				-131.3	138.6	60.7	-67.5	158.8	0	0	0	110.9
459	C	22.7	Very low	26.2	Very low	105 Å²	105	125 Å²	125	71%	0.709	76%	0.758	S	S	*	*			cis	78.6	135.8	49.5	-62.6	0	0	0	0	114.8
460	A	24.1	Very low	26.2	Very low	81 Å²	81	125.2 Å²	125.2	67%	0.669	76%	0.76	S	S	*	*			cis	177.3	167.9	-32.3	0	0	0	0	0	109.8
461	V	23.4	Very low	27.4	Very low	135 Å²	135	124 Å²	124	82%	0.818	75%	0.754	S	S	*	*			trans	65.5	151.4	167.7	-131.5	0	0	0	0	114.3
462	T	25.1	Very low	27.3	Very low	120 Å²	120	129.9 Å²	129.9	74%	0.736	76%	0.763	S	S	*	*			cis	-124.1	145.3	5.5	49.2	0	0	0	0	110.3
463	E	27.9	Very low	27.4	Very low	176 Å²	176	125.1 Å²	125.1	82%	0.822	76%	0.759	S	S	*	*				81.6	133.1	55.3	-154.8	-177.8	-123.4	0	0	114.9
464	A	26.1	Very low	28.1	Very low	92 Å²	92	124.4 Å²	124.4	76%	0.76	77%	0.767	S	S	*	*			trans	65.5	158.9	168.1	0	0	0	0	0	120.3
465	D	26.2	Very low	28.3	Very low	147 Å²	147	123.2 Å²	123.2	79%	0.786	77%	0.77	S	S	*	*			cis	-172.9	-173.7	-42.4	-148.4	-38.4	0	0	0	107.6
466	L	25.7	Very low	28.2	Very low	151 Å²	151	122 Å²	122	79%	0.791	77%	0.767	S	S	*	*			trans	75.8	145.6	170.3	-39.5	178.8	0	0	0	114.7
467	I	24.2	Very low	28.1	Very low	164 Å²	164	121.9 Å²	121.9	84%	0.841	77%	0.766	S	S	*	*			cis	-133.4	141.8	14.5	-67.4	171.5	0	0	0	111.3
468	A	25.8	Very low	27.9	Very low	83 Å²	83	122 Å²	122	69%	0.686	77%	0.771	S	S	*	*			trans	-116.3	171.5	158.1	0	0	0	0	0	107.8
469	P	39.4	Very low	27.9	Very low	111 Å²	111	119.8 Å²	119.8	72%	0.721	77%	0.769	S	S	*	*			cis	-159	-172.7	34.7	43.5	-20.2	0	0	0	119.5
470	S	25.2	Very low	28	Very low	106 Å²	106	121.1 Å²	121.1	74%	0.741	77%	0.769	S	S	*	*			trans	86.8	164.3	139.3	91.5	0	0	0	0	119
471	P	48.9	Very low	28.2	Very low	109 Å²	109	124.4 Å²	124.4	71%	0.708	77%	0.77	S	S	*	*				-146.5	-178.9	-103.8	38.3	-15.4	0	0	0	117.2
472	K	24.8	Very low	28.2	Very low	212 Å²	212	124.3 Å²	124.3	92%	0.922	77%	0.765	S	S	*	*				-165.5	155.4	124	-103.3	157.2	-173.8	175.9	0	112.1
473	A	28.6	Very low	28.1	Very low	91 Å²	91	125 Å²	125	75%	0.752	76%	0.764	S	S	*	*			trans	-141.9	-169.3	-165.3	0	0	0	0	0	109.2
474	P	40.4	Very low	27.9	Very low	120 Å²	120	123.3 Å²	123.3	78%	0.779	76%	0.76	S	S	*	*			cis	-115	-156.5	-3.2	26.1	-0.2	0	0	0	111.1
475	V	27.8	Very low	27.8	Very low	139 Å²	139	123.6 Å²	123.6	84%	0.842	76%	0.756	S	S	*	*			cis	-149.2	151.2	17.1	-177.8	0	0	0	0	108.3
476	G	25.6	Very low	28.4	Very low	74 Å²	74	124 Å²	124	76%	0.763	76%	0.758	S	S	*	*			cis	162.8	-10.3	-9.4	0	0	0	0	0	118.4
477	G	24.9	Very low	28.3	Very low	69 Å²	69	121 Å²	121	71%	0.711	75%	0.749	S	S	*	*			trans	-178.2	170.3	177.3	0	0	0	0	0	115
478	C	24.1	Very low	28.7	Very low	116 Å²	116	115.5 Å²	115.5	78%	0.784	72%	0.722	S	S	*	*			cis	-166.7	158.2	-7.3	-106.7	0	0	0	0	111.6
479	S	25.6	Very low	28.8	Very low	114 Å²	114	114.5 Å²	114.5	80%	0.797	70%	0.704	S	S	*	*			trans	60.7	171.9	157	47.2	0	0	0	0	120
480	N	24	Very low	28.4	Very low	133 Å²	133	117.9 Å²	117.9	71%	0.711	70%	0.702	S	S	*	*				-171.1	171.2	-52.6	-139.4	48.3	0	0	0	108.5
481	E	28.4	Very low	28.6	Very low	151 Å²	151	118 Å²	118	71%	0.706	70%	0.703	S	S	*	*			trans	50.6	136.4	160.5	-47.8	-52.2	68.1	0	0	124.2
482	D	23	Very low	28.1	Very low	133 Å²	133	122.1 Å²	122.1	71%	0.711	71%	0.71	S	S	*	*			trans	20.2	139.2	134.1	-78.4	-20.3	0	0	0	126.2
483	L	24.1	Very low	28.6	Very low	134 Å²	134	121.4 Å²	121.4	70%	0.702	71%	0.707	S	S	*	*			trans	62.6	128.1	134.7	-64	171.1	0	0	0	123
484	N	22.8	Very low	28.9	Very low	141 Å²	141	124 Å²	124	75%	0.754	71%	0.708	S	S	*	*			trans	68.2	148.1	152.7	-58.5	-31.1	0	0	0	118.3
485	S	25.1	Very low	29.1	Very low	97 Å²	97	124.9 Å²	124.9	68%	0.678	71%	0.712	S	S	*	*			cis	-159.7	126.8	-18.8	-103.7	0	0	0	0	112.5
486	L	38.5	Very low	30.1	Very low	156 Å²	156	122.1 Å²	122.1	82%	0.817	70%	0.703	S	S	*	*			trans	48.5	116.1	155.9	-65.9	174.3	0	0	0	122.6
487	S	24.1	Very low	31.7	Very low	87 Å²	87	121.8 Å²	121.8	61%	0.608	69%	0.693	S	S	*	*			trans	-132.1	175.5	157.2	-73.1	0	0	0	0	111.1
488	L	31.3	Very low	33.3	Very low	50 Å²	50	123 Å²	123	26%	0.262	69%	0.687	S	S	.	*				-148.9	-13.8	-127.4	-81.3	161.3	0	0	0	120.1	E418 P419 R420 P421	E418-L488 PolarHBondContact OE1-N 2.88Å; P419-L488 HydrophobicContact CB-CB 4.21Å; R420-L488 HydrophobicContact CB-CB 4.23Å; R420-L488 HydrophobicContact CB-CD1 4.21Å; R420-L488 HydrophobicContact CG-CB 4.04Å; R420-L488 PolarHBondContact NE-O 3.48Å; R420-L488 PolarHBondContact NH2-O 3.17Å; R420-L488 WeakPolarHBondContact O-CD1 3.21Å; P421-L488 HydrophobicContact CB-CD1 4.03Å; P421-L488 HydrophobicContact CG-CD1 4.3Å
489	I	28.6	Very low	35.7	Very low	62 Å²	62	120.3 Å²	120.3	32%	0.318	66%	0.662	S	S	.	*			trans	-133.8	157.1	-170.3	-75.6	-165.3	0	0	0	110.8	E418 R420	E418-I489 HydrophobicContact CB-CB 4.03Å; E418-I489 HydrophobicContact CB-CG2 4.34Å; E418-I489 HydrophobicContact CG-CB 4.04Å; E418-I489 HydrophobicContact CG-CG2 4.36Å; E418-I489 PolarHBondContact OE1-N 2.81Å; R420-I489 HydrophobicContact CG-CD1 3.78Å; R420-I489 HydrophobicContact CG-CG1 3.6Å
490	R	30.4	Very low	37.9	Very low	181 Å²	181	117.8 Å²	117.8	68%	0.683	65%	0.648	S	S	*	*	S	Bend	cis	-126.4	177.2	5.7	-148.6	150.5	172.3	172.4	-7	110.1	Q416	Q416-R490 PolarHBondContact O-NH1 3.38Å
491	S	29.6	Very low	40.4	Very low	108 Å²	108	112.2 Å²	112.2	76%	0.755	62%	0.619	S	S	*	*			trans	37.1	89.1	154.1	-59.1	0	0	0	0	118.5	K493	S491-K493 PolarHBondContact O-N 2.83Å
492	K	37.8	Very low	42.5	Very low	197 Å²	197	109.9 Å²	109.9	86%	0.857	62%	0.618	S	S	*	*			trans	-68.9	113.9	158.9	-73.1	-172.6	175.5	-174.3	0	109.8
493	K	36.8	Very low	44.5	Very low	196 Å²	196	108 Å²	108	85%	0.852	60%	0.604	S	S	*	*			trans	-106	108.6	162.2	-177.3	174.9	-178.9	177.6	0	106.8	S491 T495	S491-K493 PolarHBondContact O-N 2.83Å; K493-T495 PolarHBondContact O-N 2.8Å
494	D	34.3	Very low	46.1	Very low	145 Å²	145	107.7 Å²	107.7	78%	0.775	61%	0.61	S	S	*	*			trans	-67.4	102	-170.5	-70.7	-46.8	0	0	0	112.1	A496	D494-A496 VanDerWaalsContact C-N 3.3Å; D494-A496 PolarHBondContact O-N 2.83Å
495	T	45	Very low	47.9	Very low	140 Å²	140	105.1 Å²	105.1	86%	0.859	62%	0.617	S	S	*	*			trans	-69	90.9	160.5	1.3	0	0	0	0	108.2	K493 A497	K493-T495 PolarHBondContact O-N 2.8Å; T495-A497 PolarHBondContact O-N 3.26Å
496	A	48.5	Very low	49.9	Very low	81 Å²	81	101.9 Å²	101.9	67%	0.669	59%	0.594	S	S	*	*			trans	-58.1	106.7	168.3	0	0	0	0	0	108.5	D494 T498	D494-A496 VanDerWaalsContact C-N 3.3Å; D494-A496 PolarHBondContact O-N 2.83Å; A496-T498 PolarHBondContact O-N 2.86Å; A496-T498 PolarHBondContact O-OG1 3.3Å
497	A	58.1	Low	51.4	Low	66 Å²	66	100.5 Å²	100.5	55%	0.545	60%	0.598	S	S	.	*			trans	-71.1	92.3	-175.6	0	0	0	0	0	110.1	T495 F499	T495-A497 PolarHBondContact O-N 3.26Å; A497-F499 HydrophobicContact CB-CE2 4.35Å; A497-F499 HydrophobicContact CB-CZ 4.27Å; A497-F499 WeakPolarHBondContact O-CD2 3.22Å; A497-F499 WeakPolarHBondContact O-CE2 3.26Å; A497-F499 PolarHBondContact O-N 2.78Å
498	T	60.3	Low	53.4	Low	95 Å²	95	98.3 Å²	98.3	58%	0.583	58%	0.583	S	S	*	*			trans	-70.1	114.3	179.5	-46.1	0	0	0	0	110.2	A496 A500 A509	A496-T498 PolarHBondContact O-N 2.86Å; A496-T498 PolarHBondContact O-OG1 3.3Å; T498-A500 PolarHBondContact O-N 3.04Å; T498-A509 HydrophobicContact CG2-CB 3.66Å
499	F	73.3	Confident	55.3	Low	59 Å²	59	98.6 Å²	98.6	26%	0.259	59%	0.592	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.4	95	-179.9	-62.8	-83.5	0	0	0	109.7	A497 F510 S512 R513 L516	A497-F499 HydrophobicContact CB-CE2 4.35Å; A497-F499 HydrophobicContact CB-CZ 4.27Å; A497-F499 WeakPolarHBondContact O-CD2 3.22Å; A497-F499 WeakPolarHBondContact O-CE2 3.26Å; A497-F499 PolarHBondContact O-N 2.78Å; F499-F510 PolarHBondContact N-O 2.89Å; F499-F510 PolarHBondContact O-N 3.39Å; F499-S512 VanDerWaalsContact CD2-C 3.49Å; F499-R513 HydrophobicContact CD1-CB 4.1Å; F499-R513 HydrophobicContact CD2-CB 4.09Å; F499-R513 HydrophobicContact CE1-CB 3.95Å; F499-R513 HydrophobicContact CE1-CG 4.5Å; F499-R513 HydrophobicContact CE2-CB 3.93Å; F499-R513 HydrophobicContact CG-CB 4.17Å; F499-R513 HydrophobicContact CZ-CB 3.87Å; F499-L516 HydrophobicContact CB-CB 3.94Å; F499-L516 HydrophobicContact CB-CD2 3.71Å; F499-L516 HydrophobicContact CB-CG 4.41Å
500	A	73.1	Confident	57.7	Low	62 Å²	62	97.8 Å²	97.8	51%	0.512	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-68.3	152.2	174	0	0	0	0	0	112.5	T498 A509 L516	T498-A500 PolarHBondContact O-N 3.04Å; A500-A509 HydrophobicContact CB-CB 4.28Å; A500-L516 WeakPolarHBondContact O-CD2 3.38Å
501	C	76.2	Confident	59.9	Low	15 Å²	15	94 Å²	94	10%	0.101	58%	0.579	C	S	.	*			trans	-72	128.3	169.9	-168.7	0	0	0	0	111	E503 C506 S508 L516 H523	C501-E503 VanDerWaalsContact C-N 3.29Å; C501-E503 PolarHBondContact O-N 3.08Å; C501-C506 HydrophobicContact CB-CB 4.31Å; C501-S508 WeakPolarHBondContact CB-O 3.44Å; C501-S508 PolarHBondContact N-O 3.15Å; C501-L516 HydrophobicContact CB-CD1 4.27Å; C501-H523 PolarHBondContact SG-CD2 3.23Å; C501-H523 PolarHBondContact SG-NE2 3.12Å; C501-H523 VanDerWaalsContact SG-NE2 3.4Å
502	P	72	Confident	62.1	Low	103 Å²	103	90.5 Å²	90.5	67%	0.669	56%	0.555	S	S	*	*			trans	-75.9	-13.2	175.7	-17.3	33.5	0	0	0	114.5
503	E	65.9	Low	63.7	Low	92 Å²	92	89.7 Å²	89.7	43%	0.43	55%	0.547	S	S	.	.	S	Bend	trans	-72.9	127.4	-171.1	-61.2	-62.4	159.2	0	0	112.7	C501 G505 C506 L520 H523	C501-E503 VanDerWaalsContact C-N 3.29Å; C501-E503 PolarHBondContact O-N 3.08Å; E503-G505 PolarHBondContact O-N 3.13Å; E503-C506 PolarHBondContact O-N 3.11Å; E503-C506 VanDerWaalsContact O-N 3.13Å; E503-L520 HydrophobicContact CG-CD2 4.29Å; E503-H523 HydrophobicContact CB-CB 4.46Å; E503-H523 HydrophobicContact CG-CB 3.79Å
504	P	57.3	Low	65.3	Low	128 Å²	128	87.8 Å²	87.8	83%	0.831	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	108.7	-175.6	27.4	-34.1	0	0	0	110.9
505	G	59.8	Low	67	Low	87 Å²	87	84.5 Å²	84.5	90%	0.897	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.5	-3.8	-177.2	0	0	0	0	0	114.9	E503	E503-G505 PolarHBondContact O-N 3.13Å
506	C	68.1	Low	68.5	Low	29 Å²	29	78.7 Å²	78.7	20%	0.196	48%	0.483	C	S	.	.			trans	-115.3	110.3	175.8	-159.7	0	0	0	0	114.3	C501 E503 S508 H519 H523	C501-C506 HydrophobicContact CB-CB 4.31Å; E503-C506 PolarHBondContact O-N 3.11Å; E503-C506 VanDerWaalsContact O-N 3.13Å; C506-S508 PolarHBondContact O-N 3.42Å; C506-S508 PolarHBondContact SG-OG 3.37Å; C506-S508 VanDerWaalsContact SG-OG 3.35Å; C506-H519 VanDerWaalsContact SG-CE1 3.56Å; C506-H519 PolarHBondContact SG-NE2 3.47Å; C506-H519 VanDerWaalsContact SG-NE2 3.38Å; C506-H523 VanDerWaalsContact CB-CE1 3.43Å; C506-H523 WeakPolarHBondContact CB-CE1 3.4Å; C506-H523 WeakPolarHBondContact CB-NE2 3.17Å; C506-H523 PolarHBondContact SG-CE1 2.76Å; C506-H523 PolarHBondContact SG-NE2 2.87Å; C506-H523 VanDerWaalsContact SG-NE2 3.36Å
507	S	68.3	Low	69.5	Low	128 Å²	128	82.1 Å²	82.1	90%	0.895	48%	0.483	S	S	*	.			trans	-78.6	12.5	176.3	53.3	0	0	0	0	115
508	S	66.9	Low	70.1	Confident	41 Å²	41	83 Å²	83	29%	0.287	48%	0.482	S	S	.	.			trans	-79.7	126.1	-176.2	-62.2	0	0	0	0	111.8	C501 C506 H519	C501-S508 WeakPolarHBondContact CB-O 3.44Å; C501-S508 PolarHBondContact N-O 3.15Å; C506-S508 PolarHBondContact O-N 3.42Å; C506-S508 PolarHBondContact SG-OG 3.37Å; C506-S508 VanDerWaalsContact SG-OG 3.35Å; S508-H519 VanDerWaalsContact CB-CE1 3.41Å; S508-H519 WeakPolarHBondContact CB-CE1 3.35Å; S508-H519 WeakPolarHBondContact CB-NE2 3.04Å; S508-H519 PolarHBondContact OG-CE1 3.33Å
509	A	72.3	Confident	70.6	Confident	56 Å²	56	79.7 Å²	79.7	46%	0.463	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	143	178.8	0	0	0	0	0	111.1	T498 A500	T498-A509 HydrophobicContact CG2-CB 3.66Å; A500-A509 HydrophobicContact CB-CB 4.28Å
510	F	79.1	Confident	70.3	Confident	45 Å²	45	79.4 Å²	79.4	20%	0.197	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	138.3	-165.6	-60.8	-85.3	0	0	0	113.5	F499 S512 K515 L516 H519	F499-F510 PolarHBondContact N-O 2.89Å; F499-F510 PolarHBondContact O-N 3.39Å; F510-S512 PolarHBondContact O-N 3.14Å; F510-K515 HydrophobicContact CB-CB 3.91Å; F510-K515 HydrophobicContact CD1-CB 3.82Å; F510-K515 HydrophobicContact CG-CB 4.1Å; F510-L516 HydrophobicContact CB-CB 4.27Å; F510-L516 HydrophobicContact CD2-CB 4.03Å; F510-L516 HydrophobicContact CD2-CD1 3.91Å; F510-L516 HydrophobicContact CE2-CD1 4.25Å; F510-L516 HydrophobicContact CG-CB 4.4Å; F510-H519 HydrophobicContact CD2-CB 4.26Å; F510-H519 HydrophobicContact CE1-CB 4.2Å; F510-H519 HydrophobicContact CE2-CB 3.49Å; F510-H519 VanDerWaalsContact CE2-CB 3.49Å; F510-H519 AromaticContact CE2-CD2 3.38Å; F510-H519 WeakPolarHBondContact CE2-CD2 3.4Å; F510-H519 AromaticContact CE2-CG 3.3Å; F510-H519 AromaticContact CE2-ND1 3.86Å; F510-H519 AromaticContact CE2-NE2 3.94Å; F510-H519 HydrophobicContact CZ-CB 3.46Å; F510-H519 VanDerWaalsContact CZ-CB 3.46Å; F510-H519 AromaticContact CZ-CD2 3.85Å; F510-H519 AromaticContact CZ-CG 3.32Å; F510-H519 AromaticContact CZ-ND1 3.48Å; F510-H519 WeakPolarHBondContact CZ-ND1 3.44Å
511	D	76.1	Confident	70.1	Confident	100 Å²	100	80.2 Å²	80.2	54%	0.535	46%	0.456	S	S	.	.	S	Bend	trans	-64.7	-3.8	173.6	61.5	-65.1	0	0	0	114.6	K515	D511-K515 WeakPolarHBondContact OD1-CD 3.42Å; D511-K515 WeakPolarHBondContact OD1-CE 3.23Å; D511-K515 IonicContact OD1-NZ 2.75Å; D511-K515 PolarHBondContact OD1-NZ 3.25Å; D511-K515 IonicContact OD2-NZ 2.62Å; D511-K515 PolarHBondContact OD2-NZ 3.27Å
512	S	74.5	Confident	69.2	Low	36 Å²	36	88.3 Å²	88.3	25%	0.252	49%	0.485	S	S	.	.	S	Bend	trans	-150.6	136.5	178.8	-179.9	0	0	0	0	112.5	F499 F510 Q514 K515 L516	F499-S512 VanDerWaalsContact CD2-C 3.49Å; F510-S512 PolarHBondContact O-N 3.14Å; S512-Q514 PolarHBondContact O-N 2.81Å; S512-Q514 VanDerWaalsContact O-N 3.12Å; S512-Q514 PolarHBondContact OG-N 3.46Å; S512-K515 WeakPolarHBondContact O-CA 3.32Å; S512-K515 WeakPolarHBondContact O-CB 3.36Å; S512-K515 PolarHBondContact O-N 2.97Å; S512-L516 PolarHBondContact O-N 3.01Å
513	R	71.4	Confident	68.9	Low	179 Å²	179	86.2 Å²	86.2	68%	0.675	47%	0.467	S	S	*	.	H	α-helix	trans	-56.2	-25.4	170.4	-178.1	175.6	-90.5	175.7	-8.5	112.5	F499 K517	F499-R513 HydrophobicContact CD1-CB 4.1Å; F499-R513 HydrophobicContact CD2-CB 4.09Å; F499-R513 HydrophobicContact CE1-CB 3.95Å; F499-R513 HydrophobicContact CE1-CG 4.5Å; F499-R513 HydrophobicContact CE2-CB 3.93Å; F499-R513 HydrophobicContact CG-CB 4.17Å; F499-R513 HydrophobicContact CZ-CB 3.87Å; R513-K517 WeakPolarHBondContact O-CB 3.41Å; R513-K517 PolarHBondContact O-N 3.19Å
514	Q	70.3	Confident	68.8	Low	157 Å²	157	84 Å²	84	73%	0.734	47%	0.465	S	S	*	.	H	α-helix	trans	-71.9	-41.6	172.3	-65.1	-173.5	2.9	0	0	112.2	S512 K517 V518	S512-Q514 PolarHBondContact O-N 2.81Å; S512-Q514 VanDerWaalsContact O-N 3.12Å; S512-Q514 PolarHBondContact OG-N 3.46Å; Q514-K517 PolarHBondContact O-N 3.01Å; Q514-V518 WeakPolarHBondContact O-CG2 3.41Å; Q514-V518 PolarHBondContact O-N 3.32Å
515	K	71.3	Confident	68.8	Low	75 Å²	75	87.3 Å²	87.3	33%	0.326	47%	0.469	S	S	.	.	H	α-helix	trans	-66.3	-44.2	175.4	-73.9	171.7	165.8	179.7	0	110.9	F510 D511 S512 K517 V518 H519	F510-K515 HydrophobicContact CB-CB 3.91Å; F510-K515 HydrophobicContact CD1-CB 3.82Å; F510-K515 HydrophobicContact CG-CB 4.1Å; D511-K515 WeakPolarHBondContact OD1-CD 3.42Å; D511-K515 WeakPolarHBondContact OD1-CE 3.23Å; D511-K515 IonicContact OD1-NZ 2.75Å; D511-K515 PolarHBondContact OD1-NZ 3.25Å; D511-K515 IonicContact OD2-NZ 2.62Å; D511-K515 PolarHBondContact OD2-NZ 3.27Å; S512-K515 WeakPolarHBondContact O-CA 3.32Å; S512-K515 WeakPolarHBondContact O-CB 3.36Å; S512-K515 PolarHBondContact O-N 2.97Å; K515-K517 PolarHBondContact O-N 3.2Å; K515-V518 PolarHBondContact O-N 2.99Å; K515-H519 PolarHBondContact O-N 2.82Å
516	L	75.7	Confident	68.6	Low	18 Å²	18	90.1 Å²	90.1	9%	0.094	46%	0.459	C	S	.	.	H	α-helix	trans	-59.2	-46.3	170.7	176.6	63.4	0	0	0	111.3	F499 A500 C501 F510 S512 V518 H519 L520	F499-L516 HydrophobicContact CB-CB 3.94Å; F499-L516 HydrophobicContact CB-CD2 3.71Å; F499-L516 HydrophobicContact CB-CG 4.41Å; A500-L516 WeakPolarHBondContact O-CD2 3.38Å; C501-L516 HydrophobicContact CB-CD1 4.27Å; F510-L516 HydrophobicContact CB-CB 4.27Å; F510-L516 HydrophobicContact CD2-CB 4.03Å; F510-L516 HydrophobicContact CD2-CD1 3.91Å; F510-L516 HydrophobicContact CE2-CD1 4.25Å; F510-L516 HydrophobicContact CG-CB 4.4Å; S512-L516 PolarHBondContact O-N 3.01Å; L516-V518 PolarHBondContact O-N 2.6Å; L516-H519 CarbonylContact O-C 3.58Å; L516-H519 WeakPolarHBondContact O-CA 3.49Å; L516-H519 WeakPolarHBondContact O-CB 3.43Å; L516-H519 PolarHBondContact O-N 2.77Å; L516-L520 HydrophobicContact CD1-CD1 4.14Å; L516-L520 HydrophobicContact CD1-CD2 4.12Å; L516-L520 HydrophobicContact CD1-CG 3.85Å; L516-L520 HydrophobicContact CD2-CD1 4.3Å; L516-L520 HydrophobicContact CG-CD1 3.87Å; L516-L520 HydrophobicContact CG-CG 4.08Å; L516-L520 WeakPolarHBondContact O-CG 3.19Å; L516-L520 PolarHBondContact O-N 3.33Å
517	K	69.9	Low	68.1	Low	153 Å²	153	90.8 Å²	90.8	67%	0.665	46%	0.463	S	S	*	.	H	α-helix	trans	-62.3	-28.7	178.4	-172.4	166.6	-175.5	170.5	0	113	R513 Q514 K515 L521	R513-K517 WeakPolarHBondContact O-CB 3.41Å; R513-K517 PolarHBondContact O-N 3.19Å; Q514-K517 PolarHBondContact O-N 3.01Å; K515-K517 PolarHBondContact O-N 3.2Å; K517-L521 WeakPolarHBondContact O-CG 3.32Å
518	V	70.1	Confident	67.5	Low	85 Å²	85	91.8 Å²	91.8	52%	0.515	45%	0.447	S	S	.	.	H	α-helix	trans	-74.6	-37.8	169.9	169.1	0	0	0	0	111.6	Q514 K515 L516 L521 Y522	Q514-V518 WeakPolarHBondContact O-CG2 3.41Å; Q514-V518 PolarHBondContact O-N 3.32Å; K515-V518 PolarHBondContact O-N 2.99Å; L516-V518 PolarHBondContact O-N 2.6Å; V518-L521 WeakPolarHBondContact O-CB 3.44Å; V518-L521 PolarHBondContact O-N 3.12Å; V518-Y522 HydrophobicContact CG1-CE2 4.26Å; V518-Y522 VanDerWaalsContact O-CD2 3.23Å; V518-Y522 WeakPolarHBondContact O-CD2 3.49Å; V518-Y522 WeakPolarHBondContact O-CE2 3.25Å
519	H	71.1	Confident	67.2	Low	26 Å²	26	94.3 Å²	94.3	12%	0.12	46%	0.462	C	S	.	.	H	α-helix	trans	-67.2	-39.6	177	175.8	74.3	0	0	0	113.5	C506 S508 F510 K515 L516 L521 Y522 H523	C506-H519 VanDerWaalsContact SG-CE1 3.56Å; C506-H519 PolarHBondContact SG-NE2 3.47Å; C506-H519 VanDerWaalsContact SG-NE2 3.38Å; S508-H519 VanDerWaalsContact CB-CE1 3.41Å; S508-H519 WeakPolarHBondContact CB-CE1 3.35Å; S508-H519 WeakPolarHBondContact CB-NE2 3.04Å; S508-H519 PolarHBondContact OG-CE1 3.33Å; F510-H519 HydrophobicContact CD2-CB 4.26Å; F510-H519 HydrophobicContact CE1-CB 4.2Å; F510-H519 HydrophobicContact CE2-CB 3.49Å; F510-H519 VanDerWaalsContact CE2-CB 3.49Å; F510-H519 AromaticContact CE2-CD2 3.38Å; F510-H519 WeakPolarHBondContact CE2-CD2 3.4Å; F510-H519 AromaticContact CE2-CG 3.3Å; F510-H519 AromaticContact CE2-ND1 3.86Å; F510-H519 AromaticContact CE2-NE2 3.94Å; F510-H519 HydrophobicContact CZ-CB 3.46Å; F510-H519 VanDerWaalsContact CZ-CB 3.46Å; F510-H519 AromaticContact CZ-CD2 3.85Å; F510-H519 AromaticContact CZ-CG 3.32Å; F510-H519 AromaticContact CZ-ND1 3.48Å; F510-H519 WeakPolarHBondContact CZ-ND1 3.44Å; K515-H519 PolarHBondContact O-N 2.82Å; L516-H519 CarbonylContact O-C 3.58Å; L516-H519 WeakPolarHBondContact O-CA 3.49Å; L516-H519 WeakPolarHBondContact O-CB 3.43Å; L516-H519 PolarHBondContact O-N 2.77Å; H519-L521 PolarHBondContact O-N 3.27Å; H519-Y522 WeakPolarHBondContact O-CB 3.26Å; H519-Y522 WeakPolarHBondContact O-CD2 3.21Å; H519-Y522 PolarHBondContact O-N 2.91Å; H519-H523 AromaticContact CD2-CD2 3.94Å; H519-H523 AromaticContact CD2-NE2 3.63Å; H519-H523 AromaticContact CE1-NE2 3.37Å; H519-H523 PolarHBondContact CE1-NE2 3.23Å; H519-H523 AromaticContact NE2-CD2 3.64Å; H519-H523 AromaticContact NE2-CE1 3.89Å; H519-H523 AromaticContact NE2-NE2 2.87Å; H519-H523 PolarHBondContact NE2-NE2 3.44Å
520	L	67.8	Low	66.8	Low	52 Å²	52	96.1 Å²	96.1	27%	0.272	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-62.7	-22.7	177	-66.3	170.3	0	0	0	112.9	E503 L516 Y522 H523 A524	E503-L520 HydrophobicContact CG-CD2 4.29Å; L516-L520 HydrophobicContact CD1-CD1 4.14Å; L516-L520 HydrophobicContact CD1-CD2 4.12Å; L516-L520 HydrophobicContact CD1-CG 3.85Å; L516-L520 HydrophobicContact CD2-CD1 4.3Å; L516-L520 HydrophobicContact CG-CD1 3.87Å; L516-L520 HydrophobicContact CG-CG 4.08Å; L516-L520 WeakPolarHBondContact O-CG 3.19Å; L516-L520 PolarHBondContact O-N 3.33Å; L520-Y522 PolarHBondContact O-N 3.31Å; L520-H523 PolarHBondContact O-N 3.41Å; L520-A524 PolarHBondContact O-N 3.32Å; L520-A524 VanDerWaalsContact O-N 3.12Å
521	L	68.4	Low	66.2	Low	80 Å²	80	98.9 Å²	98.9	42%	0.419	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-72.8	1.1	170.8	-59.4	168.9	0	0	0	113.8	K517 V518 H519 P527 A542	K517-L521 WeakPolarHBondContact O-CG 3.32Å; V518-L521 WeakPolarHBondContact O-CB 3.44Å; V518-L521 PolarHBondContact O-N 3.12Å; H519-L521 PolarHBondContact O-N 3.27Å; L521-P527 HydrophobicContact CD2-CG 3.75Å; L521-A542 HydrophobicContact CD1-CB 4.38Å
522	Y	57.3	Low	66	Low	184 Å²	184	94.8 Å²	94.8	72%	0.722	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-101.5	-17.9	169.7	-66.3	-103.6	0	0	0	112.9	V518 H519 L520	V518-Y522 HydrophobicContact CG1-CE2 4.26Å; V518-Y522 VanDerWaalsContact O-CD2 3.23Å; V518-Y522 WeakPolarHBondContact O-CD2 3.49Å; V518-Y522 WeakPolarHBondContact O-CE2 3.25Å; H519-Y522 WeakPolarHBondContact O-CB 3.26Å; H519-Y522 WeakPolarHBondContact O-CD2 3.21Å; H519-Y522 PolarHBondContact O-N 2.91Å; L520-Y522 PolarHBondContact O-N 3.31Å
523	H	65.9	Low	65.6	Low	59 Å²	59	102.7 Å²	102.7	27%	0.273	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-35	177.6	-63.5	-51.6	0	0	0	113.1	C501 E503 C506 H519 L520 E525	C501-H523 PolarHBondContact SG-CD2 3.23Å; C501-H523 PolarHBondContact SG-NE2 3.12Å; C501-H523 VanDerWaalsContact SG-NE2 3.4Å; E503-H523 HydrophobicContact CB-CB 4.46Å; E503-H523 HydrophobicContact CG-CB 3.79Å; C506-H523 VanDerWaalsContact CB-CE1 3.43Å; C506-H523 WeakPolarHBondContact CB-CE1 3.4Å; C506-H523 WeakPolarHBondContact CB-NE2 3.17Å; C506-H523 PolarHBondContact SG-CE1 2.76Å; C506-H523 PolarHBondContact SG-NE2 2.87Å; C506-H523 VanDerWaalsContact SG-NE2 3.36Å; H519-H523 AromaticContact CD2-CD2 3.94Å; H519-H523 AromaticContact CD2-NE2 3.63Å; H519-H523 AromaticContact CE1-NE2 3.37Å; H519-H523 PolarHBondContact CE1-NE2 3.23Å; H519-H523 AromaticContact NE2-CD2 3.64Å; H519-H523 AromaticContact NE2-CE1 3.89Å; H519-H523 AromaticContact NE2-NE2 2.87Å; H519-H523 PolarHBondContact NE2-NE2 3.44Å; L520-H523 PolarHBondContact O-N 3.41Å; H523-E525 PolarHBondContact O-N 3.01Å
524	A	63	Low	65.3	Low	47 Å²	47	96.6 Å²	96.6	39%	0.388	46%	0.462	S	S	.	.	S	Bend	trans	-65.2	107.1	168	0	0	0	0	0	108.3	L520 E526 P527	L520-A524 PolarHBondContact O-N 3.32Å; L520-A524 VanDerWaalsContact O-N 3.12Å; A524-E526 PolarHBondContact O-N 2.85Å; A524-P527 HydrophobicContact CB-CG 3.85Å; A524-P527 WeakPolarHBondContact O-CD 3.24Å
525	E	57.8	Low	64.1	Low	197 Å²	197	98 Å²	98	92%	0.921	47%	0.469	S	S	*	.	S	Bend	trans	-65.3	-25.6	-171.5	-65.7	-160.1	118	0	0	113.1	H523	H523-E525 PolarHBondContact O-N 3.01Å
526	E	55.4	Low	63.3	Low	146 Å²	146	98.5 Å²	98.5	68%	0.682	50%	0.496	S	S	*	.			trans	-129.1	100.1	164.8	-81.1	-99.2	-168	0	0	110.5	A524	A524-E526 PolarHBondContact O-N 2.85Å
527	P	58.2	Low	62.4	Low	43 Å²	43	98.4 Å²	98.4	28%	0.279	50%	0.497	S	S	.	.				-140.2	74	129.9	38.9	-27.4	0	0	0	110.8	L521 A524 P529	L521-P527 HydrophobicContact CD2-CG 3.75Å; A524-P527 HydrophobicContact CB-CG 3.85Å; A524-P527 WeakPolarHBondContact O-CD 3.24Å; P527-P529 WeakPolarHBondContact O-CD 3.17Å
528	R	55.7	Low	61.9	Low	148 Å²	148	95.3 Å²	95.3	56%	0.558	51%	0.508	S	S	*	.			trans	-109.2	56.2	161.9	-58.6	177.4	179.8	-135.8	12.6	110.7	Y530 Q531 A540	R528-Y530 CarbonylContact O-C 3.47Å; R528-Y530 PolarHBondContact O-N 2.81Å; R528-Q531 VanDerWaalsContact O-CG 3.3Å; R528-Q531 WeakPolarHBondContact O-CG 3.36Å; R528-Q531 PolarHBondContact O-N 3.35Å; R528-A540 HydrophobicContact CB-CB 3.59Å; R528-A540 HydrophobicContact CG-CB 4.37Å; R528-A540 PolarHBondContact NH1-O 2.82Å
529	P	60.5	Low	61.6	Low	94 Å²	94	99.3 Å²	99.3	61%	0.61	51%	0.514	S	S	*	.			trans	-61.9	-17.9	-171.1	28.5	-37.4	0	0	0	113.1	P527 Q531	P527-P529 WeakPolarHBondContact O-CD 3.17Å; P529-Q531 VanDerWaalsContact C-N 3.25Å; P529-Q531 PolarHBondContact O-N 2.98Å; P529-Q531 VanDerWaalsContact O-N 3.14Å
530	Y	62.4	Low	61.5	Low	95 Å²	95	99 Å²	99	37%	0.373	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	65.7	173.3	-50.8	-72.6	0	0	0	110.2	R528 F541 S544 L547	R528-Y530 CarbonylContact O-C 3.47Å; R528-Y530 PolarHBondContact O-N 2.81Å; Y530-F541 WeakPolarHBondContact CB-O 3.43Å; Y530-F541 PolarHBondContact N-O 3.21Å; Y530-F541 PolarHBondContact O-N 3.24Å; Y530-S544 VanDerWaalsContact CE1-CB 3.49Å; Y530-L547 HydrophobicContact CD1-CD2 4.49Å
531	Q	67.6	Low	61.8	Low	103 Å²	103	98 Å²	98	48%	0.481	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	144.5	170	-55	-166.6	-1.8	0	0	110.9	R528 P529 A540 L547	R528-Q531 VanDerWaalsContact O-CG 3.3Å; R528-Q531 WeakPolarHBondContact O-CG 3.36Å; R528-Q531 PolarHBondContact O-N 3.35Å; P529-Q531 VanDerWaalsContact C-N 3.25Å; P529-Q531 PolarHBondContact O-N 2.98Å; P529-Q531 VanDerWaalsContact O-N 3.14Å; Q531-A540 HydrophobicContact CB-CB 4.31Å; Q531-A540 HydrophobicContact CG-CB 3.86Å; Q531-L547 WeakPolarHBondContact O-CD2 3.42Å
532	C	71.3	Confident	61.9	Low	14 Å²	14	96.7 Å²	96.7	10%	0.095	51%	0.51	C	S	.	.			trans	-77.9	121.1	172.5	-168	0	0	0	0	110.7	V534 C537 W539 L547 H550 H554	C532-V534 PolarHBondContact O-N 3.35Å; C532-C537 WeakPolarHBondContact CB-O 3.42Å; C532-W539 WeakPolarHBondContact CB-O 3.42Å; C532-W539 PolarHBondContact N-O 3.38Å; C532-L547 HydrophobicContact CB-CD1 3.99Å; C532-H550 VanDerWaalsContact SG-CD2 3.59Å; C532-H554 PolarHBondContact SG-CD2 2.85Å; C532-H554 PolarHBondContact SG-NE2 3.13Å
533	K	66.1	Low	62.7	Low	201 Å²	201	91 Å²	91	87%	0.874	50%	0.495	S	S	*	.			trans	-88.3	26	178.5	-58.7	-169.8	176.5	-169.4	0	113.3
534	V	66.8	Low	62.8	Low	51 Å²	51	91.2 Å²	91.2	31%	0.309	50%	0.503	S	S	.	.	S	Bend	trans	-101.4	124.5	179.3	178.9	0	0	0	0	108.6	C532 G536 C537 L551 H554	C532-V534 PolarHBondContact O-N 3.35Å; V534-G536 PolarHBondContact O-N 3.24Å; V534-C537 WeakPolarHBondContact O-CB 3.23Å; V534-C537 PolarHBondContact O-N 3.33Å; V534-L551 HydrophobicContact CG2-CD2 3.96Å; V534-H554 HydrophobicContact CG1-CB 4.17Å; V534-H554 HydrophobicContact CG2-CB 4.02Å
535	E	44.8	Very low	63.3	Low	186 Å²	186	96.2 Å²	96.2	87%	0.869	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	132.6	-179.2	-73.8	-55	142.3	0	0	112.5
536	G	52.9	Low	64	Low	87 Å²	87	91.1 Å²	91.1	90%	0.897	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.7	7	-173.1	0	0	0	0	0	115.8	V534	V534-G536 PolarHBondContact O-N 3.24Å
537	C	58.2	Low	64.8	Low	16 Å²	16	85.2 Å²	85.2	11%	0.108	46%	0.46	C	S	.	.			trans	-126.9	81.5	-179.1	-156.5	0	0	0	0	115.8	C532 V534 W539 H550 H554	C532-C537 WeakPolarHBondContact CB-O 3.42Å; V534-C537 WeakPolarHBondContact O-CB 3.23Å; V534-C537 PolarHBondContact O-N 3.33Å; C537-W539 PolarHBondContact O-N 3.28Å; C537-H550 VanDerWaalsContact SG-CE1 3.58Å; C537-H550 PolarHBondContact SG-NE2 3.42Å; C537-H550 VanDerWaalsContact SG-NE2 3.39Å; C537-H554 VanDerWaalsContact CB-CE1 3.45Å; C537-H554 WeakPolarHBondContact CB-CE1 3.35Å; C537-H554 PolarHBondContact SG-CE1 3.04Å; C537-H554 PolarHBondContact SG-NE2 3.28Å
538	G	58.4	Low	65.5	Low	87 Å²	87	90.4 Å²	90.4	90%	0.897	48%	0.479	S	S	*	.			trans	-70.2	39.4	171.7	0	0	0	0	0	115.9
539	W	63.3	Low	66.1	Low	169 Å²	169	89.3 Å²	89.3	64%	0.64	47%	0.474	S	S	*	.			trans	-91.5	108.8	176.7	-80.4	66.5	0	0	0	110.8	C532 C537 F541 H550	C532-W539 WeakPolarHBondContact CB-O 3.42Å; C532-W539 PolarHBondContact N-O 3.38Å; C537-W539 PolarHBondContact O-N 3.28Å; W539-F541 HydrophobicContact CB-CE2 3.85Å; W539-F541 HydrophobicContact CB-CZ 3.98Å; W539-F541 HydrophobicContact CE3-CE1 4.17Å; W539-F541 AromaticContact CE3-CZ 3.84Å; W539-F541 HydrophobicContact CE3-CZ 3.84Å; W539-F541 WeakPolarHBondContact O-CE2 3.4Å; W539-H550 WeakPolarHBondContact CB-NE2 3.31Å; W539-H550 AromaticContact CG-CE1 3.76Å
540	A	69.4	Low	66.7	Low	21 Å²	21	86 Å²	86	17%	0.174	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	137.5	178.8	0	0	0	0	0	112.3	R528 Q531	R528-A540 HydrophobicContact CB-CB 3.59Å; R528-A540 HydrophobicContact CG-CB 4.37Å; R528-A540 PolarHBondContact NH1-O 2.82Å; Q531-A540 HydrophobicContact CB-CB 4.31Å; Q531-A540 HydrophobicContact CG-CB 3.86Å
541	F	75.6	Confident	67	Low	31 Å²	31	84 Å²	84	14%	0.136	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	144.8	-171.6	-58.3	-89.1	0	0	0	112.7	Y530 W539 T543 K546 L547 H550	Y530-F541 WeakPolarHBondContact CB-O 3.43Å; Y530-F541 PolarHBondContact N-O 3.21Å; Y530-F541 PolarHBondContact O-N 3.24Å; W539-F541 HydrophobicContact CB-CE2 3.85Å; W539-F541 HydrophobicContact CB-CZ 3.98Å; W539-F541 HydrophobicContact CE3-CE1 4.17Å; W539-F541 AromaticContact CE3-CZ 3.84Å; W539-F541 HydrophobicContact CE3-CZ 3.84Å; W539-F541 WeakPolarHBondContact O-CE2 3.4Å; F541-T543 PolarHBondContact O-N 2.79Å; F541-K546 HydrophobicContact CB-CB 4.02Å; F541-K546 HydrophobicContact CD1-CB 3.74Å; F541-K546 HydrophobicContact CG-CB 4.05Å; F541-L547 HydrophobicContact CB-CB 4.46Å; F541-L547 HydrophobicContact CD2-CB 3.97Å; F541-L547 HydrophobicContact CD2-CD1 4.02Å; F541-L547 HydrophobicContact CE2-CD1 4.25Å; F541-L547 HydrophobicContact CG-CB 4.47Å; F541-H550 HydrophobicContact CE1-CB 4.42Å; F541-H550 HydrophobicContact CE2-CB 3.66Å; F541-H550 AromaticContact CE2-CD2 3.43Å; F541-H550 VanDerWaalsContact CE2-CD2 3.43Å; F541-H550 WeakPolarHBondContact CE2-CD2 3.49Å; F541-H550 AromaticContact CE2-CG 3.47Å; F541-H550 VanDerWaalsContact CE2-CG 3.47Å; F541-H550 HydrophobicContact CZ-CB 3.55Å; F541-H550 AromaticContact CZ-CD2 3.84Å; F541-H550 AromaticContact CZ-CG 3.42Å; F541-H550 VanDerWaalsContact CZ-CG 3.42Å; F541-H550 AromaticContact CZ-ND1 3.7Å
542	A	70.1	Confident	67.1	Low	52 Å²	52	81.6 Å²	81.6	43%	0.43	44%	0.435	S	S	.	.	S	Bend	trans	-76.8	9	172.7	0	0	0	0	0	114.1	L521	L521-A542 HydrophobicContact CD1-CB 4.38Å
543	T	73.8	Confident	66.8	Low	65 Å²	65	84.2 Å²	84.2	40%	0.399	45%	0.453	S	S	.	.	S	Bend	trans	-157	135.4	179.6	-19.8	0	0	0	0	112.8	F541 Y545 K546 L547	F541-T543 PolarHBondContact O-N 2.79Å; T543-Y545 VanDerWaalsContact C-N 3.28Å; T543-Y545 PolarHBondContact O-N 2.99Å; T543-K546 WeakPolarHBondContact O-CB 3.37Å; T543-K546 PolarHBondContact O-N 2.82Å; T543-L547 PolarHBondContact O-N 2.76Å; T543-L547 VanDerWaalsContact O-N 3.15Å
544	S	68.6	Low	66.7	Low	62 Å²	62	77.3 Å²	77.3	43%	0.434	42%	0.424	S	S	.	.	H	α-helix	trans	-52.4	-41.8	177.7	56	0	0	0	0	113.3	Y530 K546 L547 K548	Y530-S544 VanDerWaalsContact CE1-CB 3.49Å; S544-K546 VanDerWaalsContact C-N 3.34Å; S544-K546 PolarHBondContact O-N 3.28Å; S544-L547 PolarHBondContact O-N 3.44Å; S544-K548 WeakPolarHBondContact O-CB 3.41Å; S544-K548 PolarHBondContact O-N 2.87Å
545	Y	73.4	Confident	66.2	Low	153 Å²	153	79.5 Å²	79.5	60%	0.6	43%	0.434	S	S	*	.	H	α-helix	trans	-61.9	-38	176.8	177.7	-116.8	0	0	0	113	T543 R549	T543-Y545 VanDerWaalsContact C-N 3.28Å; T543-Y545 PolarHBondContact O-N 2.99Å; Y545-R549 WeakPolarHBondContact O-CB 3.37Å; Y545-R549 PolarHBondContact O-N 2.84Å; Y545-R549 VanDerWaalsContact O-N 3.11Å
546	K	70.8	Confident	66.9	Low	90 Å²	90	79.1 Å²	79.1	39%	0.391	43%	0.43	S	S	.	.	H	α-helix	trans	-70.7	-38.8	178.3	-59.8	-71.8	-175.6	172.8	0	110.8	F541 T543 S544 H550	F541-K546 HydrophobicContact CB-CB 4.02Å; F541-K546 HydrophobicContact CD1-CB 3.74Å; F541-K546 HydrophobicContact CG-CB 4.05Å; T543-K546 WeakPolarHBondContact O-CB 3.37Å; T543-K546 PolarHBondContact O-N 2.82Å; S544-K546 VanDerWaalsContact C-N 3.34Å; S544-K546 PolarHBondContact O-N 3.28Å; K546-H550 WeakPolarHBondContact O-CB 3.32Å; K546-H550 PolarHBondContact O-N 3.33Å
547	L	74.1	Confident	66.7	Low	22 Å²	22	80.3 Å²	80.3	12%	0.115	41%	0.412	C	S	.	.	H	α-helix	trans	-65.5	-49.2	171.6	174.1	65.1	0	0	0	112	Y530 Q531 C532 F541 T543 S544 R549 H550 L551	Y530-L547 HydrophobicContact CD1-CD2 4.49Å; Q531-L547 WeakPolarHBondContact O-CD2 3.42Å; C532-L547 HydrophobicContact CB-CD1 3.99Å; F541-L547 HydrophobicContact CB-CB 4.46Å; F541-L547 HydrophobicContact CD2-CB 3.97Å; F541-L547 HydrophobicContact CD2-CD1 4.02Å; F541-L547 HydrophobicContact CE2-CD1 4.25Å; F541-L547 HydrophobicContact CG-CB 4.47Å; T543-L547 PolarHBondContact O-N 2.76Å; T543-L547 VanDerWaalsContact O-N 3.15Å; S544-L547 PolarHBondContact O-N 3.44Å; L547-R549 VanDerWaalsContact C-N 3.27Å; L547-R549 PolarHBondContact O-N 2.79Å; L547-H550 CarbonylContact O-C 3.49Å; L547-H550 WeakPolarHBondContact O-CA 3.38Å; L547-H550 WeakPolarHBondContact O-CB 3.49Å; L547-H550 PolarHBondContact O-N 2.82Å; L547-L551 HydrophobicContact CD1-CD1 4.12Å; L547-L551 HydrophobicContact CD1-CD2 4.29Å; L547-L551 HydrophobicContact CD1-CG 3.87Å; L547-L551 HydrophobicContact CD2-CD1 4.25Å; L547-L551 HydrophobicContact CG-CD1 3.85Å; L547-L551 HydrophobicContact CG-CG 4.1Å; L547-L551 PolarHBondContact O-N 2.82Å
548	K	71	Confident	66.6	Low	152 Å²	152	85.9 Å²	85.9	66%	0.661	43%	0.431	S	S	*	.	H	α-helix	trans	-56	-43.6	179.5	-179.6	172.8	-74.8	-167.7	0	111.4	S544 H550 L551 Q552	S544-K548 WeakPolarHBondContact O-CB 3.41Å; S544-K548 PolarHBondContact O-N 2.87Å; K548-H550 PolarHBondContact O-N 2.73Å; K548-L551 PolarHBondContact O-N 3.16Å; K548-Q552 WeakPolarHBondContact O-CB 3.4Å; K548-Q552 PolarHBondContact O-N 3.01Å; K548-Q552 VanDerWaalsContact O-N 3.1Å
549	R	68.9	Low	66.9	Low	125 Å²	125	84.7 Å²	84.7	47%	0.472	41%	0.407	S	S	.	.	H	α-helix	trans	-64.3	-22.8	173.8	-169.7	-171.8	67.9	146.8	7.3	113.8	Y545 L547	Y545-R549 WeakPolarHBondContact O-CB 3.37Å; Y545-R549 PolarHBondContact O-N 2.84Å; Y545-R549 VanDerWaalsContact O-N 3.11Å; L547-R549 VanDerWaalsContact C-N 3.27Å; L547-R549 PolarHBondContact O-N 2.79Å
550	H	73.2	Confident	67.2	Low	23 Å²	23	79.2 Å²	79.2	11%	0.106	39%	0.389	C	S	.	.	H	α-helix	trans	-90.5	-37.9	177.3	170.6	80	0	0	0	112.6	C532 C537 W539 F541 K546 L547 K548 Q552 S553 H554	C532-H550 VanDerWaalsContact SG-CD2 3.59Å; C537-H550 VanDerWaalsContact SG-CE1 3.58Å; C537-H550 PolarHBondContact SG-NE2 3.42Å; C537-H550 VanDerWaalsContact SG-NE2 3.39Å; W539-H550 WeakPolarHBondContact CB-NE2 3.31Å; W539-H550 AromaticContact CG-CE1 3.76Å; F541-H550 HydrophobicContact CE1-CB 4.42Å; F541-H550 HydrophobicContact CE2-CB 3.66Å; F541-H550 AromaticContact CE2-CD2 3.43Å; F541-H550 VanDerWaalsContact CE2-CD2 3.43Å; F541-H550 WeakPolarHBondContact CE2-CD2 3.49Å; F541-H550 AromaticContact CE2-CG 3.47Å; F541-H550 VanDerWaalsContact CE2-CG 3.47Å; F541-H550 HydrophobicContact CZ-CB 3.55Å; F541-H550 AromaticContact CZ-CD2 3.84Å; F541-H550 AromaticContact CZ-CG 3.42Å; F541-H550 VanDerWaalsContact CZ-CG 3.42Å; F541-H550 AromaticContact CZ-ND1 3.7Å; K546-H550 WeakPolarHBondContact O-CB 3.32Å; K546-H550 PolarHBondContact O-N 3.33Å; L547-H550 CarbonylContact O-C 3.49Å; L547-H550 WeakPolarHBondContact O-CA 3.38Å; L547-H550 WeakPolarHBondContact O-CB 3.49Å; L547-H550 PolarHBondContact O-N 2.82Å; K548-H550 PolarHBondContact O-N 2.73Å; H550-Q552 VanDerWaalsContact C-N 3.26Å; H550-Q552 PolarHBondContact O-N 3.41Å; H550-S553 WeakPolarHBondContact O-CA 3.37Å; H550-S553 WeakPolarHBondContact O-CB 3.34Å; H550-S553 PolarHBondContact O-N 2.65Å; H550-S553 PolarHBondContact O-OG 3.37Å; H550-H554 AromaticContact CD2-CD2 3.9Å; H550-H554 AromaticContact CD2-NE2 3.65Å; H550-H554 AromaticContact CE1-NE2 3.3Å; H550-H554 PolarHBondContact CE1-NE2 2.87Å; H550-H554 VanDerWaalsContact CE1-NE2 3.3Å; H550-H554 AromaticContact NE2-CD2 3.64Å; H550-H554 AromaticContact NE2-CE1 4Å; H550-H554 AromaticContact NE2-NE2 2.91Å; H550-H554 PolarHBondContact NE2-NE2 3.27Å; H550-H554 PolarHBondContact O-CD2 3.12Å; H550-H554 PolarHBondContact O-N 2.95Å
551	L	68.4	Low	67.3	Low	55 Å²	55	81 Å²	81	29%	0.288	40%	0.398	S	S	.	.	H	α-helix	trans	-56.9	-43.8	168.9	-68.9	169.1	0	0	0	110.4	V534 L547 K548 S553 H554 D555	V534-L551 HydrophobicContact CG2-CD2 3.96Å; L547-L551 HydrophobicContact CD1-CD1 4.12Å; L547-L551 HydrophobicContact CD1-CD2 4.29Å; L547-L551 HydrophobicContact CD1-CG 3.87Å; L547-L551 HydrophobicContact CD2-CD1 4.25Å; L547-L551 HydrophobicContact CG-CD1 3.85Å; L547-L551 HydrophobicContact CG-CG 4.1Å; L547-L551 PolarHBondContact O-N 2.82Å; K548-L551 PolarHBondContact O-N 3.16Å; L551-S553 PolarHBondContact O-N 3.11Å; L551-H554 WeakPolarHBondContact O-CA 3.4Å; L551-H554 WeakPolarHBondContact O-CB 3.49Å; L551-H554 PolarHBondContact O-N 2.83Å; L551-D555 VanDerWaalsContact O-CG 3.31Å; L551-D555 PolarHBondContact O-N 3.2Å; L551-D555 VanDerWaalsContact O-OD2 3.13Å
552	Q	69.3	Low	67.5	Low	51 Å²	51	80 Å²	80	24%	0.238	39%	0.394	C	S	.	.	H	α-helix	trans	-62	-6.7	171.9	-156.9	178.5	18.6	0	0	114.7	K548 H550 T572	K548-Q552 WeakPolarHBondContact O-CB 3.4Å; K548-Q552 PolarHBondContact O-N 3.01Å; K548-Q552 VanDerWaalsContact O-N 3.1Å; H550-Q552 VanDerWaalsContact C-N 3.26Å; H550-Q552 PolarHBondContact O-N 3.41Å; Q552-T572 HydrophobicContact CG-CG2 4.46Å; Q552-T572 PolarHBondContact NE2-O 3.43Å; Q552-T572 VanDerWaalsContact NE2-O 3.09Å; Q552-T572 PolarHBondContact OE1-O 3.07Å
553	S	65.9	Low	67.6	Low	69 Å²	69	85.6 Å²	85.6	48%	0.483	41%	0.411	S	S	.	.	H	α-helix	trans	-95.4	-21.1	168.2	75.3	0	0	0	0	113.9	H550 L551	H550-S553 WeakPolarHBondContact O-CA 3.37Å; H550-S553 WeakPolarHBondContact O-CB 3.34Å; H550-S553 PolarHBondContact O-N 2.65Å; H550-S553 PolarHBondContact O-OG 3.37Å; L551-S553 PolarHBondContact O-N 3.11Å
554	H	64	Low	67.5	Low	57 Å²	57	87.9 Å²	87.9	26%	0.264	42%	0.416	S	S	.	.	H	α-helix	trans	-80.8	-44.3	171.6	-71.2	-58.5	0	0	0	112.7	C532 V534 C537 H550 L551 K556	C532-H554 PolarHBondContact SG-CD2 2.85Å; C532-H554 PolarHBondContact SG-NE2 3.13Å; V534-H554 HydrophobicContact CG1-CB 4.17Å; V534-H554 HydrophobicContact CG2-CB 4.02Å; C537-H554 VanDerWaalsContact CB-CE1 3.45Å; C537-H554 WeakPolarHBondContact CB-CE1 3.35Å; C537-H554 PolarHBondContact SG-CE1 3.04Å; C537-H554 PolarHBondContact SG-NE2 3.28Å; H550-H554 AromaticContact CD2-CD2 3.9Å; H550-H554 AromaticContact CD2-NE2 3.65Å; H550-H554 AromaticContact CE1-NE2 3.3Å; H550-H554 PolarHBondContact CE1-NE2 2.87Å; H550-H554 VanDerWaalsContact CE1-NE2 3.3Å; H550-H554 AromaticContact NE2-CD2 3.64Å; H550-H554 AromaticContact NE2-CE1 4Å; H550-H554 AromaticContact NE2-NE2 2.91Å; H550-H554 PolarHBondContact NE2-NE2 3.27Å; H550-H554 PolarHBondContact O-CD2 3.12Å; H550-H554 PolarHBondContact O-N 2.95Å; L551-H554 WeakPolarHBondContact O-CA 3.4Å; L551-H554 WeakPolarHBondContact O-CB 3.49Å; L551-H554 PolarHBondContact O-N 2.83Å; H554-K556 PolarHBondContact O-N 3.47Å
555	D	56.9	Low	67.2	Low	97 Å²	97	93.1 Å²	93.1	52%	0.519	43%	0.433	S	S	.	.	S	Bend	trans	-60.1	-12.5	-178.1	-56.5	-37.1	0	0	0	113	L551 Q557	L551-D555 VanDerWaalsContact O-CG 3.31Å; L551-D555 PolarHBondContact O-N 3.2Å; L551-D555 VanDerWaalsContact O-OD2 3.13Å; D555-Q557 HydrophobicContact CB-CB 4.08Å; D555-Q557 HydrophobicContact CB-CG 3.96Å; D555-Q557 PolarHBondContact O-N 2.84Å
556	K	58.1	Low	66.5	Low	178 Å²	178	89.8 Å²	89.8	77%	0.774	45%	0.446	S	S	*	.			trans	56.3	-1.6	-168.3	-61.3	169	-171.3	167.3	0	114	H554 R558	H554-K556 PolarHBondContact O-N 3.47Å; K556-R558 VanDerWaalsContact C-N 3.27Å; K556-R558 PolarHBondContact O-N 3.39Å
557	Q	50.2	Low	66.5	Low	111 Å²	111	86.9 Å²	86.9	52%	0.519	44%	0.437	S	S	.	.			trans	-64.6	86.1	173.4	-65	-60.7	-5.6	0	0	110.4	D555 P559	D555-Q557 HydrophobicContact CB-CB 4.08Å; D555-Q557 HydrophobicContact CB-CG 3.96Å; D555-Q557 PolarHBondContact O-N 2.84Å; Q557-P559 WeakPolarHBondContact O-CD 3.4Å
558	R	56.3	Low	66.2	Low	134 Å²	134	88.9 Å²	88.9	51%	0.506	46%	0.462	S	S	.	.			trans	-91.2	89.9	159.3	-68.3	164.7	172	-116.4	7.5	105.8	K556 H560 R570 F571 T572	K556-R558 VanDerWaalsContact C-N 3.27Å; K556-R558 PolarHBondContact O-N 3.39Å; R558-H560 VanDerWaalsContact C-N 3.26Å; R558-H560 PolarHBondContact O-N 2.99Å; R558-R570 HydrophobicContact CB-CB 3.43Å; R558-R570 VanDerWaalsContact CB-CB 3.43Å; R558-R570 WeakPolarHBondContact CD-O 3.2Å; R558-R570 HydrophobicContact CG-CB 4.31Å; R558-R570 PolarHBondContact NH1-O 3.19Å; R558-R570 PolarHBondContact O-NE 3.24Å; R558-R570 PolarHBondContact O-NH2 3.26Å; R558-F571 CarbonylContact C-O 3.47Å; R558-F571 VanDerWaalsContact C-O 3.31Å; R558-F571 VanDerWaalsContact CA-O 3.26Å; R558-F571 WeakPolarHBondContact CA-O 3.46Å; R558-T572 HydrophobicContact CG-CG2 3.98Å
559	P	64	Low	66.1	Low	62 Å²	62	88.4 Å²	88.4	40%	0.403	46%	0.456	S	S	.	.			trans	-76.3	-23.6	-168.2	-10.3	29.8	0	0	0	110.9	Q557 T561 F571	Q557-P559 WeakPolarHBondContact O-CD 3.4Å; P559-T561 PolarHBondContact O-N 3.04Å; P559-F571 VanDerWaalsContact CD-O 3.32Å; P559-F571 WeakPolarHBondContact CD-O 3.36Å
560	H	69.8	Low	66.4	Low	54 Å²	54	87.9 Å²	87.9	25%	0.25	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	82.1	-174.6	-51.9	-57.7	0	0	0	108.9	R558 F571 V574 L577	R558-H560 VanDerWaalsContact C-N 3.26Å; R558-H560 PolarHBondContact O-N 2.99Å; H560-F571 HydrophobicContact CB-CB 4.38Å; H560-F571 PolarHBondContact N-O 3.39Å; H560-F571 PolarHBondContact O-N 3.21Å; H560-V574 PolarHBondContact CD2-N 3.05Å; H560-V574 WeakPolarHBondContact CE1-CG2 3.48Å; H560-L577 HydrophobicContact CB-CB 3.86Å; H560-L577 HydrophobicContact CB-CD2 3.75Å; H560-L577 HydrophobicContact CB-CG 4.34Å
561	T	71.4	Confident	66.6	Low	59 Å²	59	88.7 Å²	88.7	36%	0.362	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	144.3	165.2	31.3	0	0	0	0	110.8	P559 R570 L577	P559-T561 PolarHBondContact O-N 3.04Å; T561-R570 HydrophobicContact CG2-CG 3.83Å; T561-L577 WeakPolarHBondContact O-CD1 3.46Å; T561-L577 WeakPolarHBondContact O-CD2 3.26Å
562	C	78.3	Confident	66.6	Low	9 Å²	9	87.7 Å²	87.7	6%	0.061	45%	0.454	C	S	.	.			trans	-82.2	115.8	162.9	-169.8	0	0	0	0	108.8	F564 R569 F571 L577 H584	C562-F564 PolarHBondContact O-N 3.46Å; C562-R569 VanDerWaalsContact CB-O 3.29Å; C562-R569 WeakPolarHBondContact CB-O 3.43Å; C562-R569 PolarHBondContact N-O 3Å; C562-F571 HydrophobicContact CB-CE2 4.47Å; C562-L577 HydrophobicContact CB-CD1 3.95Å; C562-H584 PolarHBondContact SG-CD2 3.41Å; C562-H584 PolarHBondContact SG-NE2 2.9Å
563	E	73.4	Confident	66.7	Low	169 Å²	169	86.9 Å²	86.9	79%	0.79	45%	0.452	S	S	*	.			trans	-77.3	2.3	-180	-69.5	149.2	-168.5	0	0	112.8
564	F	71.1	Confident	67.1	Low	113 Å²	113	87.8 Å²	87.8	50%	0.496	46%	0.455	S	S	.	.	S	Bend	trans	-76.9	126.3	173.8	-167.6	-89.7	0	0	0	110.8	C562 C567 H584	C562-F564 PolarHBondContact O-N 3.46Å; F564-C567 HydrophobicContact CB-CB 4.33Å; F564-C567 HydrophobicContact CD1-CB 4.41Å; F564-C567 WeakPolarHBondContact O-CB 3.33Å; F564-C567 PolarHBondContact O-N 3.09Å; F564-H584 HydrophobicContact CB-CB 4.36Å; F564-H584 VanDerWaalsContact CB-CD2 3.43Å; F564-H584 WeakPolarHBondContact CB-CD2 3.4Å; F564-H584 HydrophobicContact CD1-CB 4.22Å; F564-H584 AromaticContact CD1-CG 3.84Å; F564-H584 AromaticContact CD1-ND1 3.89Å; F564-H584 HydrophobicContact CD2-CB 3.57Å; F564-H584 AromaticContact CD2-CG 3.98Å; F564-H584 HydrophobicContact CE1-CB 4.44Å; F564-H584 HydrophobicContact CE2-CB 3.82Å; F564-H584 HydrophobicContact CG-CB 3.77Å; F564-H584 AromaticContact CG-CD2 3.67Å; F564-H584 AromaticContact CG-CG 3.62Å; F564-H584 HydrophobicContact CZ-CB 4.25Å
565	E	61.8	Low	67.7	Low	172 Å²	172	93.9 Å²	93.9	80%	0.804	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	140.7	-174.5	-80.4	-57.2	152	0	0	113.7	C567	E565-C567 PolarHBondContact O-N 2.73Å
566	G	59.1	Low	68.7	Low	84 Å²	84	92.8 Å²	92.8	87%	0.866	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	-4.1	-174.4	0	0	0	0	0	116.1
567	C	72.1	Confident	69.6	Low	29 Å²	29	85.4 Å²	85.4	20%	0.196	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-48.6	-177.7	-168.4	0	0	0	0	113.5	F564 E565 R569 H580 H584	F564-C567 HydrophobicContact CB-CB 4.33Å; F564-C567 HydrophobicContact CD1-CB 4.41Å; F564-C567 WeakPolarHBondContact O-CB 3.33Å; F564-C567 PolarHBondContact O-N 3.09Å; E565-C567 PolarHBondContact O-N 2.73Å; C567-R569 PolarHBondContact O-N 2.94Å; C567-H580 PolarHBondContact SG-NE2 3.32Å; C567-H584 PolarHBondContact SG-CE1 3.33Å; C567-H584 PolarHBondContact SG-NE2 3.01Å
568	G	67	Low	70.9	Confident	63 Å²	63	86.9 Å²	86.9	65%	0.649	44%	0.444	S	S	*	.			trans	60.6	2	176.7	0	0	0	0	0	116.8	R570	G568-R570 PolarHBondContact O-N 3.06Å
569	R	70	Confident	71.9	Confident	142 Å²	142	83.1 Å²	83.1	54%	0.536	44%	0.442	S	S	.	.			trans	-72.8	129.4	-174.9	-70.7	179.6	-179.7	-167.1	-0.1	110.9	C562 C567 F571	C562-R569 VanDerWaalsContact CB-O 3.29Å; C562-R569 WeakPolarHBondContact CB-O 3.43Å; C562-R569 PolarHBondContact N-O 3Å; C567-R569 PolarHBondContact O-N 2.94Å; R569-F571 HydrophobicContact CB-CE2 3.6Å; R569-F571 HydrophobicContact CB-CZ 3.79Å; R569-F571 WeakPolarHBondContact O-CE2 3.48Å
570	R	73.8	Confident	72.6	Confident	114 Å²	114	81 Å²	81	43%	0.43	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	139.2	-179.2	-52.3	-177.7	59.1	160.8	-0.5	111.3	R558 T561 G568	R558-R570 HydrophobicContact CB-CB 3.43Å; R558-R570 VanDerWaalsContact CB-CB 3.43Å; R558-R570 WeakPolarHBondContact CD-O 3.2Å; R558-R570 HydrophobicContact CG-CB 4.31Å; R558-R570 PolarHBondContact NH1-O 3.19Å; R558-R570 PolarHBondContact O-NE 3.24Å; R558-R570 PolarHBondContact O-NH2 3.26Å; T561-R570 HydrophobicContact CG2-CG 3.83Å; G568-R570 PolarHBondContact O-N 3.06Å
571	F	77.9	Confident	72.9	Confident	41 Å²	41	80.1 Å²	80.1	18%	0.18	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	151.8	-175.8	-59.6	-90.5	0	0	0	112.1	R558 P559 H560 C562 R569 N576 L577 H580	R558-F571 CarbonylContact C-O 3.47Å; R558-F571 VanDerWaalsContact C-O 3.31Å; R558-F571 VanDerWaalsContact CA-O 3.26Å; R558-F571 WeakPolarHBondContact CA-O 3.46Å; P559-F571 VanDerWaalsContact CD-O 3.32Å; P559-F571 WeakPolarHBondContact CD-O 3.36Å; H560-F571 HydrophobicContact CB-CB 4.38Å; H560-F571 PolarHBondContact N-O 3.39Å; H560-F571 PolarHBondContact O-N 3.21Å; C562-F571 HydrophobicContact CB-CE2 4.47Å; R569-F571 HydrophobicContact CB-CE2 3.6Å; R569-F571 HydrophobicContact CB-CZ 3.79Å; R569-F571 WeakPolarHBondContact O-CE2 3.48Å; F571-N576 HydrophobicContact CB-CB 4.21Å; F571-N576 HydrophobicContact CD1-CB 3.96Å; F571-N576 HydrophobicContact CG-CB 4.4Å; F571-L577 HydrophobicContact CB-CB 4.28Å; F571-L577 HydrophobicContact CD2-CB 4.25Å; F571-L577 HydrophobicContact CD2-CD1 3.88Å; F571-L577 HydrophobicContact CE2-CD1 4.3Å; F571-L577 HydrophobicContact CG-CB 4.43Å; F571-H580 HydrophobicContact CE1-CB 4Å; F571-H580 HydrophobicContact CE2-CB 3.96Å; F571-H580 AromaticContact CE2-CD2 3.17Å; F571-H580 WeakPolarHBondContact CE2-CD2 3.37Å; F571-H580 AromaticContact CE2-CG 3.71Å; F571-H580 HydrophobicContact CZ-CB 3.57Å; F571-H580 AromaticContact CZ-CD2 3.24Å; F571-H580 WeakPolarHBondContact CZ-CD2 3.48Å; F571-H580 AromaticContact CZ-CG 3.32Å; F571-H580 AromaticContact CZ-NE2 3.99Å
572	T	67.8	Low	73.1	Confident	33 Å²	33	82.9 Å²	82.9	20%	0.202	43%	0.432	C	S	.	.	S	Bend	trans	-82.3	-14.8	177.7	48.5	0	0	0	0	113.6	Q552 R558	Q552-T572 HydrophobicContact CG-CG2 4.46Å; Q552-T572 PolarHBondContact NE2-O 3.43Å; Q552-T572 VanDerWaalsContact NE2-O 3.09Å; Q552-T572 PolarHBondContact OE1-O 3.07Å; R558-T572 HydrophobicContact CG-CG2 3.98Å
573	T	71.7	Confident	72.7	Confident	35 Å²	35	84.8 Å²	84.8	22%	0.215	44%	0.443	C	S	.	.	S	Bend	trans	-138.9	147.2	177.9	67.8	0	0	0	0	112.1	Y575 N576 L577	T573-Y575 PolarHBondContact O-N 2.91Å; T573-N576 PolarHBondContact O-N 3.03Å; T573-N576 VanDerWaalsContact O-N 3.16Å; T573-N576 WeakPolarHBondContact OG1-CB 3.46Å; T573-N576 PolarHBondContact OG1-N 3.44Å; T573-N576 PolarHBondContact OG1-ND2 2.92Å; T573-L577 PolarHBondContact O-N 3.48Å
574	V	74.1	Confident	72.5	Confident	87 Å²	87	78.9 Å²	78.9	53%	0.527	42%	0.415	S	S	.	.	H	α-helix	trans	-56.7	-36.8	173.3	-177	0	0	0	0	111.5	H560 L577 K578	H560-V574 PolarHBondContact CD2-N 3.05Å; H560-V574 WeakPolarHBondContact CE1-CG2 3.48Å; V574-L577 PolarHBondContact O-N 3.17Å; V574-K578 WeakPolarHBondContact O-CB 3.46Å; V574-K578 PolarHBondContact O-N 2.85Å
575	Y	77.1	Confident	72.4	Confident	186 Å²	186	79.5 Å²	79.5	73%	0.729	42%	0.42	S	S	*	.	H	α-helix	trans	-60.9	-45.8	176.6	-178.7	-92.7	0	0	0	112	T573 L577 K578 A579	T573-Y575 PolarHBondContact O-N 2.91Å; Y575-L577 VanDerWaalsContact C-N 3.35Å; Y575-K578 PolarHBondContact O-N 3.01Å; Y575-A579 VanDerWaalsContact O-CB 3.29Å; Y575-A579 WeakPolarHBondContact O-CB 3.38Å; Y575-A579 PolarHBondContact O-N 3.16Å
576	N	76.9	Confident	72.4	Confident	73 Å²	73	75.1 Å²	75.1	39%	0.39	40%	0.4	S	S	.	.	H	α-helix	trans	-69.5	-33.7	177.9	-69.8	-10.9	0	0	0	111.8	F571 T573 H580	F571-N576 HydrophobicContact CB-CB 4.21Å; F571-N576 HydrophobicContact CD1-CB 3.96Å; F571-N576 HydrophobicContact CG-CB 4.4Å; T573-N576 PolarHBondContact O-N 3.03Å; T573-N576 VanDerWaalsContact O-N 3.16Å; T573-N576 WeakPolarHBondContact OG1-CB 3.46Å; T573-N576 PolarHBondContact OG1-N 3.44Å; T573-N576 PolarHBondContact OG1-ND2 2.92Å; N576-H580 WeakPolarHBondContact O-CB 3.29Å; N576-H580 PolarHBondContact O-N 3.2Å; N576-H580 VanDerWaalsContact O-N 3.12Å
577	L	78	Confident	72.3	Confident	23 Å²	23	77.8 Å²	77.8	12%	0.12	39%	0.394	C	S	.	.	H	α-helix	trans	-63.7	-53.7	170.5	175.1	63.4	0	0	0	111	H560 T561 C562 F571 T573 V574 Y575 A579 H580 V581	H560-L577 HydrophobicContact CB-CB 3.86Å; H560-L577 HydrophobicContact CB-CD2 3.75Å; H560-L577 HydrophobicContact CB-CG 4.34Å; T561-L577 WeakPolarHBondContact O-CD1 3.46Å; T561-L577 WeakPolarHBondContact O-CD2 3.26Å; C562-L577 HydrophobicContact CB-CD1 3.95Å; F571-L577 HydrophobicContact CB-CB 4.28Å; F571-L577 HydrophobicContact CD2-CB 4.25Å; F571-L577 HydrophobicContact CD2-CD1 3.88Å; F571-L577 HydrophobicContact CE2-CD1 4.3Å; F571-L577 HydrophobicContact CG-CB 4.43Å; T573-L577 PolarHBondContact O-N 3.48Å; V574-L577 PolarHBondContact O-N 3.17Å; Y575-L577 VanDerWaalsContact C-N 3.35Å; L577-A579 VanDerWaalsContact C-N 3.29Å; L577-A579 PolarHBondContact O-N 3.37Å; L577-H580 CarbonylContact O-C 3.59Å; L577-H580 WeakPolarHBondContact O-CA 3.41Å; L577-H580 WeakPolarHBondContact O-CB 3.32Å; L577-H580 PolarHBondContact O-N 3.3Å; L577-V581 HydrophobicContact CD1-CG2 3.6Å; L577-V581 HydrophobicContact CG-CG2 3.94Å; L577-V581 WeakPolarHBondContact O-CG2 3.48Å; L577-V581 PolarHBondContact O-N 2.81Å
578	K	77.4	Confident	71.6	Confident	143 Å²	143	79.8 Å²	79.8	62%	0.622	40%	0.4	S	S	*	.	H	α-helix	trans	-61.9	-35.4	-179.2	-180	161.5	-74.1	-162.6	0	112.4	V574 Y575 H580 K582	V574-K578 WeakPolarHBondContact O-CB 3.46Å; V574-K578 PolarHBondContact O-N 2.85Å; Y575-K578 PolarHBondContact O-N 3.01Å; K578-H580 VanDerWaalsContact C-N 3.25Å; K578-H580 PolarHBondContact O-N 3.32Å; K578-K582 WeakPolarHBondContact O-CG 3.43Å; K578-K582 PolarHBondContact O-N 3.42Å
579	A	77.8	Confident	71.7	Confident	54 Å²	54	80.4 Å²	80.4	45%	0.446	40%	0.399	S	S	.	.	H	α-helix	trans	-67.2	-24.1	171.2	0	0	0	0	0	113.5	Y575 L577	Y575-A579 VanDerWaalsContact O-CB 3.29Å; Y575-A579 WeakPolarHBondContact O-CB 3.38Å; Y575-A579 PolarHBondContact O-N 3.16Å; L577-A579 VanDerWaalsContact C-N 3.29Å; L577-A579 PolarHBondContact O-N 3.37Å
580	H	78.9	Confident	71.7	Confident	17 Å²	17	77.8 Å²	77.8	8%	0.079	39%	0.392	C	S	.	.	H	α-helix	trans	-89.7	-38.1	175.1	173.5	48.6	0	0	0	113.7	C567 F571 N576 L577 K578 K582 V583 H584	C567-H580 PolarHBondContact SG-NE2 3.32Å; F571-H580 HydrophobicContact CE1-CB 4Å; F571-H580 HydrophobicContact CE2-CB 3.96Å; F571-H580 AromaticContact CE2-CD2 3.17Å; F571-H580 WeakPolarHBondContact CE2-CD2 3.37Å; F571-H580 AromaticContact CE2-CG 3.71Å; F571-H580 HydrophobicContact CZ-CB 3.57Å; F571-H580 AromaticContact CZ-CD2 3.24Å; F571-H580 WeakPolarHBondContact CZ-CD2 3.48Å; F571-H580 AromaticContact CZ-CG 3.32Å; F571-H580 AromaticContact CZ-NE2 3.99Å; N576-H580 WeakPolarHBondContact O-CB 3.29Å; N576-H580 PolarHBondContact O-N 3.2Å; N576-H580 VanDerWaalsContact O-N 3.12Å; L577-H580 CarbonylContact O-C 3.59Å; L577-H580 WeakPolarHBondContact O-CA 3.41Å; L577-H580 WeakPolarHBondContact O-CB 3.32Å; L577-H580 PolarHBondContact O-N 3.3Å; K578-H580 VanDerWaalsContact C-N 3.25Å; K578-H580 PolarHBondContact O-N 3.32Å; H580-K582 PolarHBondContact O-N 3.12Å; H580-V583 WeakPolarHBondContact O-CA 3.49Å; H580-V583 WeakPolarHBondContact O-CB 3.46Å; H580-V583 WeakPolarHBondContact O-CG2 3.5Å; H580-V583 PolarHBondContact O-N 3.31Å; H580-H584 AromaticContact CE1-CE1 3.63Å; H580-H584 AromaticContact CE1-NE2 3.32Å; H580-H584 PolarHBondContact CE1-NE2 3.26Å; H580-H584 VanDerWaalsContact CE1-NE2 3.32Å; H580-H584 AromaticContact NE2-CE1 3.85Å; H580-H584 AromaticContact NE2-NE2 3.16Å; H580-H584 PolarHBondContact NE2-NE2 2.93Å; H580-H584 VanDerWaalsContact NE2-NE2 3.16Å
581	V	75.3	Confident	71.9	Confident	37 Å²	37	74.8 Å²	74.8	22%	0.224	39%	0.386	C	S	.	.	H	α-helix	trans	-61.3	-35.1	175.5	175.7	0	0	0	0	109.9	L577 V583 H584 E585	L577-V581 HydrophobicContact CD1-CG2 3.6Å; L577-V581 HydrophobicContact CG-CG2 3.94Å; L577-V581 WeakPolarHBondContact O-CG2 3.48Å; L577-V581 PolarHBondContact O-N 2.81Å; V581-V583 PolarHBondContact O-N 3.25Å; V581-H584 WeakPolarHBondContact O-CA 3.41Å; V581-H584 PolarHBondContact O-N 3.09Å; V581-E585 HydrophobicContact CG1-CG 3.91Å; V581-E585 WeakPolarHBondContact O-CG 3.34Å; V581-E585 PolarHBondContact O-N 2.75Å
582	K	75.3	Confident	72.1	Confident	116 Å²	116	72.9 Å²	72.9	50%	0.504	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-9.2	165.8	-77.4	-173.6	175.5	-160.4	0	116.1	K578 H580 E585 Q586	K578-K582 WeakPolarHBondContact O-CG 3.43Å; K578-K582 PolarHBondContact O-N 3.42Å; H580-K582 PolarHBondContact O-N 3.12Å; K582-E585 WeakPolarHBondContact CA-OE2 3.46Å; K582-E585 VanDerWaalsContact CG-OE2 3.25Å; K582-E585 WeakPolarHBondContact CG-OE2 3.18Å; K582-E585 PolarHBondContact N-OE2 2.94Å; K582-Q586 WeakPolarHBondContact O-CB 3.46Å; K582-Q586 WeakPolarHBondContact O-CG 3.48Å; K582-Q586 PolarHBondContact O-N 2.91Å; K582-Q586 PolarHBondContact O-OE1 3.42Å
583	V	69.8	Low	72.5	Confident	49 Å²	49	79.1 Å²	79.1	30%	0.297	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-16.4	172.4	-172.5	0	0	0	0	111.3	H580 V581 R600	H580-V583 WeakPolarHBondContact O-CA 3.49Å; H580-V583 WeakPolarHBondContact O-CB 3.46Å; H580-V583 WeakPolarHBondContact O-CG2 3.5Å; H580-V583 PolarHBondContact O-N 3.31Å; V581-V583 PolarHBondContact O-N 3.25Å; V583-R600 PolarHBondContact O-NE 2.75Å; V583-R600 PolarHBondContact O-NH2 2.95Å
584	H	70.2	Confident	72.8	Confident	45 Å²	45	81.4 Å²	81.4	21%	0.208	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-42.6	171.8	-49.8	-53.6	0	0	0	111.4	C562 F564 C567 H580 V581 Q586	C562-H584 PolarHBondContact SG-CD2 3.41Å; C562-H584 PolarHBondContact SG-NE2 2.9Å; F564-H584 HydrophobicContact CB-CB 4.36Å; F564-H584 VanDerWaalsContact CB-CD2 3.43Å; F564-H584 WeakPolarHBondContact CB-CD2 3.4Å; F564-H584 HydrophobicContact CD1-CB 4.22Å; F564-H584 AromaticContact CD1-CG 3.84Å; F564-H584 AromaticContact CD1-ND1 3.89Å; F564-H584 HydrophobicContact CD2-CB 3.57Å; F564-H584 AromaticContact CD2-CG 3.98Å; F564-H584 HydrophobicContact CE1-CB 4.44Å; F564-H584 HydrophobicContact CE2-CB 3.82Å; F564-H584 HydrophobicContact CG-CB 3.77Å; F564-H584 AromaticContact CG-CD2 3.67Å; F564-H584 AromaticContact CG-CG 3.62Å; F564-H584 HydrophobicContact CZ-CB 4.25Å; C567-H584 PolarHBondContact SG-CE1 3.33Å; C567-H584 PolarHBondContact SG-NE2 3.01Å; H580-H584 AromaticContact CE1-CE1 3.63Å; H580-H584 AromaticContact CE1-NE2 3.32Å; H580-H584 PolarHBondContact CE1-NE2 3.26Å; H580-H584 VanDerWaalsContact CE1-NE2 3.32Å; H580-H584 AromaticContact NE2-CE1 3.85Å; H580-H584 AromaticContact NE2-NE2 3.16Å; H580-H584 PolarHBondContact NE2-NE2 2.93Å; H580-H584 VanDerWaalsContact NE2-NE2 3.16Å; V581-H584 WeakPolarHBondContact O-CA 3.41Å; V581-H584 PolarHBondContact O-N 3.09Å; H584-Q586 PolarHBondContact O-N 3.46Å
585	E	68.9	Low	73	Confident	126 Å²	126	79.7 Å²	79.7	59%	0.589	41%	0.41	S	S	*	.	S	Bend	trans	-65.2	-19.9	172.7	-60.5	166.9	153.1	0	0	112.9	V581 K582 D587	V581-E585 HydrophobicContact CG1-CG 3.91Å; V581-E585 WeakPolarHBondContact O-CG 3.34Å; V581-E585 PolarHBondContact O-N 2.75Å; K582-E585 WeakPolarHBondContact CA-OE2 3.46Å; K582-E585 VanDerWaalsContact CG-OE2 3.25Å; K582-E585 WeakPolarHBondContact CG-OE2 3.18Å; K582-E585 PolarHBondContact N-OE2 2.94Å; E585-D587 VanDerWaalsContact C-N 3.32Å; E585-D587 PolarHBondContact O-N 3.17Å
586	Q	62.5	Low	73.1	Confident	81 Å²	81	76.3 Å²	76.3	38%	0.379	40%	0.404	S	S	.	.	S	Bend	trans	-77.1	87.9	171.5	-85.5	175.4	-7.7	0	0	110.1	K582 H584 H588 R600	K582-Q586 WeakPolarHBondContact O-CB 3.46Å; K582-Q586 WeakPolarHBondContact O-CG 3.48Å; K582-Q586 PolarHBondContact O-N 2.91Å; K582-Q586 PolarHBondContact O-OE1 3.42Å; H584-Q586 PolarHBondContact O-N 3.46Å; Q586-H588 PolarHBondContact O-N 2.89Å; Q586-R600 HydrophobicContact CB-CB 4.18Å; Q586-R600 HydrophobicContact CB-CG 4.25Å; Q586-R600 PolarHBondContact OE1-O 3.03Å
587	D	55.5	Low	73	Confident	140 Å²	140	77 Å²	77	75%	0.749	41%	0.405	S	S	*	.			trans	-40	136.6	154.4	-97.3	-44.3	0	0	0	110.2	E585 A589	E585-D587 VanDerWaalsContact C-N 3.32Å; E585-D587 PolarHBondContact O-N 3.17Å; D587-A589 PolarHBondContact O-N 3.38Å
588	H	57.3	Low	73.1	Confident	70 Å²	70	82.3 Å²	82.3	32%	0.324	43%	0.427	S	S	.	.			trans	-80.7	55.9	-177.6	-65.8	-134.5	0	0	0	110.7	Q586 F590 K598 F599 R600	Q586-H588 PolarHBondContact O-N 2.89Å; H588-F590 PolarHBondContact O-N 3.48Å; H588-K598 HydrophobicContact CB-CB 3.38Å; H588-K598 HydrophobicContact CB-CD 4.31Å; H588-K598 PolarHBondContact ND1-O 2.86Å; H588-F599 CarbonylContact C-O 3.51Å; H588-R600 VanDerWaalsContact NE2-CZ 3.34Å; H588-R600 PolarHBondContact NE2-NH2 2.81Å
589	A	69.3	Low	73.1	Confident	77 Å²	77	76.9 Å²	76.9	64%	0.636	40%	0.404	S	S	*	.			trans	-63.3	-23.4	-172.7	0	0	0	0	0	114.1	D587 V591	D587-A589 PolarHBondContact O-N 3.38Å; A589-V591 PolarHBondContact O-N 2.91Å
590	F	70.8	Confident	72.8	Confident	87 Å²	87	78.3 Å²	78.3	38%	0.382	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	79.1	-178	-58	-78.9	0	0	0	110.5	H588 F599 S601 A602 L605	H588-F590 PolarHBondContact O-N 3.48Å; F590-F599 HydrophobicContact CB-CB 4.24Å; F590-F599 WeakPolarHBondContact CB-O 3.48Å; F590-F599 PolarHBondContact N-O 2.62Å; F590-F599 WeakPolarHBondContact O-CB 3.41Å; F590-F599 WeakPolarHBondContact O-CD2 3.12Å; F590-F599 PolarHBondContact O-N 2.8Å; F590-S601 VanDerWaalsContact CD2-C 3.45Å; F590-S601 VanDerWaalsContact CD2-CA 3.47Å; F590-A602 HydrophobicContact CD1-CB 3.85Å; F590-A602 HydrophobicContact CE1-CB 3.68Å; F590-A602 HydrophobicContact CG-CB 4.42Å; F590-A602 HydrophobicContact CZ-CB 4.1Å; F590-L605 HydrophobicContact CB-CB 3.92Å; F590-L605 HydrophobicContact CB-CD2 3.82Å; F590-L605 HydrophobicContact CB-CG 4.49Å
591	V	77.7	Confident	72.7	Confident	51 Å²	51	78.9 Å²	78.9	31%	0.309	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	140.1	175.3	-171.3	0	0	0	0	110.3	A589 N596 K598 L605	A589-V591 PolarHBondContact O-N 2.91Å; V591-N596 HydrophobicContact CG1-CB 4.31Å; V591-K598 HydrophobicContact CG1-CG 4.43Å; V591-K598 HydrophobicContact CG2-CB 4.44Å; V591-K598 HydrophobicContact CG2-CD 4.21Å; V591-K598 HydrophobicContact CG2-CG 4.02Å; V591-L605 WeakPolarHBondContact O-CD2 3.47Å
592	C	81.8	Confident	72.7	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	41%	0.413	C	S	.	.			trans	-87.8	112.3	169.5	-173.4	0	0	0	0	111	V594 C595 N596 E597 F599 L605 H612	C592-V594 PolarHBondContact O-N 3.06Å; C592-C595 PolarHBondContact O-N 2.81Å; C592-C595 VanDerWaalsContact O-N 3.16Å; C592-N596 VanDerWaalsContact O-CA 3.25Å; C592-N596 WeakPolarHBondContact O-CA 3.45Å; C592-N596 PolarHBondContact O-N 3.19Å; C592-E597 PolarHBondContact N-O 2.93Å; C592-F599 HydrophobicContact CB-CE2 3.95Å; C592-L605 VanDerWaalsContact CA-CD1 3.47Å; C592-L605 HydrophobicContact CB-CD1 3.44Å; C592-L605 VanDerWaalsContact CB-CD1 3.44Å; C592-H612 VanDerWaalsContact SG-CD2 3.53Å
593	E	76.9	Confident	72.8	Confident	165 Å²	165	78.7 Å²	78.7	77%	0.771	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-26.2	-179.7	-66.7	152.4	-166.8	0	0	114.4
594	V	76.9	Confident	73.1	Confident	83 Å²	83	82.8 Å²	82.8	50%	0.503	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-24.6	-176	-170.7	0	0	0	0	113.6	C592 H612 F613	C592-V594 PolarHBondContact O-N 3.06Å; V594-H612 HydrophobicContact CB-CB 4.28Å; V594-H612 HydrophobicContact CG1-CB 3.95Å; V594-H612 HydrophobicContact CG2-CB 4.3Å; V594-F613 HydrophobicContact CG2-CE2 4.49Å; V594-F613 HydrophobicContact CG2-CZ 4.39Å
595	C	79.3	Confident	73.6	Confident	51 Å²	51	81.6 Å²	81.6	35%	0.345	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.9	-4.7	-174.8	68.1	0	0	0	0	115.1	C592 E597 H608 H612	C592-C595 PolarHBondContact O-N 2.81Å; C592-C595 VanDerWaalsContact O-N 3.16Å; C595-E597 PolarHBondContact O-N 2.83Å; C595-E597 VanDerWaalsContact O-N 3.17Å; C595-E597 PolarHBondContact SG-N 3.26Å; C595-E597 VanDerWaalsContact SG-N 3.41Å; C595-H608 PolarHBondContact SG-NE2 2.86Å; C595-H612 PolarHBondContact SG-NE2 3.13Å; C595-H612 VanDerWaalsContact SG-NE2 3.43Å
596	N	78.1	Confident	73.9	Confident	114 Å²	114	77.5 Å²	77.5	61%	0.61	41%	0.41	S	S	*	.			trans	57.5	15.5	-174	-63.4	-68.9	0	0	0	116.4	V591 C592 K598	V591-N596 HydrophobicContact CG1-CB 4.31Å; C592-N596 VanDerWaalsContact O-CA 3.25Å; C592-N596 WeakPolarHBondContact O-CA 3.45Å; C592-N596 PolarHBondContact O-N 3.19Å; N596-K598 PolarHBondContact O-N 3.26Å
597	E	75.4	Confident	74.5	Confident	88 Å²	88	77.5 Å²	77.5	41%	0.411	41%	0.413	S	S	.	.			trans	-60.9	130.6	164.4	-76.4	-171.2	-160.5	0	0	109.9	C592 C595 F599 H608	C592-E597 PolarHBondContact N-O 2.93Å; C595-E597 PolarHBondContact O-N 2.83Å; C595-E597 VanDerWaalsContact O-N 3.17Å; C595-E597 PolarHBondContact SG-N 3.26Å; C595-E597 VanDerWaalsContact SG-N 3.41Å; E597-F599 HydrophobicContact CB-CE2 3.61Å; E597-F599 HydrophobicContact CB-CZ 3.57Å; E597-F599 WeakPolarHBondContact O-CD2 3.49Å; E597-F599 VanDerWaalsContact O-CE2 3.23Å; E597-F599 WeakPolarHBondContact O-CE2 3.13Å; E597-F599 WeakPolarHBondContact OE2-CZ 3.28Å; E597-H608 VanDerWaalsContact CD-CE1 3.46Å; E597-H608 IonicContact OE1-CE1 2.76Å; E597-H608 IonicContact OE2-CE1 2.98Å; E597-H608 PolarHBondContact OE2-CE1 3.17Å; E597-H608 IonicContact OE2-ND1 3.64Å; E597-H608 PolarHBondContact OE2-ND1 3.02Å
598	K	79.4	Confident	75.7	Confident	135 Å²	135	72.1 Å²	72.1	59%	0.587	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	122.8	-175.2	-46.4	-165.6	178	-174.4	0	111.6	H588 V591 N596	H588-K598 HydrophobicContact CB-CB 3.38Å; H588-K598 HydrophobicContact CB-CD 4.31Å; H588-K598 PolarHBondContact ND1-O 2.86Å; V591-K598 HydrophobicContact CG1-CG 4.43Å; V591-K598 HydrophobicContact CG2-CB 4.44Å; V591-K598 HydrophobicContact CG2-CD 4.21Å; V591-K598 HydrophobicContact CG2-CG 4.02Å; N596-K598 PolarHBondContact O-N 3.26Å
599	F	78.5	Confident	76.5	Confident	29 Å²	29	71.3 Å²	71.3	13%	0.127	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	144.7	-174.7	-61.5	-81.2	0	0	0	113.5	H588 F590 C592 E597 S601 R604 L605 H608	H588-F599 CarbonylContact C-O 3.51Å; F590-F599 HydrophobicContact CB-CB 4.24Å; F590-F599 WeakPolarHBondContact CB-O 3.48Å; F590-F599 PolarHBondContact N-O 2.62Å; F590-F599 WeakPolarHBondContact O-CB 3.41Å; F590-F599 WeakPolarHBondContact O-CD2 3.12Å; F590-F599 PolarHBondContact O-N 2.8Å; C592-F599 HydrophobicContact CB-CE2 3.95Å; E597-F599 HydrophobicContact CB-CE2 3.61Å; E597-F599 HydrophobicContact CB-CZ 3.57Å; E597-F599 WeakPolarHBondContact O-CD2 3.49Å; E597-F599 VanDerWaalsContact O-CE2 3.23Å; E597-F599 WeakPolarHBondContact O-CE2 3.13Å; E597-F599 WeakPolarHBondContact OE2-CZ 3.28Å; F599-S601 PolarHBondContact O-N 2.98Å; F599-R604 HydrophobicContact CB-CB 4.11Å; F599-R604 HydrophobicContact CD1-CB 3.98Å; F599-R604 HydrophobicContact CG-CB 4.32Å; F599-L605 HydrophobicContact CB-CB 4.17Å; F599-L605 HydrophobicContact CD2-CB 4.04Å; F599-L605 HydrophobicContact CD2-CD1 3.9Å; F599-L605 HydrophobicContact CE2-CD1 4.28Å; F599-L605 HydrophobicContact CG-CB 4.29Å; F599-H608 HydrophobicContact CE1-CB 3.93Å; F599-H608 HydrophobicContact CE2-CB 3.91Å; F599-H608 AromaticContact CE2-CD2 3.6Å; F599-H608 AromaticContact CE2-CG 3.63Å; F599-H608 HydrophobicContact CZ-CB 3.53Å; F599-H608 AromaticContact CZ-CD2 3.61Å; F599-H608 AromaticContact CZ-CE1 3.77Å; F599-H608 AromaticContact CZ-CG 3.21Å; F599-H608 AromaticContact CZ-ND1 3.34Å; F599-H608 VanDerWaalsContact CZ-ND1 3.34Å; F599-H608 WeakPolarHBondContact CZ-ND1 3.39Å; F599-H608 AromaticContact CZ-NE2 3.95Å
600	R	70.9	Confident	76.7	Confident	84 Å²	84	71.7 Å²	71.7	32%	0.317	36%	0.364	S	S	.	.	S	Bend	trans	-76.9	0.2	176.3	-65.1	179.6	171.5	97.2	-3.1	114.9	V583 Q586 H588	V583-R600 PolarHBondContact O-NE 2.75Å; V583-R600 PolarHBondContact O-NH2 2.95Å; Q586-R600 HydrophobicContact CB-CB 4.18Å; Q586-R600 HydrophobicContact CB-CG 4.25Å; Q586-R600 PolarHBondContact OE1-O 3.03Å; H588-R600 VanDerWaalsContact NE2-CZ 3.34Å; H588-R600 PolarHBondContact NE2-NH2 2.81Å
601	S	76.5	Confident	76.5	Confident	28 Å²	28	72.5 Å²	72.5	20%	0.196	38%	0.376	C	S	.	.	S	Bend	trans	-163.4	146.5	173.5	60.8	0	0	0	0	112.5	F590 F599 T603 R604 L605	F590-S601 VanDerWaalsContact CD2-C 3.45Å; F590-S601 VanDerWaalsContact CD2-CA 3.47Å; F599-S601 PolarHBondContact O-N 2.98Å; S601-T603 PolarHBondContact O-N 2.82Å; S601-R604 WeakPolarHBondContact O-CA 3.39Å; S601-R604 WeakPolarHBondContact O-CB 3.48Å; S601-R604 PolarHBondContact O-N 2.98Å; S601-R604 WeakPolarHBondContact OG-CG 3.4Å; S601-R604 PolarHBondContact OG-N 3Å; S601-L605 PolarHBondContact O-N 3.36Å
602	A	75	Confident	76.1	Confident	51 Å²	51	73.3 Å²	73.3	42%	0.421	38%	0.377	S	S	.	.	H	α-helix	trans	-51.2	-38.6	173.5	0	0	0	0	0	112.6	F590 R604 L605 A606	F590-A602 HydrophobicContact CD1-CB 3.85Å; F590-A602 HydrophobicContact CE1-CB 3.68Å; F590-A602 HydrophobicContact CG-CB 4.42Å; F590-A602 HydrophobicContact CZ-CB 4.1Å; A602-R604 VanDerWaalsContact C-N 3.31Å; A602-R604 PolarHBondContact O-N 3.24Å; A602-L605 PolarHBondContact O-N 2.92Å; A602-A606 WeakPolarHBondContact O-CB 3.31Å; A602-A606 PolarHBondContact O-N 3.13Å
603	T	78.4	Confident	75.2	Confident	99 Å²	99	80 Å²	80	61%	0.607	41%	0.406	S	S	*	.	H	α-helix	trans	-66.7	-29.6	177.4	-19.8	0	0	0	0	113	S601 N607	S601-T603 PolarHBondContact O-N 2.82Å; T603-N607 WeakPolarHBondContact O-CB 3.43Å; T603-N607 PolarHBondContact O-N 3.16Å; T603-N607 VanDerWaalsContact O-N 3.12Å; T603-N607 PolarHBondContact O-ND2 3.48Å; T603-N607 VanDerWaalsContact O-ND2 3.11Å; T603-N607 PolarHBondContact O-OD1 3.11Å
604	R	75.3	Confident	74.1	Confident	134 Å²	134	75.4 Å²	75.4	51%	0.506	40%	0.396	S	S	.	.	H	α-helix	trans	-76.6	-42.3	172.7	-77.3	-176.6	180	114.4	-7.9	111.2	F599 S601 A602 N607 H608	F599-R604 HydrophobicContact CB-CB 4.11Å; F599-R604 HydrophobicContact CD1-CB 3.98Å; F599-R604 HydrophobicContact CG-CB 4.32Å; S601-R604 WeakPolarHBondContact O-CA 3.39Å; S601-R604 WeakPolarHBondContact O-CB 3.48Å; S601-R604 PolarHBondContact O-N 2.98Å; S601-R604 WeakPolarHBondContact OG-CG 3.4Å; S601-R604 PolarHBondContact OG-N 3Å; A602-R604 VanDerWaalsContact C-N 3.31Å; A602-R604 PolarHBondContact O-N 3.24Å; R604-N607 WeakPolarHBondContact O-CB 3.38Å; R604-N607 PolarHBondContact O-N 3.39Å; R604-H608 WeakPolarHBondContact O-CB 3.49Å; R604-H608 PolarHBondContact O-N 3.44Å
605	L	80.4	Confident	73.2	Confident	21 Å²	21	77 Å²	77	11%	0.11	41%	0.408	C	S	.	.	H	α-helix	trans	-56.7	-52.1	172.4	171.1	58.6	0	0	0	110.8	F590 V591 C592 F599 S601 A602 N607 H608 Q609	F590-L605 HydrophobicContact CB-CB 3.92Å; F590-L605 HydrophobicContact CB-CD2 3.82Å; F590-L605 HydrophobicContact CB-CG 4.49Å; V591-L605 WeakPolarHBondContact O-CD2 3.47Å; C592-L605 VanDerWaalsContact CA-CD1 3.47Å; C592-L605 HydrophobicContact CB-CD1 3.44Å; C592-L605 VanDerWaalsContact CB-CD1 3.44Å; F599-L605 HydrophobicContact CB-CB 4.17Å; F599-L605 HydrophobicContact CD2-CB 4.04Å; F599-L605 HydrophobicContact CD2-CD1 3.9Å; F599-L605 HydrophobicContact CE2-CD1 4.28Å; F599-L605 HydrophobicContact CG-CB 4.29Å; S601-L605 PolarHBondContact O-N 3.36Å; A602-L605 PolarHBondContact O-N 2.92Å; L605-N607 VanDerWaalsContact C-N 3.26Å; L605-N607 PolarHBondContact O-N 3.02Å; L605-H608 CarbonylContact O-C 3.31Å; L605-H608 WeakPolarHBondContact O-CA 3.38Å; L605-H608 PolarHBondContact O-N 3.44Å; L605-Q609 HydrophobicContact CD1-CG 3.81Å; L605-Q609 HydrophobicContact CG-CG 4.28Å; L605-Q609 PolarHBondContact O-N 3.04Å
606	A	76.3	Confident	72	Confident	39 Å²	39	82.2 Å²	82.2	32%	0.322	43%	0.428	S	S	.	.	H	α-helix	trans	-62.2	-29.7	176.5	0	0	0	0	0	113.3	A602 R610	A602-A606 WeakPolarHBondContact O-CB 3.31Å; A602-A606 PolarHBondContact O-N 3.13Å; A606-R610 WeakPolarHBondContact O-CG 3.45Å; A606-R610 PolarHBondContact O-NH1 2.88Å; A606-R610 VanDerWaalsContact O-NH1 3.1Å
607	N	75.4	Confident	71	Confident	82 Å²	82	81.9 Å²	81.9	44%	0.439	42%	0.418	S	S	.	.	H	α-helix	trans	-71.6	-30.1	171.4	-73.7	-18.5	0	0	0	112.9	T603 R604 L605 R610	T603-N607 WeakPolarHBondContact O-CB 3.43Å; T603-N607 PolarHBondContact O-N 3.16Å; T603-N607 VanDerWaalsContact O-N 3.12Å; T603-N607 PolarHBondContact O-ND2 3.48Å; T603-N607 VanDerWaalsContact O-ND2 3.11Å; T603-N607 PolarHBondContact O-OD1 3.11Å; R604-N607 WeakPolarHBondContact O-CB 3.38Å; R604-N607 PolarHBondContact O-N 3.39Å; L605-N607 VanDerWaalsContact C-N 3.26Å; L605-N607 PolarHBondContact O-N 3.02Å; N607-R610 VanDerWaalsContact OD1-CZ 3.28Å; N607-R610 PolarHBondContact OD1-NH1 3.34Å; N607-R610 PolarHBondContact OD1-NH2 3.38Å
608	H	79.2	Confident	70.5	Confident	26 Å²	26	82 Å²	82	12%	0.12	43%	0.426	C	S	.	.	H	α-helix	trans	-86.3	-34.6	178.7	174.2	96.3	0	0	0	112.9	C595 E597 F599 R604 L605 R610 V611 H612	C595-H608 PolarHBondContact SG-NE2 2.86Å; E597-H608 VanDerWaalsContact CD-CE1 3.46Å; E597-H608 IonicContact OE1-CE1 2.76Å; E597-H608 IonicContact OE2-CE1 2.98Å; E597-H608 PolarHBondContact OE2-CE1 3.17Å; E597-H608 IonicContact OE2-ND1 3.64Å; E597-H608 PolarHBondContact OE2-ND1 3.02Å; F599-H608 HydrophobicContact CE1-CB 3.93Å; F599-H608 HydrophobicContact CE2-CB 3.91Å; F599-H608 AromaticContact CE2-CD2 3.6Å; F599-H608 AromaticContact CE2-CG 3.63Å; F599-H608 HydrophobicContact CZ-CB 3.53Å; F599-H608 AromaticContact CZ-CD2 3.61Å; F599-H608 AromaticContact CZ-CE1 3.77Å; F599-H608 AromaticContact CZ-CG 3.21Å; F599-H608 AromaticContact CZ-ND1 3.34Å; F599-H608 VanDerWaalsContact CZ-ND1 3.34Å; F599-H608 WeakPolarHBondContact CZ-ND1 3.39Å; F599-H608 AromaticContact CZ-NE2 3.95Å; R604-H608 WeakPolarHBondContact O-CB 3.49Å; R604-H608 PolarHBondContact O-N 3.44Å; L605-H608 CarbonylContact O-C 3.31Å; L605-H608 WeakPolarHBondContact O-CA 3.38Å; L605-H608 PolarHBondContact O-N 3.44Å; H608-R610 PolarHBondContact O-N 3.43Å; H608-V611 WeakPolarHBondContact O-CA 3.3Å; H608-V611 WeakPolarHBondContact O-CB 3.5Å; H608-V611 WeakPolarHBondContact O-CG2 3.38Å; H608-V611 PolarHBondContact O-N 3.41Å; H608-H612 AromaticContact CD2-CD2 3.92Å; H608-H612 AromaticContact CD2-NE2 3.48Å; H608-H612 PolarHBondContact CD2-NE2 2.93Å; H608-H612 AromaticContact CE1-NE2 3.86Å; H608-H612 AromaticContact NE2-CD2 3.81Å; H608-H612 AromaticContact NE2-CE1 3.77Å; H608-H612 AromaticContact NE2-NE2 2.91Å; H608-H612 PolarHBondContact NE2-NE2 3.27Å
609	Q	74.5	Confident	69.8	Low	53 Å²	53	78.5 Å²	78.5	25%	0.248	41%	0.412	C	S	.	.	H	α-helix	trans	-57.3	-31.8	173.1	-78.1	166.2	-42.3	0	0	111.6	L605 V611 H612 F613	L605-Q609 HydrophobicContact CD1-CG 3.81Å; L605-Q609 HydrophobicContact CG-CG 4.28Å; L605-Q609 PolarHBondContact O-N 3.04Å; Q609-V611 PolarHBondContact O-N 3.39Å; Q609-H612 PolarHBondContact O-N 2.99Å; Q609-F613 HydrophobicContact CB-CD2 4.33Å; Q609-F613 VanDerWaalsContact O-CD2 3.31Å; Q609-F613 WeakPolarHBondContact O-CD2 3.33Å; Q609-F613 PolarHBondContact O-N 3.32Å
610	R	73.1	Confident	69.5	Low	85 Å²	85	84.8 Å²	84.8	32%	0.321	44%	0.439	S	S	.	.	H	α-helix	trans	-73	4.6	171.6	-57.5	-175.9	-42.8	-103.4	3.3	114.7	A606 N607 H608 I631	A606-R610 WeakPolarHBondContact O-CG 3.45Å; A606-R610 PolarHBondContact O-NH1 2.88Å; A606-R610 VanDerWaalsContact O-NH1 3.1Å; N607-R610 VanDerWaalsContact OD1-CZ 3.28Å; N607-R610 PolarHBondContact OD1-NH1 3.34Å; N607-R610 PolarHBondContact OD1-NH2 3.38Å; H608-R610 PolarHBondContact O-N 3.43Å; R610-I631 HydrophobicContact CB-CG2 3.84Å; R610-I631 HydrophobicContact CG-CG2 4.25Å
611	V	68.4	Low	69.8	Low	105 Å²	105	81.5 Å²	81.5	64%	0.636	43%	0.429	S	S	*	.	H	α-helix	trans	-90.7	-32	165	-175.2	0	0	0	0	110.4	H608 Q609	H608-V611 WeakPolarHBondContact O-CA 3.3Å; H608-V611 WeakPolarHBondContact O-CB 3.5Å; H608-V611 WeakPolarHBondContact O-CG2 3.38Å; H608-V611 PolarHBondContact O-N 3.41Å; Q609-V611 PolarHBondContact O-N 3.39Å
612	H	68.6	Low	69.4	Low	67 Å²	67	88.8 Å²	88.8	31%	0.31	46%	0.46	S	S	.	.	H	α-helix	trans	-81.7	-44.3	174.3	-57.4	-55.8	0	0	0	111.8	C592 V594 C595 H608 Q609 A614	C592-H612 VanDerWaalsContact SG-CD2 3.53Å; V594-H612 HydrophobicContact CB-CB 4.28Å; V594-H612 HydrophobicContact CG1-CB 3.95Å; V594-H612 HydrophobicContact CG2-CB 4.3Å; C595-H612 PolarHBondContact SG-NE2 3.13Å; C595-H612 VanDerWaalsContact SG-NE2 3.43Å; H608-H612 AromaticContact CD2-CD2 3.92Å; H608-H612 AromaticContact CD2-NE2 3.48Å; H608-H612 PolarHBondContact CD2-NE2 2.93Å; H608-H612 AromaticContact CE1-NE2 3.86Å; H608-H612 AromaticContact NE2-CD2 3.81Å; H608-H612 AromaticContact NE2-CE1 3.77Å; H608-H612 AromaticContact NE2-NE2 2.91Å; H608-H612 PolarHBondContact NE2-NE2 3.27Å; Q609-H612 PolarHBondContact O-N 2.99Å; H612-A614 PolarHBondContact O-N 3.06Å
613	F	61.7	Low	69	Low	140 Å²	140	90.8 Å²	90.8	61%	0.614	46%	0.459	S	S	*	.	S	Bend	trans	-90.7	83.2	179.2	-60.3	-67.5	0	0	0	111.7	V594 Q609	V594-F613 HydrophobicContact CG2-CE2 4.49Å; V594-F613 HydrophobicContact CG2-CZ 4.39Å; Q609-F613 HydrophobicContact CB-CD2 4.33Å; Q609-F613 VanDerWaalsContact O-CD2 3.31Å; Q609-F613 WeakPolarHBondContact O-CD2 3.33Å; Q609-F613 PolarHBondContact O-N 3.32Å
614	A	54.9	Low	68.1	Low	69 Å²	69	91.3 Å²	91.3	57%	0.57	46%	0.464	S	S	*	.			trans	-101.1	138.1	150.9	0	0	0	0	0	108.2	H612	H612-A614 PolarHBondContact O-N 3.06Å
615	P	58.7	Low	67.4	Low	117 Å²	117	89 Å²	89	76%	0.76	48%	0.482	S	S	*	.	S	Bend	cis	-129.5	102	24.3	36.3	-17.7	0	0	0	114.3
616	Q	54.1	Low	66.6	Low	160 Å²	160	88.5 Å²	88.5	75%	0.748	48%	0.48	S	S	*	.			trans	-125.9	117.4	144.2	-71.6	-159.5	14.5	0	0	109.6
617	R	56.6	Low	66.1	Low	107 Å²	107	95.1 Å²	95.1	40%	0.404	51%	0.505	S	S	.	.			trans	-127.4	75.3	176.1	-60.9	-179.2	-171.6	162.3	9.8	108.5	H619 T629 F630 I631	R617-H619 PolarHBondContact O-N 3.29Å; R617-H619 VanDerWaalsContact O-N 3.13Å; R617-T629 WeakPolarHBondContact CD-OG1 3.48Å; R617-T629 PolarHBondContact NH1-OG1 2.9Å; R617-F630 CarbonylContact C-O 3.53Å; R617-I631 HydrophobicContact CG-CG1 3.97Å
618	P	64.8	Low	65.7	Low	90 Å²	90	96.8 Å²	96.8	58%	0.584	51%	0.508	S	S	*	.			trans	-64.4	-23	-167.6	-22.5	34.8	0	0	0	113.8	K620	P618-K620 PolarHBondContact O-N 2.67Å
619	H	64.8	Low	65.3	Low	63 Å²	63	97.7 Å²	97.7	29%	0.292	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	87.1	-174.4	-55.7	-60.2	0	0	0	110.7	R617 F630 F633 L636	R617-H619 PolarHBondContact O-N 3.29Å; R617-H619 VanDerWaalsContact O-N 3.13Å; H619-F630 HydrophobicContact CB-CB 4.31Å; H619-F630 WeakPolarHBondContact CB-O 3.37Å; H619-F630 PolarHBondContact N-O 3.02Å; H619-F630 PolarHBondContact O-N 3.4Å; H619-F633 PolarHBondContact CD2-N 3.06Å; H619-F633 PolarHBondContact NE2-N 3.15Å; H619-L636 HydrophobicContact CB-CB 4.11Å; H619-L636 HydrophobicContact CB-CD2 4.09Å; H619-L636 HydrophobicContact CB-CG 4.47Å
620	K	71.8	Confident	65.3	Low	160 Å²	160	97.3 Å²	97.3	70%	0.696	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	149	168	-53.9	-164.8	178.3	-178.7	0	110.2	P618 T629 L636	P618-K620 PolarHBondContact O-N 2.67Å; K620-T629 HydrophobicContact CB-CG2 4.34Å; K620-T629 HydrophobicContact CG-CG2 3.93Å; K620-L636 VanDerWaalsContact O-CD1 3.26Å; K620-L636 WeakPolarHBondContact O-CD1 3.37Å
621	C	77.3	Confident	65.1	Low	15 Å²	15	96.3 Å²	96.3	10%	0.101	51%	0.514	C	S	.	.			trans	-77.2	140.4	164.4	-166.7	0	0	0	0	109.8	C626 K628 L636 H639 N640 H643	C621-C626 WeakPolarHBondContact CB-O 3.33Å; C621-K628 WeakPolarHBondContact CB-O 3.41Å; C621-K628 PolarHBondContact N-O 3.2Å; C621-L636 HydrophobicContact CB-CD1 4.2Å; C621-H639 VanDerWaalsContact SG-CD2 3.59Å; C621-N640 PolarHBondContact SG-OD1 3.47Å; C621-H643 VanDerWaalsContact SG-CD2 3.51Å
622	E	67.9	Low	65.1	Low	182 Å²	182	93 Å²	93	85%	0.85	49%	0.494	S	S	*	.			trans	-103.2	5.9	-174.7	-163.8	168.9	-155.3	0	0	111.5
623	F	67.9	Low	64.9	Low	92 Å²	92	96.1 Å²	96.1	40%	0.404	51%	0.506	S	S	.	.	S	Bend	trans	-82.2	131.4	179.7	-168.5	-98	0	0	0	110.9	G625 C626 H643	F623-G625 PolarHBondContact O-N 2.92Å; F623-C626 PolarHBondContact O-N 3.47Å; F623-H643 HydrophobicContact CB-CB 4.36Å; F623-H643 VanDerWaalsContact CB-CD2 3.4Å; F623-H643 WeakPolarHBondContact CB-CD2 3.39Å; F623-H643 HydrophobicContact CD1-CB 4.13Å; F623-H643 AromaticContact CD1-CE1 3.19Å; F623-H643 WeakPolarHBondContact CD1-CE1 3.41Å; F623-H643 AromaticContact CD1-CG 3.55Å; F623-H643 AromaticContact CD1-ND1 3.26Å; F623-H643 VanDerWaalsContact CD1-ND1 3.26Å; F623-H643 WeakPolarHBondContact CD1-ND1 3.35Å; F623-H643 AromaticContact CD1-NE2 3.88Å; F623-H643 HydrophobicContact CD2-CB 3.62Å; F623-H643 AromaticContact CD2-CG 3.83Å; F623-H643 HydrophobicContact CE1-CB 4.31Å; F623-H643 AromaticContact CE1-CE1 3.17Å; F623-H643 WeakPolarHBondContact CE1-CE1 3.42Å; F623-H643 AromaticContact CE1-ND1 3.63Å; F623-H643 HydrophobicContact CE2-CB 3.83Å; F623-H643 HydrophobicContact CG-CB 3.76Å; F623-H643 AromaticContact CG-CD2 3.67Å; F623-H643 AromaticContact CG-CE1 3.85Å; F623-H643 AromaticContact CG-CG 3.4Å; F623-H643 AromaticContact CG-ND1 3.65Å; F623-H643 HydrophobicContact CZ-CB 4.16Å; F623-H643 AromaticContact CZ-CE1 3.84Å
624	P	58.9	Low	65.4	Low	110 Å²	110	93.3 Å²	93.3	71%	0.714	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	130	178.1	-28.3	35.8	0	0	0	112.4
625	G	59.8	Low	66.2	Low	86 Å²	86	91.7 Å²	91.7	89%	0.887	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	75	15.9	-178	0	0	0	0	0	115.6	F623	F623-G625 PolarHBondContact O-N 2.92Å
626	C	63.7	Low	67	Low	10 Å²	10	86.9 Å²	86.9	7%	0.068	46%	0.459	C	S	.	.			trans	-132.4	91.3	174.2	-138.5	0	0	0	0	115.6	C621 F623 K628 H643	C621-C626 WeakPolarHBondContact CB-O 3.33Å; F623-C626 PolarHBondContact O-N 3.47Å; C626-K628 PolarHBondContact O-N 3.06Å; C626-K628 PolarHBondContact SG-NZ 3.46Å; C626-H643 WeakPolarHBondContact CB-NE2 3.42Å; C626-H643 PolarHBondContact SG-NE2 2.95Å
627	E	65.4	Low	67.8	Low	179 Å²	179	84.9 Å²	84.9	84%	0.836	45%	0.448	S	S	*	.			trans	-74.6	17.2	180	-53.7	-177.1	156.3	0	0	114.7	T629	E627-T629 PolarHBondContact O-N 3.41Å
628	K	68.7	Low	68.6	Low	116 Å²	116	83.2 Å²	83.2	50%	0.504	45%	0.452	S	S	.	.			trans	-71.8	118.1	-173.2	-69.7	177.6	-175	118	0	110.3	C621 C626 F630	C621-K628 WeakPolarHBondContact CB-O 3.41Å; C621-K628 PolarHBondContact N-O 3.2Å; C626-K628 PolarHBondContact O-N 3.06Å; C626-K628 PolarHBondContact SG-NZ 3.46Å; K628-F630 HydrophobicContact CB-CE2 3.62Å; K628-F630 HydrophobicContact CB-CZ 3.85Å; K628-F630 WeakPolarHBondContact O-CD2 3.44Å; K628-F630 WeakPolarHBondContact O-CE2 3.41Å
629	T	70.6	Confident	69	Low	46 Å²	46	79.7 Å²	79.7	28%	0.282	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	138.6	-177.8	51.8	0	0	0	0	111.4	R617 K620 E627	R617-T629 WeakPolarHBondContact CD-OG1 3.48Å; R617-T629 PolarHBondContact NH1-OG1 2.9Å; K620-T629 HydrophobicContact CB-CG2 4.34Å; K620-T629 HydrophobicContact CG-CG2 3.93Å; E627-T629 PolarHBondContact O-N 3.41Å
630	F	73.7	Confident	69.1	Low	44 Å²	44	78.5 Å²	78.5	19%	0.193	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	146.8	-171.4	-65.1	-86.8	0	0	0	113.1	R617 H619 K628 A635 L636 H639	R617-F630 CarbonylContact C-O 3.53Å; H619-F630 HydrophobicContact CB-CB 4.31Å; H619-F630 WeakPolarHBondContact CB-O 3.37Å; H619-F630 PolarHBondContact N-O 3.02Å; H619-F630 PolarHBondContact O-N 3.4Å; K628-F630 HydrophobicContact CB-CE2 3.62Å; K628-F630 HydrophobicContact CB-CZ 3.85Å; K628-F630 WeakPolarHBondContact O-CD2 3.44Å; K628-F630 WeakPolarHBondContact O-CE2 3.41Å; F630-A635 HydrophobicContact CB-CB 4.25Å; F630-A635 HydrophobicContact CD1-CB 3.72Å; F630-A635 HydrophobicContact CG-CB 4.29Å; F630-L636 HydrophobicContact CB-CB 4.29Å; F630-L636 HydrophobicContact CD2-CB 4.41Å; F630-L636 HydrophobicContact CD2-CD1 3.96Å; F630-L636 HydrophobicContact CG-CB 4.48Å; F630-H639 HydrophobicContact CE1-CB 4.02Å; F630-H639 HydrophobicContact CE2-CB 3.8Å; F630-H639 AromaticContact CE2-CD2 3.12Å; F630-H639 WeakPolarHBondContact CE2-CD2 3.31Å; F630-H639 AromaticContact CE2-CG 3.55Å; F630-H639 AromaticContact CE2-NE2 3.93Å; F630-H639 HydrophobicContact CZ-CB 3.44Å; F630-H639 VanDerWaalsContact CZ-CB 3.44Å; F630-H639 AromaticContact CZ-CD2 3.42Å; F630-H639 VanDerWaalsContact CZ-CD2 3.42Å; F630-H639 WeakPolarHBondContact CZ-CD2 3.43Å; F630-H639 AromaticContact CZ-CG 3.33Å
631	I	68.1	Low	68.8	Low	65 Å²	65	77 Å²	77	33%	0.333	41%	0.414	S	S	.	.	S	Bend	trans	-80.2	-21.5	179.8	-61.3	172.8	0	0	0	111.4	R610 R617	R610-I631 HydrophobicContact CB-CG2 3.84Å; R610-I631 HydrophobicContact CG-CG2 4.25Å; R617-I631 HydrophobicContact CG-CG1 3.97Å
632	T	69.8	Low	68.1	Low	36 Å²	36	79.2 Å²	79.2	22%	0.221	43%	0.427	C	S	.	.	S	Bend	trans	-138.4	144.4	177.6	68.1	0	0	0	0	112.3	S634 A635 L636	T632-S634 PolarHBondContact O-N 2.89Å; T632-S634 PolarHBondContact OG1-OG 3.23Å; T632-A635 WeakPolarHBondContact O-CB 3.49Å; T632-A635 PolarHBondContact O-N 3.1Å; T632-A635 WeakPolarHBondContact OG1-CB 3.45Å; T632-A635 PolarHBondContact OG1-N 2.92Å; T632-L636 PolarHBondContact O-N 3.18Å
633	F	64.6	Low	67.7	Low	131 Å²	131	71.6 Å²	71.6	58%	0.575	39%	0.391	S	S	*	.	H	α-helix	trans	-56.2	-30.1	172.3	-173.1	-96.4	0	0	0	113	H619 L636 F637	H619-F633 PolarHBondContact CD2-N 3.06Å; H619-F633 PolarHBondContact NE2-N 3.15Å; F633-L636 HydrophobicContact CD2-CD2 4.15Å; F633-L636 HydrophobicContact CE2-CD2 4.31Å; F633-L636 PolarHBondContact O-N 2.8Å; F633-F637 VanDerWaalsContact O-CB 3.31Å; F633-F637 WeakPolarHBondContact O-CB 3.48Å; F633-F637 PolarHBondContact O-N 3.3Å
634	S	71.4	Confident	67	Low	82 Å²	82	74.6 Å²	74.6	57%	0.573	40%	0.404	S	S	*	.	H	α-helix	trans	-68.4	-31.5	174.3	53.9	0	0	0	0	113.7	T632 S638	T632-S634 PolarHBondContact O-N 2.89Å; T632-S634 PolarHBondContact OG1-OG 3.23Å; S634-S638 WeakPolarHBondContact O-CB 3.37Å; S634-S638 PolarHBondContact O-N 3.38Å; S634-S638 PolarHBondContact O-OG 3.1Å
635	A	72.3	Confident	66.6	Low	34 Å²	34	72.3 Å²	72.3	28%	0.281	38%	0.381	S	S	.	.	H	α-helix	trans	-77.6	-43	173.3	0	0	0	0	0	110.7	F630 T632 S638 H639	F630-A635 HydrophobicContact CB-CB 4.25Å; F630-A635 HydrophobicContact CD1-CB 3.72Å; F630-A635 HydrophobicContact CG-CB 4.29Å; T632-A635 WeakPolarHBondContact O-CB 3.49Å; T632-A635 PolarHBondContact O-N 3.1Å; T632-A635 WeakPolarHBondContact OG1-CB 3.45Å; T632-A635 PolarHBondContact OG1-N 2.92Å; A635-S638 WeakPolarHBondContact O-CB 3.33Å; A635-S638 PolarHBondContact O-N 3.28Å; A635-S638 VanDerWaalsContact O-N 3.15Å; A635-H639 PolarHBondContact O-N 3.33Å
636	L	75.6	Confident	66.1	Low	17 Å²	17	74.4 Å²	74.4	9%	0.089	37%	0.368	C	S	.	.	H	α-helix	trans	-52.5	-56.5	170	180	73.3	0	0	0	110.7	H619 K620 C621 F630 T632 F633 S638 H639 N640	H619-L636 HydrophobicContact CB-CB 4.11Å; H619-L636 HydrophobicContact CB-CD2 4.09Å; H619-L636 HydrophobicContact CB-CG 4.47Å; K620-L636 VanDerWaalsContact O-CD1 3.26Å; K620-L636 WeakPolarHBondContact O-CD1 3.37Å; C621-L636 HydrophobicContact CB-CD1 4.2Å; F630-L636 HydrophobicContact CB-CB 4.29Å; F630-L636 HydrophobicContact CD2-CB 4.41Å; F630-L636 HydrophobicContact CD2-CD1 3.96Å; F630-L636 HydrophobicContact CG-CB 4.48Å; T632-L636 PolarHBondContact O-N 3.18Å; F633-L636 HydrophobicContact CD2-CD2 4.15Å; F633-L636 HydrophobicContact CE2-CD2 4.31Å; F633-L636 PolarHBondContact O-N 2.8Å; L636-S638 PolarHBondContact O-N 3.11Å; L636-H639 CarbonylContact O-C 3.57Å; L636-H639 WeakPolarHBondContact O-CA 3.32Å; L636-H639 WeakPolarHBondContact O-CB 3.23Å; L636-H639 PolarHBondContact O-N 3.45Å; L636-N640 WeakPolarHBondContact CD1-OD1 3.36Å; L636-N640 PolarHBondContact O-N 2.63Å; L636-N640 PolarHBondContact O-OD1 3.18Å; L636-N640 VanDerWaalsContact O-OD1 3.11Å
637	F	70.9	Confident	65.4	Low	118 Å²	118	79.4 Å²	79.4	52%	0.518	40%	0.398	S	S	.	.	H	α-helix	trans	-59.9	-32.7	179.9	-172.5	-100.4	0	0	0	112.8	F633 H639 R641	F633-F637 VanDerWaalsContact O-CB 3.31Å; F633-F637 WeakPolarHBondContact O-CB 3.48Å; F633-F637 PolarHBondContact O-N 3.3Å; F637-H639 VanDerWaalsContact C-N 3.3Å; F637-H639 PolarHBondContact O-N 3.31Å; F637-R641 HydrophobicContact CE1-CG 4.37Å; F637-R641 WeakPolarHBondContact O-CB 3.36Å; F637-R641 WeakPolarHBondContact O-CG 3.22Å; F637-R641 PolarHBondContact O-N 2.9Å; F637-R641 VanDerWaalsContact O-N 3.1Å
638	S	72	Confident	64.9	Low	71 Å²	71	72.2 Å²	72.2	50%	0.497	37%	0.373	S	S	.	.	H	α-helix	trans	-70.4	-25.4	173.8	-61.1	0	0	0	0	113.2	S634 A635 L636	S634-S638 WeakPolarHBondContact O-CB 3.37Å; S634-S638 PolarHBondContact O-N 3.38Å; S634-S638 PolarHBondContact O-OG 3.1Å; A635-S638 WeakPolarHBondContact O-CB 3.33Å; A635-S638 PolarHBondContact O-N 3.28Å; A635-S638 VanDerWaalsContact O-N 3.15Å; L636-S638 PolarHBondContact O-N 3.11Å
639	H	73.4	Confident	64.9	Low	16 Å²	16	71.3 Å²	71.3	7%	0.074	37%	0.37	C	S	.	.	H	α-helix	trans	-91	-33.5	175.9	171.3	54.6	0	0	0	113.7	C621 F630 A635 L636 F637 R641 T642 H643	C621-H639 VanDerWaalsContact SG-CD2 3.59Å; F630-H639 HydrophobicContact CE1-CB 4.02Å; F630-H639 HydrophobicContact CE2-CB 3.8Å; F630-H639 AromaticContact CE2-CD2 3.12Å; F630-H639 WeakPolarHBondContact CE2-CD2 3.31Å; F630-H639 AromaticContact CE2-CG 3.55Å; F630-H639 AromaticContact CE2-NE2 3.93Å; F630-H639 HydrophobicContact CZ-CB 3.44Å; F630-H639 VanDerWaalsContact CZ-CB 3.44Å; F630-H639 AromaticContact CZ-CD2 3.42Å; F630-H639 VanDerWaalsContact CZ-CD2 3.42Å; F630-H639 WeakPolarHBondContact CZ-CD2 3.43Å; F630-H639 AromaticContact CZ-CG 3.33Å; A635-H639 PolarHBondContact O-N 3.33Å; L636-H639 CarbonylContact O-C 3.57Å; L636-H639 WeakPolarHBondContact O-CA 3.32Å; L636-H639 WeakPolarHBondContact O-CB 3.23Å; L636-H639 PolarHBondContact O-N 3.45Å; F637-H639 VanDerWaalsContact C-N 3.3Å; F637-H639 PolarHBondContact O-N 3.31Å; H639-R641 PolarHBondContact O-N 3.33Å; H639-T642 PolarHBondContact ND1-OG1 3.1Å; H639-T642 WeakPolarHBondContact O-CA 3.47Å; H639-T642 WeakPolarHBondContact O-CB 3.48Å; H639-T642 PolarHBondContact O-N 3.11Å; H639-T642 PolarHBondContact O-OG1 3.43Å; H639-H643 AromaticContact CE1-CD2 3.99Å; H639-H643 AromaticContact CE1-NE2 3.86Å; H639-H643 AromaticContact NE2-CD2 3.92Å; H639-H643 PolarHBondContact O-N 3.12Å
640	N	67.2	Low	64.9	Low	38 Å²	38	73.6 Å²	73.6	20%	0.203	38%	0.377	C	S	.	.	H	α-helix	trans	-62.3	-33.9	167.1	-63.9	22.9	0	0	0	108.8	C621 L636 T642 H643 F644	C621-N640 PolarHBondContact SG-OD1 3.47Å; L636-N640 WeakPolarHBondContact CD1-OD1 3.36Å; L636-N640 PolarHBondContact O-N 2.63Å; L636-N640 PolarHBondContact O-OD1 3.18Å; L636-N640 VanDerWaalsContact O-OD1 3.11Å; N640-T642 PolarHBondContact O-N 2.93Å; N640-T642 VanDerWaalsContact O-N 3.1Å; N640-H643 PolarHBondContact O-N 2.88Å; N640-F644 HydrophobicContact CB-CD2 4.48Å; N640-F644 HydrophobicContact CB-CE2 4.46Å; N640-F644 VanDerWaalsContact O-CD2 3.23Å; N640-F644 WeakPolarHBondContact O-CD2 3.24Å; N640-F644 PolarHBondContact O-N 3.42Å
641	R	65.6	Low	65.1	Low	130 Å²	130	75 Å²	75	49%	0.491	39%	0.391	S	S	.	.	H	α-helix	trans	-69.5	12	163.4	-69.7	179.7	76.3	-161.7	11.4	115.4	F637 H639 R645	F637-R641 HydrophobicContact CE1-CG 4.37Å; F637-R641 WeakPolarHBondContact O-CB 3.36Å; F637-R641 WeakPolarHBondContact O-CG 3.22Å; F637-R641 PolarHBondContact O-N 2.9Å; F637-R641 VanDerWaalsContact O-N 3.1Å; H639-R641 PolarHBondContact O-N 3.33Å; R641-R645 VanDerWaalsContact O-CD 3.26Å; R641-R645 WeakPolarHBondContact O-CD 3.33Å; R641-R645 VanDerWaalsContact O-CG 3.27Å; R641-R645 WeakPolarHBondContact O-CG 3.41Å; R641-R645 PolarHBondContact O-NE 3.22Å
642	T	63	Low	65.8	Low	60 Å²	60	72.5 Å²	72.5	37%	0.368	38%	0.38	S	S	.	.	H	α-helix	trans	-105.9	-28.3	159.8	55.9	0	0	0	0	112.1	H639 N640 R645	H639-T642 PolarHBondContact ND1-OG1 3.1Å; H639-T642 WeakPolarHBondContact O-CA 3.47Å; H639-T642 WeakPolarHBondContact O-CB 3.48Å; H639-T642 PolarHBondContact O-N 3.11Å; H639-T642 PolarHBondContact O-OG1 3.43Å; N640-T642 PolarHBondContact O-N 2.93Å; N640-T642 VanDerWaalsContact O-N 3.1Å; T642-R645 WeakPolarHBondContact O-CB 3.41Å; T642-R645 PolarHBondContact O-N 3.4Å
643	H	58.6	Low	66.3	Low	23 Å²	23	76.9 Å²	76.9	11%	0.106	41%	0.407	C	S	.	.	H	α-helix	trans	-71.2	-49.2	167.5	-60.6	-52.6	0	0	0	111.8	C621 F623 C626 H639 N640 R645 E646	C621-H643 VanDerWaalsContact SG-CD2 3.51Å; F623-H643 HydrophobicContact CB-CB 4.36Å; F623-H643 VanDerWaalsContact CB-CD2 3.4Å; F623-H643 WeakPolarHBondContact CB-CD2 3.39Å; F623-H643 HydrophobicContact CD1-CB 4.13Å; F623-H643 AromaticContact CD1-CE1 3.19Å; F623-H643 WeakPolarHBondContact CD1-CE1 3.41Å; F623-H643 AromaticContact CD1-CG 3.55Å; F623-H643 AromaticContact CD1-ND1 3.26Å; F623-H643 VanDerWaalsContact CD1-ND1 3.26Å; F623-H643 WeakPolarHBondContact CD1-ND1 3.35Å; F623-H643 AromaticContact CD1-NE2 3.88Å; F623-H643 HydrophobicContact CD2-CB 3.62Å; F623-H643 AromaticContact CD2-CG 3.83Å; F623-H643 HydrophobicContact CE1-CB 4.31Å; F623-H643 AromaticContact CE1-CE1 3.17Å; F623-H643 WeakPolarHBondContact CE1-CE1 3.42Å; F623-H643 AromaticContact CE1-ND1 3.63Å; F623-H643 HydrophobicContact CE2-CB 3.83Å; F623-H643 HydrophobicContact CG-CB 3.76Å; F623-H643 AromaticContact CG-CD2 3.67Å; F623-H643 AromaticContact CG-CE1 3.85Å; F623-H643 AromaticContact CG-CG 3.4Å; F623-H643 AromaticContact CG-ND1 3.65Å; F623-H643 HydrophobicContact CZ-CB 4.16Å; F623-H643 AromaticContact CZ-CE1 3.84Å; C626-H643 WeakPolarHBondContact CB-NE2 3.42Å; C626-H643 PolarHBondContact SG-NE2 2.95Å; H639-H643 AromaticContact CE1-CD2 3.99Å; H639-H643 AromaticContact CE1-NE2 3.86Å; H639-H643 AromaticContact NE2-CD2 3.92Å; H639-H643 PolarHBondContact O-N 3.12Å; N640-H643 PolarHBondContact O-N 2.88Å; H643-R645 PolarHBondContact O-N 2.91Å; H643-E646 IonicContact CE1-OE2 2.97Å; H643-E646 PolarHBondContact O-N 3.45Å
644	F	53.6	Low	66.8	Low	154 Å²	154	74.9 Å²	74.9	68%	0.675	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	3.4	170.4	-65.2	-66	0	0	0	114.2	N640	N640-F644 HydrophobicContact CB-CD2 4.48Å; N640-F644 HydrophobicContact CB-CE2 4.46Å; N640-F644 VanDerWaalsContact O-CD2 3.23Å; N640-F644 WeakPolarHBondContact O-CD2 3.24Å; N640-F644 PolarHBondContact O-N 3.42Å
645	R	50.3	Low	66.8	Low	62 Å²	62	76.2 Å²	76.2	23%	0.234	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-21.2	165.3	-80	173.1	-159.4	-63.7	-19	113.1	R641 T642 H643 T647 G648 D662 K663	R641-R645 VanDerWaalsContact O-CD 3.26Å; R641-R645 WeakPolarHBondContact O-CD 3.33Å; R641-R645 VanDerWaalsContact O-CG 3.27Å; R641-R645 WeakPolarHBondContact O-CG 3.41Å; R641-R645 PolarHBondContact O-NE 3.22Å; T642-R645 WeakPolarHBondContact O-CB 3.41Å; T642-R645 PolarHBondContact O-N 3.4Å; H643-R645 PolarHBondContact O-N 2.91Å; R645-T647 VanDerWaalsContact C-N 3.31Å; R645-G648 PolarHBondContact O-N 3.3Å; R645-D662 HydrophobicContact CB-CB 4.44Å; R645-D662 HydrophobicContact CG-CB 4.39Å; R645-D662 PolarHBondContact NH1-O 3.46Å; R645-D662 IonicContact NH1-OD2 3.42Å; R645-K663 VanDerWaalsContact NH1-CE 3.31Å
646	E	49.7	Very low	66.9	Low	130 Å²	130	78.3 Å²	78.3	61%	0.607	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-8.2	178.8	-62	-178.4	153.9	0	0	112.1	H643 Q649	H643-E646 IonicContact CE1-OE2 2.97Å; H643-E646 PolarHBondContact O-N 3.45Å; E646-Q649 PolarHBondContact O-NE2 3.26Å; E646-Q649 PolarHBondContact O-OE1 3.31Å
647	T	47.8	Very low	67.1	Low	115 Å²	115	78.1 Å²	78.1	71%	0.706	43%	0.43	S	S	*	.	S	Bend	trans	-99.3	-5.2	167.3	-19.5	0	0	0	0	113.1	R645	R645-T647 VanDerWaalsContact C-N 3.31Å
648	G	55.5	Low	67.5	Low	29 Å²	29	79.7 Å²	79.7	30%	0.299	44%	0.443	S	S	.	.			trans	-129.6	39.8	-164.2	0	0	0	0	0	114	R645 F650	R645-G648 PolarHBondContact O-N 3.3Å; G648-F650 WeakPolarHBondContact O-CD2 3.43Å; G648-F650 PolarHBondContact O-N 2.93Å
649	Q	69	Low	67.9	Low	96 Å²	96	81.7 Å²	81.7	45%	0.449	44%	0.443	S	S	.	.			trans	-67.4	118.9	178.3	-71.1	81.4	-10.5	0	0	110.9	E646 S651 T660	E646-Q649 PolarHBondContact O-NE2 3.26Å; E646-Q649 PolarHBondContact O-OE1 3.31Å; Q649-S651 PolarHBondContact O-N 3.25Å; Q649-T660 HydrophobicContact CB-CG2 3.93Å; Q649-T660 HydrophobicContact CG-CG2 4.28Å
650	F	70.1	Confident	68.2	Low	95 Å²	95	84.9 Å²	84.9	42%	0.417	46%	0.464	S	S	.	.	B	Isolated β-bridge	trans	-81.5	97.6	166.8	-63.2	-86.5	0	0	0	108.5	G648 Y661 A664 L667	G648-F650 WeakPolarHBondContact O-CD2 3.43Å; G648-F650 PolarHBondContact O-N 2.93Å; F650-Y661 WeakPolarHBondContact CD2-O 3.32Å; F650-Y661 PolarHBondContact N-O 3.49Å; F650-Y661 PolarHBondContact O-N 3.22Å; F650-A664 HydrophobicContact CD1-CB 3.86Å; F650-A664 HydrophobicContact CD2-CB 4.33Å; F650-A664 VanDerWaalsContact CD2-N 3.29Å; F650-A664 HydrophobicContact CE1-CB 3.84Å; F650-A664 HydrophobicContact CE2-CB 4.31Å; F650-A664 HydrophobicContact CG-CB 4.11Å; F650-A664 HydrophobicContact CZ-CB 4.07Å; F650-L667 HydrophobicContact CB-CB 4.14Å; F650-L667 HydrophobicContact CB-CD2 3.8Å
651	S	79	Confident	68.7	Low	72 Å²	72	85.8 Å²	85.8	50%	0.503	47%	0.465	S	S	.	.			trans	-68.9	152.1	175.5	53	0	0	0	0	112	Q649 L667	Q649-S651 PolarHBondContact O-N 3.25Å; S651-L667 WeakPolarHBondContact O-CD2 3.46Å
652	C	82.8	Confident	69	Low	13 Å²	13	82 Å²	82	9%	0.088	45%	0.454	C	S	.	.			trans	-82.2	123.9	173.3	171.2	0	0	0	0	110.5	F654 C657 K659 L667 M671 H674	C652-F654 PolarHBondContact O-N 3.4Å; C652-F654 VanDerWaalsContact SG-CB 3.58Å; C652-F654 PolarHBondContact SG-N 3.19Å; C652-C657 VanDerWaalsContact CB-O 3.27Å; C652-C657 WeakPolarHBondContact CB-O 3.37Å; C652-K659 HydrophobicContact CB-CB 4.46Å; C652-K659 VanDerWaalsContact CB-O 3.31Å; C652-K659 WeakPolarHBondContact CB-O 3.35Å; C652-K659 PolarHBondContact N-O 3.27Å; C652-K659 VanDerWaalsContact N-O 3.09Å; C652-L667 HydrophobicContact CB-CD1 3.93Å; C652-M671 HydrophobicContact CB-SD 4.48Å; C652-M671 VanDerWaalsContact SG-SD 3.63Å; C652-H674 PolarHBondContact SG-NE2 3.22Å
653	T	78.9	Confident	69.5	Low	128 Å²	128	82.7 Å²	82.7	79%	0.785	45%	0.452	S	S	*	.			trans	-82.6	5.7	-178.6	-27.5	0	0	0	0	113.2
654	F	76.9	Confident	70.1	Confident	89 Å²	89	84 Å²	84	39%	0.39	47%	0.467	S	S	.	.	S	Bend	trans	-82.9	130.6	179.1	-163.3	-94.7	0	0	0	110.7	C652 G656 C657 M671 H674	C652-F654 PolarHBondContact O-N 3.4Å; C652-F654 VanDerWaalsContact SG-CB 3.58Å; C652-F654 PolarHBondContact SG-N 3.19Å; F654-G656 PolarHBondContact O-N 2.86Å; F654-C657 PolarHBondContact O-N 3.43Å; F654-C657 VanDerWaalsContact O-N 3.15Å; F654-M671 HydrophobicContact CB-CE 4.14Å; F654-H674 HydrophobicContact CB-CB 4.41Å; F654-H674 HydrophobicContact CD1-CB 4.24Å; F654-H674 AromaticContact CD1-CE1 3.76Å; F654-H674 AromaticContact CD1-CG 3.79Å; F654-H674 AromaticContact CD1-ND1 3.5Å; F654-H674 HydrophobicContact CD2-CB 3.61Å; F654-H674 AromaticContact CD2-CG 3.91Å; F654-H674 HydrophobicContact CE1-CB 4.45Å; F654-H674 AromaticContact CE1-ND1 3.92Å; F654-H674 HydrophobicContact CE2-CB 3.86Å; F654-H674 HydrophobicContact CG-CB 3.81Å; F654-H674 AromaticContact CG-CD2 3.79Å; F654-H674 AromaticContact CG-CG 3.55Å; F654-H674 AromaticContact CG-ND1 3.79Å; F654-H674 HydrophobicContact CZ-CB 4.27Å
655	P	70.8	Confident	70.9	Confident	110 Å²	110	80.4 Å²	80.4	71%	0.714	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	131.8	-178.8	24.3	-34.1	0	0	0	111.3
656	G	73.6	Confident	72.2	Confident	79 Å²	79	83.2 Å²	83.2	81%	0.814	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	25.3	-176.2	0	0	0	0	0	114.8	F654	F654-G656 PolarHBondContact O-N 2.86Å
657	C	81	Confident	73.6	Confident	13 Å²	13	78.2 Å²	78.2	9%	0.088	45%	0.448	C	S	.	.			trans	-142.8	90.8	173.2	-150.5	0	0	0	0	114.8	C652 F654 K659 H674	C652-C657 VanDerWaalsContact CB-O 3.27Å; C652-C657 WeakPolarHBondContact CB-O 3.37Å; F654-C657 PolarHBondContact O-N 3.43Å; F654-C657 VanDerWaalsContact O-N 3.15Å; C657-K659 PolarHBondContact O-N 3.41Å; C657-H674 VanDerWaalsContact CB-CE1 3.46Å; C657-H674 WeakPolarHBondContact CB-CE1 3.44Å; C657-H674 PolarHBondContact SG-CE1 2.87Å
658	D	79.4	Confident	74.9	Confident	150 Å²	150	79.7 Å²	79.7	80%	0.802	44%	0.444	S	S	*	.			trans	-77.8	27.9	-174.1	-39.5	-77.1	0	0	0	114	T660	D658-T660 PolarHBondContact O-N 2.76Å
659	K	79.5	Confident	76.1	Confident	114 Å²	114	81 Å²	81	50%	0.496	44%	0.444	S	S	.	.			trans	-82.5	107.8	-171.3	-70.7	178.6	-173.7	156.1	0	111.6	C652 C657 Y661	C652-K659 HydrophobicContact CB-CB 4.46Å; C652-K659 VanDerWaalsContact CB-O 3.31Å; C652-K659 WeakPolarHBondContact CB-O 3.35Å; C652-K659 PolarHBondContact N-O 3.27Å; C652-K659 VanDerWaalsContact N-O 3.09Å; C657-K659 PolarHBondContact O-N 3.41Å; K659-Y661 HydrophobicContact CB-CE2 3.73Å; K659-Y661 WeakPolarHBondContact O-CD2 3.44Å; K659-Y661 VanDerWaalsContact O-CE2 3.28Å; K659-Y661 WeakPolarHBondContact O-CE2 3.46Å
660	T	79.8	Confident	76.7	Confident	83 Å²	83	77.2 Å²	77.2	51%	0.509	43%	0.426	S	S	.	.			trans	-84.5	148.4	174.1	49.2	0	0	0	0	112.4	Q649 D658	Q649-T660 HydrophobicContact CB-CG2 3.93Å; Q649-T660 HydrophobicContact CG-CG2 4.28Å; D658-T660 PolarHBondContact O-N 2.76Å
661	Y	78.8	Confident	77	Confident	57 Å²	57	75 Å²	75	22%	0.224	42%	0.418	C	S	.	.	B	Isolated β-bridge	trans	-136.7	137.6	-179.9	-67.7	-83.3	0	0	0	112.3	F650 K659 K663 R666 L667 H670	F650-Y661 WeakPolarHBondContact CD2-O 3.32Å; F650-Y661 PolarHBondContact N-O 3.49Å; F650-Y661 PolarHBondContact O-N 3.22Å; K659-Y661 HydrophobicContact CB-CE2 3.73Å; K659-Y661 WeakPolarHBondContact O-CD2 3.44Å; K659-Y661 VanDerWaalsContact O-CE2 3.28Å; K659-Y661 WeakPolarHBondContact O-CE2 3.46Å; Y661-K663 PolarHBondContact O-N 2.97Å; Y661-R666 HydrophobicContact CD1-CB 3.75Å; Y661-R666 HydrophobicContact CG-CB 4.18Å; Y661-L667 HydrophobicContact CD2-CB 4.1Å; Y661-L667 HydrophobicContact CD2-CD1 4.11Å; Y661-L667 HydrophobicContact CG-CB 4.38Å; Y661-H670 HydrophobicContact CE1-CB 4.46Å; Y661-H670 HydrophobicContact CE2-CB 3.77Å; Y661-H670 AromaticContact CE2-CD2 3.29Å; Y661-H670 WeakPolarHBondContact CE2-CD2 3.21Å; Y661-H670 AromaticContact CE2-CG 3.65Å; Y661-H670 AromaticContact CZ-CD2 3.78Å; Y661-H670 AromaticContact CZ-CG 3.69Å; Y661-H670 VanDerWaalsContact OH-CG 3.3Å
662	D	71.1	Confident	77.1	Confident	49 Å²	49	74.2 Å²	74.2	26%	0.262	40%	0.404	S	S	.	.	S	Bend	trans	-66.6	-4.5	177.1	77	-48.2	0	0	0	115	R645 R666	R645-D662 HydrophobicContact CB-CB 4.44Å; R645-D662 HydrophobicContact CG-CB 4.39Å; R645-D662 PolarHBondContact NH1-O 3.46Å; R645-D662 IonicContact NH1-OD2 3.42Å; D662-R666 VanDerWaalsContact OD1-CD 3.26Å; D662-R666 WeakPolarHBondContact OD1-CD 3.32Å; D662-R666 IonicContact OD1-CZ 3.45Å; D662-R666 IonicContact OD1-NE 2.83Å; D662-R666 IonicContact OD1-NH1 3.81Å; D662-R666 PolarHBondContact OD1-NH1 3.41Å; D662-R666 IonicContact OD2-NH1 2.65Å; D662-R666 PolarHBondContact OD2-NH1 2.9Å
663	K	74.4	Confident	76.8	Confident	76 Å²	76	77 Å²	77	33%	0.33	42%	0.423	S	S	.	.	S	Bend	trans	-152.9	127.2	-173.9	-67.4	173.9	-170.6	171.1	0	111	R645 Y661 C665 R666 L667	R645-K663 VanDerWaalsContact NH1-CE 3.31Å; Y661-K663 PolarHBondContact O-N 2.97Å; K663-C665 PolarHBondContact O-N 2.99Å; K663-C665 VanDerWaalsContact O-N 3.08Å; K663-R666 HydrophobicContact CB-CB 4.41Å; K663-R666 HydrophobicContact CB-CG 4.38Å; K663-R666 WeakPolarHBondContact O-CA 3.43Å; K663-R666 WeakPolarHBondContact O-CB 3.36Å; K663-R666 PolarHBondContact O-N 3.24Å; K663-L667 PolarHBondContact O-N 3.4Å; K663-L667 VanDerWaalsContact O-N 3.13Å
664	A	70.6	Confident	76.9	Confident	49 Å²	49	73.3 Å²	73.3	41%	0.405	40%	0.397	S	S	.	.	H	α-helix	trans	-52.2	-31.1	171.1	0	0	0	0	0	114	F650 L667 K668	F650-A664 HydrophobicContact CD1-CB 3.86Å; F650-A664 HydrophobicContact CD2-CB 4.33Å; F650-A664 VanDerWaalsContact CD2-N 3.29Å; F650-A664 HydrophobicContact CE1-CB 3.84Å; F650-A664 HydrophobicContact CE2-CB 4.31Å; F650-A664 HydrophobicContact CG-CB 4.11Å; F650-A664 HydrophobicContact CZ-CB 4.07Å; A664-L667 PolarHBondContact O-N 3.39Å; A664-K668 WeakPolarHBondContact O-CB 3.47Å; A664-K668 PolarHBondContact O-N 3.05Å
665	C	70.6	Confident	76.9	Confident	79 Å²	79	73 Å²	73	53%	0.534	40%	0.403	S	S	.	.	H	α-helix	trans	-71.3	-26.7	175.7	67	0	0	0	0	113.7	K663 I669	K663-C665 PolarHBondContact O-N 2.99Å; K663-C665 VanDerWaalsContact O-N 3.08Å; C665-I669 WeakPolarHBondContact O-CD1 3.3Å; C665-I669 VanDerWaalsContact O-CG1 3.3Å; C665-I669 WeakPolarHBondContact O-CG1 3.39Å; C665-I669 PolarHBondContact O-N 3.38Å
666	R	76.3	Confident	77.3	Confident	121 Å²	121	70.1 Å²	70.1	46%	0.457	39%	0.393	S	S	.	.	H	α-helix	trans	-77.1	-42.6	171.2	-76.6	177.9	169.4	145.2	-11.6	110.9	Y661 D662 K663 K668 I669 H670	Y661-R666 HydrophobicContact CD1-CB 3.75Å; Y661-R666 HydrophobicContact CG-CB 4.18Å; D662-R666 VanDerWaalsContact OD1-CD 3.26Å; D662-R666 WeakPolarHBondContact OD1-CD 3.32Å; D662-R666 IonicContact OD1-CZ 3.45Å; D662-R666 IonicContact OD1-NE 2.83Å; D662-R666 IonicContact OD1-NH1 3.81Å; D662-R666 PolarHBondContact OD1-NH1 3.41Å; D662-R666 IonicContact OD2-NH1 2.65Å; D662-R666 PolarHBondContact OD2-NH1 2.9Å; K663-R666 HydrophobicContact CB-CB 4.41Å; K663-R666 HydrophobicContact CB-CG 4.38Å; K663-R666 WeakPolarHBondContact O-CA 3.43Å; K663-R666 WeakPolarHBondContact O-CB 3.36Å; K663-R666 PolarHBondContact O-N 3.24Å; R666-K668 VanDerWaalsContact C-N 3.35Å; R666-K668 PolarHBondContact O-N 2.88Å; R666-I669 PolarHBondContact O-N 3.31Å; R666-I669 VanDerWaalsContact O-N 3.12Å; R666-H670 PolarHBondContact O-N 3.33Å
667	L	79.1	Confident	77.4	Confident	25 Å²	25	70.5 Å²	70.5	13%	0.131	37%	0.374	C	S	.	.	H	α-helix	trans	-55	-49.4	170.4	173.1	59.9	0	0	0	110.9	F650 S651 C652 Y661 K663 A664 I669 H670 M671	F650-L667 HydrophobicContact CB-CB 4.14Å; F650-L667 HydrophobicContact CB-CD2 3.8Å; S651-L667 WeakPolarHBondContact O-CD2 3.46Å; C652-L667 HydrophobicContact CB-CD1 3.93Å; Y661-L667 HydrophobicContact CD2-CB 4.1Å; Y661-L667 HydrophobicContact CD2-CD1 4.11Å; Y661-L667 HydrophobicContact CG-CB 4.38Å; K663-L667 PolarHBondContact O-N 3.4Å; K663-L667 VanDerWaalsContact O-N 3.13Å; A664-L667 PolarHBondContact O-N 3.39Å; L667-I669 VanDerWaalsContact C-N 3.25Å; L667-I669 PolarHBondContact O-N 2.68Å; L667-H670 CarbonylContact O-C 3.46Å; L667-H670 WeakPolarHBondContact O-CA 3.45Å; L667-H670 WeakPolarHBondContact O-CB 3.39Å; L667-H670 PolarHBondContact O-N 3.49Å; L667-M671 HydrophobicContact CD1-CG 3.98Å; L667-M671 HydrophobicContact CD1-SD 3.84Å; L667-M671 HydrophobicContact CG-CG 4.25Å; L667-M671 PolarHBondContact O-N 3.11Å
668	K	76.7	Confident	77.4	Confident	146 Å²	146	75.5 Å²	75.5	64%	0.635	39%	0.391	S	S	*	.	H	α-helix	trans	-59.7	-31.6	177.9	-173.1	165.9	-69.8	-164	0	113.3	A664 R666 R672	A664-K668 WeakPolarHBondContact O-CB 3.47Å; A664-K668 PolarHBondContact O-N 3.05Å; R666-K668 VanDerWaalsContact C-N 3.35Å; R666-K668 PolarHBondContact O-N 2.88Å; K668-R672 WeakPolarHBondContact O-CG 3.49Å
669	I	78.9	Confident	77.2	Confident	58 Å²	58	71.5 Å²	71.5	30%	0.297	37%	0.373	S	S	.	.	H	α-helix	trans	-76.9	-22.9	173.5	-69	166.6	0	0	0	112.3	C665 R666 L667	C665-I669 WeakPolarHBondContact O-CD1 3.3Å; C665-I669 VanDerWaalsContact O-CG1 3.3Å; C665-I669 WeakPolarHBondContact O-CG1 3.39Å; C665-I669 PolarHBondContact O-N 3.38Å; R666-I669 PolarHBondContact O-N 3.31Å; R666-I669 VanDerWaalsContact O-N 3.12Å; L667-I669 VanDerWaalsContact C-N 3.25Å; L667-I669 PolarHBondContact O-N 2.68Å
670	H	81.8	Confident	77.3	Confident	15 Å²	15	68.4 Å²	68.4	7%	0.069	36%	0.36	C	S	.	.	H	α-helix	trans	-83.4	-37.3	172.8	172.7	46.7	0	0	0	113.1	Y661 R666 L667 R672 S673 H674	Y661-H670 HydrophobicContact CE1-CB 4.46Å; Y661-H670 HydrophobicContact CE2-CB 3.77Å; Y661-H670 AromaticContact CE2-CD2 3.29Å; Y661-H670 WeakPolarHBondContact CE2-CD2 3.21Å; Y661-H670 AromaticContact CE2-CG 3.65Å; Y661-H670 AromaticContact CZ-CD2 3.78Å; Y661-H670 AromaticContact CZ-CG 3.69Å; Y661-H670 VanDerWaalsContact OH-CG 3.3Å; R666-H670 PolarHBondContact O-N 3.33Å; L667-H670 CarbonylContact O-C 3.46Å; L667-H670 WeakPolarHBondContact O-CA 3.45Å; L667-H670 WeakPolarHBondContact O-CB 3.39Å; L667-H670 PolarHBondContact O-N 3.49Å; H670-R672 PolarHBondContact O-N 2.97Å; H670-S673 PolarHBondContact ND1-OG 3.07Å; H670-S673 WeakPolarHBondContact O-CA 3.32Å; H670-S673 WeakPolarHBondContact O-CB 3.22Å; H670-S673 PolarHBondContact O-N 2.71Å; H670-S673 PolarHBondContact O-OG 2.84Å; H670-H674 AromaticContact CE1-CD2 3.82Å; H670-H674 AromaticContact CE1-CE1 3.79Å; H670-H674 AromaticContact CE1-NE2 3.15Å; H670-H674 PolarHBondContact CE1-NE2 2.87Å; H670-H674 AromaticContact NE2-CD2 3.82Å; H670-H674 AromaticContact NE2-NE2 3.08Å; H670-H674 PolarHBondContact NE2-NE2 3.22Å
671	M	76.7	Confident	77.4	Confident	48 Å²	48	67.9 Å²	67.9	24%	0.236	36%	0.356	C	S	.	.	H	α-helix	trans	-56.6	-35.7	173.4	-66.3	-49.7	-58.1	0	0	111.5	C652 F654 L667 S673 H674 T675	C652-M671 HydrophobicContact CB-SD 4.48Å; C652-M671 VanDerWaalsContact SG-SD 3.63Å; F654-M671 HydrophobicContact CB-CE 4.14Å; L667-M671 HydrophobicContact CD1-CG 3.98Å; L667-M671 HydrophobicContact CD1-SD 3.84Å; L667-M671 HydrophobicContact CG-CG 4.25Å; L667-M671 PolarHBondContact O-N 3.11Å; M671-S673 PolarHBondContact O-N 2.95Å; M671-S673 VanDerWaalsContact O-N 3.15Å; M671-H674 WeakPolarHBondContact O-CA 3.41Å; M671-H674 WeakPolarHBondContact O-CB 3.47Å; M671-H674 PolarHBondContact O-N 3.21Å; M671-T675 PolarHBondContact O-N 3.28Å; M671-T675 PolarHBondContact O-OG1 3.06Å
672	R	81	Confident	77.9	Confident	57 Å²	57	65.3 Å²	65.3	22%	0.215	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-11.1	170.3	-69.8	-169.9	171.1	148.6	0.5	116.4	K668 H670 G676 E677 T692	K668-R672 WeakPolarHBondContact O-CG 3.49Å; H670-R672 PolarHBondContact O-N 2.97Å; R672-G676 CarbonylContact O-C 3.53Å; R672-E677 HydrophobicContact CB-CB 4.04Å; R672-E677 HydrophobicContact CG-CB 3.74Å; R672-E677 WeakPolarHBondContact CG-OE2 3.48Å; R672-E677 IonicContact CZ-OE2 3.63Å; R672-E677 IonicContact NE-OE2 2.68Å; R672-E677 PolarHBondContact NE-OE2 3.31Å; R672-E677 IonicContact NH2-OE2 2.68Å; R672-E677 PolarHBondContact O-N 2.7Å; R672-T692 HydrophobicContact CB-CG2 4.14Å
673	S	77.9	Confident	78.5	Confident	71 Å²	71	68.8 Å²	68.8	50%	0.497	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-9.7	167.7	54.7	0	0	0	0	113.7	H670 M671	H670-S673 PolarHBondContact ND1-OG 3.07Å; H670-S673 WeakPolarHBondContact O-CA 3.32Å; H670-S673 WeakPolarHBondContact O-CB 3.22Å; H670-S673 PolarHBondContact O-N 2.71Å; H670-S673 PolarHBondContact O-OG 2.84Å; M671-S673 PolarHBondContact O-N 2.95Å; M671-S673 VanDerWaalsContact O-N 3.15Å
674	H	79.3	Confident	78.8	Confident	50 Å²	50	66.6 Å²	66.6	23%	0.231	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-46.3	168.4	-63.3	-58.4	0	0	0	111.4	C652 F654 C657 H670 M671 G676	C652-H674 PolarHBondContact SG-NE2 3.22Å; F654-H674 HydrophobicContact CB-CB 4.41Å; F654-H674 HydrophobicContact CD1-CB 4.24Å; F654-H674 AromaticContact CD1-CE1 3.76Å; F654-H674 AromaticContact CD1-CG 3.79Å; F654-H674 AromaticContact CD1-ND1 3.5Å; F654-H674 HydrophobicContact CD2-CB 3.61Å; F654-H674 AromaticContact CD2-CG 3.91Å; F654-H674 HydrophobicContact CE1-CB 4.45Å; F654-H674 AromaticContact CE1-ND1 3.92Å; F654-H674 HydrophobicContact CE2-CB 3.86Å; F654-H674 HydrophobicContact CG-CB 3.81Å; F654-H674 AromaticContact CG-CD2 3.79Å; F654-H674 AromaticContact CG-CG 3.55Å; F654-H674 AromaticContact CG-ND1 3.79Å; F654-H674 HydrophobicContact CZ-CB 4.27Å; C657-H674 VanDerWaalsContact CB-CE1 3.46Å; C657-H674 WeakPolarHBondContact CB-CE1 3.44Å; C657-H674 PolarHBondContact SG-CE1 2.87Å; H670-H674 AromaticContact CE1-CD2 3.82Å; H670-H674 AromaticContact CE1-CE1 3.79Å; H670-H674 AromaticContact CE1-NE2 3.15Å; H670-H674 PolarHBondContact CE1-NE2 2.87Å; H670-H674 AromaticContact NE2-CD2 3.82Å; H670-H674 AromaticContact NE2-NE2 3.08Å; H670-H674 PolarHBondContact NE2-NE2 3.22Å; M671-H674 WeakPolarHBondContact O-CA 3.41Å; M671-H674 WeakPolarHBondContact O-CB 3.47Å; M671-H674 PolarHBondContact O-N 3.21Å; H674-G676 PolarHBondContact O-N 2.76Å
675	T	77.6	Confident	79.1	Confident	83 Å²	83	73.4 Å²	73.4	51%	0.509	38%	0.383	S	S	.	.	S	Bend	trans	-75.3	-3.2	177.6	61.9	0	0	0	0	114	M671 E677	M671-T675 PolarHBondContact O-N 3.28Å; M671-T675 PolarHBondContact O-OG1 3.06Å; T675-E677 PolarHBondContact O-N 3.24Å; T675-E677 WeakPolarHBondContact OG1-CG 3.46Å; T675-E677 PolarHBondContact OG1-OE1 2.82Å
676	G	78.8	Confident	79.3	Confident	50 Å²	50	73.9 Å²	73.9	52%	0.515	40%	0.401	S	S	.	.			trans	69.1	-8.9	-176.3	0	0	0	0	0	115.5	R672 H674 R678	R672-G676 CarbonylContact O-C 3.53Å; H674-G676 PolarHBondContact O-N 2.76Å; G676-R678 WeakPolarHBondContact O-CG 3.38Å; G676-R678 PolarHBondContact O-N 3.43Å
677	E	76.6	Confident	79.7	Confident	86 Å²	86	69.6 Å²	69.6	40%	0.402	39%	0.389	S	S	.	.			trans	-48	116.7	179.8	-86.7	173	-108.4	0	0	113.2	R672 T675 P679	R672-E677 HydrophobicContact CB-CB 4.04Å; R672-E677 HydrophobicContact CG-CB 3.74Å; R672-E677 WeakPolarHBondContact CG-OE2 3.48Å; R672-E677 IonicContact CZ-OE2 3.63Å; R672-E677 IonicContact NE-OE2 2.68Å; R672-E677 PolarHBondContact NE-OE2 3.31Å; R672-E677 IonicContact NH2-OE2 2.68Å; R672-E677 PolarHBondContact O-N 2.7Å; T675-E677 PolarHBondContact O-N 3.24Å; T675-E677 WeakPolarHBondContact OG1-CG 3.46Å; T675-E677 PolarHBondContact OG1-OE1 2.82Å; E677-P679 WeakPolarHBondContact O-CD 3.48Å
678	R	79.8	Confident	79.8	Confident	118 Å²	118	70.8 Å²	70.8	45%	0.445	41%	0.408	S	S	.	.			trans	-126.3	68.8	175.3	-69.9	159.4	74.6	168	-1.5	110.6	G676 F680 S690 F691 T692	G676-R678 WeakPolarHBondContact O-CG 3.38Å; G676-R678 PolarHBondContact O-N 3.43Å; R678-F680 PolarHBondContact O-N 2.79Å; R678-S690 VanDerWaalsContact CB-OG 3.28Å; R678-S690 WeakPolarHBondContact CB-OG 3.5Å; R678-S690 VanDerWaalsContact CZ-O 3.26Å; R678-S690 PolarHBondContact NE-O 2.98Å; R678-S690 PolarHBondContact NE-OG 3.48Å; R678-S690 PolarHBondContact NH2-O 2.99Å; R678-S690 WeakPolarHBondContact O-CB 3.35Å; R678-F691 CarbonylContact C-O 3.43Å; R678-F691 VanDerWaalsContact C-O 3.31Å; R678-F691 WeakPolarHBondContact CA-O 3.4Å; R678-T692 HydrophobicContact CG-CG2 3.9Å
679	P	77.2	Confident	80	Confident	67 Å²	67	71.3 Å²	71.3	44%	0.435	41%	0.406	S	S	.	.			trans	-68.7	0.1	-169.3	-19.2	34.2	0	0	0	115.5	E677	E677-P679 WeakPolarHBondContact O-CD 3.48Å
680	F	80	Confident	80.3	Confident	48 Å²	48	70 Å²	70	21%	0.211	40%	0.402	C	S	.	.	B	Isolated β-bridge	trans	-119	82.7	-174	-52	-61.7	0	0	0	109.1	R678 S690 F691 S693 M694 L697	R678-F680 PolarHBondContact O-N 2.79Å; F680-S690 CarbonylContact O-C 3.52Å; F680-S690 WeakPolarHBondContact O-CA 3.14Å; F680-F691 HydrophobicContact CB-CB 4.48Å; F680-F691 WeakPolarHBondContact CD2-O 3.44Å; F680-F691 PolarHBondContact N-O 2.85Å; F680-F691 PolarHBondContact O-N 3.15Å; F680-S693 VanDerWaalsContact CD2-C 3.5Å; F680-S693 VanDerWaalsContact CD2-CA 3.5Å; F680-M694 HydrophobicContact CB-CE 4.09Å; F680-M694 HydrophobicContact CD1-CE 3.53Å; F680-M694 HydrophobicContact CD1-CG 3.67Å; F680-M694 HydrophobicContact CD1-SD 3.71Å; F680-M694 HydrophobicContact CD2-CG 4.31Å; F680-M694 HydrophobicContact CE1-CE 4.22Å; F680-M694 HydrophobicContact CE1-CG 3.5Å; F680-M694 VanDerWaalsContact CE1-CG 3.5Å; F680-M694 HydrophobicContact CE1-SD 3.77Å; F680-M694 HydrophobicContact CE2-CG 4.16Å; F680-M694 HydrophobicContact CG-CE 3.97Å; F680-M694 HydrophobicContact CG-CG 4.07Å; F680-M694 HydrophobicContact CG-SD 4.49Å; F680-M694 HydrophobicContact CZ-CG 3.75Å; F680-L697 HydrophobicContact CB-CB 4.35Å; F680-L697 HydrophobicContact CB-CD2 4.09Å
681	V	83	Confident	80.3	Confident	73 Å²	73	70.8 Å²	70.8	44%	0.442	41%	0.405	S	S	.	.			trans	-69	155.5	175	-173.5	0	0	0	0	110	L697	V681-L697 WeakPolarHBondContact O-CD1 3.43Å; V681-L697 WeakPolarHBondContact O-CD2 3.39Å
682	C	89	Confident	80.4	Confident	3 Å²	3	69.2 Å²	69.2	2%	0.02	40%	0.398	C	S	.	.			trans	-93.9	99.5	171.7	-162.5	0	0	0	0	111	S684 W689 L697 H700	C682-S684 PolarHBondContact O-N 2.76Å; C682-S684 PolarHBondContact SG-OG 2.98Å; C682-W689 VanDerWaalsContact CB-O 3.31Å; C682-W689 WeakPolarHBondContact CB-O 3.37Å; C682-W689 PolarHBondContact N-O 3.21Å; C682-L697 HydrophobicContact CB-CD1 3.57Å; C682-H700 PolarHBondContact SG-CD2 2.94Å
683	D	83.2	Confident	80.4	Confident	121 Å²	121	67.2 Å²	67.2	65%	0.647	39%	0.393	S	S	*	.			trans	-66.7	55.3	170.8	8	-70.2	0	0	0	112	K701	D683-K701 WeakPolarHBondContact OD2-CE 3.42Å; D683-K701 IonicContact OD2-NZ 3.54Å; D683-K701 PolarHBondContact OD2-NZ 3.27Å
684	S	79.9	Confident	80.4	Confident	30 Å²	30	68.6 Å²	68.6	21%	0.21	39%	0.393	C	S	.	.	S	Bend	trans	-131.1	128.1	171.5	57.1	0	0	0	0	107.8	C682 C687 H704	C682-S684 PolarHBondContact O-N 2.76Å; C682-S684 PolarHBondContact SG-OG 2.98Å; S684-C687 WeakPolarHBondContact O-CB 3.12Å; S684-C687 PolarHBondContact O-N 3.05Å; S684-C687 VanDerWaalsContact O-N 3.12Å; S684-C687 VanDerWaalsContact OG-CB 3.22Å; S684-C687 WeakPolarHBondContact OG-CB 3.17Å; S684-H704 PolarHBondContact OG-CD2 3.32Å; S684-H704 PolarHBondContact OG-NE2 3.14Å; S684-H704 VanDerWaalsContact OG-NE2 3.13Å
685	E	77.1	Confident	80.3	Confident	192 Å²	192	70.3 Å²	70.3	90%	0.897	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	141.4	-172.1	-64.1	-51.9	140.8	0	0	113.6	C687	E685-C687 PolarHBondContact O-N 2.82Å; E685-C687 VanDerWaalsContact O-N 3.08Å
686	G	76.1	Confident	80.5	Confident	90 Å²	90	70.1 Å²	70.1	93%	0.928	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	0.3	-177.9	0	0	0	0	0	116
687	C	84.3	Confident	80.8	Confident	30 Å²	30	68.1 Å²	68.1	20%	0.203	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-67	-176.8	-164.1	0	0	0	0	113.9	S684 E685 W689 H700 H704	S684-C687 WeakPolarHBondContact O-CB 3.12Å; S684-C687 PolarHBondContact O-N 3.05Å; S684-C687 VanDerWaalsContact O-N 3.12Å; S684-C687 VanDerWaalsContact OG-CB 3.22Å; S684-C687 WeakPolarHBondContact OG-CB 3.17Å; E685-C687 PolarHBondContact O-N 2.82Å; E685-C687 VanDerWaalsContact O-N 3.08Å; C687-W689 VanDerWaalsContact O-CD1 3.3Å; C687-W689 PolarHBondContact O-N 3.22Å; C687-H700 PolarHBondContact SG-NE2 3.33Å; C687-H704 PolarHBondContact SG-CE1 3.22Å; C687-H704 PolarHBondContact SG-NE2 3.49Å; C687-H704 VanDerWaalsContact SG-NE2 3.37Å
688	G	80.3	Confident	81.1	Confident	50 Å²	50	69.2 Å²	69.2	52%	0.515	39%	0.388	S	S	.	.			trans	65	2.9	-178.7	0	0	0	0	0	116.5	S690	G688-S690 PolarHBondContact O-N 3.39Å
689	W	81.6	Confident	81.1	Confident	158 Å²	158	69 Å²	69	60%	0.598	39%	0.387	S	S	*	.			trans	-64.9	118.1	-177.5	-81.1	63.3	0	0	0	111.5	C682 C687 F691	C682-W689 VanDerWaalsContact CB-O 3.31Å; C682-W689 WeakPolarHBondContact CB-O 3.37Å; C682-W689 PolarHBondContact N-O 3.21Å; C687-W689 VanDerWaalsContact O-CD1 3.3Å; C687-W689 PolarHBondContact O-N 3.22Å; W689-F691 HydrophobicContact CB-CE2 3.88Å; W689-F691 HydrophobicContact CB-CZ 3.92Å; W689-F691 HydrophobicContact CE3-CZ 4.4Å; W689-F691 WeakPolarHBondContact O-CD2 3.47Å; W689-F691 WeakPolarHBondContact O-CE2 3.5Å
690	S	84.5	Confident	81.4	Confident	30 Å²	30	67 Å²	67	21%	0.21	37%	0.372	C	S	.	.			trans	-94.9	151.3	179.1	65.4	0	0	0	0	113.1	R678 F680 G688	R678-S690 VanDerWaalsContact CB-OG 3.28Å; R678-S690 WeakPolarHBondContact CB-OG 3.5Å; R678-S690 VanDerWaalsContact CZ-O 3.26Å; R678-S690 PolarHBondContact NE-O 2.98Å; R678-S690 PolarHBondContact NE-OG 3.48Å; R678-S690 PolarHBondContact NH2-O 2.99Å; R678-S690 WeakPolarHBondContact O-CB 3.35Å; F680-S690 CarbonylContact O-C 3.52Å; F680-S690 WeakPolarHBondContact O-CA 3.14Å; G688-S690 PolarHBondContact O-N 3.39Å
691	F	82.9	Confident	81.5	Confident	32 Å²	32	67.3 Å²	67.3	14%	0.14	37%	0.373	C	S	.	.	B	Isolated β-bridge	trans	-135.8	150.9	-175.5	-61.7	-82.8	0	0	0	113.6	R678 F680 W689 S693 K696 L697 H700	R678-F691 CarbonylContact C-O 3.43Å; R678-F691 VanDerWaalsContact C-O 3.31Å; R678-F691 WeakPolarHBondContact CA-O 3.4Å; F680-F691 HydrophobicContact CB-CB 4.48Å; F680-F691 WeakPolarHBondContact CD2-O 3.44Å; F680-F691 PolarHBondContact N-O 2.85Å; F680-F691 PolarHBondContact O-N 3.15Å; W689-F691 HydrophobicContact CB-CE2 3.88Å; W689-F691 HydrophobicContact CB-CZ 3.92Å; W689-F691 HydrophobicContact CE3-CZ 4.4Å; W689-F691 WeakPolarHBondContact O-CD2 3.47Å; W689-F691 WeakPolarHBondContact O-CE2 3.5Å; F691-S693 VanDerWaalsContact C-N 3.28Å; F691-S693 PolarHBondContact O-N 2.79Å; F691-K696 HydrophobicContact CB-CB 4.06Å; F691-K696 HydrophobicContact CD1-CB 3.85Å; F691-K696 HydrophobicContact CG-CB 4.14Å; F691-L697 HydrophobicContact CB-CB 4.43Å; F691-L697 HydrophobicContact CD2-CB 3.89Å; F691-L697 HydrophobicContact CD2-CD1 3.84Å; F691-L697 HydrophobicContact CD2-CG 4.47Å; F691-L697 HydrophobicContact CE2-CD1 4Å; F691-L697 HydrophobicContact CG-CB 4.38Å; F691-H700 HydrophobicContact CE1-CB 4.26Å; F691-H700 HydrophobicContact CE2-CB 3.82Å; F691-H700 AromaticContact CE2-CD2 3.4Å; F691-H700 VanDerWaalsContact CE2-CD2 3.4Å; F691-H700 WeakPolarHBondContact CE2-CD2 3.36Å; F691-H700 AromaticContact CE2-CG 3.59Å; F691-H700 AromaticContact CE2-NE2 4Å; F691-H700 HydrophobicContact CZ-CB 3.54Å; F691-H700 AromaticContact CZ-CD2 3.61Å; F691-H700 AromaticContact CZ-CG 3.33Å; F691-H700 AromaticContact CZ-ND1 3.67Å
692	T	79.3	Confident	81.5	Confident	14 Å²	14	67.5 Å²	67.5	9%	0.086	37%	0.366	C	S	.	.	S	Bend	trans	-78.1	-6.5	177.3	77.4	0	0	0	0	114.4	R672 R678 K696	R672-T692 HydrophobicContact CB-CG2 4.14Å; R678-T692 HydrophobicContact CG-CG2 3.9Å; T692-K696 PolarHBondContact OG1-NZ 3.22Å
693	S	79.6	Confident	81	Confident	16 Å²	16	74.4 Å²	74.4	11%	0.112	40%	0.396	C	S	.	.	S	Bend	trans	-154.6	138	-178.6	171.6	0	0	0	0	112.4	F680 F691 S695 K696 L697	F680-S693 VanDerWaalsContact CD2-C 3.5Å; F680-S693 VanDerWaalsContact CD2-CA 3.5Å; F691-S693 VanDerWaalsContact C-N 3.28Å; F691-S693 PolarHBondContact O-N 2.79Å; S693-S695 VanDerWaalsContact C-N 3.25Å; S693-S695 PolarHBondContact O-N 3.15Å; S693-S695 PolarHBondContact OG-N 3.26Å; S693-K696 WeakPolarHBondContact O-CA 3.42Å; S693-K696 WeakPolarHBondContact O-CB 3.26Å; S693-K696 PolarHBondContact O-N 3.02Å; S693-L697 PolarHBondContact O-N 3.13Å
694	M	77.6	Confident	80.8	Confident	100 Å²	100	72.8 Å²	72.8	49%	0.493	38%	0.384	S	S	.	.	H	α-helix	trans	-51.5	-39.4	176	-65.7	-102.8	63.3	0	0	113.3	F680 K696 L697 L698	F680-M694 HydrophobicContact CB-CE 4.09Å; F680-M694 HydrophobicContact CD1-CE 3.53Å; F680-M694 HydrophobicContact CD1-CG 3.67Å; F680-M694 HydrophobicContact CD1-SD 3.71Å; F680-M694 HydrophobicContact CD2-CG 4.31Å; F680-M694 HydrophobicContact CE1-CE 4.22Å; F680-M694 HydrophobicContact CE1-CG 3.5Å; F680-M694 VanDerWaalsContact CE1-CG 3.5Å; F680-M694 HydrophobicContact CE1-SD 3.77Å; F680-M694 HydrophobicContact CE2-CG 4.16Å; F680-M694 HydrophobicContact CG-CE 3.97Å; F680-M694 HydrophobicContact CG-CG 4.07Å; F680-M694 HydrophobicContact CG-SD 4.49Å; F680-M694 HydrophobicContact CZ-CG 3.75Å; M694-K696 PolarHBondContact O-N 3.43Å; M694-L697 HydrophobicContact CE-CD2 3.68Å; M694-L697 PolarHBondContact O-N 3.08Å; M694-L697 VanDerWaalsContact O-N 3.13Å; M694-L698 PolarHBondContact O-N 2.76Å
695	S	78.7	Confident	80.6	Confident	85 Å²	85	76.6 Å²	76.6	59%	0.594	40%	0.402	S	S	*	.	H	α-helix	trans	-69	-18.3	179.3	-44.2	0	0	0	0	113.4	S693	S693-S695 VanDerWaalsContact C-N 3.25Å; S693-S695 PolarHBondContact O-N 3.15Å; S693-S695 PolarHBondContact OG-N 3.26Å
696	K	80.8	Confident	80.3	Confident	79 Å²	79	71.3 Å²	71.3	34%	0.343	38%	0.38	S	S	.	.	H	α-helix	trans	-79.8	-46	168.7	-61.3	176.5	-178.5	174.8	0	110	F691 T692 S693 M694 R699 H700	F691-K696 HydrophobicContact CB-CB 4.06Å; F691-K696 HydrophobicContact CD1-CB 3.85Å; F691-K696 HydrophobicContact CG-CB 4.14Å; T692-K696 PolarHBondContact OG1-NZ 3.22Å; S693-K696 WeakPolarHBondContact O-CA 3.42Å; S693-K696 WeakPolarHBondContact O-CB 3.26Å; S693-K696 PolarHBondContact O-N 3.02Å; M694-K696 PolarHBondContact O-N 3.43Å; K696-R699 PolarHBondContact O-N 2.87Å; K696-H700 PolarHBondContact O-N 3.32Å
697	L	84.9	Confident	80.1	Confident	8 Å²	8	68.6 Å²	68.6	4%	0.042	34%	0.344	C	S	.	.	H	α-helix	trans	-59.5	-51	177.2	174	60.9	0	0	0	112.2	F680 V681 C682 F691 S693 M694 R699 H700 K701	F680-L697 HydrophobicContact CB-CB 4.35Å; F680-L697 HydrophobicContact CB-CD2 4.09Å; V681-L697 WeakPolarHBondContact O-CD1 3.43Å; V681-L697 WeakPolarHBondContact O-CD2 3.39Å; C682-L697 HydrophobicContact CB-CD1 3.57Å; F691-L697 HydrophobicContact CB-CB 4.43Å; F691-L697 HydrophobicContact CD2-CB 3.89Å; F691-L697 HydrophobicContact CD2-CD1 3.84Å; F691-L697 HydrophobicContact CD2-CG 4.47Å; F691-L697 HydrophobicContact CE2-CD1 4Å; F691-L697 HydrophobicContact CG-CB 4.38Å; S693-L697 PolarHBondContact O-N 3.13Å; M694-L697 HydrophobicContact CE-CD2 3.68Å; M694-L697 PolarHBondContact O-N 3.08Å; M694-L697 VanDerWaalsContact O-N 3.13Å; L697-R699 PolarHBondContact O-N 2.78Å; L697-R699 VanDerWaalsContact O-N 3.13Å; L697-H700 CarbonylContact O-C 3.28Å; L697-H700 WeakPolarHBondContact O-CA 3.44Å; L697-H700 WeakPolarHBondContact O-CB 3.48Å; L697-H700 PolarHBondContact O-N 3.39Å; L697-K701 HydrophobicContact CD1-CG 4.1Å; L697-K701 HydrophobicContact CG-CG 4.48Å; L697-K701 PolarHBondContact O-N 2.97Å
698	L	82.6	Confident	79.5	Confident	109 Å²	109	72.6 Å²	72.6	57%	0.571	36%	0.355	S	S	*	.	H	α-helix	trans	-65.4	-18.6	-179.2	-174.4	61.2	0	0	0	113.4	M694 R702	M694-L698 PolarHBondContact O-N 2.76Å; L698-R702 PolarHBondContact O-NE 3.45Å; L698-R702 PolarHBondContact O-NH2 3Å
699	R	80.8	Confident	79.3	Confident	113 Å²	113	79 Å²	79	43%	0.426	36%	0.364	S	S	.	.	H	α-helix	trans	-85.9	-23.6	170	-175.7	179.5	65.4	-130.6	2.1	112.3	K696 L697	K696-R699 PolarHBondContact O-N 2.87Å; L697-R699 PolarHBondContact O-N 2.78Å; L697-R699 VanDerWaalsContact O-N 3.13Å
700	H	84.5	Confident	79.2	Confident	26 Å²	26	75 Å²	75	12%	0.12	35%	0.351	C	S	.	.	H	α-helix	trans	-82.6	-40.4	175	167.7	82	0	0	0	111.9	C682 C687 F691 K696 L697 R702 K703 H704	C682-H700 PolarHBondContact SG-CD2 2.94Å; C687-H700 PolarHBondContact SG-NE2 3.33Å; F691-H700 HydrophobicContact CE1-CB 4.26Å; F691-H700 HydrophobicContact CE2-CB 3.82Å; F691-H700 AromaticContact CE2-CD2 3.4Å; F691-H700 VanDerWaalsContact CE2-CD2 3.4Å; F691-H700 WeakPolarHBondContact CE2-CD2 3.36Å; F691-H700 AromaticContact CE2-CG 3.59Å; F691-H700 AromaticContact CE2-NE2 4Å; F691-H700 HydrophobicContact CZ-CB 3.54Å; F691-H700 AromaticContact CZ-CD2 3.61Å; F691-H700 AromaticContact CZ-CG 3.33Å; F691-H700 AromaticContact CZ-ND1 3.67Å; K696-H700 PolarHBondContact O-N 3.32Å; L697-H700 CarbonylContact O-C 3.28Å; L697-H700 WeakPolarHBondContact O-CA 3.44Å; L697-H700 WeakPolarHBondContact O-CB 3.48Å; L697-H700 PolarHBondContact O-N 3.39Å; H700-R702 VanDerWaalsContact C-N 3.28Å; H700-R702 PolarHBondContact O-N 3.09Å; H700-K703 VanDerWaalsContact O-CB 3.26Å; H700-K703 WeakPolarHBondContact O-CB 3.28Å; H700-K703 PolarHBondContact O-N 3.12Å; H700-H704 AromaticContact CD2-NE2 3.72Å; H700-H704 AromaticContact CE1-CE1 3.81Å; H700-H704 AromaticContact CE1-NE2 3.64Å; H700-H704 AromaticContact NE2-CE1 3.72Å; H700-H704 AromaticContact NE2-NE2 3.11Å; H700-H704 PolarHBondContact NE2-NE2 2.95Å; H700-H704 VanDerWaalsContact NE2-NE2 3.11Å
701	K	81.9	Confident	79	Confident	55 Å²	55	77.8 Å²	77.8	24%	0.239	37%	0.366	C	S	.	.	H	α-helix	trans	-53.3	-43.9	173.4	-74.7	-155.7	172.8	-157.5	0	112.5	D683 L697 K703 H704 D705	D683-K701 WeakPolarHBondContact OD2-CE 3.42Å; D683-K701 IonicContact OD2-NZ 3.54Å; D683-K701 PolarHBondContact OD2-NZ 3.27Å; L697-K701 HydrophobicContact CD1-CG 4.1Å; L697-K701 HydrophobicContact CG-CG 4.48Å; L697-K701 PolarHBondContact O-N 2.97Å; K701-K703 PolarHBondContact O-N 3.24Å; K701-H704 WeakPolarHBondContact O-CA 3.29Å; K701-H704 WeakPolarHBondContact O-CB 3.36Å; K701-H704 PolarHBondContact O-N 2.87Å; K701-D705 PolarHBondContact O-N 3.45Å; K701-D705 VanDerWaalsContact O-OD2 3.06Å
702	R	81.8	Confident	79.1	Confident	76 Å²	76	76.6 Å²	76.6	29%	0.287	36%	0.362	S	S	.	.	H	α-helix	trans	-59.8	0.9	171.6	-79.1	179.6	-75.6	158.7	-15.9	116.7	L698 H700 D705 D707	L698-R702 PolarHBondContact O-NE 3.45Å; L698-R702 PolarHBondContact O-NH2 3Å; H700-R702 VanDerWaalsContact C-N 3.28Å; H700-R702 PolarHBondContact O-N 3.09Å; R702-D705 VanDerWaalsContact CA-OD2 3.31Å; R702-D705 WeakPolarHBondContact CA-OD2 3.46Å; R702-D705 PolarHBondContact N-OD2 2.95Å; R702-D707 HydrophobicContact CB-CB 4.2Å; R702-D707 WeakPolarHBondContact CD-OD2 3.31Å; R702-D707 HydrophobicContact CG-CB 3.97Å; R702-D707 PolarHBondContact O-N 3.33Å
703	K	78.3	Confident	79.1	Confident	148 Å²	148	80.5 Å²	80.5	64%	0.643	39%	0.387	S	S	*	.	H	α-helix	trans	-91	-30.4	164.4	-67.8	-171.1	160.8	-155.7	0	113	H700 K701	H700-K703 VanDerWaalsContact O-CB 3.26Å; H700-K703 WeakPolarHBondContact O-CB 3.28Å; H700-K703 PolarHBondContact O-N 3.12Å; K701-K703 PolarHBondContact O-N 3.24Å
704	H	80	Confident	79	Confident	88 Å²	88	83.3 Å²	83.3	41%	0.407	40%	0.399	S	S	.	.	H	α-helix	trans	-77	-40.2	176	-52.8	-44.6	0	0	0	110.1	S684 C687 H700 K701 D706	S684-H704 PolarHBondContact OG-CD2 3.32Å; S684-H704 PolarHBondContact OG-NE2 3.14Å; S684-H704 VanDerWaalsContact OG-NE2 3.13Å; C687-H704 PolarHBondContact SG-CE1 3.22Å; C687-H704 PolarHBondContact SG-NE2 3.49Å; C687-H704 VanDerWaalsContact SG-NE2 3.37Å; H700-H704 AromaticContact CD2-NE2 3.72Å; H700-H704 AromaticContact CE1-CE1 3.81Å; H700-H704 AromaticContact CE1-NE2 3.64Å; H700-H704 AromaticContact NE2-CE1 3.72Å; H700-H704 AromaticContact NE2-NE2 3.11Å; H700-H704 PolarHBondContact NE2-NE2 2.95Å; H700-H704 VanDerWaalsContact NE2-NE2 3.11Å; K701-H704 WeakPolarHBondContact O-CA 3.29Å; K701-H704 WeakPolarHBondContact O-CB 3.36Å; K701-H704 PolarHBondContact O-N 2.87Å; H704-D706 PolarHBondContact O-N 2.75Å
705	D	74.6	Confident	78.5	Confident	110 Å²	110	87.4 Å²	87.4	59%	0.588	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-6	173	-40.4	-44	0	0	0	113.3	K701 R702 D707	K701-D705 PolarHBondContact O-N 3.45Å; K701-D705 VanDerWaalsContact O-OD2 3.06Å; R702-D705 VanDerWaalsContact CA-OD2 3.31Å; R702-D705 WeakPolarHBondContact CA-OD2 3.46Å; R702-D705 PolarHBondContact N-OD2 2.95Å; D705-D707 HydrophobicContact CB-CB 4.09Å; D705-D707 PolarHBondContact O-N 3.21Å
706	D	70.5	Confident	78.1	Confident	80 Å²	80	87.5 Å²	87.5	43%	0.428	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	32	45.3	-164	-153.4	13.7	0	0	0	114.9	H704 R708	H704-D706 PolarHBondContact O-N 2.75Å; D706-R708 VanDerWaalsContact C-N 3.28Å; D706-R708 VanDerWaalsContact CG-NE 3.27Å; D706-R708 WeakPolarHBondContact O-CG 3.41Å; D706-R708 PolarHBondContact O-N 3.07Å; D706-R708 WeakPolarHBondContact OD1-CG 3.17Å; D706-R708 IonicContact OD1-CZ 2.67Å; D706-R708 IonicContact OD1-NE 2.76Å; D706-R708 PolarHBondContact OD1-NE 2.87Å; D706-R708 IonicContact OD1-NH2 3.44Å; D706-R708 PolarHBondContact OD1-NH2 3.21Å; D706-R708 IonicContact OD2-CZ 3.88Å; D706-R708 IonicContact OD2-NE 2.9Å; D706-R708 PolarHBondContact OD2-NE 3.18Å; D706-R708 VanDerWaalsContact OD2-NE 3.12Å; D706-R708 IonicContact OD2-NH2 2.66Å; D706-R708 PolarHBondContact OD2-NH2 3.18Å
707	D	72.3	Confident	78.1	Confident	34 Å²	34	84.5 Å²	84.5	18%	0.182	42%	0.42	C	S	.	.			trans	-75.7	70.4	-167.4	-177.7	20	0	0	0	112.3	R702 D705 R709	R702-D707 HydrophobicContact CB-CB 4.2Å; R702-D707 WeakPolarHBondContact CD-OD2 3.31Å; R702-D707 HydrophobicContact CG-CB 3.97Å; R702-D707 PolarHBondContact O-N 3.33Å; D705-D707 HydrophobicContact CB-CB 4.09Å; D705-D707 PolarHBondContact O-N 3.21Å; D707-R709 VanDerWaalsContact C-N 3.28Å; D707-R709 PolarHBondContact O-N 3.48Å; D707-R709 WeakPolarHBondContact OD1-CG 3.3Å; D707-R709 IonicContact OD1-CZ 3.89Å; D707-R709 IonicContact OD1-NE 3.9Å; D707-R709 PolarHBondContact OD1-NE 3.21Å; D707-R709 IonicContact OD1-NH2 3.12Å; D707-R709 PolarHBondContact OD1-NH2 2.98Å; D707-R709 IonicContact OD2-CZ 3.16Å; D707-R709 VanDerWaalsContact OD2-CZ 3.27Å; D707-R709 IonicContact OD2-NE 2.7Å; D707-R709 PolarHBondContact OD2-NE 2.73Å; D707-R709 IonicContact OD2-NH2 3.21Å; D707-R709 PolarHBondContact OD2-NH2 2.97Å
708	R	71.6	Confident	77.8	Confident	113 Å²	113	87 Å²	87	43%	0.426	45%	0.448	S	S	.	.			trans	-84.5	53	-173.1	-62.6	-178.9	-166.2	178.5	17.7	113.7	D706 F710 S720 F721 T722	D706-R708 VanDerWaalsContact C-N 3.28Å; D706-R708 VanDerWaalsContact CG-NE 3.27Å; D706-R708 WeakPolarHBondContact O-CG 3.41Å; D706-R708 PolarHBondContact O-N 3.07Å; D706-R708 WeakPolarHBondContact OD1-CG 3.17Å; D706-R708 IonicContact OD1-CZ 2.67Å; D706-R708 IonicContact OD1-NE 2.76Å; D706-R708 PolarHBondContact OD1-NE 2.87Å; D706-R708 IonicContact OD1-NH2 3.44Å; D706-R708 PolarHBondContact OD1-NH2 3.21Å; D706-R708 IonicContact OD2-CZ 3.88Å; D706-R708 IonicContact OD2-NE 2.9Å; D706-R708 PolarHBondContact OD2-NE 3.18Å; D706-R708 VanDerWaalsContact OD2-NE 3.12Å; D706-R708 IonicContact OD2-NH2 2.66Å; D706-R708 PolarHBondContact OD2-NH2 3.18Å; R708-F710 PolarHBondContact O-N 3.15Å; R708-S720 WeakPolarHBondContact CB-OG 3.26Å; R708-S720 WeakPolarHBondContact CD-OG 3.39Å; R708-F721 CarbonylContact C-O 3.49Å; R708-F721 VanDerWaalsContact C-O 3.25Å; R708-F721 WeakPolarHBondContact CA-O 3.43Å; R708-T722 HydrophobicContact CG-CG2 3.9Å
709	R	76.8	Confident	77.6	Confident	185 Å²	185	87.1 Å²	87.1	70%	0.698	44%	0.443	S	S	*	.			trans	-54.2	-17.3	-177.8	-51	-166.8	-171	-134.2	-9.6	116	D707	D707-R709 VanDerWaalsContact C-N 3.28Å; D707-R709 PolarHBondContact O-N 3.48Å; D707-R709 WeakPolarHBondContact OD1-CG 3.3Å; D707-R709 IonicContact OD1-CZ 3.89Å; D707-R709 IonicContact OD1-NE 3.9Å; D707-R709 PolarHBondContact OD1-NE 3.21Å; D707-R709 IonicContact OD1-NH2 3.12Å; D707-R709 PolarHBondContact OD1-NH2 2.98Å; D707-R709 IonicContact OD2-CZ 3.16Å; D707-R709 VanDerWaalsContact OD2-CZ 3.27Å; D707-R709 IonicContact OD2-NE 2.7Å; D707-R709 PolarHBondContact OD2-NE 2.73Å; D707-R709 IonicContact OD2-NH2 3.21Å; D707-R709 PolarHBondContact OD2-NH2 2.97Å
710	F	78.2	Confident	77.7	Confident	75 Å²	75	83.5 Å²	83.5	33%	0.329	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	77.5	-175.4	-54.6	-77.3	0	0	0	110.2	R708 F721 R723 A724 L727	R708-F710 PolarHBondContact O-N 3.15Å; F710-F721 HydrophobicContact CB-CB 4.37Å; F710-F721 WeakPolarHBondContact CB-O 3.35Å; F710-F721 WeakPolarHBondContact CD2-O 3.26Å; F710-F721 PolarHBondContact N-O 2.87Å; F710-F721 PolarHBondContact O-N 2.96Å; F710-R723 VanDerWaalsContact CD2-C 3.48Å; F710-A724 HydrophobicContact CD1-CB 3.74Å; F710-A724 VanDerWaalsContact CD2-N 3.34Å; F710-A724 HydrophobicContact CE1-CB 3.69Å; F710-A724 HydrophobicContact CG-CB 4.22Å; F710-A724 HydrophobicContact CZ-CB 4.11Å; F710-L727 HydrophobicContact CB-CB 4.07Å; F710-L727 HydrophobicContact CB-CD2 3.84Å
711	V	82.1	Confident	77.5	Confident	88 Å²	88	84.6 Å²	84.6	53%	0.533	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	143.5	172.4	-168.7	0	0	0	0	110.2	L727	V711-L727 WeakPolarHBondContact O-CD2 3.21Å
712	C	85.1	Confident	77.3	Confident	7 Å²	7	83.5 Å²	83.5	5%	0.047	44%	0.438	C	S	.	.			trans	-74.3	124.7	171.6	-166.3	0	0	0	0	110.5	E714 C717 K719 L727	C712-E714 PolarHBondContact O-N 2.81Å; C712-C717 HydrophobicContact CB-CB 4.49Å; C712-K719 VanDerWaalsContact CB-O 3.23Å; C712-K719 WeakPolarHBondContact CB-O 3.4Å; C712-K719 PolarHBondContact N-O 3.29Å; C712-L727 HydrophobicContact CB-CD1 3.9Å
713	P	77.9	Confident	77.2	Confident	95 Å²	95	83.2 Å²	83.2	62%	0.617	44%	0.437	S	S	*	.			trans	-82.5	6	-178.7	36.9	-38.3	0	0	0	113.4
714	E	77.5	Confident	77.3	Confident	76 Å²	76	78.6 Å²	78.6	36%	0.355	43%	0.426	S	S	.	.	S	Bend	trans	-85	121.5	179.8	-52	-62	150.6	0	0	109.2	C712 C717 H734	C712-E714 PolarHBondContact O-N 2.81Å; E714-C717 HydrophobicContact CB-CB 4.39Å; E714-C717 WeakPolarHBondContact O-CB 3.37Å; E714-C717 PolarHBondContact O-N 3.13Å; E714-C717 VanDerWaalsContact O-N 3.08Å; E714-H734 HydrophobicContact CB-CB 4.47Å; E714-H734 HydrophobicContact CG-CB 3.9Å
715	E	67.6	Low	77.2	Confident	186 Å²	186	80.1 Å²	80.1	87%	0.869	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	140.8	-174.7	-71.7	-55.5	143.7	0	0	113	C717	E715-C717 PolarHBondContact O-N 3.49Å
716	G	70.9	Confident	77.5	Confident	86 Å²	86	80.4 Å²	80.4	89%	0.887	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	-2.4	-174.6	0	0	0	0	0	115.7
717	C	80.9	Confident	78	Confident	17 Å²	17	78 Å²	78	12%	0.115	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-48.7	177.7	-172	0	0	0	0	114	C712 E714 E715 K719 H730 H734	C712-C717 HydrophobicContact CB-CB 4.49Å; E714-C717 HydrophobicContact CB-CB 4.39Å; E714-C717 WeakPolarHBondContact O-CB 3.37Å; E714-C717 PolarHBondContact O-N 3.13Å; E714-C717 VanDerWaalsContact O-N 3.08Å; E715-C717 PolarHBondContact O-N 3.49Å; C717-K719 PolarHBondContact O-N 3.08Å; C717-H730 PolarHBondContact SG-NE2 2.93Å; C717-H734 WeakPolarHBondContact CB-NE2 3.23Å; C717-H734 PolarHBondContact SG-NE2 2.87Å
718	G	77.4	Confident	78.4	Confident	61 Å²	61	83.6 Å²	83.6	63%	0.629	44%	0.441	S	S	*	.			trans	62.2	-0.8	179.6	0	0	0	0	0	117.1	S720	G718-S720 PolarHBondContact O-N 3.19Å
719	K	79.6	Confident	78.8	Confident	110 Å²	110	79.6 Å²	79.6	48%	0.478	44%	0.435	S	S	.	.			trans	-75	120.9	-172.6	-71.1	173.9	-164.4	119.2	0	111.8	C712 C717 F721	C712-K719 VanDerWaalsContact CB-O 3.23Å; C712-K719 WeakPolarHBondContact CB-O 3.4Å; C712-K719 PolarHBondContact N-O 3.29Å; C717-K719 PolarHBondContact O-N 3.08Å; K719-F721 HydrophobicContact CB-CE2 3.79Å; K719-F721 HydrophobicContact CB-CZ 4.08Å; K719-F721 WeakPolarHBondContact O-CE2 3.33Å
720	S	81.1	Confident	79	Confident	37 Å²	37	71.7 Å²	71.7	26%	0.259	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	146.2	178.9	61	0	0	0	0	112.5	R708 G718	R708-S720 WeakPolarHBondContact CB-OG 3.26Å; R708-S720 WeakPolarHBondContact CD-OG 3.39Å; G718-S720 PolarHBondContact O-N 3.19Å
721	F	80.8	Confident	79	Confident	49 Å²	49	69.6 Å²	69.6	22%	0.215	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	148.6	-173.1	-59.9	-95.4	0	0	0	111.4	R708 F710 K719 R723 H726 L727 H730	R708-F721 CarbonylContact C-O 3.49Å; R708-F721 VanDerWaalsContact C-O 3.25Å; R708-F721 WeakPolarHBondContact CA-O 3.43Å; F710-F721 HydrophobicContact CB-CB 4.37Å; F710-F721 WeakPolarHBondContact CB-O 3.35Å; F710-F721 WeakPolarHBondContact CD2-O 3.26Å; F710-F721 PolarHBondContact N-O 2.87Å; F710-F721 PolarHBondContact O-N 2.96Å; K719-F721 HydrophobicContact CB-CE2 3.79Å; K719-F721 HydrophobicContact CB-CZ 4.08Å; K719-F721 WeakPolarHBondContact O-CE2 3.33Å; F721-R723 PolarHBondContact O-N 2.77Å; F721-H726 HydrophobicContact CB-CB 4.32Å; F721-H726 HydrophobicContact CD1-CB 3.77Å; F721-H726 HydrophobicContact CG-CB 4.28Å; F721-L727 HydrophobicContact CD2-CB 4.17Å; F721-L727 HydrophobicContact CD2-CD1 4.31Å; F721-H730 HydrophobicContact CE1-CB 4.35Å; F721-H730 HydrophobicContact CE2-CB 4.04Å; F721-H730 AromaticContact CE2-CD2 3.24Å; F721-H730 WeakPolarHBondContact CE2-CD2 3.19Å; F721-H730 AromaticContact CE2-CG 3.81Å; F721-H730 HydrophobicContact CZ-CB 3.69Å; F721-H730 AromaticContact CZ-CD2 3.4Å; F721-H730 WeakPolarHBondContact CZ-CD2 3.41Å; F721-H730 AromaticContact CZ-CG 3.53Å
722	T	78.8	Confident	78.9	Confident	33 Å²	33	67 Å²	67	20%	0.202	38%	0.383	C	S	.	.	S	Bend	trans	-80.4	0.2	173.7	57.7	0	0	0	0	113.5	R708	R708-T722 HydrophobicContact CG-CG2 3.9Å
723	R	79	Confident	78.4	Confident	70 Å²	70	69.8 Å²	69.8	26%	0.264	40%	0.4	S	S	.	.			trans	-146.1	128.9	-178.8	-57.9	-177.5	74.6	-138.4	3.5	112.8	F710 F721 E725 H726 L727	F710-R723 VanDerWaalsContact CD2-C 3.48Å; F721-R723 PolarHBondContact O-N 2.77Å; R723-E725 IonicContact CZ-OE2 2.81Å; R723-E725 IonicContact NH1-OE1 2.83Å; R723-E725 IonicContact NH1-OE2 3.27Å; R723-E725 PolarHBondContact NH1-OE2 2.92Å; R723-E725 IonicContact NH2-OE2 3.38Å; R723-E725 PolarHBondContact NH2-OE2 3.31Å; R723-E725 PolarHBondContact O-N 3.44Å; R723-H726 HydrophobicContact CB-CB 4.37Å; R723-H726 PolarHBondContact NH1-NE2 3.28Å; R723-H726 WeakPolarHBondContact O-CB 3.42Å; R723-H726 PolarHBondContact O-N 3.47Å; R723-L727 PolarHBondContact O-N 2.87Å; R723-L727 VanDerWaalsContact O-N 3.14Å
724	A	79.5	Confident	78.2	Confident	51 Å²	51	69.2 Å²	69.2	42%	0.421	39%	0.389	S	S	.	.	H	α-helix	trans	-54.9	-33.8	172.9	0	0	0	0	0	114.2	F710 H726 L727 K728	F710-A724 HydrophobicContact CD1-CB 3.74Å; F710-A724 VanDerWaalsContact CD2-N 3.34Å; F710-A724 HydrophobicContact CE1-CB 3.69Å; F710-A724 HydrophobicContact CG-CB 4.22Å; F710-A724 HydrophobicContact CZ-CB 4.11Å; A724-H726 VanDerWaalsContact C-N 3.32Å; A724-H726 PolarHBondContact O-N 3.21Å; A724-L727 PolarHBondContact O-N 3.12Å; A724-K728 WeakPolarHBondContact O-CB 3.27Å; A724-K728 PolarHBondContact O-N 2.87Å
725	E	79.3	Confident	77.9	Confident	119 Å²	119	71.3 Å²	71.3	56%	0.556	40%	0.402	S	S	*	.	H	α-helix	trans	-62.4	-38.8	175.4	-175.3	-169.4	159.9	0	0	112.2	R723 K728 G729	R723-E725 IonicContact CZ-OE2 2.81Å; R723-E725 IonicContact NH1-OE1 2.83Å; R723-E725 IonicContact NH1-OE2 3.27Å; R723-E725 PolarHBondContact NH1-OE2 2.92Å; R723-E725 IonicContact NH2-OE2 3.38Å; R723-E725 PolarHBondContact NH2-OE2 3.31Å; R723-E725 PolarHBondContact O-N 3.44Å; E725-K728 PolarHBondContact O-N 2.75Å; E725-G729 PolarHBondContact O-N 3.19Å
726	H	79.6	Confident	77.8	Confident	116 Å²	116	65 Å²	65	54%	0.537	39%	0.387	S	S	.	.	H	α-helix	trans	-73.9	-39.2	178.6	-65	-171.4	0	0	0	110.4	F721 R723 A724 G729 H730	F721-H726 HydrophobicContact CB-CB 4.32Å; F721-H726 HydrophobicContact CD1-CB 3.77Å; F721-H726 HydrophobicContact CG-CB 4.28Å; R723-H726 HydrophobicContact CB-CB 4.37Å; R723-H726 PolarHBondContact NH1-NE2 3.28Å; R723-H726 WeakPolarHBondContact O-CB 3.42Å; R723-H726 PolarHBondContact O-N 3.47Å; A724-H726 VanDerWaalsContact C-N 3.32Å; A724-H726 PolarHBondContact O-N 3.21Å; H726-G729 PolarHBondContact O-N 3.13Å; H726-H730 WeakPolarHBondContact O-CB 3.17Å; H726-H730 PolarHBondContact O-N 2.97Å
727	L	82.6	Confident	77.6	Confident	30 Å²	30	64.5 Å²	64.5	16%	0.157	37%	0.367	C	S	.	.	H	α-helix	trans	-59.3	-44.6	169.6	172.7	59.4	0	0	0	111.9	F710 V711 C712 F721 R723 A724 G729 H730 S731	F710-L727 HydrophobicContact CB-CB 4.07Å; F710-L727 HydrophobicContact CB-CD2 3.84Å; V711-L727 WeakPolarHBondContact O-CD2 3.21Å; C712-L727 HydrophobicContact CB-CD1 3.9Å; F721-L727 HydrophobicContact CD2-CB 4.17Å; F721-L727 HydrophobicContact CD2-CD1 4.31Å; R723-L727 PolarHBondContact O-N 2.87Å; R723-L727 VanDerWaalsContact O-N 3.14Å; A724-L727 PolarHBondContact O-N 3.12Å; L727-G729 PolarHBondContact O-N 2.81Å; L727-H730 CarbonylContact O-C 3.25Å; L727-H730 WeakPolarHBondContact O-CA 3.19Å; L727-H730 WeakPolarHBondContact O-CB 3.26Å; L727-H730 PolarHBondContact O-N 2.69Å; L727-S731 PolarHBondContact O-N 2.87Å
728	K	81	Confident	77	Confident	152 Å²	152	69.6 Å²	69.6	66%	0.661	39%	0.387	S	S	*	.	H	α-helix	trans	-64.5	-37.7	176.9	-174.2	175.7	-180	179.2	0	112.4	A724 E725 H730 S731 I732	A724-K728 WeakPolarHBondContact O-CB 3.27Å; A724-K728 PolarHBondContact O-N 2.87Å; E725-K728 PolarHBondContact O-N 2.75Å; K728-H730 PolarHBondContact O-N 3.38Å; K728-S731 PolarHBondContact O-OG 3.08Å; K728-I732 WeakPolarHBondContact O-CD1 2.84Å; K728-I732 WeakPolarHBondContact O-CG1 3.4Å
729	G	78.8	Confident	76.8	Confident	29 Å²	29	70.1 Å²	70.1	30%	0.299	38%	0.379	S	S	.	.	H	α-helix	trans	-65.5	-26	171.2	0	0	0	0	0	113.2	E725 H726 L727	E725-G729 PolarHBondContact O-N 3.19Å; H726-G729 PolarHBondContact O-N 3.13Å; L727-G729 PolarHBondContact O-N 2.81Å
730	H	81.9	Confident	76.6	Confident	19 Å²	19	67 Å²	67	9%	0.088	37%	0.366	C	S	.	.	H	α-helix	trans	-87.3	-37.7	178.8	175.8	43.8	0	0	0	113.8	C717 F721 H726 L727 K728 I732 T733 H734	C717-H730 PolarHBondContact SG-NE2 2.93Å; F721-H730 HydrophobicContact CE1-CB 4.35Å; F721-H730 HydrophobicContact CE2-CB 4.04Å; F721-H730 AromaticContact CE2-CD2 3.24Å; F721-H730 WeakPolarHBondContact CE2-CD2 3.19Å; F721-H730 AromaticContact CE2-CG 3.81Å; F721-H730 HydrophobicContact CZ-CB 3.69Å; F721-H730 AromaticContact CZ-CD2 3.4Å; F721-H730 WeakPolarHBondContact CZ-CD2 3.41Å; F721-H730 AromaticContact CZ-CG 3.53Å; H726-H730 WeakPolarHBondContact O-CB 3.17Å; H726-H730 PolarHBondContact O-N 2.97Å; L727-H730 CarbonylContact O-C 3.25Å; L727-H730 WeakPolarHBondContact O-CA 3.19Å; L727-H730 WeakPolarHBondContact O-CB 3.26Å; L727-H730 PolarHBondContact O-N 2.69Å; K728-H730 PolarHBondContact O-N 3.38Å; H730-I732 PolarHBondContact O-N 3.15Å; H730-T733 PolarHBondContact ND1-OG1 3.3Å; H730-T733 WeakPolarHBondContact O-CA 3.27Å; H730-T733 WeakPolarHBondContact O-CB 3.31Å; H730-T733 PolarHBondContact O-N 3.29Å; H730-T733 PolarHBondContact O-OG1 3.47Å; H730-H734 AromaticContact CE1-CD2 3.72Å; H730-H734 AromaticContact NE2-CD2 3.86Å
731	S	77.9	Confident	76.5	Confident	31 Å²	31	67.9 Å²	67.9	22%	0.217	37%	0.366	C	S	.	.	H	α-helix	trans	-61.5	-31.9	176.2	60.8	0	0	0	0	112.2	L727 K728 T733 H734 L735	L727-S731 PolarHBondContact O-N 2.87Å; K728-S731 PolarHBondContact O-OG 3.08Å; S731-T733 PolarHBondContact O-N 2.79Å; S731-H734 PolarHBondContact O-N 2.62Å; S731-L735 PolarHBondContact O-N 2.88Å
732	I	78.6	Confident	76.6	Confident	32 Å²	32	65.8 Å²	65.8	16%	0.164	36%	0.357	C	S	.	.	H	α-helix	trans	-58	-28	169.9	-63.5	166.7	0	0	0	112.1	K728 H730 T737 P739 S752	K728-I732 WeakPolarHBondContact O-CD1 2.84Å; K728-I732 WeakPolarHBondContact O-CG1 3.4Å; H730-I732 PolarHBondContact O-N 3.15Å; I732-T737 WeakPolarHBondContact CG2-O 3.49Å; I732-P739 HydrophobicContact CG2-CG 4.16Å; I732-S752 WeakPolarHBondContact CG2-O 3.46Å
733	T	74.8	Confident	76.5	Confident	66 Å²	66	70 Å²	70	41%	0.405	38%	0.375	S	S	.	.	H	α-helix	trans	-74.7	-23.3	175.6	70	0	0	0	0	114	H730 S731	H730-T733 PolarHBondContact ND1-OG1 3.3Å; H730-T733 WeakPolarHBondContact O-CA 3.27Å; H730-T733 WeakPolarHBondContact O-CB 3.31Å; H730-T733 PolarHBondContact O-N 3.29Å; H730-T733 PolarHBondContact O-OG1 3.47Å; S731-T733 PolarHBondContact O-N 2.79Å
734	H	74.5	Confident	76.4	Confident	84 Å²	84	68 Å²	68	39%	0.389	37%	0.372	S	S	.	.	H	α-helix	trans	-82	-40.8	174.9	-71.3	-68.6	0	0	0	112.2	E714 C717 H730 S731 G736	E714-H734 HydrophobicContact CB-CB 4.47Å; E714-H734 HydrophobicContact CG-CB 3.9Å; C717-H734 WeakPolarHBondContact CB-NE2 3.23Å; C717-H734 PolarHBondContact SG-NE2 2.87Å; H730-H734 AromaticContact CE1-CD2 3.72Å; H730-H734 AromaticContact NE2-CD2 3.86Å; S731-H734 PolarHBondContact O-N 2.62Å; H734-G736 PolarHBondContact O-N 3.48Å
735	L	71.3	Confident	75.7	Confident	119 Å²	119	74.2 Å²	74.2	62%	0.623	39%	0.393	S	S	*	.	S	Bend	trans	-62.1	-6.4	175	-65.8	170.3	0	0	0	113.8	S731 T737	S731-L735 PolarHBondContact O-N 2.88Å; L735-T737 HydrophobicContact CB-CG2 4.31Å; L735-T737 PolarHBondContact O-N 2.83Å
736	G	65.1	Low	75.1	Confident	55 Å²	55	71.8 Å²	71.8	57%	0.567	40%	0.399	S	S	*	.			trans	68.2	-23.4	-176.4	0	0	0	0	0	114.7	H734 K738	H734-G736 PolarHBondContact O-N 3.48Å; G736-K738 PolarHBondContact O-N 3.19Å
737	T	66.3	Low	74.9	Confident	74 Å²	74	67.6 Å²	67.6	45%	0.454	38%	0.383	S	S	.	.			trans	-51.8	126.3	177.5	58.4	0	0	0	0	111.4	I732 L735 P739	I732-T737 WeakPolarHBondContact CG2-O 3.49Å; L735-T737 HydrophobicContact CB-CG2 4.31Å; L735-T737 PolarHBondContact O-N 2.83Å; T737-P739 WeakPolarHBondContact O-CD 3.47Å
738	K	69.8	Low	74.3	Confident	124 Å²	124	74.6 Å²	74.6	54%	0.539	41%	0.409	S	S	.	.			trans	-114.1	71.5	173.6	-74.3	166.3	168.6	-177.4	0	108.3	G736 F740 K750 F751	G736-K738 PolarHBondContact O-N 3.19Å; K738-F740 PolarHBondContact O-N 3.36Å; K738-F740 VanDerWaalsContact O-N 3.16Å; K738-K750 HydrophobicContact CB-CB 3.58Å; K738-K750 HydrophobicContact CD-CB 4.21Å; K738-K750 WeakPolarHBondContact CD-O 3.16Å; K738-K750 HydrophobicContact CG-CB 4.5Å; K738-F751 CarbonylContact C-O 3.56Å; K738-F751 VanDerWaalsContact CA-O 3.26Å; K738-F751 WeakPolarHBondContact CA-O 3.43Å
739	P	72.6	Confident	74.2	Confident	72 Å²	72	68.8 Å²	68.8	47%	0.468	39%	0.389	S	S	.	.			trans	-69.2	-12.2	-170.2	29.5	-36.9	0	0	0	113.6	I732 T737 Q741	I732-P739 HydrophobicContact CG2-CG 4.16Å; T737-P739 WeakPolarHBondContact O-CD 3.47Å; P739-Q741 PolarHBondContact O-N 3.1Å
740	F	75.4	Confident	74.3	Confident	46 Å²	46	72.8 Å²	72.8	20%	0.202	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	84.4	179.7	-54.7	-68.4	0	0	0	109.8	K738 F751 A753 R754 L757	K738-F740 PolarHBondContact O-N 3.36Å; K738-F740 VanDerWaalsContact O-N 3.16Å; F740-F751 HydrophobicContact CB-CB 4.31Å; F740-F751 WeakPolarHBondContact CB-O 3.43Å; F740-F751 PolarHBondContact N-O 3.04Å; F740-F751 VanDerWaalsContact N-O 3.09Å; F740-F751 WeakPolarHBondContact O-CD2 3.44Å; F740-F751 PolarHBondContact O-N 3.32Å; F740-A753 VanDerWaalsContact CD2-C 3.4Å; F740-R754 HydrophobicContact CD1-CB 3.9Å; F740-R754 HydrophobicContact CD1-CG 4.06Å; F740-R754 HydrophobicContact CD2-CB 4.36Å; F740-R754 VanDerWaalsContact CD2-N 3.31Å; F740-R754 HydrophobicContact CE1-CB 3.77Å; F740-R754 HydrophobicContact CE1-CG 4.08Å; F740-R754 HydrophobicContact CE2-CB 4.23Å; F740-R754 HydrophobicContact CG-CB 4.2Å; F740-R754 HydrophobicContact CZ-CB 3.94Å; F740-L757 HydrophobicContact CB-CB 3.92Å; F740-L757 HydrophobicContact CB-CD2 3.79Å; F740-L757 HydrophobicContact CB-CG 4.46Å
741	Q	79.3	Confident	74.2	Confident	54 Å²	54	74 Å²	74	25%	0.252	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	150.1	171.4	179.6	163.6	-34.9	0	0	110.9	P739 H743 K750 L757	P739-Q741 PolarHBondContact O-N 3.1Å; Q741-H743 PolarHBondContact O-CD2 3.11Å; Q741-K750 HydrophobicContact CB-CD 4.46Å; Q741-K750 HydrophobicContact CB-CG 4.2Å; Q741-K750 HydrophobicContact CG-CG 4.18Å; Q741-L757 WeakPolarHBondContact O-CD2 3.33Å
742	C	82.5	Confident	74.2	Confident	6 Å²	6	74.1 Å²	74.1	4%	0.041	40%	0.404	C	S	.	.			trans	-83.5	128.3	167.4	-160.5	0	0	0	0	110.6	C747 A749 L757 H760 H764	C742-C747 WeakPolarHBondContact CB-O 3.36Å; C742-A749 PolarHBondContact N-O 2.61Å; C742-L757 HydrophobicContact CB-CD1 3.75Å; C742-H760 VanDerWaalsContact SG-CD2 3.59Å; C742-H764 VanDerWaalsContact SG-CD2 3.52Å
743	H	76.5	Confident	74.1	Confident	122 Å²	122	73.7 Å²	73.7	57%	0.565	41%	0.405	S	S	*	.			trans	-102.7	59.2	173	-54.4	-103.3	0	0	0	107.9	Q741	Q741-H743 PolarHBondContact O-CD2 3.11Å
744	A	76.6	Confident	74.2	Confident	26 Å²	26	79 Å²	79	22%	0.215	42%	0.418	C	S	.	.	B	Isolated β-bridge	trans	-122.8	134.3	175	0	0	0	0	0	107.8	G746 C747 H764	A744-G746 PolarHBondContact O-N 3.43Å; A744-C747 PolarHBondContact O-N 3.05Å; A744-H764 HydrophobicContact CB-CB 4.23Å; A744-H764 VanDerWaalsContact CB-CD2 3.42Å; A744-H764 WeakPolarHBondContact CB-CD2 3.38Å
745	E	65.1	Low	74.3	Confident	183 Å²	183	78.7 Å²	78.7	86%	0.855	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	129	-172.1	-64.2	-46.7	113	0	0	112.5	C747	E745-C747 VanDerWaalsContact C-N 3.3Å; E745-C747 PolarHBondContact O-N 3.1Å
746	G	66.1	Low	74.8	Confident	67 Å²	67	75.3 Å²	75.3	69%	0.691	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.2	2.6	-175	0	0	0	0	0	116.5	A744	A744-G746 PolarHBondContact O-N 3.43Å
747	C	75.9	Confident	75.7	Confident	28 Å²	28	74.1 Å²	74.1	19%	0.189	39%	0.392	C	S	.	.	B	Isolated β-bridge	trans	-126.4	87.3	-175.9	-156.5	0	0	0	0	116	C742 A744 E745 A749 H760 H764	C742-C747 WeakPolarHBondContact CB-O 3.36Å; A744-C747 PolarHBondContact O-N 3.05Å; E745-C747 VanDerWaalsContact C-N 3.3Å; E745-C747 PolarHBondContact O-N 3.1Å; C747-A749 PolarHBondContact O-N 3.34Å; C747-H760 VanDerWaalsContact SG-CE1 3.52Å; C747-H760 PolarHBondContact SG-NE2 3.49Å; C747-H760 VanDerWaalsContact SG-NE2 3.41Å; C747-H764 VanDerWaalsContact CB-CE1 3.41Å; C747-H764 WeakPolarHBondContact CB-CE1 3.42Å; C747-H764 VanDerWaalsContact CB-NE2 3.35Å; C747-H764 WeakPolarHBondContact CB-NE2 3.45Å; C747-H764 PolarHBondContact SG-CE1 2.9Å; C747-H764 PolarHBondContact SG-NE2 2.75Å
748	Y	70.8	Confident	76.5	Confident	178 Å²	178	77.9 Å²	77.9	70%	0.698	40%	0.399	S	S	*	.			trans	-76.3	24.9	178.2	-52.4	-77.1	0	0	0	115.4	K750	Y748-K750 WeakPolarHBondContact O-CG 3.36Å; Y748-K750 PolarHBondContact O-N 2.71Å
749	A	78.3	Confident	77	Confident	30 Å²	30	77.1 Å²	77.1	25%	0.248	40%	0.4	C	S	.	.			trans	-70	125.8	-174.8	0	0	0	0	0	111.7	C742 C747 F751 H760	C742-A749 PolarHBondContact N-O 2.61Å; C747-A749 PolarHBondContact O-N 3.34Å; A749-F751 HydrophobicContact CB-CE2 3.71Å; A749-F751 HydrophobicContact CB-CZ 3.8Å; A749-F751 WeakPolarHBondContact O-CE2 3.45Å; A749-H760 WeakPolarHBondContact CB-NE2 3.47Å
750	K	81.7	Confident	77.4	Confident	112 Å²	112	75.3 Å²	75.3	49%	0.487	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	138.6	-179.3	-43.2	-161.8	-167.3	-147.3	0	112.1	K738 Q741 Y748	K738-K750 HydrophobicContact CB-CB 3.58Å; K738-K750 HydrophobicContact CD-CB 4.21Å; K738-K750 WeakPolarHBondContact CD-O 3.16Å; K738-K750 HydrophobicContact CG-CB 4.5Å; Q741-K750 HydrophobicContact CB-CD 4.46Å; Q741-K750 HydrophobicContact CB-CG 4.2Å; Q741-K750 HydrophobicContact CG-CG 4.18Å; Y748-K750 WeakPolarHBondContact O-CG 3.36Å; Y748-K750 PolarHBondContact O-N 2.71Å
751	F	79.7	Confident	77.7	Confident	46 Å²	46	74.9 Å²	74.9	20%	0.202	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	148.1	-175.4	-57.6	-85.5	0	0	0	112.4	K738 F740 A749 L757 H760	K738-F751 CarbonylContact C-O 3.56Å; K738-F751 VanDerWaalsContact CA-O 3.26Å; K738-F751 WeakPolarHBondContact CA-O 3.43Å; F740-F751 HydrophobicContact CB-CB 4.31Å; F740-F751 WeakPolarHBondContact CB-O 3.43Å; F740-F751 PolarHBondContact N-O 3.04Å; F740-F751 VanDerWaalsContact N-O 3.09Å; F740-F751 WeakPolarHBondContact O-CD2 3.44Å; F740-F751 PolarHBondContact O-N 3.32Å; A749-F751 HydrophobicContact CB-CE2 3.71Å; A749-F751 HydrophobicContact CB-CZ 3.8Å; A749-F751 WeakPolarHBondContact O-CE2 3.45Å; F751-L757 HydrophobicContact CB-CB 4.35Å; F751-L757 HydrophobicContact CD2-CB 3.97Å; F751-L757 HydrophobicContact CD2-CD1 3.99Å; F751-L757 HydrophobicContact CE2-CD1 4.23Å; F751-L757 HydrophobicContact CG-CB 4.36Å; F751-H760 HydrophobicContact CE1-CB 4.14Å; F751-H760 HydrophobicContact CE2-CB 3.78Å; F751-H760 AromaticContact CE2-CD2 3.38Å; F751-H760 WeakPolarHBondContact CE2-CD2 3.42Å; F751-H760 AromaticContact CE2-CG 3.56Å; F751-H760 HydrophobicContact CZ-CB 3.46Å; F751-H760 VanDerWaalsContact CZ-CB 3.46Å; F751-H760 AromaticContact CZ-CD2 3.6Å; F751-H760 AromaticContact CZ-CG 3.29Å; F751-H760 AromaticContact CZ-ND1 3.71Å
752	S	77.5	Confident	77.7	Confident	32 Å²	32	77.2 Å²	77.2	22%	0.224	40%	0.397	C	S	.	.	S	Bend	trans	-80.7	-15.4	174.4	47.2	0	0	0	0	113.8	I732	I732-S752 WeakPolarHBondContact CG2-O 3.46Å
753	A	77.3	Confident	77.4	Confident	24 Å²	24	82.3 Å²	82.3	20%	0.198	42%	0.418	C	S	.	.	S	Bend	trans	-134.8	136.5	180	0	0	0	0	0	112.3	F740 S755 S756 L757	F740-A753 VanDerWaalsContact CD2-C 3.4Å; A753-S755 PolarHBondContact O-N 2.71Å; A753-S756 WeakPolarHBondContact O-CB 3Å; A753-S756 PolarHBondContact O-N 3.35Å; A753-L757 PolarHBondContact O-N 2.91Å; A753-L757 VanDerWaalsContact O-N 3.13Å
754	R	76.4	Confident	77.3	Confident	178 Å²	178	79 Å²	79	67%	0.672	40%	0.403	S	S	*	.	H	α-helix	trans	-61.4	-28.1	-179.9	-163.1	170	-179	141.9	-0	113	F740 Y758	F740-R754 HydrophobicContact CD1-CB 3.9Å; F740-R754 HydrophobicContact CD1-CG 4.06Å; F740-R754 HydrophobicContact CD2-CB 4.36Å; F740-R754 VanDerWaalsContact CD2-N 3.31Å; F740-R754 HydrophobicContact CE1-CB 3.77Å; F740-R754 HydrophobicContact CE1-CG 4.08Å; F740-R754 HydrophobicContact CE2-CB 4.23Å; F740-R754 HydrophobicContact CG-CB 4.2Å; F740-R754 HydrophobicContact CZ-CB 3.94Å; R754-Y758 WeakPolarHBondContact O-CB 3.37Å; R754-Y758 PolarHBondContact O-N 3.35Å
755	S	77.3	Confident	76.9	Confident	76 Å²	76	85.9 Å²	85.9	53%	0.531	43%	0.428	S	S	.	.	H	α-helix	trans	-66.5	-40	171.8	49.1	0	0	0	0	112.8	A753 Y758 I759	A753-S755 PolarHBondContact O-N 2.71Å; S755-Y758 PolarHBondContact O-N 2.95Å; S755-I759 VanDerWaalsContact O-CG1 3.31Å; S755-I759 WeakPolarHBondContact O-CG1 3.23Å; S755-I759 PolarHBondContact O-N 3.05Å
756	S	81.7	Confident	76.9	Confident	49 Å²	49	81.8 Å²	81.8	34%	0.343	41%	0.409	S	S	.	.	H	α-helix	trans	-67.9	-40.8	175.6	-56.7	0	0	0	0	111.4	A753 I759 H760	A753-S756 WeakPolarHBondContact O-CB 3Å; A753-S756 PolarHBondContact O-N 3.35Å; S756-I759 PolarHBondContact O-N 3.04Å; S756-H760 WeakPolarHBondContact O-CB 3.17Å; S756-H760 PolarHBondContact O-N 2.91Å
757	L	83.5	Confident	76.5	Confident	29 Å²	29	82.2 Å²	82.2	15%	0.152	40%	0.395	C	S	.	.	H	α-helix	trans	-59.4	-48.1	170.3	172.8	60.5	0	0	0	111.1	F740 Q741 C742 F751 A753 I759 H760 S761	F740-L757 HydrophobicContact CB-CB 3.92Å; F740-L757 HydrophobicContact CB-CD2 3.79Å; F740-L757 HydrophobicContact CB-CG 4.46Å; Q741-L757 WeakPolarHBondContact O-CD2 3.33Å; C742-L757 HydrophobicContact CB-CD1 3.75Å; F751-L757 HydrophobicContact CB-CB 4.35Å; F751-L757 HydrophobicContact CD2-CB 3.97Å; F751-L757 HydrophobicContact CD2-CD1 3.99Å; F751-L757 HydrophobicContact CE2-CD1 4.23Å; F751-L757 HydrophobicContact CG-CB 4.36Å; A753-L757 PolarHBondContact O-N 2.91Å; A753-L757 VanDerWaalsContact O-N 3.13Å; L757-I759 VanDerWaalsContact C-N 3.35Å; L757-I759 PolarHBondContact O-N 3.45Å; L757-H760 CarbonylContact O-C 3.18Å; L757-H760 WeakPolarHBondContact O-CA 3.48Å; L757-H760 WeakPolarHBondContact O-CB 3.21Å; L757-H760 PolarHBondContact O-N 3.26Å; L757-S761 PolarHBondContact O-N 2.88Å; L757-S761 PolarHBondContact O-OG 2.71Å
758	Y	82.3	Confident	75.4	Confident	153 Å²	153	85.5 Å²	85.5	60%	0.6	42%	0.424	S	S	*	.	H	α-helix	trans	-60.4	-40.5	179	177.3	-96.4	0	0	0	113.1	R754 S755 H760 S761 K762	R754-Y758 WeakPolarHBondContact O-CB 3.37Å; R754-Y758 PolarHBondContact O-N 3.35Å; S755-Y758 PolarHBondContact O-N 2.95Å; Y758-H760 VanDerWaalsContact C-N 3.28Å; Y758-H760 PolarHBondContact O-N 3.37Å; Y758-S761 PolarHBondContact O-OG 3.04Å; Y758-K762 VanDerWaalsContact O-CB 3.23Å; Y758-K762 WeakPolarHBondContact O-CB 3.34Å; Y758-K762 PolarHBondContact O-N 2.88Å
759	I	81.1	Confident	74.7	Confident	109 Å²	109	81.3 Å²	81.3	56%	0.559	42%	0.421	S	S	*	.	H	α-helix	trans	-65.5	-33.7	174.6	-69	164.8	0	0	0	111.1	S755 S756 L757 K763	S755-I759 VanDerWaalsContact O-CG1 3.31Å; S755-I759 WeakPolarHBondContact O-CG1 3.23Å; S755-I759 PolarHBondContact O-N 3.05Å; S756-I759 PolarHBondContact O-N 3.04Å; L757-I759 VanDerWaalsContact C-N 3.35Å; L757-I759 PolarHBondContact O-N 3.45Å; I759-K763 PolarHBondContact O-N 3.09Å
760	H	81.5	Confident	73.6	Confident	33 Å²	33	82.1 Å²	82.1	15%	0.153	42%	0.423	C	S	.	.	H	α-helix	trans	-77.6	-44.6	177.9	171.8	77.8	0	0	0	113.3	C742 C747 A749 F751 S756 L757 Y758 K762 K763 H764	C742-H760 VanDerWaalsContact SG-CD2 3.59Å; C747-H760 VanDerWaalsContact SG-CE1 3.52Å; C747-H760 PolarHBondContact SG-NE2 3.49Å; C747-H760 VanDerWaalsContact SG-NE2 3.41Å; A749-H760 WeakPolarHBondContact CB-NE2 3.47Å; F751-H760 HydrophobicContact CE1-CB 4.14Å; F751-H760 HydrophobicContact CE2-CB 3.78Å; F751-H760 AromaticContact CE2-CD2 3.38Å; F751-H760 WeakPolarHBondContact CE2-CD2 3.42Å; F751-H760 AromaticContact CE2-CG 3.56Å; F751-H760 HydrophobicContact CZ-CB 3.46Å; F751-H760 VanDerWaalsContact CZ-CB 3.46Å; F751-H760 AromaticContact CZ-CD2 3.6Å; F751-H760 AromaticContact CZ-CG 3.29Å; F751-H760 AromaticContact CZ-ND1 3.71Å; S756-H760 WeakPolarHBondContact O-CB 3.17Å; S756-H760 PolarHBondContact O-N 2.91Å; L757-H760 CarbonylContact O-C 3.18Å; L757-H760 WeakPolarHBondContact O-CA 3.48Å; L757-H760 WeakPolarHBondContact O-CB 3.21Å; L757-H760 PolarHBondContact O-N 3.26Å; Y758-H760 VanDerWaalsContact C-N 3.28Å; Y758-H760 PolarHBondContact O-N 3.37Å; H760-K762 VanDerWaalsContact C-N 3.26Å; H760-K762 PolarHBondContact O-N 3.35Å; H760-K763 WeakPolarHBondContact O-CA 3.19Å; H760-K763 WeakPolarHBondContact O-CB 2.98Å; H760-K763 PolarHBondContact O-N 2.82Å; H760-H764 AromaticContact CD2-NE2 3.68Å; H760-H764 AromaticContact CE1-CE1 3.83Å; H760-H764 AromaticContact CE1-NE2 3.32Å; H760-H764 PolarHBondContact CE1-NE2 3.15Å; H760-H764 VanDerWaalsContact CE1-NE2 3.32Å; H760-H764 AromaticContact NE2-CD2 3.77Å; H760-H764 AromaticContact NE2-CE1 3.84Å; H760-H764 AromaticContact NE2-NE2 2.93Å; H760-H764 PolarHBondContact NE2-NE2 3.35Å; H760-H764 PolarHBondContact O-N 3.4Å
761	S	80.4	Confident	72.3	Confident	37 Å²	37	84.8 Å²	84.8	26%	0.259	44%	0.442	S	S	.	.	H	α-helix	trans	-68	-28.1	175.2	64.1	0	0	0	0	112.1	L757 Y758 K763 H764 K765	L757-S761 PolarHBondContact O-N 2.88Å; L757-S761 PolarHBondContact O-OG 2.71Å; Y758-S761 PolarHBondContact O-OG 3.04Å; S761-K763 PolarHBondContact O-N 2.98Å; S761-H764 PolarHBondContact O-N 3.24Å; S761-K765 PolarHBondContact O-N 2.85Å
762	K	79.9	Confident	71.3	Confident	103 Å²	103	91 Å²	91	45%	0.448	46%	0.464	S	S	.	.	H	α-helix	trans	-62.4	-29.4	165.7	-175.5	164.4	-176.5	168.5	0	112.6	Y758 H760 Q766	Y758-K762 VanDerWaalsContact O-CB 3.23Å; Y758-K762 WeakPolarHBondContact O-CB 3.34Å; Y758-K762 PolarHBondContact O-N 2.88Å; H760-K762 VanDerWaalsContact C-N 3.26Å; H760-K762 PolarHBondContact O-N 3.35Å; K762-Q766 HydrophobicContact CG-CG 4.38Å; K762-Q766 WeakPolarHBondContact O-CB 3.44Å; K762-Q766 VanDerWaalsContact O-CG 3.24Å; K762-Q766 WeakPolarHBondContact O-CG 3.03Å; K762-Q766 PolarHBondContact O-N 2.97Å
763	K	76.2	Confident	70.8	Confident	114 Å²	114	93.2 Å²	93.2	50%	0.496	48%	0.476	S	S	.	.	H	α-helix	trans	-64.7	-51.3	169.7	-64.3	-174.6	177.9	-173.9	0	110.6	I759 H760 S761 K765 Q766 D767	I759-K763 PolarHBondContact O-N 3.09Å; H760-K763 WeakPolarHBondContact O-CA 3.19Å; H760-K763 WeakPolarHBondContact O-CB 2.98Å; H760-K763 PolarHBondContact O-N 2.82Å; S761-K763 PolarHBondContact O-N 2.98Å; K763-K765 VanDerWaalsContact C-N 3.3Å; K763-K765 PolarHBondContact O-N 3.2Å; K763-Q766 CarbonylContact O-C 3.57Å; K763-Q766 WeakPolarHBondContact O-CA 3.39Å; K763-Q766 WeakPolarHBondContact O-CB 3.48Å; K763-Q766 PolarHBondContact O-N 3.17Å; K763-D767 PolarHBondContact O-N 3.32Å; K763-D767 VanDerWaalsContact O-OD2 3.09Å
764	H	73.9	Confident	70.4	Confident	51 Å²	51	98.3 Å²	98.3	24%	0.236	49%	0.49	C	S	.	.	H	α-helix	trans	-54.5	-43.4	176.9	-61.6	-47.7	0	0	0	113.3	C742 A744 C747 H760 S761 Q766 D767 A768	C742-H764 VanDerWaalsContact SG-CD2 3.52Å; A744-H764 HydrophobicContact CB-CB 4.23Å; A744-H764 VanDerWaalsContact CB-CD2 3.42Å; A744-H764 WeakPolarHBondContact CB-CD2 3.38Å; C747-H764 VanDerWaalsContact CB-CE1 3.41Å; C747-H764 WeakPolarHBondContact CB-CE1 3.42Å; C747-H764 VanDerWaalsContact CB-NE2 3.35Å; C747-H764 WeakPolarHBondContact CB-NE2 3.45Å; C747-H764 PolarHBondContact SG-CE1 2.9Å; C747-H764 PolarHBondContact SG-NE2 2.75Å; H760-H764 AromaticContact CD2-NE2 3.68Å; H760-H764 AromaticContact CE1-CE1 3.83Å; H760-H764 AromaticContact CE1-NE2 3.32Å; H760-H764 PolarHBondContact CE1-NE2 3.15Å; H760-H764 VanDerWaalsContact CE1-NE2 3.32Å; H760-H764 AromaticContact NE2-CD2 3.77Å; H760-H764 AromaticContact NE2-CE1 3.84Å; H760-H764 AromaticContact NE2-NE2 2.93Å; H760-H764 PolarHBondContact NE2-NE2 3.35Å; H760-H764 PolarHBondContact O-N 3.4Å; S761-H764 PolarHBondContact O-N 3.24Å; H764-Q766 VanDerWaalsContact C-N 3.29Å; H764-Q766 PolarHBondContact O-N 3.24Å; H764-D767 PolarHBondContact O-N 3.22Å; H764-A768 WeakPolarHBondContact O-CB 3Å; H764-A768 PolarHBondContact O-N 3.04Å
765	K	68.7	Low	70.2	Confident	171 Å²	171	90 Å²	90	74%	0.743	46%	0.459	S	S	*	.	H	α-helix	trans	-67.2	-25.9	174.7	-64.2	-161.1	176.6	-159	0	113.7	S761 K763 S769	S761-K765 PolarHBondContact O-N 2.85Å; K763-K765 VanDerWaalsContact C-N 3.3Å; K763-K765 PolarHBondContact O-N 3.2Å; K765-S769 PolarHBondContact O-OG 3.45Å
766	Q	64.4	Low	69.7	Low	98 Å²	98	90.5 Å²	90.5	46%	0.458	46%	0.461	S	S	.	.	H	α-helix	trans	-81	-49.5	171.7	-74.9	-179.8	-44.7	0	0	111.7	K762 K763 H764 A768 S769 T770	K762-Q766 HydrophobicContact CG-CG 4.38Å; K762-Q766 WeakPolarHBondContact O-CB 3.44Å; K762-Q766 VanDerWaalsContact O-CG 3.24Å; K762-Q766 WeakPolarHBondContact O-CG 3.03Å; K762-Q766 PolarHBondContact O-N 2.97Å; K763-Q766 CarbonylContact O-C 3.57Å; K763-Q766 WeakPolarHBondContact O-CA 3.39Å; K763-Q766 WeakPolarHBondContact O-CB 3.48Å; K763-Q766 PolarHBondContact O-N 3.17Å; H764-Q766 VanDerWaalsContact C-N 3.29Å; H764-Q766 PolarHBondContact O-N 3.24Å; Q766-A768 VanDerWaalsContact C-N 3.28Å; Q766-A768 PolarHBondContact O-N 3.22Å; Q766-S769 CarbonylContact O-C 3.31Å; Q766-S769 VanDerWaalsContact O-C 3.28Å; Q766-S769 WeakPolarHBondContact O-CA 3.37Å; Q766-S769 PolarHBondContact O-N 2.89Å; Q766-S769 PolarHBondContact O-OG 3.12Å; Q766-S769 VanDerWaalsContact O-OG 3.08Å; Q766-T770 VanDerWaalsContact O-CG2 3.32Å; Q766-T770 WeakPolarHBondContact O-CG2 3.38Å; Q766-T770 PolarHBondContact O-N 2.88Å
767	D	57.3	Low	69	Low	75 Å²	75	90.3 Å²	90.3	40%	0.401	46%	0.457	S	S	.	.	H	α-helix	trans	-58.8	-39.6	180	-70.4	-60	0	0	0	111	K763 H764 S769 T770 S785	K763-D767 PolarHBondContact O-N 3.32Å; K763-D767 VanDerWaalsContact O-OD2 3.09Å; H764-D767 PolarHBondContact O-N 3.22Å; D767-S769 VanDerWaalsContact C-N 3.25Å; D767-S769 PolarHBondContact O-N 2.8Å; D767-T770 WeakPolarHBondContact CA-OG1 3.41Å; D767-T770 PolarHBondContact O-N 3.2Å; D767-T770 PolarHBondContact O-OG1 2.92Å; D767-S785 WeakPolarHBondContact OD1-CB 3.07Å
768	A	54.4	Low	67.7	Low	97 Å²	97	93.1 Å²	93.1	80%	0.802	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-17.6	171.8	0	0	0	0	0	114.9	H764 Q766	H764-A768 WeakPolarHBondContact O-CB 3Å; H764-A768 PolarHBondContact O-N 3.04Å; Q766-A768 VanDerWaalsContact C-N 3.28Å; Q766-A768 PolarHBondContact O-N 3.22Å
769	S	56.2	Low	66.7	Low	90 Å²	90	93.7 Å²	93.7	63%	0.629	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	0.5	173.8	53.1	0	0	0	0	113.5	K765 Q766 D767 L771	K765-S769 PolarHBondContact O-OG 3.45Å; Q766-S769 CarbonylContact O-C 3.31Å; Q766-S769 VanDerWaalsContact O-C 3.28Å; Q766-S769 WeakPolarHBondContact O-CA 3.37Å; Q766-S769 PolarHBondContact O-N 2.89Å; Q766-S769 PolarHBondContact O-OG 3.12Å; Q766-S769 VanDerWaalsContact O-OG 3.08Å; D767-S769 VanDerWaalsContact C-N 3.25Å; D767-S769 PolarHBondContact O-N 2.8Å; S769-L771 PolarHBondContact O-N 3.01Å
770	T	54.6	Low	66.2	Low	48 Å²	48	89 Å²	89	29%	0.294	48%	0.475	S	S	.	.			trans	-82.1	103.4	176.3	54.2	0	0	0	0	111.5	Q766 D767 R772	Q766-T770 VanDerWaalsContact O-CG2 3.32Å; Q766-T770 WeakPolarHBondContact O-CG2 3.38Å; Q766-T770 PolarHBondContact O-N 2.88Å; D767-T770 WeakPolarHBondContact CA-OG1 3.41Å; D767-T770 PolarHBondContact O-N 3.2Å; D767-T770 PolarHBondContact O-OG1 2.92Å; T770-R772 PolarHBondContact O-N 3.47Å
771	L	54.7	Low	65.6	Low	167 Å²	167	91.3 Å²	91.3	87%	0.874	50%	0.495	S	S	*	.			trans	-54.6	97.1	141.3	-71.5	171	0	0	0	107.6	S769 T773	S769-L771 PolarHBondContact O-N 3.01Å; L771-T773 PolarHBondContact O-N 2.74Å
772	R	59	Low	65.2	Low	177 Å²	177	94.9 Å²	94.9	67%	0.668	51%	0.506	S	S	*	.			trans	-54.6	104.1	-175.4	-68	-179.2	175.9	165.5	-1	109.7	T770 R774 H783	T770-R772 PolarHBondContact O-N 3.47Å; R772-R774 PolarHBondContact O-N 2.92Å; R772-H783 HydrophobicContact CB-CB 4.02Å; R772-H783 PolarHBondContact O-ND1 2.75Å
773	T	65	Low	64.6	Low	78 Å²	78	94.2 Å²	94.2	48%	0.479	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	117.4	-169.5	-40.7	0	0	0	0	109.5	L771 F784 L790	L771-T773 PolarHBondContact O-N 2.74Å; T773-F784 PolarHBondContact N-O 3.29Å; T773-F784 PolarHBondContact O-N 3.48Å; T773-L790 HydrophobicContact CG2-CD2 3.69Å
774	R	69.4	Low	64.4	Low	132 Å²	132	90.6 Å²	90.6	50%	0.498	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	152.6	175.1	-159.2	-179.9	-125.2	-148.3	4.3	109.3	R772 H783	R772-R774 PolarHBondContact O-N 2.92Å; R774-H783 PolarHBondContact NE-NE2 3.2Å
775	C	73.6	Confident	63.9	Low	3 Å²	3	91.3 Å²	91.3	2%	0.02	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-58.9	129	160.5	-166	0	0	0	0	109.2	V777 C780 K782 L790 H798	C775-V777 PolarHBondContact O-N 3.49Å; C775-C780 HydrophobicContact CB-CB 3.81Å; C775-K782 PolarHBondContact N-O 3.5Å; C775-L790 HydrophobicContact CB-CD1 4.31Å; C775-H798 VanDerWaalsContact SG-CD2 3.59Å
776	P	65.9	Low	63.7	Low	87 Å²	87	85.3 Å²	85.3	57%	0.565	48%	0.479	S	S	*	.	S	Bend	trans	-75.9	1.2	-179.5	31.2	-36.2	0	0	0	113.5	M794	P776-M794 HydrophobicContact CG-CE 3.69Å; P776-M794 HydrophobicContact CG-SD 4.22Å
777	V	67.8	Low	63.9	Low	44 Å²	44	87.5 Å²	87.5	27%	0.267	48%	0.483	S	S	.	.	S	Bend	trans	-82.2	121.8	174.7	-179.4	0	0	0	0	108.8	C775 N779 C780 H798 L800	C775-V777 PolarHBondContact O-N 3.49Å; V777-N779 VanDerWaalsContact C-N 3.27Å; V777-N779 PolarHBondContact O-N 2.93Å; V777-N779 VanDerWaalsContact O-N 3.1Å; V777-C780 HydrophobicContact CB-CB 4.33Å; V777-C780 PolarHBondContact O-N 2.93Å; V777-H798 HydrophobicContact CG2-CB 4.3Å; V777-L800 HydrophobicContact CG2-CD1 4.45Å
778	A	55.4	Low	64.7	Low	89 Å²	89	87.8 Å²	87.8	74%	0.736	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	-43.4	-171.6	0	0	0	0	0	114.2	C780	A778-C780 PolarHBondContact O-N 3.05Å
779	N	61.5	Low	65.6	Low	165 Å²	165	87.5 Å²	87.5	88%	0.882	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	15.9	-178.6	-65	39.1	0	0	0	114	V777	V777-N779 VanDerWaalsContact C-N 3.27Å; V777-N779 PolarHBondContact O-N 2.93Å; V777-N779 VanDerWaalsContact O-N 3.1Å
780	C	71.4	Confident	66.7	Low	9 Å²	9	84.1 Å²	84.1	6%	0.061	45%	0.451	C	S	.	.			trans	-124.9	96.7	179.7	-166.1	0	0	0	0	113.6	C775 V777 A778 K782 H793 H798	C775-C780 HydrophobicContact CB-CB 3.81Å; V777-C780 HydrophobicContact CB-CB 4.33Å; V777-C780 PolarHBondContact O-N 2.93Å; A778-C780 PolarHBondContact O-N 3.05Å; C780-K782 PolarHBondContact O-N 2.68Å; C780-H793 PolarHBondContact SG-NE2 3.38Å; C780-H798 WeakPolarHBondContact CB-NE2 3.41Å; C780-H798 PolarHBondContact SG-NE2 2.97Å
781	S	66.9	Low	67.4	Low	83 Å²	83	85.3 Å²	85.3	58%	0.58	45%	0.451	S	S	*	.			trans	-72.9	10.7	176.3	55.5	0	0	0	0	115	H783	S781-H783 PolarHBondContact O-CD2 2.68Å
782	K	72.3	Confident	68.4	Low	111 Å²	111	80.3 Å²	80.3	48%	0.483	43%	0.431	S	S	.	.			trans	-81.8	127.6	-175.3	-63	-176.1	-179.8	179.5	0	111	C775 C780 F784	C775-K782 PolarHBondContact N-O 3.5Å; C780-K782 PolarHBondContact O-N 2.68Å; K782-F784 HydrophobicContact CB-CE2 3.75Å; K782-F784 HydrophobicContact CB-CZ 3.8Å; K782-F784 WeakPolarHBondContact O-CE2 3.32Å
783	H	68.9	Low	69.3	Low	90 Å²	90	72.5 Å²	72.5	42%	0.417	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	143.5	-179.1	-73.3	-96.4	0	0	0	110.6	R772 R774 S781	R772-H783 HydrophobicContact CB-CB 4.02Å; R772-H783 PolarHBondContact O-ND1 2.75Å; R774-H783 PolarHBondContact NE-NE2 3.2Å; S781-H783 PolarHBondContact O-CD2 2.68Å
784	F	71.4	Confident	69.6	Low	38 Å²	38	69.3 Å²	69.3	17%	0.167	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	133.6	-175.6	-58.3	-88.7	0	0	0	111.8	T773 K782 S786 N789 L790 H793	T773-F784 PolarHBondContact N-O 3.29Å; T773-F784 PolarHBondContact O-N 3.48Å; K782-F784 HydrophobicContact CB-CE2 3.75Å; K782-F784 HydrophobicContact CB-CZ 3.8Å; K782-F784 WeakPolarHBondContact O-CE2 3.32Å; F784-S786 PolarHBondContact O-N 3.21Å; F784-N789 HydrophobicContact CD1-CB 3.9Å; F784-L790 HydrophobicContact CB-CB 4.12Å; F784-L790 HydrophobicContact CD2-CB 4.03Å; F784-L790 HydrophobicContact CD2-CD1 3.76Å; F784-L790 HydrophobicContact CD2-CG 4.47Å; F784-L790 HydrophobicContact CE2-CD1 4.07Å; F784-L790 HydrophobicContact CG-CB 4.16Å; F784-H793 HydrophobicContact CE1-CB 3.92Å; F784-H793 HydrophobicContact CE2-CB 4.02Å; F784-H793 AromaticContact CE2-CD2 3.38Å; F784-H793 WeakPolarHBondContact CE2-CD2 3.34Å; F784-H793 AromaticContact CE2-CG 3.74Å; F784-H793 HydrophobicContact CZ-CB 3.46Å; F784-H793 VanDerWaalsContact CZ-CB 3.46Å; F784-H793 AromaticContact CZ-CD2 3.46Å; F784-H793 VanDerWaalsContact CZ-CD2 3.46Å; F784-H793 WeakPolarHBondContact CZ-CD2 3.3Å; F784-H793 AromaticContact CZ-CG 3.3Å; F784-H793 AromaticContact CZ-ND1 3.95Å
785	S	63.5	Low	69.9	Low	66 Å²	66	67.2 Å²	67.2	46%	0.462	38%	0.38	S	S	.	.	S	Bend	trans	-80.3	-0.3	171.3	55.5	0	0	0	0	113.8	D767	D767-S785 WeakPolarHBondContact OD1-CB 3.07Å
786	S	64.7	Low	69.8	Low	45 Å²	45	74.3 Å²	74.3	32%	0.315	41%	0.41	S	S	.	.			trans	-139.6	127.3	176.9	-174.8	0	0	0	0	112	F784 S788 N789 L790	F784-S786 PolarHBondContact O-N 3.21Å; S786-S788 PolarHBondContact O-N 2.89Å; S786-N789 WeakPolarHBondContact O-CB 3.48Å; S786-N789 PolarHBondContact O-N 3.45Å; S786-L790 PolarHBondContact O-N 3.32Å
787	R	68.8	Low	69.9	Low	144 Å²	144	75.7 Å²	75.7	54%	0.543	41%	0.409	S	S	.	.	H	α-helix	trans	-54.8	-32.5	174.6	-172.9	173.2	171.5	114	0.9	112.8	L790 K791 M808	R787-L790 PolarHBondContact O-N 2.84Å; R787-K791 WeakPolarHBondContact O-CB 3.43Å; R787-K791 PolarHBondContact O-N 2.97Å; R787-M808 PolarHBondContact NH2-O 3.24Å
788	S	72.9	Confident	70	Confident	81 Å²	81	76.2 Å²	76.2	57%	0.566	41%	0.409	S	S	*	.	H	α-helix	trans	-66.4	-35.8	174.6	-56.5	0	0	0	0	112.9	S786 S792	S786-S788 PolarHBondContact O-N 2.89Å; S788-S792 WeakPolarHBondContact O-CB 3.33Å; S788-S792 PolarHBondContact O-N 3.12Å; S788-S792 PolarHBondContact O-OG 3.22Å
789	N	74.4	Confident	70.3	Confident	91 Å²	91	79.7 Å²	79.7	49%	0.487	41%	0.409	S	S	.	.	H	α-helix	trans	-75.9	-39.1	177.6	-66	-1.8	0	0	0	110.7	F784 S786 S792 H793	F784-N789 HydrophobicContact CD1-CB 3.9Å; S786-N789 WeakPolarHBondContact O-CB 3.48Å; S786-N789 PolarHBondContact O-N 3.45Å; N789-S792 PolarHBondContact O-N 3.02Å; N789-H793 WeakPolarHBondContact O-CB 3.26Å; N789-H793 PolarHBondContact O-N 2.87Å
790	L	77.8	Confident	70.2	Confident	19 Å²	19	75.2 Å²	75.2	10%	0.099	39%	0.385	C	S	.	.	H	α-helix	trans	-60.3	-50.4	172	175.6	58.7	0	0	0	111.6	T773 C775 F784 S786 R787 S792 H793 M794	T773-L790 HydrophobicContact CG2-CD2 3.69Å; C775-L790 HydrophobicContact CB-CD1 4.31Å; F784-L790 HydrophobicContact CB-CB 4.12Å; F784-L790 HydrophobicContact CD2-CB 4.03Å; F784-L790 HydrophobicContact CD2-CD1 3.76Å; F784-L790 HydrophobicContact CD2-CG 4.47Å; F784-L790 HydrophobicContact CE2-CD1 4.07Å; F784-L790 HydrophobicContact CG-CB 4.16Å; S786-L790 PolarHBondContact O-N 3.32Å; R787-L790 PolarHBondContact O-N 2.84Å; L790-S792 VanDerWaalsContact C-N 3.27Å; L790-S792 PolarHBondContact O-N 3.36Å; L790-H793 PolarHBondContact O-N 3.13Å; L790-M794 HydrophobicContact CD1-CG 3.95Å; L790-M794 HydrophobicContact CD1-SD 3.83Å; L790-M794 HydrophobicContact CG-SD 4.01Å; L790-M794 WeakPolarHBondContact O-CG 3.41Å; L790-M794 PolarHBondContact O-N 3.37Å
791	K	70.3	Confident	69.3	Low	72 Å²	72	77.6 Å²	77.6	31%	0.313	40%	0.402	S	S	.	.	H	α-helix	trans	-57.7	-40.8	176.2	-165.8	165.3	-169.1	171.4	0	111.2	R787 L795 L805 E809	R787-K791 WeakPolarHBondContact O-CB 3.43Å; R787-K791 PolarHBondContact O-N 2.97Å; K791-L795 WeakPolarHBondContact O-CB 3.45Å; K791-L795 PolarHBondContact O-N 3.4Å; K791-L805 HydrophobicContact CD-CD2 4.2Å; K791-L805 HydrophobicContact CG-CD1 3.91Å; K791-L805 HydrophobicContact CG-CD2 3.92Å; K791-E809 IonicContact NZ-OE1 3.32Å; K791-E809 PolarHBondContact NZ-OE1 2.96Å; K791-E809 IonicContact NZ-OE2 3.87Å; K791-E809 PolarHBondContact NZ-OE2 2.98Å
792	S	74.6	Confident	68.8	Low	63 Å²	63	78 Å²	78	44%	0.441	40%	0.402	S	S	.	.	H	α-helix	trans	-67.8	-32.3	175.3	-60.1	0	0	0	0	113.9	S788 N789 L790 K796	S788-S792 WeakPolarHBondContact O-CB 3.33Å; S788-S792 PolarHBondContact O-N 3.12Å; S788-S792 PolarHBondContact O-OG 3.22Å; N789-S792 PolarHBondContact O-N 3.02Å; L790-S792 VanDerWaalsContact C-N 3.27Å; L790-S792 PolarHBondContact O-N 3.36Å; S792-K796 WeakPolarHBondContact O-CB 3.45Å; S792-K796 WeakPolarHBondContact O-CD 3.3Å; S792-K796 VanDerWaalsContact O-CG 3.23Å; S792-K796 WeakPolarHBondContact O-CG 3.35Å; S792-K796 PolarHBondContact O-N 3.25Å
793	H	78.8	Confident	67.7	Low	13 Å²	13	78.4 Å²	78.4	6%	0.06	41%	0.41	C	S	.	.	H	α-helix	trans	-74.5	-48.4	177.6	162.6	63.7	0	0	0	111.5	C780 F784 N789 L790 L795 K796 H797 H798	C780-H793 PolarHBondContact SG-NE2 3.38Å; F784-H793 HydrophobicContact CE1-CB 3.92Å; F784-H793 HydrophobicContact CE2-CB 4.02Å; F784-H793 AromaticContact CE2-CD2 3.38Å; F784-H793 WeakPolarHBondContact CE2-CD2 3.34Å; F784-H793 AromaticContact CE2-CG 3.74Å; F784-H793 HydrophobicContact CZ-CB 3.46Å; F784-H793 VanDerWaalsContact CZ-CB 3.46Å; F784-H793 AromaticContact CZ-CD2 3.46Å; F784-H793 VanDerWaalsContact CZ-CD2 3.46Å; F784-H793 WeakPolarHBondContact CZ-CD2 3.3Å; F784-H793 AromaticContact CZ-CG 3.3Å; F784-H793 AromaticContact CZ-ND1 3.95Å; N789-H793 WeakPolarHBondContact O-CB 3.26Å; N789-H793 PolarHBondContact O-N 2.87Å; L790-H793 PolarHBondContact O-N 3.13Å; H793-L795 VanDerWaalsContact C-N 3.32Å; H793-L795 PolarHBondContact O-N 3.23Å; H793-K796 PolarHBondContact O-N 2.94Å; H793-K796 VanDerWaalsContact O-N 3.12Å; H793-H797 AromaticContact CE1-CD2 3.94Å; H793-H797 AromaticContact ND1-CD2 3.31Å; H793-H797 PolarHBondContact ND1-CD2 3.07Å; H793-H797 VanDerWaalsContact ND1-CD2 3.31Å; H793-H797 AromaticContact ND1-CG 3.82Å; H793-H797 PolarHBondContact O-N 3.45Å; H793-H798 AromaticContact CE1-NE2 3.79Å; H793-H798 AromaticContact NE2-CD2 3.78Å; H793-H798 AromaticContact NE2-NE2 3.44Å; H793-H798 PolarHBondContact NE2-NE2 3.42Å
794	M	71.6	Confident	67	Low	10 Å²	10	78 Å²	78	5%	0.049	41%	0.413	C	S	.	.	H	α-helix	trans	-58.4	-44.1	178.4	-68.4	175.8	72.3	0	0	111.5	P776 L790 K796 H798 H799 L800	P776-M794 HydrophobicContact CG-CE 3.69Å; P776-M794 HydrophobicContact CG-SD 4.22Å; L790-M794 HydrophobicContact CD1-CG 3.95Å; L790-M794 HydrophobicContact CD1-SD 3.83Å; L790-M794 HydrophobicContact CG-SD 4.01Å; L790-M794 WeakPolarHBondContact O-CG 3.41Å; L790-M794 PolarHBondContact O-N 3.37Å; M794-K796 VanDerWaalsContact C-N 3.28Å; M794-K796 PolarHBondContact O-N 2.79Å; M794-H798 CarbonylContact O-C 3.59Å; M794-H798 WeakPolarHBondContact O-CA 3.47Å; M794-H798 PolarHBondContact O-N 2.9Å; M794-H799 PolarHBondContact O-N 3.39Å; M794-L800 HydrophobicContact CE-CD1 3.72Å
795	L	75.6	Confident	66.2	Low	89 Å²	89	76.8 Å²	76.8	47%	0.466	41%	0.409	S	S	.	.	H	α-helix	trans	-66.9	-25.9	179	-147.2	78.4	0	0	0	113.6	K791 H793 L805	K791-L795 WeakPolarHBondContact O-CB 3.45Å; K791-L795 PolarHBondContact O-N 3.4Å; H793-L795 VanDerWaalsContact C-N 3.32Å; H793-L795 PolarHBondContact O-N 3.23Å; L795-L805 HydrophobicContact CD1-CD1 3.98Å
796	K	71.8	Confident	65.4	Low	152 Å²	152	77 Å²	77	66%	0.661	41%	0.41	S	S	*	.	H	α-helix	trans	-96.6	-29.6	-176.7	-75.7	-178.5	177.6	-173	0	115.1	S792 H793 M794	S792-K796 WeakPolarHBondContact O-CB 3.45Å; S792-K796 WeakPolarHBondContact O-CD 3.3Å; S792-K796 VanDerWaalsContact O-CG 3.23Å; S792-K796 WeakPolarHBondContact O-CG 3.35Å; S792-K796 PolarHBondContact O-N 3.25Å; H793-K796 PolarHBondContact O-N 2.94Å; H793-K796 VanDerWaalsContact O-N 3.12Å; M794-K796 VanDerWaalsContact C-N 3.28Å; M794-K796 PolarHBondContact O-N 2.79Å
797	H	67.6	Low	64.5	Low	115 Å²	115	82.1 Å²	82.1	53%	0.532	43%	0.428	S	S	.	.	H	α-helix	trans	-116.7	-15	-173.5	-68.5	-82.1	0	0	0	114.4	H793	H793-H797 AromaticContact CE1-CD2 3.94Å; H793-H797 AromaticContact ND1-CD2 3.31Å; H793-H797 PolarHBondContact ND1-CD2 3.07Å; H793-H797 VanDerWaalsContact ND1-CD2 3.31Å; H793-H797 AromaticContact ND1-CG 3.82Å; H793-H797 PolarHBondContact O-N 3.45Å
798	H	70.8	Confident	63.5	Low	56 Å²	56	79.5 Å²	79.5	26%	0.259	42%	0.423	S	S	.	.	S	Bend	trans	-124.1	-1.5	-179.8	-60.2	-58.5	0	0	0	113.4	C775 V777 C780 H793 M794 L800	C775-H798 VanDerWaalsContact SG-CD2 3.59Å; V777-H798 HydrophobicContact CG2-CB 4.3Å; C780-H798 WeakPolarHBondContact CB-NE2 3.41Å; C780-H798 PolarHBondContact SG-NE2 2.97Å; H793-H798 AromaticContact CE1-NE2 3.79Å; H793-H798 AromaticContact NE2-CD2 3.78Å; H793-H798 AromaticContact NE2-NE2 3.44Å; H793-H798 PolarHBondContact NE2-NE2 3.42Å; M794-H798 CarbonylContact O-C 3.59Å; M794-H798 WeakPolarHBondContact O-CA 3.47Å; M794-H798 PolarHBondContact O-N 2.9Å; H798-L800 HydrophobicContact CB-CD1 4.41Å; H798-L800 HydrophobicContact CB-CG 4.39Å; H798-L800 PolarHBondContact O-N 3.13Å
799	H	60.3	Low	62.3	Low	161 Å²	161	80.4 Å²	80.4	75%	0.745	42%	0.418	S	S	*	.			trans	50.8	21.3	172.2	-60.4	-64.9	0	0	0	116.5	M794	M794-H799 PolarHBondContact O-N 3.39Å
800	L	60.9	Low	60.5	Low	71 Å²	71	81.2 Å²	81.2	37%	0.372	43%	0.427	S	S	.	.			trans	-63.5	137.9	177.7	-67.2	168.1	0	0	0	110.8	V777 M794 H798	V777-L800 HydrophobicContact CG2-CD1 4.45Å; M794-L800 HydrophobicContact CE-CD1 3.72Å; H798-L800 HydrophobicContact CB-CD1 4.41Å; H798-L800 HydrophobicContact CB-CG 4.39Å; H798-L800 PolarHBondContact O-N 3.13Å
801	S	52.5	Low	58.2	Low	60 Å²	60	85.4 Å²	85.4	42%	0.42	45%	0.454	S	S	.	.			trans	-69	152.8	-174.9	58.7	0	0	0	0	112.6	D803	S801-D803 PolarHBondContact O-N 2.96Å
802	P	55.7	Low	56.5	Low	90 Å²	90	88 Å²	88	58%	0.584	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-29.1	-175.5	-26.2	36.4	0	0	0	115	L805 C806	P802-L805 WeakPolarHBondContact O-CB 3.47Å; P802-L805 PolarHBondContact O-N 3.29Å; P802-C806 PolarHBondContact O-N 3.36Å
803	D	49.1	Very low	54.3	Low	120 Å²	120	91 Å²	91	64%	0.642	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-37.2	-171.5	-51.7	-65.7	0	0	0	112.6	S801 L805 C806	S801-D803 PolarHBondContact O-N 2.96Å; D803-L805 VanDerWaalsContact C-N 3.26Å; D803-L805 PolarHBondContact O-N 3.4Å; D803-C806 VanDerWaalsContact O-CB 3.3Å; D803-C806 WeakPolarHBondContact O-CB 3.38Å; D803-C806 PolarHBondContact O-N 3.42Å
804	V	53.5	Low	51.8	Low	82 Å²	82	98.1 Å²	98.1	50%	0.497	53%	0.531	S	S	.	.	H	α-helix	trans	-64.2	-36.1	172.9	-175.2	0	0	0	0	110.6	C806 Q807	V804-C806 PolarHBondContact O-N 3.35Å; V804-Q807 PolarHBondContact O-N 3.07Å
805	L	55.5	Low	49.6	Very low	13 Å²	13	103.8 Å²	103.8	7%	0.068	57%	0.566	C	S	.	*	H	α-helix	trans	-68.5	-14.4	174.9	-102.5	169.7	0	0	0	113.9	K791 L795 P802 D803 M808	K791-L805 HydrophobicContact CD-CD2 4.2Å; K791-L805 HydrophobicContact CG-CD1 3.91Å; K791-L805 HydrophobicContact CG-CD2 3.92Å; L795-L805 HydrophobicContact CD1-CD1 3.98Å; P802-L805 WeakPolarHBondContact O-CB 3.47Å; P802-L805 PolarHBondContact O-N 3.29Å; D803-L805 VanDerWaalsContact C-N 3.26Å; D803-L805 PolarHBondContact O-N 3.4Å; L805-M808 HydrophobicContact CD2-SD 4.07Å
806	C	47	Very low	47.5	Very low	71 Å²	71	105.4 Å²	105.4	48%	0.48	58%	0.583	S	S	.	*	H	α-helix	trans	-83.2	-35	176.9	-161.2	0	0	0	0	112.1	P802 D803 V804 M808 E809	P802-C806 PolarHBondContact O-N 3.36Å; D803-C806 VanDerWaalsContact O-CB 3.3Å; D803-C806 WeakPolarHBondContact O-CB 3.38Å; D803-C806 PolarHBondContact O-N 3.42Å; V804-C806 PolarHBondContact O-N 3.35Å; C806-M808 PolarHBondContact O-N 3.22Å; C806-E809 WeakPolarHBondContact O-CB 3.48Å; C806-E809 PolarHBondContact O-N 2.79Å
807	Q	45	Very low	45.2	Very low	151 Å²	151	103.7 Å²	103.7	71%	0.706	59%	0.589	S	S	*	*	H	α-helix	trans	-65.1	-25.4	174.4	-60.5	-173	19.5	0	0	112.6	V804 E809 T810	V804-Q807 PolarHBondContact O-N 3.07Å; Q807-E809 PolarHBondContact O-N 2.98Å; Q807-T810 PolarHBondContact O-OG1 2.99Å; Q807-T810 VanDerWaalsContact O-OG1 3.11Å
808	M	47.2	Very low	43.4	Very low	90 Å²	90	104.4 Å²	104.4	44%	0.443	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.1	-6.8	172.4	-52.7	-168.1	89.8	0	0	113.4	R787 L805 C806	R787-M808 PolarHBondContact NH2-O 3.24Å; L805-M808 HydrophobicContact CD2-SD 4.07Å; C806-M808 PolarHBondContact O-N 3.22Å
809	E	49	Very low	41.7	Very low	99 Å²	99	110 Å²	110	46%	0.463	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.8	0.1	-175.3	-65.5	-179.8	152.8	0	0	113.2	K791 C806 Q807	K791-E809 IonicContact NZ-OE1 3.32Å; K791-E809 PolarHBondContact NZ-OE1 2.96Å; K791-E809 IonicContact NZ-OE2 3.87Å; K791-E809 PolarHBondContact NZ-OE2 2.98Å; C806-E809 WeakPolarHBondContact O-CB 3.48Å; C806-E809 PolarHBondContact O-N 2.79Å; Q807-E809 PolarHBondContact O-N 2.98Å
810	T	36.3	Very low	40.6	Very low	108 Å²	108	109.8 Å²	109.8	66%	0.663	64%	0.637	S	S	*	*			trans	-105.4	20.2	-176.3	52.1	0	0	0	0	115.2	Q807	Q807-T810 PolarHBondContact O-OG1 2.99Å; Q807-T810 VanDerWaalsContact O-OG1 3.11Å
811	T	29.4	Very low	38.9	Very low	108 Å²	108	114.6 Å²	114.6	66%	0.663	66%	0.662	S	S	*	*			trans	-105.9	109.6	168.4	39.9	0	0	0	0	111	T813	T811-T813 PolarHBondContact O-N 2.9Å; T811-T813 VanDerWaalsContact O-N 3.13Å
812	P	33.6	Very low	37.6	Very low	125 Å²	125	116.8 Å²	116.8	81%	0.812	68%	0.677	S	S	*	*			trans	-78.6	97.6	-178.9	30.7	-33.4	0	0	0	111.1	L814	P812-L814 PolarHBondContact O-N 3.45Å
813	T	28.1	Very low	36.1	Very low	128 Å²	128	117.1 Å²	117.1	79%	0.785	68%	0.681	S	S	*	*			trans	-70.5	109.5	171.7	-45.4	0	0	0	0	110.3	T811 T815	T811-T813 PolarHBondContact O-N 2.9Å; T811-T813 VanDerWaalsContact O-N 3.13Å; T813-T815 PolarHBondContact O-N 3.28Å
814	L	26.6	Very low	35	Very low	161 Å²	161	117.7 Å²	117.7	84%	0.843	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-59.6	132.1	166.4	-65.7	171.1	0	0	0	109.4	P812 P816	P812-L814 PolarHBondContact O-N 3.45Å; L814-P816 WeakPolarHBondContact O-CD 3.5Å
815	T	26.9	Very low	34.2	Very low	129 Å²	129	119.2 Å²	119.2	79%	0.791	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-87.8	116.4	175.3	48.9	0	0	0	0	110.4	T813	T813-T815 PolarHBondContact O-N 3.28Å
816	P	29.5	Very low	32.6	Very low	124 Å²	124	124.9 Å²	124.9	81%	0.805	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-68.2	154.2	167.3	30.6	-34.3	0	0	0	110.4	L814	L814-P816 WeakPolarHBondContact O-CD 3.5Å
817	S	23.9	Very low	31.5	Very low	115 Å²	115	126.1 Å²	126.1	80%	0.804	75%	0.746	S	S	*	*			trans	-121.2	148.7	161.8	-66.4	0	0	0	0	108
818	S	29.9	Very low	30.6	Very low	131 Å²	131	125.5 Å²	125.5	92%	0.916	75%	0.752	S	S	*	*			trans	-71.5	167.8	-155.5	-56.8	0	0	0	0	116.5
819	E	34.6	Very low	29.5	Very low	172 Å²	172	126.2 Å²	126.2	80%	0.804	77%	0.772	S	S	*	*			trans	-100.5	143.8	-159.3	-54	177.6	146.2	0	0	114.7
820	L	38	Very low	28.4	Very low	158 Å²	158	124.8 Å²	124.8	83%	0.827	78%	0.784	S	S	*	*				51.5	-175.6	129.9	-58.5	178.9	0	0	0	121.8
821	I	25.4	Very low	27.8	Very low	171 Å²	171	125.2 Å²	125.2	88%	0.877	79%	0.792	S	S	*	*			trans	83	117.6	-174.4	-53.2	168.5	0	0	0	112.1
822	S	24.9	Very low	27.6	Very low	106 Å²	106	126.1 Å²	126.1	74%	0.741	80%	0.797	S	S	*	*			cis	-148.6	-173.8	-2.2	-161.6	0	0	0	0	107.7
823	S	25.5	Very low	27.3	Very low	97 Å²	97	126.9 Å²	126.9	68%	0.678	80%	0.799	S	S	*	*			cis	-158.1	177	15.2	-82.4	0	0	0	0	107.3
824	T	24.3	Very low	27.1	Very low	132 Å²	132	124.3 Å²	124.3	81%	0.81	80%	0.797	S	S	*	*			cis	-156.6	172.4	1.3	2.9	0	0	0	0	107.9
825	P	37.1	Very low	27	Very low	115 Å²	115	120.3 Å²	120.3	75%	0.747	80%	0.795	S	S	*	*			trans	-111.5	-172.9	-163	43.3	-37	0	0	0	116
826	T	22.1	Very low	26.9	Very low	132 Å²	132	121 Å²	121	81%	0.81	80%	0.8	S	S	*	*			trans	131.4	129.7	161.8	-61.9	0	0	0	0	110.7
827	S	24.7	Very low	27.1	Very low	96 Å²	96	123.9 Å²	123.9	67%	0.671	80%	0.802	S	S	*	*			cis	-164.5	137.8	-12.3	53	0	0	0	0	114.6
828	V	25.8	Very low	27.4	Very low	138 Å²	138	127.7 Å²	127.7	84%	0.836	81%	0.807	S	S	*	*			trans	55.6	116.9	131.3	-177.2	0	0	0	0	121.7
829	A	24.3	Very low	27.4	Very low	106 Å²	106	128.9 Å²	128.9	88%	0.876	80%	0.803	S	S	*	*				-174.1	133.3	112.3	0	0	0	0	0	111
830	G	24.6	Very low	27.1	Very low	69 Å²	69	125.7 Å²	125.7	71%	0.711	80%	0.799	S	S	*	*			cis	179	177.8	-9	0	0	0	0	0	114.1
831	S	23.7	Very low	27	Very low	117 Å²	117	123.2 Å²	123.2	82%	0.818	80%	0.795	S	S	*	*			trans	80.8	109.9	158.6	-67	0	0	0	0	123.9
832	V	25.1	Very low	27.2	Very low	126 Å²	126	123.5 Å²	123.5	76%	0.764	80%	0.797	S	S	*	*				88.4	114.3	119.7	173	0	0	0	0	121.3
833	V	27.9	Very low	27.4	Very low	142 Å²	142	123.4 Å²	123.4	86%	0.861	79%	0.789	S	S	*	*			trans	61.7	138.7	152.6	171.3	0	0	0	0	118.1
834	G	23.3	Very low	27.9	Very low	73 Å²	73	125.4 Å²	125.4	75%	0.753	79%	0.791	S	S	*	*			cis	141.6	122.7	-5.3	0	0	0	0	0	112.2
835	G	24.6	Very low	28.5	Very low	78 Å²	78	123.6 Å²	123.6	80%	0.804	78%	0.784	S	S	*	*			trans	168.5	131.9	178.7	0	0	0	0	0	115.8
836	T	25.2	Very low	28.4	Very low	143 Å²	143	123.5 Å²	123.5	88%	0.877	79%	0.786	S	S	*	*			trans	-40.4	159.7	173.3	46.7	0	0	0	0	119.3
837	E	34.3	Very low	29.1	Very low	185 Å²	185	123.7 Å²	123.7	86%	0.864	78%	0.781	S	S	*	*			trans	-57	151.6	162.9	-55.2	-172.2	144.1	0	0	113.5
838	Q	29.5	Very low	29.8	Very low	195 Å²	195	128.5 Å²	128.5	91%	0.911	79%	0.79	S	S	*	*			trans	-154.3	145.9	138.3	-122.8	173.1	45.5	0	0	112.9
839	L	31.5	Very low	30	Very low	156 Å²	156	127.3 Å²	127.3	82%	0.817	79%	0.788	S	S	*	*			trans	-69.5	156	169.4	-58.8	161.8	0	0	0	108.6
840	S	27.9	Very low	30.2	Very low	105 Å²	105	127.9 Å²	127.9	73%	0.734	79%	0.786	S	S	*	*				174.5	170.7	66.4	46.1	0	0	0	0	112.9
841	S	34.4	Very low	30.7	Very low	105 Å²	105	131.3 Å²	131.3	73%	0.734	79%	0.792	S	S	*	*			trans	-12.6	146.7	163.4	55.2	0	0	0	0	121
842	L	30.4	Very low	31.3	Very low	177 Å²	177	131.6 Å²	131.6	93%	0.927	79%	0.792	S	S	*	*				-151	173.1	123.1	-113	170.6	0	0	0	112.4
843	D	29.2	Very low	31.4	Very low	104 Å²	104	129.2 Å²	129.2	56%	0.556	79%	0.793	S	S	*	*			trans	-105.3	156.5	-155.7	176	37.1	0	0	0	114.5	S845	D843-S845 PolarHBondContact OD1-N 3.05Å; D843-S845 PolarHBondContact OD1-OG 2.97Å; D843-S845 WeakPolarHBondContact OD2-CB 3.4Å; D843-S845 PolarHBondContact OD2-N 3.13Å; D843-S845 PolarHBondContact OD2-OG 2.93Å; D843-S845 VanDerWaalsContact OD2-OG 3.12Å
844	L	35.9	Very low	31.3	Very low	140 Å²	140	126.1 Å²	126.1	73%	0.733	79%	0.789	S	S	*	*			trans	-128.7	27.6	175.1	-72.8	179.8	0	0	0	113.5	S846	L844-S846 PolarHBondContact O-N 3.49Å; L844-S846 VanDerWaalsContact O-N 3.09Å
845	S	37.7	Very low	31.6	Very low	93 Å²	93	128 Å²	128	65%	0.65	80%	0.797	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-3.3	176.6	-60.6	0	0	0	0	114.9	D843	D843-S845 PolarHBondContact OD1-N 3.05Å; D843-S845 PolarHBondContact OD1-OG 2.97Å; D843-S845 WeakPolarHBondContact OD2-CB 3.4Å; D843-S845 PolarHBondContact OD2-N 3.13Å; D843-S845 PolarHBondContact OD2-OG 2.93Å; D843-S845 VanDerWaalsContact OD2-OG 3.12Å
846	S	34.2	Very low	31.8	Very low	114 Å²	114	128.6 Å²	128.6	80%	0.797	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-1.3	-172.6	-58.2	0	0	0	0	116.5	L844	L844-S846 PolarHBondContact O-N 3.49Å; L844-S846 VanDerWaalsContact O-N 3.09Å
847	L	37.1	Very low	32.8	Very low	135 Å²	135	126.8 Å²	126.8	71%	0.707	79%	0.786	S	S	*	*	S	Bend	trans	-93.5	-2.7	-176.5	-76.2	172.8	0	0	0	115.4
848	F	38.7	Very low	32.5	Very low	198 Å²	198	124.4 Å²	124.4	87%	0.868	78%	0.784	S	S	*	*	S	Bend	trans	-130.9	57.1	-175	-66.1	-68.6	0	0	0	113.9
849	S	30.9	Very low	32.6	Very low	113 Å²	113	120 Å²	120	79%	0.79	78%	0.781	S	S	*	*			trans	-150.9	101.2	164.5	-169	0	0	0	0	113.7
850	S	28.2	Very low	32.4	Very low	117 Å²	117	115.5 Å²	115.5	82%	0.818	77%	0.772	S	S	*	*			trans	172.6	151.2	133.9	43.2	0	0	0	0	111.2
851	V	35	Very low	32.5	Very low	141 Å²	141	118.1 Å²	118.1	86%	0.855	78%	0.776	S	S	*	*			trans	-139.5	125.6	176.3	171.1	0	0	0	0	108.1
852	P	37	Very low	31.9	Very low	124 Å²	124	120.6 Å²	120.6	81%	0.805	78%	0.776	S	S	*	*				-138	168.3	120.3	33.3	-18.5	0	0	0	111.9
853	G	26.6	Very low	31.8	Very low	76 Å²	76	118.4 Å²	118.4	78%	0.784	77%	0.77	S	S	*	*			cis	136.3	105.2	-5.6	0	0	0	0	0	113.1
854	G	27	Very low	31.7	Very low	77 Å²	77	116.5 Å²	116.5	79%	0.794	78%	0.775	S	S	*	*			trans	114.8	136.1	159.8	0	0	0	0	0	118.2
855	A	29.6	Very low	31.5	Very low	111 Å²	111	117.7 Å²	117.7	92%	0.917	78%	0.78	S	S	*	*			trans	65.1	163.7	153.8	0	0	0	0	0	121.2
856	A	28	Very low	31.7	Very low	91 Å²	91	118.4 Å²	118.4	75%	0.752	78%	0.783	S	S	*	*			trans	-121	-172.3	175	0	0	0	0	0	107.3
857	P	46.1	Very low	31.5	Very low	106 Å²	106	119.4 Å²	119.4	69%	0.688	78%	0.784	S	S	*	*			cis	-145.2	-159.4	9.4	40.5	-17.2	0	0	0	115.8
858	T	28	Very low	31.2	Very low	134 Å²	134	117.4 Å²	117.4	82%	0.822	79%	0.787	S	S	*	*			trans	79.4	159.9	150.4	38.9	0	0	0	0	122.1
859	A	31.3	Very low	30.7	Very low	103 Å²	103	112.1 Å²	112.1	85%	0.851	79%	0.788	S	S	*	*			trans	-49.5	165	179.5	0	0	0	0	0	115.2
860	G	27.6	Very low	30.6	Very low	61 Å²	61	109.9 Å²	109.9	63%	0.629	78%	0.783	S	S	*	*			cis	135.7	-176.5	12.8	0	0	0	0	0	109.1
861	I	29.6	Very low	30.6	Very low	160 Å²	160	111.5 Å²	111.5	82%	0.821	79%	0.788	S	S	*	*			trans	67.6	143.6	176.3	-67.2	169.5	0	0	0	112.9
862	E	23	Very low	30.5	Very low	157 Å²	157	109.6 Å²	109.6	73%	0.734	78%	0.781	S	S	*	*			cis	-156.6	-176.4	-17.4	-114.7	-170.9	106.4	0	0	110
863	V	28.5	Very low	30.3	Very low	131 Å²	131	111.6 Å²	111.6	79%	0.794	79%	0.785	S	S	*	*			trans	6.5	139.2	145.7	-175.4	0	0	0	0	118.8
864	G	26.8	Very low	30.3	Very low	65 Å²	65	111.4 Å²	111.4	67%	0.67	78%	0.783	S	S	*	*			cis	160.4	-170.1	-0.6	0	0	0	0	0	115.3
865	I	30.8	Very low	30.3	Very low	164 Å²	164	112.6 Å²	112.6	84%	0.841	78%	0.779	S	S	*	*			trans	-13.6	129.7	165.6	-67.6	171.2	0	0	0	116.2
866	P	41.3	Very low	30	Very low	109 Å²	109	116.8 Å²	116.8	71%	0.708	78%	0.777	S	S	*	*				-149.7	147.6	85	43.8	-25.4	0	0	0	117
867	V	31.1	Very low	30	Very low	135 Å²	135	118.5 Å²	118.5	82%	0.818	78%	0.778	S	S	*	*				66.8	141.6	99.5	-179	0	0	0	0	116
868	A	30.9	Very low	29.3	Very low	92 Å²	92	121 Å²	121	76%	0.76	78%	0.782	S	S	*	*			cis	-174.9	160.4	-28.1	0	0	0	0	0	110.9
869	G	27.5	Very low	29.2	Very low	87 Å²	87	121.3 Å²	121.3	90%	0.897	78%	0.779	S	S	*	*			trans	78.9	158	164.2	0	0	0	0	0	117.5
870	G	28.9	Very low	29.1	Very low	66 Å²	66	123.7 Å²	123.7	68%	0.68	78%	0.777	S	S	*	*			cis	167.7	147.5	-12.1	0	0	0	0	0	114.5
871	T	29.2	Very low	29.1	Very low	151 Å²	151	125.8 Å²	125.8	93%	0.926	78%	0.782	S	S	*	*			trans	62.6	146.6	168.1	65.3	0	0	0	0	117.6
872	S	32.9	Very low	29.2	Very low	101 Å²	101	125.6 Å²	125.6	71%	0.706	78%	0.782	S	S	*	*			cis	-162.5	168.8	24.5	51.3	0	0	0	0	113.5
873	N	31.1	Very low	29.6	Very low	167 Å²	167	124.1 Å²	124.1	89%	0.893	78%	0.783	S	S	*	*			trans	22.2	145.1	153.3	-49.3	-2.5	0	0	0	122
874	G	27.5	Very low	29.5	Very low	72 Å²	72	123 Å²	123	74%	0.742	78%	0.781	S	S	*	*			cis	160.9	160.8	-2.9	0	0	0	0	0	113.6
875	S	27.1	Very low	29.7	Very low	102 Å²	102	124.9 Å²	124.9	71%	0.713	78%	0.784	S	S	*	*			trans	70.8	151.7	-177.4	-131.8	0	0	0	0	116
876	F	23.9	Very low	29.7	Very low	198 Å²	198	121 Å²	121	87%	0.868	79%	0.785	S	S	*	*			cis	-133.9	170.4	9.2	-97.1	-85.6	0	0	0	112.2
877	T	26.2	Very low	29.1	Very low	127 Å²	127	123.6 Å²	123.6	78%	0.779	79%	0.791	S	S	*	*			trans	-103.4	175.9	166.7	52	0	0	0	0	110.4
878	M	32.9	Very low	29	Very low	158 Å²	158	124.6 Å²	124.6	78%	0.778	79%	0.791	S	S	*	*			cis	-129.3	-168.6	14.4	-64.7	174.3	54.7	0	0	109.8
879	D	25.2	Very low	28.9	Very low	142 Å²	142	127 Å²	127	76%	0.759	80%	0.796	S	S	*	*			cis	-148.3	177.2	8.8	-157.5	1.3	0	0	0	112.2
880	L	30.3	Very low	29.2	Very low	153 Å²	153	129.9 Å²	129.9	80%	0.801	79%	0.79	S	S	*	*			trans	-102.5	134.9	-156.8	-173.1	72.8	0	0	0	115
881	S	27.3	Very low	29	Very low	104 Å²	104	132.8 Å²	132.8	73%	0.727	79%	0.789	S	S	*	*			trans	-177.7	143.8	133.6	38.6	0	0	0	0	117
882	L	31.8	Very low	29.2	Very low	157 Å²	157	131.6 Å²	131.6	82%	0.822	78%	0.784	S	S	*	*			trans	78.8	122.2	144.6	-75.9	164.2	0	0	0	123.4
883	V	29.8	Very low	29.2	Very low	126 Å²	126	131.3 Å²	131.3	76%	0.764	78%	0.782	S	S	*	*			trans	66.1	85.5	154.8	-166.6	0	0	0	0	118
884	S	26.7	Very low	29.2	Very low	107 Å²	107	128.9 Å²	128.9	75%	0.748	78%	0.778	S	S	*	*			trans	-78.8	127	141.5	46.1	0	0	0	0	111.2
885	S	30.8	Very low	29.4	Very low	105 Å²	105	132.6 Å²	132.6	73%	0.734	79%	0.786	S	S	*	*			trans	41.5	110	134.9	-50.7	0	0	0	0	119.9
886	G	31.9	Very low	29.4	Very low	83 Å²	83	131.3 Å²	131.3	86%	0.856	79%	0.789	S	S	*	*			trans	-67.4	148.9	165.2	0	0	0	0	0	113.3
887	I	28.9	Very low	29.7	Very low	163 Å²	163	126.4 Å²	126.4	84%	0.836	79%	0.785	S	S	*	*			trans	-110.5	127.4	178.8	-65.2	176.1	0	0	0	109.7
888	L	28.9	Very low	29.9	Very low	156 Å²	156	127 Å²	127	82%	0.817	79%	0.789	S	S	*	*			trans	-79.9	117	177.2	-76.4	157.8	0	0	0	110.9	I890	L888-I890 PolarHBondContact O-N 3.23Å
889	T	27.9	Very low	29.5	Very low	142 Å²	142	128 Å²	128	87%	0.871	80%	0.796	S	S	*	*			trans	-77.1	114.2	164.7	50.1	0	0	0	0	110.3
890	I	33.5	Very low	29.7	Very low	148 Å²	148	127.8 Å²	127.8	76%	0.759	80%	0.8	S	S	*	*			trans	-94	135.4	177	-62.4	175.9	0	0	0	109.7	L888 P892	L888-I890 PolarHBondContact O-N 3.23Å; I890-P892 WeakPolarHBondContact O-CD 3.31Å
891	D	24.9	Very low	29.6	Very low	126 Å²	126	124.8 Å²	124.8	67%	0.674	80%	0.797	S	S	*	*			trans	-76.4	117.7	175.7	-175.6	-29.1	0	0	0	110.7	S893	D891-S893 PolarHBondContact O-N 2.92Å; D891-S893 VanDerWaalsContact O-N 3.11Å; D891-S893 PolarHBondContact OD1-OG 3.17Å
892	P	33.9	Very low	29.6	Very low	127 Å²	127	125.2 Å²	125.2	83%	0.825	80%	0.8	S	S	*	*			trans	-86.5	78	-171.2	35	-35.6	0	0	0	112.6	I890	I890-P892 WeakPolarHBondContact O-CD 3.31Å
893	S	32	Very low	29.4	Very low	95 Å²	95	122.9 Å²	122.9	66%	0.664	80%	0.804	S	S	*	*			trans	-140.4	34.1	-176.9	50.5	0	0	0	0	116.2	D891	D891-S893 PolarHBondContact O-N 2.92Å; D891-S893 VanDerWaalsContact O-N 3.11Å; D891-S893 PolarHBondContact OD1-OG 3.17Å
894	S	31.1	Very low	29.2	Very low	115 Å²	115	120.5 Å²	120.5	80%	0.804	81%	0.805	S	S	*	*			trans	-158.5	74.6	172.1	-179.5	0	0	0	0	116.6
895	V	33.2	Very low	29.2	Very low	151 Å²	151	119.5 Å²	119.5	92%	0.915	80%	0.803	S	S	*	*			trans	-135.5	92.6	153.8	-171.1	0	0	0	0	110.3
896	G	26.5	Very low	29	Very low	75 Å²	75	120.5 Å²	120.5	77%	0.773	81%	0.805	S	S	*	*			trans	-87.5	130.1	166.7	0	0	0	0	0	110.3
897	A	30.6	Very low	28.7	Very low	95 Å²	95	124.6 Å²	124.6	79%	0.785	81%	0.806	S	S	*	*			trans	-72.8	154.2	-173.9	0	0	0	0	0	113.8
898	T	29.7	Very low	28.7	Very low	139 Å²	139	121.3 Å²	121.3	85%	0.853	80%	0.803	S	S	*	*			trans	-171.6	105.7	145.8	10.8	0	0	0	0	112
899	L	25.6	Very low	28.6	Very low	179 Å²	179	123.5 Å²	123.5	94%	0.937	81%	0.806	S	S	*	*			trans	-154	151.1	145.1	-92.8	-172.6	0	0	0	108.3
900	V	28.6	Very low	29	Very low	137 Å²	137	122.3 Å²	122.3	83%	0.83	80%	0.801	S	S	*	*			trans	-146.2	153.6	-171.7	169.4	0	0	0	0	109.2
901	A	28.6	Very low	28.7	Very low	91 Å²	91	123.8 Å²	123.8	75%	0.752	81%	0.809	S	S	*	*			trans	76.7	139.3	177.4	0	0	0	0	0	115.6
902	S	26.6	Very low	29.1	Very low	112 Å²	112	124.9 Å²	124.9	78%	0.783	81%	0.811	S	S	*	*			cis	-167.7	158.9	-5.8	43.1	0	0	0	0	113.9
903	A	27.9	Very low	29.1	Very low	109 Å²	109	124.7 Å²	124.7	90%	0.901	81%	0.809	S	S	*	*			trans	76.5	144.8	157.9	0	0	0	0	0	119.8
904	G	24.8	Very low	29	Very low	76 Å²	76	126.4 Å²	126.4	78%	0.784	81%	0.81	S	S	*	*			trans	131.4	74.5	153.3	0	0	0	0	0	120.1
905	A	27.5	Very low	29	Very low	86 Å²	86	127 Å²	127	71%	0.711	81%	0.809	S	S	*	*			trans	51.3	122.2	141.4	0	0	0	0	0	124.2
906	T	26.3	Very low	28.6	Very low	126 Å²	126	128.4 Å²	128.4	77%	0.773	81%	0.808	S	S	*	*			trans	69.5	137	132.5	56.9	0	0	0	0	124.2
907	L	26.6	Very low	29.2	Very low	169 Å²	169	129 Å²	129	89%	0.885	81%	0.805	S	S	*	*			trans	66.5	148.2	163.5	-95.1	67.4	0	0	0	116.9
908	A	28.4	Very low	29.2	Very low	93 Å²	93	131.7 Å²	131.7	77%	0.769	81%	0.812	S	S	*	*			cis	-140.3	-169.1	-1.4	0	0	0	0	0	111.8
909	K	26.9	Very low	29.3	Very low	202 Å²	202	128.4 Å²	128.4	88%	0.878	81%	0.806	S	S	*	*			trans	-74.3	155	-172.4	-77.6	-179.1	175.2	178.5	0	114.8
910	P	36.6	Very low	29.8	Very low	118 Å²	118	124.8 Å²	124.8	77%	0.766	80%	0.802	S	S	*	*			trans	-85.4	162.5	165.5	37.4	-35.7	0	0	0	112.5
911	L	26.8	Very low	29.8	Very low	178 Å²	178	124.6 Å²	124.6	93%	0.932	80%	0.796	S	S	*	*			trans	-167.9	156.7	147.6	-109.5	164.9	0	0	0	110.8
912	E	32.7	Very low	30.1	Very low	150 Å²	150	127.2 Å²	127.2	70%	0.701	80%	0.797	S	S	*	*			trans	-86	166.7	173.5	-158	177.9	-143.8	0	0	110.6
913	P	35.3	Very low	30.3	Very low	122 Å²	122	125.1 Å²	125.1	79%	0.792	79%	0.786	S	S	*	*				-147.8	167.4	114.4	38.8	-24.1	0	0	0	116.1
914	L	28.2	Very low	30.8	Very low	131 Å²	131	127.4 Å²	127.4	69%	0.686	78%	0.778	S	S	*	*			trans	-88.8	149	176.7	-77.6	87.8	0	0	0	114.1
915	V	32.7	Very low	31.3	Very low	128 Å²	128	130.2 Å²	130.2	78%	0.776	77%	0.77	S	S	*	*			trans	53.8	126.5	134.9	177.5	0	0	0	0	121
916	M	24.8	Very low	31.6	Very low	181 Å²	181	134 Å²	134	89%	0.892	77%	0.773	S	S	*	*				178.2	171.7	122.9	-92.3	-152.4	80.9	0	0	111.8
917	A	39.1	Very low	31.7	Very low	88 Å²	88	130.4 Å²	130.4	73%	0.727	76%	0.761	S	S	*	*			trans	-146.3	152.3	-172.1	0	0	0	0	0	115.5
918	T	29	Very low	32.1	Very low	150 Å²	150	130.5 Å²	130.5	92%	0.92	76%	0.762	S	S	*	*			trans	-167.9	160.9	169.6	40.2	0	0	0	0	109.5
919	G	32.3	Very low	32	Very low	70 Å²	70	133.4 Å²	133.4	72%	0.722	76%	0.759	S	S	*	*			cis	150	123.3	-8.8	0	0	0	0	0	114.3
920	A	35.4	Very low	32.1	Very low	104 Å²	104	126.8 Å²	126.8	86%	0.86	75%	0.749	S	S	*	*			trans	66.6	159.4	166.3	0	0	0	0	0	118.4
921	D	29.7	Very low	31.9	Very low	133 Å²	133	126.6 Å²	126.6	71%	0.711	75%	0.746	S	S	*	*			cis	-159.4	160.8	-6	-148.5	-9.4	0	0	0	114.7
922	L	33.7	Very low	31.9	Very low	146 Å²	146	125 Å²	125	76%	0.764	74%	0.743	S	S	*	*			trans	56.8	177	151.1	-115.9	64.8	0	0	0	119.3
923	A	32	Very low	31.7	Very low	67 Å²	67	120.4 Å²	120.4	55%	0.554	74%	0.736	S	S	*	*			cis	-158.2	145.5	-6.8	0	0	0	0	0	113
924	H	38.9	Very low	31.3	Very low	157 Å²	157	120.6 Å²	120.6	73%	0.727	73%	0.73	S	S	*	*			trans	60.4	153.6	146.5	-70.3	42.7	0	0	0	119.4
925	Q	34.8	Very low	31.5	Very low	136 Å²	136	121 Å²	121	64%	0.636	74%	0.738	S	S	*	*			cis	-165.5	168.9	-12.5	-110.2	-177.8	6.7	0	0	105.4
926	H	32.9	Very low	31.2	Very low	164 Å²	164	121 Å²	121	76%	0.759	73%	0.732	S	S	*	*			cis	-151.3	-169.3	-2.2	-127.7	-25.9	0	0	0	106.4
927	G	29.8	Very low	31.9	Very low	51 Å²	51	117.8 Å²	117.8	53%	0.526	73%	0.726	S	S	.	*			cis	133.5	131.6	3.3	0	0	0	0	0	111.5
928	L	34	Very low	32.2	Very low	171 Å²	171	119 Å²	119	90%	0.895	73%	0.726	S	S	*	*			trans	66	143.2	-167.3	-57.2	179.5	0	0	0	113.3
929	E	26.5	Very low	32.5	Very low	154 Å²	154	121 Å²	121	72%	0.72	73%	0.725	S	S	*	*			cis	-128.1	167.3	-10.1	-89.7	-123.8	70.3	0	0	108.7	T931	E929-T931 WeakPolarHBondContact OE1-CG2 3.48Å
930	G	29.1	Very low	32.3	Very low	64 Å²	64	121.4 Å²	121.4	66%	0.66	73%	0.729	S	S	*	*			cis	112.5	138.5	9.9	0	0	0	0	0	111.5
931	T	31.7	Very low	32.1	Very low	114 Å²	114	122.8 Å²	122.8	70%	0.699	73%	0.727	S	S	*	*			cis	-144	167.8	-7.5	53.8	0	0	0	0	110.1	E929	E929-T931 WeakPolarHBondContact OE1-CG2 3.48Å
932	V	27.7	Very low	32	Very low	143 Å²	143	123.7 Å²	123.7	87%	0.867	73%	0.731	S	S	*	*			trans	69.8	140.1	-179	-176.5	0	0	0	0	113.1
933	G	28.4	Very low	31.9	Very low	54 Å²	54	123.6 Å²	123.6	56%	0.557	73%	0.731	S	S	*	*			cis	121.6	141	-1	0	0	0	0	0	111.9
934	D	27.1	Very low	32.2	Very low	127 Å²	127	127.7 Å²	127.7	68%	0.679	74%	0.743	S	S	*	*			cis	-147	-174.4	-11.5	-129.8	-107	0	0	0	106.4	L936	D934-L936 PolarHBondContact OD1-N 2.85Å
935	V	31	Very low	31.6	Very low	139 Å²	139	128.1 Å²	128.1	84%	0.842	75%	0.75	S	S	*	*			cis	-126.7	137.3	34	172.3	0	0	0	0	111.6
936	L	28.2	Very low	31.6	Very low	127 Å²	127	128.5 Å²	128.5	67%	0.665	76%	0.757	S	S	*	*			trans	-97.3	177.9	173.4	-85.5	164.2	0	0	0	112.2	D934	D934-L936 PolarHBondContact OD1-N 2.85Å
937	P	38.3	Very low	31.6	Very low	115 Å²	115	127.1 Å²	127.1	75%	0.747	76%	0.759	S	S	*	*			cis	-132.1	-151	12.7	45	-23.8	0	0	0	113.1
938	P	46.7	Very low	31.8	Very low	112 Å²	112	133.4 Å²	133.4	73%	0.727	78%	0.775	S	S	*	*				-135.7	-171.5	-103.6	42.7	-21.7	0	0	0	116.5
939	Q	34.5	Very low	31.5	Very low	193 Å²	193	129.9 Å²	129.9	90%	0.902	77%	0.765	S	S	*	*			trans	-76.3	157.2	164.1	-68.5	-84.9	-24.5	0	0	111.9
940	G	27.7	Very low	31.4	Very low	78 Å²	78	128.2 Å²	128.2	80%	0.804	77%	0.765	S	S	*	*			trans	175.4	115.5	167.6	0	0	0	0	0	115.2
941	T	32	Very low	31.4	Very low	133 Å²	133	131.5 Å²	131.5	82%	0.816	77%	0.772	S	S	*	*			trans	-117	137.3	168.3	46.1	0	0	0	0	110.3
942	L	27.6	Very low	32.2	Very low	153 Å²	153	131.5 Å²	131.5	80%	0.801	77%	0.774	S	S	*	*				172.1	118.1	127.7	-94	168.7	0	0	0	113.5
943	N	31.3	Very low	32.5	Very low	144 Å²	144	133.5 Å²	133.5	77%	0.77	77%	0.774	S	S	*	*			trans	56.5	166.3	146.3	-88.6	-60.1	0	0	0	123.7
944	L	38.6	Very low	32.6	Very low	152 Å²	152	134.8 Å²	134.8	80%	0.796	78%	0.78	S	S	*	*			trans	-75.4	158.4	-177.7	-82.8	58.6	0	0	0	112.9
945	D	25.6	Very low	32.7	Very low	167 Å²	167	137 Å²	137	89%	0.893	79%	0.79	S	S	*	*			trans	-126.4	161.9	145.7	-144.7	-46.9	0	0	0	108.7
946	D	34.8	Very low	32.5	Very low	143 Å²	143	133.7 Å²	133.7	77%	0.765	79%	0.785	S	S	*	*			trans	-113.6	175.2	-152.8	-145.1	-23.1	0	0	0	115.5
947	V	33.8	Very low	32.5	Very low	135 Å²	135	133.4 Å²	133.4	82%	0.818	79%	0.788	S	S	*	*			trans	-94.4	132.9	-170.4	177.3	0	0	0	0	113.1
948	Q	32.4	Very low	31.9	Very low	183 Å²	183	135.7 Å²	135.7	86%	0.855	79%	0.794	S	S	*	*			trans	-151.3	137.2	167.9	-148.3	158	39.1	0	0	108.9
949	S	28.1	Very low	31	Very low	97 Å²	97	134.8 Å²	134.8	68%	0.678	80%	0.795	S	S	*	*			cis	-162.4	-176.2	-3.5	43.4	0	0	0	0	109.7
950	V	25.1	Very low	30.8	Very low	120 Å²	120	129.5 Å²	129.5	73%	0.727	79%	0.785	S	S	*	*				164.6	110.9	122.7	158	0	0	0	0	114.2
951	T	28.8	Very low	30.7	Very low	132 Å²	132	134.4 Å²	134.4	81%	0.81	79%	0.791	S	S	*	*			trans	66.5	157.9	151.6	56.7	0	0	0	0	124.5
952	P	48.5	Very low	30.4	Very low	114 Å²	114	133 Å²	133	74%	0.74	79%	0.787	S	S	*	*			trans	-137.6	-146	-163.3	43.1	-19.9	0	0	0	115.2
953	E	33.3	Very low	30.3	Very low	186 Å²	186	132.9 Å²	132.9	87%	0.869	78%	0.784	S	S	*	*			trans	87.1	147.5	172.3	-47.3	-159.2	143.2	0	0	116.8
954	A	30.8	Very low	30.2	Very low	81 Å²	81	134.3 Å²	134.3	67%	0.669	79%	0.786	S	S	*	*			cis	-149.7	156.3	10.3	0	0	0	0	0	115.1
955	L	29.3	Very low	29.5	Very low	172 Å²	172	130.7 Å²	130.7	90%	0.901	79%	0.786	S	S	*	*			trans	54.4	140.7	147.8	-72.9	157.3	0	0	0	122.1
956	G	27.2	Very low	29.5	Very low	70 Å²	70	128 Å²	128	72%	0.722	79%	0.787	S	S	*	*			trans	175.7	-12	172.2	0	0	0	0	0	122.1
957	T	28.7	Very low	29.1	Very low	121 Å²	121	124.4 Å²	124.4	74%	0.742	78%	0.783	S	S	*	*			trans	23.4	109.1	160.9	46.1	0	0	0	0	121.5
958	L	26	Very low	28.8	Very low	164 Å²	164	125.7 Å²	125.7	86%	0.859	79%	0.791	S	S	*	*				147.9	131.9	110.5	-90.6	157.9	0	0	0	116.5
959	A	27.9	Very low	28.5	Very low	92 Å²	92	120.4 Å²	120.4	76%	0.76	79%	0.786	S	S	*	*			trans	59.2	162.7	141.3	0	0	0	0	0	121.4
960	A	28.7	Very low	28.5	Very low	83 Å²	83	120.5 Å²	120.5	69%	0.686	79%	0.792	S	S	*	*			cis	-167.2	144.1	-38.1	0	0	0	0	0	110.6
961	L	25.8	Very low	28.6	Very low	180 Å²	180	119 Å²	119	94%	0.942	79%	0.793	S	S	*	*			trans	61.1	176.2	156.9	-68.1	170.2	0	0	0	118.4
962	S	26.6	Very low	28.7	Very low	103 Å²	103	119.5 Å²	119.5	72%	0.72	80%	0.795	S	S	*	*			trans	-140.1	179.6	-168.7	58.3	0	0	0	0	111.4
963	M	25.3	Very low	27.5	Very low	151 Å²	151	120.5 Å²	120.5	74%	0.744	79%	0.794	S	S	*	*			trans	86.8	143.9	166.4	-57.6	-59.5	-60.3	0	0	119.6
964	Q	28.6	Very low	28	Very low	175 Å²	175	117.2 Å²	117.2	82%	0.818	79%	0.789	S	S	*	*			trans	71.9	146.4	154.5	-125.8	71.2	23.4	0	0	119.3
965	G	23.9	Very low	27.9	Very low	76 Å²	76	116.6 Å²	116.6	78%	0.784	78%	0.784	S	S	*	*			trans	135.5	76.2	158.2	0	0	0	0	0	115.5
966	A	26.7	Very low	27.8	Very low	110 Å²	110	115.6 Å²	115.6	91%	0.909	78%	0.779	S	S	*	*			trans	-68.2	140.1	-179.5	0	0	0	0	0	115.1
967	G	24.8	Very low	27.9	Very low	67 Å²	67	119.2 Å²	119.2	69%	0.691	78%	0.777	S	S	*	*				108.8	176.8	122.8	0	0	0	0	0	119.5
968	V	28.9	Very low	27.7	Very low	162 Å²	162	120.6 Å²	120.6	98%	0.982	78%	0.775	S	S	*	*			trans	71.3	138.9	176.6	-168.3	0	0	0	0	115.8
969	G	26.2	Very low	27.6	Very low	73 Å²	73	117.6 Å²	117.6	75%	0.753	77%	0.768	S	S	*	*			trans	135.8	90.4	152.5	0	0	0	0	0	116.1
970	A	27.5	Very low	27.5	Very low	98 Å²	98	120.3 Å²	120.3	81%	0.81	77%	0.768	S	S	*	*			trans	-66.9	139.3	177.8	0	0	0	0	0	115.6
971	A	26.9	Very low	27.3	Very low	89 Å²	89	121.4 Å²	121.4	74%	0.736	77%	0.771	S	S	*	*				73.2	163	128.5	0	0	0	0	0	122.6
972	V	30.3	Very low	27.4	Very low	142 Å²	142	118.3 Å²	118.3	86%	0.861	77%	0.765	S	S	*	*			trans	65.8	120	166.2	-114.8	0	0	0	0	120.5
973	D	25	Very low	27.8	Very low	136 Å²	136	119 Å²	119	73%	0.727	77%	0.769	S	S	*	*			trans	-54.8	150.6	145.3	-136.9	-35.8	0	0	0	109.1	A975	D973-A975 PolarHBondContact OD1-N 2.79Å
974	P	43.8	Very low	28	Very low	116 Å²	116	115.6 Å²	115.6	75%	0.753	77%	0.773	S	S	*	*				-146.6	133.6	78.2	36.1	-17.3	0	0	0	116.1
975	A	27.5	Very low	28.1	Very low	69 Å²	69	110.7 Å²	110.7	57%	0.57	77%	0.77	S	S	*	*				54	131.5	120.3	0	0	0	0	0	121.9	D973	D973-A975 PolarHBondContact OD1-N 2.79Å
976	L	28.4	Very low	28.3	Very low	151 Å²	151	115.1 Å²	115.1	79%	0.791	77%	0.774	S	S	*	*			trans	80.8	121.9	144.1	-67.9	168	0	0	0	121.8
977	Q	28.1	Very low	28.4	Very low	145 Å²	145	113.2 Å²	113.2	68%	0.678	77%	0.766	S	S	*	*				108.9	131.8	122.8	-86.2	174	11.3	0	0	122.3
978	H	25.6	Very low	28.7	Very low	150 Å²	150	115.8 Å²	115.8	69%	0.694	77%	0.768	S	S	*	*			trans	48	118.1	154.6	-54.8	-56.9	0	0	0	119
979	S	23.6	Very low	28.9	Very low	102 Å²	102	116.2 Å²	116.2	71%	0.713	76%	0.759	S	S	*	*				-164.6	144.2	70.7	-72.7	0	0	0	0	111
980	L	25.2	Very low	29.3	Very low	148 Å²	148	116.9 Å²	116.9	78%	0.775	75%	0.752	S	S	*	*				50.6	136.3	83.6	-49.2	175.2	0	0	0	113.7
981	S	24.4	Very low	29.6	Very low	107 Å²	107	116.9 Å²	116.9	75%	0.748	75%	0.752	S	S	*	*			cis	-172.2	-178	-4.7	-105.2	0	0	0	0	109.9
982	S	27.9	Very low	29.7	Very low	115 Å²	115	116.9 Å²	116.9	80%	0.804	75%	0.752	S	S	*	*			trans	115.5	142.8	155.2	-163.8	0	0	0	0	116.3
983	S	34.4	Very low	29.6	Very low	117 Å²	117	115 Å²	115	82%	0.818	75%	0.745	S	S	*	*			cis	178.3	155.7	-43.4	-100.3	0	0	0	0	110.5
984	G	29.7	Very low	29.6	Very low	80 Å²	80	116.9 Å²	116.9	83%	0.825	75%	0.754	S	S	*	*			trans	113.7	118.1	170.9	0	0	0	0	0	113.1
985	G	30.8	Very low	28.8	Very low	72 Å²	72	115 Å²	115	74%	0.742	75%	0.749	S	S	*	*			cis	111.7	139.8	2.3	0	0	0	0	0	112.2
986	L	27.9	Very low	28.8	Very low	168 Å²	168	118.8 Å²	118.8	88%	0.88	76%	0.764	S	S	*	*			cis	-83.4	-147.2	3	-49.9	-179.8	0	0	0	111.3	V988	L986-V988 HydrophobicContact CB-CG2 4.29Å; L986-V988 HydrophobicContact CD1-CG2 4.43Å
987	G	29.4	Very low	28.7	Very low	71 Å²	71	115.8 Å²	115.8	73%	0.732	76%	0.761	S	S	*	*			cis	159.1	178.3	5.7	0	0	0	0	0	111
988	V	31.5	Very low	29.9	Very low	120 Å²	120	114.3 Å²	114.3	73%	0.727	76%	0.764	S	S	*	*			cis	-150.3	125.1	-8.6	-175.8	0	0	0	0	108.3	L986	L986-V988 HydrophobicContact CB-CG2 4.29Å; L986-V988 HydrophobicContact CD1-CG2 4.43Å
989	E	33.4	Very low	30.1	Very low	171 Å²	171	113.3 Å²	113.3	80%	0.799	77%	0.768	S	S	*	*			trans	37.3	150.5	151.6	-61.6	-127.1	86	0	0	124.3
990	S	33.5	Very low	30.6	Very low	88 Å²	88	113.6 Å²	113.6	62%	0.615	77%	0.77	S	S	*	*			cis	-174.3	155.6	-21.6	-105.5	0	0	0	0	112.5
991	A	34	Very low	31.1	Very low	97 Å²	97	115.1 Å²	115.1	80%	0.802	77%	0.773	S	S	*	*			trans	54.3	161.6	143.5	0	0	0	0	0	119.9
992	A	28.5	Very low	31.3	Very low	90 Å²	90	117.4 Å²	117.4	74%	0.744	78%	0.776	S	S	*	*			cis	-164.6	-169.8	-6.2	0	0	0	0	0	108.3
993	S	29.3	Very low	31.2	Very low	101 Å²	101	119.1 Å²	119.1	71%	0.706	78%	0.776	S	S	*	*				172.9	140.4	-57.3	-84	0	0	0	0	110
994	L	25.6	Very low	30.7	Very low	176 Å²	176	118 Å²	118	92%	0.921	77%	0.773	S	S	*	*			trans	68.5	158	167.4	-57.5	161.7	0	0	0	116.9
995	A	27	Very low	30.8	Very low	77 Å²	77	119.5 Å²	119.5	64%	0.636	77%	0.771	S	S	*	*			cis	-174.3	-179.9	-27.8	0	0	0	0	0	111.4
996	V	25.9	Very low	31.1	Very low	149 Å²	149	122.1 Å²	122.1	90%	0.903	78%	0.776	S	S	*	*			trans	90.3	148	158.6	-165.4	0	0	0	0	118.4
997	A	26.9	Very low	31.2	Very low	87 Å²	87	119.6 Å²	119.6	72%	0.719	77%	0.772	S	S	*	*			trans	-113.4	-145.2	-177.2	0	0	0	0	0	110.4
998	P	53	Low	31.1	Very low	114 Å²	114	125.7 Å²	125.7	74%	0.74	78%	0.778	S	S	*	*			cis	-144.2	170.9	5.1	44.5	-24.4	0	0	0	119.4
999	V	29.4	Very low	30.8	Very low	129 Å²	129	126.1 Å²	126.1	78%	0.782	78%	0.781	S	S	*	*			trans	68.5	120.8	140.1	164.6	0	0	0	0	123.7
1000	S	36	Very low	30.5	Very low	108 Å²	108	124 Å²	124	76%	0.755	78%	0.78	S	S	*	*			trans	44.9	162.5	141.7	-48	0	0	0	0	122.7
1001	E	35.3	Very low	30	Very low	180 Å²	180	128 Å²	128	84%	0.841	79%	0.789	S	S	*	*			cis	-157.9	174.6	8.7	-148.9	177.9	169.4	0	0	111
1002	L	27.2	Very low	29.7	Very low	155 Å²	155	130.1 Å²	130.1	81%	0.812	79%	0.791	S	S	*	*			trans	161.7	126	137.8	-86	172.2	0	0	0	116.6
1003	L	25.7	Very low	29.6	Very low	151 Å²	151	129.6 Å²	129.6	79%	0.791	79%	0.794	S	S	*	*			trans	49.4	109.7	140.1	-62.7	178.4	0	0	0	126.1
1004	A	24.9	Very low	29.5	Very low	93 Å²	93	130 Å²	130	77%	0.769	80%	0.803	S	S	*	*				70.2	155.1	104.4	0	0	0	0	0	125.4
1005	S	31.8	Very low	29.9	Very low	112 Å²	112	130.8 Å²	130.8	78%	0.783	80%	0.802	S	S	*	*			trans	-84.7	172.1	-169.3	-26.5	0	0	0	0	116.1
1006	P	36.5	Very low	30	Very low	128 Å²	128	132 Å²	132	83%	0.831	81%	0.812	S	S	*	*				-153.3	-171.8	84.2	41.6	-21.9	0	0	0	116.7
1007	S	30.7	Very low	30.2	Very low	114 Å²	114	128.5 Å²	128.5	80%	0.797	81%	0.807	S	S	*	*			trans	-135.6	148.4	-177.8	-38	0	0	0	0	113.9
1008	K	27.9	Very low	30.9	Very low	199 Å²	199	129.6 Å²	129.6	87%	0.865	82%	0.816	S	S	*	*			trans	176.7	130.6	154.9	-101.5	161.2	-177.6	-177.6	0	110.4
1009	V	24.5	Very low	29.6	Very low	129 Å²	129	127.3 Å²	127.3	78%	0.782	81%	0.813	S	S	*	*				91.7	153.3	72.1	166	0	0	0	0	113.3
1010	V	26.5	Very low	29.4	Very low	128 Å²	128	129 Å²	129	78%	0.776	81%	0.812	S	S	*	*			trans	83.2	115.7	-168.7	-173.6	0	0	0	0	111.9
1011	E	23.1	Very low	28.9	Very low	172 Å²	172	129.8 Å²	129.8	80%	0.804	81%	0.807	S	S	*	*			cis	88.6	110.5	26.7	-163.6	-176.7	178.9	0	0	115.4
1012	V	28.6	Very low	28.8	Very low	141 Å²	141	129.2 Å²	129.2	86%	0.855	81%	0.809	S	S	*	*			trans	170.3	124.6	135.5	150.8	0	0	0	0	111.6
1013	G	26.6	Very low	28.6	Very low	78 Å²	78	124.6 Å²	124.6	80%	0.804	80%	0.799	S	S	*	*			trans	58.4	94.2	138	0	0	0	0	0	121.9
1014	A	25.9	Very low	28.5	Very low	109 Å²	109	123.7 Å²	123.7	90%	0.901	80%	0.803	S	S	*	*			trans	-145.4	154.4	146.1	0	0	0	0	0	111
1015	Q	33.8	Very low	28.4	Very low	194 Å²	194	125.1 Å²	125.1	91%	0.907	80%	0.803	S	S	*	*			trans	-117.9	147.2	-173.2	-179	177.6	-11.5	0	0	110.3
1016	A	30.4	Very low	28	Very low	102 Å²	102	128.1 Å²	128.1	84%	0.843	80%	0.804	S	S	*	*	S	Bend	trans	80.7	140.8	178.4	0	0	0	0	0	118.1
1017	G	28.9	Very low	27.4	Very low	76 Å²	76	127 Å²	127	78%	0.784	80%	0.795	S	S	*	*	S	Bend	trans	88	104.8	159.1	0	0	0	0	0	118
1018	A	42.5	Very low	27.2	Very low	110 Å²	110	129.8 Å²	129.8	91%	0.909	80%	0.8	S	S	*	*			trans	60.9	151.6	161.8	0	0	0	0	0	119.2
1019	G	25.4	Very low	27.2	Very low	66 Å²	66	123.7 Å²	123.7	68%	0.68	79%	0.794	S	S	*	*			trans	146.8	163.7	176.5	0	0	0	0	0	113.1
1020	H	25.5	Very low	27.6	Very low	164 Å²	164	123.7 Å²	123.7	76%	0.759	80%	0.796	S	S	*	*			cis	-132.1	132	0.4	-106.4	52.7	0	0	0	109.4
1021	L	25.1	Very low	27.6	Very low	124 Å²	124	125.6 Å²	125.6	65%	0.649	80%	0.797	S	S	*	*				63.9	114	95.2	-56.3	-163.6	0	0	0	113.5
1022	L	32.6	Very low	27.8	Very low	168 Å²	168	126.3 Å²	126.3	88%	0.88	80%	0.8	S	S	*	*				71.6	132.2	70.3	-80	165.2	0	0	0	113.5
1023	G	24.1	Very low	27.7	Very low	59 Å²	59	123.3 Å²	123.3	61%	0.608	80%	0.798	S	S	*	*			cis	179	-154.2	0.5	0	0	0	0	0	113.2
1024	C	23.7	Very low	27.8	Very low	131 Å²	131	123.5 Å²	123.5	89%	0.885	80%	0.8	S	S	*	*			trans	77.7	166.9	-173.5	-54.7	0	0	0	0	116
1025	V	23.3	Very low	27.9	Very low	124 Å²	124	128.3 Å²	128.3	75%	0.752	80%	0.8	S	S	*	*			trans	71.4	99.2	-175	-173.5	0	0	0	0	112.5
1026	E	22	Very low	27.4	Very low	174 Å²	174	127 Å²	127	81%	0.813	80%	0.798	S	S	*	*				83.7	167.7	82.8	-151.4	-174.2	174.8	0	0	112.8
1027	V	25.4	Very low	27.2	Very low	106 Å²	106	128.5 Å²	128.5	64%	0.642	80%	0.796	S	S	*	*			trans	68.7	98.9	162.8	-175.2	0	0	0	0	118.6
1028	L	25.8	Very low	27	Very low	172 Å²	172	130.6 Å²	130.6	90%	0.901	79%	0.794	S	S	*	*			trans	59.4	136.1	137.3	-54.8	176	0	0	0	122
1029	G	28.5	Very low	26.1	Very low	71 Å²	71	130.7 Å²	130.7	73%	0.732	79%	0.788	S	S	*	*			trans	148.1	60	158	0	0	0	0	0	116.7
1030	P	32	Very low	26	Very low	129 Å²	129	134.9 Å²	134.9	84%	0.838	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-75.9	141.2	-177.2	31.9	-35.1	0	0	0	113.8
1031	Q	25.8	Very low	25.9	Very low	168 Å²	168	135.7 Å²	135.7	79%	0.785	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-83.6	167.9	163.7	-109	-76.2	12.2	0	0	111.3
1032	E	28.3	Very low	25.8	Very low	187 Å²	187	134.9 Å²	134.9	87%	0.874	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-66	138.9	-169.1	-62.9	-176.5	93.4	0	0	114.8
1033	G	27.3	Very low	25.5	Very low	78 Å²	78	135.6 Å²	135.6	80%	0.804	79%	0.787	S	S	*	*			trans	-147.3	16.1	-179.9	0	0	0	0	0	115.7	K1035	G1033-K1035 PolarHBondContact O-N 2.89Å
1034	G	26.7	Very low	25.9	Very low	82 Å²	82	138.9 Å²	138.9	85%	0.845	80%	0.798	S	S	*	*			trans	-76.8	104.1	-171.7	0	0	0	0	0	114.9
1035	K	28.1	Very low	25.9	Very low	209 Å²	209	136 Å²	136	91%	0.909	79%	0.791	S	S	*	*			trans	-129.2	136.4	160.1	-80.9	-177.9	-178.8	167.8	0	111.8	G1033	G1033-K1035 PolarHBondContact O-N 2.89Å
1036	I	24.6	Very low	26.1	Very low	167 Å²	167	136.6 Å²	136.6	86%	0.856	80%	0.8	S	S	*	*			trans	-83.2	140.3	-170.7	-58.8	152.4	0	0	0	111
1037	V	25.2	Very low	26.2	Very low	134 Å²	134	131.9 Å²	131.9	81%	0.812	80%	0.798	S	S	*	*			trans	-158.7	107.5	143.9	132.9	0	0	0	0	111.5
1038	T	24.6	Very low	26.1	Very low	119 Å²	119	130.7 Å²	130.7	73%	0.73	81%	0.808	S	S	*	*			trans	39.8	146.4	150.6	14.7	0	0	0	0	125.8
1039	S	23.8	Very low	26	Very low	112 Å²	112	126.6 Å²	126.6	78%	0.783	81%	0.807	S	S	*	*			trans	77.3	151.9	158.9	76.8	0	0	0	0	118.2
1040	Q	23.7	Very low	25.8	Very low	155 Å²	155	126.3 Å²	126.3	72%	0.724	80%	0.804	S	S	*	*			cis	-165.4	174.7	-30.3	-176.5	155.8	-25.9	0	0	108
1041	F	23.2	Very low	25.5	Very low	180 Å²	180	130.6 Å²	130.6	79%	0.789	81%	0.81	S	S	*	*			trans	78.9	127.2	179.6	-58	-81.1	0	0	0	114.4
1042	V	22.4	Very low	25.3	Very low	108 Å²	108	127.9 Å²	127.9	66%	0.655	81%	0.809	S	S	*	*			cis	70.5	124.5	14.8	154.7	0	0	0	0	114.7
1043	F	28	Very low	26	Very low	182 Å²	182	123.7 Å²	123.7	80%	0.798	80%	0.798	S	S	*	*			cis	-152.8	167.1	-8.4	-102	-47.9	0	0	0	108
1044	P	31.5	Very low	25.7	Very low	129 Å²	129	127.2 Å²	127.2	84%	0.838	79%	0.794	S	S	*	*				-141.4	175.2	107.3	39.1	-26.9	0	0	0	113.1
1045	G	24.1	Very low	25.6	Very low	71 Å²	71	130.2 Å²	130.2	73%	0.732	78%	0.784	S	S	*	*			trans	-170	167.6	178.6	0	0	0	0	0	115.9
1046	S	27.2	Very low	25.3	Very low	135 Å²	135	126.7 Å²	126.7	94%	0.944	77%	0.771	S	S	*	*			trans	-170.5	140.5	170.1	-76.1	0	0	0	0	108.2
1047	G	23.6	Very low	25.3	Very low	75 Å²	75	125 Å²	125	77%	0.773	76%	0.762	S	S	*	*			cis	-172.6	173.6	-3.6	0	0	0	0	0	111.4
1048	G	24.6	Very low	25.2	Very low	81 Å²	81	124.3 Å²	124.3	84%	0.835	75%	0.754	S	S	*	*			trans	81	138.3	-175.7	0	0	0	0	0	113.5
1049	G	24.1	Very low	25.2	Very low	86 Å²	86	126 Å²	126	89%	0.887	76%	0.758	S	S	*	*			cis	92.5	117.2	6.9	0	0	0	0	0	112
1050	G	24.3	Very low	25.2	Very low	66 Å²	66	125 Å²	125	68%	0.68	76%	0.756	S	S	*	*			cis	-176.6	-163.3	-2.1	0	0	0	0	0	111.9
1051	F	23.9	Very low	25.1	Very low	219 Å²	219	124.5 Å²	124.5	96%	0.961	76%	0.764	S	S	*	*			trans	73.3	120.2	172.7	-66.7	-79.9	0	0	0	121.2
1052	S	22.6	Very low	25.1	Very low	110 Å²	110	121 Å²	121	77%	0.769	76%	0.762	S	S	*	*			trans	-130.9	173.5	135.6	-146.2	0	0	0	0	105.5
1053	P	42.2	Very low	25.9	Very low	99 Å²	99	121.1 Å²	121.1	64%	0.643	77%	0.765	S	S	*	*			cis	-137.7	-159.5	-0.5	40.5	-19.6	0	0	0	114.1
1054	Q	21.7	Very low	25.8	Very low	152 Å²	152	118 Å²	118	71%	0.71	77%	0.765	S	S	*	*			trans	84.4	135.6	145.3	-89.3	-174.2	-53.2	0	0	123.8
1055	K	23.6	Very low	25.5	Very low	146 Å²	146	116.9 Å²	116.9	64%	0.635	76%	0.761	S	S	*	*			trans	70	148.4	138.3	-80.5	-169.3	174.1	-105.9	0	120.1
1056	E	22.7	Very low	25.5	Very low	135 Å²	135	122.5 Å²	122.5	63%	0.631	77%	0.765	S	S	*	*			cis	-169.2	174.2	-20.3	-139.4	170.8	-154.6	0	0	111.6
1057	L	25.4	Very low	25.7	Very low	130 Å²	130	124.2 Å²	124.2	68%	0.681	76%	0.763	S	S	*	*			trans	81.9	133.3	148.1	-110.2	67.3	0	0	0	123.8
1058	D	22.6	Very low	25.8	Very low	120 Å²	120	127.3 Å²	127.3	64%	0.642	76%	0.762	S	S	*	*			trans	76.2	107.1	139.9	-71.8	-11.4	0	0	0	126.7
1059	L	24.2	Very low	25.9	Very low	154 Å²	154	130.1 Å²	130.1	81%	0.806	76%	0.763	S	S	*	*				55.3	120.3	118.3	-61.3	169.2	0	0	0	121.5
1060	A	23.2	Very low	26.1	Very low	91 Å²	91	129.3 Å²	129.3	75%	0.752	76%	0.755	S	S	*	*				171.6	131.5	99.2	0	0	0	0	0	117
1061	V	22.8	Very low	26.3	Very low	145 Å²	145	130.1 Å²	130.1	88%	0.879	76%	0.763	S	S	*	*			trans	74	147.2	144	177.8	0	0	0	0	121.2
1062	S	23.2	Very low	26.6	Very low	107 Å²	107	125.8 Å²	125.8	75%	0.748	76%	0.76	S	S	*	*			trans	-104.5	-170.4	-169.5	-28	0	0	0	0	112.3
1063	P	39	Very low	27.1	Very low	111 Å²	111	124.5 Å²	124.5	72%	0.721	76%	0.756	S	S	*	*			cis	-150.8	163.2	37.5	42.4	-20.7	0	0	0	121.1
1064	S	26.1	Very low	26.7	Very low	115 Å²	115	131.4 Å²	131.4	80%	0.804	77%	0.769	S	S	*	*			trans	62.7	145.8	152	62.6	0	0	0	0	119.9
1065	S	25	Very low	27.3	Very low	106 Å²	106	130.4 Å²	130.4	74%	0.741	77%	0.774	S	S	*	*			cis	-157.9	164.1	31.7	59.3	0	0	0	0	115.6
1066	F	24	Very low	28	Very low	189 Å²	189	128.7 Å²	128.7	83%	0.829	77%	0.772	S	S	*	*			trans	7	140.8	154.2	-78	-110.9	0	0	0	120.3
1067	L	31.2	Very low	28.5	Very low	172 Å²	172	131.5 Å²	131.5	90%	0.901	78%	0.778	S	S	*	*				-142.2	178.1	53.7	-90.3	166.7	0	0	0	115
1068	D	24.8	Very low	29.2	Very low	139 Å²	139	135 Å²	135	74%	0.743	78%	0.782	S	S	*	*			trans	-133.4	132.1	-162.8	176.4	21	0	0	0	114.2
1069	T	26.6	Very low	30.1	Very low	141 Å²	141	132.1 Å²	132.1	87%	0.865	78%	0.775	S	S	*	*			trans	-168.8	135.2	153.6	-8.7	0	0	0	0	108.5
1070	G	28.5	Very low	31.3	Very low	69 Å²	69	129.9 Å²	129.9	71%	0.711	76%	0.762	S	S	*	*			cis	114.3	110.1	2.7	0	0	0	0	0	111.3
1071	G	29	Very low	32.2	Very low	82 Å²	82	131 Å²	131	85%	0.845	75%	0.752	S	S	*	*			cis	177.7	175.2	-4.4	0	0	0	0	0	110.9
1072	S	30.1	Very low	33.2	Very low	129 Å²	129	130 Å²	130	90%	0.902	74%	0.741	S	S	*	*			trans	-140.1	147.2	173.6	-169.6	0	0	0	0	111.2
1073	A	34.1	Very low	34.3	Very low	83 Å²	83	128.8 Å²	128.8	69%	0.686	74%	0.737	S	S	*	*			trans	-128.8	142.2	-146.6	0	0	0	0	0	116.7
1074	R	32.6	Very low	34.5	Very low	243 Å²	243	131.2 Å²	131.2	92%	0.917	74%	0.736	S	S	*	*			trans	75.5	146.6	166.1	-54.2	175.3	175.4	168.9	-0.8	115
1075	T	35.3	Very low	35.2	Very low	132 Å²	132	134.9 Å²	134.9	81%	0.81	74%	0.738	S	S	*	*			cis	-129.9	124.9	12	49.5	0	0	0	0	112.6
1076	D	38.1	Very low	36	Very low	110 Å²	110	139.4 Å²	139.4	59%	0.588	74%	0.744	S	S	*	*			trans	-149.1	111.4	149.9	-149.4	-40.1	0	0	0	111.8	R1078	D1076-R1078 PolarHBondContact OD1-N 3.21Å
1077	Y	33.1	Very low	36.7	Very low	193 Å²	193	139.8 Å²	139.8	76%	0.757	75%	0.745	S	S	*	*	H	α-helix	trans	-89.7	-15.2	-173.9	-151.4	-106.8	0	0	0	112.3
1078	R	39.4	Very low	36.9	Very low	205 Å²	205	140.3 Å²	140.3	77%	0.774	74%	0.743	S	S	*	*	H	α-helix	trans	-80.8	-37.6	-177.7	-172.6	173.2	-80	-133.8	-0	111.7	D1076 I1080 Q1081	D1076-R1078 PolarHBondContact OD1-N 3.21Å; R1078-I1080 PolarHBondContact O-N 2.82Å; R1078-Q1081 PolarHBondContact O-N 2.93Å
1079	A	42.3	Very low	37.1	Very low	59 Å²	59	146 Å²	146	49%	0.488	75%	0.754	S	S	.	*	H	α-helix	trans	-61.3	-41.1	177.6	0	0	0	0	0	113.3	Q1081 L1082 A1083	A1079-Q1081 VanDerWaalsContact C-N 3.3Å; A1079-Q1081 PolarHBondContact O-N 2.97Å; A1079-L1082 PolarHBondContact O-N 2.85Å; A1079-A1083 PolarHBondContact O-N 3.23Å
1080	I	48	Very low	37.1	Very low	106 Å²	106	143 Å²	143	54%	0.544	75%	0.752	S	S	.	*	H	α-helix	trans	-67	-30.2	-175.1	-59.2	173.6	0	0	0	112.2	R1078	R1078-I1080 PolarHBondContact O-N 2.82Å
1081	Q	42.6	Very low	37.3	Very low	115 Å²	115	145.8 Å²	145.8	54%	0.537	76%	0.76	S	S	.	*	H	α-helix	trans	-70	-42.7	176.8	-69.1	-71.4	2.8	0	0	112	R1078 A1079 A1083 K1084 K1085	R1078-Q1081 PolarHBondContact O-N 2.93Å; A1079-Q1081 VanDerWaalsContact C-N 3.3Å; A1079-Q1081 PolarHBondContact O-N 2.97Å; Q1081-A1083 PolarHBondContact O-N 2.97Å; Q1081-K1084 PolarHBondContact O-N 3Å; Q1081-K1085 PolarHBondContact O-N 3.12Å
1082	L	44.9	Very low	37.4	Very low	125 Å²	125	147.5 Å²	147.5	65%	0.654	76%	0.759	S	S	*	*	H	α-helix	trans	-65.9	-39.2	-178.6	-66	172.3	0	0	0	111.8	A1079 K1084 K1085	A1079-L1082 PolarHBondContact O-N 2.85Å; L1082-K1084 VanDerWaalsContact C-N 3.25Å; L1082-K1084 PolarHBondContact O-N 2.89Å; L1082-K1085 PolarHBondContact O-N 2.83Å
1083	A	44.9	Very low	37.3	Very low	80 Å²	80	146.7 Å²	146.7	66%	0.661	76%	0.76	S	S	*	*	H	α-helix	trans	-60.9	-30.7	175.1	0	0	0	0	0	113.4	A1079 Q1081	A1079-A1083 PolarHBondContact O-N 3.23Å; Q1081-A1083 PolarHBondContact O-N 2.97Å
1084	K	43.8	Very low	37	Very low	163 Å²	163	146.4 Å²	146.4	71%	0.709	77%	0.765	S	S	*	*	H	α-helix	trans	-83.1	-30.8	178.7	-76.1	-168.7	170.7	-172.2	0	114.1	Q1081 L1082 K1086	Q1081-K1084 PolarHBondContact O-N 3Å; L1082-K1084 VanDerWaalsContact C-N 3.25Å; L1082-K1084 PolarHBondContact O-N 2.89Å; K1084-K1086 VanDerWaalsContact C-N 3.27Å; K1084-K1086 PolarHBondContact O-N 2.8Å
1085	K	40.9	Very low	36.8	Very low	192 Å²	192	140.2 Å²	140.2	84%	0.835	77%	0.766	S	S	*	*	H	α-helix	trans	-70.6	-16.3	-175.7	-161.4	170.4	-178.6	179.2	0	114.2	Q1081 L1082	Q1081-K1085 PolarHBondContact O-N 3.12Å; L1082-K1085 PolarHBondContact O-N 2.83Å
1086	K	40.7	Very low	36.3	Very low	201 Å²	201	137.6 Å²	137.6	87%	0.874	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-4	-177.3	-159.8	169	179.6	179.3	0	115.3	K1084	K1084-K1086 VanDerWaalsContact C-N 3.27Å; K1084-K1086 PolarHBondContact O-N 2.8Å
1087	K	40.7	Very low	35.9	Very low	196 Å²	196	139.1 Å²	139.1	85%	0.852	78%	0.779	S	S	*	*	S	Bend	trans	-114.5	38.9	-175.6	-153.3	-179.7	179.5	176.9	0	114.8
1088	Q	34.3	Very low	35.6	Very low	184 Å²	184	135.7 Å²	135.7	86%	0.86	78%	0.783	S	S	*	*			trans	-150.9	68.2	172.6	-153.8	169	14.7	0	0	113.7
1089	R	29.3	Very low	35	Very low	258 Å²	258	129.6 Å²	129.6	97%	0.974	78%	0.784	S	S	*	*			trans	-150.4	126	161.1	-140.7	-179.4	-159	-129.6	4.3	109
1090	G	26.6	Very low	34.4	Very low	78 Å²	78	132.2 Å²	132.2	80%	0.804	80%	0.798	S	S	*	*			trans	108.4	98.6	-178.6	0	0	0	0	0	113.9
1091	S	32.4	Very low	33.2	Very low	127 Å²	127	132.2 Å²	132.2	89%	0.888	81%	0.807	S	S	*	*			trans	-143	133.9	165.5	-59.9	0	0	0	0	108.8
1092	S	31.8	Very low	32.5	Very low	119 Å²	119	133.6 Å²	133.6	83%	0.832	81%	0.813	S	S	*	*			trans	-172.1	155.2	151.6	52	0	0	0	0	111.5
1093	A	28.4	Very low	31.7	Very low	111 Å²	111	137.5 Å²	137.5	92%	0.917	82%	0.819	S	S	*	*			trans	61.6	136.1	179.8	0	0	0	0	0	116.7
1094	G	26.1	Very low	30.9	Very low	77 Å²	77	142 Å²	142	79%	0.794	82%	0.824	S	S	*	*			cis	-145.9	171	-3.6	0	0	0	0	0	111.7
1095	A	28.4	Very low	30.1	Very low	114 Å²	114	139.6 Å²	139.6	94%	0.942	82%	0.823	S	S	*	*			trans	-88.4	156	-172.1	0	0	0	0	0	113.7
1096	G	24.6	Very low	29.5	Very low	76 Å²	76	140.1 Å²	140.1	78%	0.784	83%	0.825	S	S	*	*			trans	-178.8	91.7	177.5	0	0	0	0	0	115.2
1097	T	30	Very low	28.7	Very low	143 Å²	143	134.6 Å²	134.6	88%	0.877	82%	0.817	S	S	*	*			trans	-43.4	162.8	155.5	45.7	0	0	0	0	114.2
1098	S	27.9	Very low	28.1	Very low	121 Å²	121	130.5 Å²	130.5	85%	0.846	81%	0.814	S	S	*	*			cis	-175.1	149.7	-13.6	176.7	0	0	0	0	106.2
1099	G	27	Very low	27.7	Very low	77 Å²	77	131 Å²	131	79%	0.794	81%	0.813	S	S	*	*			trans	-167	124.3	-179.1	0	0	0	0	0	113.1
1100	S	28.5	Very low	27.5	Very low	113 Å²	113	124.6 Å²	124.6	79%	0.79	80%	0.802	S	S	*	*			trans	-131.3	149.8	-165.1	-170.1	0	0	0	0	113.9
1101	C	24.3	Very low	27.4	Very low	107 Å²	107	125.4 Å²	125.4	72%	0.723	80%	0.795	S	S	*	*			trans	96.2	149.4	138.2	-135.9	0	0	0	0	121.7
1102	Q	27.8	Very low	27.1	Very low	143 Å²	143	126 Å²	126	67%	0.668	79%	0.793	S	S	*	*			trans	77.1	107.3	159	-53.6	-148.6	55.5	0	0	119.5
1103	R	27.8	Very low	26.7	Very low	207 Å²	207	124.1 Å²	124.1	78%	0.781	79%	0.785	S	S	*	*				87.7	136.5	61.6	-178	-161.6	-77.5	169.3	-13.6	112.9
1104	K	26.8	Very low	26.5	Very low	176 Å²	176	125.1 Å²	125.1	77%	0.765	78%	0.78	S	S	*	*			trans	109	123.7	146.1	-124.6	-173.9	-179.2	-176.4	0	120.8
1105	T	27.6	Very low	26.7	Very low	112 Å²	112	128.9 Å²	128.9	69%	0.687	78%	0.78	S	S	*	*			trans	64.9	111.8	141	38.3	0	0	0	0	124.7
1106	K	28.1	Very low	27.4	Very low	202 Å²	202	128.9 Å²	128.9	88%	0.878	77%	0.77	S	S	*	*				57.3	120.3	104.8	-167.5	-172.2	-175.6	-177.7	0	120.1
1107	A	25	Very low	27.4	Very low	85 Å²	85	132.2 Å²	132.2	70%	0.702	77%	0.769	S	S	*	*				146.6	131.5	126.9	0	0	0	0	0	116.6
1108	S	27.5	Very low	27.2	Very low	111 Å²	111	131.3 Å²	131.3	78%	0.776	76%	0.764	S	S	*	*			trans	52.8	114	131.7	-55.4	0	0	0	0	124.9
1109	K	26.9	Very low	27.1	Very low	193 Å²	193	130.9 Å²	130.9	84%	0.839	76%	0.761	S	S	*	*				65.1	151.1	103.8	-148.9	-169.2	-176.9	-175.9	0	120.5
1110	V	24.1	Very low	27.2	Very low	125 Å²	125	133 Å²	133	76%	0.758	76%	0.764	S	S	*	*			trans	81.9	153.4	163.3	-168.5	0	0	0	0	115.5
1111	S	24.7	Very low	27.1	Very low	94 Å²	94	131.3 Å²	131.3	66%	0.657	76%	0.764	S	S	*	*				-174.6	168.5	-64.2	65.5	0	0	0	0	111.7
1112	V	25	Very low	27.2	Very low	140 Å²	140	130.7 Å²	130.7	85%	0.848	77%	0.767	S	S	*	*			trans	76.8	138.2	153.3	170.8	0	0	0	0	119.1
1113	A	24.4	Very low	27.3	Very low	79 Å²	79	134.2 Å²	134.2	65%	0.653	77%	0.774	S	S	*	*			trans	-66.5	179.8	-176.1	0	0	0	0	0	117.3
1114	T	24.4	Very low	27.2	Very low	132 Å²	132	133.6 Å²	133.6	81%	0.81	77%	0.773	S	S	*	*				-165.5	149.9	119	-73.9	0	0	0	0	110.7
1115	I	31.1	Very low	27.1	Very low	156 Å²	156	129.5 Å²	129.5	80%	0.8	77%	0.767	S	S	*	*			trans	-152	144.4	177.1	22.6	166.2	0	0	0	108.2
1116	P	42.2	Very low	27	Very low	114 Å²	114	132 Å²	132	74%	0.74	78%	0.776	S	S	*	*				-155.2	-159.9	110.6	35.4	-12.5	0	0	0	114.9
1117	L	24.9	Very low	26.9	Very low	146 Å²	146	125.4 Å²	125.4	76%	0.764	77%	0.765	S	S	*	*			trans	84.2	80.9	164.1	-91.2	78.1	0	0	0	121.6
1118	T	25.6	Very low	27.2	Very low	125 Å²	125	126.2 Å²	126.2	77%	0.767	77%	0.771	S	S	*	*				39.6	134.7	111.8	62.8	0	0	0	0	122.8
1119	S	26.4	Very low	27.2	Very low	111 Å²	111	127 Å²	127	78%	0.776	77%	0.771	S	S	*	*				135.7	122.2	119	-170.4	0	0	0	0	116.3
1120	S	29.2	Very low	27.3	Very low	123 Å²	123	123.6 Å²	123.6	86%	0.86	77%	0.767	S	S	*	*			trans	6.1	136.4	146.5	-160.9	0	0	0	0	121.2
1121	G	25.6	Very low	27.4	Very low	76 Å²	76	122 Å²	122	78%	0.784	77%	0.767	S	S	*	*			trans	-176.9	149.8	164.5	0	0	0	0	0	111.7
1122	A	27	Very low	27.6	Very low	95 Å²	95	123.8 Å²	123.8	79%	0.785	78%	0.779	S	S	*	*			trans	-137.6	154.7	-172.8	0	0	0	0	0	114.6
1123	R	28.6	Very low	27.8	Very low	216 Å²	216	121 Å²	121	82%	0.815	78%	0.779	S	S	*	*			trans	78.1	154.9	164	-66.6	-166.7	-98	-166.3	-8.3	120
1124	Y	25.6	Very low	27.8	Very low	194 Å²	194	120.4 Å²	120.4	76%	0.761	78%	0.781	S	S	*	*			trans	83.1	101.4	156.2	-78.5	-64.4	0	0	0	121.8
1125	S	24.9	Very low	27.9	Very low	91 Å²	91	121.8 Å²	121.8	64%	0.636	78%	0.782	S	S	*	*				58.9	151	121.7	60.7	0	0	0	0	123.3
1126	D	26.3	Very low	27.9	Very low	165 Å²	165	120.5 Å²	120.5	88%	0.882	78%	0.782	S	S	*	*			trans	63.8	156.6	169.5	-68.8	-27	0	0	0	116.9
1127	G	25.9	Very low	27.2	Very low	63 Å²	63	120.7 Å²	120.7	65%	0.649	78%	0.776	S	S	*	*			cis	-175.1	153.1	-4.7	0	0	0	0	0	110.4
1128	A	30.7	Very low	27.4	Very low	101 Å²	101	124 Å²	124	84%	0.835	78%	0.778	S	S	*	*			trans	-80.5	137.1	-172.6	0	0	0	0	0	113.5
1129	V	28	Very low	27.5	Very low	128 Å²	128	124.9 Å²	124.9	78%	0.776	78%	0.778	S	S	*	*			trans	-130.7	95.9	173.3	176.1	0	0	0	0	105.8
1130	T	28.1	Very low	28.7	Very low	121 Å²	121	123.5 Å²	123.5	74%	0.742	77%	0.767	S	S	*	*				56.8	150.5	81.6	70.2	0	0	0	0	115.1
1131	A	27.8	Very low	28.8	Very low	92 Å²	92	124.1 Å²	124.1	76%	0.76	77%	0.765	S	S	*	*			cis	-179.1	129.3	-34.1	0	0	0	0	0	107.5
1132	S	28.8	Very low	29.3	Very low	131 Å²	131	125.9 Å²	125.9	92%	0.916	76%	0.761	S	S	*	*			trans	-175.6	132.2	164.7	47.2	0	0	0	0	108.4
1133	G	27.6	Very low	29.3	Very low	82 Å²	82	124.4 Å²	124.4	85%	0.845	75%	0.754	S	S	*	*			cis	155.4	152.8	-1	0	0	0	0	0	107.5
1134	G	25.2	Very low	29.4	Very low	67 Å²	67	119.7 Å²	119.7	69%	0.691	75%	0.75	S	S	*	*			cis	164.8	146.6	-6.6	0	0	0	0	0	110.2
1135	L	25.7	Very low	29.8	Very low	161 Å²	161	117.9 Å²	117.9	84%	0.843	75%	0.748	S	S	*	*			trans	66.3	144.3	175.2	-46	177.8	0	0	0	114.2	L1137	L1135-L1137 HydrophobicContact CB-CD1 4.25Å; L1135-L1137 HydrophobicContact CD2-CD1 4.12Å
1136	T	32.3	Very low	29.9	Very low	128 Å²	128	122.8 Å²	122.8	79%	0.785	75%	0.754	S	S	*	*			cis	-115.7	149.7	38.6	46.6	0	0	0	0	113.3
1137	L	26.6	Very low	29.9	Very low	118 Å²	118	120.8 Å²	120.8	62%	0.618	75%	0.748	S	S	*	*				54.1	129.9	71.2	-76.1	81.1	0	0	0	112.7	L1135	L1135-L1137 HydrophobicContact CB-CD1 4.25Å; L1135-L1137 HydrophobicContact CD2-CD1 4.12Å
1138	R	30.1	Very low	29.9	Very low	217 Å²	217	126.1 Å²	126.1	82%	0.819	76%	0.756	S	S	*	*			cis	-154.3	141.9	11.9	-117.8	-78.2	171.8	97.8	-0.9	113.5
1139	D	27.2	Very low	29.8	Very low	143 Å²	143	129.4 Å²	129.4	77%	0.765	76%	0.758	S	S	*	*			trans	-78.3	-164.9	153.2	-151.8	26.2	0	0	0	109
1140	P	52.6	Low	29.8	Very low	82 Å²	82	130 Å²	130	53%	0.532	75%	0.752	S	S	.	*			cis	-128.4	-159.1	-18.8	43.2	-25.8	0	0	0	112
1141	V	30.4	Very low	29.9	Very low	135 Å²	135	131.5 Å²	131.5	82%	0.818	75%	0.754	S	S	*	*				168.5	148.8	125	150.3	0	0	0	0	112.2
1142	T	35.4	Very low	30.1	Very low	114 Å²	114	132.6 Å²	132.6	70%	0.699	75%	0.747	S	S	*	*			cis	-165.8	150.2	-45.4	-53.6	0	0	0	0	107.9	T1144	T1142-T1144 HydrophobicContact CG2-CG2 4.3Å
1143	G	28.2	Very low	30.2	Very low	63 Å²	63	132.8 Å²	132.8	65%	0.649	73%	0.733	S	S	*	*			trans	145.5	100.1	161.3	0	0	0	0	0	112.9
1144	T	30.5	Very low	30.2	Very low	118 Å²	118	136.7 Å²	136.7	72%	0.724	73%	0.729	S	S	*	*			cis	59.1	128.9	48.4	80.4	0	0	0	0	113	T1142	T1142-T1144 HydrophobicContact CG2-CG2 4.3Å
1145	Q	32.9	Very low	30.3	Very low	155 Å²	155	139.1 Å²	139.1	72%	0.724	73%	0.727	S	S	*	*			cis	-167.5	169.5	23.7	-145.6	171	18.3	0	0	113.2
1146	Y	28.1	Very low	30.9	Very low	195 Å²	195	139.2 Å²	139.2	77%	0.765	73%	0.728	S	S	*	*			trans	88.3	142.7	145.6	-94	-61	0	0	0	125.3
1147	V	26	Very low	31.4	Very low	123 Å²	123	139.1 Å²	139.1	75%	0.745	73%	0.729	S	S	*	*			trans	74.1	88.4	157.7	-174.2	0	0	0	0	121.4
1148	Q	26.6	Very low	31.7	Very low	175 Å²	175	138.4 Å²	138.4	82%	0.818	74%	0.741	S	S	*	*				20.9	129.6	117.5	-178.1	178	2.1	0	0	121.8
1149	I	28.7	Very low	31.6	Very low	170 Å²	170	132.8 Å²	132.8	87%	0.872	74%	0.735	S	S	*	*				-159.9	158.6	129.8	-104.2	159.5	0	0	0	110.8
1150	Q	28.1	Very low	31.6	Very low	141 Å²	141	133.5 Å²	133.5	66%	0.659	74%	0.739	S	S	*	*			trans	-98.7	157.3	-166.7	-174.1	69.9	18	0	0	113.5
1151	L	29.9	Very low	30.5	Very low	152 Å²	152	133.3 Å²	133.3	80%	0.796	75%	0.751	S	S	*	*			trans	158.8	106	140.7	-86.3	141.1	0	0	0	108.1
1152	L	30.5	Very low	30.3	Very low	114 Å²	114	133.8 Å²	133.8	60%	0.597	75%	0.749	S	S	*	*				71.8	138.6	82.9	-73.1	160.3	0	0	0	112.6
1153	Q	31.5	Very low	30	Very low	136 Å²	136	135.5 Å²	135.5	64%	0.636	75%	0.753	S	S	*	*			cis	-154.9	137.1	5.2	-154.2	159.2	-41.9	0	0	105.9
1154	Q	28.3	Very low	29.9	Very low	163 Å²	163	135.7 Å²	135.7	76%	0.762	75%	0.749	S	S	*	*				50.6	122.5	75.8	-159.3	-175	-18.4	0	0	114.3
1155	D	27.3	Very low	29.8	Very low	119 Å²	119	138.3 Å²	138.3	64%	0.636	75%	0.751	S	S	*	*			trans	165	109.7	130.6	-78.9	-22	0	0	0	113
1156	D	38.1	Very low	29.6	Very low	162 Å²	162	138.3 Å²	138.3	87%	0.866	75%	0.751	S	S	*	*			trans	-77.4	150.3	141.7	-85.2	-70.9	0	0	0	107.6
1157	P	42.8	Very low	29.6	Very low	126 Å²	126	136.9 Å²	136.9	82%	0.818	76%	0.755	S	S	*	*				-146.1	159.6	114.5	36	-21.3	0	0	0	115.4
1158	A	31.6	Very low	29.6	Very low	103 Å²	103	135.9 Å²	135.9	85%	0.851	75%	0.753	S	S	*	*			trans	-110.2	161.8	177.7	0	0	0	0	0	112.9
1159	S	28.5	Very low	29.6	Very low	99 Å²	99	133.1 Å²	133.1	69%	0.692	75%	0.753	S	S	*	*			trans	-168.6	124.5	147.9	179.9	0	0	0	0	110.3
1160	D	28.3	Very low	29.6	Very low	159 Å²	159	131.5 Å²	131.5	85%	0.85	74%	0.742	S	S	*	*			trans	38.6	145.7	144	-48.7	-76.7	0	0	0	122.3
1161	G	28.5	Very low	29.9	Very low	77 Å²	77	131 Å²	131	79%	0.794	75%	0.752	S	S	*	*			trans	-166.1	-47.4	178.7	0	0	0	0	0	119.7
1162	D	26.2	Very low	29.7	Very low	145 Å²	145	127.4 Å²	127.4	78%	0.775	74%	0.739	S	S	*	*			trans	65.4	154.2	172.9	-150.3	5.3	0	0	0	119.6
1163	L	29.1	Very low	29.6	Very low	150 Å²	150	127.8 Å²	127.8	79%	0.785	75%	0.746	S	S	*	*			trans	61.5	162.6	166.8	-51.6	-178.5	0	0	0	120.7
1164	A	27	Very low	29.7	Very low	68 Å²	68	126.5 Å²	126.5	56%	0.562	75%	0.752	S	S	*	*			cis	-172.4	171.5	-43.9	0	0	0	0	0	110.9
1165	F	27.9	Very low	29.5	Very low	173 Å²	173	126.1 Å²	126.1	76%	0.759	76%	0.755	S	S	*	*			trans	70.4	119.6	172.2	-67.4	-91.7	0	0	0	116.9
1166	Q	29.8	Very low	29.7	Very low	155 Å²	155	125 Å²	125	72%	0.724	76%	0.757	S	S	*	*				70.7	139.7	70.3	-69.1	-172.9	2.5	0	0	113
1167	L	26.9	Very low	29.3	Very low	165 Å²	165	125.5 Å²	125.5	86%	0.864	75%	0.754	S	S	*	*			cis	-134.3	-175.5	35.4	-78.7	165.6	0	0	0	114.7
1168	S	25.8	Very low	28.5	Very low	101 Å²	101	125.9 Å²	125.9	71%	0.706	75%	0.748	S	S	*	*			trans	-141.5	148.9	-169.4	172.3	0	0	0	0	113.1
1169	S	27	Very low	28.2	Very low	117 Å²	117	126.7 Å²	126.7	82%	0.818	74%	0.743	S	S	*	*			trans	-151.4	84.5	157	61.8	0	0	0	0	112.7
1170	Q	29.4	Very low	28.3	Very low	137 Å²	137	128 Å²	128	64%	0.64	75%	0.746	S	S	*	*				-1.3	153.4	125.4	-77.2	-77.7	-31.3	0	0	117.4	S1172	Q1170-S1172 PolarHBondContact NE2-OG 2.84Å; Q1170-S1172 PolarHBondContact OE1-OG 2.99Å
1171	P	33.5	Very low	28.2	Very low	131 Å²	131	126.8 Å²	126.8	85%	0.851	74%	0.74	S	S	*	*			cis	-136.5	175.3	49	38.1	-19.5	0	0	0	118.3
1172	S	26.3	Very low	28.3	Very low	75 Å²	75	129.9 Å²	129.9	52%	0.524	74%	0.737	S	S	.	*			trans	-131.7	162.8	-166.1	-47.3	0	0	0	0	114.6	Q1170	Q1170-S1172 PolarHBondContact NE2-OG 2.84Å; Q1170-S1172 PolarHBondContact OE1-OG 2.99Å
1173	T	27.4	Very low	28.9	Very low	123 Å²	123	128.5 Å²	128.5	76%	0.755	74%	0.737	S	S	*	*			trans	7.2	126	146.8	56.1	0	0	0	0	121.2
1174	S	33.3	Very low	28.8	Very low	109 Å²	109	126.7 Å²	126.7	76%	0.762	73%	0.731	S	S	*	*			trans	18.3	140.3	133.6	61	0	0	0	0	122.6
1175	D	25.4	Very low	28.8	Very low	154 Å²	154	131.5 Å²	131.5	82%	0.824	75%	0.748	S	S	*	*				-160	-157.9	112.4	-139.7	-44.2	0	0	0	113.1
1176	S	30.3	Very low	28.9	Very low	96 Å²	96	130 Å²	130	67%	0.671	75%	0.746	S	S	*	*			trans	-127.4	174	-149.6	-50	0	0	0	0	116.7
1177	Q	29.8	Very low	28.7	Very low	173 Å²	173	130.6 Å²	130.6	81%	0.808	75%	0.753	S	S	*	*			trans	108.3	124.2	151.3	-64.4	-169.7	-7	0	0	123
1178	L	27.7	Very low	28.6	Very low	133 Å²	133	131.1 Å²	131.1	70%	0.696	75%	0.751	S	S	*	*				80.3	106.7	128.5	-70.3	172.6	0	0	0	126.1
1179	T	24.6	Very low	28.9	Very low	120 Å²	120	135.1 Å²	135.1	74%	0.736	76%	0.759	S	S	*	*				70.8	167.1	129.6	49.9	0	0	0	0	123.9
1180	V	29.6	Very low	29.4	Very low	126 Å²	126	135.7 Å²	135.7	76%	0.764	76%	0.76	S	S	*	*			trans	86.2	140.9	170.4	-172.9	0	0	0	0	115.4
1181	D	27.3	Very low	29.1	Very low	135 Å²	135	134.6 Å²	134.6	72%	0.722	77%	0.767	S	S	*	*			cis	-176.1	171.6	-40.3	-91.2	-32.7	0	0	0	107.1
1182	L	30.7	Very low	28.9	Very low	141 Å²	141	134 Å²	134	74%	0.738	76%	0.761	S	S	*	*			cis	-132.5	-117.7	-1.8	-154.4	71	0	0	0	107.6
1183	P	38.2	Very low	28.7	Very low	117 Å²	117	137.9 Å²	137.9	76%	0.76	77%	0.773	S	S	*	*			cis	-113.7	179.6	-23.3	42.8	-29.5	0	0	0	114
1184	V	27.8	Very low	28.7	Very low	111 Å²	111	136.8 Å²	136.8	67%	0.673	77%	0.766	S	S	*	*			trans	-144.4	148.3	178.4	173.8	0	0	0	0	110.7	I1186	V1184-I1186 HydrophobicContact CG1-CD1 4.22Å; V1184-I1186 HydrophobicContact CG1-CG1 3.96Å
1185	N	26.3	Very low	28.4	Very low	169 Å²	169	138.5 Å²	138.5	90%	0.904	76%	0.762	S	S	*	*			trans	-121.4	140	168.7	-95.2	-41.2	0	0	0	111.1
1186	I	29	Very low	28.5	Very low	142 Å²	142	139.6 Å²	139.6	73%	0.728	76%	0.762	S	S	*	*			trans	-140	128.7	-178.7	-61.8	173	0	0	0	110.5	V1184	V1184-I1186 HydrophobicContact CG1-CD1 4.22Å; V1184-I1186 HydrophobicContact CG1-CG1 3.96Å
1187	L	27	Very low	28.4	Very low	167 Å²	167	141.3 Å²	141.3	87%	0.874	76%	0.764	S	S	*	*			trans	-140.6	119.9	159.2	-67.1	168.8	0	0	0	104.4
1188	Q	25.4	Very low	28.3	Very low	176 Å²	176	140 Å²	140	82%	0.822	76%	0.762	S	S	*	*			cis	80.3	107.7	44.2	-163.7	163.7	50.5	0	0	113.2
1189	E	30.8	Very low	28.2	Very low	186 Å²	186	137.1 Å²	137.1	87%	0.869	77%	0.765	S	S	*	*			trans	-82.6	159.5	-178.8	-56.8	177.2	136.4	0	0	113.3
1190	P	37.3	Very low	28.5	Very low	129 Å²	129	137.5 Å²	137.5	84%	0.838	77%	0.773	S	S	*	*			trans	-123.7	173.8	137.4	37.6	-28.9	0	0	0	112.6
1191	S	23.9	Very low	28.3	Very low	114 Å²	114	138.1 Å²	138.1	80%	0.797	77%	0.772	S	S	*	*			trans	-139.3	-169.1	-173.7	-171.5	0	0	0	0	111.1
1192	V	28.1	Very low	28.4	Very low	117 Å²	117	139.2 Å²	139.2	71%	0.709	78%	0.778	S	S	*	*			trans	96.9	99.6	159.9	-176.7	0	0	0	0	118.7
1193	M	23.7	Very low	28.4	Very low	157 Å²	157	137.7 Å²	137.7	77%	0.773	78%	0.778	S	S	*	*			trans	72.7	154.7	138	-51.9	-75.7	82.1	0	0	119.5
1194	T	26.9	Very low	28.2	Very low	100 Å²	100	141 Å²	141	61%	0.613	78%	0.784	S	S	*	*			cis	-165.8	175.8	-7.3	20.1	0	0	0	0	111.9
1195	E	27.2	Very low	28.1	Very low	145 Å²	145	145.3 Å²	145.3	68%	0.678	79%	0.794	S	S	*	*			trans	69	115	167.7	-35.3	-52.5	54.2	0	0	117.4
1196	E	26.8	Very low	28.4	Very low	178 Å²	178	142.7 Å²	142.7	83%	0.832	78%	0.784	S	S	*	*				85.1	133.4	95.1	-73.5	-172.9	167.8	0	0	113.4
1197	D	27.9	Very low	28.4	Very low	131 Å²	131	139.4 Å²	139.4	70%	0.701	79%	0.785	S	S	*	*			cis	-153.1	161.5	3.3	-175.3	30.4	0	0	0	112.4
1198	N	28.3	Very low	28.5	Very low	145 Å²	145	136.4 Å²	136.4	78%	0.775	78%	0.779	S	S	*	*			trans	37.4	122.5	160.5	-85.3	-54.9	0	0	0	122.8
1199	G	26.1	Very low	28.8	Very low	74 Å²	74	134.1 Å²	134.1	76%	0.763	78%	0.777	S	S	*	*			trans	155.3	102.6	145	0	0	0	0	0	120.9
1200	S	29.5	Very low	28.8	Very low	128 Å²	128	133.6 Å²	133.6	90%	0.895	78%	0.778	S	S	*	*			trans	70.3	143.3	156.5	-159.7	0	0	0	0	121.4
1201	D	26.6	Very low	28.3	Very low	139 Å²	139	133.5 Å²	133.5	74%	0.743	77%	0.771	S	S	*	*			trans	-82.5	143.7	178.1	-63.4	-75.8	0	0	0	114.4
1202	N	28.8	Very low	28.9	Very low	158 Å²	158	133.9 Å²	133.9	85%	0.845	76%	0.763	S	S	*	*				-177.5	148.3	98.4	-113.1	-58.6	0	0	0	117.3
1203	S	31.3	Very low	29	Very low	108 Å²	108	133.6 Å²	133.6	76%	0.755	75%	0.754	S	S	*	*			trans	48.8	98.1	148.5	-158.8	0	0	0	0	121.4
1204	Q	33	Very low	29.3	Very low	186 Å²	186	134 Å²	134	87%	0.869	76%	0.759	S	S	*	*				-133.4	135	128.5	-74.1	-169.1	2.9	0	0	108.8
1205	F	27.4	Very low	29.8	Very low	202 Å²	202	137 Å²	137	89%	0.886	77%	0.771	S	S	*	*			trans	-152.6	153.6	159.8	-132.9	-87.1	0	0	0	114.2
1206	T	31	Very low	30	Very low	114 Å²	114	142.7 Å²	142.7	70%	0.699	80%	0.797	S	S	*	*			trans	-77.2	145.4	-174.8	56.4	0	0	0	0	113.4
1207	G	29	Very low	30.1	Very low	73 Å²	73	140.9 Å²	140.9	75%	0.753	80%	0.795	S	S	*	*			trans	-67	153.4	178.6	0	0	0	0	0	115.1
1208	S	30.7	Very low	30.2	Very low	105 Å²	105	141.4 Å²	141.4	73%	0.734	80%	0.8	S	S	*	*			trans	-164.3	158.9	169.8	-89.2	0	0	0	0	112.8
1209	T	29.8	Very low	30.3	Very low	128 Å²	128	141.2 Å²	141.2	79%	0.785	80%	0.802	S	S	*	*			trans	33.6	109	152.2	57	0	0	0	0	119.7	N1211	T1209-N1211 PolarHBondContact O-N 3.46Å
1210	I	31.3	Very low	30.6	Very low	174 Å²	174	145.2 Å²	145.2	89%	0.892	80%	0.804	S	S	*	*			trans	-63.8	129	151.1	-72	175.5	0	0	0	108.8
1211	N	27.4	Very low	30.7	Very low	128 Å²	128	146.3 Å²	146.3	68%	0.684	80%	0.798	S	S	*	*			trans	-80.9	162.4	178.5	-161.6	3.3	0	0	0	111.3	T1209	T1209-N1211 PolarHBondContact O-N 3.46Å
1212	L	36.5	Very low	30.9	Very low	122 Å²	122	146.7 Å²	146.7	64%	0.639	80%	0.802	S	S	*	*	S	Bend	trans	-118.2	80.4	-179.6	-94.8	164.7	0	0	0	109.8
1213	Q	30.8	Very low	31.1	Very low	111 Å²	111	145.9 Å²	145.9	52%	0.519	80%	0.799	S	S	.	*			trans	-134	-25	178.8	-139	61.4	76.2	0	0	114.6	L1215	Q1213-L1215 PolarHBondContact O-N 2.67Å
1214	D	30	Very low	31.1	Very low	166 Å²	166	148.8 Å²	148.8	89%	0.888	80%	0.802	S	S	*	*			trans	-93.6	78.1	177.7	-54.3	-64.5	0	0	0	112.4
1215	L	36.2	Very low	30.9	Very low	163 Å²	163	145.8 Å²	145.8	85%	0.853	80%	0.797	S	S	*	*			trans	-161.7	59.3	166.6	-125.3	171.9	0	0	0	110.9	Q1213	Q1213-L1215 PolarHBondContact O-N 2.67Å
1216	E	30.8	Very low	31.2	Very low	263 Å²	263	140.6 Å²	140.6	100%	1.229	79%	0.789	S	S	*	*			trans	-89.6	0	158.9	-61.3	-158.3	127.8	0	0	110.2

Retrieved 1,216 of 1,216 residues in 1547.8 ms (Link to these results)

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