A0A087Y2F9_POEFO Loading...

MDS1 and EVI1 complex locus

AlphaFold DB , UniProt , Accession A0A087Y2F9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,255 aa.

						>A0A087Y2F9_POEFO|A0A087Y2F9
MRSKGRARKLATSDGNDDFGFFPSNVLDNACGSDGDPTPSSALTDDPLSDDESSPQSLQQASIFFPQGNLTIPLDFELRESAVPGASLGIWSRRKVNIGERFGPYEGEHAPCLQDPMQGWEILDGSGHVKFCLDASKPDAGSWLKHIQFAPAATQHNLRACQIDEQIFYKVTREIFPGEELLLFMKAEEYFCDAMAPDIHEERQYRCEDCDQHFESRSELLDHQKEPCGMPPSAFLNPGEDADLTAQEPQDLRPLHMSHGLHECKECDQVFPDVQSLENHSQSHSEEREYKCDQCPKAFNWKSNLIRHQMSHDSGKHYECENCSKQVFTDPSNLQRHIRSQHVGARAHACSDCGKTFATSSGLKQHKHIHSSVKPFMCEVCHKSYTQFSNLCRHKRMHADCRTQIKCKDCGQMFSTTSSLNKHRRFCEGKNHFAAGGLFAQGLPLPGTPGLDKSALTLGHSSAGLADYFGASRHHSGLTFPAAPAFPFSFPGLFPSGLYHRPQLIPATSAPVRHTAHAPVTGPGVELSKSPLLPPSPGALESQELLKALCKNGSSPGNDMQDSDLPNQGSSVSAKQQNKQSDQSESSDVDDVSTPSGSDLESTTGSELESDMDSEKERGVARENGKGPRRKATERDPQSPSLIGSSTAKGFPGQSLIQSSLDEHTAVTGAVNDSIKAIASIAEKYFGSAGLAGLQDKKVGSLPYPSMFPLPFFPTFSPPVYPLPDRDLRPTGVKGEPQSPGDDCKKAQSKSSESPFDLTTKRKEGKLSLFVPTKTDAANVTGQDQPLDLSLGSRGRGQIPCQEETRKNKSFEEEKKAVDAPKADTSLQHARPTPFFMDPIYRVEKRRMSDPFETLKDKYMRPTPGFLFHPQFRLPDQRTWMTAIESMAEKLETFGSLKPETGELLRSVPSMFDFRAPPSTLPETLLRKGKERYTCRYCGKIFPRSANLTRHLRTHTGEQPYRCKYCDRSFSISSNLQRHIRNIHNKEKPFKCHLCDRCFGQQTNLDRHLKKHENGHLSGTAMSSPQSELDSSSAILDDKEDSYFNEIRNFISSASQNQTSPDPSEEGLNGGLLEEGKPLMPSHGSRDLEDEEVEDLDAEEEEAEEPRNSPPKTDVKVHPSSVGDDEMDFSEPSNLNLSCKTSPRRYSHEEEQSSFSALDQIHRFSDLRKMEESELSDRDGDGDGDEDDGSFASPSLAKAVKQPLFRKSKSQAYAMMLSLAEKDSLHSAPHTPATMWHSLARAAAESSAIQSLSHV
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.9	Very low	31.5	Very low	237 Å²	237	164.3 Å²	164.3	100%	1.167	83%	0.825	S	S	*	*				0	124.2	0	-66.2	139.8	69.4	0	0	106.5
2	R	32.6	Very low	31.5	Very low	236 Å²	236	160.8 Å²	160.8	89%	0.891	82%	0.819	S	S	*	*			cis	83.2	121.1	45.9	-159.2	-175.3	-156.5	-169.7	9	112.3
3	S	32	Very low	31.1	Very low	106 Å²	106	157.1 Å²	157.1	74%	0.741	82%	0.816	S	S	*	*			trans	79	156	164.6	88.7	0	0	0	0	118
4	K	33.8	Very low	31.1	Very low	201 Å²	201	156.9 Å²	156.9	87%	0.874	82%	0.817	S	S	*	*			cis	-170.6	133.4	-24.1	-111.1	178.5	-179.6	-178.9	0	110.3
5	G	31.3	Very low	31	Very low	79 Å²	79	151 Å²	151	81%	0.814	81%	0.81	S	S	*	*			trans	67.8	177.8	149.5	0	0	0	0	0	119.7
6	R	32.3	Very low	31	Very low	241 Å²	241	150.1 Å²	150.1	91%	0.909	81%	0.805	S	S	*	*			cis	-174.2	146.2	-23.4	-175.3	-177.4	-179.3	-168	2.5	110.4
7	A	28.8	Very low	30.9	Very low	89 Å²	89	148.9 Å²	148.9	74%	0.736	80%	0.799	S	S	*	*			trans	70.7	153.2	167.6	0	0	0	0	0	116.1
8	R	33.8	Very low	30.7	Very low	236 Å²	236	148.7 Å²	148.7	89%	0.891	80%	0.797	S	S	*	*			cis	-141.6	171.6	13.3	-52.9	164.6	-176.1	176.2	0.1	107.4
9	K	32.9	Very low	30.7	Very low	180 Å²	180	150.9 Å²	150.9	78%	0.783	80%	0.799	S	S	*	*			cis	-165.6	-179.9	-7.4	-119.4	-176.7	149.1	-154.5	0	104.9
10	L	29.9	Very low	30.6	Very low	132 Å²	132	146.6 Å²	146.6	69%	0.691	79%	0.792	S	S	*	*			cis	-159	169	5.9	-123.7	176.8	0	0	0	110
11	A	29.2	Very low	30.4	Very low	70 Å²	70	148.1 Å²	148.1	58%	0.579	79%	0.792	S	S	*	*			trans	2.2	160.9	139	0	0	0	0	0	123.6
12	T	31	Very low	30.2	Very low	123 Å²	123	145.4 Å²	145.4	76%	0.755	77%	0.774	S	S	*	*			cis	-174.8	145	-7.8	28.9	0	0	0	0	111.1
13	S	26.7	Very low	30.8	Very low	112 Å²	112	140 Å²	140	78%	0.783	77%	0.769	S	S	*	*			trans	157.2	124.3	146.7	56.2	0	0	0	0	108.8
14	D	30.5	Very low	30.9	Very low	154 Å²	154	140.1 Å²	140.1	82%	0.824	77%	0.77	S	S	*	*			cis	95.9	130.5	31.7	-64.1	-32.3	0	0	0	114.4
15	G	29.6	Very low	30.6	Very low	69 Å²	69	138 Å²	138	71%	0.711	77%	0.768	S	S	*	*			trans	113.5	98.4	-168.3	0	0	0	0	0	111.8
16	N	30.8	Very low	30.5	Very low	137 Å²	137	139.8 Å²	139.8	73%	0.733	76%	0.763	S	S	*	*			cis	65.1	125.3	36.6	-79.2	63	0	0	0	113.2
17	D	29.9	Very low	30.5	Very low	130 Å²	130	135.9 Å²	135.9	70%	0.695	76%	0.76	S	S	*	*			cis	-149	-173.6	-5.2	-73.6	-49.5	0	0	0	108.3
18	D	28.1	Very low	30.4	Very low	144 Å²	144	139.3 Å²	139.3	77%	0.77	77%	0.766	S	S	*	*			cis	-157.9	-179	8.8	-151.6	-15.8	0	0	0	112.1
19	F	30.1	Very low	30.1	Very low	192 Å²	192	135.1 Å²	135.1	84%	0.842	76%	0.761	S	S	*	*			trans	-96.8	179.3	165.6	-72.9	-109.2	0	0	0	110.3
20	G	29	Very low	30.1	Very low	63 Å²	63	131 Å²	131	65%	0.649	76%	0.761	S	S	*	*			cis	161.9	143.6	-10.9	0	0	0	0	0	112.9
21	F	26.7	Very low	30.1	Very low	179 Å²	179	131 Å²	131	79%	0.785	77%	0.77	S	S	*	*			trans	50.3	127.5	157.5	-72.3	-68.7	0	0	0	124.7
22	F	25.1	Very low	30	Very low	181 Å²	181	131.1 Å²	131.1	79%	0.794	78%	0.778	S	S	*	*			trans	64	170.8	140.6	-72.6	-47	0	0	0	120.3
23	P	45.9	Very low	30.2	Very low	122 Å²	122	130.4 Å²	130.4	79%	0.792	78%	0.778	S	S	*	*			cis	-128.4	-152.9	-35.6	35.4	-16.3	0	0	0	112.3
24	S	32.9	Very low	30.3	Very low	109 Å²	109	132.3 Å²	132.3	76%	0.762	78%	0.779	S	S	*	*			trans	-84.4	169.3	-167.3	-39.9	0	0	0	0	117.8
25	N	28.5	Very low	30.4	Very low	155 Å²	155	128.6 Å²	128.6	83%	0.829	78%	0.778	S	S	*	*			trans	109.7	146.8	132.2	-116.9	-7.4	0	0	0	121.3
26	V	29.3	Very low	30.5	Very low	118 Å²	118	132.9 Å²	132.9	72%	0.715	78%	0.784	S	S	*	*			trans	86.4	123.6	157.5	174.4	0	0	0	0	121.4
27	L	31.2	Very low	31.2	Very low	159 Å²	159	130.3 Å²	130.3	83%	0.832	78%	0.775	S	S	*	*			trans	28.7	138.7	148.7	-60.7	170.8	0	0	0	122.6
28	D	26.4	Very low	31	Very low	161 Å²	161	130.4 Å²	130.4	86%	0.861	78%	0.78	S	S	*	*				-164.7	-176.5	96.4	-140.6	-27.1	0	0	0	113.1
29	N	28	Very low	31.5	Very low	147 Å²	147	129.5 Å²	129.5	79%	0.786	78%	0.782	S	S	*	*			trans	-138.4	142.2	-158.8	-146.7	3.9	0	0	0	115.7
30	A	33.5	Very low	31.3	Very low	95 Å²	95	125.8 Å²	125.8	79%	0.785	78%	0.78	S	S	*	*			trans	64.1	166.4	166.4	0	0	0	0	0	118
31	C	30.4	Very low	31.1	Very low	132 Å²	132	128.4 Å²	128.4	89%	0.892	79%	0.788	S	S	*	*			cis	-152.8	159.5	3.2	-161.1	0	0	0	0	112.1
32	G	25.6	Very low	31.1	Very low	72 Å²	72	124 Å²	124	74%	0.742	79%	0.786	S	S	*	*			trans	173.2	103.3	168.7	0	0	0	0	0	117
33	S	36.6	Very low	31.1	Very low	107 Å²	107	123 Å²	123	75%	0.748	79%	0.788	S	S	*	*			trans	-7.7	152.1	153.7	-92.9	0	0	0	0	121.2
34	D	28.9	Very low	30.1	Very low	152 Å²	152	122.7 Å²	122.7	81%	0.813	78%	0.784	S	S	*	*			cis	-137.6	156.5	4.3	-68.4	-56.6	0	0	0	108.7
35	G	32.1	Very low	29.7	Very low	77 Å²	77	124.3 Å²	124.3	79%	0.794	78%	0.784	S	S	*	*				101.3	137.9	59.1	0	0	0	0	0	110.2
36	D	31.8	Very low	29.8	Very low	159 Å²	159	123.9 Å²	123.9	85%	0.85	78%	0.781	S	S	*	*			cis	-158.8	-162.9	2.2	-152.4	27.3	0	0	0	109.5
37	P	45	Very low	30.4	Very low	82 Å²	82	123.9 Å²	123.9	53%	0.532	78%	0.784	S	S	.	*				-139.6	159.5	-106.7	45.3	-27.7	0	0	0	120.7
38	T	25.3	Very low	30.2	Very low	132 Å²	132	124 Å²	124	81%	0.81	79%	0.785	S	S	*	*			trans	62.1	175	139.6	60.4	0	0	0	0	120.9
39	P	39.4	Very low	30.2	Very low	125 Å²	125	121 Å²	121	81%	0.812	78%	0.776	S	S	*	*			cis	-129.2	-177.5	0.1	38.3	-18.3	0	0	0	117.7
40	S	26.2	Very low	30.1	Very low	115 Å²	115	121 Å²	121	80%	0.804	78%	0.776	S	S	*	*			trans	-76.8	154	-166.8	-35.6	0	0	0	0	118.6
41	S	25.2	Very low	29.8	Very low	117 Å²	117	123.4 Å²	123.4	82%	0.818	78%	0.776	S	S	*	*			trans	-172.3	138.8	139.7	-77.5	0	0	0	0	107.5
42	A	25.8	Very low	29.6	Very low	88 Å²	88	123.1 Å²	123.1	73%	0.727	76%	0.761	S	S	*	*			cis	97	104.7	36	0	0	0	0	0	114.2
43	L	25.1	Very low	29.5	Very low	160 Å²	160	125.2 Å²	125.2	84%	0.838	77%	0.765	S	S	*	*			trans	74.5	144.9	153.5	-66.7	169.3	0	0	0	122.7
44	T	24.3	Very low	29	Very low	115 Å²	115	124.9 Å²	124.9	71%	0.706	76%	0.762	S	S	*	*			trans	84.2	143.7	141.1	34.6	0	0	0	0	123.7
45	D	25.8	Very low	29.2	Very low	142 Å²	142	123.1 Å²	123.1	76%	0.759	76%	0.759	S	S	*	*			trans	77.1	95.6	152.7	-53.9	-18.4	0	0	0	122.2
46	D	30.9	Very low	29	Very low	146 Å²	146	128.2 Å²	128.2	78%	0.781	76%	0.762	S	S	*	*			trans	-61.2	149.1	133.6	-119.1	-64.2	0	0	0	109.5
47	P	40.9	Very low	28.8	Very low	119 Å²	119	125.8 Å²	125.8	77%	0.773	76%	0.758	S	S	*	*				-152.6	173.6	78.7	40.7	-21.7	0	0	0	117.8
48	L	27.7	Very low	28	Very low	162 Å²	162	129.6 Å²	129.6	85%	0.848	77%	0.773	S	S	*	*			trans	-61.2	145.9	169.7	-60.7	150.8	0	0	0	114
49	S	26.7	Very low	28.2	Very low	97 Å²	97	132.6 Å²	132.6	68%	0.678	78%	0.777	S	S	*	*				168.6	160.7	99.7	-143.7	0	0	0	0	113.9
50	D	25.5	Very low	27.7	Very low	148 Å²	148	135.1 Å²	135.1	79%	0.791	78%	0.779	S	S	*	*			trans	65.2	146.4	156.1	-53.3	-7.2	0	0	0	121.1
51	D	26	Very low	27.6	Very low	144 Å²	144	134.1 Å²	134.1	77%	0.77	78%	0.777	S	S	*	*			cis	-162	165.5	-33.8	-165.8	-153.9	0	0	0	110.5
52	E	26.7	Very low	27.6	Very low	127 Å²	127	133.1 Å²	133.1	59%	0.593	77%	0.77	S	S	*	*			trans	51.5	121.8	156.2	-102.7	-76	71.4	0	0	122.2	S54	E52-S54 PolarHBondContact OE1-N 2.59Å
53	S	23.3	Very low	28	Very low	116 Å²	116	135.5 Å²	135.5	81%	0.811	77%	0.769	S	S	*	*				-171.3	92.7	128.3	28.8	0	0	0	0	112.2
54	S	26	Very low	28.1	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	77%	0.77	S	S	*	*			trans	-67.4	145.4	166.6	-63.9	0	0	0	0	112.4	E52	E52-S54 PolarHBondContact OE1-N 2.59Å
55	P	34.3	Very low	28.8	Very low	115 Å²	115	137.3 Å²	137.3	75%	0.747	76%	0.761	S	S	*	*				-148	136.1	102.9	36	-19.5	0	0	0	117
56	Q	27.9	Very low	29.2	Very low	184 Å²	184	136.5 Å²	136.5	86%	0.86	76%	0.764	S	S	*	*			trans	38.9	102.1	141.9	-62.8	-176.6	-18.7	0	0	120.2
57	S	26	Very low	29.7	Very low	109 Å²	109	139.2 Å²	139.2	76%	0.762	77%	0.772	S	S	*	*				149.2	144.5	87.7	60	0	0	0	0	115.7
58	L	29.6	Very low	29.3	Very low	161 Å²	161	136.3 Å²	136.3	84%	0.843	76%	0.763	S	S	*	*			trans	32.7	102.5	150.8	-69.3	165.4	0	0	0	119.6
59	Q	28	Very low	30.1	Very low	195 Å²	195	135.7 Å²	135.7	91%	0.911	76%	0.761	S	S	*	*				-166.8	111.5	106.1	-103.4	166.9	17.5	0	0	111.5
60	Q	29.1	Very low	31.3	Very low	179 Å²	179	134.3 Å²	134.3	84%	0.836	75%	0.745	S	S	*	*			trans	-77.9	124.8	166.6	-172.9	172.5	5.4	0	0	108.2	S62	Q60-S62 PolarHBondContact O-N 3.49Å; Q60-S62 VanDerWaalsContact O-N 3.17Å
61	A	25.5	Very low	32.7	Very low	94 Å²	94	132.7 Å²	132.7	78%	0.777	74%	0.741	S	S	*	*			trans	-62.9	117	-174.1	0	0	0	0	0	111.3	I63	A61-I63 PolarHBondContact O-N 3.15Å
62	S	25.6	Very low	34.5	Very low	96 Å²	96	127.9 Å²	127.9	67%	0.671	72%	0.715	S	S	*	*			trans	-84.3	110.1	-179.9	8.5	0	0	0	0	109.8	Q60 F64	Q60-S62 PolarHBondContact O-N 3.49Å; Q60-S62 VanDerWaalsContact O-N 3.17Å; S62-F64 PolarHBondContact O-N 3.45Å
63	I	33.1	Very low	36.5	Very low	138 Å²	138	124.1 Å²	124.1	71%	0.708	70%	0.701	S	S	*	*			trans	-69.9	113.7	170.4	-60.2	177.3	0	0	0	107.7	A61 F65	A61-I63 PolarHBondContact O-N 3.15Å; I63-F65 HydrophobicContact CG2-CE2 4.3Å; I63-F65 HydrophobicContact CG2-CZ 4.28Å; I63-F65 WeakPolarHBondContact O-CD2 3.49Å; I63-F65 PolarHBondContact O-N 3.07Å
64	F	27.6	Very low	38.5	Very low	193 Å²	193	125.9 Å²	125.9	85%	0.846	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-75	116.4	-178.9	-97.3	-103	0	0	0	111	S62	S62-F64 PolarHBondContact O-N 3.45Å
65	F	38.6	Very low	40.7	Very low	119 Å²	119	124.2 Å²	124.2	52%	0.522	68%	0.684	S	S	.	*	P	Polyproline II helix	trans	-94.8	141.9	167.6	-65.4	-82.4	0	0	0	110.8	I63 L88	I63-F65 HydrophobicContact CG2-CE2 4.3Å; I63-F65 HydrophobicContact CG2-CZ 4.28Å; I63-F65 WeakPolarHBondContact O-CD2 3.49Å; I63-F65 PolarHBondContact O-N 3.07Å; F65-L88 HydrophobicContact CE1-CD2 4.27Å; F65-L88 HydrophobicContact CZ-CD2 4.36Å
66	P	33.8	Very low	42.8	Very low	125 Å²	125	119.3 Å²	119.3	81%	0.812	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-68.6	133.3	178.7	28.1	-34	0	0	0	111.4	G68	P66-G68 PolarHBondContact O-N 3.22Å; P66-G68 VanDerWaalsContact O-N 3.12Å
67	Q	41.6	Very low	45.2	Very low	204 Å²	204	113.5 Å²	113.5	95%	0.953	62%	0.624	S	S	*	*			trans	-74	103.5	-175.4	-71.8	-179.8	-25.6	0	0	112.2
68	G	33.8	Very low	47.7	Very low	57 Å²	57	109.9 Å²	109.9	59%	0.588	60%	0.596	S	S	*	*			trans	-129.4	67.7	174.7	0	0	0	0	0	112.9	P66 L70	P66-G68 PolarHBondContact O-N 3.22Å; P66-G68 VanDerWaalsContact O-N 3.12Å; G68-L70 PolarHBondContact O-N 2.85Å
69	N	42.9	Very low	49.9	Very low	150 Å²	150	107.5 Å²	107.5	80%	0.802	58%	0.576	S	S	*	*			trans	45.1	49.8	167.4	-67	-23.6	0	0	0	117.1
70	L	53	Low	52	Low	67 Å²	67	105.6 Å²	105.6	35%	0.351	57%	0.567	S	S	.	*			trans	-102.2	96.2	166.8	-65.9	177.9	0	0	0	110.5	G68 I72	G68-L70 PolarHBondContact O-N 2.85Å; L70-I72 HydrophobicContact CB-CG1 4.27Å; L70-I72 PolarHBondContact O-N 2.79Å
71	T	54.3	Low	54.2	Low	114 Å²	114	97.9 Å²	97.9	70%	0.699	53%	0.532	S	S	*	.			trans	-78.9	74.9	170	44.1	0	0	0	0	110.7
72	I	63.1	Low	56.1	Low	44 Å²	44	97.1 Å²	97.1	23%	0.226	53%	0.526	C	S	.	.			trans	-70.5	132.8	166.7	-50.3	-175.3	0	0	0	107.9	L70 F76 L78 W143	L70-I72 HydrophobicContact CB-CG1 4.27Å; L70-I72 PolarHBondContact O-N 2.79Å; I72-F76 HydrophobicContact CG2-CB 3.93Å; I72-L78 HydrophobicContact CD1-CB 3.73Å; I72-L78 HydrophobicContact CD1-CD1 4.45Å; I72-L78 HydrophobicContact CD1-CD2 4.31Å; I72-L78 HydrophobicContact CD1-CG 4.4Å; I72-W143 HydrophobicContact CB-CB 4.39Å; I72-W143 HydrophobicContact CG1-CB 3.92Å
73	P	69.9	Low	58.1	Low	47 Å²	47	93.6 Å²	93.6	31%	0.305	50%	0.501	S	S	.	.			trans	-64.6	144.2	176.2	-14.8	27.3	0	0	0	110.8	D75 F76 W143	P73-D75 PolarHBondContact O-N 3.47Å; P73-F76 HydrophobicContact CB-CD2 4.01Å; P73-F76 HydrophobicContact CG-CD2 4.06Å; P73-F76 PolarHBondContact O-N 3.43Å; P73-W143 HydrophobicContact CG-CD2 4.23Å; P73-W143 HydrophobicContact CG-CH2 4.41Å; P73-W143 HydrophobicContact CG-CZ2 3.8Å
74	L	64.9	Low	58.8	Low	153 Å²	153	92.7 Å²	92.7	80%	0.801	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-18.5	-175.3	-67.8	167.4	0	0	0	115	F76 R93	L74-F76 VanDerWaalsContact C-N 3.3Å; L74-R93 PolarHBondContact O-NH1 3.46Å
75	D	71.3	Confident	60.1	Low	64 Å²	64	87.9 Å²	87.9	34%	0.342	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-2	177.2	-64.8	-37.6	0	0	0	114.1	P73 R93 R94	P73-D75 PolarHBondContact O-N 3.47Å; D75-R93 WeakPolarHBondContact O-CA 3.41Å; D75-R93 VanDerWaalsContact O-CB 3.27Å; D75-R93 WeakPolarHBondContact O-CB 3.42Å; D75-R93 PolarHBondContact O-N 3.43Å; D75-R94 HydrophobicContact CB-CB 4.49Å; D75-R94 HydrophobicContact CB-CG 4.01Å; D75-R94 IonicContact OD2-CZ 2.63Å; D75-R94 IonicContact OD2-NH1 3.37Å; D75-R94 PolarHBondContact OD2-NH1 2.67Å
76	F	78.3	Confident	61.3	Low	12 Å²	12	83.3 Å²	83.3	5%	0.053	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	153.8	-179.8	-59.1	-78.3	0	0	0	111.1	I72 P73 L74 I90 W91 R93 V96 F102 W143 L181	I72-F76 HydrophobicContact CG2-CB 3.93Å; P73-F76 HydrophobicContact CB-CD2 4.01Å; P73-F76 HydrophobicContact CG-CD2 4.06Å; P73-F76 PolarHBondContact O-N 3.43Å; L74-F76 VanDerWaalsContact C-N 3.3Å; F76-I90 HydrophobicContact CB-CG2 3.8Å; F76-I90 HydrophobicContact CD1-CG2 4.13Å; F76-I90 HydrophobicContact CG-CG2 4.23Å; F76-W91 CarbonylContact C-O 3.36Å; F76-W91 WeakPolarHBondContact CA-O 3.32Å; F76-R93 VanDerWaalsContact C-CD 3.46Å; F76-R93 WeakPolarHBondContact O-CD 3.32Å; F76-V96 HydrophobicContact CE1-CG2 4.17Å; F76-V96 HydrophobicContact CZ-CG2 4.18Å; F76-F102 HydrophobicContact CE1-CZ 4.24Å; F76-F102 AromaticContact CE2-CE1 3.96Å; F76-F102 HydrophobicContact CE2-CE1 3.96Å; F76-F102 HydrophobicContact CE2-CZ 4.35Å; F76-F102 AromaticContact CZ-CE1 3.6Å; F76-F102 HydrophobicContact CZ-CE1 3.6Å; F76-F102 HydrophobicContact CZ-CE2 4.47Å; F76-F102 AromaticContact CZ-CZ 3.54Å; F76-F102 HydrophobicContact CZ-CZ 3.54Å; F76-W143 HydrophobicContact CD2-CH2 4.06Å; F76-W143 HydrophobicContact CD2-CZ3 4.1Å; F76-W143 HydrophobicContact CE2-CH2 4.09Å; F76-W143 HydrophobicContact CG-CZ3 4.17Å; F76-L181 HydrophobicContact CD1-CD1 4Å; F76-L181 HydrophobicContact CD1-CD2 3.94Å; F76-L181 HydrophobicContact CE1-CD1 3.98Å; F76-L181 HydrophobicContact CE1-CD2 3.81Å
77	E	80.1	Confident	62.7	Low	62 Å²	62	81.8 Å²	81.8	29%	0.29	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	142.9	-179.5	-142.4	170.8	107.5	0	0	110.1	R79 I90 W91 R93	E77-R79 IonicContact OE1-CZ 3.86Å; E77-R79 IonicContact OE1-NE 3.87Å; E77-R79 PolarHBondContact OE1-NE 3.18Å; E77-R79 IonicContact OE1-NH2 2.82Å; E77-R79 PolarHBondContact OE1-NH2 3.41Å; E77-R79 IonicContact OE2-NH2 3.48Å; E77-I90 CarbonylContact O-C 3.29Å; E77-I90 WeakPolarHBondContact O-CA 3.17Å; E77-W91 PolarHBondContact N-O 3.24Å; E77-W91 PolarHBondContact O-N 3.24Å; E77-R93 HydrophobicContact CB-CG 3.95Å; E77-R93 IonicContact OE2-CZ 3.21Å; E77-R93 IonicContact OE2-NE 2.72Å; E77-R93 PolarHBondContact OE2-NE 3.17Å; E77-R93 IonicContact OE2-NH2 2.8Å
78	L	77.4	Confident	64.3	Low	34 Å²	34	74 Å²	74	18%	0.178	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	125.8	171.2	-163.6	71.3	0	0	0	108.7	I72 L88 I90 H146	I72-L78 HydrophobicContact CD1-CB 3.73Å; I72-L78 HydrophobicContact CD1-CD1 4.45Å; I72-L78 HydrophobicContact CD1-CD2 4.31Å; I72-L78 HydrophobicContact CD1-CG 4.4Å; L78-L88 HydrophobicContact CD1-CB 4.23Å; L78-L88 HydrophobicContact CD2-CB 4.41Å; L78-L88 HydrophobicContact CD2-CD1 4.02Å; L78-L88 HydrophobicContact CG-CB 4.26Å; L78-L88 HydrophobicContact CG-CD2 4.42Å; L78-I90 HydrophobicContact CD1-CG1 3.9Å; L78-H146 HydrophobicContact CD1-CB 3.55Å
79	R	75.9	Confident	66.5	Low	111 Å²	111	71.3 Å²	71.3	42%	0.419	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	173.4	176.6	-60.9	-175.6	172.5	-178.3	-0.1	109.5	E77 L88 G89 W91	E77-R79 IonicContact OE1-CZ 3.86Å; E77-R79 IonicContact OE1-NE 3.87Å; E77-R79 PolarHBondContact OE1-NE 3.18Å; E77-R79 IonicContact OE1-NH2 2.82Å; E77-R79 PolarHBondContact OE1-NH2 3.41Å; E77-R79 IonicContact OE2-NH2 3.48Å; R79-L88 CarbonylContact O-C 3.12Å; R79-L88 WeakPolarHBondContact O-CA 2.93Å; R79-G89 PolarHBondContact N-O 2.8Å; R79-G89 PolarHBondContact O-N 3.01Å; R79-G89 VanDerWaalsContact O-O 3.13Å; R79-W91 HydrophobicContact CB-CG 4.48Å
80	E	72.8	Confident	68.4	Low	155 Å²	155	64.1 Å²	64.1	72%	0.724	38%	0.384	S	S	*	.			trans	-58.2	141.4	164.8	-163.9	160.1	-154.3	0	0	109.3	W91	E80-W91 PolarHBondContact O-NE1 3.37Å
81	S	75.1	Confident	69.8	Low	16 Å²	16	63.6 Å²	63.6	11%	0.112	38%	0.377	C	S	.	.			trans	-84	149.8	-176	-177.8	0	0	0	0	111	V83 E180	S81-V83 PolarHBondContact O-N 3.01Å; S81-V83 WeakPolarHBondContact OG-CB 3.26Å; S81-V83 WeakPolarHBondContact OG-CG2 3.34Å; S81-V83 PolarHBondContact OG-N 3.28Å; S81-E180 WeakPolarHBondContact CB-OE1 3.34Å; S81-E180 PolarHBondContact OG-OE1 2.84Å; S81-E180 PolarHBondContact OG-OE2 3.07Å
82	A	64.8	Low	71.2	Confident	79 Å²	79	58.2 Å²	58.2	65%	0.653	34%	0.344	S	S	*	.	S	Bend	trans	-78.2	-6.1	168.3	0	0	0	0	0	113.2	W91 E180	A82-W91 HydrophobicContact CB-CZ2 4.47Å; A82-E180 PolarHBondContact N-OE2 2.9Å
83	V	67.1	Low	71.9	Confident	22 Å²	22	62.7 Å²	62.7	13%	0.133	36%	0.358	C	S	.	.	S	Bend	trans	-85.9	124.9	-175.6	-175.9	0	0	0	0	111.1	S81 G85 A86 Q148 L182	S81-V83 PolarHBondContact O-N 3.01Å; S81-V83 WeakPolarHBondContact OG-CB 3.26Å; S81-V83 WeakPolarHBondContact OG-CG2 3.34Å; S81-V83 PolarHBondContact OG-N 3.28Å; V83-G85 PolarHBondContact O-N 3.24Å; V83-A86 HydrophobicContact CB-CB 4.13Å; V83-A86 PolarHBondContact O-N 3.32Å; V83-A86 VanDerWaalsContact O-N 3.08Å; V83-Q148 HydrophobicContact CG2-CB 4.18Å; V83-L182 HydrophobicContact CG2-CD2 3.88Å
84	P	48.1	Very low	72.4	Confident	118 Å²	118	64.7 Å²	64.7	77%	0.766	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	124.3	179.8	-26.9	35.4	0	0	0	113.1
85	G	55.7	Low	73.1	Confident	93 Å²	93	61.9 Å²	61.9	96%	0.959	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.8	-6.7	-179.7	0	0	0	0	0	115.4	V83	V83-G85 PolarHBondContact O-N 3.24Å
86	A	64.1	Low	73.5	Confident	23 Å²	23	58.8 Å²	58.8	19%	0.19	33%	0.325	C	S	.	.			trans	-93	133.9	173.4	0	0	0	0	0	111.5	V83 Q148	V83-A86 HydrophobicContact CB-CB 4.13Å; V83-A86 PolarHBondContact O-N 3.32Å; V83-A86 VanDerWaalsContact O-N 3.08Å; A86-Q148 HydrophobicContact CB-CG 4.18Å
87	S	61.7	Low	73.6	Confident	92 Å²	92	62.1 Å²	62.1	64%	0.643	34%	0.343	S	S	*	.	S	Bend	trans	-89.8	-31.8	-177.2	56.2	0	0	0	0	114.7
88	L	76	Confident	73.4	Confident	41 Å²	41	64.9 Å²	64.9	22%	0.215	36%	0.358	C	S	.	.			trans	-146.2	127.7	-176.3	-68.7	171.9	0	0	0	111	F65 L78 R79 Q148	F65-L88 HydrophobicContact CE1-CD2 4.27Å; F65-L88 HydrophobicContact CZ-CD2 4.36Å; L78-L88 HydrophobicContact CD1-CB 4.23Å; L78-L88 HydrophobicContact CD2-CB 4.41Å; L78-L88 HydrophobicContact CD2-CD1 4.02Å; L78-L88 HydrophobicContact CG-CB 4.26Å; L78-L88 HydrophobicContact CG-CD2 4.42Å; R79-L88 CarbonylContact O-C 3.12Å; R79-L88 WeakPolarHBondContact O-CA 2.93Å; L88-Q148 PolarHBondContact O-NE2 2.96Å
89	G	79.9	Confident	72.9	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	157.2	179	0	0	0	0	0	112.7	R79 H146 E180	R79-G89 PolarHBondContact N-O 2.8Å; R79-G89 PolarHBondContact O-N 3.01Å; R79-G89 VanDerWaalsContact O-O 3.13Å; G89-H146 WeakPolarHBondContact CA-O 3.24Å; G89-E180 WeakPolarHBondContact CA-OE1 3.34Å
90	I	83.3	Confident	72.9	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	128.6	-179.7	-64.9	164.4	0	0	0	110.8	F76 E77 L78 W143 H146 I147 E180 L181	F76-I90 HydrophobicContact CB-CG2 3.8Å; F76-I90 HydrophobicContact CD1-CG2 4.13Å; F76-I90 HydrophobicContact CG-CG2 4.23Å; E77-I90 CarbonylContact O-C 3.29Å; E77-I90 WeakPolarHBondContact O-CA 3.17Å; L78-I90 HydrophobicContact CD1-CG1 3.9Å; I90-W143 HydrophobicContact CD1-CE3 3.54Å; I90-W143 HydrophobicContact CD1-CZ3 4.07Å; I90-W143 WeakPolarHBondContact CD1-O 3.38Å; I90-W143 HydrophobicContact CG2-CE3 4.39Å; I90-W143 HydrophobicContact CG2-CZ3 4.2Å; I90-H146 HydrophobicContact CD1-CB 3.67Å; I90-H146 HydrophobicContact CG1-CB 3.69Å; I90-H146 PolarHBondContact N-O 3.24Å; I90-I147 HydrophobicContact CD1-CG1 3.85Å; I90-E180 CarbonylContact O-C 3.5Å; I90-E180 WeakPolarHBondContact O-CA 3.33Å; I90-E180 WeakPolarHBondContact O-CG 3.4Å; I90-L181 HydrophobicContact CG2-CD2 4.12Å; I90-L181 PolarHBondContact O-N 3.37Å
91	W	82.8	Confident	73	Confident	55 Å²	55	61.3 Å²	61.3	21%	0.208	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	138.5	-179.8	-64.9	70.1	0	0	0	110.9	F76 E77 R79 E80 A82 G178 E179 E180	F76-W91 CarbonylContact C-O 3.36Å; F76-W91 WeakPolarHBondContact CA-O 3.32Å; E77-W91 PolarHBondContact N-O 3.24Å; E77-W91 PolarHBondContact O-N 3.24Å; R79-W91 HydrophobicContact CB-CG 4.48Å; E80-W91 PolarHBondContact O-NE1 3.37Å; A82-W91 HydrophobicContact CB-CZ2 4.47Å; W91-G178 VanDerWaalsContact CE3-O 3.26Å; W91-G178 VanDerWaalsContact CZ3-O 3.23Å; W91-G178 WeakPolarHBondContact CZ3-O 3.33Å; W91-E179 CarbonylContact C-O 3.58Å; W91-E179 WeakPolarHBondContact CA-O 3.46Å; W91-E180 HydrophobicContact CD2-CB 3.9Å; W91-E180 HydrophobicContact CD2-CG 4.32Å; W91-E180 HydrophobicContact CE3-CB 4.17Å; W91-E180 HydrophobicContact CG-CB 4.43Å; W91-E180 HydrophobicContact CH2-CB 4.19Å; W91-E180 HydrophobicContact CZ2-CB 3.92Å; W91-E180 HydrophobicContact CZ2-CG 4.29Å; W91-E180 WeakPolarHBondContact CZ2-OE2 3.46Å; W91-E180 HydrophobicContact CZ3-CB 4.31Å
92	S	83.3	Confident	72.9	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.014	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	135.2	176.8	-164.7	0	0	0	0	111.5	R94 V96 P177 G178 E179	S92-R94 PolarHBondContact OG-N 3.35Å; S92-R94 PolarHBondContact OG-O 3.21Å; S92-V96 WeakPolarHBondContact OG-CG2 3.36Å; S92-P177 CarbonylContact O-C 3.56Å; S92-P177 WeakPolarHBondContact O-CA 3.31Å; S92-G178 PolarHBondContact O-N 3.24Å; S92-E179 PolarHBondContact N-O 3.45Å
93	R	78.1	Confident	72.7	Confident	138 Å²	138	59.4 Å²	59.4	52%	0.521	33%	0.331	S	S	.	.	S	Bend	trans	-102.1	-9.8	172	-49	174.2	81.4	-123.2	-2.6	111.8	L74 D75 F76 E77	L74-R93 PolarHBondContact O-NH1 3.46Å; D75-R93 WeakPolarHBondContact O-CA 3.41Å; D75-R93 VanDerWaalsContact O-CB 3.27Å; D75-R93 WeakPolarHBondContact O-CB 3.42Å; D75-R93 PolarHBondContact O-N 3.43Å; F76-R93 VanDerWaalsContact C-CD 3.46Å; F76-R93 WeakPolarHBondContact O-CD 3.32Å; E77-R93 HydrophobicContact CB-CG 3.95Å; E77-R93 IonicContact OE2-CZ 3.21Å; E77-R93 IonicContact OE2-NE 2.72Å; E77-R93 PolarHBondContact OE2-NE 3.17Å; E77-R93 IonicContact OE2-NH2 2.8Å
94	R	79.8	Confident	72.4	Confident	88 Å²	88	60.2 Å²	60.2	33%	0.332	34%	0.337	S	S	.	.	S	Bend	trans	-120.3	169.7	175.3	76.7	172.5	-164.2	-150.8	9.4	112	D75 S92 V96 E100	D75-R94 HydrophobicContact CB-CB 4.49Å; D75-R94 HydrophobicContact CB-CG 4.01Å; D75-R94 IonicContact OD2-CZ 2.63Å; D75-R94 IonicContact OD2-NH1 3.37Å; D75-R94 PolarHBondContact OD2-NH1 2.67Å; S92-R94 PolarHBondContact OG-N 3.35Å; S92-R94 PolarHBondContact OG-O 3.21Å; R94-V96 HydrophobicContact CG-CG2 4.02Å; R94-E100 IonicContact CZ-OE2 3.51Å; R94-E100 IonicContact NH2-OE2 2.73Å; R94-E100 PolarHBondContact NH2-OE2 3.26Å
95	K	79.8	Confident	72.9	Confident	94 Å²	94	56 Å²	56	41%	0.409	31%	0.306	S	S	.	.			trans	-75.9	130.1	164.1	-151.3	-169.1	-161	-150.4	0	109	E174 I175 F176	K95-E174 HydrophobicContact CD-CG 4.36Å; K95-E174 VanDerWaalsContact CE-OE1 3.25Å; K95-E174 WeakPolarHBondContact CE-OE1 3.43Å; K95-E174 WeakPolarHBondContact CE-OE2 3.34Å; K95-E174 HydrophobicContact CG-CG 4.24Å; K95-E174 IonicContact NZ-OE1 3.17Å; K95-E174 PolarHBondContact NZ-OE1 3.49Å; K95-E174 IonicContact NZ-OE2 2.79Å; K95-E174 PolarHBondContact NZ-OE2 2.67Å; K95-I175 CarbonylContact C-O 3.57Å; K95-I175 WeakPolarHBondContact CA-O 3.42Å; K95-F176 HydrophobicContact CG-CD1 4.45Å
96	V	80.3	Confident	72.7	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-116.8	122.9	178.9	-176.2	0	0	0	0	108.8	F76 S92 R94 E100 F102 V171 E174 I175	F76-V96 HydrophobicContact CE1-CG2 4.17Å; F76-V96 HydrophobicContact CZ-CG2 4.18Å; S92-V96 WeakPolarHBondContact OG-CG2 3.36Å; R94-V96 HydrophobicContact CG-CG2 4.02Å; V96-E100 HydrophobicContact CG1-CB 3.96Å; V96-E100 HydrophobicContact CG1-CG 4.39Å; V96-F102 HydrophobicContact CG1-CE2 4.12Å; V96-F102 HydrophobicContact CG1-CZ 3.66Å; V96-F102 HydrophobicContact CG2-CZ 4.37Å; V96-V171 HydrophobicContact CG1-CB 4.43Å; V96-V171 HydrophobicContact CG1-CG1 4.18Å; V96-V171 HydrophobicContact CG1-CG2 3.6Å; V96-E174 WeakPolarHBondContact O-CA 3.07Å; V96-I175 HydrophobicContact CB-CB 4.04Å; V96-I175 HydrophobicContact CB-CD1 4.47Å; V96-I175 HydrophobicContact CB-CG1 4.34Å; V96-I175 HydrophobicContact CG2-CB 4.45Å; V96-I175 PolarHBondContact N-O 2.98Å; V96-I175 PolarHBondContact O-N 3.5Å
97	N	79.1	Confident	72.3	Confident	82 Å²	82	57.7 Å²	57.7	44%	0.439	29%	0.291	S	S	.	.			trans	-82.5	150.8	-171.6	-56.3	-93.1	0	0	0	111.8	G99 E100 V171	N97-G99 PolarHBondContact O-N 3.37Å; N97-E100 HydrophobicContact CB-CG 4.38Å; N97-E100 WeakPolarHBondContact CB-OE1 3.38Å; N97-E100 PolarHBondContact N-OE1 3.37Å; N97-E100 PolarHBondContact ND2-OE1 3.37Å; N97-E100 WeakPolarHBondContact O-CB 3.4Å; N97-E100 PolarHBondContact O-N 3.35Å; N97-E100 VanDerWaalsContact O-N 3.12Å; N97-V171 WeakPolarHBondContact O-CG1 3.17Å
98	I	76	Confident	71.6	Confident	119 Å²	119	61.4 Å²	61.4	61%	0.61	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	123.8	176	-60.3	174.6	0	0	0	109.9	E174	I98-E174 HydrophobicContact CG1-CB 4.16Å; I98-E174 VanDerWaalsContact CG1-N 3.31Å
99	G	67.5	Low	70.4	Confident	26 Å²	26	63.8 Å²	63.8	27%	0.268	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.9	-1.9	179.2	0	0	0	0	0	116.3	N97 V171	N97-G99 PolarHBondContact O-N 3.37Å; G99-V171 PolarHBondContact N-O 2.81Å
100	E	76.6	Confident	68.7	Low	45 Å²	45	65.3 Å²	65.3	21%	0.21	32%	0.32	C	S	.	.			trans	-56.2	153.3	160	-75.8	-178.2	-131.6	0	0	110.4	R94 V96 N97 K170 V171	R94-E100 IonicContact CZ-OE2 3.51Å; R94-E100 IonicContact NH2-OE2 2.73Å; R94-E100 PolarHBondContact NH2-OE2 3.26Å; V96-E100 HydrophobicContact CG1-CB 3.96Å; V96-E100 HydrophobicContact CG1-CG 4.39Å; N97-E100 HydrophobicContact CB-CG 4.38Å; N97-E100 WeakPolarHBondContact CB-OE1 3.38Å; N97-E100 PolarHBondContact N-OE1 3.37Å; N97-E100 PolarHBondContact ND2-OE1 3.37Å; N97-E100 WeakPolarHBondContact O-CB 3.4Å; N97-E100 PolarHBondContact O-N 3.35Å; N97-E100 VanDerWaalsContact O-N 3.12Å; E100-K170 WeakPolarHBondContact O-CA 3.43Å; E100-V171 HydrophobicContact CB-CB 4.47Å; E100-V171 HydrophobicContact CB-CG2 4.04Å; E100-V171 WeakPolarHBondContact O-CG2 3.49Å; E100-V171 PolarHBondContact O-N 3.24Å
101	R	73.8	Confident	66.6	Low	155 Å²	155	71.4 Å²	71.4	59%	0.585	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.9	133	-173.5	-52.2	-178.9	-157.8	167.8	5.2	110.3	I163 Y169	R101-I163 VanDerWaalsContact NH1-CD1 3.28Å; R101-Y169 CarbonylContact C-O 3.59Å; R101-Y169 WeakPolarHBondContact CA-O 3.43Å
102	F	73.3	Confident	64.7	Low	18 Å²	18	73.4 Å²	73.4	8%	0.079	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	129.1	173.1	-52.7	-64.1	0	0	0	109.5	F76 V96 W143 L144 L158 F168 Y169 V171 L181	F76-F102 HydrophobicContact CE1-CZ 4.24Å; F76-F102 AromaticContact CE2-CE1 3.96Å; F76-F102 HydrophobicContact CE2-CE1 3.96Å; F76-F102 HydrophobicContact CE2-CZ 4.35Å; F76-F102 AromaticContact CZ-CE1 3.6Å; F76-F102 HydrophobicContact CZ-CE1 3.6Å; F76-F102 HydrophobicContact CZ-CE2 4.47Å; F76-F102 AromaticContact CZ-CZ 3.54Å; F76-F102 HydrophobicContact CZ-CZ 3.54Å; V96-F102 HydrophobicContact CG1-CE2 4.12Å; V96-F102 HydrophobicContact CG1-CZ 3.66Å; V96-F102 HydrophobicContact CG2-CZ 4.37Å; F102-W143 HydrophobicContact CB-CH2 4.28Å; F102-W143 HydrophobicContact CB-CZ2 4.33Å; F102-W143 AromaticContact CD1-CH2 3.99Å; F102-W143 HydrophobicContact CD1-CH2 3.99Å; F102-W143 HydrophobicContact CD1-CZ2 4.25Å; F102-W143 HydrophobicContact CG-CH2 4.1Å; F102-W143 HydrophobicContact CG-CZ2 4.49Å; F102-L144 HydrophobicContact CB-CD2 3.94Å; F102-L158 HydrophobicContact CD2-CD2 4.07Å; F102-L158 HydrophobicContact CE2-CD2 4.04Å; F102-F168 CarbonylContact O-C 3.56Å; F102-F168 WeakPolarHBondContact O-CA 3.44Å; F102-Y169 PolarHBondContact N-O 2.8Å; F102-Y169 PolarHBondContact O-N 2.72Å; F102-V171 HydrophobicContact CD2-CG2 4.22Å; F102-V171 HydrophobicContact CE2-CG2 3.53Å; F102-V171 HydrophobicContact CZ-CG2 4.22Å; F102-L181 HydrophobicContact CE2-CD2 4.36Å
103	G	61.3	Low	62.7	Low	36 Å²	36	75.8 Å²	75.8	37%	0.371	39%	0.394	S	S	.	.			trans	151.1	-177.3	-176.5	0	0	0	0	0	112.4	F168	G103-F168 VanDerWaalsContact C-CE1 3.48Å
104	P	59.7	Low	61	Low	39 Å²	39	78.8 Å²	78.8	25%	0.253	41%	0.414	S	S	.	.			cis	-70.2	156.8	7.1	30.1	-37.6	0	0	0	114.1	Q166 I167 F168	P104-Q166 HydrophobicContact CB-CB 3.89Å; P104-Q166 HydrophobicContact CB-CG 4.06Å; P104-I167 CarbonylContact C-O 3.59Å; P104-I167 WeakPolarHBondContact CA-O 3.49Å; P104-F168 HydrophobicContact CB-CE1 4.24Å; P104-F168 HydrophobicContact CB-CZ 4.06Å
105	Y	59.7	Low	58.8	Low	30 Å²	30	78.3 Å²	78.3	12%	0.118	42%	0.418	C	S	.	.			trans	-76.4	126.5	161.4	176.9	-97	0	0	0	109	L133 I167 Y169	Y105-L133 HydrophobicContact CE1-CD1 4.28Å; Y105-I167 PolarHBondContact N-O 2.81Å; Y105-Y169 HydrophobicContact CD2-CE2 4.21Å; Y105-Y169 WeakPolarHBondContact CD2-OH 3.45Å
106	E	51.7	Low	56.9	Low	129 Å²	129	79.4 Å²	79.4	60%	0.603	44%	0.435	S	S	*	.			trans	-108	103.8	178.2	-65.5	-175.9	151.7	0	0	108.9
107	G	55.6	Low	54.8	Low	22 Å²	22	86.8 Å²	86.8	23%	0.227	47%	0.471	C	S	.	.	S	Bend	trans	-165	162.7	178.6	0	0	0	0	0	110.4	H109	G107-H109 PolarHBondContact O-CD2 3.48Å; G107-H109 PolarHBondContact O-N 2.73Å
108	E	45.8	Very low	52.8	Low	171 Å²	171	88.6 Å²	88.6	80%	0.799	48%	0.477	S	S	*	.			trans	-70	119.2	-173.2	-64.8	-167.4	142.9	0	0	112.3	A110	E108-A110 PolarHBondContact O-N 3.15Å
109	H	50.1	Low	50.9	Low	90 Å²	90	83.6 Å²	83.6	42%	0.417	46%	0.455	S	S	.	.			trans	-79.2	94	175.2	-77.1	-116.3	0	0	0	110.5	G107 P111	G107-H109 PolarHBondContact O-CD2 3.48Å; G107-H109 PolarHBondContact O-N 2.73Å; H109-P111 WeakPolarHBondContact O-CD 3.45Å
110	A	46	Very low	50.2	Low	32 Å²	32	88 Å²	88	26%	0.264	46%	0.463	S	S	.	.			trans	-90.8	112.4	175.7	0	0	0	0	0	111.5	E108 C112 L113	E108-A110 PolarHBondContact O-N 3.15Å; A110-C112 PolarHBondContact O-N 3.43Å; A110-C112 VanDerWaalsContact O-N 3.17Å; A110-L113 HydrophobicContact CB-CD2 4.32Å; A110-L113 HydrophobicContact CB-CG 4.47Å
111	P	39.2	Very low	48.7	Very low	128 Å²	128	90.7 Å²	90.7	83%	0.831	48%	0.476	S	S	*	.	S	Bend	trans	-75.1	-1	-177	30.6	-36.3	0	0	0	114.7	H109	H109-P111 WeakPolarHBondContact O-CD 3.45Å
112	C	42.8	Very low	47.8	Very low	98 Å²	98	85 Å²	85	66%	0.662	46%	0.456	S	S	*	.			trans	-161.7	117	170	-177.6	0	0	0	0	109.2	A110	A110-C112 PolarHBondContact O-N 3.43Å; A110-C112 VanDerWaalsContact O-N 3.17Å
113	L	40.8	Very low	46.7	Very low	52 Å²	52	86.2 Å²	86.2	27%	0.272	46%	0.464	S	S	.	.			trans	-91.2	138.7	163.4	-72.4	168.9	0	0	0	108.4	A110 D115 C132 D134	A110-L113 HydrophobicContact CB-CD2 4.32Å; A110-L113 HydrophobicContact CB-CG 4.47Å; L113-D115 VanDerWaalsContact C-N 3.32Å; L113-C132 HydrophobicContact CD1-CB 4.26Å; L113-D134 HydrophobicContact CD1-CB 4.24Å; L113-D134 HydrophobicContact CD2-CB 4.32Å
114	Q	42.1	Very low	46	Very low	200 Å²	200	87 Å²	87	94%	0.935	46%	0.459	S	S	*	.	S	Bend	trans	-84.6	-3.4	-179.3	-75.2	-167.2	-58.1	0	0	114.2
115	D	32.6	Very low	45.1	Very low	79 Å²	79	88.9 Å²	88.9	42%	0.422	49%	0.485	S	S	.	.			trans	-136.3	118	178.1	-166.8	-22.4	0	0	0	110	L113 M117	L113-D115 VanDerWaalsContact C-N 3.32Å; D115-M117 PolarHBondContact O-N 3.12Å; D115-M117 VanDerWaalsContact OD1-CB 3.23Å; D115-M117 WeakPolarHBondContact OD1-CB 3.47Å; D115-M117 VanDerWaalsContact OD1-CG 3.29Å; D115-M117 WeakPolarHBondContact OD1-CG 3.25Å; D115-M117 PolarHBondContact OD1-N 3.09Å
116	P	40	Very low	44.2	Very low	117 Å²	117	91.7 Å²	91.7	76%	0.76	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-64.2	-20.9	174.6	-21.8	34.1	0	0	0	114.1	Q118	P116-Q118 PolarHBondContact O-N 3.39Å; P116-Q118 VanDerWaalsContact O-N 3.14Å
117	M	37.8	Very low	43.8	Very low	154 Å²	154	87.1 Å²	87.1	76%	0.759	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-73.2	-4.7	-170.6	-61.2	-65.2	-69.1	0	0	114.5	D115	D115-M117 PolarHBondContact O-N 3.12Å; D115-M117 VanDerWaalsContact OD1-CB 3.23Å; D115-M117 WeakPolarHBondContact OD1-CB 3.47Å; D115-M117 VanDerWaalsContact OD1-CG 3.29Å; D115-M117 WeakPolarHBondContact OD1-CG 3.25Å; D115-M117 PolarHBondContact OD1-N 3.09Å
118	Q	37	Very low	42.8	Very low	121 Å²	121	92.5 Å²	92.5	57%	0.565	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-132.9	9.2	-179.3	-98.1	99.5	93.7	0	0	114.5	P116 A135	P116-Q118 PolarHBondContact O-N 3.39Å; P116-Q118 VanDerWaalsContact O-N 3.14Å; Q118-A135 VanDerWaalsContact O-CB 3.27Å; Q118-A135 WeakPolarHBondContact O-CB 3.37Å; Q118-A135 PolarHBondContact O-N 3.4Å; Q118-A135 VanDerWaalsContact O-N 3.1Å
119	G	34.8	Very low	42.8	Very low	14 Å²	14	87.8 Å²	87.8	14%	0.144	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	145.5	-178.3	0	0	0	0	0	114.1	L133	G119-L133 CarbonylContact C-O 3.45Å; G119-L133 WeakPolarHBondContact CA-O 3.44Å
120	W	53.8	Low	42.9	Very low	118 Å²	118	88.8 Å²	88.8	45%	0.447	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	135.7	177.9	-52.9	126.2	0	0	0	112	C132 L133 A135 F149 M185	W120-C132 CarbonylContact O-C 3.4Å; W120-C132 WeakPolarHBondContact O-CA 3.41Å; W120-L133 PolarHBondContact N-O 3.07Å; W120-L133 PolarHBondContact O-N 3.03Å; W120-A135 HydrophobicContact CD2-CB 4.48Å; W120-A135 HydrophobicContact CZ2-CB 4.11Å; W120-F149 HydrophobicContact CD2-CZ 4.36Å; W120-F149 HydrophobicContact CG-CZ 4.3Å; W120-F149 HydrophobicContact CZ2-CE2 4.29Å; W120-F149 AromaticContact NE1-CZ 3.84Å; W120-M185 HydrophobicContact CB-SD 4.44Å; W120-M185 HydrophobicContact CD2-SD 4.37Å; W120-M185 HydrophobicContact CE3-CE 4.01Å; W120-M185 HydrophobicContact CE3-SD 4.13Å; W120-M185 HydrophobicContact CZ3-CE 4.18Å
121	E	45.6	Very low	43.3	Very low	102 Å²	102	90.5 Å²	90.5	48%	0.477	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	129.6	-176.8	-61.8	-159.5	138.5	0	0	113.7	V129 F131 C132	E121-V129 HydrophobicContact CB-CG1 4.07Å; E121-V129 HydrophobicContact CB-CG2 4.45Å; E121-V129 HydrophobicContact CG-CG1 4.23Å; E121-V129 VanDerWaalsContact OE2-CG2 3.23Å; E121-V129 WeakPolarHBondContact OE2-CG2 3.47Å; E121-F131 WeakPolarHBondContact CA-O 3.43Å; E121-C132 HydrophobicContact CG-CB 4.47Å; E121-C132 PolarHBondContact OE1-SG 2.92Å
122	I	53.3	Low	43.5	Very low	35 Å²	35	85.9 Å²	85.9	18%	0.179	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	111.7	177.5	-63	179.1	0	0	0	109.9	K130 F131 L133 A160 I167	I122-K130 WeakPolarHBondContact O-CB 3.43Å; I122-K130 PolarHBondContact O-N 3.06Å; I122-F131 PolarHBondContact N-O 2.65Å; I122-L133 HydrophobicContact CD1-CD1 3.75Å; I122-L133 HydrophobicContact CD1-CG 4.23Å; I122-A160 HydrophobicContact CD1-CB 4.12Å; I122-A160 HydrophobicContact CG2-CB 4.43Å; I122-I167 HydrophobicContact CD1-CD1 3.84Å; I122-I167 HydrophobicContact CD1-CG2 4.33Å
123	L	50.8	Low	44	Very low	44 Å²	44	82 Å²	82	23%	0.23	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	135	177.7	-66.7	161.3	0	0	0	112.1	G127 H128 V129 R159 K186	L123-G127 WeakPolarHBondContact CD2-O 3.34Å; L123-H128 WeakPolarHBondContact CA-O 3.47Å; L123-V129 HydrophobicContact CD2-CB 4.46Å; L123-V129 HydrophobicContact CD2-CG2 3.66Å; L123-R159 PolarHBondContact O-NH2 3.11Å; L123-K186 HydrophobicContact CD1-CB 3.86Å; L123-K186 HydrophobicContact CD1-CD 4.23Å
124	D	46.1	Very low	43.9	Very low	52 Å²	52	82 Å²	82	28%	0.278	45%	0.447	S	S	.	.			trans	-76.3	-174.9	178.9	82.9	-8.3	0	0	0	113.5	S126 G127 H128 R159	D124-S126 VanDerWaalsContact CG-OG 3.26Å; D124-S126 PolarHBondContact O-N 3.35Å; D124-S126 VanDerWaalsContact OD1-CA 3.28Å; D124-S126 WeakPolarHBondContact OD1-CA 3.41Å; D124-S126 VanDerWaalsContact OD1-CB 3.32Å; D124-S126 WeakPolarHBondContact OD1-CB 3.46Å; D124-S126 PolarHBondContact OD1-N 3.3Å; D124-S126 PolarHBondContact OD1-OG 3.34Å; D124-S126 PolarHBondContact OD2-OG 3.45Å; D124-G127 PolarHBondContact O-N 3.44Å; D124-G127 PolarHBondContact OD1-N 3.41Å; D124-H128 PolarHBondContact N-O 3.45Å; D124-H128 PolarHBondContact OD1-N 3.09Å; D124-R159 PolarHBondContact O-NH2 2.79Å
125	G	40.9	Very low	44.2	Very low	78 Å²	78	74.3 Å²	74.3	80%	0.804	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-17.2	178.7	0	0	0	0	0	114.7
126	S	40.6	Very low	44.4	Very low	89 Å²	89	74 Å²	74	62%	0.622	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-11.9	-178.3	-4.4	0	0	0	0	113.1	D124	D124-S126 VanDerWaalsContact CG-OG 3.26Å; D124-S126 PolarHBondContact O-N 3.35Å; D124-S126 VanDerWaalsContact OD1-CA 3.28Å; D124-S126 WeakPolarHBondContact OD1-CA 3.41Å; D124-S126 VanDerWaalsContact OD1-CB 3.32Å; D124-S126 WeakPolarHBondContact OD1-CB 3.46Å; D124-S126 PolarHBondContact OD1-N 3.3Å; D124-S126 PolarHBondContact OD1-OG 3.34Å; D124-S126 PolarHBondContact OD2-OG 3.45Å
127	G	43.2	Very low	44.6	Very low	34 Å²	34	76 Å²	76	35%	0.351	42%	0.418	S	S	.	.	S	Bend	trans	86.6	18.6	-173.8	0	0	0	0	0	114.2	L123 D124	L123-G127 WeakPolarHBondContact CD2-O 3.34Å; D124-G127 PolarHBondContact O-N 3.44Å; D124-G127 PolarHBondContact OD1-N 3.41Å
128	H	36.2	Very low	45	Very low	134 Å²	134	71.2 Å²	71.2	62%	0.62	40%	0.399	S	S	*	.			trans	-91.2	138.6	169.7	-68.6	-55.7	0	0	0	111.1	L123 D124 K130	L123-H128 WeakPolarHBondContact CA-O 3.47Å; D124-H128 PolarHBondContact N-O 3.45Å; D124-H128 PolarHBondContact OD1-N 3.09Å; H128-K130 PolarHBondContact O-N 2.95Å
129	V	45.7	Very low	45.2	Very low	73 Å²	73	71.2 Å²	71.2	44%	0.442	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	123.9	173.8	174.5	0	0	0	0	108.7	E121 L123	E121-V129 HydrophobicContact CB-CG1 4.07Å; E121-V129 HydrophobicContact CB-CG2 4.45Å; E121-V129 HydrophobicContact CG-CG1 4.23Å; E121-V129 VanDerWaalsContact OE2-CG2 3.23Å; E121-V129 WeakPolarHBondContact OE2-CG2 3.47Å; L123-V129 HydrophobicContact CD2-CB 4.46Å; L123-V129 HydrophobicContact CD2-CG2 3.66Å
130	K	52.3	Low	45.7	Very low	110 Å²	110	73.7 Å²	73.7	48%	0.478	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	-38.7	-178.6	-154.2	-172.7	178.2	-160.3	0	112.8	I122 H128	I122-K130 WeakPolarHBondContact O-CB 3.43Å; I122-K130 PolarHBondContact O-N 3.06Å; H128-K130 PolarHBondContact O-N 2.95Å
131	F	53.3	Low	45.4	Very low	68 Å²	68	70.2 Å²	70.2	30%	0.298	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	153.7	178.8	-58.9	-76.9	0	0	0	111.2	E121 I122 Q162	E121-F131 WeakPolarHBondContact CA-O 3.43Å; I122-F131 PolarHBondContact N-O 2.65Å; F131-Q162 VanDerWaalsContact CE2-OE1 3.32Å
132	C	43.8	Very low	46.3	Very low	31 Å²	31	66.3 Å²	66.3	21%	0.209	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	141.6	163.9	-37.4	0	0	0	0	108.7	L113 W120 E121	L113-C132 HydrophobicContact CD1-CB 4.26Å; W120-C132 CarbonylContact O-C 3.4Å; W120-C132 WeakPolarHBondContact O-CA 3.41Å; E121-C132 HydrophobicContact CG-CB 4.47Å; E121-C132 PolarHBondContact OE1-SG 2.92Å
133	L	53.3	Low	47.1	Very low	16 Å²	16	66.3 Å²	66.3	8%	0.084	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	137.5	172.2	-66.8	-177.7	0	0	0	110	Y105 G119 W120 I122 A135 I167	Y105-L133 HydrophobicContact CE1-CD1 4.28Å; G119-L133 CarbonylContact C-O 3.45Å; G119-L133 WeakPolarHBondContact CA-O 3.44Å; W120-L133 PolarHBondContact N-O 3.07Å; W120-L133 PolarHBondContact O-N 3.03Å; I122-L133 HydrophobicContact CD1-CD1 3.75Å; I122-L133 HydrophobicContact CD1-CG 4.23Å; L133-A135 PolarHBondContact O-N 2.92Å; L133-I167 HydrophobicContact CD1-CD1 3.96Å; L133-I167 HydrophobicContact CD2-CD1 4Å; L133-I167 HydrophobicContact CG-CD1 4.44Å
134	D	39.6	Very low	48	Very low	54 Å²	54	64.5 Å²	64.5	29%	0.289	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	124.2	175.2	-170.5	-21.7	0	0	0	110.4	L113 S136	L113-D134 HydrophobicContact CD1-CB 4.24Å; L113-D134 HydrophobicContact CD2-CB 4.32Å; D134-S136 VanDerWaalsContact C-N 3.33Å; D134-S136 VanDerWaalsContact CG-OG 3.29Å; D134-S136 WeakPolarHBondContact OD1-CB 3.48Å; D134-S136 PolarHBondContact OD1-N 3.09Å; D134-S136 PolarHBondContact OD1-OG 2.79Å; D134-S136 PolarHBondContact OD2-OG 3.4Å
135	A	46.7	Very low	49.1	Very low	38 Å²	38	65.2 Å²	65.2	31%	0.314	40%	0.395	S	S	.	.	S	Bend	trans	-74.9	-23.1	178.4	0	0	0	0	0	113.1	Q118 W120 L133 K137	Q118-A135 VanDerWaalsContact O-CB 3.27Å; Q118-A135 WeakPolarHBondContact O-CB 3.37Å; Q118-A135 PolarHBondContact O-N 3.4Å; Q118-A135 VanDerWaalsContact O-N 3.1Å; W120-A135 HydrophobicContact CD2-CB 4.48Å; W120-A135 HydrophobicContact CZ2-CB 4.11Å; L133-A135 PolarHBondContact O-N 2.92Å; A135-K137 PolarHBondContact O-N 3.46Å
136	S	37.8	Very low	50.4	Low	72 Å²	72	63 Å²	63	50%	0.503	36%	0.364	S	S	.	.	S	Bend	trans	-77.4	-18.2	-161.2	70.9	0	0	0	0	114.9	D134	D134-S136 VanDerWaalsContact C-N 3.33Å; D134-S136 VanDerWaalsContact CG-OG 3.29Å; D134-S136 WeakPolarHBondContact OD1-CB 3.48Å; D134-S136 PolarHBondContact OD1-N 3.09Å; D134-S136 PolarHBondContact OD1-OG 2.79Å; D134-S136 PolarHBondContact OD2-OG 3.4Å
137	K	43.5	Very low	52.2	Low	158 Å²	158	59.3 Å²	59.3	69%	0.687	34%	0.337	S	S	*	.			trans	-145.3	75.3	-174.6	-64.6	177.1	-166.7	151.6	0	113.9	A135 D139	A135-K137 PolarHBondContact O-N 3.46Å; K137-D139 PolarHBondContact O-N 3.27Å
138	P	46.7	Very low	53.8	Low	54 Å²	54	59.4 Å²	59.4	35%	0.351	33%	0.329	S	S	.	.			trans	-67.3	124.1	157.7	29.1	-32	0	0	0	109.4	K145	P138-K145 HydrophobicContact CB-CB 3.61Å; P138-K145 HydrophobicContact CB-CD 4.29Å; P138-K145 HydrophobicContact CG-CB 4.01Å; P138-K145 HydrophobicContact CG-CD 4.4Å
139	D	41.7	Very low	55.5	Low	122 Å²	122	56 Å²	56	65%	0.652	31%	0.312	S	S	*	.			trans	-66.2	151.1	-177.9	-158.9	-1.1	0	0	0	111.4	K137 G141	K137-D139 PolarHBondContact O-N 3.27Å; D139-G141 VanDerWaalsContact C-N 3.28Å; D139-G141 PolarHBondContact O-N 2.89Å
140	A	44.1	Very low	56.7	Low	65 Å²	65	53.2 Å²	53.2	54%	0.537	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-26.2	-152.6	0	0	0	0	0	114.6	K145	A140-K145 PolarHBondContact O-NZ 2.97Å
141	G	48.1	Very low	57	Low	45 Å²	45	51.8 Å²	51.8	46%	0.464	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-20.6	-169.4	0	0	0	0	0	117.1	D139	D139-G141 VanDerWaalsContact C-N 3.28Å; D139-G141 PolarHBondContact O-N 2.89Å
142	S	64.3	Low	57.3	Low	21 Å²	21	50.1 Å²	50.1	15%	0.147	30%	0.298	C	S	.	.			trans	-86	122.1	-173.6	-167.5	0	0	0	0	112.4	L144 K145	S142-L144 PolarHBondContact O-N 3.03Å; S142-K145 WeakPolarHBondContact O-CD 3.3Å; S142-K145 VanDerWaalsContact O-CG 3.27Å; S142-K145 WeakPolarHBondContact O-CG 3.47Å; S142-K145 PolarHBondContact O-N 3.19Å
143	W	69.6	Low	58	Low	34 Å²	34	51.6 Å²	51.6	13%	0.129	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-60.5	-27.3	174.5	62	-79.9	0	0	0	112.5	I72 P73 F76 I90 F102 K145 H146 L181	I72-W143 HydrophobicContact CB-CB 4.39Å; I72-W143 HydrophobicContact CG1-CB 3.92Å; P73-W143 HydrophobicContact CG-CD2 4.23Å; P73-W143 HydrophobicContact CG-CH2 4.41Å; P73-W143 HydrophobicContact CG-CZ2 3.8Å; F76-W143 HydrophobicContact CD2-CH2 4.06Å; F76-W143 HydrophobicContact CD2-CZ3 4.1Å; F76-W143 HydrophobicContact CE2-CH2 4.09Å; F76-W143 HydrophobicContact CG-CZ3 4.17Å; I90-W143 HydrophobicContact CD1-CE3 3.54Å; I90-W143 HydrophobicContact CD1-CZ3 4.07Å; I90-W143 WeakPolarHBondContact CD1-O 3.38Å; I90-W143 HydrophobicContact CG2-CE3 4.39Å; I90-W143 HydrophobicContact CG2-CZ3 4.2Å; F102-W143 HydrophobicContact CB-CH2 4.28Å; F102-W143 HydrophobicContact CB-CZ2 4.33Å; F102-W143 AromaticContact CD1-CH2 3.99Å; F102-W143 HydrophobicContact CD1-CH2 3.99Å; F102-W143 HydrophobicContact CD1-CZ2 4.25Å; F102-W143 HydrophobicContact CG-CH2 4.1Å; F102-W143 HydrophobicContact CG-CZ2 4.49Å; W143-K145 PolarHBondContact O-N 2.89Å; W143-H146 PolarHBondContact O-N 3.12Å; W143-L181 HydrophobicContact CZ3-CD2 4.27Å
144	L	70.8	Confident	58.2	Low	6 Å²	6	56 Å²	56	3%	0.031	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-56.8	-21.2	-177.8	-57.9	173.3	0	0	0	113.8	F102 S142 H146 I147 Y169	F102-L144 HydrophobicContact CB-CD2 3.94Å; S142-L144 PolarHBondContact O-N 3.03Å; L144-H146 PolarHBondContact O-N 3.37Å; L144-H146 VanDerWaalsContact O-N 3.16Å; L144-I147 HydrophobicContact CB-CD1 4.22Å; L144-I147 HydrophobicContact CD2-CD1 3.65Å; L144-I147 WeakPolarHBondContact O-CB 3.49Å; L144-I147 WeakPolarHBondContact O-CG1 3.46Å; L144-I147 PolarHBondContact O-N 3.34Å; L144-I147 VanDerWaalsContact O-N 3.11Å; L144-Y169 HydrophobicContact CB-CE2 4Å; L144-Y169 HydrophobicContact CD1-CD2 4.15Å; L144-Y169 HydrophobicContact CD1-CE2 3.98Å; L144-Y169 HydrophobicContact CD2-CD2 4.18Å; L144-Y169 HydrophobicContact CD2-CE2 4.47Å; L144-Y169 HydrophobicContact CG-CE2 4.37Å
145	K	69.1	Low	59.3	Low	67 Å²	67	58.4 Å²	58.4	29%	0.291	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-65	-10.9	175	77.3	-167	-178.3	-176.6	0	115	P138 A140 S142 W143	P138-K145 HydrophobicContact CB-CB 3.61Å; P138-K145 HydrophobicContact CB-CD 4.29Å; P138-K145 HydrophobicContact CG-CB 4.01Å; P138-K145 HydrophobicContact CG-CD 4.4Å; A140-K145 PolarHBondContact O-NZ 2.97Å; S142-K145 WeakPolarHBondContact O-CD 3.3Å; S142-K145 VanDerWaalsContact O-CG 3.27Å; S142-K145 WeakPolarHBondContact O-CG 3.47Å; S142-K145 PolarHBondContact O-N 3.19Å; W143-K145 PolarHBondContact O-N 2.89Å
146	H	68.5	Low	60.6	Low	31 Å²	31	58 Å²	58	14%	0.144	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-102.7	8.8	175.7	-58.7	-78.2	0	0	0	112.9	L78 G89 I90 W143 L144 Q148	L78-H146 HydrophobicContact CD1-CB 3.55Å; G89-H146 WeakPolarHBondContact CA-O 3.24Å; I90-H146 HydrophobicContact CD1-CB 3.67Å; I90-H146 HydrophobicContact CG1-CB 3.69Å; I90-H146 PolarHBondContact N-O 3.24Å; W143-H146 PolarHBondContact O-N 3.12Å; L144-H146 PolarHBondContact O-N 3.37Å; L144-H146 VanDerWaalsContact O-N 3.16Å; H146-Q148 PolarHBondContact O-N 3.24Å
147	I	78.1	Confident	62.5	Low	12 Å²	12	55 Å²	55	6%	0.062	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-74.6	121.4	169.5	-67.4	174.3	0	0	0	107.1	I90 L144 L158 Y169 L181 L183	I90-I147 HydrophobicContact CD1-CG1 3.85Å; L144-I147 HydrophobicContact CB-CD1 4.22Å; L144-I147 HydrophobicContact CD2-CD1 3.65Å; L144-I147 WeakPolarHBondContact O-CB 3.49Å; L144-I147 WeakPolarHBondContact O-CG1 3.46Å; L144-I147 PolarHBondContact O-N 3.34Å; L144-I147 VanDerWaalsContact O-N 3.11Å; I147-L158 HydrophobicContact CD1-CD1 3.9Å; I147-L158 HydrophobicContact CG1-CD1 4.47Å; I147-L158 HydrophobicContact CG2-CD1 3.78Å; I147-Y169 HydrophobicContact CD1-CD2 4.21Å; I147-L181 HydrophobicContact CG1-CB 4.47Å; I147-L183 HydrophobicContact CG2-CB 3.98Å
148	Q	75.7	Confident	64.2	Low	37 Å²	37	47.5 Å²	47.5	17%	0.173	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	160.2	-176.1	-68	-61.7	-19.1	0	0	111.8	V83 A86 L88 H146 E180 L181 L182 L183	V83-Q148 HydrophobicContact CG2-CB 4.18Å; A86-Q148 HydrophobicContact CB-CG 4.18Å; L88-Q148 PolarHBondContact O-NE2 2.96Å; H146-Q148 PolarHBondContact O-N 3.24Å; Q148-E180 WeakPolarHBondContact CG-OE1 3.35Å; Q148-L181 PolarHBondContact N-O 3.24Å; Q148-L182 HydrophobicContact CB-CD2 3.95Å; Q148-L182 CarbonylContact O-C 3.48Å; Q148-L182 WeakPolarHBondContact O-CA 3.44Å; Q148-L183 PolarHBondContact O-N 3.4Å
149	F	72.7	Confident	65.7	Low	62 Å²	62	49.1 Å²	49.1	27%	0.272	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	138.6	175.6	-63.6	-73.6	0	0	0	110.4	W120 P151 L183 M185	W120-F149 HydrophobicContact CD2-CZ 4.36Å; W120-F149 HydrophobicContact CG-CZ 4.3Å; W120-F149 HydrophobicContact CZ2-CE2 4.29Å; W120-F149 AromaticContact NE1-CZ 3.84Å; F149-P151 WeakPolarHBondContact O-CD 3.33Å; F149-L183 HydrophobicContact CD1-CB 4.24Å; F149-L183 HydrophobicContact CD1-CD2 4.19Å; F149-L183 HydrophobicContact CD1-CG 4.31Å; F149-L183 HydrophobicContact CE1-CD2 3.78Å; F149-L183 HydrophobicContact CE1-CG 4.36Å; F149-M185 HydrophobicContact CD1-CE 3.77Å; F149-M185 HydrophobicContact CD1-CG 3.68Å; F149-M185 HydrophobicContact CD1-SD 3.83Å; F149-M185 HydrophobicContact CD2-CE 4.41Å; F149-M185 HydrophobicContact CE1-CE 3.97Å; F149-M185 HydrophobicContact CE1-CG 3.83Å; F149-M185 HydrophobicContact CE1-SD 3.58Å; F149-M185 VanDerWaalsContact CE1-SD 3.58Å; F149-M185 HydrophobicContact CG-CE 3.98Å; F149-M185 HydrophobicContact CZ-CE 4.39Å; F149-M185 HydrophobicContact CZ-SD 4.21Å
150	A	71	Confident	67.4	Low	15 Å²	15	44.1 Å²	44.1	12%	0.124	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-68.7	121.9	176.6	0	0	0	0	0	110.3	A152 H156 L182 L183	A150-A152 PolarHBondContact O-N 3.26Å; A150-H156 HydrophobicContact CB-CB 3.65Å; A150-L182 HydrophobicContact CB-CB 3.99Å; A150-L183 PolarHBondContact N-O 2.8Å
151	P	58.5	Low	68.7	Low	79 Å²	79	42.9 Å²	42.9	51%	0.513	25%	0.249	S	C	.	.	S	Bend	trans	-72	-9	-179.6	29.8	-35.2	0	0	0	113	F149	F149-P151 WeakPolarHBondContact O-CD 3.33Å
152	A	60	Low	69.6	Low	33 Å²	33	43.4 Å²	43.4	27%	0.273	24%	0.239	S	C	.	.	S	Bend	trans	-137.3	142.6	172.6	0	0	0	0	0	111.1	A150 T154 Q155	A150-A152 PolarHBondContact O-N 3.26Å; A152-T154 PolarHBondContact O-N 3.48Å; A152-Q155 HydrophobicContact CB-CB 4.44Å; A152-Q155 HydrophobicContact CB-CG 4.16Å; A152-Q155 PolarHBondContact O-N 3.22Å
153	A	58.1	Low	69.7	Low	63 Å²	63	44.8 Å²	44.8	52%	0.521	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-27.5	175.4	0	0	0	0	0	112.9	Q155 H156 R173 F184	A153-Q155 VanDerWaalsContact C-N 3.34Å; A153-Q155 PolarHBondContact O-N 3.12Å; A153-H156 PolarHBondContact O-CE1 3.23Å; A153-H156 PolarHBondContact O-ND1 3.16Å; A153-R173 PolarHBondContact O-NH2 2.94Å; A153-F184 HydrophobicContact CB-CE2 3.61Å; A153-F184 HydrophobicContact CB-CZ 4.03Å
154	T	57.6	Low	68.7	Low	109 Å²	109	50.3 Å²	50.3	67%	0.669	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	0	176.3	52.6	0	0	0	0	114.7	A152 R173	A152-T154 PolarHBondContact O-N 3.48Å; T154-R173 VanDerWaalsContact O-CZ 3.31Å; T154-R173 PolarHBondContact O-NH1 2.75Å; T154-R173 PolarHBondContact O-NH2 2.96Å
155	Q	62.8	Low	68	Low	103 Å²	103	57.3 Å²	57.3	48%	0.481	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-13.5	-176	-69.7	178.6	-10.1	0	0	116	A152 A153	A152-Q155 HydrophobicContact CB-CB 4.44Å; A152-Q155 HydrophobicContact CB-CG 4.16Å; A152-Q155 PolarHBondContact O-N 3.22Å; A153-Q155 VanDerWaalsContact C-N 3.34Å; A153-Q155 PolarHBondContact O-N 3.12Å
156	H	73.9	Confident	67.5	Low	29 Å²	29	58 Å²	58	13%	0.134	31%	0.313	C	S	.	.			trans	-60.2	142	179.2	77	-95.7	0	0	0	114.2	A150 A153 T172 R173 L182 F184	A150-H156 HydrophobicContact CB-CB 3.65Å; A153-H156 PolarHBondContact O-CE1 3.23Å; A153-H156 PolarHBondContact O-ND1 3.16Å; H156-T172 PolarHBondContact CD2-OG1 3.46Å; H156-T172 VanDerWaalsContact CD2-OG1 3.23Å; H156-T172 PolarHBondContact NE2-OG1 3.3Å; H156-R173 PolarHBondContact ND1-NH2 2.86Å; H156-R173 WeakPolarHBondContact O-CD 3.35Å; H156-R173 PolarHBondContact O-NE 3.33Å; H156-R173 PolarHBondContact O-NH2 3.03Å; H156-L182 CarbonylContact C-O 3.46Å; H156-L182 WeakPolarHBondContact CA-O 3.21Å; H156-F184 HydrophobicContact CB-CB 3.5Å; H156-F184 VanDerWaalsContact CB-CB 3.5Å; H156-F184 HydrophobicContact CB-CD2 4.11Å; H156-F184 HydrophobicContact CB-CG 4.01Å; H156-F184 AromaticContact CE1-CD1 3.85Å; H156-F184 AromaticContact CE1-CG 3.9Å; H156-F184 VanDerWaalsContact CG-CB 3.4Å; H156-F184 AromaticContact CG-CD2 3.93Å; H156-F184 AromaticContact CG-CG 3.6Å; H156-F184 AromaticContact ND1-CD1 3.93Å; H156-F184 AromaticContact ND1-CD2 3.61Å; H156-F184 AromaticContact ND1-CG 3.52Å
157	N	78.5	Confident	67.8	Low	11 Å²	11	56.7 Å²	56.7	6%	0.059	31%	0.307	C	S	.	.			trans	-122.4	-6.9	170.5	58.6	24	0	0	0	114.2	T172 R173 I175 E180 L182	N157-T172 PolarHBondContact O-N 3.21Å; N157-T172 PolarHBondContact O-OG1 3.44Å; N157-R173 HydrophobicContact CB-CB 4.25Å; N157-I175 HydrophobicContact CB-CD1 4.01Å; N157-I175 HydrophobicContact CB-CG1 3.88Å; N157-E180 PolarHBondContact ND2-O 3.2Å; N157-L182 PolarHBondContact N-O 3.15Å; N157-L182 PolarHBondContact OD1-N 3.42Å; N157-L182 PolarHBondContact OD1-O 2.81Å
158	L	79.1	Confident	67.6	Low	0 Å²	0	58 Å²	58	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	153.6	171.8	-58.7	-179.9	0	0	0	112.3	F102 I147 K170 V171 I175 L181 L182 L183 F184	F102-L158 HydrophobicContact CD2-CD2 4.07Å; F102-L158 HydrophobicContact CE2-CD2 4.04Å; I147-L158 HydrophobicContact CD1-CD1 3.9Å; I147-L158 HydrophobicContact CG1-CD1 4.47Å; I147-L158 HydrophobicContact CG2-CD1 3.78Å; L158-K170 CarbonylContact C-O 3.59Å; L158-V171 HydrophobicContact CD2-CB 4.31Å; L158-V171 HydrophobicContact CD2-CG2 3.61Å; L158-I175 HydrophobicContact CD2-CD1 4.14Å; L158-L181 HydrophobicContact CD1-CB 3.94Å; L158-L181 HydrophobicContact CD1-CD2 4.2Å; L158-L181 HydrophobicContact CD1-CG 4.12Å; L158-L182 PolarHBondContact N-O 3.36Å; L158-L183 HydrophobicContact CB-CD1 4.15Å; L158-F184 PolarHBondContact O-N 2.95Å
159	R	77.9	Confident	67.7	Low	87 Å²	87	57.1 Å²	57.1	33%	0.328	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	133.5	167.9	-179.3	178.4	178.5	167.7	6.3	110.9	L123 D124 K170 T172	L123-R159 PolarHBondContact O-NH2 3.11Å; D124-R159 PolarHBondContact O-NH2 2.79Å; R159-K170 PolarHBondContact N-O 3.42Å; R159-K170 PolarHBondContact O-N 3.34Å; R159-T172 HydrophobicContact CB-CG2 3.51Å
160	A	76.8	Confident	68	Low	17 Å²	17	58.4 Å²	58.4	14%	0.14	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	136.3	173.7	0	0	0	0	0	112	I122 I167 Y169	I122-A160 HydrophobicContact CD1-CB 4.12Å; I122-A160 HydrophobicContact CG2-CB 4.43Å; A160-I167 HydrophobicContact CB-CG2 4.24Å; A160-Y169 HydrophobicContact CB-CD1 4.29Å; A160-Y169 HydrophobicContact CB-CE1 4.34Å
161	C	71.9	Confident	68.6	Low	40 Å²	40	57.7 Å²	57.7	27%	0.27	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	129.9	-179.7	-67.7	0	0	0	0	109.2	F168 K170	C161-F168 PolarHBondContact N-O 2.87Å; C161-F168 PolarHBondContact O-N 2.86Å; C161-F168 VanDerWaalsContact O-O 3.11Å; C161-K170 HydrophobicContact CB-CB 4.38Å
162	Q	67.6	Low	69.4	Low	56 Å²	56	56.1 Å²	56.1	26%	0.262	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	133.6	175.8	-164	-167.3	21.5	0	0	111	F131 E165 Q166	F131-Q162 VanDerWaalsContact CE2-OE1 3.32Å; Q162-E165 WeakPolarHBondContact CG-O 3.31Å; Q162-E165 PolarHBondContact NE2-O 3.41Å; Q162-Q166 CarbonylContact C-O 3.6Å; Q162-Q166 VanDerWaalsContact CA-O 3.31Å; Q162-Q166 WeakPolarHBondContact CA-O 3.49Å; Q162-Q166 VanDerWaalsContact CG-O 3.31Å; Q162-Q166 WeakPolarHBondContact CG-O 3.39Å
163	I	65.6	Low	70.2	Confident	49 Å²	49	58.8 Å²	58.8	25%	0.251	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	127.5	175.5	-61.2	151.5	0	0	0	106.8	R101 E165 Q166 F168	R101-I163 VanDerWaalsContact NH1-CD1 3.28Å; I163-E165 PolarHBondContact O-N 2.83Å; I163-Q166 PolarHBondContact N-O 2.82Å; I163-Q166 PolarHBondContact O-N 3.22Å; I163-Q166 VanDerWaalsContact O-N 3.11Å; I163-F168 HydrophobicContact CB-CD2 3.96Å; I163-F168 HydrophobicContact CB-CE2 4.02Å; I163-F168 HydrophobicContact CD1-CB 4.33Å; I163-F168 HydrophobicContact CD1-CD2 3.88Å; I163-F168 HydrophobicContact CD1-CG 4.21Å; I163-F168 HydrophobicContact CG1-CD2 4.37Å
164	D	47.8	Very low	71.2	Confident	150 Å²	150	58.8 Å²	58.8	80%	0.802	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	60	175.6	-53.7	-30.2	0	0	0	113	Q166	D164-Q166 PolarHBondContact O-N 3.45Å
165	E	56.3	Low	72.2	Confident	153 Å²	153	53.6 Å²	53.6	72%	0.715	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	-35.8	-171.1	-60.9	-75.1	79.5	0	0	115.8	Q162 I163	Q162-E165 WeakPolarHBondContact CG-O 3.31Å; Q162-E165 PolarHBondContact NE2-O 3.41Å; I163-E165 PolarHBondContact O-N 2.83Å
166	Q	59.9	Low	73	Confident	81 Å²	81	53.1 Å²	53.1	38%	0.379	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	159.3	-176.8	-72.8	-174.4	-41.7	0	0	114.5	P104 Q162 I163 D164 F168	P104-Q166 HydrophobicContact CB-CB 3.89Å; P104-Q166 HydrophobicContact CB-CG 4.06Å; Q162-Q166 CarbonylContact C-O 3.6Å; Q162-Q166 VanDerWaalsContact CA-O 3.31Å; Q162-Q166 WeakPolarHBondContact CA-O 3.49Å; Q162-Q166 VanDerWaalsContact CG-O 3.31Å; Q162-Q166 WeakPolarHBondContact CG-O 3.39Å; I163-Q166 PolarHBondContact N-O 2.82Å; I163-Q166 PolarHBondContact O-N 3.22Å; I163-Q166 VanDerWaalsContact O-N 3.11Å; D164-Q166 PolarHBondContact O-N 3.45Å; Q166-F168 HydrophobicContact CB-CE2 3.84Å; Q166-F168 HydrophobicContact CB-CZ 4.41Å
167	I	73.3	Confident	73.1	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.021	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	132.2	-178.4	-62.3	168.8	0	0	0	110.2	P104 Y105 I122 L133 A160	P104-I167 CarbonylContact C-O 3.59Å; P104-I167 WeakPolarHBondContact CA-O 3.49Å; Y105-I167 PolarHBondContact N-O 2.81Å; I122-I167 HydrophobicContact CD1-CD1 3.84Å; I122-I167 HydrophobicContact CD1-CG2 4.33Å; L133-I167 HydrophobicContact CD1-CD1 3.96Å; L133-I167 HydrophobicContact CD2-CD1 4Å; L133-I167 HydrophobicContact CG-CD1 4.44Å; A160-I167 HydrophobicContact CB-CG2 4.24Å
168	F	74.9	Confident	72.8	Confident	39 Å²	39	57.3 Å²	57.3	17%	0.171	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	136	178.4	-63.9	-97.9	0	0	0	110.3	F102 G103 P104 C161 I163 Q166 K170	F102-F168 CarbonylContact O-C 3.56Å; F102-F168 WeakPolarHBondContact O-CA 3.44Å; G103-F168 VanDerWaalsContact C-CE1 3.48Å; P104-F168 HydrophobicContact CB-CE1 4.24Å; P104-F168 HydrophobicContact CB-CZ 4.06Å; C161-F168 PolarHBondContact N-O 2.87Å; C161-F168 PolarHBondContact O-N 2.86Å; C161-F168 VanDerWaalsContact O-O 3.11Å; I163-F168 HydrophobicContact CB-CD2 3.96Å; I163-F168 HydrophobicContact CB-CE2 4.02Å; I163-F168 HydrophobicContact CD1-CB 4.33Å; I163-F168 HydrophobicContact CD1-CD2 3.88Å; I163-F168 HydrophobicContact CD1-CG 4.21Å; I163-F168 HydrophobicContact CG1-CD2 4.37Å; Q166-F168 HydrophobicContact CB-CE2 3.84Å; Q166-F168 HydrophobicContact CB-CZ 4.41Å; F168-K170 PolarHBondContact O-N 2.97Å
169	Y	78.6	Confident	72.9	Confident	19 Å²	19	60.9 Å²	60.9	8%	0.075	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	110.1	172	-55	-74.8	0	0	0	109.3	R101 F102 Y105 L144 I147 A160 L183	R101-Y169 CarbonylContact C-O 3.59Å; R101-Y169 WeakPolarHBondContact CA-O 3.43Å; F102-Y169 PolarHBondContact N-O 2.8Å; F102-Y169 PolarHBondContact O-N 2.72Å; Y105-Y169 HydrophobicContact CD2-CE2 4.21Å; Y105-Y169 WeakPolarHBondContact CD2-OH 3.45Å; L144-Y169 HydrophobicContact CB-CE2 4Å; L144-Y169 HydrophobicContact CD1-CD2 4.15Å; L144-Y169 HydrophobicContact CD1-CE2 3.98Å; L144-Y169 HydrophobicContact CD2-CD2 4.18Å; L144-Y169 HydrophobicContact CD2-CE2 4.47Å; L144-Y169 HydrophobicContact CG-CE2 4.37Å; I147-Y169 HydrophobicContact CD1-CD2 4.21Å; A160-Y169 HydrophobicContact CB-CD1 4.29Å; A160-Y169 HydrophobicContact CB-CE1 4.34Å; Y169-L183 HydrophobicContact CD1-CD1 3.81Å; Y169-L183 HydrophobicContact CD1-CD2 4.05Å; Y169-L183 HydrophobicContact CE1-CD1 4.21Å; Y169-L183 HydrophobicContact CE1-CD2 3.61Å
170	K	78.8	Confident	73.1	Confident	90 Å²	90	57.3 Å²	57.3	39%	0.391	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	133.9	175.9	-174.6	-175.2	174.4	-171.3	0	110	E100 L158 R159 C161 F168 T172	E100-K170 WeakPolarHBondContact O-CA 3.43Å; L158-K170 CarbonylContact C-O 3.59Å; R159-K170 PolarHBondContact N-O 3.42Å; R159-K170 PolarHBondContact O-N 3.34Å; C161-K170 HydrophobicContact CB-CB 4.38Å; F168-K170 PolarHBondContact O-N 2.97Å; K170-T172 PolarHBondContact O-N 2.8Å
171	V	81.9	Confident	73.3	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	120.4	175.7	177.9	0	0	0	0	109.8	V96 N97 G99 E100 F102 L158 R173 I175	V96-V171 HydrophobicContact CG1-CB 4.43Å; V96-V171 HydrophobicContact CG1-CG1 4.18Å; V96-V171 HydrophobicContact CG1-CG2 3.6Å; N97-V171 WeakPolarHBondContact O-CG1 3.17Å; G99-V171 PolarHBondContact N-O 2.81Å; E100-V171 HydrophobicContact CB-CB 4.47Å; E100-V171 HydrophobicContact CB-CG2 4.04Å; E100-V171 WeakPolarHBondContact O-CG2 3.49Å; E100-V171 PolarHBondContact O-N 3.24Å; F102-V171 HydrophobicContact CD2-CG2 4.22Å; F102-V171 HydrophobicContact CE2-CG2 3.53Å; F102-V171 HydrophobicContact CZ-CG2 4.22Å; L158-V171 HydrophobicContact CD2-CB 4.31Å; L158-V171 HydrophobicContact CD2-CG2 3.61Å; V171-R173 WeakPolarHBondContact CG1-O 3.5Å; V171-I175 HydrophobicContact CG1-CD1 4.28Å; V171-I175 HydrophobicContact CG1-CG1 4.17Å
172	T	76.3	Confident	73.6	Confident	46 Å²	46	55.5 Å²	55.5	28%	0.282	28%	0.281	S	S	.	.			trans	-95.5	-24.2	179.8	59.6	0	0	0	0	113.1	H156 N157 R159 K170	H156-T172 PolarHBondContact CD2-OG1 3.46Å; H156-T172 VanDerWaalsContact CD2-OG1 3.23Å; H156-T172 PolarHBondContact NE2-OG1 3.3Å; N157-T172 PolarHBondContact O-N 3.21Å; N157-T172 PolarHBondContact O-OG1 3.44Å; R159-T172 HydrophobicContact CB-CG2 3.51Å; K170-T172 PolarHBondContact O-N 2.8Å
173	R	75.8	Confident	74.1	Confident	88 Å²	88	53.6 Å²	53.6	33%	0.332	27%	0.273	S	S	.	.	S	Bend	trans	-132.1	151.5	178.3	-51.7	-172.4	-161.6	171.8	15.3	109.7	A153 T154 H156 N157 V171 I175	A153-R173 PolarHBondContact O-NH2 2.94Å; T154-R173 VanDerWaalsContact O-CZ 3.31Å; T154-R173 PolarHBondContact O-NH1 2.75Å; T154-R173 PolarHBondContact O-NH2 2.96Å; H156-R173 PolarHBondContact ND1-NH2 2.86Å; H156-R173 WeakPolarHBondContact O-CD 3.35Å; H156-R173 PolarHBondContact O-NE 3.33Å; H156-R173 PolarHBondContact O-NH2 3.03Å; N157-R173 HydrophobicContact CB-CB 4.25Å; V171-R173 WeakPolarHBondContact CG1-O 3.5Å; R173-I175 PolarHBondContact O-N 3.34Å
174	E	79.9	Confident	74.3	Confident	63 Å²	63	53.9 Å²	53.9	29%	0.294	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-65.3	124.3	174	-169	168	-127.6	0	0	109.4	K95 V96 I98 F176	K95-E174 HydrophobicContact CD-CG 4.36Å; K95-E174 VanDerWaalsContact CE-OE1 3.25Å; K95-E174 WeakPolarHBondContact CE-OE1 3.43Å; K95-E174 WeakPolarHBondContact CE-OE2 3.34Å; K95-E174 HydrophobicContact CG-CG 4.24Å; K95-E174 IonicContact NZ-OE1 3.17Å; K95-E174 PolarHBondContact NZ-OE1 3.49Å; K95-E174 IonicContact NZ-OE2 2.79Å; K95-E174 PolarHBondContact NZ-OE2 2.67Å; V96-E174 WeakPolarHBondContact O-CA 3.07Å; I98-E174 HydrophobicContact CG1-CB 4.16Å; I98-E174 VanDerWaalsContact CG1-N 3.31Å; E174-F176 HydrophobicContact CB-CE2 4.48Å; E174-F176 HydrophobicContact CG-CE2 4.4Å; E174-F176 HydrophobicContact CG-CZ 4.43Å
175	I	78.6	Confident	74.9	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.25	C	S	.	.	B	Isolated β-bridge	trans	-99.8	129	-178.5	-45.6	179.8	0	0	0	108.2	K95 V96 N157 L158 V171 R173 E179 L181	K95-I175 CarbonylContact C-O 3.57Å; K95-I175 WeakPolarHBondContact CA-O 3.42Å; V96-I175 HydrophobicContact CB-CB 4.04Å; V96-I175 HydrophobicContact CB-CD1 4.47Å; V96-I175 HydrophobicContact CB-CG1 4.34Å; V96-I175 HydrophobicContact CG2-CB 4.45Å; V96-I175 PolarHBondContact N-O 2.98Å; V96-I175 PolarHBondContact O-N 3.5Å; N157-I175 HydrophobicContact CB-CD1 4.01Å; N157-I175 HydrophobicContact CB-CG1 3.88Å; L158-I175 HydrophobicContact CD2-CD1 4.14Å; V171-I175 HydrophobicContact CG1-CD1 4.28Å; V171-I175 HydrophobicContact CG1-CG1 4.17Å; R173-I175 PolarHBondContact O-N 3.34Å; I175-E179 WeakPolarHBondContact CA-OE2 3.41Å; I175-E179 HydrophobicContact CG2-CB 3.76Å; I175-L181 HydrophobicContact CD1-CD1 4.27Å; I175-L181 HydrophobicContact CD1-CG 4.19Å; I175-L181 HydrophobicContact CG2-CD1 4.44Å
176	F	78.7	Confident	74.5	Confident	94 Å²	94	47.2 Å²	47.2	41%	0.412	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-93	158.2	179.3	-67.8	-94.3	0	0	0	111.9	K95 E174 G178 E179	K95-F176 HydrophobicContact CG-CD1 4.45Å; E174-F176 HydrophobicContact CB-CE2 4.48Å; E174-F176 HydrophobicContact CG-CE2 4.4Å; E174-F176 HydrophobicContact CG-CZ 4.43Å; F176-G178 PolarHBondContact O-N 3.04Å; F176-E179 HydrophobicContact CB-CG 4.25Å; F176-E179 PolarHBondContact N-OE2 3.44Å; F176-E179 PolarHBondContact O-N 2.82Å
177	P	76.3	Confident	73.6	Confident	80 Å²	80	47 Å²	47	52%	0.519	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	126	170.7	-20.2	31.3	0	0	0	110.5	S92	S92-P177 CarbonylContact O-C 3.56Å; S92-P177 WeakPolarHBondContact O-CA 3.31Å
178	G	73.7	Confident	71.5	Confident	47 Å²	47	53.5 Å²	53.5	49%	0.485	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.4	15.6	-175.4	0	0	0	0	0	115.2	W91 S92 F176	W91-G178 VanDerWaalsContact CE3-O 3.26Å; W91-G178 VanDerWaalsContact CZ3-O 3.23Å; W91-G178 WeakPolarHBondContact CZ3-O 3.33Å; S92-G178 PolarHBondContact O-N 3.24Å; F176-G178 PolarHBondContact O-N 3.04Å
179	E	79.9	Confident	69.3	Low	76 Å²	76	58.7 Å²	58.7	36%	0.355	30%	0.303	S	S	.	.			trans	-109.3	143.3	171.4	-65.4	179.8	163.5	0	0	112.3	W91 S92 I175 F176	W91-E179 CarbonylContact C-O 3.58Å; W91-E179 WeakPolarHBondContact CA-O 3.46Å; S92-E179 PolarHBondContact N-O 3.45Å; I175-E179 WeakPolarHBondContact CA-OE2 3.41Å; I175-E179 HydrophobicContact CG2-CB 3.76Å; F176-E179 HydrophobicContact CB-CG 4.25Å; F176-E179 PolarHBondContact N-OE2 3.44Å; F176-E179 PolarHBondContact O-N 2.82Å
180	E	82.1	Confident	66.9	Low	11 Å²	11	67.8 Å²	67.8	5%	0.051	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-75.1	140.6	176.3	-161.6	172.2	167.8	0	0	111.4	S81 A82 G89 I90 W91 Q148 N157 L182	S81-E180 WeakPolarHBondContact CB-OE1 3.34Å; S81-E180 PolarHBondContact OG-OE1 2.84Å; S81-E180 PolarHBondContact OG-OE2 3.07Å; A82-E180 PolarHBondContact N-OE2 2.9Å; G89-E180 WeakPolarHBondContact CA-OE1 3.34Å; I90-E180 CarbonylContact O-C 3.5Å; I90-E180 WeakPolarHBondContact O-CA 3.33Å; I90-E180 WeakPolarHBondContact O-CG 3.4Å; W91-E180 HydrophobicContact CD2-CB 3.9Å; W91-E180 HydrophobicContact CD2-CG 4.32Å; W91-E180 HydrophobicContact CE3-CB 4.17Å; W91-E180 HydrophobicContact CG-CB 4.43Å; W91-E180 HydrophobicContact CH2-CB 4.19Å; W91-E180 HydrophobicContact CZ2-CB 3.92Å; W91-E180 HydrophobicContact CZ2-CG 4.29Å; W91-E180 WeakPolarHBondContact CZ2-OE2 3.46Å; W91-E180 HydrophobicContact CZ3-CB 4.31Å; Q148-E180 WeakPolarHBondContact CG-OE1 3.35Å; N157-E180 PolarHBondContact ND2-O 3.2Å; E180-L182 HydrophobicContact CB-CD2 4.32Å; E180-L182 HydrophobicContact CB-CG 4.24Å; E180-L182 HydrophobicContact CG-CD2 3.99Å; E180-L182 HydrophobicContact CG-CG 4.41Å; E180-L182 PolarHBondContact O-N 3.13Å
181	L	80.9	Confident	64.4	Low	0 Å²	0	71.5 Å²	71.5	0%	0	36%	0.355	C	S	.	.			trans	-79.2	104.9	174.5	-88.1	62.8	0	0	0	108.6	F76 I90 F102 W143 I147 Q148 L158 I175	F76-L181 HydrophobicContact CD1-CD1 4Å; F76-L181 HydrophobicContact CD1-CD2 3.94Å; F76-L181 HydrophobicContact CE1-CD1 3.98Å; F76-L181 HydrophobicContact CE1-CD2 3.81Å; I90-L181 HydrophobicContact CG2-CD2 4.12Å; I90-L181 PolarHBondContact O-N 3.37Å; F102-L181 HydrophobicContact CE2-CD2 4.36Å; W143-L181 HydrophobicContact CZ3-CD2 4.27Å; I147-L181 HydrophobicContact CG1-CB 4.47Å; Q148-L181 PolarHBondContact N-O 3.24Å; L158-L181 HydrophobicContact CD1-CB 3.94Å; L158-L181 HydrophobicContact CD1-CD2 4.2Å; L158-L181 HydrophobicContact CD1-CG 4.12Å; I175-L181 HydrophobicContact CD1-CD1 4.27Å; I175-L181 HydrophobicContact CD1-CG 4.19Å; I175-L181 HydrophobicContact CG2-CD1 4.44Å
182	L	78.8	Confident	61.7	Low	20 Å²	20	77.3 Å²	77.3	11%	0.105	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	117.2	-173.5	-63.9	179.8	0	0	0	111.3	V83 Q148 A150 H156 N157 L158 E180	V83-L182 HydrophobicContact CG2-CD2 3.88Å; Q148-L182 HydrophobicContact CB-CD2 3.95Å; Q148-L182 CarbonylContact O-C 3.48Å; Q148-L182 WeakPolarHBondContact O-CA 3.44Å; A150-L182 HydrophobicContact CB-CB 3.99Å; H156-L182 CarbonylContact C-O 3.46Å; H156-L182 WeakPolarHBondContact CA-O 3.21Å; N157-L182 PolarHBondContact N-O 3.15Å; N157-L182 PolarHBondContact OD1-N 3.42Å; N157-L182 PolarHBondContact OD1-O 2.81Å; L158-L182 PolarHBondContact N-O 3.36Å; E180-L182 HydrophobicContact CB-CD2 4.32Å; E180-L182 HydrophobicContact CB-CG 4.24Å; E180-L182 HydrophobicContact CG-CD2 3.99Å; E180-L182 HydrophobicContact CG-CG 4.41Å; E180-L182 PolarHBondContact O-N 3.13Å
183	L	78.6	Confident	59.4	Low	16 Å²	16	82.8 Å²	82.8	8%	0.084	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	133.5	-179.4	-179.1	58.3	0	0	0	111.8	I147 Q148 F149 A150 L158 Y169	I147-L183 HydrophobicContact CG2-CB 3.98Å; Q148-L183 PolarHBondContact O-N 3.4Å; F149-L183 HydrophobicContact CD1-CB 4.24Å; F149-L183 HydrophobicContact CD1-CD2 4.19Å; F149-L183 HydrophobicContact CD1-CG 4.31Å; F149-L183 HydrophobicContact CE1-CD2 3.78Å; F149-L183 HydrophobicContact CE1-CG 4.36Å; A150-L183 PolarHBondContact N-O 2.8Å; L158-L183 HydrophobicContact CB-CD1 4.15Å; Y169-L183 HydrophobicContact CD1-CD1 3.81Å; Y169-L183 HydrophobicContact CD1-CD2 4.05Å; Y169-L183 HydrophobicContact CE1-CD1 4.21Å; Y169-L183 HydrophobicContact CE1-CD2 3.61Å
184	F	68.6	Low	57.5	Low	55 Å²	55	82.4 Å²	82.4	24%	0.241	44%	0.437	C	S	.	.			trans	-76.7	125.2	172.9	-165	-151	0	0	0	111.9	A153 H156 L158 K186	A153-F184 HydrophobicContact CB-CE2 3.61Å; A153-F184 HydrophobicContact CB-CZ 4.03Å; H156-F184 HydrophobicContact CB-CB 3.5Å; H156-F184 VanDerWaalsContact CB-CB 3.5Å; H156-F184 HydrophobicContact CB-CD2 4.11Å; H156-F184 HydrophobicContact CB-CG 4.01Å; H156-F184 AromaticContact CE1-CD1 3.85Å; H156-F184 AromaticContact CE1-CG 3.9Å; H156-F184 VanDerWaalsContact CG-CB 3.4Å; H156-F184 AromaticContact CG-CD2 3.93Å; H156-F184 AromaticContact CG-CG 3.6Å; H156-F184 AromaticContact ND1-CD1 3.93Å; H156-F184 AromaticContact ND1-CD2 3.61Å; H156-F184 AromaticContact ND1-CG 3.52Å; L158-F184 PolarHBondContact O-N 2.95Å; F184-K186 HydrophobicContact CE1-CB 4.15Å; F184-K186 HydrophobicContact CE2-CB 4.48Å; F184-K186 HydrophobicContact CZ-CB 3.88Å; F184-K186 HydrophobicContact CZ-CG 4.34Å
185	M	61.7	Low	55.2	Low	69 Å²	69	87.6 Å²	87.6	34%	0.34	46%	0.463	S	S	.	.			trans	-110.5	132.2	149.9	-62	-162	-63.1	0	0	108.3	W120 F149 A187	W120-M185 HydrophobicContact CB-SD 4.44Å; W120-M185 HydrophobicContact CD2-SD 4.37Å; W120-M185 HydrophobicContact CE3-CE 4.01Å; W120-M185 HydrophobicContact CE3-SD 4.13Å; W120-M185 HydrophobicContact CZ3-CE 4.18Å; F149-M185 HydrophobicContact CD1-CE 3.77Å; F149-M185 HydrophobicContact CD1-CG 3.68Å; F149-M185 HydrophobicContact CD1-SD 3.83Å; F149-M185 HydrophobicContact CD2-CE 4.41Å; F149-M185 HydrophobicContact CE1-CE 3.97Å; F149-M185 HydrophobicContact CE1-CG 3.83Å; F149-M185 HydrophobicContact CE1-SD 3.58Å; F149-M185 VanDerWaalsContact CE1-SD 3.58Å; F149-M185 HydrophobicContact CG-CE 3.98Å; F149-M185 HydrophobicContact CZ-CE 4.39Å; F149-M185 HydrophobicContact CZ-SD 4.21Å; M185-A187 VanDerWaalsContact C-N 3.26Å; M185-A187 PolarHBondContact O-N 3.05Å; M185-A187 VanDerWaalsContact O-N 3.08Å
186	K	47.3	Very low	52.9	Low	94 Å²	94	91.8 Å²	91.8	41%	0.409	50%	0.498	S	S	.	.			trans	-81.6	80.4	168.4	-176.3	-150.4	171.6	-161.7	0	107.8	L123 F184 E188	L123-K186 HydrophobicContact CD1-CB 3.86Å; L123-K186 HydrophobicContact CD1-CD 4.23Å; F184-K186 HydrophobicContact CE1-CB 4.15Å; F184-K186 HydrophobicContact CE2-CB 4.48Å; F184-K186 HydrophobicContact CZ-CB 3.88Å; F184-K186 HydrophobicContact CZ-CG 4.34Å; K186-E188 HydrophobicContact CD-CG 4.39Å; K186-E188 VanDerWaalsContact CE-OE1 3.26Å; K186-E188 WeakPolarHBondContact CE-OE1 3.27Å; K186-E188 VanDerWaalsContact NZ-CD 3.27Å; K186-E188 IonicContact NZ-OE1 2.59Å; K186-E188 PolarHBondContact NZ-OE1 3.33Å; K186-E188 PolarHBondContact O-N 2.99Å
187	A	41.6	Very low	51.3	Low	76 Å²	76	92.9 Å²	92.9	63%	0.628	52%	0.515	S	S	*	.			trans	-62.6	128.5	158.9	0	0	0	0	0	108.1	M185 E189	M185-A187 VanDerWaalsContact C-N 3.26Å; M185-A187 PolarHBondContact O-N 3.05Å; M185-A187 VanDerWaalsContact O-N 3.08Å; A187-E189 PolarHBondContact O-N 3.27Å
188	E	28.3	Very low	49.1	Very low	140 Å²	140	96.8 Å²	96.8	65%	0.654	53%	0.531	S	S	*	.			trans	-88.9	84.9	164.8	-72.7	-168.4	138.7	0	0	108.2	K186 Y190	K186-E188 HydrophobicContact CD-CG 4.39Å; K186-E188 VanDerWaalsContact CE-OE1 3.26Å; K186-E188 WeakPolarHBondContact CE-OE1 3.27Å; K186-E188 VanDerWaalsContact NZ-CD 3.27Å; K186-E188 IonicContact NZ-OE1 2.59Å; K186-E188 PolarHBondContact NZ-OE1 3.33Å; K186-E188 PolarHBondContact O-N 2.99Å; E188-Y190 PolarHBondContact O-N 2.91Å
189	E	28.7	Very low	47.7	Very low	149 Å²	149	101.6 Å²	101.6	70%	0.696	54%	0.544	S	S	*	.			trans	-66.9	98.7	167.4	-67.6	-177.9	127.2	0	0	109.3	A187 F191	A187-E189 PolarHBondContact O-N 3.27Å; E189-F191 HydrophobicContact CB-CD2 3.98Å; E189-F191 HydrophobicContact CB-CE2 3.95Å; E189-F191 HydrophobicContact CG-CE2 4.48Å; E189-F191 PolarHBondContact O-N 2.82Å; E189-F191 VanDerWaalsContact O-N 3.11Å
190	Y	29	Very low	45.6	Very low	209 Å²	209	104 Å²	104	82%	0.82	56%	0.555	S	S	*	*			trans	-73.4	93.6	161.8	-97.3	-92.5	0	0	0	109	E188 C192	E188-Y190 PolarHBondContact O-N 2.91Å; Y190-C192 PolarHBondContact O-N 3.32Å
191	F	25.3	Very low	44	Very low	169 Å²	169	113.1 Å²	113.1	74%	0.741	60%	0.598	S	S	*	*			trans	-75.8	116.8	163.7	-84.9	-88.6	0	0	0	109.7	E189	E189-F191 HydrophobicContact CB-CD2 3.98Å; E189-F191 HydrophobicContact CB-CE2 3.95Å; E189-F191 HydrophobicContact CG-CE2 4.48Å; E189-F191 PolarHBondContact O-N 2.82Å; E189-F191 VanDerWaalsContact O-N 3.11Å
192	C	26.7	Very low	42.1	Very low	121 Å²	121	119 Å²	119	82%	0.818	63%	0.625	S	S	*	*			trans	-93.9	133	163.1	-66.2	0	0	0	0	109	Y190	Y190-C192 PolarHBondContact O-N 3.32Å
193	D	26.2	Very low	40.7	Very low	162 Å²	162	128.5 Å²	128.5	87%	0.866	66%	0.66	S	S	*	*			trans	-136	161	174.6	-153.9	-8.6	0	0	0	111.2
194	A	36.8	Very low	39.7	Very low	80 Å²	80	132.7 Å²	132.7	66%	0.661	68%	0.679	S	S	*	*	S	Bend	trans	-65.3	153.8	-164.5	0	0	0	0	0	115.3
195	M	31.4	Very low	39.4	Very low	172 Å²	172	134.3 Å²	134.3	85%	0.847	68%	0.684	S	S	*	*			cis	-158.4	127.6	0.3	-119.1	-87.1	-173	0	0	111.1
196	A	29.9	Very low	39.7	Very low	88 Å²	88	137.7 Å²	137.7	73%	0.727	69%	0.693	S	S	*	*			trans	-155.3	128.4	148.2	0	0	0	0	0	106.5	D198	A196-D198 PolarHBondContact O-N 2.88Å
197	P	44.8	Very low	41.1	Very low	117 Å²	117	133.4 Å²	133.4	76%	0.76	68%	0.675	S	S	*	*			trans	-79.5	94	-170.7	30.8	-34.4	0	0	0	111.3
198	D	30.2	Very low	42.4	Very low	161 Å²	161	138.4 Å²	138.4	86%	0.861	69%	0.685	S	S	*	*			trans	-92.9	142	155.2	-155.1	-5	0	0	0	108.5	A196	A196-D198 PolarHBondContact O-N 2.88Å
199	I	44.8	Very low	44.2	Very low	148 Å²	148	136.9 Å²	136.9	76%	0.759	68%	0.681	S	S	*	*			trans	-120	152.7	-155	44.8	172.8	0	0	0	113.7
200	H	37	Very low	46.3	Very low	127 Å²	127	132.2 Å²	132.2	59%	0.588	66%	0.664	S	S	*	*			trans	93	52.7	165.6	-152.5	66.6	0	0	0	118.4	E215	H200-E215 IonicContact CE1-OE2 3.75Å; H200-E215 IonicContact NE2-OE2 2.88Å
201	E	46.7	Very low	47.9	Very low	203 Å²	203	126.2 Å²	126.2	95%	0.949	65%	0.647	S	S	*	*			trans	-113.6	73.4	132.7	-75.2	-164.9	160.3	0	0	108.6
202	E	42.3	Very low	50.2	Low	124 Å²	124	123.2 Å²	123.2	58%	0.579	64%	0.635	S	S	*	*			trans	-75.4	141.8	175.5	-65	-143.6	126.5	0	0	111.2	Q204	E202-Q204 PolarHBondContact O-N 3.26Å
203	R	49.9	Very low	52.3	Low	218 Å²	218	122.2 Å²	122.2	82%	0.823	62%	0.618	S	S	*	*			trans	-65	106.4	-175	-68.3	174.2	176.5	163.3	-1.9	110.2	Y205	R203-Y205 WeakPolarHBondContact O-CD2 3.4Å; R203-Y205 WeakPolarHBondContact O-CE2 3.37Å; R203-Y205 PolarHBondContact O-N 3.34Å; R203-Y205 VanDerWaalsContact O-N 3.13Å
204	Q	55.9	Low	54.5	Low	104 Å²	104	116.2 Å²	116.2	49%	0.486	58%	0.584	S	S	.	*	P	Polyproline II helix	trans	-60	119.3	-179.1	-74	-178.7	-16.6	0	0	112.2	E202 H213 F214 E215	E202-Q204 PolarHBondContact O-N 3.26Å; Q204-H213 HydrophobicContact CB-CB 4.18Å; Q204-F214 CarbonylContact C-O 3.46Å; Q204-F214 WeakPolarHBondContact CA-O 3.25Å; Q204-E215 HydrophobicContact CG-CG 3.9Å; Q204-E215 PolarHBondContact NE2-OE1 2.82Å
205	Y	63.9	Low	56.1	Low	89 Å²	89	116.6 Å²	116.6	35%	0.349	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82	118.9	-180	-64.6	-92.5	0	0	0	109.4	R203 F214 R217	R203-Y205 WeakPolarHBondContact O-CD2 3.4Å; R203-Y205 WeakPolarHBondContact O-CE2 3.37Å; R203-Y205 PolarHBondContact O-N 3.34Å; R203-Y205 VanDerWaalsContact O-N 3.13Å; Y205-F214 PolarHBondContact N-O 2.81Å; Y205-F214 PolarHBondContact O-N 2.97Å; Y205-R217 HydrophobicContact CD1-CB 3.92Å; Y205-R217 HydrophobicContact CD1-CG 4Å; Y205-R217 HydrophobicContact CD2-CB 4.19Å; Y205-R217 HydrophobicContact CE1-CB 3.65Å; Y205-R217 HydrophobicContact CE1-CG 3.89Å; Y205-R217 HydrophobicContact CE2-CB 3.95Å; Y205-R217 HydrophobicContact CG-CB 4.19Å
206	R	67.4	Low	58	Low	141 Å²	141	109.5 Å²	109.5	53%	0.532	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	126.3	-176.5	177.6	-179.6	170.2	-173.4	-0.8	111.6	D211 Q212 L220	R206-D211 IonicContact CZ-OD1 4Å; R206-D211 IonicContact CZ-OD2 2.63Å; R206-D211 IonicContact NE-OD1 3.97Å; R206-D211 PolarHBondContact NE-OD1 3.24Å; R206-D211 IonicContact NH2-OD1 3.69Å; R206-D211 PolarHBondContact NH2-OD1 2.79Å; R206-D211 IonicContact NH2-OD2 2.94Å; R206-D211 PolarHBondContact NH2-OD2 2.93Å; R206-Q212 WeakPolarHBondContact CA-O 3.2Å; R206-L220 VanDerWaalsContact O-CD1 3.27Å; R206-L220 WeakPolarHBondContact O-CD1 3.39Å
207	C	76.4	Confident	59.8	Low	3 Å²	3	113.1 Å²	113.1	2%	0.02	54%	0.535	C	S	.	.	P	Polyproline II helix	trans	-75.9	120.7	172	179.7	0	0	0	0	110.8	D209 C210 D211 Q212 F214 L220 H223	C207-D209 VanDerWaalsContact C-N 3.28Å; C207-D209 PolarHBondContact O-N 3.27Å; C207-C210 PolarHBondContact O-N 3.06Å; C207-D211 WeakPolarHBondContact O-CA 3.27Å; C207-D211 PolarHBondContact O-N 3.29Å; C207-Q212 PolarHBondContact N-O 3.17Å; C207-F214 HydrophobicContact CB-CE2 4.09Å; C207-L220 HydrophobicContact CB-CD1 4.44Å; C207-H223 VanDerWaalsContact SG-CD2 3.52Å; C207-H223 PolarHBondContact SG-NE2 3.34Å; C207-H223 VanDerWaalsContact SG-NE2 3.39Å
208	E	67.9	Low	60.9	Low	182 Å²	182	111.3 Å²	111.3	85%	0.85	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-24.2	-177.4	-59.7	-171.4	136.8	0	0	113.2
209	D	66	Low	62.9	Low	108 Å²	108	107.6 Å²	107.6	58%	0.578	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-15.6	-178.7	-66	-59.2	0	0	0	114.1	C207 C228	C207-D209 VanDerWaalsContact C-N 3.28Å; C207-D209 PolarHBondContact O-N 3.27Å; D209-C228 HydrophobicContact CB-CB 3.54Å
210	C	72.9	Confident	64.5	Low	50 Å²	50	101.8 Å²	101.8	34%	0.338	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-149.7	6.4	179.8	81.4	0	0	0	0	117.5	C207 Q212 H223	C207-C210 PolarHBondContact O-N 3.06Å; C210-Q212 PolarHBondContact O-N 2.96Å; C210-Q212 VanDerWaalsContact O-N 3.08Å; C210-Q212 PolarHBondContact SG-NE2 3.24Å; C210-H223 VanDerWaalsContact SG-CE1 3.57Å; C210-H223 PolarHBondContact SG-NE2 2.87Å
211	D	63.8	Low	66.2	Low	84 Å²	84	99.3 Å²	99.3	45%	0.449	46%	0.463	S	S	.	.			trans	58.3	16.5	178	-77.3	-14.4	0	0	0	116.3	R206 C207 H213	R206-D211 IonicContact CZ-OD1 4Å; R206-D211 IonicContact CZ-OD2 2.63Å; R206-D211 IonicContact NE-OD1 3.97Å; R206-D211 PolarHBondContact NE-OD1 3.24Å; R206-D211 IonicContact NH2-OD1 3.69Å; R206-D211 PolarHBondContact NH2-OD1 2.79Å; R206-D211 IonicContact NH2-OD2 2.94Å; R206-D211 PolarHBondContact NH2-OD2 2.93Å; C207-D211 WeakPolarHBondContact O-CA 3.27Å; C207-D211 PolarHBondContact O-N 3.29Å; D211-H213 PolarHBondContact O-CE1 2.89Å; D211-H213 VanDerWaalsContact O-CE1 3.31Å; D211-H213 PolarHBondContact O-ND1 2.83Å
212	Q	73.1	Confident	67.5	Low	105 Å²	105	94 Å²	94	49%	0.491	44%	0.441	S	S	.	.			trans	-73.4	142.2	168	-73.3	179	90.4	0	0	111	R206 C207 C210 F214	R206-Q212 WeakPolarHBondContact CA-O 3.2Å; C207-Q212 PolarHBondContact N-O 3.17Å; C210-Q212 PolarHBondContact O-N 2.96Å; C210-Q212 VanDerWaalsContact O-N 3.08Å; C210-Q212 PolarHBondContact SG-NE2 3.24Å; Q212-F214 HydrophobicContact CB-CD2 4.49Å; Q212-F214 HydrophobicContact CB-CE2 3.5Å; Q212-F214 VanDerWaalsContact CB-CE2 3.5Å; Q212-F214 HydrophobicContact CB-CZ 3.59Å
213	H	70.1	Confident	69.1	Low	101 Å²	101	89.9 Å²	89.9	47%	0.468	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	123.4	-174.9	-70.8	65	0	0	0	108.1	Q204 D211	Q204-H213 HydrophobicContact CB-CB 4.18Å; D211-H213 PolarHBondContact O-CE1 2.89Å; D211-H213 VanDerWaalsContact O-CE1 3.31Å; D211-H213 PolarHBondContact O-ND1 2.83Å
214	F	73.6	Confident	70	Confident	35 Å²	35	84.7 Å²	84.7	15%	0.154	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	140.9	-173	-63.6	-81.8	0	0	0	110.3	Q204 Y205 C207 Q212 E219 L220 H223	Q204-F214 CarbonylContact C-O 3.46Å; Q204-F214 WeakPolarHBondContact CA-O 3.25Å; Y205-F214 PolarHBondContact N-O 2.81Å; Y205-F214 PolarHBondContact O-N 2.97Å; C207-F214 HydrophobicContact CB-CE2 4.09Å; Q212-F214 HydrophobicContact CB-CD2 4.49Å; Q212-F214 HydrophobicContact CB-CE2 3.5Å; Q212-F214 VanDerWaalsContact CB-CE2 3.5Å; Q212-F214 HydrophobicContact CB-CZ 3.59Å; F214-E219 HydrophobicContact CB-CB 3.76Å; F214-E219 HydrophobicContact CD1-CB 3.88Å; F214-E219 HydrophobicContact CG-CB 4.1Å; F214-L220 HydrophobicContact CB-CB 4.37Å; F214-L220 HydrophobicContact CD2-CB 4.22Å; F214-H223 HydrophobicContact CE1-CB 4.15Å; F214-H223 HydrophobicContact CE2-CB 4.13Å; F214-H223 AromaticContact CE2-CD2 3.16Å; F214-H223 WeakPolarHBondContact CE2-CD2 3.5Å; F214-H223 AromaticContact CE2-CG 3.62Å; F214-H223 AromaticContact CE2-NE2 3.56Å; F214-H223 HydrophobicContact CZ-CB 3.81Å; F214-H223 AromaticContact CZ-CD2 3.32Å; F214-H223 WeakPolarHBondContact CZ-CD2 3.45Å; F214-H223 AromaticContact CZ-CE1 3.73Å; F214-H223 AromaticContact CZ-CG 3.29Å; F214-H223 AromaticContact CZ-ND1 3.57Å; F214-H223 AromaticContact CZ-NE2 3.58Å
215	E	70	Confident	70.7	Confident	88 Å²	88	86.8 Å²	86.8	41%	0.411	42%	0.415	S	S	.	.	S	Bend	trans	-76.7	-29.3	-169.6	-75	162.9	-178	0	0	111.5	H200 Q204 E219	H200-E215 IonicContact CE1-OE2 3.75Å; H200-E215 IonicContact NE2-OE2 2.88Å; Q204-E215 HydrophobicContact CG-CG 3.9Å; Q204-E215 PolarHBondContact NE2-OE1 2.82Å; E215-E219 PolarHBondContact N-OE2 3.16Å
216	S	70.4	Confident	70.4	Confident	24 Å²	24	89.2 Å²	89.2	17%	0.168	43%	0.429	C	S	.	.	S	Bend	trans	-114	156.9	170.3	78.6	0	0	0	0	114.7	S218 E219 L220	S216-S218 PolarHBondContact O-N 3.45Å; S216-S218 PolarHBondContact OG-N 3.17Å; S216-E219 WeakPolarHBondContact CB-OE1 3.43Å; S216-E219 PolarHBondContact N-OE1 2.89Å; S216-E219 PolarHBondContact N-OE2 3.47Å; S216-E219 PolarHBondContact O-N 3.27Å; S216-E219 VanDerWaalsContact OG-CD 3.25Å; S216-E219 WeakPolarHBondContact OG-CG 3.42Å; S216-E219 PolarHBondContact OG-N 3.43Å; S216-E219 PolarHBondContact OG-OE1 3.25Å; S216-L220 PolarHBondContact O-N 3.38Å
217	R	68.7	Low	69.8	Low	164 Å²	164	87.6 Å²	87.6	62%	0.619	44%	0.437	S	S	*	.	H	α-helix	trans	-64.9	-27.5	173.2	-166.9	174.1	177.9	165.2	1	112	Y205 L221	Y205-R217 HydrophobicContact CD1-CB 3.92Å; Y205-R217 HydrophobicContact CD1-CG 4Å; Y205-R217 HydrophobicContact CD2-CB 4.19Å; Y205-R217 HydrophobicContact CE1-CB 3.65Å; Y205-R217 HydrophobicContact CE1-CG 3.89Å; Y205-R217 HydrophobicContact CE2-CB 3.95Å; Y205-R217 HydrophobicContact CG-CB 4.19Å; R217-L221 HydrophobicContact CG-CD1 4.25Å; R217-L221 WeakPolarHBondContact O-CB 3.32Å; R217-L221 VanDerWaalsContact O-CG 3.31Å; R217-L221 WeakPolarHBondContact O-CG 3.28Å; R217-L221 PolarHBondContact O-N 3.45Å
218	S	68.1	Low	69.1	Low	79 Å²	79	89.3 Å²	89.3	55%	0.552	45%	0.448	S	S	*	.	H	α-helix	trans	-68	-45.5	179.2	-56.1	0	0	0	0	110.9	S216 L220 L221 D222	S216-S218 PolarHBondContact O-N 3.45Å; S216-S218 PolarHBondContact OG-N 3.17Å; S218-L220 PolarHBondContact O-N 2.93Å; S218-L221 PolarHBondContact O-N 2.96Å; S218-L221 VanDerWaalsContact O-N 3.13Å; S218-D222 PolarHBondContact O-N 2.81Å
219	E	72.4	Confident	68.2	Low	83 Å²	83	83.6 Å²	83.6	39%	0.388	44%	0.438	S	S	.	.	H	α-helix	trans	-58.3	-45.5	173	-74.5	147.6	-118.6	0	0	112.1	F214 E215 S216 L221 D222 H223	F214-E219 HydrophobicContact CB-CB 3.76Å; F214-E219 HydrophobicContact CD1-CB 3.88Å; F214-E219 HydrophobicContact CG-CB 4.1Å; E215-E219 PolarHBondContact N-OE2 3.16Å; S216-E219 WeakPolarHBondContact CB-OE1 3.43Å; S216-E219 PolarHBondContact N-OE1 2.89Å; S216-E219 PolarHBondContact N-OE2 3.47Å; S216-E219 PolarHBondContact O-N 3.27Å; S216-E219 VanDerWaalsContact OG-CD 3.25Å; S216-E219 WeakPolarHBondContact OG-CG 3.42Å; S216-E219 PolarHBondContact OG-N 3.43Å; S216-E219 PolarHBondContact OG-OE1 3.25Å; E219-L221 VanDerWaalsContact C-N 3.3Å; E219-L221 PolarHBondContact O-N 3.46Å; E219-D222 PolarHBondContact O-N 3.29Å; E219-H223 WeakPolarHBondContact O-CB 3.46Å; E219-H223 PolarHBondContact O-N 3.45Å
220	L	78.9	Confident	66.7	Low	25 Å²	25	86 Å²	86	13%	0.131	45%	0.448	C	S	.	.	H	α-helix	trans	-60.3	-41.2	175	177.5	145.5	0	0	0	111.5	R206 C207 F214 S216 S218 H223 Q224	R206-L220 VanDerWaalsContact O-CD1 3.27Å; R206-L220 WeakPolarHBondContact O-CD1 3.39Å; C207-L220 HydrophobicContact CB-CD1 4.44Å; F214-L220 HydrophobicContact CB-CB 4.37Å; F214-L220 HydrophobicContact CD2-CB 4.22Å; S216-L220 PolarHBondContact O-N 3.38Å; S218-L220 PolarHBondContact O-N 2.93Å; L220-H223 CarbonylContact O-C 3.48Å; L220-H223 PolarHBondContact O-N 2.82Å; L220-Q224 VanDerWaalsContact O-CB 3.26Å; L220-Q224 WeakPolarHBondContact O-CB 3.33Å; L220-Q224 PolarHBondContact O-N 3.3Å
221	L	72.4	Confident	65	Low	75 Å²	75	87.5 Å²	87.5	39%	0.393	46%	0.457	S	S	.	.	H	α-helix	trans	-71.1	-31.6	179.5	-74.9	170.5	0	0	0	113.1	R217 S218 E219 K225	R217-L221 HydrophobicContact CG-CD1 4.25Å; R217-L221 WeakPolarHBondContact O-CB 3.32Å; R217-L221 VanDerWaalsContact O-CG 3.31Å; R217-L221 WeakPolarHBondContact O-CG 3.28Å; R217-L221 PolarHBondContact O-N 3.45Å; S218-L221 PolarHBondContact O-N 2.96Å; S218-L221 VanDerWaalsContact O-N 3.13Å; E219-L221 VanDerWaalsContact C-N 3.3Å; E219-L221 PolarHBondContact O-N 3.46Å; L221-K225 VanDerWaalsContact O-CG 3.31Å; L221-K225 WeakPolarHBondContact O-CG 3.29Å; L221-K225 PolarHBondContact O-N 2.77Å
222	D	73.1	Confident	63.4	Low	91 Å²	91	90.4 Å²	90.4	49%	0.487	48%	0.481	S	S	.	.	H	α-helix	trans	-73.6	-39.4	171.6	-75.2	-26.9	0	0	0	111.4	S218 E219 Q224 K225 E226	S218-D222 PolarHBondContact O-N 2.81Å; E219-D222 PolarHBondContact O-N 3.29Å; D222-Q224 VanDerWaalsContact C-N 3.25Å; D222-Q224 PolarHBondContact O-N 2.95Å; D222-K225 WeakPolarHBondContact O-CB 3.42Å; D222-K225 PolarHBondContact O-N 3.36Å; D222-K225 VanDerWaalsContact O-N 3.16Å; D222-K225 WeakPolarHBondContact OD1-CE 3.35Å; D222-K225 IonicContact OD1-NZ 2.69Å; D222-K225 PolarHBondContact OD1-NZ 3.43Å; D222-E226 PolarHBondContact O-N 3.11Å
223	H	75.3	Confident	61.4	Low	38 Å²	38	89.7 Å²	89.7	18%	0.176	49%	0.487	C	S	.	.	H	α-helix	trans	-63.6	-28.3	171.5	175.5	67	0	0	0	113.2	C207 C210 F214 E219 L220 C228	C207-H223 VanDerWaalsContact SG-CD2 3.52Å; C207-H223 PolarHBondContact SG-NE2 3.34Å; C207-H223 VanDerWaalsContact SG-NE2 3.39Å; C210-H223 VanDerWaalsContact SG-CE1 3.57Å; C210-H223 PolarHBondContact SG-NE2 2.87Å; F214-H223 HydrophobicContact CE1-CB 4.15Å; F214-H223 HydrophobicContact CE2-CB 4.13Å; F214-H223 AromaticContact CE2-CD2 3.16Å; F214-H223 WeakPolarHBondContact CE2-CD2 3.5Å; F214-H223 AromaticContact CE2-CG 3.62Å; F214-H223 AromaticContact CE2-NE2 3.56Å; F214-H223 HydrophobicContact CZ-CB 3.81Å; F214-H223 AromaticContact CZ-CD2 3.32Å; F214-H223 WeakPolarHBondContact CZ-CD2 3.45Å; F214-H223 AromaticContact CZ-CE1 3.73Å; F214-H223 AromaticContact CZ-CG 3.29Å; F214-H223 AromaticContact CZ-ND1 3.57Å; F214-H223 AromaticContact CZ-NE2 3.58Å; E219-H223 WeakPolarHBondContact O-CB 3.46Å; E219-H223 PolarHBondContact O-N 3.45Å; L220-H223 CarbonylContact O-C 3.48Å; L220-H223 PolarHBondContact O-N 2.82Å; H223-C228 PolarHBondContact CE1-SG 3.1Å; H223-C228 PolarHBondContact NE2-SG 3.43Å; H223-C228 PolarHBondContact O-SG 3.23Å; H223-C228 VanDerWaalsContact O-SG 3.38Å
224	Q	69	Low	59.5	Low	109 Å²	109	88.9 Å²	88.9	51%	0.509	50%	0.498	S	S	.	.	H	α-helix	trans	-85.1	-14.6	174.7	-166.5	173.3	36.8	0	0	113.5	L220 D222	L220-Q224 VanDerWaalsContact O-CB 3.26Å; L220-Q224 WeakPolarHBondContact O-CB 3.33Å; L220-Q224 PolarHBondContact O-N 3.3Å; D222-Q224 VanDerWaalsContact C-N 3.25Å; D222-Q224 PolarHBondContact O-N 2.95Å
225	K	70.4	Confident	57.5	Low	148 Å²	148	97 Å²	97	64%	0.643	53%	0.534	S	S	*	.	H	α-helix	trans	-75	-33.2	169	-72.3	163.5	-158.4	168.1	0	111.6	L221 D222	L221-K225 VanDerWaalsContact O-CG 3.31Å; L221-K225 WeakPolarHBondContact O-CG 3.29Å; L221-K225 PolarHBondContact O-N 2.77Å; D222-K225 WeakPolarHBondContact O-CB 3.42Å; D222-K225 PolarHBondContact O-N 3.36Å; D222-K225 VanDerWaalsContact O-N 3.16Å; D222-K225 WeakPolarHBondContact OD1-CE 3.35Å; D222-K225 IonicContact OD1-NZ 2.69Å; D222-K225 PolarHBondContact OD1-NZ 3.43Å
226	E	58.8	Low	55.7	Low	141 Å²	141	99.9 Å²	99.9	66%	0.659	55%	0.551	S	S	*	*	S	Bend	trans	-81.7	139.5	169.7	-69.7	-62.5	142	0	0	110.5	D222 C228	D222-E226 PolarHBondContact O-N 3.11Å; E226-C228 PolarHBondContact O-N 3.3Å
227	P	55.2	Low	53.8	Low	107 Å²	107	105.9 Å²	105.9	70%	0.695	58%	0.581	S	S	*	*			trans	-71.8	102.8	-173.8	27.3	-34.1	0	0	0	112.4	G229	P227-G229 VanDerWaalsContact C-N 3.33Å; P227-G229 PolarHBondContact O-N 3.18Å
228	C	60.6	Low	52.2	Low	38 Å²	38	104.6 Å²	104.6	26%	0.257	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64	84.2	171	-72.8	0	0	0	0	111.6	D209 H223 E226	D209-C228 HydrophobicContact CB-CB 3.54Å; H223-C228 PolarHBondContact CE1-SG 3.1Å; H223-C228 PolarHBondContact NE2-SG 3.43Å; H223-C228 PolarHBondContact O-SG 3.23Å; H223-C228 VanDerWaalsContact O-SG 3.38Å; E226-C228 PolarHBondContact O-N 3.3Å
229	G	50.4	Low	50.3	Low	62 Å²	62	104 Å²	104	64%	0.639	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	167.2	18.1	-178.5	0	0	0	0	0	118.2	P227	P227-G229 VanDerWaalsContact C-N 3.33Å; P227-G229 PolarHBondContact O-N 3.18Å
230	M	33.5	Very low	48.5	Very low	158 Å²	158	108.9 Å²	108.9	78%	0.778	62%	0.623	S	S	*	*			trans	-118.5	125.4	172.3	-74.5	-85.3	91.1	0	0	111
231	P	36.8	Very low	46.1	Very low	83 Å²	83	115.3 Å²	115.3	54%	0.539	66%	0.658	S	S	.	*			trans	-67.2	154.9	165.7	31.2	-33.8	0	0	0	109.5	S233	P231-S233 PolarHBondContact O-N 3.49Å; P231-S233 PolarHBondContact O-OG 3.23Å
232	P	31.2	Very low	44.1	Very low	144 Å²	144	116 Å²	116	94%	0.935	67%	0.674	S	S	*	*	S	Bend	trans	-73.3	72	177.2	30	-35.4	0	0	0	111.6
233	S	31.2	Very low	41.9	Very low	91 Å²	91	118.6 Å²	118.6	64%	0.636	69%	0.688	S	S	*	*			trans	-114.3	49.4	-174.5	64.4	0	0	0	0	113.7	P231	P231-S233 PolarHBondContact O-N 3.49Å; P231-S233 PolarHBondContact O-OG 3.23Å
234	A	29.4	Very low	39.9	Very low	84 Å²	84	122.8 Å²	122.8	69%	0.694	71%	0.711	S	S	*	*			trans	-142.9	95.7	158.9	0	0	0	0	0	107.2
235	F	32.4	Very low	38	Very low	206 Å²	206	123.7 Å²	123.7	90%	0.904	72%	0.724	S	S	*	*				-50.2	86.1	70.1	-64.6	-83.6	0	0	0	118.7
236	L	31.5	Very low	36.1	Very low	148 Å²	148	121 Å²	121	78%	0.775	73%	0.73	S	S	*	*			trans	-129.1	145.5	137.6	-73.1	178	0	0	0	107.2
237	N	29.7	Very low	34.8	Very low	150 Å²	150	123.2 Å²	123.2	80%	0.802	74%	0.741	S	S	*	*			trans	-83.5	145.2	-178.8	-45.1	-73.3	0	0	0	109.8	G239	N237-G239 PolarHBondContact O-N 3.01Å
238	P	35.3	Very low	33.7	Very low	136 Å²	136	124.9 Å²	124.9	88%	0.883	74%	0.739	S	S	*	*			trans	-64.4	115.9	152	-9.5	26	0	0	0	107.9
239	G	28.1	Very low	32.7	Very low	67 Å²	67	128.2 Å²	128.2	69%	0.691	76%	0.76	S	S	*	*			trans	-99.6	142.7	156.3	0	0	0	0	0	108	N237	N237-G239 PolarHBondContact O-N 3.01Å
240	E	34.3	Very low	31.8	Very low	185 Å²	185	132.7 Å²	132.7	86%	0.864	76%	0.764	S	S	*	*			trans	-67.9	134.4	179.8	-63.7	141.7	119.6	0	0	111.1
241	D	30.2	Very low	31.7	Very low	161 Å²	161	132 Å²	132	86%	0.861	76%	0.764	S	S	*	*				175.5	149.1	113.1	-97.8	-31.2	0	0	0	115.2
242	A	30.2	Very low	31.4	Very low	89 Å²	89	136.4 Å²	136.4	74%	0.736	78%	0.782	S	S	*	*			trans	65.9	77.3	147.3	0	0	0	0	0	122.9
243	D	26.6	Very low	31.6	Very low	146 Å²	146	140.4 Å²	140.4	78%	0.781	78%	0.779	S	S	*	*				68.7	151.8	104.5	-147.2	9.5	0	0	0	124.1
244	L	32.6	Very low	31.7	Very low	125 Å²	125	142 Å²	142	65%	0.654	79%	0.787	S	S	*	*			trans	83.7	87.9	159.8	-56.6	-176.7	0	0	0	124.4
245	T	29.6	Very low	31.7	Very low	128 Å²	128	144.6 Å²	144.6	79%	0.785	79%	0.788	S	S	*	*				79	151.3	121	58.9	0	0	0	0	124.6
246	A	29.7	Very low	32.1	Very low	93 Å²	93	142.4 Å²	142.4	77%	0.769	78%	0.781	S	S	*	*			trans	80	131.7	159	0	0	0	0	0	118
247	Q	31.4	Very low	32.1	Very low	187 Å²	187	141.9 Å²	141.9	87%	0.874	78%	0.776	S	S	*	*			cis	-159.9	139.1	-8.3	-172.2	172.8	-28.9	0	0	111.7
248	E	32.2	Very low	33	Very low	141 Å²	141	139.3 Å²	139.3	66%	0.659	77%	0.769	S	S	*	*			trans	-64.1	150.4	169.6	-102.3	-79.7	123.7	0	0	112.3	Q250	E248-Q250 WeakPolarHBondContact OE2-CG 3.3Å; E248-Q250 PolarHBondContact OE2-N 3.28Å
249	P	39.7	Very low	33.4	Very low	109 Å²	109	140.6 Å²	140.6	71%	0.708	76%	0.763	S	S	*	*				-152.8	128.9	85.3	36.9	-16.3	0	0	0	118.8
250	Q	31.7	Very low	34.2	Very low	155 Å²	155	139.2 Å²	139.2	72%	0.724	75%	0.749	S	S	*	*				66.2	136	123.8	-61.4	-179.6	-16.3	0	0	123.3	E248	E248-Q250 WeakPolarHBondContact OE2-CG 3.3Å; E248-Q250 PolarHBondContact OE2-N 3.28Å
251	D	31	Very low	35.4	Very low	143 Å²	143	136.2 Å²	136.2	77%	0.765	74%	0.739	S	S	*	*			trans	66.5	74	147.9	-71.3	-12.6	0	0	0	121.2
252	L	31.9	Very low	37	Very low	176 Å²	176	131.8 Å²	131.8	92%	0.921	71%	0.712	S	S	*	*				-137.3	138.8	121.8	-78.4	-174.2	0	0	0	110.6
253	R	34.4	Very low	39	Very low	229 Å²	229	133.8 Å²	133.8	86%	0.864	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-85.3	138.9	-176.9	-49.3	-175.8	-163.8	172.9	5.2	112.7
254	P	33	Very low	41.3	Very low	125 Å²	125	127 Å²	127	81%	0.812	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-80	148.5	143.6	-16.1	32.7	0	0	0	110.9
255	L	30.7	Very low	43.1	Very low	138 Å²	138	130.7 Å²	130.7	72%	0.723	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-83.7	140.1	-179.6	-74	167.2	0	0	0	112.2	M257	L255-M257 HydrophobicContact CB-CE 4.37Å; L255-M257 PolarHBondContact O-N 3.07Å; L255-M257 VanDerWaalsContact O-N 3.13Å
256	H	39.3	Very low	44.8	Very low	160 Å²	160	130.8 Å²	130.8	74%	0.741	67%	0.673	S	S	*	*			trans	-66.4	104.4	162.8	174.7	95.9	0	0	0	109.1
257	M	33	Very low	46.5	Very low	137 Å²	137	128.7 Å²	128.7	68%	0.675	65%	0.652	S	S	*	*			trans	-101.8	99.8	170.5	-68.9	-74	87.6	0	0	109.1	L255 H259	L255-M257 HydrophobicContact CB-CE 4.37Å; L255-M257 PolarHBondContact O-N 3.07Å; L255-M257 VanDerWaalsContact O-N 3.13Å; M257-H259 PolarHBondContact O-N 3.33Å
258	S	48.9	Very low	48.3	Very low	95 Å²	95	126.3 Å²	126.3	66%	0.664	65%	0.645	S	S	*	*			trans	-73.7	100.3	179.4	52.9	0	0	0	0	111.1
259	H	41.9	Very low	50	Low	163 Å²	163	124.9 Å²	124.9	76%	0.755	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-96.6	137.2	157.4	-73.8	-96.7	0	0	0	108.9	M257 L261	M257-H259 PolarHBondContact O-N 3.33Å; H259-L261 PolarHBondContact O-N 2.79Å
260	G	46.3	Very low	51.5	Low	39 Å²	39	123.1 Å²	123.1	40%	0.402	63%	0.626	S	S	.	*	P	Polyproline II helix	trans	-68.8	122.2	-170.4	0	0	0	0	0	112.1	H262	G260-H262 PolarHBondContact O-CD2 3.18Å
261	L	59	Low	53.6	Low	122 Å²	122	117.7 Å²	117.7	64%	0.639	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-81.2	123	161.9	-66.4	-176.6	0	0	0	108.2	H259 V270	H259-L261 PolarHBondContact O-N 2.79Å; L261-V270 HydrophobicContact CB-CG1 3.74Å; L261-V270 HydrophobicContact CD1-CG1 4.14Å; L261-V270 HydrophobicContact CD2-CG1 4.38Å; L261-V270 HydrophobicContact CG-CG1 4.31Å
262	H	64	Low	55.5	Low	67 Å²	67	115.6 Å²	115.6	31%	0.31	59%	0.594	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.6	104.3	-171	-74.9	-71.2	0	0	0	110.4	G260 F271 V274 L277	G260-H262 PolarHBondContact O-CD2 3.18Å; H262-F271 PolarHBondContact N-O 3.07Å; H262-F271 PolarHBondContact O-N 2.75Å; H262-V274 VanDerWaalsContact CD2-CG2 3.49Å; H262-V274 WeakPolarHBondContact CD2-CG2 3.47Å; H262-V274 VanDerWaalsContact NE2-CG2 3.34Å; H262-V274 WeakPolarHBondContact NE2-CG2 3.04Å; H262-L277 HydrophobicContact CB-CB 4.15Å; H262-L277 HydrophobicContact CB-CD2 3.83Å
263	E	72.3	Confident	57.4	Low	131 Å²	131	110.4 Å²	110.4	61%	0.612	57%	0.567	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.8	134.2	-173.2	-49.6	-171.1	140.2	0	0	112	K265 V270	E263-K265 PolarHBondContact O-N 3.37Å; E263-V270 HydrophobicContact CG-CG1 4.32Å; E263-V270 HydrophobicContact CG-CG2 4.13Å
264	C	74.8	Confident	59.4	Low	4 Å²	4	103.1 Å²	103.1	3%	0.027	55%	0.548	C	S	.	.			trans	-79.3	109.8	175.8	-174	0	0	0	0	111.8	E266 C267 D268 Q269 F271 L277 H280 H284	C264-E266 PolarHBondContact O-N 3.18Å; C264-C267 PolarHBondContact O-N 2.91Å; C264-C267 VanDerWaalsContact O-N 3.16Å; C264-D268 WeakPolarHBondContact O-CA 3.24Å; C264-D268 PolarHBondContact O-N 3.12Å; C264-Q269 HydrophobicContact CB-CB 4.44Å; C264-Q269 PolarHBondContact N-O 3.5Å; C264-F271 HydrophobicContact CB-CE2 4.12Å; C264-L277 HydrophobicContact CB-CD1 3.55Å; C264-H280 PolarHBondContact SG-CD2 3.42Å; C264-H280 PolarHBondContact SG-NE2 2.9Å; C264-H284 VanDerWaalsContact SG-CD2 3.6Å; C264-H284 PolarHBondContact SG-NE2 3.2Å
265	K	69.9	Low	61.3	Low	202 Å²	202	102.7 Å²	102.7	88%	0.878	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-4.1	178.5	-59.4	-179.9	-179.8	177.5	0	115.9	E263	E263-K265 PolarHBondContact O-N 3.37Å
266	E	65	Low	63.5	Low	131 Å²	131	98.5 Å²	98.5	61%	0.612	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.3	-9.9	-176.1	-63.8	-179.2	-104	0	0	113.4	C264 H284	C264-E266 PolarHBondContact O-N 3.18Å; E266-H284 IonicContact OE1-CD2 3.09Å; E266-H284 WeakPolarHBondContact OE2-CB 3.42Å; E266-H284 IonicContact OE2-CG 3.63Å
267	C	66.4	Low	65.3	Low	49 Å²	49	92.5 Å²	92.5	33%	0.331	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-157.6	16.3	175.1	76	0	0	0	0	116	C264 Q269 H280	C264-C267 PolarHBondContact O-N 2.91Å; C264-C267 VanDerWaalsContact O-N 3.16Å; C267-Q269 PolarHBondContact O-N 2.82Å; C267-Q269 VanDerWaalsContact SG-CG 3.53Å; C267-H280 PolarHBondContact SG-NE2 2.83Å
268	D	68.9	Low	67.1	Low	137 Å²	137	90.6 Å²	90.6	73%	0.733	48%	0.48	S	S	*	.			trans	54.8	24.2	174.2	-47.6	-34.6	0	0	0	114.9	C264	C264-D268 WeakPolarHBondContact O-CA 3.24Å; C264-D268 PolarHBondContact O-N 3.12Å
269	Q	67.7	Low	68.2	Low	110 Å²	110	89.7 Å²	89.7	51%	0.514	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-78.8	123.7	171.2	-70.7	-63.1	-63.2	0	0	109.9	C264 C267 F271	C264-Q269 HydrophobicContact CB-CB 4.44Å; C264-Q269 PolarHBondContact N-O 3.5Å; C267-Q269 PolarHBondContact O-N 2.82Å; C267-Q269 VanDerWaalsContact SG-CG 3.53Å; Q269-F271 HydrophobicContact CB-CD2 4.36Å; Q269-F271 HydrophobicContact CB-CE2 3.44Å; Q269-F271 VanDerWaalsContact CB-CE2 3.44Å; Q269-F271 HydrophobicContact CB-CZ 3.67Å; Q269-F271 HydrophobicContact CG-CZ 4.49Å; Q269-F271 WeakPolarHBondContact O-CD2 3.17Å; Q269-F271 WeakPolarHBondContact O-CE2 3.46Å
270	V	71.6	Confident	69.7	Low	72 Å²	72	83.5 Å²	83.5	44%	0.436	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	117.7	178.4	-172.2	0	0	0	0	109.2	L261 E263	L261-V270 HydrophobicContact CB-CG1 3.74Å; L261-V270 HydrophobicContact CD1-CG1 4.14Å; L261-V270 HydrophobicContact CD2-CG1 4.38Å; L261-V270 HydrophobicContact CG-CG1 4.31Å; E263-V270 HydrophobicContact CG-CG1 4.32Å; E263-V270 HydrophobicContact CG-CG2 4.13Å
271	F	75.4	Confident	70.6	Confident	42 Å²	42	83.7 Å²	83.7	18%	0.184	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	146.1	176.9	-63.3	-84.6	0	0	0	110.9	H262 C264 Q269 D273 L277 H280	H262-F271 PolarHBondContact N-O 3.07Å; H262-F271 PolarHBondContact O-N 2.75Å; C264-F271 HydrophobicContact CB-CE2 4.12Å; Q269-F271 HydrophobicContact CB-CD2 4.36Å; Q269-F271 HydrophobicContact CB-CE2 3.44Å; Q269-F271 VanDerWaalsContact CB-CE2 3.44Å; Q269-F271 HydrophobicContact CB-CZ 3.67Å; Q269-F271 HydrophobicContact CG-CZ 4.49Å; Q269-F271 WeakPolarHBondContact O-CD2 3.17Å; Q269-F271 WeakPolarHBondContact O-CE2 3.46Å; F271-D273 PolarHBondContact O-N 3.02Å; F271-L277 HydrophobicContact CB-CB 4.32Å; F271-L277 HydrophobicContact CD2-CB 4.14Å; F271-L277 HydrophobicContact CD2-CD1 3.96Å; F271-L277 HydrophobicContact CE2-CD1 4.26Å; F271-L277 HydrophobicContact CG-CB 4.43Å; F271-H280 HydrophobicContact CE1-CB 4.2Å; F271-H280 HydrophobicContact CE2-CB 3.93Å; F271-H280 AromaticContact CE2-CD2 3.3Å; F271-H280 WeakPolarHBondContact CE2-CD2 3.14Å; F271-H280 AromaticContact CE2-CG 3.59Å; F271-H280 AromaticContact CE2-NE2 3.99Å; F271-H280 HydrophobicContact CZ-CB 3.66Å; F271-H280 AromaticContact CZ-CD2 3.5Å; F271-H280 VanDerWaalsContact CZ-CD2 3.5Å; F271-H280 WeakPolarHBondContact CZ-CD2 3.46Å; F271-H280 AromaticContact CZ-CG 3.32Å; F271-H280 AromaticContact CZ-ND1 3.8Å
272	P	71	Confident	70.9	Confident	98 Å²	98	80.7 Å²	80.7	64%	0.636	42%	0.417	S	S	*	.	S	Bend	trans	-75.3	-2.3	178.7	32.6	-36.7	0	0	0	113.8
273	D	72.1	Confident	70.7	Confident	68 Å²	68	80.3 Å²	80.3	36%	0.364	42%	0.422	S	S	.	.	S	Bend	trans	-158.1	152.7	-171.1	158.7	58.8	0	0	0	111.5	F271 Q275 S276 L277	F271-D273 PolarHBondContact O-N 3.02Å; D273-Q275 VanDerWaalsContact CG-N 3.34Å; D273-Q275 PolarHBondContact OD1-N 2.99Å; D273-Q275 WeakPolarHBondContact OD2-CA 3.45Å; D273-Q275 WeakPolarHBondContact OD2-CB 3.46Å; D273-Q275 PolarHBondContact OD2-N 3.44Å; D273-S276 PolarHBondContact OD2-N 3.27Å; D273-S276 PolarHBondContact OD2-OG 3Å; D273-L277 PolarHBondContact O-N 3.45Å; D273-L277 VanDerWaalsContact O-N 3.14Å
274	V	76.4	Confident	70.2	Confident	76 Å²	76	77 Å²	77	46%	0.461	41%	0.406	S	S	.	.	H	α-helix	trans	-67.2	-42.8	178.3	-175.4	0	0	0	0	111.8	H262 S276 L277 E278	H262-V274 VanDerWaalsContact CD2-CG2 3.49Å; H262-V274 WeakPolarHBondContact CD2-CG2 3.47Å; H262-V274 VanDerWaalsContact NE2-CG2 3.34Å; H262-V274 WeakPolarHBondContact NE2-CG2 3.04Å; V274-S276 PolarHBondContact O-N 2.98Å; V274-L277 CarbonylContact O-C 3.56Å; V274-L277 PolarHBondContact O-N 3.45Å; V274-L277 VanDerWaalsContact O-N 3.1Å; V274-E278 WeakPolarHBondContact O-CB 3.33Å; V274-E278 PolarHBondContact O-N 2.93Å
275	Q	73.4	Confident	69.4	Low	116 Å²	116	79.7 Å²	79.7	54%	0.542	43%	0.425	S	S	.	.	H	α-helix	trans	-62.8	-36.9	-180	-152.2	92.9	68.3	0	0	110.6	D273 E278 N279	D273-Q275 VanDerWaalsContact CG-N 3.34Å; D273-Q275 PolarHBondContact OD1-N 2.99Å; D273-Q275 WeakPolarHBondContact OD2-CA 3.45Å; D273-Q275 WeakPolarHBondContact OD2-CB 3.46Å; D273-Q275 PolarHBondContact OD2-N 3.44Å; Q275-E278 PolarHBondContact NE2-OE2 2.18Å; Q275-E278 PolarHBondContact O-N 3.4Å; Q275-N279 WeakPolarHBondContact O-CB 3.34Å; Q275-N279 PolarHBondContact O-N 3.29Å; Q275-N279 PolarHBondContact O-ND2 2.72Å
276	S	76.3	Confident	68.8	Low	50 Å²	50	76.7 Å²	76.7	35%	0.35	41%	0.414	S	S	.	.	H	α-helix	trans	-65.5	-41.2	172.9	-64.1	0	0	0	0	112.7	D273 V274 H280	D273-S276 PolarHBondContact OD2-N 3.27Å; D273-S276 PolarHBondContact OD2-OG 3Å; V274-S276 PolarHBondContact O-N 2.98Å; S276-H280 WeakPolarHBondContact O-CB 3.3Å; S276-H280 PolarHBondContact O-N 3.14Å
277	L	77.6	Confident	68.3	Low	33 Å²	33	78.3 Å²	78.3	17%	0.173	42%	0.422	C	S	.	.	H	α-helix	trans	-66.1	-38.7	172.8	173.1	60.5	0	0	0	112.2	H262 C264 F271 D273 V274 H280 S281	H262-L277 HydrophobicContact CB-CB 4.15Å; H262-L277 HydrophobicContact CB-CD2 3.83Å; C264-L277 HydrophobicContact CB-CD1 3.55Å; F271-L277 HydrophobicContact CB-CB 4.32Å; F271-L277 HydrophobicContact CD2-CB 4.14Å; F271-L277 HydrophobicContact CD2-CD1 3.96Å; F271-L277 HydrophobicContact CE2-CD1 4.26Å; F271-L277 HydrophobicContact CG-CB 4.43Å; D273-L277 PolarHBondContact O-N 3.45Å; D273-L277 VanDerWaalsContact O-N 3.14Å; V274-L277 CarbonylContact O-C 3.56Å; V274-L277 PolarHBondContact O-N 3.45Å; V274-L277 VanDerWaalsContact O-N 3.1Å; L277-H280 CarbonylContact O-C 2.97Å; L277-H280 WeakPolarHBondContact O-CA 3.41Å; L277-H280 WeakPolarHBondContact O-CB 3.43Å; L277-H280 PolarHBondContact O-N 3.41Å; L277-H280 VanDerWaalsContact O-N 3.16Å; L277-S281 PolarHBondContact O-N 3.28Å
278	E	70.9	Confident	68.1	Low	97 Å²	97	82.5 Å²	82.5	45%	0.453	43%	0.43	S	S	.	.	H	α-helix	trans	-70.5	-45	-178.7	-174.5	174	-136.8	0	0	112.1	V274 Q275 H280 S281 Q282	V274-E278 WeakPolarHBondContact O-CB 3.33Å; V274-E278 PolarHBondContact O-N 2.93Å; Q275-E278 PolarHBondContact NE2-OE2 2.18Å; Q275-E278 PolarHBondContact O-N 3.4Å; E278-H280 PolarHBondContact O-N 2.82Å; E278-H280 VanDerWaalsContact O-N 3.12Å; E278-S281 PolarHBondContact O-N 2.79Å; E278-S281 VanDerWaalsContact O-N 3.17Å; E278-S281 PolarHBondContact O-OG 2.77Å; E278-Q282 VanDerWaalsContact O-CG 3.32Å; E278-Q282 WeakPolarHBondContact O-CG 3.35Å; E278-Q282 PolarHBondContact O-N 3.28Å
279	N	70.6	Confident	68.1	Low	76 Å²	76	81.8 Å²	81.8	41%	0.406	42%	0.423	S	S	.	.	H	α-helix	trans	-60	-21.9	170.2	-75.9	-61.7	0	0	0	112.6	Q275	Q275-N279 WeakPolarHBondContact O-CB 3.34Å; Q275-N279 PolarHBondContact O-N 3.29Å; Q275-N279 PolarHBondContact O-ND2 2.72Å
280	H	73.3	Confident	68.3	Low	34 Å²	34	80.3 Å²	80.3	16%	0.157	41%	0.413	C	S	.	.	H	α-helix	trans	-88.5	-34.8	174.2	177.3	66	0	0	0	113.7	C264 C267 F271 S276 L277 E278 Q282 S283 H284	C264-H280 PolarHBondContact SG-CD2 3.42Å; C264-H280 PolarHBondContact SG-NE2 2.9Å; C267-H280 PolarHBondContact SG-NE2 2.83Å; F271-H280 HydrophobicContact CE1-CB 4.2Å; F271-H280 HydrophobicContact CE2-CB 3.93Å; F271-H280 AromaticContact CE2-CD2 3.3Å; F271-H280 WeakPolarHBondContact CE2-CD2 3.14Å; F271-H280 AromaticContact CE2-CG 3.59Å; F271-H280 AromaticContact CE2-NE2 3.99Å; F271-H280 HydrophobicContact CZ-CB 3.66Å; F271-H280 AromaticContact CZ-CD2 3.5Å; F271-H280 VanDerWaalsContact CZ-CD2 3.5Å; F271-H280 WeakPolarHBondContact CZ-CD2 3.46Å; F271-H280 AromaticContact CZ-CG 3.32Å; F271-H280 AromaticContact CZ-ND1 3.8Å; S276-H280 WeakPolarHBondContact O-CB 3.3Å; S276-H280 PolarHBondContact O-N 3.14Å; L277-H280 CarbonylContact O-C 2.97Å; L277-H280 WeakPolarHBondContact O-CA 3.41Å; L277-H280 WeakPolarHBondContact O-CB 3.43Å; L277-H280 PolarHBondContact O-N 3.41Å; L277-H280 VanDerWaalsContact O-N 3.16Å; E278-H280 PolarHBondContact O-N 2.82Å; E278-H280 VanDerWaalsContact O-N 3.12Å; H280-Q282 VanDerWaalsContact C-N 3.26Å; H280-Q282 PolarHBondContact O-N 2.87Å; H280-S283 PolarHBondContact ND1-OG 2.89Å; H280-S283 WeakPolarHBondContact O-CA 2.75Å; H280-S283 VanDerWaalsContact O-CB 3.28Å; H280-S283 WeakPolarHBondContact O-CB 3.46Å; H280-S283 PolarHBondContact O-N 3.11Å; H280-S283 PolarHBondContact O-OG 2.89Å; H280-H284 AromaticContact CD2-NE2 3.79Å; H280-H284 AromaticContact CE1-NE2 3.59Å; H280-H284 AromaticContact NE2-CD2 3.97Å; H280-H284 AromaticContact NE2-CE1 3.85Å; H280-H284 AromaticContact NE2-NE2 3.05Å; H280-H284 PolarHBondContact NE2-NE2 3.02Å
281	S	65.6	Low	68.2	Low	42 Å²	42	83.6 Å²	83.6	29%	0.294	42%	0.421	S	S	.	.	H	α-helix	trans	-67.8	-28.6	172.2	64.4	0	0	0	0	111.7	L277 E278 S283 H284 S285	L277-S281 PolarHBondContact O-N 3.28Å; E278-S281 PolarHBondContact O-N 2.79Å; E278-S281 VanDerWaalsContact O-N 3.17Å; E278-S281 PolarHBondContact O-OG 2.77Å; S281-S283 PolarHBondContact O-N 3.13Å; S281-H284 PolarHBondContact O-N 2.59Å; S281-S285 PolarHBondContact O-N 2.7Å
282	Q	66.4	Low	68.4	Low	60 Å²	60	82 Å²	82	28%	0.28	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-0.5	162.4	-67	170.9	25.6	0	0	114.8	E278 H280 N300	E278-Q282 VanDerWaalsContact O-CG 3.32Å; E278-Q282 WeakPolarHBondContact O-CG 3.35Å; E278-Q282 PolarHBondContact O-N 3.28Å; H280-Q282 VanDerWaalsContact C-N 3.26Å; H280-Q282 PolarHBondContact O-N 2.87Å; Q282-N300 WeakPolarHBondContact O-CB 3.27Å; Q282-N300 PolarHBondContact O-ND2 3.05Å; Q282-N300 VanDerWaalsContact O-ND2 3.12Å
283	S	60	Low	68.6	Low	59 Å²	59	84 Å²	84	41%	0.413	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-13.4	168.3	79.8	0	0	0	0	113.9	H280 S281	H280-S283 PolarHBondContact ND1-OG 2.89Å; H280-S283 WeakPolarHBondContact O-CA 2.75Å; H280-S283 VanDerWaalsContact O-CB 3.28Å; H280-S283 WeakPolarHBondContact O-CB 3.46Å; H280-S283 PolarHBondContact O-N 3.11Å; H280-S283 PolarHBondContact O-OG 2.89Å; S281-S283 PolarHBondContact O-N 3.13Å
284	H	61.1	Low	68.3	Low	60 Å²	60	87.2 Å²	87.2	28%	0.278	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-31.7	171.2	-56.6	-58	0	0	0	112.3	C264 E266 H280 S281 E286	C264-H284 VanDerWaalsContact SG-CD2 3.6Å; C264-H284 PolarHBondContact SG-NE2 3.2Å; E266-H284 IonicContact OE1-CD2 3.09Å; E266-H284 WeakPolarHBondContact OE2-CB 3.42Å; E266-H284 IonicContact OE2-CG 3.63Å; H280-H284 AromaticContact CD2-NE2 3.79Å; H280-H284 AromaticContact CE1-NE2 3.59Å; H280-H284 AromaticContact NE2-CD2 3.97Å; H280-H284 AromaticContact NE2-CE1 3.85Å; H280-H284 AromaticContact NE2-NE2 3.05Å; H280-H284 PolarHBondContact NE2-NE2 3.02Å; S281-H284 PolarHBondContact O-N 2.59Å; H284-E286 PolarHBondContact O-N 3.11Å
285	S	58.3	Low	68.2	Low	61 Å²	61	85.1 Å²	85.1	43%	0.427	42%	0.422	S	S	.	.			trans	-63.2	131.9	175.8	67	0	0	0	0	112.1	S281 E287	S281-S285 PolarHBondContact O-N 2.7Å; S285-E287 VanDerWaalsContact C-N 3.29Å; S285-E287 PolarHBondContact O-N 3.34Å
286	E	56.3	Low	67.9	Low	140 Å²	140	86.4 Å²	86.4	65%	0.654	44%	0.44	S	S	*	.			trans	-81.1	-4.2	177.8	-94.4	-142.3	102.9	0	0	114.1	H284 R288	H284-E286 PolarHBondContact O-N 3.11Å; E286-R288 PolarHBondContact O-N 3.33Å; E286-R288 IonicContact OE1-CZ 3.77Å; E286-R288 IonicContact OE1-NH1 3.22Å; E286-R288 PolarHBondContact OE1-NH1 3.16Å; E286-R288 IonicContact OE1-NH2 3.8Å; E286-R288 PolarHBondContact OE1-NH2 3.34Å
287	E	54.4	Low	67.4	Low	165 Å²	165	89.6 Å²	89.6	77%	0.771	45%	0.448	S	S	*	.			trans	-71.6	90.3	175.2	-70.9	-155.4	104.4	0	0	111.4	S285 E289	S285-E287 VanDerWaalsContact C-N 3.29Å; S285-E287 PolarHBondContact O-N 3.34Å; E287-E289 VanDerWaalsContact C-N 3.31Å; E287-E289 PolarHBondContact O-N 3.47Å
288	R	62.5	Low	67.3	Low	136 Å²	136	89.6 Å²	89.6	51%	0.513	45%	0.453	S	S	.	.			trans	-78.5	78.2	176.3	-63.9	162.5	-173.3	113.8	8.3	109.8	E286 Y290 A298 F299	E286-R288 PolarHBondContact O-N 3.33Å; E286-R288 IonicContact OE1-CZ 3.77Å; E286-R288 IonicContact OE1-NH1 3.22Å; E286-R288 PolarHBondContact OE1-NH1 3.16Å; E286-R288 IonicContact OE1-NH2 3.8Å; E286-R288 PolarHBondContact OE1-NH2 3.34Å; R288-Y290 VanDerWaalsContact C-N 3.26Å; R288-Y290 PolarHBondContact O-N 2.82Å; R288-A298 HydrophobicContact CB-CB 3.47Å; R288-A298 VanDerWaalsContact CB-CB 3.47Å; R288-A298 VanDerWaalsContact O-CB 3.3Å; R288-A298 WeakPolarHBondContact O-CB 3.5Å; R288-F299 CarbonylContact C-O 3.53Å
289	E	70.4	Confident	67.5	Low	123 Å²	123	87.1 Å²	87.1	58%	0.575	44%	0.441	S	S	*	.			trans	-51.3	-42.1	-178	-59.7	178.5	165.8	0	0	113.5	E287 K291	E287-E289 VanDerWaalsContact C-N 3.31Å; E287-E289 PolarHBondContact O-N 3.47Å; E289-K291 PolarHBondContact O-N 3.04Å
290	Y	69.9	Low	67.6	Low	78 Å²	78	85.3 Å²	85.3	31%	0.306	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	73	-170.1	-58	-84.3	0	0	0	111.5	R288 A298 F299 N300 K302 L305	R288-Y290 VanDerWaalsContact C-N 3.26Å; R288-Y290 PolarHBondContact O-N 2.82Å; Y290-A298 WeakPolarHBondContact O-CA 3.04Å; Y290-F299 WeakPolarHBondContact CB-O 3.46Å; Y290-F299 PolarHBondContact N-O 2.98Å; Y290-F299 PolarHBondContact O-N 3.37Å; Y290-N300 VanDerWaalsContact CD2-O 3.29Å; Y290-N300 WeakPolarHBondContact CD2-O 3.43Å; Y290-N300 WeakPolarHBondContact CE2-O 3.26Å; Y290-K302 HydrophobicContact CD1-CB 3.81Å; Y290-K302 HydrophobicContact CD1-CG 4.18Å; Y290-K302 HydrophobicContact CE1-CB 3.64Å; Y290-K302 HydrophobicContact CE1-CD 4.4Å; Y290-K302 HydrophobicContact CE1-CG 4.07Å; Y290-K302 HydrophobicContact CG-CB 4.45Å; Y290-L305 HydrophobicContact CD1-CD2 4.49Å
291	K	71.2	Confident	67.6	Low	141 Å²	141	88.7 Å²	88.7	61%	0.613	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.5	146.7	170.2	61	177.2	175	-68.6	0	112.8	E289 A298 L305	E289-K291 PolarHBondContact O-N 3.04Å; K291-A298 HydrophobicContact CB-CB 4.11Å; K291-L305 WeakPolarHBondContact O-CD1 3.39Å; K291-L305 WeakPolarHBondContact O-CD2 3.46Å
292	C	79.9	Confident	68	Low	10 Å²	10	93.3 Å²	93.3	7%	0.068	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	119.3	174.6	178.2	0	0	0	0	111.3	Q294 C295 K297 L305 H312	C292-Q294 PolarHBondContact O-N 3.33Å; C292-C295 CarbonylContact O-C 3.4Å; C292-C295 PolarHBondContact O-N 3.33Å; C292-C295 VanDerWaalsContact O-N 3.15Å; C292-K297 VanDerWaalsContact CB-O 3.27Å; C292-K297 WeakPolarHBondContact CB-O 3.42Å; C292-K297 PolarHBondContact N-O 2.93Å; C292-L305 HydrophobicContact CB-CD1 3.64Å; C292-H312 VanDerWaalsContact SG-CD2 3.54Å; C292-H312 PolarHBondContact SG-NE2 2.83Å; C292-H312 VanDerWaalsContact SG-NE2 3.38Å
293	D	74.5	Confident	68.4	Low	140 Å²	140	94 Å²	94	75%	0.749	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-17.5	-174.4	-52.8	-55.1	0	0	0	114.1
294	Q	64.8	Low	69.1	Low	134 Å²	134	92.7 Å²	92.7	63%	0.626	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-7.2	177.4	-62	-161.9	35.2	0	0	115.3	C292 H312	C292-Q294 PolarHBondContact O-N 3.33Å; Q294-H312 HydrophobicContact CB-CB 4.35Å
295	C	74.7	Confident	69.9	Low	32 Å²	32	91 Å²	91	22%	0.216	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	156.6	173.2	87.4	0	0	0	0	112.4	C292 K297 H308	C292-C295 CarbonylContact O-C 3.4Å; C292-C295 PolarHBondContact O-N 3.33Å; C292-C295 VanDerWaalsContact O-N 3.15Å; C295-K297 PolarHBondContact O-N 3.02Å; C295-H308 PolarHBondContact SG-NE2 2.99Å
296	P	67.6	Low	70.6	Confident	143 Å²	143	92.2 Å²	92.2	93%	0.929	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	33.5	-172.9	33.4	-38.9	0	0	0	114.7
297	K	65.4	Low	71.4	Confident	118 Å²	118	92.2 Å²	92.2	51%	0.513	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	133.9	169.9	-65.2	176.6	-172.5	169	0	109.1	C292 C295 F299	C292-K297 VanDerWaalsContact CB-O 3.27Å; C292-K297 WeakPolarHBondContact CB-O 3.42Å; C292-K297 PolarHBondContact N-O 2.93Å; C295-K297 PolarHBondContact O-N 3.02Å; K297-F299 HydrophobicContact CB-CE2 3.8Å; K297-F299 HydrophobicContact CB-CZ 3.91Å; K297-F299 HydrophobicContact CD-CZ 4.32Å
298	A	76.1	Confident	72.3	Confident	32 Å²	32	85.3 Å²	85.3	26%	0.264	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	155.1	169.1	0	0	0	0	0	109.9	R288 Y290 K291	R288-A298 HydrophobicContact CB-CB 3.47Å; R288-A298 VanDerWaalsContact CB-CB 3.47Å; R288-A298 VanDerWaalsContact O-CB 3.3Å; R288-A298 WeakPolarHBondContact O-CB 3.5Å; Y290-A298 WeakPolarHBondContact O-CA 3.04Å; K291-A298 HydrophobicContact CB-CB 4.11Å
299	F	74.8	Confident	72.8	Confident	46 Å²	46	83 Å²	83	20%	0.202	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	155.7	-173.3	-57.7	-92.3	0	0	0	109.7	R288 Y290 K297 N304 L305 H308	R288-F299 CarbonylContact C-O 3.53Å; Y290-F299 WeakPolarHBondContact CB-O 3.46Å; Y290-F299 PolarHBondContact N-O 2.98Å; Y290-F299 PolarHBondContact O-N 3.37Å; K297-F299 HydrophobicContact CB-CE2 3.8Å; K297-F299 HydrophobicContact CB-CZ 3.91Å; K297-F299 HydrophobicContact CD-CZ 4.32Å; F299-N304 HydrophobicContact CB-CB 3.88Å; F299-N304 HydrophobicContact CD1-CB 3.89Å; F299-N304 HydrophobicContact CG-CB 4.09Å; F299-L305 HydrophobicContact CD2-CB 4.22Å; F299-L305 HydrophobicContact CD2-CD1 4.27Å; F299-H308 HydrophobicContact CE1-CB 4.28Å; F299-H308 HydrophobicContact CE2-CB 3.83Å; F299-H308 AromaticContact CE2-CD2 3.31Å; F299-H308 WeakPolarHBondContact CE2-CD2 3.41Å; F299-H308 AromaticContact CE2-CG 3.72Å; F299-H308 HydrophobicContact CZ-CB 3.61Å; F299-H308 AromaticContact CZ-CD2 3.44Å; F299-H308 VanDerWaalsContact CZ-CD2 3.44Å; F299-H308 WeakPolarHBondContact CZ-CD2 3.37Å; F299-H308 AromaticContact CZ-CG 3.46Å; F299-H308 VanDerWaalsContact CZ-CG 3.46Å
300	N	73.1	Confident	72.6	Confident	38 Å²	38	80.1 Å²	80.1	20%	0.203	40%	0.395	C	S	.	.	S	Bend	trans	-77.4	-24	175.6	66.4	-27.8	0	0	0	113.2	Q282 Y290 N304	Q282-N300 WeakPolarHBondContact O-CB 3.27Å; Q282-N300 PolarHBondContact O-ND2 3.05Å; Q282-N300 VanDerWaalsContact O-ND2 3.12Å; Y290-N300 VanDerWaalsContact CD2-O 3.29Å; Y290-N300 WeakPolarHBondContact CD2-O 3.43Å; Y290-N300 WeakPolarHBondContact CE2-O 3.26Å; N300-N304 PolarHBondContact OD1-ND2 3.02Å
301	W	73.5	Confident	72.3	Confident	105 Å²	105	79.4 Å²	79.4	40%	0.398	40%	0.401	S	S	.	.	S	Bend	trans	-126.1	140.3	-178.2	-56.9	-33.3	0	0	0	113.2	S303 N304 L305	W301-S303 VanDerWaalsContact C-N 3.25Å; W301-S303 PolarHBondContact O-N 2.86Å; W301-N304 HydrophobicContact CB-CB 4.48Å; W301-N304 VanDerWaalsContact CE3-ND2 3.31Å; W301-N304 WeakPolarHBondContact O-CA 3.43Å; W301-N304 WeakPolarHBondContact O-CB 3.29Å; W301-N304 PolarHBondContact O-N 3.23Å; W301-L305 PolarHBondContact O-N 3.23Å; W301-L305 VanDerWaalsContact O-N 3.1Å
302	K	73	Confident	72.2	Confident	139 Å²	139	75.4 Å²	75.4	60%	0.604	38%	0.384	S	S	*	.	H	α-helix	trans	-52.8	-38.7	175	-166.8	175.7	-179.5	179.2	0	113.2	Y290 N304 L305 I306	Y290-K302 HydrophobicContact CD1-CB 3.81Å; Y290-K302 HydrophobicContact CD1-CG 4.18Å; Y290-K302 HydrophobicContact CE1-CB 3.64Å; Y290-K302 HydrophobicContact CE1-CD 4.4Å; Y290-K302 HydrophobicContact CE1-CG 4.07Å; Y290-K302 HydrophobicContact CG-CB 4.45Å; K302-N304 PolarHBondContact O-N 3.43Å; K302-L305 PolarHBondContact O-N 3.49Å; K302-I306 HydrophobicContact CG-CD1 4.11Å; K302-I306 VanDerWaalsContact O-CG1 3.32Å; K302-I306 WeakPolarHBondContact O-CG1 3.22Å; K302-I306 PolarHBondContact O-N 3.43Å
303	S	74.3	Confident	71.5	Confident	75 Å²	75	79 Å²	79	52%	0.524	40%	0.403	S	S	.	.	H	α-helix	trans	-66	-34.5	176.5	58.9	0	0	0	0	113.2	W301 R307	W301-S303 VanDerWaalsContact C-N 3.25Å; W301-S303 PolarHBondContact O-N 2.86Å; S303-R307 WeakPolarHBondContact O-CB 3.46Å; S303-R307 PolarHBondContact O-N 3.19Å; S303-R307 VanDerWaalsContact O-N 3.07Å
304	N	74.8	Confident	70.6	Confident	31 Å²	31	76.9 Å²	76.9	17%	0.166	40%	0.399	C	S	.	.	H	α-helix	trans	-69.7	-41.7	173.2	-77.7	-35.6	0	0	0	111.3	F299 N300 W301 K302 R307 H308	F299-N304 HydrophobicContact CB-CB 3.88Å; F299-N304 HydrophobicContact CD1-CB 3.89Å; F299-N304 HydrophobicContact CG-CB 4.09Å; N300-N304 PolarHBondContact OD1-ND2 3.02Å; W301-N304 HydrophobicContact CB-CB 4.48Å; W301-N304 VanDerWaalsContact CE3-ND2 3.31Å; W301-N304 WeakPolarHBondContact O-CA 3.43Å; W301-N304 WeakPolarHBondContact O-CB 3.29Å; W301-N304 PolarHBondContact O-N 3.23Å; K302-N304 PolarHBondContact O-N 3.43Å; N304-R307 PolarHBondContact OD1-NH2 2.95Å; N304-H308 WeakPolarHBondContact O-CB 3.43Å; N304-H308 PolarHBondContact O-N 2.96Å
305	L	79.3	Confident	70.3	Confident	23 Å²	23	72.1 Å²	72.1	12%	0.12	39%	0.386	C	S	.	.	H	α-helix	trans	-61.4	-50.5	173.1	171.3	60.9	0	0	0	111.6	Y290 K291 C292 F299 W301 K302 R307 H308 Q309	Y290-L305 HydrophobicContact CD1-CD2 4.49Å; K291-L305 WeakPolarHBondContact O-CD1 3.39Å; K291-L305 WeakPolarHBondContact O-CD2 3.46Å; C292-L305 HydrophobicContact CB-CD1 3.64Å; F299-L305 HydrophobicContact CD2-CB 4.22Å; F299-L305 HydrophobicContact CD2-CD1 4.27Å; W301-L305 PolarHBondContact O-N 3.23Å; W301-L305 VanDerWaalsContact O-N 3.1Å; K302-L305 PolarHBondContact O-N 3.49Å; L305-R307 PolarHBondContact O-N 3.34Å; L305-H308 CarbonylContact O-C 3.54Å; L305-H308 WeakPolarHBondContact O-CA 3.49Å; L305-H308 WeakPolarHBondContact O-CB 3.48Å; L305-H308 PolarHBondContact O-N 3.48Å; L305-Q309 WeakPolarHBondContact O-CB 3.32Å; L305-Q309 PolarHBondContact O-N 2.75Å
306	I	72.6	Confident	69.5	Low	88 Å²	88	79 Å²	79	45%	0.451	41%	0.412	S	S	.	.	H	α-helix	trans	-57.6	-48.8	179.5	-69.3	164.2	0	0	0	110.4	K302 H308 Q309 M310	K302-I306 HydrophobicContact CG-CD1 4.11Å; K302-I306 VanDerWaalsContact O-CG1 3.32Å; K302-I306 WeakPolarHBondContact O-CG1 3.22Å; K302-I306 PolarHBondContact O-N 3.43Å; I306-H308 PolarHBondContact O-N 3.2Å; I306-Q309 WeakPolarHBondContact O-CB 3.33Å; I306-Q309 PolarHBondContact O-N 2.98Å; I306-M310 WeakPolarHBondContact O-CG 3.35Å; I306-M310 PolarHBondContact O-N 2.95Å
307	R	72.1	Confident	69.4	Low	139 Å²	139	75.7 Å²	75.7	53%	0.525	38%	0.384	S	S	.	.	H	α-helix	trans	-60.4	-28.8	176	179.3	168.5	57.7	-173.9	-5.7	113.1	S303 N304 L305	S303-R307 WeakPolarHBondContact O-CB 3.46Å; S303-R307 PolarHBondContact O-N 3.19Å; S303-R307 VanDerWaalsContact O-N 3.07Å; N304-R307 PolarHBondContact OD1-NH2 2.95Å; L305-R307 PolarHBondContact O-N 3.34Å
308	H	74.5	Confident	69.6	Low	21 Å²	21	74.9 Å²	74.9	10%	0.097	38%	0.378	C	S	.	.	H	α-helix	trans	-79	-34.8	172.2	179.9	43	0	0	0	112.9	C295 F299 N304 L305 I306 M310 S311 H312	C295-H308 PolarHBondContact SG-NE2 2.99Å; F299-H308 HydrophobicContact CE1-CB 4.28Å; F299-H308 HydrophobicContact CE2-CB 3.83Å; F299-H308 AromaticContact CE2-CD2 3.31Å; F299-H308 WeakPolarHBondContact CE2-CD2 3.41Å; F299-H308 AromaticContact CE2-CG 3.72Å; F299-H308 HydrophobicContact CZ-CB 3.61Å; F299-H308 AromaticContact CZ-CD2 3.44Å; F299-H308 VanDerWaalsContact CZ-CD2 3.44Å; F299-H308 WeakPolarHBondContact CZ-CD2 3.37Å; F299-H308 AromaticContact CZ-CG 3.46Å; F299-H308 VanDerWaalsContact CZ-CG 3.46Å; N304-H308 WeakPolarHBondContact O-CB 3.43Å; N304-H308 PolarHBondContact O-N 2.96Å; L305-H308 CarbonylContact O-C 3.54Å; L305-H308 WeakPolarHBondContact O-CA 3.49Å; L305-H308 WeakPolarHBondContact O-CB 3.48Å; L305-H308 PolarHBondContact O-N 3.48Å; I306-H308 PolarHBondContact O-N 3.2Å; H308-M310 VanDerWaalsContact C-N 3.3Å; H308-M310 PolarHBondContact O-N 3.29Å; H308-S311 PolarHBondContact ND1-OG 2.95Å; H308-S311 WeakPolarHBondContact O-CA 3.23Å; H308-S311 WeakPolarHBondContact O-CB 3.27Å; H308-S311 PolarHBondContact O-N 2.65Å; H308-S311 PolarHBondContact O-OG 3.5Å; H308-H312 AromaticContact CD2-NE2 3.83Å; H308-H312 AromaticContact CE1-CD2 3.89Å; H308-H312 AromaticContact CE1-CE1 3.91Å; H308-H312 AromaticContact CE1-NE2 3.2Å; H308-H312 PolarHBondContact CE1-NE2 3.15Å; H308-H312 AromaticContact NE2-CD2 3.78Å; H308-H312 AromaticContact NE2-CE1 3.91Å; H308-H312 AromaticContact NE2-NE2 2.96Å; H308-H312 PolarHBondContact NE2-NE2 3.39Å
309	Q	71.8	Confident	69.5	Low	87 Å²	87	79.6 Å²	79.6	41%	0.407	40%	0.395	S	S	.	.	H	α-helix	trans	-64.6	-36	175.6	-166.1	167.9	-1.6	0	0	111.2	L305 I306 S311 H312 D313	L305-Q309 WeakPolarHBondContact O-CB 3.32Å; L305-Q309 PolarHBondContact O-N 2.75Å; I306-Q309 WeakPolarHBondContact O-CB 3.33Å; I306-Q309 PolarHBondContact O-N 2.98Å; Q309-S311 PolarHBondContact O-N 3.49Å; Q309-H312 PolarHBondContact O-N 3.26Å; Q309-D313 PolarHBondContact O-N 3.26Å
310	M	67.4	Low	69.6	Low	63 Å²	63	77.6 Å²	77.6	31%	0.31	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	3.3	166.8	-56.4	-51	-56.5	0	0	114.7	I306 H308 T329	I306-M310 WeakPolarHBondContact O-CG 3.35Å; I306-M310 PolarHBondContact O-N 2.95Å; H308-M310 VanDerWaalsContact C-N 3.3Å; H308-M310 PolarHBondContact O-N 3.29Å; M310-T329 WeakPolarHBondContact O-CB 3.38Å
311	S	63.4	Low	69.7	Low	62 Å²	62	85 Å²	85	43%	0.434	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-4.1	167.6	73.2	0	0	0	0	114	H308 Q309	H308-S311 PolarHBondContact ND1-OG 2.95Å; H308-S311 WeakPolarHBondContact O-CA 3.23Å; H308-S311 WeakPolarHBondContact O-CB 3.27Å; H308-S311 PolarHBondContact O-N 2.65Å; H308-S311 PolarHBondContact O-OG 3.5Å; Q309-S311 PolarHBondContact O-N 3.49Å
312	H	67.8	Low	69.1	Low	57 Å²	57	84.9 Å²	84.9	26%	0.264	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-39.5	166.8	-63.2	-71	0	0	0	111.4	C292 Q294 H308 Q309 S314	C292-H312 VanDerWaalsContact SG-CD2 3.54Å; C292-H312 PolarHBondContact SG-NE2 2.83Å; C292-H312 VanDerWaalsContact SG-NE2 3.38Å; Q294-H312 HydrophobicContact CB-CB 4.35Å; H308-H312 AromaticContact CD2-NE2 3.83Å; H308-H312 AromaticContact CE1-CD2 3.89Å; H308-H312 AromaticContact CE1-CE1 3.91Å; H308-H312 AromaticContact CE1-NE2 3.2Å; H308-H312 PolarHBondContact CE1-NE2 3.15Å; H308-H312 AromaticContact NE2-CD2 3.78Å; H308-H312 AromaticContact NE2-CE1 3.91Å; H308-H312 AromaticContact NE2-NE2 2.96Å; H308-H312 PolarHBondContact NE2-NE2 3.39Å; Q309-H312 PolarHBondContact O-N 3.26Å; H312-S314 PolarHBondContact O-N 3.12Å
313	D	66.7	Low	69	Low	85 Å²	85	80 Å²	80	46%	0.455	41%	0.41	S	S	.	.			trans	-66.3	121.6	169.6	-166.4	-6.7	0	0	0	109.5	Q309 G315	Q309-D313 PolarHBondContact O-N 3.26Å; D313-G315 PolarHBondContact OD1-N 3.24Å
314	S	54.9	Low	68.2	Low	97 Å²	97	81.9 Å²	81.9	68%	0.678	42%	0.423	S	S	*	.			trans	-94.5	-2.4	178.6	57	0	0	0	0	112.8	H312 H317	H312-S314 PolarHBondContact O-N 3.12Å; S314-H317 PolarHBondContact O-CE1 3.16Å; S314-H317 PolarHBondContact O-ND1 2.73Å
315	G	58.8	Low	67.2	Low	33 Å²	33	88.7 Å²	88.7	34%	0.34	45%	0.451	S	S	.	.	S	Bend	trans	-77.2	150.2	165.9	0	0	0	0	0	112.3	D313 H317	D313-G315 PolarHBondContact OD1-N 3.24Å; G315-H317 PolarHBondContact O-N 3.44Å
316	K	57.9	Low	66.2	Low	177 Å²	177	92 Å²	92	77%	0.77	47%	0.467	S	S	*	.			trans	57.6	47	174.1	-54.3	-178.4	-177.1	178.9	0	115
317	H	64.9	Low	65.8	Low	74 Å²	74	91.6 Å²	91.6	34%	0.343	47%	0.468	S	S	.	.			trans	-68.4	139.1	159.5	-64.4	95.6	0	0	0	110.8	S314 G315 E319 V327 F328	S314-H317 PolarHBondContact O-CE1 3.16Å; S314-H317 PolarHBondContact O-ND1 2.73Å; G315-H317 PolarHBondContact O-N 3.44Å; H317-E319 PolarHBondContact O-N 2.9Å; H317-V327 HydrophobicContact CB-CG1 3.32Å; H317-V327 VanDerWaalsContact CG-CG1 3.41Å; H317-F328 CarbonylContact C-O 3.55Å; H317-F328 WeakPolarHBondContact CA-O 3.45Å
318	Y	69.9	Low	65.9	Low	100 Å²	100	86.4 Å²	86.4	39%	0.392	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	106.8	175.3	-62.3	-87.8	0	0	0	109.6	F328 P331	Y318-F328 PolarHBondContact N-O 2.8Å; Y318-F328 WeakPolarHBondContact O-CB 3.32Å; Y318-F328 WeakPolarHBondContact O-CD2 3.15Å; Y318-F328 PolarHBondContact O-N 2.91Å; Y318-P331 HydrophobicContact CD1-CG 4.36Å; Y318-P331 HydrophobicContact CD2-CG 4.25Å; Y318-P331 HydrophobicContact CE1-CG 3.91Å; Y318-P331 HydrophobicContact CE2-CG 3.8Å
319	E	73.3	Confident	65.6	Low	132 Å²	132	88.3 Å²	88.3	62%	0.617	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	153.8	176.1	-57.9	-154.8	159.3	0	0	111.8	H317 V327 L334	H317-E319 PolarHBondContact O-N 2.9Å; E319-V327 HydrophobicContact CG-CG2 4.38Å; E319-L334 WeakPolarHBondContact O-CD2 3.31Å
320	C	77.9	Confident	65.6	Low	4 Å²	4	85.2 Å²	85.2	3%	0.027	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	114.2	171	-174.5	0	0	0	0	110.6	N322 C323 F328 L334 H337 H342	C320-N322 VanDerWaalsContact C-N 3.26Å; C320-N322 PolarHBondContact O-N 3.44Å; C320-C323 HydrophobicContact CB-CB 3.98Å; C320-C323 CarbonylContact O-C 3.53Å; C320-C323 WeakPolarHBondContact O-CA 3.46Å; C320-C323 PolarHBondContact O-N 2.68Å; C320-F328 HydrophobicContact CB-CE2 4.49Å; C320-L334 HydrophobicContact CB-CD1 3.56Å; C320-H337 PolarHBondContact SG-CD2 3.18Å; C320-H342 PolarHBondContact SG-CD2 3.25Å; C320-H342 PolarHBondContact SG-NE2 3.22Å
321	E	74.1	Confident	65.9	Low	194 Å²	194	85.4 Å²	85.4	91%	0.907	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-41.8	177.4	-58.5	-179	150.8	0	0	112.3	C323	E321-C323 PolarHBondContact O-N 3.17Å
322	N	62.8	Low	66.2	Low	102 Å²	102	85.9 Å²	85.9	55%	0.545	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-4.3	176.3	-46.1	104.3	0	0	0	113.6	C320 H342	C320-N322 VanDerWaalsContact C-N 3.26Å; C320-N322 PolarHBondContact O-N 3.44Å; N322-H342 HydrophobicContact CB-CB 4.24Å; N322-H342 WeakPolarHBondContact CB-ND1 3.31Å; N322-H342 PolarHBondContact O-CE1 2.9Å
323	C	70.7	Confident	66.5	Low	35 Å²	35	85.4 Å²	85.4	24%	0.236	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	87.4	-172.6	-135.5	0	0	0	0	114.2	C320 E321 K325 Q326 H337 H342	C320-C323 HydrophobicContact CB-CB 3.98Å; C320-C323 CarbonylContact O-C 3.53Å; C320-C323 WeakPolarHBondContact O-CA 3.46Å; C320-C323 PolarHBondContact O-N 2.68Å; E321-C323 PolarHBondContact O-N 3.17Å; C323-K325 PolarHBondContact O-N 2.86Å; C323-Q326 PolarHBondContact O-N 2.77Å; C323-H337 WeakPolarHBondContact CB-NE2 3.4Å; C323-H342 WeakPolarHBondContact CB-CE1 3.48Å; C323-H342 WeakPolarHBondContact CB-NE2 3.47Å; C323-H342 PolarHBondContact SG-CE1 3.44Å
324	S	57	Low	67	Low	115 Å²	115	82.5 Å²	82.5	80%	0.804	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.5	36.7	176.9	54.3	0	0	0	0	116.5
325	K	53.7	Low	67.8	Low	174 Å²	174	82.8 Å²	82.8	76%	0.757	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.1	2.7	-175.7	-66.3	-177.9	-179.1	154	0	114.1	C323	C323-K325 PolarHBondContact O-N 2.86Å
326	Q	58.5	Low	68.5	Low	94 Å²	94	87.4 Å²	87.4	44%	0.439	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	126.1	177.1	-63.5	-75.2	-102.8	0	0	109.6	C323 F328	C323-Q326 PolarHBondContact O-N 2.77Å; Q326-F328 HydrophobicContact CB-CD2 4.23Å; Q326-F328 HydrophobicContact CB-CE1 4.28Å; Q326-F328 HydrophobicContact CB-CE2 3.38Å; Q326-F328 HydrophobicContact CB-CZ 3.4Å; Q326-F328 VanDerWaalsContact CB-CZ 3.4Å; Q326-F328 HydrophobicContact CG-CE2 4.36Å; Q326-F328 HydrophobicContact CG-CZ 3.96Å
327	V	64.4	Low	69.4	Low	78 Å²	78	80 Å²	80	47%	0.473	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	107.9	-172.9	172.4	0	0	0	0	103.8	H317 E319	H317-V327 HydrophobicContact CB-CG1 3.32Å; H317-V327 VanDerWaalsContact CG-CG1 3.41Å; E319-V327 HydrophobicContact CG-CG2 4.38Å
328	F	72.6	Confident	69.9	Low	30 Å²	30	78.9 Å²	78.9	13%	0.132	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	142.2	-167.9	-63.3	-79.3	0	0	0	112	H317 Y318 C320 Q326 D330 N333 L334 H337	H317-F328 CarbonylContact C-O 3.55Å; H317-F328 WeakPolarHBondContact CA-O 3.45Å; Y318-F328 PolarHBondContact N-O 2.8Å; Y318-F328 WeakPolarHBondContact O-CB 3.32Å; Y318-F328 WeakPolarHBondContact O-CD2 3.15Å; Y318-F328 PolarHBondContact O-N 2.91Å; C320-F328 HydrophobicContact CB-CE2 4.49Å; Q326-F328 HydrophobicContact CB-CD2 4.23Å; Q326-F328 HydrophobicContact CB-CE1 4.28Å; Q326-F328 HydrophobicContact CB-CE2 3.38Å; Q326-F328 HydrophobicContact CB-CZ 3.4Å; Q326-F328 VanDerWaalsContact CB-CZ 3.4Å; Q326-F328 HydrophobicContact CG-CE2 4.36Å; Q326-F328 HydrophobicContact CG-CZ 3.96Å; F328-D330 VanDerWaalsContact C-N 3.33Å; F328-N333 HydrophobicContact CD1-CB 3.95Å; F328-L334 HydrophobicContact CB-CB 4.26Å; F328-L334 HydrophobicContact CD2-CB 3.83Å; F328-L334 HydrophobicContact CD2-CD1 3.71Å; F328-L334 HydrophobicContact CD2-CG 4.36Å; F328-L334 HydrophobicContact CE2-CB 4.49Å; F328-L334 HydrophobicContact CE2-CD1 3.82Å; F328-L334 HydrophobicContact CG-CB 4.2Å; F328-H337 HydrophobicContact CE1-CB 4.11Å; F328-H337 HydrophobicContact CE2-CB 3.71Å; F328-H337 AromaticContact CE2-CD2 3.81Å; F328-H337 AromaticContact CE2-CG 3.65Å; F328-H337 HydrophobicContact CZ-CB 3.31Å; F328-H337 AromaticContact CZ-CG 3.38Å; F328-H337 AromaticContact CZ-ND1 3.64Å
329	T	69.7	Low	69.9	Low	62 Å²	62	79.6 Å²	79.6	38%	0.38	41%	0.405	S	S	.	.	S	Bend	trans	-89.4	6.7	178.3	58.3	0	0	0	0	113.7	M310	M310-T329 WeakPolarHBondContact O-CB 3.38Å
330	D	72.2	Confident	69.5	Low	22 Å²	22	75.5 Å²	75.5	12%	0.118	39%	0.391	C	S	.	.	S	Bend	trans	-158.7	125.7	-168.6	171.8	-5.7	0	0	0	110	F328 S332 N333 L334	F328-D330 VanDerWaalsContact C-N 3.33Å; D330-S332 PolarHBondContact O-N 3.42Å; D330-S332 WeakPolarHBondContact OD1-CA 3.43Å; D330-S332 WeakPolarHBondContact OD1-CB 3.42Å; D330-S332 PolarHBondContact OD1-N 3.37Å; D330-S332 PolarHBondContact OD1-OG 3.22Å; D330-N333 HydrophobicContact CB-CB 4.22Å; D330-N333 WeakPolarHBondContact O-CB 3.43Å; D330-N333 PolarHBondContact O-N 3.34Å; D330-N333 PolarHBondContact OD2-ND2 2.83Å; D330-L334 PolarHBondContact O-N 3.47Å
331	P	72.1	Confident	68.8	Low	66 Å²	66	81.1 Å²	81.1	43%	0.429	42%	0.417	S	S	.	.	H	α-helix	trans	-53.3	-38	177	-26.4	34.3	0	0	0	113.6	Y318 N333 L334 Q335	Y318-P331 HydrophobicContact CD1-CG 4.36Å; Y318-P331 HydrophobicContact CD2-CG 4.25Å; Y318-P331 HydrophobicContact CE1-CG 3.91Å; Y318-P331 HydrophobicContact CE2-CG 3.8Å; P331-N333 PolarHBondContact O-N 2.83Å; P331-L334 PolarHBondContact O-N 3.06Å; P331-Q335 WeakPolarHBondContact O-CB 3.2Å; P331-Q335 PolarHBondContact O-N 2.88Å
332	S	70.8	Confident	68.4	Low	73 Å²	73	75.2 Å²	75.2	51%	0.51	39%	0.389	S	S	.	.	H	α-helix	trans	-61.5	-33.4	179.2	-37	0	0	0	0	111.6	D330 R336	D330-S332 PolarHBondContact O-N 3.42Å; D330-S332 WeakPolarHBondContact OD1-CA 3.43Å; D330-S332 WeakPolarHBondContact OD1-CB 3.42Å; D330-S332 PolarHBondContact OD1-N 3.37Å; D330-S332 PolarHBondContact OD1-OG 3.22Å; S332-R336 WeakPolarHBondContact O-CB 3.3Å; S332-R336 PolarHBondContact O-N 3.26Å
333	N	72.8	Confident	68.7	Low	46 Å²	46	74.7 Å²	74.7	25%	0.246	39%	0.389	C	S	.	.	H	α-helix	trans	-77.6	-40.4	177.7	-80.3	-65.1	0	0	0	112	F328 D330 P331 R336 H337	F328-N333 HydrophobicContact CD1-CB 3.95Å; D330-N333 HydrophobicContact CB-CB 4.22Å; D330-N333 WeakPolarHBondContact O-CB 3.43Å; D330-N333 PolarHBondContact O-N 3.34Å; D330-N333 PolarHBondContact OD2-ND2 2.83Å; P331-N333 PolarHBondContact O-N 2.83Å; N333-R336 PolarHBondContact OD1-NH2 2.93Å; N333-H337 WeakPolarHBondContact O-CB 3.41Å; N333-H337 PolarHBondContact O-N 3.46Å
334	L	78.4	Confident	67.9	Low	24 Å²	24	75.5 Å²	75.5	13%	0.126	40%	0.404	C	S	.	.	H	α-helix	trans	-62.2	-47.8	170.4	173.5	60.6	0	0	0	111.1	E319 C320 F328 D330 P331 R336 H337 I338	E319-L334 WeakPolarHBondContact O-CD2 3.31Å; C320-L334 HydrophobicContact CB-CD1 3.56Å; F328-L334 HydrophobicContact CB-CB 4.26Å; F328-L334 HydrophobicContact CD2-CB 3.83Å; F328-L334 HydrophobicContact CD2-CD1 3.71Å; F328-L334 HydrophobicContact CD2-CG 4.36Å; F328-L334 HydrophobicContact CE2-CB 4.49Å; F328-L334 HydrophobicContact CE2-CD1 3.82Å; F328-L334 HydrophobicContact CG-CB 4.2Å; D330-L334 PolarHBondContact O-N 3.47Å; P331-L334 PolarHBondContact O-N 3.06Å; L334-R336 VanDerWaalsContact C-N 3.31Å; L334-R336 PolarHBondContact O-N 3.17Å; L334-H337 CarbonylContact O-C 3.59Å; L334-H337 WeakPolarHBondContact O-CA 3.22Å; L334-H337 VanDerWaalsContact O-CB 3.32Å; L334-H337 WeakPolarHBondContact O-CB 3.31Å; L334-H337 PolarHBondContact O-N 2.75Å; L334-I338 HydrophobicContact CD1-CD1 3.78Å; L334-I338 HydrophobicContact CD1-CG1 3.92Å; L334-I338 HydrophobicContact CD2-CD1 4.28Å; L334-I338 HydrophobicContact CG-CD1 3.76Å; L334-I338 HydrophobicContact CG-CG1 4.31Å; L334-I338 WeakPolarHBondContact O-CG1 3.31Å; L334-I338 PolarHBondContact O-N 3.24Å
335	Q	70.8	Confident	67.7	Low	104 Å²	104	73.2 Å²	73.2	49%	0.486	39%	0.392	S	S	.	.	H	α-helix	trans	-63	-38.6	-178.8	-154.7	-170.9	32.2	0	0	111.3	P331 I338 R339	P331-Q335 WeakPolarHBondContact O-CB 3.2Å; P331-Q335 PolarHBondContact O-N 2.88Å; Q335-I338 PolarHBondContact O-N 3.48Å; Q335-R339 WeakPolarHBondContact O-CG 3.25Å; Q335-R339 PolarHBondContact O-N 3.25Å
336	R	74.2	Confident	67.9	Low	130 Å²	130	71.9 Å²	71.9	49%	0.491	38%	0.382	S	S	.	.	H	α-helix	trans	-64.6	-35.9	170.5	179.5	165.5	63.6	170.1	-1.8	112.7	S332 N333 L334 S340	S332-R336 WeakPolarHBondContact O-CB 3.3Å; S332-R336 PolarHBondContact O-N 3.26Å; N333-R336 PolarHBondContact OD1-NH2 2.93Å; L334-R336 VanDerWaalsContact C-N 3.31Å; L334-R336 PolarHBondContact O-N 3.17Å; R336-S340 VanDerWaalsContact O-CB 3.23Å; R336-S340 WeakPolarHBondContact O-CB 3.27Å; R336-S340 PolarHBondContact O-N 2.85Å; R336-S340 VanDerWaalsContact O-N 3.16Å; R336-S340 PolarHBondContact O-OG 3.3Å
337	H	76.6	Confident	68.2	Low	20 Å²	20	71.3 Å²	71.3	9%	0.093	39%	0.394	C	S	.	.	H	α-helix	trans	-66	-48.8	172.1	171.8	86.3	0	0	0	111.4	C320 C323 F328 N333 L334 R339 S340 Q341 H342	C320-H337 PolarHBondContact SG-CD2 3.18Å; C323-H337 WeakPolarHBondContact CB-NE2 3.4Å; F328-H337 HydrophobicContact CE1-CB 4.11Å; F328-H337 HydrophobicContact CE2-CB 3.71Å; F328-H337 AromaticContact CE2-CD2 3.81Å; F328-H337 AromaticContact CE2-CG 3.65Å; F328-H337 HydrophobicContact CZ-CB 3.31Å; F328-H337 AromaticContact CZ-CG 3.38Å; F328-H337 AromaticContact CZ-ND1 3.64Å; N333-H337 WeakPolarHBondContact O-CB 3.41Å; N333-H337 PolarHBondContact O-N 3.46Å; L334-H337 CarbonylContact O-C 3.59Å; L334-H337 WeakPolarHBondContact O-CA 3.22Å; L334-H337 VanDerWaalsContact O-CB 3.32Å; L334-H337 WeakPolarHBondContact O-CB 3.31Å; L334-H337 PolarHBondContact O-N 2.75Å; H337-R339 PolarHBondContact O-N 3.46Å; H337-S340 PolarHBondContact O-N 3.07Å; H337-S340 VanDerWaalsContact O-N 3.12Å; H337-S340 PolarHBondContact O-OG 2.93Å; H337-Q341 WeakPolarHBondContact O-CB 3.24Å; H337-Q341 PolarHBondContact O-N 3.11Å; H337-H342 AromaticContact CD2-CD2 3.97Å; H337-H342 AromaticContact CD2-NE2 2.98Å; H337-H342 PolarHBondContact CD2-NE2 3.11Å; H337-H342 AromaticContact CE1-NE2 3.14Å; H337-H342 PolarHBondContact CE1-NE2 3.18Å; H337-H342 AromaticContact NE2-CD2 3.8Å; H337-H342 AromaticContact NE2-NE2 2.18Å; H337-H342 PolarHBondContact NE2-NE2 2.83Å
338	I	75	Confident	68.5	Low	52 Å²	52	70.8 Å²	70.8	27%	0.267	39%	0.386	S	S	.	.	H	α-helix	trans	-57.2	-52.1	178.3	-69.1	170.6	0	0	0	111.1	L334 Q335 S340 H342 V343	L334-I338 HydrophobicContact CD1-CD1 3.78Å; L334-I338 HydrophobicContact CD1-CG1 3.92Å; L334-I338 HydrophobicContact CD2-CD1 4.28Å; L334-I338 HydrophobicContact CG-CD1 3.76Å; L334-I338 HydrophobicContact CG-CG1 4.31Å; L334-I338 WeakPolarHBondContact O-CG1 3.31Å; L334-I338 PolarHBondContact O-N 3.24Å; Q335-I338 PolarHBondContact O-N 3.48Å; I338-S340 VanDerWaalsContact C-N 3.26Å; I338-S340 PolarHBondContact O-N 3.39Å; I338-H342 PolarHBondContact O-N 2.85Å; I338-V343 HydrophobicContact CG2-CG2 3.81Å; I338-V343 PolarHBondContact O-N 2.97Å
339	R	70.2	Confident	68.8	Low	115 Å²	115	72.2 Å²	72.2	43%	0.434	40%	0.403	S	S	.	.	H	α-helix	trans	-60.4	-32.3	176.9	-67.3	-172.8	-153	131.5	-0.3	113.4	Q335 H337	Q335-R339 WeakPolarHBondContact O-CG 3.25Å; Q335-R339 PolarHBondContact O-N 3.25Å; H337-R339 PolarHBondContact O-N 3.46Å
340	S	65.8	Low	69.4	Low	45 Å²	45	69.4 Å²	69.4	32%	0.315	39%	0.386	S	S	.	.	H	α-helix	trans	-95.2	-21.6	-174.1	67.7	0	0	0	0	115.9	R336 H337 I338	R336-S340 VanDerWaalsContact O-CB 3.23Å; R336-S340 WeakPolarHBondContact O-CB 3.27Å; R336-S340 PolarHBondContact O-N 2.85Å; R336-S340 VanDerWaalsContact O-N 3.16Å; R336-S340 PolarHBondContact O-OG 3.3Å; H337-S340 PolarHBondContact O-N 3.07Å; H337-S340 VanDerWaalsContact O-N 3.12Å; H337-S340 PolarHBondContact O-OG 2.93Å; I338-S340 VanDerWaalsContact C-N 3.26Å; I338-S340 PolarHBondContact O-N 3.39Å
341	Q	63.5	Low	69.7	Low	123 Å²	123	72.6 Å²	72.6	58%	0.575	41%	0.41	S	S	*	.	H	α-helix	trans	-110.7	-35	-179.5	-58.2	-53.4	-64	0	0	113.6	H337	H337-Q341 WeakPolarHBondContact O-CB 3.24Å; H337-Q341 PolarHBondContact O-N 3.11Å
342	H	64	Low	69.5	Low	70 Å²	70	73.4 Å²	73.4	32%	0.324	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-45.7	-167.1	-57.7	-55.2	0	0	0	113.7	C320 N322 C323 H337 I338 G344	C320-H342 PolarHBondContact SG-CD2 3.25Å; C320-H342 PolarHBondContact SG-NE2 3.22Å; N322-H342 HydrophobicContact CB-CB 4.24Å; N322-H342 WeakPolarHBondContact CB-ND1 3.31Å; N322-H342 PolarHBondContact O-CE1 2.9Å; C323-H342 WeakPolarHBondContact CB-CE1 3.48Å; C323-H342 WeakPolarHBondContact CB-NE2 3.47Å; C323-H342 PolarHBondContact SG-CE1 3.44Å; H337-H342 AromaticContact CD2-CD2 3.97Å; H337-H342 AromaticContact CD2-NE2 2.98Å; H337-H342 PolarHBondContact CD2-NE2 3.11Å; H337-H342 AromaticContact CE1-NE2 3.14Å; H337-H342 PolarHBondContact CE1-NE2 3.18Å; H337-H342 AromaticContact NE2-CD2 3.8Å; H337-H342 AromaticContact NE2-NE2 2.18Å; H337-H342 PolarHBondContact NE2-NE2 2.83Å; I338-H342 PolarHBondContact O-N 2.85Å; H342-G344 VanDerWaalsContact C-N 3.26Å; H342-G344 PolarHBondContact O-N 3.5Å
343	V	68.8	Low	69.7	Low	90 Å²	90	72.5 Å²	72.5	55%	0.545	40%	0.404	S	S	.	.	S	Bend	trans	-69.9	-26.1	-180	-177.3	0	0	0	0	111.7	I338 A345	I338-V343 HydrophobicContact CG2-CG2 3.81Å; I338-V343 PolarHBondContact O-N 2.97Å; V343-A345 HydrophobicContact CG1-CB 4.02Å; V343-A345 PolarHBondContact O-N 3.22Å
344	G	55.2	Low	70	Confident	52 Å²	52	73 Å²	73	54%	0.536	42%	0.419	S	S	.	.			trans	69.2	-18.5	174.6	0	0	0	0	0	116.1	H342 R346	H342-G344 VanDerWaalsContact C-N 3.26Å; H342-G344 PolarHBondContact O-N 3.5Å; G344-R346 PolarHBondContact O-N 3.25Å
345	A	52.2	Low	70	Confident	67 Å²	67	76.1 Å²	76.1	55%	0.554	43%	0.432	S	S	*	.			trans	-66.2	83.7	179.7	0	0	0	0	0	112.4	V343 A347	V343-A345 HydrophobicContact CG1-CB 4.02Å; V343-A345 PolarHBondContact O-N 3.22Å; A345-A347 PolarHBondContact O-N 3.23Å
346	R	58.3	Low	70.3	Confident	146 Å²	146	73.8 Å²	73.8	55%	0.551	43%	0.425	S	S	*	.			trans	-80.4	69.8	174.9	-64.1	173.7	168.6	-156.2	0.1	111.2	G344 H348 T356 F357	G344-R346 PolarHBondContact O-N 3.25Å; R346-H348 PolarHBondContact O-N 3.35Å; R346-T356 WeakPolarHBondContact CD-O 3.31Å; R346-T356 VanDerWaalsContact CD-OG1 3.22Å; R346-T356 WeakPolarHBondContact CD-OG1 3.31Å; R346-T356 PolarHBondContact NH1-O 2.99Å; R346-T356 VanDerWaalsContact NH1-O 3.15Å; R346-T356 PolarHBondContact NH1-OG1 2.94Å; R346-F357 CarbonylContact C-O 3.55Å; R346-F357 VanDerWaalsContact C-O 3.27Å; R346-F357 WeakPolarHBondContact CA-O 3.49Å
347	A	63.8	Low	70.5	Confident	83 Å²	83	70.1 Å²	70.1	69%	0.686	41%	0.412	S	S	*	.			trans	-55.5	-24.2	-174	0	0	0	0	0	115	A345	A345-A347 PolarHBondContact O-N 3.23Å
348	H	70.9	Confident	70.4	Confident	67 Å²	67	70.4 Å²	70.4	31%	0.31	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	89.3	-171.6	-57.6	-67.8	0	0	0	111.8	R346 F357 S360 L363	R346-H348 PolarHBondContact O-N 3.35Å; H348-F357 HydrophobicContact CB-CB 4.37Å; H348-F357 PolarHBondContact N-O 3.32Å; H348-F357 PolarHBondContact O-N 3.36Å; H348-S360 PolarHBondContact CD2-N 3.39Å; H348-S360 PolarHBondContact NE2-N 2.78Å; H348-L363 HydrophobicContact CB-CB 3.96Å; H348-L363 HydrophobicContact CB-CD2 3.84Å
349	A	79.1	Confident	70.5	Confident	60 Å²	60	69.5 Å²	69.5	50%	0.496	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	140.7	170.7	0	0	0	0	0	111.8	T356 L363	A349-T356 HydrophobicContact CB-CG2 4.09Å; A349-L363 WeakPolarHBondContact O-CD2 3.27Å
350	C	83.4	Confident	70.6	Confident	3 Å²	3	67.6 Å²	67.6	2%	0.02	42%	0.42	C	S	.	.			trans	-84.6	119.1	169.5	171.5	0	0	0	0	110.3	D352 G354 K355 F357 L363 H370	C350-D352 PolarHBondContact O-N 2.8Å; C350-D352 PolarHBondContact SG-OD2 3.11Å; C350-D352 VanDerWaalsContact SG-OD2 3.33Å; C350-G354 VanDerWaalsContact O-CA 3.29Å; C350-G354 WeakPolarHBondContact O-CA 3.37Å; C350-G354 PolarHBondContact O-N 2.99Å; C350-K355 HydrophobicContact CB-CB 4.49Å; C350-K355 VanDerWaalsContact CB-O 3.31Å; C350-K355 WeakPolarHBondContact CB-O 3.29Å; C350-K355 PolarHBondContact N-O 3.4Å; C350-F357 HydrophobicContact CB-CE2 4.26Å; C350-L363 VanDerWaalsContact CA-CD1 3.49Å; C350-L363 HydrophobicContact CB-CD1 3.54Å; C350-H370 PolarHBondContact SG-CD2 2.88Å; C350-H370 PolarHBondContact SG-NE2 2.88Å
351	S	77.1	Confident	71.1	Confident	88 Å²	88	68.9 Å²	68.9	62%	0.615	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.3	-45.5	172.5	36	0	0	0	0	112.6	C353	S351-C353 PolarHBondContact O-N 2.86Å
352	D	69.3	Low	71.7	Confident	84 Å²	84	64 Å²	64	45%	0.449	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-10	-160.6	-21.1	-57.5	0	0	0	112.8	C350 H370	C350-D352 PolarHBondContact O-N 2.8Å; C350-D352 PolarHBondContact SG-OD2 3.11Å; C350-D352 VanDerWaalsContact SG-OD2 3.33Å; D352-H370 HydrophobicContact CB-CB 3.91Å; D352-H370 IonicContact OD2-CD2 3.21Å; D352-H370 PolarHBondContact OD2-CD2 3.04Å; D352-H370 IonicContact OD2-CG 2.66Å
353	C	75.3	Confident	72.6	Confident	54 Å²	54	61.8 Å²	61.8	37%	0.365	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-158.9	13.2	177.3	70.6	0	0	0	0	116.2	S351 K355 H366 H370	S351-C353 PolarHBondContact O-N 2.86Å; C353-K355 PolarHBondContact O-N 3.16Å; C353-K355 PolarHBondContact SG-NZ 3.1Å; C353-H366 PolarHBondContact SG-NE2 3.07Å; C353-H370 PolarHBondContact SG-CE1 3.36Å; C353-H370 PolarHBondContact SG-NE2 2.86Å
354	G	77.9	Confident	72.9	Confident	55 Å²	55	64.6 Å²	64.6	57%	0.567	41%	0.407	S	S	*	.			trans	66.4	4.9	176.6	0	0	0	0	0	116.5	C350 T356	C350-G354 VanDerWaalsContact O-CA 3.29Å; C350-G354 WeakPolarHBondContact O-CA 3.37Å; C350-G354 PolarHBondContact O-N 2.99Å; G354-T356 PolarHBondContact O-N 3.42Å
355	K	78.3	Confident	73.8	Confident	91 Å²	91	67.8 Å²	67.8	40%	0.396	41%	0.407	S	S	.	.			trans	-68.6	125.4	177.8	-69.4	-170.7	-152.8	77.1	0	110.3	C350 C353 F357 H366	C350-K355 HydrophobicContact CB-CB 4.49Å; C350-K355 VanDerWaalsContact CB-O 3.31Å; C350-K355 WeakPolarHBondContact CB-O 3.29Å; C350-K355 PolarHBondContact N-O 3.4Å; C353-K355 PolarHBondContact O-N 3.16Å; C353-K355 PolarHBondContact SG-NZ 3.1Å; K355-F357 HydrophobicContact CB-CE2 3.61Å; K355-F357 HydrophobicContact CB-CZ 3.96Å; K355-F357 VanDerWaalsContact O-CD2 3.29Å; K355-F357 WeakPolarHBondContact O-CD2 3.32Å; K355-F357 VanDerWaalsContact O-CE2 3.22Å; K355-F357 WeakPolarHBondContact O-CE2 3.22Å; K355-H366 PolarHBondContact NZ-CE1 2.83Å; K355-H366 PolarHBondContact NZ-NE2 3.33Å
356	T	77.2	Confident	75	Confident	54 Å²	54	65.3 Å²	65.3	33%	0.331	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	132.5	-178.6	50.9	0	0	0	0	111.8	R346 A349 G354	R346-T356 WeakPolarHBondContact CD-O 3.31Å; R346-T356 VanDerWaalsContact CD-OG1 3.22Å; R346-T356 WeakPolarHBondContact CD-OG1 3.31Å; R346-T356 PolarHBondContact NH1-O 2.99Å; R346-T356 VanDerWaalsContact NH1-O 3.15Å; R346-T356 PolarHBondContact NH1-OG1 2.94Å; A349-T356 HydrophobicContact CB-CG2 4.09Å; G354-T356 PolarHBondContact O-N 3.42Å
357	F	77.7	Confident	75.7	Confident	53 Å²	53	63 Å²	63	23%	0.232	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	149	-175.8	-64	-92.3	0	0	0	111.5	R346 H348 C350 K355 L363 H366	R346-F357 CarbonylContact C-O 3.55Å; R346-F357 VanDerWaalsContact C-O 3.27Å; R346-F357 WeakPolarHBondContact CA-O 3.49Å; H348-F357 HydrophobicContact CB-CB 4.37Å; H348-F357 PolarHBondContact N-O 3.32Å; H348-F357 PolarHBondContact O-N 3.36Å; C350-F357 HydrophobicContact CB-CE2 4.26Å; K355-F357 HydrophobicContact CB-CE2 3.61Å; K355-F357 HydrophobicContact CB-CZ 3.96Å; K355-F357 VanDerWaalsContact O-CD2 3.29Å; K355-F357 WeakPolarHBondContact O-CD2 3.32Å; K355-F357 VanDerWaalsContact O-CE2 3.22Å; K355-F357 WeakPolarHBondContact O-CE2 3.22Å; F357-L363 HydrophobicContact CB-CB 4.39Å; F357-L363 HydrophobicContact CD2-CB 4.23Å; F357-L363 HydrophobicContact CD2-CD1 4.24Å; F357-L363 HydrophobicContact CG-CB 4.44Å; F357-H366 HydrophobicContact CE1-CB 4.01Å; F357-H366 HydrophobicContact CE2-CB 3.81Å; F357-H366 AromaticContact CE2-CD2 3.31Å; F357-H366 WeakPolarHBondContact CE2-CD2 3.16Å; F357-H366 AromaticContact CE2-CG 3.69Å; F357-H366 HydrophobicContact CZ-CB 3.46Å; F357-H366 VanDerWaalsContact CZ-CB 3.46Å; F357-H366 AromaticContact CZ-CD2 3.32Å; F357-H366 WeakPolarHBondContact CZ-CD2 3.44Å; F357-H366 AromaticContact CZ-CG 3.3Å
358	A	75.9	Confident	76.1	Confident	27 Å²	27	63 Å²	63	22%	0.223	36%	0.364	C	S	.	.	S	Bend	trans	-85.2	-4.1	177.9	0	0	0	0	0	114
359	T	76.7	Confident	76.1	Confident	33 Å²	33	65 Å²	65	20%	0.202	38%	0.376	C	S	.	.	S	Bend	trans	-143.4	147.8	172.2	68.1	0	0	0	0	111.1	S361 G362 L363	T359-S361 VanDerWaalsContact C-N 3.26Å; T359-S361 WeakPolarHBondContact CB-OG 3.47Å; T359-S361 PolarHBondContact O-N 3.22Å; T359-S361 PolarHBondContact OG1-OG 3.05Å; T359-G362 PolarHBondContact O-N 3.27Å; T359-G362 VanDerWaalsContact O-N 3.17Å; T359-G362 PolarHBondContact OG1-N 2.8Å; T359-G362 VanDerWaalsContact OG1-N 3.07Å; T359-L363 PolarHBondContact O-N 2.8Å; T359-L363 VanDerWaalsContact O-N 3.16Å
360	S	73.3	Confident	75.4	Confident	74 Å²	74	65.1 Å²	65.1	52%	0.517	37%	0.366	S	S	.	.	H	α-helix	trans	-59.1	-36.8	172.9	53.9	0	0	0	0	111.9	H348 G362 L363 K364	H348-S360 PolarHBondContact CD2-N 3.39Å; H348-S360 PolarHBondContact NE2-N 2.78Å; S360-G362 PolarHBondContact O-N 2.79Å; S360-L363 CarbonylContact O-C 3.55Å; S360-L363 WeakPolarHBondContact O-CB 3.32Å; S360-L363 PolarHBondContact O-N 3.27Å; S360-K364 PolarHBondContact O-N 2.76Å
361	S	75.2	Confident	74.6	Confident	73 Å²	73	67 Å²	67	51%	0.51	38%	0.379	S	S	.	.	H	α-helix	trans	-61.8	-39.6	173.9	52.4	0	0	0	0	113.2	T359 L363 K364 Q365	T359-S361 VanDerWaalsContact C-N 3.26Å; T359-S361 WeakPolarHBondContact CB-OG 3.47Å; T359-S361 PolarHBondContact O-N 3.22Å; T359-S361 PolarHBondContact OG1-OG 3.05Å; S361-L363 VanDerWaalsContact C-N 3.35Å; S361-K364 PolarHBondContact O-N 3.48Å; S361-Q365 PolarHBondContact O-N 3.19Å
362	G	77.1	Confident	73.5	Confident	19 Å²	19	67.8 Å²	67.8	20%	0.196	38%	0.384	C	S	.	.	H	α-helix	trans	-66.2	-37.4	173.9	0	0	0	0	0	112.1	T359 S360 H366	T359-G362 PolarHBondContact O-N 3.27Å; T359-G362 VanDerWaalsContact O-N 3.17Å; T359-G362 PolarHBondContact OG1-N 2.8Å; T359-G362 VanDerWaalsContact OG1-N 3.07Å; S360-G362 PolarHBondContact O-N 2.79Å; G362-H366 WeakPolarHBondContact O-CB 3.41Å; G362-H366 PolarHBondContact O-N 2.86Å
363	L	81.1	Confident	73.1	Confident	25 Å²	25	68.8 Å²	68.8	13%	0.131	39%	0.394	C	S	.	.	H	α-helix	trans	-67.2	-44.5	171.4	173.2	60	0	0	0	112.2	H348 A349 C350 F357 T359 S360 S361 Q365 H366 K367	H348-L363 HydrophobicContact CB-CB 3.96Å; H348-L363 HydrophobicContact CB-CD2 3.84Å; A349-L363 WeakPolarHBondContact O-CD2 3.27Å; C350-L363 VanDerWaalsContact CA-CD1 3.49Å; C350-L363 HydrophobicContact CB-CD1 3.54Å; F357-L363 HydrophobicContact CB-CB 4.39Å; F357-L363 HydrophobicContact CD2-CB 4.23Å; F357-L363 HydrophobicContact CD2-CD1 4.24Å; F357-L363 HydrophobicContact CG-CB 4.44Å; T359-L363 PolarHBondContact O-N 2.8Å; T359-L363 VanDerWaalsContact O-N 3.16Å; S360-L363 CarbonylContact O-C 3.55Å; S360-L363 WeakPolarHBondContact O-CB 3.32Å; S360-L363 PolarHBondContact O-N 3.27Å; S361-L363 VanDerWaalsContact C-N 3.35Å; L363-Q365 PolarHBondContact O-N 2.69Å; L363-H366 CarbonylContact O-C 3.48Å; L363-H366 WeakPolarHBondContact O-CA 3.21Å; L363-H366 WeakPolarHBondContact O-CB 3.38Å; L363-H366 PolarHBondContact O-N 2.88Å; L363-K367 HydrophobicContact CD1-CG 4.18Å; L363-K367 PolarHBondContact O-N 3.35Å
364	K	76.4	Confident	72.7	Confident	149 Å²	149	71.1 Å²	71.1	65%	0.648	40%	0.397	S	S	*	.	H	α-helix	trans	-60.5	-47.5	178.3	-168.1	171.9	-177.7	176.5	0	110.6	S360 S361 H366 K367 H368	S360-K364 PolarHBondContact O-N 2.76Å; S361-K364 PolarHBondContact O-N 3.48Å; K364-H366 PolarHBondContact O-N 3.23Å; K364-K367 PolarHBondContact O-N 3.39Å; K364-H368 PolarHBondContact O-CD2 3.39Å; K364-H368 PolarHBondContact O-N 2.81Å
365	Q	73.6	Confident	72.4	Confident	119 Å²	119	72.6 Å²	72.6	56%	0.556	40%	0.397	S	S	*	.	H	α-helix	trans	-60.5	-31.3	172.8	-163.6	-178.2	24.8	0	0	112.5	S361 L363 Q387	S361-Q365 PolarHBondContact O-N 3.19Å; L363-Q365 PolarHBondContact O-N 2.69Å; Q365-Q387 PolarHBondContact O-NE2 3.14Å
366	H	77.1	Confident	72.2	Confident	14 Å²	14	71.8 Å²	71.8	7%	0.065	39%	0.394	C	S	.	.	H	α-helix	trans	-77.2	-33	176.5	-171.3	41.5	0	0	0	114.4	C353 K355 F357 G362 L363 K364 H368 I369 H370	C353-H366 PolarHBondContact SG-NE2 3.07Å; K355-H366 PolarHBondContact NZ-CE1 2.83Å; K355-H366 PolarHBondContact NZ-NE2 3.33Å; F357-H366 HydrophobicContact CE1-CB 4.01Å; F357-H366 HydrophobicContact CE2-CB 3.81Å; F357-H366 AromaticContact CE2-CD2 3.31Å; F357-H366 WeakPolarHBondContact CE2-CD2 3.16Å; F357-H366 AromaticContact CE2-CG 3.69Å; F357-H366 HydrophobicContact CZ-CB 3.46Å; F357-H366 VanDerWaalsContact CZ-CB 3.46Å; F357-H366 AromaticContact CZ-CD2 3.32Å; F357-H366 WeakPolarHBondContact CZ-CD2 3.44Å; F357-H366 AromaticContact CZ-CG 3.3Å; G362-H366 WeakPolarHBondContact O-CB 3.41Å; G362-H366 PolarHBondContact O-N 2.86Å; L363-H366 CarbonylContact O-C 3.48Å; L363-H366 WeakPolarHBondContact O-CA 3.21Å; L363-H366 WeakPolarHBondContact O-CB 3.38Å; L363-H366 PolarHBondContact O-N 2.88Å; K364-H366 PolarHBondContact O-N 3.23Å; H366-H368 PolarHBondContact O-N 3.12Å; H366-I369 VanDerWaalsContact O-CB 3.29Å; H366-I369 WeakPolarHBondContact O-CB 3.44Å; H366-I369 PolarHBondContact O-N 2.75Å; H366-H370 AromaticContact CD2-NE2 3.57Å; H366-H370 AromaticContact CE1-CE1 3.81Å; H366-H370 AromaticContact CE1-NE2 3.35Å; H366-H370 PolarHBondContact CE1-NE2 3.15Å; H366-H370 AromaticContact NE2-CE1 3.65Å; H366-H370 AromaticContact NE2-NE2 2.97Å; H366-H370 PolarHBondContact NE2-NE2 2.98Å
367	K	74.2	Confident	71.9	Confident	98 Å²	98	74.1 Å²	74.1	43%	0.426	40%	0.402	S	S	.	.	H	α-helix	trans	-59.3	-34.2	173.6	-75.9	-166.1	169.3	-165	0	111.4	L363 K364 I369 H370 S371	L363-K367 HydrophobicContact CD1-CG 4.18Å; L363-K367 PolarHBondContact O-N 3.35Å; K364-K367 PolarHBondContact O-N 3.39Å; K367-I369 PolarHBondContact O-N 2.77Å; K367-H370 PolarHBondContact O-N 2.82Å; K367-S371 PolarHBondContact O-N 2.93Å; K367-S371 VanDerWaalsContact O-N 3.13Å
368	H	71.2	Confident	72.1	Confident	82 Å²	82	71.6 Å²	71.6	38%	0.38	39%	0.391	S	S	.	.	H	α-helix	trans	-66.6	10.8	168.2	-60.6	-71.3	0	0	0	115.2	K364 H366 S371 T386	K364-H368 PolarHBondContact O-CD2 3.39Å; K364-H368 PolarHBondContact O-N 2.81Å; H366-H368 PolarHBondContact O-N 3.12Å; H368-S371 WeakPolarHBondContact CA-OG 3.35Å; H368-T386 WeakPolarHBondContact O-CB 3.37Å; H368-T386 WeakPolarHBondContact O-CG2 3.27Å; H368-T386 PolarHBondContact O-OG1 2.89Å
369	I	70.2	Confident	72.2	Confident	109 Å²	109	75.6 Å²	75.6	56%	0.559	41%	0.405	S	S	*	.	H	α-helix	trans	-105	-20.3	167.4	-53.9	-170	0	0	0	110.8	H366 K367	H366-I369 VanDerWaalsContact O-CB 3.29Å; H366-I369 WeakPolarHBondContact O-CB 3.44Å; H366-I369 PolarHBondContact O-N 2.75Å; K367-I369 PolarHBondContact O-N 2.77Å
370	H	65.9	Low	72	Confident	63 Å²	63	78.5 Å²	78.5	29%	0.292	42%	0.423	S	S	.	.	H	α-helix	trans	-96.8	-20.8	176.5	-54	-59.2	0	0	0	112.9	C350 D352 C353 H366 K367 S372	C350-H370 PolarHBondContact SG-CD2 2.88Å; C350-H370 PolarHBondContact SG-NE2 2.88Å; D352-H370 HydrophobicContact CB-CB 3.91Å; D352-H370 IonicContact OD2-CD2 3.21Å; D352-H370 PolarHBondContact OD2-CD2 3.04Å; D352-H370 IonicContact OD2-CG 2.66Å; C353-H370 PolarHBondContact SG-CE1 3.36Å; C353-H370 PolarHBondContact SG-NE2 2.86Å; H366-H370 AromaticContact CD2-NE2 3.57Å; H366-H370 AromaticContact CE1-CE1 3.81Å; H366-H370 AromaticContact CE1-NE2 3.35Å; H366-H370 PolarHBondContact CE1-NE2 3.15Å; H366-H370 AromaticContact NE2-CE1 3.65Å; H366-H370 AromaticContact NE2-NE2 2.97Å; H366-H370 PolarHBondContact NE2-NE2 2.98Å; K367-H370 PolarHBondContact O-N 2.82Å; H370-S372 VanDerWaalsContact C-N 3.34Å; H370-S372 PolarHBondContact O-N 2.79Å
371	S	65.4	Low	72.2	Confident	43 Å²	43	76.8 Å²	76.8	30%	0.301	41%	0.41	S	S	.	.			trans	-60.2	98.3	160.8	62	0	0	0	0	109.1	K367 H368 V373 T386	K367-S371 PolarHBondContact O-N 2.93Å; K367-S371 VanDerWaalsContact O-N 3.13Å; H368-S371 WeakPolarHBondContact CA-OG 3.35Å; S371-V373 PolarHBondContact O-N 3.13Å; S371-T386 WeakPolarHBondContact O-CG2 3.22Å
372	S	55.4	Low	72.1	Confident	104 Å²	104	79.6 Å²	79.6	73%	0.727	42%	0.415	S	S	*	.			trans	-62.3	-26.1	174.3	51.6	0	0	0	0	111.9	H370 K374	H370-S372 VanDerWaalsContact C-N 3.34Å; H370-S372 PolarHBondContact O-N 2.79Å; S372-K374 WeakPolarHBondContact O-CG 3.21Å; S372-K374 PolarHBondContact O-N 2.91Å
373	V	59.3	Low	72	Confident	106 Å²	106	84.1 Å²	84.1	64%	0.642	43%	0.429	S	S	*	.			trans	-58.6	114.9	167.1	-169.9	0	0	0	0	109.3	S371 P375	S371-V373 PolarHBondContact O-N 3.13Å; V373-P375 WeakPolarHBondContact O-CD 3.27Å
374	K	67.6	Low	71.8	Confident	102 Å²	102	85.2 Å²	85.2	44%	0.443	44%	0.439	S	S	.	.			trans	-118.7	76.6	-178.9	-72.6	159.6	169.6	-173.3	0	108.8	S372 F376 S384 Y385 T386	S372-K374 WeakPolarHBondContact O-CG 3.21Å; S372-K374 PolarHBondContact O-N 2.91Å; K374-F376 PolarHBondContact O-N 2.83Å; K374-F376 VanDerWaalsContact O-N 3.12Å; K374-S384 WeakPolarHBondContact CD-O 3.43Å; K374-S384 WeakPolarHBondContact CD-OG 3.48Å; K374-Y385 CarbonylContact C-O 3.58Å; K374-Y385 WeakPolarHBondContact CA-O 3.37Å; K374-T386 HydrophobicContact CB-CG2 4.48Å; K374-T386 HydrophobicContact CG-CG2 3.55Å
375	P	71.9	Confident	72	Confident	87 Å²	87	80.9 Å²	80.9	57%	0.565	42%	0.419	S	S	*	.			trans	-65.4	-20.2	-170	26.6	-33.7	0	0	0	112.9	V373 M377	V373-P375 WeakPolarHBondContact O-CD 3.27Å; P375-M377 PolarHBondContact O-N 2.98Å
376	F	73.9	Confident	72	Confident	74 Å²	74	76.6 Å²	76.6	33%	0.325	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	78.1	-177.8	-55.6	-66.9	0	0	0	111	K374 Y385 Q387 F388 L391	K374-F376 PolarHBondContact O-N 2.83Å; K374-F376 VanDerWaalsContact O-N 3.12Å; F376-Y385 WeakPolarHBondContact CB-O 3.41Å; F376-Y385 PolarHBondContact N-O 3.13Å; F376-Y385 PolarHBondContact O-N 3.49Å; F376-Q387 VanDerWaalsContact CD2-C 3.43Å; F376-F388 HydrophobicContact CD1-CB 3.92Å; F376-F388 AromaticContact CD1-CD2 3.81Å; F376-F388 HydrophobicContact CD1-CD2 3.81Å; F376-F388 HydrophobicContact CD1-CG 4.38Å; F376-F388 HydrophobicContact CD2-CB 4.33Å; F376-F388 HydrophobicContact CE1-CB 3.79Å; F376-F388 HydrophobicContact CE1-CD2 4.01Å; F376-F388 HydrophobicContact CE1-CG 4.35Å; F376-F388 HydrophobicContact CE2-CB 4.19Å; F376-F388 HydrophobicContact CG-CB 4.18Å; F376-F388 HydrophobicContact CZ-CB 3.93Å; F376-L391 HydrophobicContact CB-CB 3.83Å; F376-L391 HydrophobicContact CB-CD2 3.7Å; F376-L391 HydrophobicContact CB-CG 4.36Å
377	M	70.1	Confident	71.9	Confident	103 Å²	103	77.4 Å²	77.4	51%	0.507	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	151.8	169.6	67.6	-170.9	-73	0	0	112.4	P375 L391	P375-M377 PolarHBondContact O-N 2.98Å; M377-L391 WeakPolarHBondContact O-CD1 3.33Å; M377-L391 VanDerWaalsContact O-CD2 3.32Å; M377-L391 WeakPolarHBondContact O-CD2 3.48Å
378	C	82.3	Confident	71.6	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	41%	0.411	C	S	.	.			trans	-105.5	113.7	176.9	-175.5	0	0	0	0	110.5	V380 C381 H382 K383 L391 H398	C378-V380 PolarHBondContact O-N 3.41Å; C378-V380 VanDerWaalsContact O-N 3.13Å; C378-C381 PolarHBondContact O-N 3.07Å; C378-H382 WeakPolarHBondContact O-CA 3.4Å; C378-H382 PolarHBondContact O-N 3.09Å; C378-K383 WeakPolarHBondContact CB-O 3.36Å; C378-K383 PolarHBondContact N-O 3.23Å; C378-L391 HydrophobicContact CB-CD1 3.42Å; C378-L391 VanDerWaalsContact CB-CD1 3.42Å; C378-H398 PolarHBondContact SG-CD2 3Å; C378-H398 PolarHBondContact SG-NE2 3.24Å
379	E	77.5	Confident	71.7	Confident	110 Å²	110	78.2 Å²	78.2	51%	0.514	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-43.5	-179.8	-51.9	84.7	-96.1	0	0	112.5	C381 H382 K395	E379-C381 VanDerWaalsContact C-N 3.28Å; E379-C381 PolarHBondContact O-N 3.33Å; E379-C381 VanDerWaalsContact O-N 3.16Å; E379-H382 PolarHBondContact O-CE1 2.89Å; E379-H382 PolarHBondContact O-NE2 3.38Å; E379-K395 WeakPolarHBondContact OE1-CE 2.99Å; E379-K395 IonicContact OE1-NZ 2.68Å; E379-K395 PolarHBondContact OE1-NZ 3.17Å; E379-K395 WeakPolarHBondContact OE2-CE 3.32Å; E379-K395 IonicContact OE2-NZ 3.71Å; E379-K395 PolarHBondContact OE2-NZ 3.31Å
380	V	73.1	Confident	72.1	Confident	95 Å²	95	74.8 Å²	74.8	58%	0.576	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-18.9	-171.9	-169.1	0	0	0	0	114.8	C378 H398	C378-V380 PolarHBondContact O-N 3.41Å; C378-V380 VanDerWaalsContact O-N 3.13Å; V380-H398 HydrophobicContact CB-CB 4.18Å; V380-H398 HydrophobicContact CG1-CB 4.01Å; V380-H398 WeakPolarHBondContact CG1-ND1 3.13Å; V380-H398 HydrophobicContact CG2-CB 4.18Å
381	C	77.6	Confident	72.8	Confident	38 Å²	38	72.1 Å²	72.1	26%	0.257	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-155.4	17.8	176	71.4	0	0	0	0	115.3	C378 E379 K383 H394 H398	C378-C381 PolarHBondContact O-N 3.07Å; E379-C381 VanDerWaalsContact C-N 3.28Å; E379-C381 PolarHBondContact O-N 3.33Å; E379-C381 VanDerWaalsContact O-N 3.16Å; C381-K383 PolarHBondContact O-N 2.82Å; C381-K383 VanDerWaalsContact SG-CG 3.55Å; C381-H394 PolarHBondContact SG-NE2 2.98Å; C381-H398 PolarHBondContact SG-CE1 2.8Å; C381-H398 PolarHBondContact SG-NE2 2.71Å
382	H	73.6	Confident	73.3	Confident	132 Å²	132	72.7 Å²	72.7	61%	0.611	39%	0.391	S	S	*	.			trans	48.7	20	-179.6	-49.6	-69.5	0	0	0	116.3	C378 E379 S384	C378-H382 WeakPolarHBondContact O-CA 3.4Å; C378-H382 PolarHBondContact O-N 3.09Å; E379-H382 PolarHBondContact O-CE1 2.89Å; E379-H382 PolarHBondContact O-NE2 3.38Å; H382-S384 PolarHBondContact O-N 3Å
383	K	73.8	Confident	74.3	Confident	113 Å²	113	74.7 Å²	74.7	49%	0.491	38%	0.382	S	S	.	.			trans	-72.2	124	173	-65.8	-176.9	-156.1	-38.4	0	109.2	C378 C381 Y385	C378-K383 WeakPolarHBondContact CB-O 3.36Å; C378-K383 PolarHBondContact N-O 3.23Å; C381-K383 PolarHBondContact O-N 2.82Å; C381-K383 VanDerWaalsContact SG-CG 3.55Å; K383-Y385 HydrophobicContact CB-CE2 3.68Å; K383-Y385 VanDerWaalsContact O-CD2 3.32Å; K383-Y385 WeakPolarHBondContact O-CD2 3.25Å; K383-Y385 WeakPolarHBondContact O-CE2 3.37Å
384	S	77.5	Confident	75.2	Confident	48 Å²	48	70.7 Å²	70.7	34%	0.336	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	136	-178	54.5	0	0	0	0	112	K374 H382	K374-S384 WeakPolarHBondContact CD-O 3.43Å; K374-S384 WeakPolarHBondContact CD-OG 3.48Å; H382-S384 PolarHBondContact O-N 3Å
385	Y	80.4	Confident	75.3	Confident	58 Å²	58	69.6 Å²	69.6	23%	0.227	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	147.2	-174.5	-63.7	-88.4	0	0	0	110.7	K374 F376 K383 Q387 N390 L391 H394	K374-Y385 CarbonylContact C-O 3.58Å; K374-Y385 WeakPolarHBondContact CA-O 3.37Å; F376-Y385 WeakPolarHBondContact CB-O 3.41Å; F376-Y385 PolarHBondContact N-O 3.13Å; F376-Y385 PolarHBondContact O-N 3.49Å; K383-Y385 HydrophobicContact CB-CE2 3.68Å; K383-Y385 VanDerWaalsContact O-CD2 3.32Å; K383-Y385 WeakPolarHBondContact O-CD2 3.25Å; K383-Y385 WeakPolarHBondContact O-CE2 3.37Å; Y385-Q387 VanDerWaalsContact C-N 3.33Å; Y385-N390 HydrophobicContact CD1-CB 3.93Å; Y385-N390 HydrophobicContact CG-CB 4.4Å; Y385-L391 HydrophobicContact CD2-CB 4.27Å; Y385-L391 HydrophobicContact CD2-CD1 4.17Å; Y385-L391 HydrophobicContact CG-CB 4.48Å; Y385-H394 HydrophobicContact CE2-CB 4.1Å; Y385-H394 AromaticContact CE2-CD2 3.26Å; Y385-H394 WeakPolarHBondContact CE2-CD2 3.44Å; Y385-H394 AromaticContact CE2-CG 3.8Å; Y385-H394 AromaticContact CE2-NE2 3.95Å; Y385-H394 AromaticContact CZ-CD2 3.52Å; Y385-H394 AromaticContact CZ-CG 3.65Å; Y385-H394 PolarHBondContact OH-CD2 2.95Å; Y385-H394 PolarHBondContact OH-CE1 3.48Å; Y385-H394 VanDerWaalsContact OH-CG 3.28Å; Y385-H394 PolarHBondContact OH-ND1 3.31Å; Y385-H394 PolarHBondContact OH-NE2 2.95Å
386	T	73.8	Confident	75.4	Confident	30 Å²	30	73.5 Å²	73.5	18%	0.184	36%	0.355	C	S	.	.	S	Bend	trans	-84.8	-3.8	178.8	58.9	0	0	0	0	113.9	H368 S371 K374	H368-T386 WeakPolarHBondContact O-CB 3.37Å; H368-T386 WeakPolarHBondContact O-CG2 3.27Å; H368-T386 PolarHBondContact O-OG1 2.89Å; S371-T386 WeakPolarHBondContact O-CG2 3.22Å; K374-T386 HydrophobicContact CB-CG2 4.48Å; K374-T386 HydrophobicContact CG-CG2 3.55Å
387	Q	75.7	Confident	74.8	Confident	30 Å²	30	74 Å²	74	14%	0.14	36%	0.359	C	S	.	.	S	Bend	trans	-145.7	133.8	-179.2	-60.9	171.5	1.2	0	0	110.4	Q365 F376 Y385 S389 N390 L391	Q365-Q387 PolarHBondContact O-NE2 3.14Å; F376-Q387 VanDerWaalsContact CD2-C 3.43Å; Y385-Q387 VanDerWaalsContact C-N 3.33Å; Q387-S389 VanDerWaalsContact C-N 3.27Å; Q387-S389 PolarHBondContact O-N 2.85Å; Q387-N390 WeakPolarHBondContact O-CB 3.45Å; Q387-N390 PolarHBondContact O-N 3.17Å; Q387-N390 PolarHBondContact OE1-ND2 3.07Å; Q387-L391 PolarHBondContact O-N 3.45Å
388	F	67	Low	74.7	Confident	127 Å²	127	70.5 Å²	70.5	56%	0.557	34%	0.342	S	S	*	.	H	α-helix	trans	-56.9	-37.3	-179.9	-177.3	-103.4	0	0	0	112.9	F376 N390 L391 C392	F376-F388 HydrophobicContact CD1-CB 3.92Å; F376-F388 AromaticContact CD1-CD2 3.81Å; F376-F388 HydrophobicContact CD1-CD2 3.81Å; F376-F388 HydrophobicContact CD1-CG 4.38Å; F376-F388 HydrophobicContact CD2-CB 4.33Å; F376-F388 HydrophobicContact CE1-CB 3.79Å; F376-F388 HydrophobicContact CE1-CD2 4.01Å; F376-F388 HydrophobicContact CE1-CG 4.35Å; F376-F388 HydrophobicContact CE2-CB 4.19Å; F376-F388 HydrophobicContact CG-CB 4.18Å; F376-F388 HydrophobicContact CZ-CB 3.93Å; F388-N390 VanDerWaalsContact C-N 3.25Å; F388-N390 PolarHBondContact O-N 2.9Å; F388-L391 HydrophobicContact CD2-CD2 4.43Å; F388-L391 CarbonylContact O-C 3.52Å; F388-L391 WeakPolarHBondContact O-CB 3.4Å; F388-L391 PolarHBondContact O-N 2.8Å; F388-L391 VanDerWaalsContact O-N 3.11Å; F388-C392 HydrophobicContact CE1-CB 4.26Å; F388-C392 WeakPolarHBondContact O-CB 3.34Å; F388-C392 PolarHBondContact O-N 3.16Å
389	S	73.9	Confident	73.7	Confident	71 Å²	71	73.6 Å²	73.6	50%	0.497	37%	0.368	S	S	.	.	H	α-helix	trans	-63.1	-28.5	176.5	60.3	0	0	0	0	113.7	Q387 R393	Q387-S389 VanDerWaalsContact C-N 3.27Å; Q387-S389 PolarHBondContact O-N 2.85Å; S389-R393 WeakPolarHBondContact O-CB 3.48Å; S389-R393 PolarHBondContact O-N 3.41Å
390	N	77.4	Confident	72.6	Confident	37 Å²	37	71 Å²	71	20%	0.198	36%	0.358	C	S	.	.	H	α-helix	trans	-78.7	-37.1	173.3	-67.8	-46.7	0	0	0	111.3	Y385 Q387 F388 R393 H394	Y385-N390 HydrophobicContact CD1-CB 3.93Å; Y385-N390 HydrophobicContact CG-CB 4.4Å; Q387-N390 WeakPolarHBondContact O-CB 3.45Å; Q387-N390 PolarHBondContact O-N 3.17Å; Q387-N390 PolarHBondContact OE1-ND2 3.07Å; F388-N390 VanDerWaalsContact C-N 3.25Å; F388-N390 PolarHBondContact O-N 2.9Å; N390-R393 VanDerWaalsContact OD1-CZ 3.27Å; N390-R393 PolarHBondContact OD1-NH1 3.03Å; N390-R393 PolarHBondContact OD1-NH2 3.36Å; N390-H394 WeakPolarHBondContact O-CB 3.49Å; N390-H394 PolarHBondContact O-N 3.25Å; N390-H394 VanDerWaalsContact O-N 3.13Å
391	L	80.9	Confident	71.4	Confident	7 Å²	7	68.5 Å²	68.5	4%	0.037	34%	0.344	C	S	.	.	H	α-helix	trans	-62.9	-49.3	170	171.8	62.2	0	0	0	111.4	F376 M377 C378 Y385 Q387 F388 R393 H394 K395	F376-L391 HydrophobicContact CB-CB 3.83Å; F376-L391 HydrophobicContact CB-CD2 3.7Å; F376-L391 HydrophobicContact CB-CG 4.36Å; M377-L391 WeakPolarHBondContact O-CD1 3.33Å; M377-L391 VanDerWaalsContact O-CD2 3.32Å; M377-L391 WeakPolarHBondContact O-CD2 3.48Å; C378-L391 HydrophobicContact CB-CD1 3.42Å; C378-L391 VanDerWaalsContact CB-CD1 3.42Å; Y385-L391 HydrophobicContact CD2-CB 4.27Å; Y385-L391 HydrophobicContact CD2-CD1 4.17Å; Y385-L391 HydrophobicContact CG-CB 4.48Å; Q387-L391 PolarHBondContact O-N 3.45Å; F388-L391 HydrophobicContact CD2-CD2 4.43Å; F388-L391 CarbonylContact O-C 3.52Å; F388-L391 WeakPolarHBondContact O-CB 3.4Å; F388-L391 PolarHBondContact O-N 2.8Å; F388-L391 VanDerWaalsContact O-N 3.11Å; L391-R393 PolarHBondContact O-N 3.17Å; L391-H394 CarbonylContact O-C 3.33Å; L391-H394 VanDerWaalsContact O-CA 3.31Å; L391-H394 WeakPolarHBondContact O-CA 3.45Å; L391-H394 WeakPolarHBondContact O-CB 3.29Å; L391-H394 PolarHBondContact O-N 3.46Å; L391-K395 HydrophobicContact CD1-CD 4.49Å; L391-K395 HydrophobicContact CD1-CG 3.94Å; L391-K395 HydrophobicContact CG-CG 4.28Å; L391-K395 PolarHBondContact O-N 3.21Å
392	C	76.8	Confident	70	Confident	55 Å²	55	78.2 Å²	78.2	37%	0.372	38%	0.375	S	S	.	.	H	α-helix	trans	-64.2	-40.5	-177.5	-175.8	0	0	0	0	111.8	F388 H394 K395 R396	F388-C392 HydrophobicContact CE1-CB 4.26Å; F388-C392 WeakPolarHBondContact O-CB 3.34Å; F388-C392 PolarHBondContact O-N 3.16Å; C392-H394 PolarHBondContact O-N 2.72Å; C392-K395 PolarHBondContact O-N 3.14Å; C392-R396 PolarHBondContact O-N 3.49Å
393	R	75.3	Confident	69.1	Low	146 Å²	146	76.5 Å²	76.5	55%	0.551	37%	0.374	S	S	*	.	H	α-helix	trans	-60	-32	168.9	-172.5	175.3	68.2	-111.6	-4.8	112.3	S389 N390 L391 M397	S389-R393 WeakPolarHBondContact O-CB 3.48Å; S389-R393 PolarHBondContact O-N 3.41Å; N390-R393 VanDerWaalsContact OD1-CZ 3.27Å; N390-R393 PolarHBondContact OD1-NH1 3.03Å; N390-R393 PolarHBondContact OD1-NH2 3.36Å; L391-R393 PolarHBondContact O-N 3.17Å; R393-M397 WeakPolarHBondContact O-CG 3.46Å; R393-M397 PolarHBondContact O-N 2.96Å
394	H	78.3	Confident	68.4	Low	21 Å²	21	74.4 Å²	74.4	10%	0.097	37%	0.366	C	S	.	.	H	α-helix	trans	-82.2	-36.3	177.9	-179	57.4	0	0	0	113.8	C381 Y385 N390 L391 C392 R396 M397 H398	C381-H394 PolarHBondContact SG-NE2 2.98Å; Y385-H394 HydrophobicContact CE2-CB 4.1Å; Y385-H394 AromaticContact CE2-CD2 3.26Å; Y385-H394 WeakPolarHBondContact CE2-CD2 3.44Å; Y385-H394 AromaticContact CE2-CG 3.8Å; Y385-H394 AromaticContact CE2-NE2 3.95Å; Y385-H394 AromaticContact CZ-CD2 3.52Å; Y385-H394 AromaticContact CZ-CG 3.65Å; Y385-H394 PolarHBondContact OH-CD2 2.95Å; Y385-H394 PolarHBondContact OH-CE1 3.48Å; Y385-H394 VanDerWaalsContact OH-CG 3.28Å; Y385-H394 PolarHBondContact OH-ND1 3.31Å; Y385-H394 PolarHBondContact OH-NE2 2.95Å; N390-H394 WeakPolarHBondContact O-CB 3.49Å; N390-H394 PolarHBondContact O-N 3.25Å; N390-H394 VanDerWaalsContact O-N 3.13Å; L391-H394 CarbonylContact O-C 3.33Å; L391-H394 VanDerWaalsContact O-CA 3.31Å; L391-H394 WeakPolarHBondContact O-CA 3.45Å; L391-H394 WeakPolarHBondContact O-CB 3.29Å; L391-H394 PolarHBondContact O-N 3.46Å; C392-H394 PolarHBondContact O-N 2.72Å; H394-R396 VanDerWaalsContact C-N 3.29Å; H394-R396 PolarHBondContact O-N 3.46Å; H394-M397 CarbonylContact O-C 3.6Å; H394-M397 WeakPolarHBondContact O-CA 3.23Å; H394-M397 WeakPolarHBondContact O-CB 3.37Å; H394-M397 PolarHBondContact O-N 3.22Å; H394-M397 VanDerWaalsContact O-N 3.09Å; H394-H398 AromaticContact CD2-CD2 3.97Å; H394-H398 AromaticContact CD2-NE2 3.57Å; H394-H398 AromaticContact CE1-CD2 3.96Å; H394-H398 AromaticContact CE1-CE1 3.82Å; H394-H398 AromaticContact CE1-NE2 3.15Å; H394-H398 PolarHBondContact CE1-NE2 2.81Å; H394-H398 AromaticContact ND1-NE2 3.88Å; H394-H398 AromaticContact NE2-CD2 3.77Å; H394-H398 AromaticContact NE2-CE1 3.87Å; H394-H398 AromaticContact NE2-NE2 2.92Å; H394-H398 PolarHBondContact NE2-NE2 2.82Å; H394-H398 PolarHBondContact O-CD2 2.76Å; H394-H398 PolarHBondContact O-N 3.28Å; H394-H398 VanDerWaalsContact O-N 3.09Å
395	K	71.2	Confident	67.9	Low	80 Å²	80	75.1 Å²	75.1	35%	0.348	37%	0.365	S	S	.	.	H	α-helix	trans	-61.4	-38.4	168.8	-72.8	-161.6	-179.5	-167.3	0	110.9	E379 L391 C392 M397 H398 A399	E379-K395 WeakPolarHBondContact OE1-CE 2.99Å; E379-K395 IonicContact OE1-NZ 2.68Å; E379-K395 PolarHBondContact OE1-NZ 3.17Å; E379-K395 WeakPolarHBondContact OE2-CE 3.32Å; E379-K395 IonicContact OE2-NZ 3.71Å; E379-K395 PolarHBondContact OE2-NZ 3.31Å; L391-K395 HydrophobicContact CD1-CD 4.49Å; L391-K395 HydrophobicContact CD1-CG 3.94Å; L391-K395 HydrophobicContact CG-CG 4.28Å; L391-K395 PolarHBondContact O-N 3.21Å; C392-K395 PolarHBondContact O-N 3.14Å; K395-M397 PolarHBondContact O-N 2.71Å; K395-H398 WeakPolarHBondContact O-CA 3.48Å; K395-H398 WeakPolarHBondContact O-CB 3.39Å; K395-H398 PolarHBondContact O-N 3.48Å; K395-A399 PolarHBondContact O-N 2.87Å; K395-A399 VanDerWaalsContact O-N 3.14Å
396	R	74.1	Confident	67.4	Low	168 Å²	168	79.6 Å²	79.6	63%	0.634	39%	0.386	S	S	*	.	H	α-helix	trans	-58.3	-45.9	169	-168.4	177.7	-58.7	178.8	1.2	112	C392 H394 H398 A399 D400	C392-R396 PolarHBondContact O-N 3.49Å; H394-R396 VanDerWaalsContact C-N 3.29Å; H394-R396 PolarHBondContact O-N 3.46Å; R396-H398 PolarHBondContact O-N 3.4Å; R396-H398 VanDerWaalsContact O-N 3.11Å; R396-A399 WeakPolarHBondContact O-CB 3.29Å; R396-A399 PolarHBondContact O-N 3.46Å; R396-A399 VanDerWaalsContact O-N 3.12Å; R396-D400 VanDerWaalsContact O-CG 3.27Å; R396-D400 PolarHBondContact O-N 2.93Å
397	M	61.4	Low	67.6	Low	84 Å²	84	78.3 Å²	78.3	41%	0.414	38%	0.378	S	S	.	.	H	α-helix	trans	-60.2	-19.6	172.7	-69.4	-180	68.6	0	0	113.7	R393 H394 K395 D400 C401	R393-M397 WeakPolarHBondContact O-CG 3.46Å; R393-M397 PolarHBondContact O-N 2.96Å; H394-M397 CarbonylContact O-C 3.6Å; H394-M397 WeakPolarHBondContact O-CA 3.23Å; H394-M397 WeakPolarHBondContact O-CB 3.37Å; H394-M397 PolarHBondContact O-N 3.22Å; H394-M397 VanDerWaalsContact O-N 3.09Å; K395-M397 PolarHBondContact O-N 2.71Å; M397-D400 CarbonylContact O-C 3.27Å; M397-C401 WeakPolarHBondContact O-CB 3.45Å; M397-C401 PolarHBondContact O-N 2.77Å; M397-C401 PolarHBondContact O-SG 2.76Å
398	H	66.6	Low	67.4	Low	30 Å²	30	86.5 Å²	86.5	14%	0.139	41%	0.413	C	S	.	.	H	α-helix	trans	-82.7	-35.7	173.4	-74.1	-62.7	0	0	0	113.6	C378 V380 C381 H394 K395 R396 D400 C401 R402	C378-H398 PolarHBondContact SG-CD2 3Å; C378-H398 PolarHBondContact SG-NE2 3.24Å; V380-H398 HydrophobicContact CB-CB 4.18Å; V380-H398 HydrophobicContact CG1-CB 4.01Å; V380-H398 WeakPolarHBondContact CG1-ND1 3.13Å; V380-H398 HydrophobicContact CG2-CB 4.18Å; C381-H398 PolarHBondContact SG-CE1 2.8Å; C381-H398 PolarHBondContact SG-NE2 2.71Å; H394-H398 AromaticContact CD2-CD2 3.97Å; H394-H398 AromaticContact CD2-NE2 3.57Å; H394-H398 AromaticContact CE1-CD2 3.96Å; H394-H398 AromaticContact CE1-CE1 3.82Å; H394-H398 AromaticContact CE1-NE2 3.15Å; H394-H398 PolarHBondContact CE1-NE2 2.81Å; H394-H398 AromaticContact ND1-NE2 3.88Å; H394-H398 AromaticContact NE2-CD2 3.77Å; H394-H398 AromaticContact NE2-CE1 3.87Å; H394-H398 AromaticContact NE2-NE2 2.92Å; H394-H398 PolarHBondContact NE2-NE2 2.82Å; H394-H398 PolarHBondContact O-CD2 2.76Å; H394-H398 PolarHBondContact O-N 3.28Å; H394-H398 VanDerWaalsContact O-N 3.09Å; K395-H398 WeakPolarHBondContact O-CA 3.48Å; K395-H398 WeakPolarHBondContact O-CB 3.39Å; K395-H398 PolarHBondContact O-N 3.48Å; R396-H398 PolarHBondContact O-N 3.4Å; R396-H398 VanDerWaalsContact O-N 3.11Å; H398-D400 VanDerWaalsContact C-N 3.27Å; H398-C401 WeakPolarHBondContact O-CB 3.43Å; H398-C401 PolarHBondContact O-N 2.81Å; H398-R402 PolarHBondContact O-N 2.85Å
399	A	62.9	Low	67.6	Low	66 Å²	66	83.6 Å²	83.6	55%	0.545	40%	0.403	S	S	.	.	H	α-helix	trans	-57.8	-46.1	164	0	0	0	0	0	109.9	K395 R396 C401 R402	K395-A399 PolarHBondContact O-N 2.87Å; K395-A399 VanDerWaalsContact O-N 3.14Å; R396-A399 WeakPolarHBondContact O-CB 3.29Å; R396-A399 PolarHBondContact O-N 3.46Å; R396-A399 VanDerWaalsContact O-N 3.12Å; A399-C401 PolarHBondContact O-N 2.85Å; A399-R402 PolarHBondContact O-N 3.3Å
400	D	52.4	Low	67.6	Low	56 Å²	56	83.1 Å²	83.1	30%	0.299	40%	0.399	S	S	.	.	H	α-helix	trans	-69.2	-12.2	173.9	-52.7	-40.1	0	0	0	113.8	R396 M397 H398 T403 S415	R396-D400 VanDerWaalsContact O-CG 3.27Å; R396-D400 PolarHBondContact O-N 2.93Å; M397-D400 CarbonylContact O-C 3.27Å; H398-D400 VanDerWaalsContact C-N 3.27Å; D400-T403 WeakPolarHBondContact CA-OG1 3.48Å; D400-T403 PolarHBondContact O-OG1 2.76Å; D400-S415 VanDerWaalsContact CB-O 3.3Å; D400-S415 WeakPolarHBondContact CB-O 3.42Å
401	C	49.4	Very low	67.4	Low	42 Å²	42	83.6 Å²	83.6	28%	0.284	41%	0.413	S	S	.	.	H	α-helix	trans	-81.6	-28.6	174.1	-84.5	0	0	0	0	112.3	M397 H398 A399 Q404	M397-C401 WeakPolarHBondContact O-CB 3.45Å; M397-C401 PolarHBondContact O-N 2.77Å; M397-C401 PolarHBondContact O-SG 2.76Å; H398-C401 WeakPolarHBondContact O-CB 3.43Å; H398-C401 PolarHBondContact O-N 2.81Å; A399-C401 PolarHBondContact O-N 2.85Å; C401-Q404 VanDerWaalsContact O-CB 3.28Å; C401-Q404 WeakPolarHBondContact O-CB 3.35Å; C401-Q404 WeakPolarHBondContact O-CG 3.41Å; C401-Q404 PolarHBondContact O-N 2.82Å; C401-Q404 PolarHBondContact O-NE2 3.05Å
402	R	47.7	Very low	67	Low	242 Å²	242	88.5 Å²	88.5	91%	0.913	44%	0.436	S	S	*	.	H	α-helix	trans	-78.5	-26.8	175.5	-157	174.7	-174.6	111.9	-3.2	111.4	H398 A399 Q404	H398-R402 PolarHBondContact O-N 2.85Å; A399-R402 PolarHBondContact O-N 3.3Å; R402-Q404 VanDerWaalsContact C-N 3.28Å; R402-Q404 PolarHBondContact O-N 2.89Å
403	T	54.3	Low	67	Low	95 Å²	95	91.7 Å²	91.7	58%	0.583	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	21.7	169.8	59.4	0	0	0	0	113.2	D400 I405	D400-T403 WeakPolarHBondContact CA-OG1 3.48Å; D400-T403 PolarHBondContact O-OG1 2.76Å; T403-I405 WeakPolarHBondContact O-CG1 3.45Å; T403-I405 PolarHBondContact O-N 3.45Å
404	Q	60.1	Low	67.1	Low	69 Å²	69	86.5 Å²	86.5	32%	0.322	43%	0.428	S	S	.	.			trans	-52.1	106.8	-178.4	-111.5	175	105.3	0	0	112	C401 R402 K406 M413	C401-Q404 VanDerWaalsContact O-CB 3.28Å; C401-Q404 WeakPolarHBondContact O-CB 3.35Å; C401-Q404 WeakPolarHBondContact O-CG 3.41Å; C401-Q404 PolarHBondContact O-N 2.82Å; C401-Q404 PolarHBondContact O-NE2 3.05Å; R402-Q404 VanDerWaalsContact C-N 3.28Å; R402-Q404 PolarHBondContact O-N 2.89Å; Q404-K406 PolarHBondContact O-N 2.86Å; Q404-M413 HydrophobicContact CB-CB 4.15Å; Q404-M413 HydrophobicContact CG-CB 4.19Å; Q404-M413 VanDerWaalsContact OE1-CB 3.32Å
405	I	65.8	Low	66.4	Low	63 Å²	63	87.1 Å²	87.1	32%	0.323	44%	0.435	S	S	.	.			trans	-81.6	103.9	-168.6	-41.4	178.6	0	0	0	108.5	T403 F414 T417 L420	T403-I405 WeakPolarHBondContact O-CG1 3.45Å; T403-I405 PolarHBondContact O-N 3.45Å; I405-F414 PolarHBondContact N-O 2.92Å; I405-F414 PolarHBondContact O-N 3.07Å; I405-T417 HydrophobicContact CD1-CG2 3.79Å; I405-T417 WeakPolarHBondContact CD1-OG1 3.28Å; I405-L420 HydrophobicContact CB-CD2 3.75Å; I405-L420 HydrophobicContact CG2-CD2 3.37Å
406	K	70.4	Confident	66.3	Low	153 Å²	153	86 Å²	86	67%	0.665	44%	0.435	S	S	*	.			trans	-61.5	133	176.9	64.8	-175.8	178.9	-176.4	0	111.2	Q404 K408 M413	Q404-K406 PolarHBondContact O-N 2.86Å; K406-K408 PolarHBondContact O-N 2.67Å; K406-M413 HydrophobicContact CB-CG 4.47Å
407	C	78.9	Confident	65.9	Low	2 Å²	2	81.9 Å²	81.9	1%	0.014	43%	0.429	C	S	.	.			trans	-67.4	123.5	167.6	-175.9	0	0	0	0	109.3	D409 G411 Q412 F414 L420 H423	C407-D409 PolarHBondContact O-N 2.98Å; C407-D409 PolarHBondContact SG-N 3.31Å; C407-D409 PolarHBondContact SG-OD2 3.27Å; C407-G411 VanDerWaalsContact O-CA 3.27Å; C407-G411 WeakPolarHBondContact O-CA 3.33Å; C407-G411 PolarHBondContact O-N 2.86Å; C407-Q412 WeakPolarHBondContact CB-O 3.34Å; C407-Q412 PolarHBondContact N-O 2.91Å; C407-F414 HydrophobicContact CB-CE2 4.16Å; C407-L420 HydrophobicContact CB-CD1 3.67Å; C407-H423 PolarHBondContact SG-CD2 2.94Å; C407-H423 PolarHBondContact SG-NE2 2.9Å
408	K	71.4	Confident	66.4	Low	202 Å²	202	81 Å²	81	88%	0.878	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-25.7	175.9	-71.3	-166.7	174.8	-171.2	0	112	K406	K406-K408 PolarHBondContact O-N 2.67Å
409	D	69.7	Low	66.7	Low	66 Å²	66	81.1 Å²	81.1	35%	0.353	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-16	-170	-37.8	-72.7	0	0	0	113.8	C407 C427	C407-D409 PolarHBondContact O-N 2.98Å; C407-D409 PolarHBondContact SG-N 3.31Å; C407-D409 PolarHBondContact SG-OD2 3.27Å; D409-C427 HydrophobicContact CB-CB 4.14Å
410	C	74.4	Confident	67.5	Low	61 Å²	61	78.6 Å²	78.6	41%	0.412	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.9	8.9	173.9	75.1	0	0	0	0	116.1	Q412 H423	C410-Q412 PolarHBondContact O-N 2.84Å; C410-H423 PolarHBondContact SG-CE1 3.03Å; C410-H423 PolarHBondContact SG-NE2 3.28Å
411	G	72.8	Confident	68.5	Low	48 Å²	48	79.2 Å²	79.2	50%	0.495	42%	0.415	S	S	.	.			trans	74.3	-13.5	178.3	0	0	0	0	0	116.5	C407 M413	C407-G411 VanDerWaalsContact O-CA 3.27Å; C407-G411 WeakPolarHBondContact O-CA 3.33Å; C407-G411 PolarHBondContact O-N 2.86Å; G411-M413 PolarHBondContact O-N 2.88Å
412	Q	73.1	Confident	69.8	Low	110 Å²	110	83.1 Å²	83.1	51%	0.514	43%	0.427	S	S	.	.			trans	-57.2	134.2	180	-73.2	-174.1	-0.6	0	0	112	C407 C410 F414 H423	C407-Q412 WeakPolarHBondContact CB-O 3.34Å; C407-Q412 PolarHBondContact N-O 2.91Å; C410-Q412 PolarHBondContact O-N 2.84Å; Q412-F414 HydrophobicContact CB-CE2 3.53Å; Q412-F414 HydrophobicContact CB-CZ 3.74Å; Q412-F414 VanDerWaalsContact O-CD2 3.25Å; Q412-F414 WeakPolarHBondContact O-CD2 3.45Å; Q412-F414 VanDerWaalsContact O-CE2 3.22Å; Q412-F414 WeakPolarHBondContact O-CE2 3.23Å; Q412-H423 PolarHBondContact OE1-CE1 2.82Å; Q412-H423 VanDerWaalsContact OE1-CE1 3.22Å; Q412-H423 PolarHBondContact OE1-ND1 2.89Å
413	M	77.2	Confident	71.4	Confident	122 Å²	122	73 Å²	73	60%	0.601	39%	0.391	S	S	*	.			trans	-93.2	140.2	-176.8	-64.2	-170.1	-65.1	0	0	111.7	Q404 K406 G411	Q404-M413 HydrophobicContact CB-CB 4.15Å; Q404-M413 HydrophobicContact CG-CB 4.19Å; Q404-M413 VanDerWaalsContact OE1-CB 3.32Å; K406-M413 HydrophobicContact CB-CG 4.47Å; G411-M413 PolarHBondContact O-N 2.88Å
414	F	76.7	Confident	72.4	Confident	37 Å²	37	73.3 Å²	73.3	16%	0.162	38%	0.381	C	S	.	.			trans	-135.3	120.2	-174.7	-68	-77.5	0	0	0	112.3	I405 C407 Q412 T416 L420 H423	I405-F414 PolarHBondContact N-O 2.92Å; I405-F414 PolarHBondContact O-N 3.07Å; C407-F414 HydrophobicContact CB-CE2 4.16Å; Q412-F414 HydrophobicContact CB-CE2 3.53Å; Q412-F414 HydrophobicContact CB-CZ 3.74Å; Q412-F414 VanDerWaalsContact O-CD2 3.25Å; Q412-F414 WeakPolarHBondContact O-CD2 3.45Å; Q412-F414 VanDerWaalsContact O-CE2 3.22Å; Q412-F414 WeakPolarHBondContact O-CE2 3.23Å; F414-T416 PolarHBondContact O-N 3.45Å; F414-T416 VanDerWaalsContact O-N 3.07Å; F414-L420 HydrophobicContact CB-CB 3.98Å; F414-L420 HydrophobicContact CD2-CB 4.27Å; F414-L420 HydrophobicContact CD2-CD1 3.71Å; F414-L420 HydrophobicContact CE2-CD1 4.26Å; F414-L420 HydrophobicContact CG-CB 4.26Å; F414-H423 HydrophobicContact CD2-CB 4.47Å; F414-H423 HydrophobicContact CE1-CB 3.88Å; F414-H423 HydrophobicContact CE2-CB 3.81Å; F414-H423 AromaticContact CE2-CD2 3.41Å; F414-H423 VanDerWaalsContact CE2-CD2 3.41Å; F414-H423 WeakPolarHBondContact CE2-CD2 3.45Å; F414-H423 AromaticContact CE2-CG 3.37Å; F414-H423 AromaticContact CE2-ND1 3.8Å; F414-H423 AromaticContact CE2-NE2 3.87Å; F414-H423 HydrophobicContact CZ-CB 3.51Å; F414-H423 AromaticContact CZ-CD2 3.74Å; F414-H423 AromaticContact CZ-CE1 3.86Å; F414-H423 AromaticContact CZ-CG 3.19Å; F414-H423 AromaticContact CZ-ND1 3.3Å; F414-H423 VanDerWaalsContact CZ-ND1 3.3Å; F414-H423 WeakPolarHBondContact CZ-ND1 3.3Å
415	S	62.8	Low	73	Confident	34 Å²	34	78.3 Å²	78.3	24%	0.238	40%	0.397	C	S	.	.	S	Bend	trans	-73.1	8.8	-180	55.6	0	0	0	0	115.3	D400	D400-S415 VanDerWaalsContact CB-O 3.3Å; D400-S415 WeakPolarHBondContact CB-O 3.42Å
416	T	69.3	Low	72.9	Confident	56 Å²	56	82.6 Å²	82.6	34%	0.344	41%	0.414	S	S	.	.	S	Bend	trans	-150.9	147.5	161	66.9	0	0	0	0	111.1	F414 S418 S419 L420	F414-T416 PolarHBondContact O-N 3.45Å; F414-T416 VanDerWaalsContact O-N 3.07Å; T416-S418 PolarHBondContact O-N 2.86Å; T416-S418 VanDerWaalsContact O-N 3.13Å; T416-S418 PolarHBondContact OG1-OG 3.29Å; T416-S419 PolarHBondContact N-OG 3.42Å; T416-S419 PolarHBondContact O-N 2.96Å; T416-S419 PolarHBondContact O-OG 2.89Å; T416-S419 PolarHBondContact OG1-N 3.21Å; T416-S419 VanDerWaalsContact OG1-N 3.07Å; T416-S419 PolarHBondContact OG1-OG 2.73Å; T416-L420 PolarHBondContact O-N 3.47Å
417	T	67.1	Low	72.9	Confident	82 Å²	82	76.2 Å²	76.2	50%	0.503	39%	0.388	S	S	.	.	H	α-helix	trans	-56.8	-26.5	170.1	-23.2	0	0	0	0	112.4	I405 N421	I405-T417 HydrophobicContact CD1-CG2 3.79Å; I405-T417 WeakPolarHBondContact CD1-OG1 3.28Å; T417-N421 VanDerWaalsContact O-CB 3.31Å; T417-N421 WeakPolarHBondContact O-CB 3.4Å; T417-N421 PolarHBondContact O-N 2.83Å; T417-N421 PolarHBondContact O-ND2 3.42Å
418	S	70.3	Confident	72.1	Confident	66 Å²	66	80.2 Å²	80.2	46%	0.462	41%	0.406	S	S	.	.	H	α-helix	trans	-74.9	-29.8	175.9	94.4	0	0	0	0	113.4	T416 K422	T416-S418 PolarHBondContact O-N 2.86Å; T416-S418 VanDerWaalsContact O-N 3.13Å; T416-S418 PolarHBondContact OG1-OG 3.29Å; S418-K422 WeakPolarHBondContact O-CD 3.44Å; S418-K422 VanDerWaalsContact O-CE 3.31Å; S418-K422 WeakPolarHBondContact O-CE 3.39Å; S418-K422 VanDerWaalsContact O-CG 3.25Å; S418-K422 WeakPolarHBondContact O-CG 3.45Å; S418-K422 PolarHBondContact O-N 3.21Å; S418-K422 PolarHBondContact O-NZ 2.95Å; S418-K422 PolarHBondContact OG-NZ 2.95Å
419	S	74.1	Confident	71.2	Confident	32 Å²	32	73.4 Å²	73.4	22%	0.224	39%	0.394	C	S	.	.	H	α-helix	trans	-78.8	-41.8	171.3	41.1	0	0	0	0	111.1	T416 N421 K422 H423	T416-S419 PolarHBondContact N-OG 3.42Å; T416-S419 PolarHBondContact O-N 2.96Å; T416-S419 PolarHBondContact O-OG 2.89Å; T416-S419 PolarHBondContact OG1-N 3.21Å; T416-S419 VanDerWaalsContact OG1-N 3.07Å; T416-S419 PolarHBondContact OG1-OG 2.73Å; S419-N421 PolarHBondContact O-N 3.31Å; S419-K422 PolarHBondContact O-N 2.91Å; S419-K422 VanDerWaalsContact O-N 3.17Å; S419-H423 WeakPolarHBondContact O-CB 3.32Å; S419-H423 PolarHBondContact O-N 3.02Å
420	L	80.5	Confident	70.3	Confident	12 Å²	12	78 Å²	78	6%	0.063	41%	0.411	C	S	.	.	H	α-helix	trans	-58.9	-47.1	173.5	177.5	61.5	0	0	0	111.4	I405 C407 F414 T416 K422 H423 R424	I405-L420 HydrophobicContact CB-CD2 3.75Å; I405-L420 HydrophobicContact CG2-CD2 3.37Å; C407-L420 HydrophobicContact CB-CD1 3.67Å; F414-L420 HydrophobicContact CB-CB 3.98Å; F414-L420 HydrophobicContact CD2-CB 4.27Å; F414-L420 HydrophobicContact CD2-CD1 3.71Å; F414-L420 HydrophobicContact CE2-CD1 4.26Å; F414-L420 HydrophobicContact CG-CB 4.26Å; T416-L420 PolarHBondContact O-N 3.47Å; L420-K422 PolarHBondContact O-N 2.89Å; L420-H423 CarbonylContact O-C 3.54Å; L420-H423 PolarHBondContact O-N 2.89Å; L420-R424 HydrophobicContact CD1-CG 3.78Å; L420-R424 HydrophobicContact CG-CG 4.1Å; L420-R424 WeakPolarHBondContact O-CB 2.92Å; L420-R424 PolarHBondContact O-N 3.26Å
421	N	72.5	Confident	68.6	Low	69 Å²	69	80.9 Å²	80.9	37%	0.369	42%	0.422	S	S	.	.	H	α-helix	trans	-65.6	-24	178.9	-88.9	-77.9	0	0	0	114	T417 S419 R425	T417-N421 VanDerWaalsContact O-CB 3.31Å; T417-N421 WeakPolarHBondContact O-CB 3.4Å; T417-N421 PolarHBondContact O-N 2.83Å; T417-N421 PolarHBondContact O-ND2 3.42Å; S419-N421 PolarHBondContact O-N 3.31Å; N421-R425 VanDerWaalsContact O-CD 3.27Å; N421-R425 WeakPolarHBondContact O-CD 3.5Å; N421-R425 VanDerWaalsContact O-CG 3.24Å; N421-R425 WeakPolarHBondContact O-CG 3.38Å
422	K	77.6	Confident	67.1	Low	124 Å²	124	86.8 Å²	86.8	54%	0.539	44%	0.436	S	S	.	.	H	α-helix	trans	-73.7	-46	169.2	-70.4	160.3	-167	143.6	0	110.1	S418 S419 L420 F426	S418-K422 WeakPolarHBondContact O-CD 3.44Å; S418-K422 VanDerWaalsContact O-CE 3.31Å; S418-K422 WeakPolarHBondContact O-CE 3.39Å; S418-K422 VanDerWaalsContact O-CG 3.25Å; S418-K422 WeakPolarHBondContact O-CG 3.45Å; S418-K422 PolarHBondContact O-N 3.21Å; S418-K422 PolarHBondContact O-NZ 2.95Å; S418-K422 PolarHBondContact OG-NZ 2.95Å; S419-K422 PolarHBondContact O-N 2.91Å; S419-K422 VanDerWaalsContact O-N 3.17Å; L420-K422 PolarHBondContact O-N 2.89Å; K422-F426 WeakPolarHBondContact O-CD2 3.28Å
423	H	81.1	Confident	65.2	Low	31 Å²	31	91 Å²	91	14%	0.144	45%	0.453	C	S	.	.	H	α-helix	trans	-65	-48.3	-179.6	168.5	87.5	0	0	0	112.9	C407 C410 Q412 F414 S419 L420 R425 F426 C427	C407-H423 PolarHBondContact SG-CD2 2.94Å; C407-H423 PolarHBondContact SG-NE2 2.9Å; C410-H423 PolarHBondContact SG-CE1 3.03Å; C410-H423 PolarHBondContact SG-NE2 3.28Å; Q412-H423 PolarHBondContact OE1-CE1 2.82Å; Q412-H423 VanDerWaalsContact OE1-CE1 3.22Å; Q412-H423 PolarHBondContact OE1-ND1 2.89Å; F414-H423 HydrophobicContact CD2-CB 4.47Å; F414-H423 HydrophobicContact CE1-CB 3.88Å; F414-H423 HydrophobicContact CE2-CB 3.81Å; F414-H423 AromaticContact CE2-CD2 3.41Å; F414-H423 VanDerWaalsContact CE2-CD2 3.41Å; F414-H423 WeakPolarHBondContact CE2-CD2 3.45Å; F414-H423 AromaticContact CE2-CG 3.37Å; F414-H423 AromaticContact CE2-ND1 3.8Å; F414-H423 AromaticContact CE2-NE2 3.87Å; F414-H423 HydrophobicContact CZ-CB 3.51Å; F414-H423 AromaticContact CZ-CD2 3.74Å; F414-H423 AromaticContact CZ-CE1 3.86Å; F414-H423 AromaticContact CZ-CG 3.19Å; F414-H423 AromaticContact CZ-ND1 3.3Å; F414-H423 VanDerWaalsContact CZ-ND1 3.3Å; F414-H423 WeakPolarHBondContact CZ-ND1 3.3Å; S419-H423 WeakPolarHBondContact O-CB 3.32Å; S419-H423 PolarHBondContact O-N 3.02Å; L420-H423 CarbonylContact O-C 3.54Å; L420-H423 PolarHBondContact O-N 2.89Å; H423-R425 VanDerWaalsContact C-N 3.28Å; H423-R425 PolarHBondContact O-N 2.75Å; H423-F426 CarbonylContact O-C 3.57Å; H423-F426 WeakPolarHBondContact O-CA 3.15Å; H423-F426 WeakPolarHBondContact O-CB 3.32Å; H423-F426 PolarHBondContact O-N 3.05Å; H423-C427 PolarHBondContact O-N 3.33Å
424	R	75.6	Confident	62.8	Low	101 Å²	101	89.8 Å²	89.8	38%	0.381	46%	0.463	S	S	.	.	H	α-helix	trans	-51.1	-46.7	175.6	-83	-175	61.4	176.1	-0.4	111.6	L420 F426 C427 E428	L420-R424 HydrophobicContact CD1-CG 3.78Å; L420-R424 HydrophobicContact CG-CG 4.1Å; L420-R424 WeakPolarHBondContact O-CB 2.92Å; L420-R424 PolarHBondContact O-N 3.26Å; R424-F426 PolarHBondContact O-N 3.22Å; R424-C427 CarbonylContact O-C 3.56Å; R424-C427 PolarHBondContact O-N 3.1Å; R424-E428 HydrophobicContact CB-CG 4.48Å; R424-E428 IonicContact CZ-OE1 2.71Å; R424-E428 IonicContact NE-OE1 2.59Å; R424-E428 PolarHBondContact NE-OE1 3.24Å; R424-E428 IonicContact NH2-OE1 2.71Å; R424-E428 PolarHBondContact NH2-OE1 3.08Å; R424-E428 VanDerWaalsContact O-CB 3.26Å; R424-E428 WeakPolarHBondContact O-CB 3.36Å; R424-E428 VanDerWaalsContact O-CG 3.27Å; R424-E428 WeakPolarHBondContact O-CG 3.38Å; R424-E428 PolarHBondContact O-N 3.49Å
425	R	71.8	Confident	60.6	Low	174 Å²	174	92.1 Å²	92.1	66%	0.657	49%	0.489	S	S	*	.	H	α-helix	trans	-63.7	-10.4	175.8	-67.4	174.5	-174.9	-159.7	-1.4	115.1	N421 H423	N421-R425 VanDerWaalsContact O-CD 3.27Å; N421-R425 WeakPolarHBondContact O-CD 3.5Å; N421-R425 VanDerWaalsContact O-CG 3.24Å; N421-R425 WeakPolarHBondContact O-CG 3.38Å; H423-R425 VanDerWaalsContact C-N 3.28Å; H423-R425 PolarHBondContact O-N 2.75Å
426	F	64.3	Low	58.9	Low	153 Å²	153	94.2 Å²	94.2	67%	0.671	52%	0.515	S	S	*	.	H	α-helix	trans	-104.4	-22.5	168.1	-64.4	-60.6	0	0	0	113.3	K422 H423 R424 K430	K422-F426 WeakPolarHBondContact O-CD2 3.28Å; H423-F426 CarbonylContact O-C 3.57Å; H423-F426 WeakPolarHBondContact O-CA 3.15Å; H423-F426 WeakPolarHBondContact O-CB 3.32Å; H423-F426 PolarHBondContact O-N 3.05Å; R424-F426 PolarHBondContact O-N 3.22Å; F426-K430 WeakPolarHBondContact O-CB 3.44Å; F426-K430 PolarHBondContact O-N 3.5Å
427	C	69.8	Low	56.9	Low	19 Å²	19	95.2 Å²	95.2	13%	0.128	54%	0.537	C	S	.	.	H	α-helix	trans	-82.1	-54.9	177.2	-147.2	0	0	0	0	111.1	D409 H423 R424 G429 K430 N431	D409-C427 HydrophobicContact CB-CB 4.14Å; H423-C427 PolarHBondContact O-N 3.33Å; R424-C427 CarbonylContact O-C 3.56Å; R424-C427 PolarHBondContact O-N 3.1Å; C427-G429 PolarHBondContact O-N 3.23Å; C427-G429 VanDerWaalsContact O-N 3.17Å; C427-K430 CarbonylContact O-C 3.58Å; C427-K430 VanDerWaalsContact O-C 3.29Å; C427-K430 PolarHBondContact O-N 3.19Å; C427-N431 PolarHBondContact O-N 3.45Å
428	E	62.5	Low	55.4	Low	85 Å²	85	99.2 Å²	99.2	40%	0.397	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-53.8	-33.3	169.4	-61.4	161.4	165.3	0	0	111.3	R424 K430	R424-E428 HydrophobicContact CB-CG 4.48Å; R424-E428 IonicContact CZ-OE1 2.71Å; R424-E428 IonicContact NE-OE1 2.59Å; R424-E428 PolarHBondContact NE-OE1 3.24Å; R424-E428 IonicContact NH2-OE1 2.71Å; R424-E428 PolarHBondContact NH2-OE1 3.08Å; R424-E428 VanDerWaalsContact O-CB 3.26Å; R424-E428 WeakPolarHBondContact O-CB 3.36Å; R424-E428 VanDerWaalsContact O-CG 3.27Å; R424-E428 WeakPolarHBondContact O-CG 3.38Å; R424-E428 PolarHBondContact O-N 3.49Å; E428-K430 VanDerWaalsContact C-N 3.34Å
429	G	53.1	Low	53.5	Low	59 Å²	59	106.8 Å²	106.8	61%	0.608	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-81.8	-0.9	176.4	0	0	0	0	0	115.6	C427	C427-G429 PolarHBondContact O-N 3.23Å; C427-G429 VanDerWaalsContact O-N 3.17Å
430	K	50.4	Low	51.3	Low	164 Å²	164	109.5 Å²	109.5	71%	0.713	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-150	55.2	-178.7	-70.4	-163.9	170.7	-165.5	0	113.5	F426 C427 E428 H432	F426-K430 WeakPolarHBondContact O-CB 3.44Å; F426-K430 PolarHBondContact O-N 3.5Å; C427-K430 CarbonylContact O-C 3.58Å; C427-K430 VanDerWaalsContact O-C 3.29Å; C427-K430 PolarHBondContact O-N 3.19Å; E428-K430 VanDerWaalsContact C-N 3.34Å; K430-H432 PolarHBondContact O-N 2.99Å
431	N	38.1	Very low	49	Very low	121 Å²	121	118 Å²	118	65%	0.647	64%	0.643	S	S	*	*			trans	-68.3	80.9	159.2	-78.9	-35.2	0	0	0	110.3	C427	C427-N431 PolarHBondContact O-N 3.45Å
432	H	40.8	Very low	46.8	Very low	171 Å²	171	117.9 Å²	117.9	79%	0.792	66%	0.659	S	S	*	*			trans	-179.9	83.5	148.8	-89.6	-57.1	0	0	0	109.2	K430	K430-H432 PolarHBondContact O-N 2.99Å
433	F	32.6	Very low	44.6	Very low	198 Å²	198	119.4 Å²	119.4	87%	0.868	67%	0.672	S	S	*	*			trans	-130.9	39.5	150.8	-112.3	-80.5	0	0	0	110.7	A435	F433-A435 PolarHBondContact O-N 3.26Å
434	A	28.2	Very low	42.6	Very low	98 Å²	98	123.9 Å²	123.9	81%	0.81	70%	0.704	S	S	*	*			trans	-78.3	87.9	162.1	0	0	0	0	0	108.6
435	A	29.3	Very low	40.4	Very low	86 Å²	86	126.2 Å²	126.2	71%	0.711	72%	0.723	S	S	*	*			trans	-117.2	92.5	161.7	0	0	0	0	0	106.3	F433	F433-A435 PolarHBondContact O-N 3.26Å
436	G	27.1	Very low	38.9	Very low	77 Å²	77	124.1 Å²	124.1	79%	0.794	73%	0.732	S	S	*	*			trans	-67.7	152.3	-179.4	0	0	0	0	0	111.8
437	G	29	Very low	37.1	Very low	77 Å²	77	119.5 Å²	119.5	79%	0.794	73%	0.728	S	S	*	*			trans	-75.8	154.9	167.3	0	0	0	0	0	111.4
438	L	35.4	Very low	35.1	Very low	166 Å²	166	125.6 Å²	125.6	87%	0.869	76%	0.764	S	S	*	*			trans	-139.4	125.4	166.2	-78.6	178.5	0	0	0	110.4
439	F	29.3	Very low	34.2	Very low	225 Å²	225	127.7 Å²	127.7	99%	0.987	79%	0.785	S	S	*	*			trans	-150.6	92.8	152	-109.6	-68.2	0	0	0	108.1
440	A	27.6	Very low	33.1	Very low	90 Å²	90	128.7 Å²	128.7	74%	0.744	80%	0.795	S	S	*	*			trans	-161	145.6	167.5	0	0	0	0	0	109.1
441	Q	32	Very low	32.4	Very low	190 Å²	190	128.7 Å²	128.7	89%	0.888	80%	0.802	S	S	*	*			trans	-81.4	171.4	170.9	-53.3	96.9	-14.6	0	0	110.5
442	G	27.5	Very low	31.8	Very low	67 Å²	67	127.7 Å²	127.7	69%	0.691	80%	0.797	S	S	*	*			cis	144.4	127	-9.9	0	0	0	0	0	113.2
443	L	32	Very low	31.5	Very low	155 Å²	155	127.1 Å²	127.1	81%	0.812	79%	0.792	S	S	*	*			trans	69.7	161.7	171	-74.2	168.5	0	0	0	116.6	L445	L443-L445 HydrophobicContact CD2-CG 4.13Å
444	P	39.2	Very low	31.4	Very low	126 Å²	126	122.8 Å²	122.8	82%	0.818	79%	0.786	S	S	*	*			cis	-124.3	-173.7	19.2	43	-27.9	0	0	0	119
445	L	28.8	Very low	31.3	Very low	149 Å²	149	122.4 Å²	122.4	78%	0.78	78%	0.783	S	S	*	*			trans	-88.3	-169.8	-175.7	-67.6	169	0	0	0	111.9	L443	L443-L445 HydrophobicContact CD2-CG 4.13Å
446	P	40.4	Very low	31.2	Very low	131 Å²	131	125.6 Å²	125.6	85%	0.851	79%	0.787	S	S	*	*			cis	-134.9	-174.7	5.1	42.4	-23.4	0	0	0	115.5
447	G	25.4	Very low	31.1	Very low	56 Å²	56	127.4 Å²	127.4	58%	0.577	78%	0.784	S	S	*	*			cis	157.3	150	-14.8	0	0	0	0	0	115.2
448	T	28.3	Very low	31.2	Very low	146 Å²	146	131.6 Å²	131.6	90%	0.896	79%	0.787	S	S	*	*			trans	61.4	165.3	159.2	66	0	0	0	0	120.6
449	P	43	Very low	30.8	Very low	130 Å²	130	126.6 Å²	126.6	84%	0.844	78%	0.775	S	S	*	*			cis	-122.2	174	-16.1	36.9	-21.4	0	0	0	114.3
450	G	30	Very low	30.8	Very low	79 Å²	79	124.5 Å²	124.5	81%	0.814	77%	0.768	S	S	*	*			trans	-171.6	116.4	170.7	0	0	0	0	0	114.6
451	L	36.8	Very low	30.8	Very low	164 Å²	164	125.4 Å²	125.4	86%	0.859	77%	0.769	S	S	*	*			trans	-92.3	171.6	173.8	-64.7	164.3	0	0	0	109.4
452	D	25.4	Very low	30.5	Very low	101 Å²	101	122.3 Å²	122.3	54%	0.54	77%	0.768	S	S	.	*			cis	-163.6	167	13.6	-139.1	-21	0	0	0	113.6
453	K	33.3	Very low	30.6	Very low	159 Å²	159	123.4 Å²	123.4	69%	0.691	77%	0.771	S	S	*	*			trans	31	120.1	147.1	-75.2	152.6	-157.9	136.5	0	124.6
454	S	30.7	Very low	30.3	Very low	106 Å²	106	119.2 Å²	119.2	74%	0.741	77%	0.765	S	S	*	*				65.4	110.2	109.6	-50.9	0	0	0	0	124.7
455	A	25.9	Very low	29.8	Very low	91 Å²	91	121.1 Å²	121.1	75%	0.752	77%	0.768	S	S	*	*				80.1	161.2	114.3	0	0	0	0	0	123.8
456	L	27.6	Very low	29.7	Very low	152 Å²	152	117.5 Å²	117.5	80%	0.796	76%	0.759	S	S	*	*			trans	97.1	111.4	157.8	-55.3	-173.8	0	0	0	121.7
457	T	24.8	Very low	29.1	Very low	116 Å²	116	117.1 Å²	117.1	71%	0.712	75%	0.75	S	S	*	*				66.5	117.7	127.4	61.5	0	0	0	0	124.1
458	L	32.8	Very low	29.1	Very low	165 Å²	165	125.7 Å²	125.7	86%	0.864	77%	0.767	S	S	*	*				72.1	126.4	114.1	-168.2	68.6	0	0	0	121.5
459	G	25.9	Very low	29	Very low	61 Å²	61	127.9 Å²	127.9	63%	0.629	76%	0.764	S	S	*	*			trans	136	143.6	152.4	0	0	0	0	0	114
460	H	30	Very low	28.2	Very low	181 Å²	181	125.3 Å²	125.3	84%	0.838	76%	0.761	S	S	*	*			cis	-151.8	162.4	-14.8	-111.5	-86.7	0	0	0	108.3
461	S	26.1	Very low	28.1	Very low	108 Å²	108	126.3 Å²	126.3	76%	0.755	76%	0.761	S	S	*	*			trans	-112.9	162	-173.3	-52.6	0	0	0	0	114.1
462	S	26.1	Very low	27.6	Very low	125 Å²	125	123.5 Å²	123.5	87%	0.874	76%	0.756	S	S	*	*			trans	74.1	159.4	169.9	82.8	0	0	0	0	116.2
463	A	30.7	Very low	27.7	Very low	91 Å²	91	128.7 Å²	128.7	75%	0.752	77%	0.768	S	S	*	*			cis	-143.7	170.8	9.6	0	0	0	0	0	113.6
464	G	25.4	Very low	27.4	Very low	67 Å²	67	128.2 Å²	128.2	69%	0.691	77%	0.768	S	S	*	*			trans	136.7	70	-174	0	0	0	0	0	110.2
465	L	27.5	Very low	27.3	Very low	165 Å²	165	131.4 Å²	131.4	86%	0.864	77%	0.77	S	S	*	*				53.3	128.5	65.7	-59.9	177.9	0	0	0	113
466	A	26.4	Very low	27.3	Very low	73 Å²	73	132.8 Å²	132.8	60%	0.603	77%	0.774	S	S	*	*			cis	-161.6	166.6	-14.2	0	0	0	0	0	109.8
467	D	27.9	Very low	27.2	Very low	124 Å²	124	128.7 Å²	128.7	66%	0.663	77%	0.769	S	S	*	*			trans	35.1	120.5	151	-53.1	-37.3	0	0	0	120.8
468	Y	27	Very low	27.6	Very low	236 Å²	236	131 Å²	131	93%	0.925	78%	0.777	S	S	*	*				-150.1	132.5	108.2	-123.2	-85.8	0	0	0	110.9
469	F	24.6	Very low	27.4	Very low	192 Å²	192	128.9 Å²	128.9	84%	0.842	77%	0.77	S	S	*	*			trans	-84.6	148.1	-178	-88.2	-109.3	0	0	0	112.4
470	G	26.1	Very low	27.5	Very low	75 Å²	75	135 Å²	135	77%	0.773	78%	0.78	S	S	*	*			trans	-169.7	126.6	168.8	0	0	0	0	0	112.7
471	A	29.1	Very low	27.8	Very low	100 Å²	100	132.5 Å²	132.5	83%	0.826	78%	0.78	S	S	*	*			trans	-72.5	148.9	176.5	0	0	0	0	0	111.1
472	S	26.3	Very low	27.8	Very low	105 Å²	105	131.9 Å²	131.9	73%	0.734	78%	0.782	S	S	*	*			cis	86.7	107.5	28.4	-161	0	0	0	0	115.2
473	R	27.8	Very low	28.5	Very low	211 Å²	211	129.9 Å²	129.9	80%	0.796	77%	0.772	S	S	*	*			trans	84.7	146.5	167.7	-52	-173.5	173.7	-136.7	-2.8	119.5
474	H	27	Very low	28.6	Very low	149 Å²	149	131.7 Å²	131.7	69%	0.69	78%	0.777	S	S	*	*			trans	70.8	139.6	167.5	-55.4	-71.7	0	0	0	115.9
475	H	27.1	Very low	28.7	Very low	172 Å²	172	132.8 Å²	132.8	80%	0.796	78%	0.779	S	S	*	*			cis	-134.2	177.2	-0.6	-86.9	-70.1	0	0	0	112.1
476	S	27.1	Very low	29.4	Very low	120 Å²	120	135 Å²	135	84%	0.839	78%	0.782	S	S	*	*			trans	-89.6	152.3	176.6	50.9	0	0	0	0	114.5
477	G	25.4	Very low	30.1	Very low	67 Å²	67	136.5 Å²	136.5	69%	0.691	79%	0.786	S	S	*	*			trans	113.4	159.9	173.6	0	0	0	0	0	112.9
478	L	32.3	Very low	30.2	Very low	165 Å²	165	140.2 Å²	140.2	86%	0.864	80%	0.796	S	S	*	*			cis	-148.6	174.2	-4.6	-61.9	173.8	0	0	0	106.9
479	T	29.6	Very low	30.1	Very low	119 Å²	119	133.8 Å²	133.8	73%	0.73	79%	0.786	S	S	*	*			cis	-157.6	163	3.9	-15.3	0	0	0	0	109
480	F	28.6	Very low	30.8	Very low	189 Å²	189	134.1 Å²	134.1	83%	0.829	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-83.9	152.2	146.1	-93.1	-105.3	0	0	0	108.9	A482	F480-A482 PolarHBondContact O-N 2.85Å
481	P	34.9	Very low	31.4	Very low	129 Å²	129	136.5 Å²	136.5	84%	0.838	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-65.5	132.1	170.9	28.5	-33.6	0	0	0	110.6
482	A	27.5	Very low	31.2	Very low	96 Å²	96	135 Å²	135	79%	0.793	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-101.3	160.5	-176.4	0	0	0	0	0	112.9	F480	F480-A482 PolarHBondContact O-N 2.85Å
483	A	40.6	Very low	31.4	Very low	82 Å²	82	138.1 Å²	138.1	68%	0.678	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-80.2	163	176	0	0	0	0	0	112.9	A485	A483-A485 PolarHBondContact O-N 3.37Å
484	P	31.8	Very low	31.5	Very low	130 Å²	130	136.9 Å²	136.9	84%	0.844	79%	0.791	S	S	*	*			trans	-74.3	109.5	157.5	30.8	-30.1	0	0	0	108.5
485	A	27.9	Very low	31.9	Very low	89 Å²	89	135.3 Å²	135.3	74%	0.736	79%	0.794	S	S	*	*			cis	90.6	100	46.7	0	0	0	0	0	113.2	A483	A483-A485 PolarHBondContact O-N 3.37Å
486	F	42.6	Very low	31.9	Very low	213 Å²	213	132.6 Å²	132.6	93%	0.934	80%	0.795	S	S	*	*			trans	-82.8	151.3	162.7	-73.8	-94.6	0	0	0	110.5
487	P	40.6	Very low	32.1	Very low	104 Å²	104	130.1 Å²	130.1	68%	0.675	79%	0.788	S	S	*	*			trans	-119.1	132.2	178.5	37.2	-26	0	0	0	116.8
488	F	30.6	Very low	32.2	Very low	202 Å²	202	133.6 Å²	133.6	89%	0.886	79%	0.79	S	S	*	*			trans	56.1	150.5	139.7	-68.3	-113.9	0	0	0	119.9
489	S	23.6	Very low	32	Very low	101 Å²	101	134.5 Å²	134.5	71%	0.706	78%	0.783	S	S	*	*			cis	-167.7	165.6	-14.6	-99.6	0	0	0	0	111.5
490	F	41.2	Very low	32.2	Very low	199 Å²	199	136.1 Å²	136.1	87%	0.873	78%	0.782	S	S	*	*			trans	-90.3	150.3	167.8	-95.5	-90.4	0	0	0	111.4
491	P	37.3	Very low	32.4	Very low	124 Å²	124	136 Å²	136	81%	0.805	78%	0.776	S	S	*	*				-134.2	-175.5	70	41.3	-27.8	0	0	0	113.7
492	G	25.7	Very low	32.2	Very low	68 Å²	68	135.5 Å²	135.5	70%	0.701	77%	0.773	S	S	*	*			cis	124.1	117.4	-5.5	0	0	0	0	0	114.5
493	L	29.5	Very low	32.1	Very low	171 Å²	171	136.7 Å²	136.7	90%	0.895	76%	0.762	S	S	*	*			trans	-154.8	139.2	177.6	-122.8	171.4	0	0	0	110.9
494	F	31.5	Very low	31.4	Very low	185 Å²	185	139.6 Å²	139.6	81%	0.811	77%	0.766	S	S	*	*			trans	-114.2	144.2	169.6	-89.3	-80.9	0	0	0	110
495	P	34.9	Very low	31.5	Very low	116 Å²	116	140.8 Å²	140.8	75%	0.753	76%	0.763	S	S	*	*				-121.1	150.5	105.1	0.1	20.9	0	0	0	110.9
496	S	27.6	Very low	32.2	Very low	116 Å²	116	142.2 Å²	142.2	81%	0.811	77%	0.765	S	S	*	*			cis	84.6	117.2	46.4	-55.9	0	0	0	0	114.1
497	G	29.8	Very low	31.4	Very low	67 Å²	67	136.4 Å²	136.4	69%	0.691	76%	0.756	S	S	*	*			trans	107.1	102.1	-176.3	0	0	0	0	0	111.8
498	L	28.9	Very low	30.8	Very low	140 Å²	140	138.2 Å²	138.2	73%	0.733	77%	0.765	S	S	*	*				56.8	116.6	55.1	-47.5	175.5	0	0	0	110.6
499	Y	27.5	Very low	30.5	Very low	185 Å²	185	134.1 Å²	134.1	73%	0.725	76%	0.762	S	S	*	*			cis	-164.7	166.8	41.6	-94.6	-67.5	0	0	0	116
500	H	32.9	Very low	30.6	Very low	153 Å²	153	133.4 Å²	133.4	71%	0.708	76%	0.762	S	S	*	*			trans	47.3	114.7	145.5	-70.4	-60.2	0	0	0	125.6
501	R	32.5	Very low	30.9	Very low	186 Å²	186	129.3 Å²	129.3	70%	0.702	76%	0.755	S	S	*	*				-4.2	127	119.3	-176.9	-164.4	-165.2	109.4	-8.8	117.5	Q503	R501-Q503 HydrophobicContact CG-CB 4.48Å
502	P	31.5	Very low	30.4	Very low	118 Å²	118	128.7 Å²	128.7	77%	0.766	75%	0.749	S	S	*	*				-111.3	173.8	110.5	-9.5	28.1	0	0	0	110.5
503	Q	25.1	Very low	30.4	Very low	122 Å²	122	136.4 Å²	136.4	57%	0.57	76%	0.757	S	S	*	*			cis	75.2	123.7	-12.5	-94.1	-163.7	-60.4	0	0	124.9	R501	R501-Q503 HydrophobicContact CG-CB 4.48Å
504	L	25.7	Very low	30.2	Very low	143 Å²	143	135.9 Å²	135.9	75%	0.749	75%	0.75	S	S	*	*			trans	72.9	142.8	145.8	-64.3	175.2	0	0	0	122.3
505	I	35.7	Very low	29.9	Very low	154 Å²	154	133 Å²	133	79%	0.79	75%	0.747	S	S	*	*			trans	-54.9	157.6	167.9	-2.2	175.7	0	0	0	112
506	P	41.3	Very low	29.4	Very low	119 Å²	119	131 Å²	131	77%	0.773	74%	0.741	S	S	*	*				-162.4	174.2	76.3	44.8	-23.9	0	0	0	120.7
507	A	26.4	Very low	29.4	Very low	92 Å²	92	134.6 Å²	134.6	76%	0.76	74%	0.744	S	S	*	*			trans	75.7	100	136.6	0	0	0	0	0	124
508	T	27.2	Very low	29.3	Very low	141 Å²	141	135.6 Å²	135.6	87%	0.865	75%	0.747	S	S	*	*			trans	-147.9	143.1	134.7	50.1	0	0	0	0	108.1
509	S	25.7	Very low	30.1	Very low	117 Å²	117	134 Å²	134	82%	0.818	75%	0.745	S	S	*	*			cis	-160.6	-157.6	-8.4	59.4	0	0	0	0	110.1
510	A	23.9	Very low	30.1	Very low	85 Å²	85	131.2 Å²	131.2	70%	0.702	75%	0.747	S	S	*	*			trans	-134.8	-178.5	175.3	0	0	0	0	0	108.3
511	P	48.1	Very low	29.9	Very low	113 Å²	113	130 Å²	130	73%	0.734	75%	0.75	S	S	*	*			cis	-155.2	179.6	23.4	44.5	-21.2	0	0	0	120.5
512	V	26.2	Very low	29.4	Very low	112 Å²	112	124.1 Å²	124.1	68%	0.679	75%	0.747	S	S	*	*			trans	55.3	120.5	159.3	-140.5	0	0	0	0	122.7
513	R	27	Very low	29.8	Very low	230 Å²	230	125 Å²	125	87%	0.868	75%	0.753	S	S	*	*				157.4	106.1	119.3	-85	175.2	-175.6	178.6	2.3	110.7
514	H	25.6	Very low	29.9	Very low	159 Å²	159	122.3 Å²	122.3	74%	0.736	76%	0.758	S	S	*	*				79.8	105.8	89.8	-93.2	-76.4	0	0	0	115.8
515	T	24.9	Very low	30.1	Very low	124 Å²	124	122.1 Å²	122.1	76%	0.761	76%	0.762	S	S	*	*				31.5	131.7	129.4	54.9	0	0	0	0	118.8
516	A	24.7	Very low	29.7	Very low	75 Å²	75	122.5 Å²	122.5	62%	0.62	76%	0.761	S	S	*	*			cis	-171.3	-177.3	38.5	0	0	0	0	0	114.7
517	H	27.5	Very low	29.2	Very low	191 Å²	191	124.7 Å²	124.7	88%	0.884	77%	0.765	S	S	*	*			trans	82.1	122.1	157.4	-58.1	-64	0	0	0	121.6
518	A	26.9	Very low	29.3	Very low	89 Å²	89	126 Å²	126	74%	0.736	77%	0.768	S	S	*	*			trans	-109.4	-155	150.9	0	0	0	0	0	106.7
519	P	47	Very low	29.2	Very low	106 Å²	106	129 Å²	129	69%	0.688	77%	0.769	S	S	*	*			cis	-139.4	-161.2	-5.7	32.4	-6.6	0	0	0	114.4
520	V	26.6	Very low	29.9	Very low	127 Å²	127	128.8 Å²	128.8	77%	0.77	77%	0.768	S	S	*	*			trans	61.4	160.3	162.4	-76.8	0	0	0	0	118
521	T	28	Very low	30.4	Very low	128 Å²	128	129.9 Å²	129.9	79%	0.785	77%	0.768	S	S	*	*			cis	-147.6	159.3	12.1	-21	0	0	0	0	111.2
522	G	23.4	Very low	29.4	Very low	62 Å²	62	129.1 Å²	129.1	64%	0.639	76%	0.757	S	S	*	*			trans	-93.4	-159	154.4	0	0	0	0	0	111.1
523	P	38.4	Very low	30	Very low	135 Å²	135	130.8 Å²	130.8	88%	0.877	76%	0.762	S	S	*	*			cis	-135.8	176.8	-3.7	42.6	-26.9	0	0	0	115.1
524	G	26.9	Very low	30.8	Very low	66 Å²	66	123.8 Å²	123.8	68%	0.68	75%	0.746	S	S	*	*				101.5	132.8	128.4	0	0	0	0	0	122.4
525	V	31.3	Very low	31.2	Very low	139 Å²	139	119.2 Å²	119.2	84%	0.842	73%	0.731	S	S	*	*			trans	85	131.3	133.9	-172.7	0	0	0	0	120.8
526	E	26.6	Very low	31.2	Very low	163 Å²	163	116.2 Å²	116.2	76%	0.762	72%	0.715	S	S	*	*			trans	56.8	113.4	161.9	-75.7	-172.3	156.7	0	0	124.9
527	L	32.1	Very low	31.7	Very low	165 Å²	165	119.5 Å²	119.5	86%	0.864	73%	0.73	S	S	*	*				29.4	97.9	109.5	-78.5	163.1	0	0	0	118.1
528	S	27.2	Very low	31.8	Very low	118 Å²	118	113.3 Å²	113.3	83%	0.825	72%	0.718	S	S	*	*			trans	-148.9	145.6	137.5	47.6	0	0	0	0	110.3
529	K	26.5	Very low	32.3	Very low	204 Å²	204	112.6 Å²	112.6	89%	0.887	71%	0.712	S	S	*	*			trans	-94.6	140.4	169.3	-77.4	-179.5	176.9	176.4	0	109
530	S	39.2	Very low	32	Very low	113 Å²	113	114 Å²	114	79%	0.79	71%	0.712	S	S	*	*			trans	-11.4	153.3	151.8	-40.4	0	0	0	0	116.9
531	P	35.2	Very low	32.2	Very low	108 Å²	108	115.4 Å²	115.4	70%	0.701	71%	0.711	S	S	*	*			cis	-153	-167.5	42.1	34	-7.8	0	0	0	118.3
532	L	25.5	Very low	32.1	Very low	98 Å²	98	112.4 Å²	112.4	51%	0.513	70%	0.695	S	S	.	*			trans	108.9	118.1	153.2	-52.2	-177.4	0	0	0	119.8	E544	L532-E544 HydrophobicContact CD1-CB 3.68Å; L532-E544 HydrophobicContact CD1-CG 4.04Å
533	L	40.5	Very low	32.6	Very low	147 Å²	147	115.7 Å²	115.7	77%	0.77	69%	0.694	S	S	*	*			trans	-102.3	-166	168.5	-74.5	167.1	0	0	0	108.6	S542	L533-S542 CarbonylContact O-C 3.58Å; L533-S542 VanDerWaalsContact O-CA 3.26Å; L533-S542 WeakPolarHBondContact O-CA 3.26Å
534	P	42.3	Very low	32	Very low	82 Å²	82	114.5 Å²	114.5	53%	0.532	68%	0.676	S	S	.	*			cis	-111.2	-135.5	-15.5	43.6	-39.8	0	0	0	112.1	E541	P534-E541 CarbonylContact C-O 3.46Å; P534-E541 WeakPolarHBondContact CD-O 3.32Å; P534-E541 WeakPolarHBondContact CG-O 3.44Å
535	P	34.4	Very low	32.2	Very low	64 Å²	64	118.4 Å²	118.4	42%	0.416	68%	0.681	S	S	.	*			cis	-129.8	-176	-23.1	32.7	-8.5	0	0	0	113.1	L540 E541	P535-L540 VanDerWaalsContact CD-O 3.24Å; P535-L540 WeakPolarHBondContact CD-O 3.35Å; P535-L540 WeakPolarHBondContact CG-O 3.46Å; P535-E541 WeakPolarHBondContact CD-O 3.21Å; P535-E541 WeakPolarHBondContact CG-O 3.46Å
536	S	24.2	Very low	31.9	Very low	61 Å²	61	118.3 Å²	118.3	43%	0.427	68%	0.675	S	S	.	*				156.3	165.6	81.3	55.1	0	0	0	0	113.2	G538 A539 L540	S536-G538 VanDerWaalsContact C-N 3.26Å; S536-G538 VanDerWaalsContact CB-C 3.49Å; S536-G538 WeakPolarHBondContact CB-O 3.48Å; S536-G538 PolarHBondContact O-N 2.99Å; S536-G538 PolarHBondContact OG-N 3.33Å; S536-A539 WeakPolarHBondContact CB-O 3.41Å; S536-A539 VanDerWaalsContact OG-C 3.27Å; S536-A539 PolarHBondContact OG-N 2.99Å; S536-A539 PolarHBondContact OG-O 2.92Å; S536-L540 PolarHBondContact OG-N 2.77Å
537	P	36	Very low	31.8	Very low	144 Å²	144	119.9 Å²	119.9	94%	0.935	68%	0.679	S	S	*	*	S	Bend	trans	-87.5	60.9	149.5	37.5	-30.7	0	0	0	110.4
538	G	30	Very low	31.5	Very low	61 Å²	61	116 Å²	116	63%	0.629	67%	0.671	S	S	*	*	S	Bend	trans	95.7	122	-172.9	0	0	0	0	0	112.9	S536	S536-G538 VanDerWaalsContact C-N 3.26Å; S536-G538 VanDerWaalsContact CB-C 3.49Å; S536-G538 WeakPolarHBondContact CB-O 3.48Å; S536-G538 PolarHBondContact O-N 2.99Å; S536-G538 PolarHBondContact OG-N 3.33Å
539	A	37.3	Very low	31.8	Very low	74 Å²	74	118.3 Å²	118.3	61%	0.612	67%	0.673	S	S	*	*			trans	57.1	101.9	-174.5	0	0	0	0	0	114.7	S536	S536-A539 WeakPolarHBondContact CB-O 3.41Å; S536-A539 VanDerWaalsContact OG-C 3.27Å; S536-A539 PolarHBondContact OG-N 2.99Å; S536-A539 PolarHBondContact OG-O 2.92Å
540	L	40.3	Very low	31.7	Very low	135 Å²	135	114.4 Å²	114.4	71%	0.707	67%	0.67	S	S	*	*				66.8	157.1	88.8	-68.8	162.9	0	0	0	114.6	P535 S536	P535-L540 VanDerWaalsContact CD-O 3.24Å; P535-L540 WeakPolarHBondContact CD-O 3.35Å; P535-L540 WeakPolarHBondContact CG-O 3.46Å; S536-L540 PolarHBondContact OG-N 2.77Å
541	E	31.5	Very low	31.1	Very low	156 Å²	156	118 Å²	118	73%	0.729	67%	0.672	S	S	*	*			trans	91.6	111.8	-174.1	-53.3	-175.5	127.8	0	0	118.7	P534 P535	P534-E541 CarbonylContact C-O 3.46Å; P534-E541 WeakPolarHBondContact CD-O 3.32Å; P534-E541 WeakPolarHBondContact CG-O 3.44Å; P535-E541 WeakPolarHBondContact CD-O 3.21Å; P535-E541 WeakPolarHBondContact CG-O 3.46Å
542	S	26.4	Very low	30.7	Very low	65 Å²	65	120.5 Å²	120.5	46%	0.455	68%	0.679	S	S	.	*				4.1	170.1	127.3	44.5	0	0	0	0	120.3	L533	L533-S542 CarbonylContact O-C 3.58Å; L533-S542 VanDerWaalsContact O-CA 3.26Å; L533-S542 WeakPolarHBondContact O-CA 3.26Å
543	Q	32.7	Very low	30.7	Very low	131 Å²	131	119.6 Å²	119.6	61%	0.612	69%	0.693	S	S	*	*			cis	-169.7	152.1	36.9	-141.5	140.4	-13.2	0	0	107.4
544	E	27.1	Very low	29.8	Very low	111 Å²	111	118.1 Å²	118.1	52%	0.519	70%	0.695	S	S	.	*				68.3	153.1	90.8	-148.6	141.6	-121.8	0	0	114.7	L532	L532-E544 HydrophobicContact CD1-CB 3.68Å; L532-E544 HydrophobicContact CD1-CG 4.04Å
545	L	30.6	Very low	29.1	Very low	148 Å²	148	119.5 Å²	119.5	78%	0.775	71%	0.707	S	S	*	*			cis	-140.7	-159.4	9.3	-146	166.8	0	0	0	109.8
546	L	24.2	Very low	29.3	Very low	136 Å²	136	122.2 Å²	122.2	71%	0.712	73%	0.725	S	S	*	*			trans	-92.5	154.4	167.2	-72.2	153.1	0	0	0	111.4
547	K	24.8	Very low	29.4	Very low	196 Å²	196	122.2 Å²	122.2	85%	0.852	73%	0.734	S	S	*	*			trans	62.1	168.4	144.8	-77.9	179.7	174.2	-178.7	0	119.3
548	A	26.4	Very low	29.1	Very low	85 Å²	85	122.3 Å²	122.3	70%	0.702	73%	0.727	S	S	*	*			trans	67	117.1	168.1	0	0	0	0	0	115.6
549	L	32.1	Very low	29.1	Very low	165 Å²	165	125.7 Å²	125.7	86%	0.864	73%	0.73	S	S	*	*				54.9	99.3	70.4	-66.7	164.6	0	0	0	112.6
550	C	25.7	Very low	28.5	Very low	122 Å²	122	128.3 Å²	128.3	82%	0.824	73%	0.732	S	S	*	*				-176.2	161.2	116	-103.3	0	0	0	0	112.7
551	K	26.6	Very low	27.8	Very low	189 Å²	189	129.2 Å²	129.2	82%	0.822	73%	0.732	S	S	*	*			trans	68.3	118.4	169.9	-69.5	171.8	-179.3	176.7	0	114.4
552	N	25.2	Very low	27.3	Very low	161 Å²	161	128 Å²	128	86%	0.861	73%	0.731	S	S	*	*			cis	55.2	89	42.7	-50.8	-13.2	0	0	0	111.5
553	G	25.4	Very low	27.4	Very low	78 Å²	78	129 Å²	129	80%	0.804	74%	0.737	S	S	*	*			trans	-159.1	55.8	-177.3	0	0	0	0	0	111.8
554	S	23.4	Very low	27.1	Very low	116 Å²	116	129.9 Å²	129.9	81%	0.811	75%	0.746	S	S	*	*			trans	-81.9	155.2	176.8	-46.3	0	0	0	0	111.8
555	S	26.2	Very low	27	Very low	112 Å²	112	131.8 Å²	131.8	78%	0.783	76%	0.76	S	S	*	*			trans	73.6	161.2	170.8	-151.8	0	0	0	0	115.6
556	P	39.4	Very low	27.2	Very low	121 Å²	121	130.3 Å²	130.3	79%	0.786	76%	0.759	S	S	*	*			cis	-103.7	-178.8	-18.5	6.4	18.1	0	0	0	111.4
557	G	26.8	Very low	27.3	Very low	61 Å²	61	130.6 Å²	130.6	63%	0.629	76%	0.761	S	S	*	*			cis	124	147.2	5.6	0	0	0	0	0	111.5
558	N	29.7	Very low	27.5	Very low	145 Å²	145	130.1 Å²	130.1	78%	0.775	76%	0.762	S	S	*	*			trans	65.2	158.8	178.2	-81.5	49.7	0	0	0	116.2
559	D	29.1	Very low	27.6	Very low	132 Å²	132	129.8 Å²	129.8	71%	0.706	77%	0.767	S	S	*	*			cis	-123.3	160.3	1	-84.7	-54	0	0	0	109.5
560	M	24.9	Very low	27.7	Very low	129 Å²	129	127.5 Å²	127.5	64%	0.635	77%	0.765	S	S	*	*			cis	-173.7	174.8	-14.9	175	161.9	54.1	0	0	107.3
561	Q	25.7	Very low	28.1	Very low	155 Å²	155	127.2 Å²	127.2	72%	0.724	76%	0.764	S	S	*	*			trans	72.6	141.2	163.6	-87.3	147.9	-19.9	0	0	117.5
562	D	20.8	Very low	28.6	Very low	131 Å²	131	124.2 Å²	124.2	70%	0.701	76%	0.761	S	S	*	*			cis	-161.5	-159.2	-15.3	-140.7	77	0	0	0	114
563	S	28.1	Very low	29.3	Very low	84 Å²	84	122 Å²	122	59%	0.587	76%	0.759	S	S	*	*			trans	-36.7	155.7	170.9	33.5	0	0	0	0	119.4
564	D	27.3	Very low	29.7	Very low	150 Å²	150	122.7 Å²	122.7	80%	0.802	76%	0.756	S	S	*	*			cis	-154.3	176.8	4.7	-126.4	-41.2	0	0	0	115.5
565	L	24.5	Very low	30.3	Very low	152 Å²	152	126 Å²	126	80%	0.796	76%	0.756	S	S	*	*			trans	-80.8	-179.9	174.8	-68.1	165.2	0	0	0	112.4
566	P	35.5	Very low	30.9	Very low	117 Å²	117	127.8 Å²	127.8	76%	0.76	75%	0.752	S	S	*	*			cis	-141.7	167	6.9	44.5	-26.3	0	0	0	118.9
567	N	25.8	Very low	30.7	Very low	142 Å²	142	129 Å²	129	76%	0.759	75%	0.747	S	S	*	*			trans	48.4	143.5	133.8	-155.3	21.6	0	0	0	124.8
568	Q	28.2	Very low	30.8	Very low	186 Å²	186	132.2 Å²	132.2	87%	0.869	75%	0.75	S	S	*	*			trans	74.2	149.7	165.4	-51.8	-155.9	79.7	0	0	120.8
569	G	29.1	Very low	31	Very low	78 Å²	78	132.9 Å²	132.9	80%	0.804	75%	0.746	S	S	*	*			trans	135.1	145.2	166.5	0	0	0	0	0	115.7
570	S	33.8	Very low	31.3	Very low	117 Å²	117	133.9 Å²	133.9	82%	0.818	75%	0.747	S	S	*	*			trans	-126.4	158.8	-171.6	-62.3	0	0	0	0	115.5
571	S	34.6	Very low	31.4	Very low	115 Å²	115	132 Å²	132	80%	0.804	75%	0.746	S	S	*	*			trans	72	164	167	73.2	0	0	0	0	117.5
572	V	36.3	Very low	32.3	Very low	126 Å²	126	131.5 Å²	131.5	76%	0.764	75%	0.749	S	S	*	*			cis	-146	158.2	11.1	-148.9	0	0	0	0	111.7
573	S	40.8	Very low	32.9	Very low	116 Å²	116	134.5 Å²	134.5	81%	0.811	76%	0.758	S	S	*	*			trans	62.9	144.4	160.3	-73.2	0	0	0	0	119.9
574	A	34.6	Very low	33.3	Very low	92 Å²	92	135.9 Å²	135.9	76%	0.76	77%	0.768	S	S	*	*			cis	-163.8	149.6	-13.6	0	0	0	0	0	113.4
575	K	34.1	Very low	33.3	Very low	184 Å²	184	137.6 Å²	137.6	80%	0.8	77%	0.771	S	S	*	*			trans	62.3	96.6	154.6	-135.8	159.6	-172.1	172.6	0	120.5
576	Q	40.7	Very low	33.5	Very low	151 Å²	151	136.2 Å²	136.2	71%	0.706	77%	0.774	S	S	*	*				75.1	153.5	88.9	-70.7	174.2	-92.3	0	0	117.2
577	Q	33.6	Very low	33.3	Very low	145 Å²	145	135.8 Å²	135.8	68%	0.678	77%	0.774	S	S	*	*			cis	-179.2	177.4	-15.8	-98.9	171.7	-30.3	0	0	107.7
578	N	29.1	Very low	33.5	Very low	130 Å²	130	136.1 Å²	136.1	70%	0.695	78%	0.776	S	S	*	*			cis	-171.7	-177.4	-11.8	-100.6	-13.6	0	0	0	108.8
579	K	33.5	Very low	33.7	Very low	158 Å²	158	132.5 Å²	132.5	69%	0.687	77%	0.766	S	S	*	*				-177.6	116.1	-54	179.4	-179.6	177.8	-61	0	115.5
580	Q	35.4	Very low	33.8	Very low	154 Å²	154	136.4 Å²	136.4	72%	0.72	77%	0.768	S	S	*	*			trans	70.6	170.3	157.5	-109.9	-176.4	-65	0	0	121.3
581	S	29	Very low	33.8	Very low	89 Å²	89	137.4 Å²	137.4	62%	0.622	77%	0.765	S	S	*	*			cis	-165.2	164.6	-5	-150.7	0	0	0	0	114.5
582	D	43.1	Very low	33.6	Very low	145 Å²	145	138.2 Å²	138.2	78%	0.775	77%	0.765	S	S	*	*			trans	-91.3	162.2	172	-54.7	-94.8	0	0	0	118
583	Q	33.7	Very low	33.1	Very low	194 Å²	194	136 Å²	136	91%	0.907	76%	0.755	S	S	*	*			trans	177.9	-171.2	131.8	-101.4	164	106.3	0	0	117.6
584	S	36.2	Very low	32.9	Very low	112 Å²	112	137 Å²	137	78%	0.783	76%	0.756	S	S	*	*			trans	-147.6	177.7	-158.7	-55.2	0	0	0	0	117
585	E	28.7	Very low	33.6	Very low	186 Å²	186	138.1 Å²	138.1	87%	0.869	76%	0.756	S	S	*	*			trans	99.3	143.7	155.5	-56.8	-160.1	119.9	0	0	123.5
586	S	27.6	Very low	33.3	Very low	124 Å²	124	135.1 Å²	135.1	87%	0.867	76%	0.758	S	S	*	*			trans	83.8	176.7	154.2	78.8	0	0	0	0	121.4
587	S	30.8	Very low	32.7	Very low	108 Å²	108	130.9 Å²	130.9	76%	0.755	76%	0.755	S	S	*	*			trans	-150.2	161.9	-138.4	57.1	0	0	0	0	117.8
588	D	31.6	Very low	32.5	Very low	149 Å²	149	129.9 Å²	129.9	80%	0.797	76%	0.764	S	S	*	*			trans	95.7	159.3	142.8	-139	-3	0	0	0	121.4
589	V	32.2	Very low	32.7	Very low	110 Å²	110	130.6 Å²	130.6	67%	0.667	77%	0.767	S	S	*	*			trans	78	125.7	163	-53.6	0	0	0	0	125.4
590	D	30.7	Very low	32.6	Very low	159 Å²	159	131.7 Å²	131.7	85%	0.85	78%	0.78	S	S	*	*			trans	90.9	148.3	137.3	-72.3	-31.8	0	0	0	126
591	D	33.2	Very low	32.5	Very low	138 Å²	138	132.3 Å²	132.3	74%	0.738	78%	0.783	S	S	*	*			trans	-73.3	173.9	-174.7	-105.3	-69	0	0	0	113.7
592	V	31.2	Very low	32.6	Very low	133 Å²	133	133 Å²	133	81%	0.806	79%	0.788	S	S	*	*				-159.4	131.5	55.9	178.2	0	0	0	0	114.3
593	S	25.5	Very low	32.1	Very low	80 Å²	80	132 Å²	132	56%	0.559	79%	0.787	S	S	*	*			trans	5.7	131.1	145.9	-60.8	0	0	0	0	124.8
594	T	36.9	Very low	31.8	Very low	136 Å²	136	129 Å²	129	83%	0.834	78%	0.782	S	S	*	*			trans	71.5	170.8	134	63.3	0	0	0	0	119.4
595	P	48	Very low	31.4	Very low	116 Å²	116	126.5 Å²	126.5	75%	0.753	77%	0.774	S	S	*	*			cis	-137.1	-173.3	6.5	45	-27.4	0	0	0	118
596	S	29.4	Very low	31.2	Very low	120 Å²	120	122.6 Å²	122.6	84%	0.839	77%	0.767	S	S	*	*			trans	81.3	138	161.5	-151.4	0	0	0	0	118.3
597	G	26.7	Very low	31.1	Very low	63 Å²	63	124 Å²	124	65%	0.649	76%	0.76	S	S	*	*			cis	144.2	106.8	-9.8	0	0	0	0	0	114.5
598	S	29.9	Very low	30.9	Very low	123 Å²	123	125 Å²	125	86%	0.86	76%	0.756	S	S	*	*			trans	-169.9	64.9	167.2	39.4	0	0	0	0	113.2
599	D	32.6	Very low	30.6	Very low	145 Å²	145	125.8 Å²	125.8	78%	0.775	76%	0.755	S	S	*	*			trans	-74.1	140.9	160	-66.9	-69.2	0	0	0	110.7
600	L	33	Very low	30.3	Very low	182 Å²	182	125.6 Å²	125.6	95%	0.953	76%	0.759	S	S	*	*			trans	-140.4	99.1	150.6	-79.6	-175.7	0	0	0	109
601	E	32.3	Very low	30.2	Very low	166 Å²	166	125.2 Å²	125.2	78%	0.776	76%	0.756	S	S	*	*			trans	-82.4	-172.4	170.6	-56.2	-177.4	94.4	0	0	111.7
602	S	31.9	Very low	30	Very low	104 Å²	104	126.3 Å²	126.3	73%	0.727	76%	0.759	S	S	*	*			trans	71.4	146.5	159.1	-60	0	0	0	0	116.3
603	T	31.3	Very low	29.7	Very low	124 Å²	124	126.2 Å²	126.2	76%	0.761	75%	0.754	S	S	*	*			cis	-154.3	177.5	-4	4.5	0	0	0	0	106.9
604	T	27.7	Very low	30	Very low	132 Å²	132	127.3 Å²	127.3	81%	0.81	76%	0.762	S	S	*	*			cis	-137.1	-158.6	9.8	-8.1	0	0	0	0	107.1
605	G	27.6	Very low	29.3	Very low	58 Å²	58	129.9 Å²	129.9	60%	0.598	76%	0.764	S	S	*	*			cis	114.5	136.5	3	0	0	0	0	0	112.8
606	S	25.8	Very low	28.5	Very low	105 Å²	105	133.1 Å²	133.1	73%	0.734	77%	0.766	S	S	*	*			trans	66.7	166.6	168.6	-59.3	0	0	0	0	118.9
607	E	25.6	Very low	28.4	Very low	153 Å²	153	135 Å²	135	72%	0.715	76%	0.762	S	S	*	*				-164.5	155.4	-81.4	58.2	-151.2	72.5	0	0	110.6
608	L	26.7	Very low	28.4	Very low	130 Å²	130	143.1 Å²	143.1	68%	0.681	77%	0.773	S	S	*	*			trans	58.8	136	164.3	-57.8	174.5	0	0	0	120.5
609	E	25.5	Very low	28.1	Very low	165 Å²	165	140.6 Å²	140.6	77%	0.771	77%	0.766	S	S	*	*				39.8	124.9	127.3	-55.1	169.7	167.9	0	0	118.5
610	S	26	Very low	27.8	Very low	106 Å²	106	140 Å²	140	74%	0.741	77%	0.768	S	S	*	*				-171.3	141.6	57.1	30.1	0	0	0	0	108.6
611	D	27.5	Very low	27.4	Very low	150 Å²	150	136 Å²	136	80%	0.802	76%	0.761	S	S	*	*				73	156	75.9	-91.3	-46.1	0	0	0	116
612	M	29.6	Very low	27.2	Very low	162 Å²	162	139.3 Å²	139.3	80%	0.798	77%	0.766	S	S	*	*			trans	70.8	149.2	-173.6	-100.7	74.6	72.8	0	0	116.7
613	D	25.3	Very low	26.8	Very low	131 Å²	131	142.8 Å²	142.8	70%	0.701	77%	0.771	S	S	*	*			cis	-148.1	177.7	2	-167.4	-104.6	0	0	0	112.6
614	S	30	Very low	26.5	Very low	103 Å²	103	143.5 Å²	143.5	72%	0.72	77%	0.77	S	S	*	*			trans	91.8	97	154	-74.4	0	0	0	0	118.9
615	E	23.7	Very low	26.5	Very low	189 Å²	189	140.2 Å²	140.2	88%	0.883	76%	0.762	S	S	*	*			trans	-71.8	-160.9	157.8	-52.1	179.9	91	0	0	112
616	K	30	Very low	26.5	Very low	184 Å²	184	147.7 Å²	147.7	80%	0.8	78%	0.778	S	S	*	*			trans	80.6	127.7	166.2	-159.3	168.4	-173.4	-177.9	0	115.3
617	E	27.6	Very low	26.4	Very low	159 Å²	159	146 Å²	146	74%	0.743	78%	0.778	S	S	*	*			cis	-153.7	174.4	-4.9	-137.1	175.5	146	0	0	112.2
618	R	26.5	Very low	26.9	Very low	235 Å²	235	144.1 Å²	144.1	89%	0.887	78%	0.779	S	S	*	*			trans	-89.7	151.6	150.6	-53.2	176.5	-174	-170.3	1.5	106.8
619	G	24.1	Very low	26.9	Very low	69 Å²	69	145.4 Å²	145.4	71%	0.711	78%	0.775	S	S	*	*			cis	145	-170.5	7.8	0	0	0	0	0	109.4
620	V	25.7	Very low	27.2	Very low	134 Å²	134	145.5 Å²	145.5	81%	0.812	77%	0.768	S	S	*	*			trans	68.1	105.8	163.4	-169.6	0	0	0	0	118.9	R622	V620-R622 HydrophobicContact CG1-CG 4.24Å
621	A	25.5	Very low	27.4	Very low	98 Å²	98	149.2 Å²	149.2	81%	0.81	77%	0.771	S	S	*	*				-140.9	125.7	128.8	0	0	0	0	0	105.3
622	R	26.9	Very low	27.4	Very low	235 Å²	235	146.1 Å²	146.1	89%	0.887	77%	0.766	S	S	*	*			cis	53.8	99.5	46.9	-81.4	-160	177.1	-135.5	1.3	113.9	V620	V620-R622 HydrophobicContact CG1-CG 4.24Å
623	E	25	Very low	27.2	Very low	176 Å²	176	143.5 Å²	143.5	82%	0.822	76%	0.759	S	S	*	*				-152.2	-180	113.8	-126	-156.1	77.3	0	0	114
624	N	24.8	Very low	27.2	Very low	139 Å²	139	144.1 Å²	144.1	74%	0.743	76%	0.758	S	S	*	*			trans	-55.5	161.5	-171.4	-58.6	-54.2	0	0	0	115.8
625	G	27.5	Very low	27	Very low	63 Å²	63	148.9 Å²	148.9	65%	0.649	76%	0.76	S	S	*	*			cis	127.4	115.3	-1.4	0	0	0	0	0	113.8
626	K	27.5	Very low	27	Very low	215 Å²	215	146.4 Å²	146.4	94%	0.935	75%	0.753	S	S	*	*			trans	-175.5	146.1	160.2	-100.1	146.8	-172.5	176	0	110.2
627	G	24.3	Very low	27.4	Very low	70 Å²	70	143.3 Å²	143.3	72%	0.722	75%	0.751	S	S	*	*			trans	-90.4	-154	168.4	0	0	0	0	0	111.8
628	P	34.8	Very low	27.4	Very low	113 Å²	113	143.4 Å²	143.4	73%	0.734	75%	0.752	S	S	*	*			cis	-147.2	151.6	21.5	39.9	-19.4	0	0	0	119.1
629	R	27.1	Very low	27.5	Very low	158 Å²	158	137.5 Å²	137.5	60%	0.596	75%	0.747	S	S	*	*			trans	64.8	156.9	139.7	-58.8	-78.4	-170.7	-168	13.8	118.2	E892	R629-E892 IonicContact CZ-OE1 2.62Å; R629-E892 IonicContact CZ-OE2 3.96Å; R629-E892 IonicContact NH1-OE1 3.13Å; R629-E892 PolarHBondContact NH1-OE1 2.83Å; R629-E892 IonicContact NH1-OE2 2.68Å; R629-E892 PolarHBondContact NH1-OE2 2.75Å; R629-E892 VanDerWaalsContact NH2-CD 3.34Å; R629-E892 IonicContact NH2-OE1 2.73Å; R629-E892 PolarHBondContact NH2-OE1 2.97Å; R629-E892 IonicContact NH2-OE2 2.68Å; R629-E892 PolarHBondContact NH2-OE2 2.79Å
630	R	32.5	Very low	28.1	Very low	167 Å²	167	140.4 Å²	140.4	63%	0.63	75%	0.753	S	S	*	*			cis	-165.9	148.2	-12	-125.9	175.3	-168.7	170.5	1.7	110.5	E892	R630-E892 IonicContact NH2-OE2 2.67Å; R630-E892 PolarHBondContact NH2-OE2 2.62Å
631	K	29	Very low	28	Very low	184 Å²	184	138.7 Å²	138.7	80%	0.8	75%	0.747	S	S	*	*			trans	47.8	158.6	138.5	-79.1	-170.1	175.1	-162	0	120.4
632	A	28.8	Very low	28	Very low	85 Å²	85	141.7 Å²	141.7	70%	0.702	75%	0.748	S	S	*	*			cis	-167.4	-179.5	3.4	0	0	0	0	0	109.3
633	T	25.1	Very low	27.9	Very low	106 Å²	106	138.4 Å²	138.4	65%	0.65	75%	0.747	S	S	*	*			cis	176	140.5	-33.1	-79.1	0	0	0	0	108.6
634	E	24.4	Very low	27.9	Very low	144 Å²	144	133.3 Å²	133.3	67%	0.673	74%	0.742	S	S	*	*			trans	67.9	162.1	166.3	-77.3	177.8	119.2	0	0	118.5
635	R	25.5	Very low	27.8	Very low	204 Å²	204	131.8 Å²	131.8	77%	0.77	74%	0.742	S	S	*	*			cis	-153.2	157	4.4	-142	175	-130	176.5	9.4	115.6
636	D	25.1	Very low	27.6	Very low	136 Å²	136	134 Å²	134	73%	0.727	75%	0.748	S	S	*	*			trans	-63.2	174	152.3	-86.3	-74.6	0	0	0	113.6
637	P	37.9	Very low	27.4	Very low	119 Å²	119	129.9 Å²	129.9	77%	0.773	74%	0.741	S	S	*	*			cis	-149.2	-153.1	33.7	44.6	-21	0	0	0	117.9
638	Q	26.9	Very low	27.5	Very low	161 Å²	161	130.9 Å²	130.9	75%	0.752	74%	0.742	S	S	*	*			trans	-99.7	149	-153.9	-46.5	158	-86.9	0	0	117.8
639	S	29.5	Very low	27.1	Very low	112 Å²	112	135.5 Å²	135.5	78%	0.783	75%	0.75	S	S	*	*			trans	66	161.2	142.8	77.4	0	0	0	0	118.9
640	P	36.4	Very low	27	Very low	130 Å²	130	131.3 Å²	131.3	84%	0.844	76%	0.756	S	S	*	*			cis	-134.5	-133.8	27.5	42.2	-20.2	0	0	0	115.8
641	S	23.1	Very low	26.6	Very low	98 Å²	98	133.1 Å²	133.1	69%	0.685	77%	0.769	S	S	*	*			trans	-133.6	171.3	-142.8	59.1	0	0	0	0	119
642	L	25	Very low	26.9	Very low	160 Å²	160	130.3 Å²	130.3	84%	0.838	77%	0.77	S	S	*	*			trans	90.8	152.9	155.1	-72.7	165.7	0	0	0	122.6
643	I	25	Very low	26.8	Very low	167 Å²	167	129.1 Å²	129.1	86%	0.856	77%	0.765	S	S	*	*			trans	92.4	130	161.4	-47.8	-172.1	0	0	0	119.3
644	G	25.7	Very low	26.9	Very low	69 Å²	69	133.1 Å²	133.1	71%	0.711	78%	0.776	S	S	*	*			trans	124.1	105.1	165.9	0	0	0	0	0	113.1
645	S	23.5	Very low	27	Very low	106 Å²	106	130.6 Å²	130.6	74%	0.741	78%	0.775	S	S	*	*			cis	87.6	118.9	35.1	-58.8	0	0	0	0	116.4
646	S	22.9	Very low	27.1	Very low	111 Å²	111	127.7 Å²	127.7	78%	0.776	77%	0.774	S	S	*	*			trans	67.7	150.5	150.9	68.9	0	0	0	0	119
647	T	24	Very low	27.1	Very low	128 Å²	128	127.6 Å²	127.6	79%	0.785	77%	0.772	S	S	*	*			cis	-169.5	157.5	-9.5	18.3	0	0	0	0	111.4
648	A	26	Very low	26.4	Very low	91 Å²	91	130.3 Å²	130.3	75%	0.752	77%	0.774	S	S	*	*			trans	67.6	166.2	154	0	0	0	0	0	116.6
649	K	26.7	Very low	26.3	Very low	210 Å²	210	127.5 Å²	127.5	91%	0.913	77%	0.773	S	S	*	*			cis	-160.7	145.5	3.8	-139.4	164.7	-173.8	-179.8	0	106.6
650	G	23.5	Very low	26.1	Very low	69 Å²	69	127.4 Å²	127.4	71%	0.711	77%	0.772	S	S	*	*			cis	177.1	171.3	-5.8	0	0	0	0	0	111.6
651	F	25.6	Very low	25.6	Very low	206 Å²	206	128.4 Å²	128.4	90%	0.904	77%	0.769	S	S	*	*			trans	-67	170.6	163	-76.5	-82.7	0	0	0	111.1
652	P	34.8	Very low	25.8	Very low	125 Å²	125	129.8 Å²	129.8	81%	0.812	77%	0.769	S	S	*	*			cis	-130.1	-175.7	18	40.9	-22.3	0	0	0	114.5
653	G	25.9	Very low	26	Very low	59 Å²	59	130.6 Å²	130.6	61%	0.608	77%	0.769	S	S	*	*			cis	170.7	-167.1	-9.1	0	0	0	0	0	112.4
654	Q	28.5	Very low	26.5	Very low	190 Å²	190	129.7 Å²	129.7	89%	0.888	76%	0.76	S	S	*	*			trans	53.9	142.9	145.6	-66	-178.2	-15	0	0	121
655	S	25.5	Very low	26.6	Very low	92 Å²	92	132.6 Å²	132.6	64%	0.643	76%	0.764	S	S	*	*			cis	-175.9	-178.9	-12.6	54.4	0	0	0	0	111.1
656	L	28.1	Very low	27	Very low	143 Å²	143	131.4 Å²	131.4	75%	0.749	76%	0.761	S	S	*	*			trans	92.7	115.2	152.6	-112.3	73.8	0	0	0	120.4
657	I	25.1	Very low	27.5	Very low	133 Å²	133	132.3 Å²	132.3	68%	0.682	76%	0.762	S	S	*	*			trans	54.7	123.4	132.7	-67.6	175.2	0	0	0	118.8
658	Q	23	Very low	27.9	Very low	176 Å²	176	132.6 Å²	132.6	82%	0.822	76%	0.763	S	S	*	*			cis	88.7	146.2	34.9	-171.6	175.8	-11.2	0	0	115.3
659	S	24.1	Very low	28.2	Very low	103 Å²	103	131.4 Å²	131.4	72%	0.72	76%	0.76	S	S	*	*			trans	103.2	143.9	171.6	-45.8	0	0	0	0	114.4
660	S	25.1	Very low	28.8	Very low	109 Å²	109	126.4 Å²	126.4	76%	0.762	76%	0.758	S	S	*	*			cis	-174.4	-175.9	-9.4	46	0	0	0	0	111.3
661	L	26.6	Very low	29.5	Very low	152 Å²	152	128.4 Å²	128.4	80%	0.796	76%	0.756	S	S	*	*			trans	82.8	120.5	171.8	-130.7	65.6	0	0	0	114.3
662	D	27.8	Very low	30.2	Very low	127 Å²	127	123.1 Å²	123.1	68%	0.679	74%	0.737	S	S	*	*				70.7	139.1	53.1	-66.2	-55	0	0	0	113.2
663	E	28.8	Very low	30.8	Very low	177 Å²	177	122.4 Å²	122.4	83%	0.827	73%	0.726	S	S	*	*			cis	-154.7	127.6	32.1	-175.3	168.2	130.3	0	0	115.7
664	H	34.7	Very low	31.7	Very low	148 Å²	148	123.1 Å²	123.1	69%	0.685	72%	0.722	S	S	*	*			trans	40.1	123.5	142.2	-77.6	-93.4	0	0	0	128.5
665	T	29.6	Very low	32.9	Very low	129 Å²	129	118.6 Å²	118.6	79%	0.791	70%	0.703	S	S	*	*			trans	68.4	155.4	136.4	45.4	0	0	0	0	123.2
666	A	31.8	Very low	33.8	Very low	81 Å²	81	119.8 Å²	119.8	67%	0.669	70%	0.697	S	S	*	*			cis	-162.8	146.5	-6.7	0	0	0	0	0	115.5
667	V	32.9	Very low	35	Very low	131 Å²	131	115.7 Å²	115.7	79%	0.794	68%	0.683	S	S	*	*			trans	43.2	124.9	131.5	-165.4	0	0	0	0	119.3
668	T	32.7	Very low	36.2	Very low	134 Å²	134	115.2 Å²	115.2	82%	0.822	68%	0.681	S	S	*	*				-174.5	157.2	71.6	-33.5	0	0	0	0	108.9
669	G	31.7	Very low	37.2	Very low	66 Å²	66	108.7 Å²	108.7	68%	0.68	66%	0.657	S	S	*	*			cis	139.7	95	-8.1	0	0	0	0	0	113.3
670	A	38.4	Very low	38.3	Very low	105 Å²	105	107.1 Å²	107.1	87%	0.868	65%	0.646	S	S	*	*	S	Bend	trans	-136.2	-10.1	178.8	0	0	0	0	0	115.8
671	V	39.9	Very low	39.7	Very low	111 Å²	111	107.3 Å²	107.3	67%	0.673	64%	0.637	S	S	*	*	S	Bend	trans	-92.8	-1.7	-177.6	-177.6	0	0	0	0	112.4	S674 I675	V671-S674 PolarHBondContact O-OG 3.07Å; V671-S674 VanDerWaalsContact O-OG 3.11Å; V671-I675 HydrophobicContact CG1-CD1 4.46Å
672	N	40.2	Very low	40.5	Very low	94 Å²	94	102.7 Å²	102.7	50%	0.503	62%	0.621	S	S	.	*	H	α-helix	trans	-87.6	-18.3	-159.7	-145.7	4.1	0	0	0	114.9	K676	N672-K676 WeakPolarHBondContact O-CG 3.19Å; N672-K676 PolarHBondContact O-N 3.29Å
673	D	46.5	Very low	41.2	Very low	110 Å²	110	103.1 Å²	103.1	59%	0.588	62%	0.619	S	S	*	*	H	α-helix	trans	-85.6	-25.4	-174.7	-70.1	-26.1	0	0	0	113.7	I675 K676 A677	D673-I675 VanDerWaalsContact C-N 3.35Å; D673-K676 PolarHBondContact O-N 3.44Å; D673-K676 IonicContact OD1-NZ 3.63Å; D673-K676 PolarHBondContact OD1-NZ 3.11Å; D673-A677 PolarHBondContact O-N 3.38Å
674	S	45.8	Very low	42	Very low	74 Å²	74	103.1 Å²	103.1	52%	0.517	62%	0.616	S	S	.	*	H	α-helix	trans	-65.2	-40.8	165.3	53.2	0	0	0	0	111.2	V671 A677 I678	V671-S674 PolarHBondContact O-OG 3.07Å; V671-S674 VanDerWaalsContact O-OG 3.11Å; S674-A677 PolarHBondContact O-N 2.92Å; S674-I678 WeakPolarHBondContact O-CG1 3.32Å; S674-I678 PolarHBondContact O-N 3.28Å; S674-I678 VanDerWaalsContact O-N 3.16Å
675	I	52.9	Low	42.1	Very low	95 Å²	95	104.8 Å²	104.8	49%	0.487	62%	0.618	S	S	.	*	H	α-helix	trans	-64.8	-43.4	174.6	-59.3	175.9	0	0	0	110.4	V671 D673 A677 I678 A679	V671-I675 HydrophobicContact CG1-CD1 4.46Å; D673-I675 VanDerWaalsContact C-N 3.35Å; I675-A677 PolarHBondContact O-N 3.18Å; I675-I678 PolarHBondContact O-N 2.91Å; I675-A679 VanDerWaalsContact O-CB 3.29Å; I675-A679 WeakPolarHBondContact O-CB 3.47Å; I675-A679 PolarHBondContact O-N 3.13Å
676	K	45.1	Very low	42.8	Very low	118 Å²	118	106.9 Å²	106.9	51%	0.513	62%	0.616	S	S	.	*	H	α-helix	trans	-62.4	-36.5	173	-75.2	-179.3	-159.9	148	0	113.6	N672 D673 I678 A679 S680	N672-K676 WeakPolarHBondContact O-CG 3.19Å; N672-K676 PolarHBondContact O-N 3.29Å; D673-K676 PolarHBondContact O-N 3.44Å; D673-K676 IonicContact OD1-NZ 3.63Å; D673-K676 PolarHBondContact OD1-NZ 3.11Å; K676-I678 VanDerWaalsContact C-N 3.33Å; K676-A679 PolarHBondContact O-N 2.72Å; K676-S680 WeakPolarHBondContact O-CB 3.38Å; K676-S680 PolarHBondContact O-N 3.15Å
677	A	51.8	Low	42.8	Very low	56 Å²	56	106.7 Å²	106.7	46%	0.463	62%	0.622	S	S	.	*	H	α-helix	trans	-62.6	-42.5	176.1	0	0	0	0	0	111.3	D673 S674 I675 I681	D673-A677 PolarHBondContact O-N 3.38Å; S674-A677 PolarHBondContact O-N 2.92Å; I675-A677 PolarHBondContact O-N 3.18Å; A677-I681 WeakPolarHBondContact O-CG1 3.23Å; A677-I681 PolarHBondContact O-N 3.21Å
678	I	51.6	Low	43	Very low	123 Å²	123	106.1 Å²	106.1	63%	0.631	62%	0.624	S	S	*	*	H	α-helix	trans	-70.7	-42.4	177	-63.6	166.3	0	0	0	110.9	S674 I675 K676 I681 A682	S674-I678 WeakPolarHBondContact O-CG1 3.32Å; S674-I678 PolarHBondContact O-N 3.28Å; S674-I678 VanDerWaalsContact O-N 3.16Å; I675-I678 PolarHBondContact O-N 2.91Å; K676-I678 VanDerWaalsContact C-N 3.33Å; I678-I681 PolarHBondContact O-N 3.48Å; I678-A682 PolarHBondContact O-N 3.35Å
679	A	43.9	Very low	43.1	Very low	40 Å²	40	104.5 Å²	104.5	33%	0.331	62%	0.624	S	S	.	*	H	α-helix	trans	-64.5	-41.6	177.1	0	0	0	0	0	112.4	I675 K676 I681 A682 E683	I675-A679 VanDerWaalsContact O-CB 3.29Å; I675-A679 WeakPolarHBondContact O-CB 3.47Å; I675-A679 PolarHBondContact O-N 3.13Å; K676-A679 PolarHBondContact O-N 2.72Å; A679-I681 PolarHBondContact O-N 3.39Å; A679-A682 CarbonylContact O-C 3.58Å; A679-A682 WeakPolarHBondContact O-CA 3.5Å; A679-A682 WeakPolarHBondContact O-CB 3.46Å; A679-A682 PolarHBondContact O-N 3.17Å; A679-E683 WeakPolarHBondContact O-CG 3.43Å; A679-E683 PolarHBondContact O-N 3.16Å
680	S	47.5	Very low	43.1	Very low	70 Å²	70	105 Å²	105	49%	0.49	63%	0.629	S	S	.	*	H	α-helix	trans	-64	-29.3	176.6	-170.8	0	0	0	0	112.5	K676 K684	K676-S680 WeakPolarHBondContact O-CB 3.38Å; K676-S680 PolarHBondContact O-N 3.15Å; S680-K684 VanDerWaalsContact O-CB 3.27Å; S680-K684 WeakPolarHBondContact O-CB 3.49Å; S680-K684 PolarHBondContact O-N 3.27Å
681	I	54	Low	42.8	Very low	112 Å²	112	108.9 Å²	108.9	57%	0.574	63%	0.634	S	S	*	*	H	α-helix	trans	-71.9	-39	170.1	-66.3	166.9	0	0	0	110.6	A677 I678 A679 Y685	A677-I681 WeakPolarHBondContact O-CG1 3.23Å; A677-I681 PolarHBondContact O-N 3.21Å; I678-I681 PolarHBondContact O-N 3.48Å; A679-I681 PolarHBondContact O-N 3.39Å; I681-Y685 WeakPolarHBondContact O-CD2 3.37Å
682	A	43.2	Very low	42.5	Very low	55 Å²	55	108.5 Å²	108.5	46%	0.455	64%	0.643	S	S	.	*	H	α-helix	trans	-67.6	-48.9	176.7	0	0	0	0	0	113	I678 A679 K684 Y685 F686	I678-A682 PolarHBondContact O-N 3.35Å; A679-A682 CarbonylContact O-C 3.58Å; A679-A682 WeakPolarHBondContact O-CA 3.5Å; A679-A682 WeakPolarHBondContact O-CB 3.46Å; A679-A682 PolarHBondContact O-N 3.17Å; A682-K684 PolarHBondContact O-N 3.21Å; A682-Y685 PolarHBondContact O-N 3.28Å; A682-F686 PolarHBondContact O-N 2.92Å
683	E	42.8	Very low	42.1	Very low	137 Å²	137	107.8 Å²	107.8	64%	0.64	66%	0.657	S	S	*	*	H	α-helix	trans	-59.9	-30.8	178.3	-70.4	178.4	147.5	0	0	112.4	A679 Y685	A679-E683 WeakPolarHBondContact O-CG 3.43Å; A679-E683 PolarHBondContact O-N 3.16Å; E683-Y685 PolarHBondContact O-N 2.8Å
684	K	44.8	Very low	41.5	Very low	176 Å²	176	110 Å²	110	77%	0.765	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-11.4	176.1	-165.9	167.5	-174.3	173.6	0	114	S680 A682	S680-K684 VanDerWaalsContact O-CB 3.27Å; S680-K684 WeakPolarHBondContact O-CB 3.49Å; S680-K684 PolarHBondContact O-N 3.27Å; A682-K684 PolarHBondContact O-N 3.21Å
685	Y	37.9	Very low	40.8	Very low	184 Å²	184	114.1 Å²	114.1	72%	0.722	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.5	-23.4	175.7	-79.3	-89	0	0	0	114	I681 A682 E683	I681-Y685 WeakPolarHBondContact O-CD2 3.37Å; A682-Y685 PolarHBondContact O-N 3.28Å; E683-Y685 PolarHBondContact O-N 2.8Å
686	F	44.1	Very low	39.7	Very low	173 Å²	173	114.7 Å²	114.7	76%	0.759	68%	0.683	S	S	*	*	S	Bend	trans	-140.3	90.6	179.3	-63	-80.9	0	0	0	111.9	A682	A682-F686 PolarHBondContact O-N 2.92Å
687	G	32	Very low	39.4	Very low	76 Å²	76	116.9 Å²	116.9	78%	0.784	69%	0.693	S	S	*	*			trans	-79.9	143.1	177	0	0	0	0	0	113.8
688	S	37.1	Very low	38.5	Very low	119 Å²	119	123.4 Å²	123.4	83%	0.832	71%	0.711	S	S	*	*			trans	-99.7	157.1	-169.3	-41.6	0	0	0	0	115.1
689	A	34.8	Very low	37.6	Very low	101 Å²	101	123.8 Å²	123.8	84%	0.835	72%	0.719	S	S	*	*			trans	-155	133.7	152.5	0	0	0	0	0	110
690	G	31.6	Very low	36.9	Very low	76 Å²	76	125.6 Å²	125.6	78%	0.784	74%	0.741	S	S	*	*			trans	-112.1	173.9	179.6	0	0	0	0	0	113.5
691	L	31.7	Very low	35.9	Very low	187 Å²	187	128.1 Å²	128.1	98%	0.979	76%	0.759	S	S	*	*			trans	-135.2	150.2	175.8	-76	175.4	0	0	0	111.2
692	A	33.8	Very low	34.7	Very low	103 Å²	103	130.8 Å²	130.8	85%	0.851	77%	0.774	S	S	*	*			trans	-144.8	116.5	173.4	0	0	0	0	0	112
693	G	31.6	Very low	34.4	Very low	78 Å²	78	133.5 Å²	133.5	80%	0.804	79%	0.786	S	S	*	*			trans	73.1	165.5	162.1	0	0	0	0	0	119
694	L	33.9	Very low	33.8	Very low	156 Å²	156	137.7 Å²	137.7	82%	0.817	80%	0.798	S	S	*	*			cis	-167.7	120.6	-21.2	-175.4	65	0	0	0	111.6
695	Q	30.3	Very low	33.1	Very low	161 Å²	161	134.6 Å²	134.6	75%	0.752	80%	0.796	S	S	*	*			trans	61.9	171.5	165.3	-58.6	-73.7	1.1	0	0	116
696	D	29.6	Very low	32.8	Very low	107 Å²	107	130.6 Å²	130.6	57%	0.572	79%	0.794	S	S	*	*			cis	-150.5	-172.2	12.5	-149.3	-9.7	0	0	0	115.4
697	K	38.5	Very low	32	Very low	164 Å²	164	129.8 Å²	129.8	71%	0.713	80%	0.795	S	S	*	*			trans	-50.5	126.2	-165.4	-63.4	132.9	-167.1	117.8	0	121.7
698	K	34.9	Very low	33.2	Very low	194 Å²	194	134 Å²	134	84%	0.843	79%	0.792	S	S	*	*				66	140.3	106.5	-139.4	-178.4	-173.6	177.3	0	122.8
699	V	31.6	Very low	32.7	Very low	130 Å²	130	133.4 Å²	133.4	79%	0.788	79%	0.785	S	S	*	*			trans	89.6	70	161.3	-159.3	0	0	0	0	119.9
700	G	28.7	Very low	33.1	Very low	78 Å²	78	135.1 Å²	135.1	80%	0.804	78%	0.78	S	S	*	*				59.6	102.1	108.4	0	0	0	0	0	123.3
701	S	27.6	Very low	33.4	Very low	124 Å²	124	135.5 Å²	135.5	87%	0.867	77%	0.768	S	S	*	*			trans	-152.7	155.2	146.3	58.9	0	0	0	0	111.8
702	L	28.8	Very low	33.2	Very low	168 Å²	168	135.4 Å²	135.4	88%	0.88	76%	0.76	S	S	*	*			trans	-121.2	168.4	179.2	-78.9	169.4	0	0	0	110.1
703	P	36.6	Very low	33.6	Very low	111 Å²	111	139.7 Å²	139.7	72%	0.721	76%	0.76	S	S	*	*			cis	-126	159.9	-13.1	37	-22.7	0	0	0	113.7
704	Y	30.2	Very low	33.5	Very low	226 Å²	226	140.9 Å²	140.9	89%	0.886	75%	0.754	S	S	*	*			trans	-149.9	156.4	167.1	-138.8	-108.7	0	0	0	112.6
705	P	30.4	Very low	33.1	Very low	110 Å²	110	139.8 Å²	139.8	71%	0.714	75%	0.754	S	S	*	*			trans	-75.9	168.6	-177.4	-17.2	33.7	0	0	0	115
706	S	30.7	Very low	33.1	Very low	100 Å²	100	142.2 Å²	142.2	70%	0.699	76%	0.762	S	S	*	*			trans	-81.6	131.5	-170.1	55.4	0	0	0	0	115.6
707	M	28.7	Very low	33.6	Very low	157 Å²	157	142.3 Å²	142.3	77%	0.773	77%	0.771	S	S	*	*			trans	-128.3	116.1	146.2	-73.2	-72.1	-76.8	0	0	107
708	F	55.8	Low	33.8	Very low	165 Å²	165	140.3 Å²	140.3	72%	0.724	78%	0.775	S	S	*	*			trans	-94.5	153.1	173.8	-102.3	-75.7	0	0	0	109.7	L710	F708-L710 HydrophobicContact CD1-CD2 4.13Å; F708-L710 HydrophobicContact CD1-CG 3.98Å; F708-L710 HydrophobicContact CE1-CD2 3.81Å; F708-L710 HydrophobicContact CE1-CG 4.12Å
709	P	27.1	Very low	34	Very low	105 Å²	105	136.4 Å²	136.4	68%	0.682	77%	0.77	S	S	*	*				-132.9	152.1	102.5	37.7	-29.7	0	0	0	115.1
710	L	43	Very low	34.5	Very low	137 Å²	137	135.9 Å²	135.9	72%	0.717	77%	0.767	S	S	*	*			trans	-86	-159.9	160.7	-63.6	169.5	0	0	0	107.4	F708	F708-L710 HydrophobicContact CD1-CD2 4.13Å; F708-L710 HydrophobicContact CD1-CG 3.98Å; F708-L710 HydrophobicContact CE1-CD2 3.81Å; F708-L710 HydrophobicContact CE1-CG 4.12Å
711	P	37.2	Very low	35.2	Very low	84 Å²	84	142.8 Å²	142.8	55%	0.545	77%	0.77	S	S	.	*			cis	-138.8	166.1	-7.2	40.6	-22.8	0	0	0	117.2
712	F	29.3	Very low	35.5	Very low	185 Å²	185	141.9 Å²	141.9	81%	0.811	76%	0.761	S	S	*	*	S	Bend	trans	-162	162.5	138.8	-92.6	-64.7	0	0	0	107.5	P714	F712-P714 HydrophobicContact CD1-CG 4.36Å; F712-P714 HydrophobicContact CE1-CG 4.47Å
713	F	41.9	Very low	35.7	Very low	193 Å²	193	140.4 Å²	140.4	85%	0.846	75%	0.753	S	S	*	*	S	Bend		7.9	141.4	-59.6	-50.5	-92.1	0	0	0	118.9
714	P	28	Very low	36.1	Very low	103 Å²	103	140.3 Å²	140.3	67%	0.669	75%	0.753	S	S	*	*			trans	-107.6	96.8	166.9	35.7	-24.4	0	0	0	112.5	F712	F712-P714 HydrophobicContact CD1-CG 4.36Å; F712-P714 HydrophobicContact CE1-CG 4.47Å
715	T	25.7	Very low	35.8	Very low	134 Å²	134	136.2 Å²	136.2	82%	0.822	75%	0.746	S	S	*	*			trans	-77.1	148.9	136.4	43.3	0	0	0	0	108.2	S717	T715-S717 PolarHBondContact O-N 3.25Å
716	F	30.6	Very low	35.9	Very low	211 Å²	211	140.1 Å²	140.1	93%	0.925	75%	0.747	S	S	*	*	S	Bend	trans	-54.9	118.1	-178.8	-75.9	-106.1	0	0	0	113.2
717	S	40.4	Very low	35.8	Very low	110 Å²	110	140.6 Å²	140.6	77%	0.769	74%	0.741	S	S	*	*			trans	-179.1	161.4	143	-81.8	0	0	0	0	112.6	T715	T715-S717 PolarHBondContact O-N 3.25Å
718	P	42.3	Very low	35.9	Very low	122 Å²	122	141 Å²	141	79%	0.792	75%	0.745	S	S	*	*			trans	-116.7	-148.3	-155	45.2	-30.6	0	0	0	115.3
719	P	39	Very low	34.7	Very low	112 Å²	112	144 Å²	144	73%	0.727	75%	0.752	S	S	*	*				-130.8	-166.2	-118.2	34.2	-9.5	0	0	0	117.8
720	V	42.6	Very low	35.4	Very low	119 Å²	119	143.4 Å²	143.4	72%	0.721	75%	0.748	S	S	*	*			trans	120.7	159.3	153.4	-176.9	0	0	0	0	118.8
721	Y	43.8	Very low	34.7	Very low	223 Å²	223	143.4 Å²	143.4	88%	0.875	75%	0.754	S	S	*	*			trans	-70	173.7	-166.4	-82.8	-104.9	0	0	0	118.8
722	P	34	Very low	34.3	Very low	105 Å²	105	142.5 Å²	142.5	68%	0.682	76%	0.76	S	S	*	*			trans	-107.3	143.3	-172.6	38.7	-32.1	0	0	0	119
723	L	33.2	Very low	34.3	Very low	136 Å²	136	139.6 Å²	139.6	71%	0.712	76%	0.757	S	S	*	*			trans	48	154.2	151.4	-72	173.1	0	0	0	122.2
724	P	44.2	Very low	33.5	Very low	110 Å²	110	140.1 Å²	140.1	71%	0.714	76%	0.759	S	S	*	*			cis	-116	-158	8.2	40.6	-23.8	0	0	0	112.8
725	D	24.1	Very low	33.4	Very low	139 Å²	139	138.4 Å²	138.4	74%	0.743	76%	0.76	S	S	*	*			cis	-160.6	176.8	7.1	-154.3	-0.6	0	0	0	113.9
726	R	33.2	Very low	33.4	Very low	193 Å²	193	141.1 Å²	141.1	73%	0.728	76%	0.763	S	S	*	*			trans	56.5	112	157.1	-62.5	-152.8	71.7	172.3	2.1	123.5
727	D	26.8	Very low	34.2	Very low	109 Å²	109	135.6 Å²	135.6	58%	0.583	75%	0.748	S	S	*	*				73.1	122.3	123.4	-76.8	-37.4	0	0	0	125.5
728	L	31.8	Very low	33.4	Very low	165 Å²	165	139.5 Å²	139.5	86%	0.864	75%	0.754	S	S	*	*			trans	92.9	141.8	136.9	-67.8	170.5	0	0	0	123.7
729	R	29.8	Very low	32.9	Very low	229 Å²	229	139 Å²	139	86%	0.864	75%	0.754	S	S	*	*			trans	-88.3	-175.8	-173.6	-105	-169.9	166.3	-153.6	0	112.6
730	P	42.8	Very low	33	Very low	93 Å²	93	139.6 Å²	139.6	60%	0.604	76%	0.758	S	S	*	*			cis	-143	-177	-31.8	40.9	-23.5	0	0	0	115.1
731	T	27.6	Very low	32.2	Very low	137 Å²	137	137.2 Å²	137.2	84%	0.84	76%	0.757	S	S	*	*			trans	58.3	141	148.9	-49.9	0	0	0	0	120.1
732	G	28.9	Very low	31.5	Very low	64 Å²	64	134.2 Å²	134.2	66%	0.66	76%	0.756	S	S	*	*			cis	146.4	161	-6.8	0	0	0	0	0	114.1
733	V	30.6	Very low	31.4	Very low	124 Å²	124	134.8 Å²	134.8	75%	0.752	75%	0.754	S	S	*	*			trans	71	118.5	155.7	-173.2	0	0	0	0	120.8
734	K	24.7	Very low	31.2	Very low	205 Å²	205	132.5 Å²	132.5	89%	0.891	75%	0.748	S	S	*	*			trans	57.8	154.2	160	-67.8	175.8	177.9	-174.4	0	117.8
735	G	26.4	Very low	30.8	Very low	66 Å²	66	134.5 Å²	134.5	68%	0.68	75%	0.745	S	S	*	*			cis	147.3	136.9	-3.2	0	0	0	0	0	111.5
736	E	24.2	Very low	31.2	Very low	192 Å²	192	136.6 Å²	136.6	90%	0.897	75%	0.748	S	S	*	*			trans	61.4	173.7	176.8	-77.3	-168	77.4	0	0	116.6
737	P	47	Very low	31.1	Very low	95 Å²	95	130.8 Å²	130.8	62%	0.617	74%	0.741	S	S	*	*				-133.6	-176	-56.6	40.5	-25.7	0	0	0	113.5
738	Q	24.6	Very low	31.2	Very low	191 Å²	191	133.6 Å²	133.6	89%	0.893	75%	0.75	S	S	*	*			trans	73.6	146.8	164.5	-67.2	-177.1	-23.6	0	0	119.9
739	S	32.6	Very low	31	Very low	111 Å²	111	130.4 Å²	130.4	78%	0.776	74%	0.742	S	S	*	*			trans	-75.8	164.5	176.9	52.9	0	0	0	0	111.3
740	P	39.6	Very low	31	Very low	126 Å²	126	128.5 Å²	128.5	82%	0.818	74%	0.74	S	S	*	*				-155.6	176.2	53.2	44	-22.6	0	0	0	119.6
741	G	26.8	Very low	30.3	Very low	68 Å²	68	128.1 Å²	128.1	70%	0.701	74%	0.74	S	S	*	*				76.8	90.4	117.6	0	0	0	0	0	121.5
742	D	29.5	Very low	30.5	Very low	160 Å²	160	126.3 Å²	126.3	86%	0.856	73%	0.732	S	S	*	*				62.2	158.7	127.4	-102.6	-54.3	0	0	0	124.4
743	D	30.3	Very low	30.6	Very low	118 Å²	118	131.7 Å²	131.7	63%	0.631	74%	0.741	S	S	*	*			trans	65.8	139.5	158.1	-112.7	18.7	0	0	0	118.9	K745	D743-K745 IonicContact OD1-NZ 3.56Å; D743-K745 IonicContact OD2-NZ 2.59Å; D743-K745 PolarHBondContact OD2-NZ 2.97Å
744	C	29.3	Very low	30.6	Very low	88 Å²	88	130.8 Å²	130.8	60%	0.595	74%	0.739	S	S	*	*			cis	178.9	-175.7	-18.2	-141.9	0	0	0	0	112.6
745	K	37.2	Very low	31.9	Very low	152 Å²	152	126.6 Å²	126.6	66%	0.661	73%	0.733	S	S	*	*			trans	71.4	152.3	150.2	-68.3	142	-154	151.7	0	114.9	D743	D743-K745 IonicContact OD1-NZ 3.56Å; D743-K745 IonicContact OD2-NZ 2.59Å; D743-K745 PolarHBondContact OD2-NZ 2.97Å
746	K	32.5	Very low	32.4	Very low	183 Å²	183	133 Å²	133	80%	0.796	74%	0.743	S	S	*	*			cis	-157.6	170.3	4.6	-130.6	175	179.4	-178.2	0	108.9
747	A	30.7	Very low	32.7	Very low	70 Å²	70	129.9 Å²	129.9	58%	0.579	73%	0.732	S	S	*	*			cis	-152.2	-162.4	10.7	0	0	0	0	0	110.2
748	Q	29.3	Very low	32	Very low	168 Å²	168	132 Å²	132	79%	0.785	74%	0.738	S	S	*	*			cis	-156.6	-169.5	7.1	-156.2	105.2	-101	0	0	110.7
749	S	27.9	Very low	32.6	Very low	99 Å²	99	128 Å²	128	69%	0.692	73%	0.726	S	S	*	*			trans	-83.2	166.2	166.6	54.9	0	0	0	0	111.7
750	K	29	Very low	32.5	Very low	189 Å²	189	129.6 Å²	129.6	82%	0.822	73%	0.732	S	S	*	*				-164.4	172.5	59	-80.9	-170.5	-178.1	-175.9	0	111.5
751	S	27.6	Very low	31.9	Very low	85 Å²	85	133.2 Å²	133.2	59%	0.594	73%	0.734	S	S	*	*			cis	-178.9	168	-32.7	62.7	0	0	0	0	109.7
752	S	32.8	Very low	31.9	Very low	98 Å²	98	140.2 Å²	140.2	69%	0.685	74%	0.74	S	S	*	*			trans	62	138.1	152.7	45.7	0	0	0	0	120.5
753	E	29.2	Very low	31.8	Very low	178 Å²	178	139.9 Å²	139.9	83%	0.832	73%	0.731	S	S	*	*			cis	-175.8	143.9	-4	163.7	163.9	-176.8	0	0	114.3
754	S	31.1	Very low	31.6	Very low	104 Å²	104	141.7 Å²	141.7	73%	0.727	74%	0.735	S	S	*	*			trans	69.3	161.9	155.5	-149.4	0	0	0	0	120.4
755	P	51.9	Low	31.5	Very low	118 Å²	118	140.7 Å²	140.7	77%	0.766	74%	0.74	S	S	*	*			cis	-125.8	178.8	-5.2	15.3	11.1	0	0	0	117.8
756	F	36.5	Very low	30.9	Very low	201 Å²	201	142.9 Å²	142.9	88%	0.882	75%	0.749	S	S	*	*			trans	-87.5	-177.1	171.7	-91.8	-108.4	0	0	0	112.7
757	D	32.6	Very low	30.5	Very low	125 Å²	125	140.5 Å²	140.5	67%	0.668	75%	0.745	S	S	*	*			cis	-138.3	-138.7	14.2	-159.2	13.2	0	0	0	111
758	L	31.5	Very low	30.1	Very low	141 Å²	141	141.1 Å²	141.1	74%	0.738	75%	0.745	S	S	*	*			cis	-154.8	-168.6	7.1	-136.4	-174.2	0	0	0	110.8
759	T	36.3	Very low	29.8	Very low	106 Å²	106	139.8 Å²	139.8	65%	0.65	74%	0.742	S	S	*	*			trans	-140.1	167	-170.2	68.3	0	0	0	0	114.1
760	T	31.2	Very low	29.5	Very low	144 Å²	144	143.8 Å²	143.8	88%	0.883	75%	0.747	S	S	*	*			trans	-177.9	175.7	136.1	22.7	0	0	0	0	115.3
761	K	27.8	Very low	29.4	Very low	202 Å²	202	140.5 Å²	140.5	88%	0.878	74%	0.743	S	S	*	*			trans	-99.1	-174.5	-179.7	-59.2	176	-179.3	176.4	0	110.5
762	R	25.1	Very low	30	Very low	216 Å²	216	141.5 Å²	141.5	82%	0.815	75%	0.748	S	S	*	*			cis	176.9	151.8	36.9	-169.2	-167.1	-173.3	176.3	2.7	111.9
763	K	28.1	Very low	29.5	Very low	153 Å²	153	142 Å²	142	67%	0.665	75%	0.747	S	S	*	*			trans	68.6	162.6	156.4	-110.1	-178.9	171.3	-148.5	0	117
764	E	26.6	Very low	29.2	Very low	156 Å²	156	141.7 Å²	141.7	73%	0.729	74%	0.743	S	S	*	*			cis	-157.8	167	7.9	-164.3	142.7	-145.7	0	0	113
765	G	26.5	Very low	28.9	Very low	67 Å²	67	141.8 Å²	141.8	69%	0.691	74%	0.739	S	S	*	*			trans	96.9	129	173	0	0	0	0	0	115.5
766	K	25.8	Very low	27.6	Very low	197 Å²	197	142 Å²	142	86%	0.857	73%	0.734	S	S	*	*			cis	69.7	131	27.3	-106.7	-165	177.6	-172.8	0	113.7
767	L	23.1	Very low	27.1	Very low	134 Å²	134	134 Å²	134	70%	0.702	70%	0.704	S	S	*	*			cis	-145.7	141.7	12.5	-81.7	164.3	0	0	0	108.3
768	S	22.2	Very low	26.8	Very low	83 Å²	83	131.7 Å²	131.7	58%	0.58	70%	0.703	S	S	*	*				70.2	140.3	71.8	87.6	0	0	0	0	118.3
769	L	22.5	Very low	26.4	Very low	140 Å²	140	128.7 Å²	128.7	73%	0.733	69%	0.688	S	S	*	*			trans	82.5	158	167.7	-53.8	165.7	0	0	0	116
770	F	23	Very low	26.1	Very low	182 Å²	182	127.5 Å²	127.5	80%	0.798	68%	0.68	S	S	*	*			cis	-151.4	176.9	2.5	-122.6	-44.6	0	0	0	112.1
771	V	27	Very low	25.9	Very low	120 Å²	120	127.2 Å²	127.2	73%	0.727	68%	0.678	S	S	*	*			trans	-121.5	161.8	164	169.6	0	0	0	0	105.6
772	P	39.5	Very low	25.9	Very low	107 Å²	107	120.9 Å²	120.9	70%	0.695	67%	0.67	S	S	*	*			cis	-110	-132.9	-7.9	21.2	4.7	0	0	0	111.3
773	T	22.1	Very low	26.1	Very low	109 Å²	109	119.2 Å²	119.2	67%	0.669	67%	0.672	S	S	*	*			cis	-168.4	155	6.5	-14	0	0	0	0	112.8
774	K	23.7	Very low	26	Very low	170 Å²	170	118.1 Å²	118.1	74%	0.739	67%	0.673	S	S	*	*			trans	62	145.9	148.8	-78.1	-174.1	170.8	-161.2	0	119.2
775	T	23.8	Very low	26.4	Very low	107 Å²	107	119 Å²	119	66%	0.656	68%	0.677	S	S	*	*				51.8	134.9	67.2	83.7	0	0	0	0	112.7
776	D	24.2	Very low	27.5	Very low	122 Å²	122	120.8 Å²	120.8	65%	0.652	68%	0.677	S	S	*	*			cis	-155.9	144	41.9	-79.1	-73	0	0	0	114.4
777	A	26.9	Very low	27.7	Very low	32 Å²	32	118.8 Å²	118.8	26%	0.264	67%	0.674	S	S	.	*				48.2	121.7	123.9	0	0	0	0	0	124.9	T1059 S1060 P1061	A777-T1059 VanDerWaalsContact N-CG2 3.26Å; A777-S1060 CarbonylContact C-O 3.19Å; A777-S1060 WeakPolarHBondContact CA-O 3.34Å; A777-S1060 WeakPolarHBondContact CB-O 3.31Å; A777-P1061 HydrophobicContact CB-CB 4.41Å; A777-P1061 VanDerWaalsContact CB-CD 3.44Å; A777-P1061 HydrophobicContact CB-CG 3.71Å
778	A	25	Very low	27.8	Very low	77 Å²	77	118.7 Å²	118.7	64%	0.636	68%	0.675	S	S	*	*			trans	-153.9	145.5	134.1	0	0	0	0	0	112.3	S1060	A778-S1060 CarbonylContact C-O 2.87Å; A778-S1060 WeakPolarHBondContact CA-O 3.39Å; A778-S1060 PolarHBondContact N-O 3.31Å
779	N	25.1	Very low	28	Very low	78 Å²	78	121.3 Å²	121.3	42%	0.417	68%	0.681	S	S	.	*			trans	-157.4	-163	-171.6	74.8	-174	0	0	0	117.5	S1060 P1061	N779-S1060 PolarHBondContact N-O 3.02Å; N779-S1060 WeakPolarHBondContact OD1-CA 3.49Å; N779-P1061 VanDerWaalsContact CG-C 3.5Å; N779-P1061 VanDerWaalsContact CG-N 3.26Å; N779-P1061 PolarHBondContact ND2-O 3.09Å; N779-P1061 WeakPolarHBondContact OD1-CA 3.33Å
780	V	28.7	Very low	28.3	Very low	82 Å²	82	119.1 Å²	119.1	50%	0.497	68%	0.678	S	S	.	*			trans	104.2	139.6	154.7	132.7	0	0	0	0	118.7
781	T	26.6	Very low	28.6	Very low	138 Å²	138	118.3 Å²	118.3	85%	0.847	68%	0.681	S	S	*	*			trans	51.2	159.4	172.2	44.8	0	0	0	0	119.8
782	G	29.1	Very low	28.6	Very low	68 Å²	68	115.6 Å²	115.6	70%	0.701	68%	0.677	S	S	*	*			cis	166.7	140.9	-11.7	0	0	0	0	0	114.4
783	Q	28.6	Very low	28.2	Very low	181 Å²	181	115.9 Å²	115.9	85%	0.846	68%	0.682	S	S	*	*			trans	54.4	120.9	158.9	-70	-158.9	-94.1	0	0	124.1
784	D	27.1	Very low	28.8	Very low	131 Å²	131	122.8 Å²	122.8	70%	0.701	70%	0.696	S	S	*	*				86.7	160.8	124.1	-79.6	-67.6	0	0	0	127.3
785	Q	34.1	Very low	29	Very low	173 Å²	173	118.5 Å²	118.5	81%	0.808	70%	0.699	S	S	*	*			trans	-65.2	176.7	-177.9	-78.7	-169.3	-2.7	0	0	114.9
786	P	50.4	Low	29.3	Very low	105 Å²	105	125.6 Å²	125.6	68%	0.682	71%	0.714	S	S	*	*			cis	-158.8	-177.8	34.9	46.3	-22.9	0	0	0	122.4
787	L	29.8	Very low	29.3	Very low	155 Å²	155	123.4 Å²	123.4	81%	0.812	72%	0.72	S	S	*	*			trans	64.1	111.6	144.9	-74.1	160.7	0	0	0	125.8
788	D	24.3	Very low	29.3	Very low	133 Å²	133	130.3 Å²	130.3	71%	0.711	75%	0.747	S	S	*	*				72.6	158.9	110.1	-155.2	26.1	0	0	0	125.8
789	L	27.6	Very low	29.3	Very low	137 Å²	137	133.8 Å²	133.8	72%	0.717	75%	0.753	S	S	*	*			trans	114.8	105.6	152.6	-61.9	178.7	0	0	0	122.6
790	S	27.6	Very low	29.6	Very low	94 Å²	94	135.7 Å²	135.7	66%	0.657	77%	0.77	S	S	*	*				46.6	148.7	108.3	-71.2	0	0	0	0	124.1
791	L	29.8	Very low	29.7	Very low	165 Å²	165	137.7 Å²	137.7	86%	0.864	79%	0.786	S	S	*	*			cis	-174.7	143.7	-17.3	-120	175.3	0	0	0	113.5
792	G	27.3	Very low	29.5	Very low	63 Å²	63	140.4 Å²	140.4	65%	0.649	79%	0.789	S	S	*	*			trans	85.9	170.7	152	0	0	0	0	0	120.6
793	S	30.7	Very low	29.4	Very low	113 Å²	113	146 Å²	146	79%	0.79	80%	0.797	S	S	*	*			cis	-175.4	161.4	-11.2	-99.4	0	0	0	0	114.6
794	R	33.9	Very low	29.5	Very low	255 Å²	255	145.6 Å²	145.6	96%	0.962	80%	0.795	S	S	*	*			trans	84	140.4	168	-51	173.6	-179.6	177.7	0.3	118.2
795	G	29.1	Very low	29.4	Very low	79 Å²	79	144.8 Å²	144.8	81%	0.814	80%	0.795	S	S	*	*			cis	155.2	165	-13.7	0	0	0	0	0	115.5
796	R	30.3	Very low	29.1	Very low	257 Å²	257	147.1 Å²	147.1	97%	0.97	80%	0.797	S	S	*	*			trans	127.8	98.6	152	-169.3	-176	-114	-114.2	2.6	119.3
797	G	24.1	Very low	27.9	Very low	75 Å²	75	150.2 Å²	150.2	77%	0.773	80%	0.799	S	S	*	*			trans	78.7	154.9	147.3	0	0	0	0	0	120
798	Q	25.9	Very low	27.6	Very low	178 Å²	178	149.1 Å²	149.1	83%	0.832	79%	0.794	S	S	*	*			cis	-167.7	113.9	-8.6	-153.5	171.8	5.9	0	0	112.5
799	I	25.1	Very low	27.5	Very low	149 Å²	149	152 Å²	152	76%	0.764	80%	0.8	S	S	*	*			trans	55	142.7	149.8	-61.6	174.2	0	0	0	119.3
800	P	32.2	Very low	27.3	Very low	119 Å²	119	150.2 Å²	150.2	77%	0.773	80%	0.799	S	S	*	*			cis	-124	-177.6	8.9	40.5	-26.3	0	0	0	115.1
801	C	29.2	Very low	27	Very low	123 Å²	123	155.1 Å²	155.1	83%	0.831	81%	0.809	S	S	*	*			cis	-178.2	80.3	-38.6	-174.9	0	0	0	0	108.8
802	Q	23.7	Very low	26.5	Very low	195 Å²	195	154.3 Å²	154.3	91%	0.911	80%	0.801	S	S	*	*			trans	-154.1	79.8	177.4	-170.2	-175.6	102.9	0	0	111.4
803	E	25.7	Very low	26.3	Very low	187 Å²	187	158.6 Å²	158.6	87%	0.874	80%	0.804	S	S	*	*			trans	-157.9	137.1	170.7	-152.7	160.6	-156.1	0	0	114
804	E	32.2	Very low	26	Very low	171 Å²	171	159.1 Å²	159.1	80%	0.799	79%	0.794	S	S	*	*			trans	63	177.4	156.2	-105.2	-155.9	-146.3	0	0	123.7
805	T	25.1	Very low	25.7	Very low	114 Å²	114	154.2 Å²	154.2	70%	0.699	78%	0.78	S	S	*	*			trans	79.8	139	-171.2	70.4	0	0	0	0	115.7
806	R	27.1	Very low	25.4	Very low	223 Å²	223	159.5 Å²	159.5	84%	0.842	78%	0.78	S	S	*	*			cis	-166.4	160.6	-0.6	-109.7	167.8	-175.3	-165.4	4.2	105.8
807	K	24.9	Very low	25.1	Very low	170 Å²	170	151.3 Å²	151.3	74%	0.739	77%	0.768	S	S	*	*			cis	174.3	168.7	-9.3	-144.1	-173.9	-179.1	-170.8	0	106.5
808	N	23.5	Very low	25.1	Very low	132 Å²	132	153.7 Å²	153.7	71%	0.706	77%	0.767	S	S	*	*			trans	74.9	132.5	165	-50.2	-17.1	0	0	0	115.6
809	K	23.2	Very low	25.1	Very low	193 Å²	193	152.2 Å²	152.2	84%	0.839	77%	0.765	S	S	*	*				68.1	104	50.9	-75.2	-158.1	170.8	-167.6	0	112.6
810	S	21.8	Very low	25.3	Very low	99 Å²	99	149 Å²	149	69%	0.692	76%	0.76	S	S	*	*				88.5	104.9	58	71.8	0	0	0	0	113.9
811	F	21.2	Very low	25.3	Very low	198 Å²	198	149.3 Å²	149.3	87%	0.868	76%	0.762	S	S	*	*			trans	-157.4	-168.8	145	-147.8	-108.1	0	0	0	111.1
812	E	20.9	Very low	25.1	Very low	147 Å²	147	153 Å²	153	69%	0.687	76%	0.764	S	S	*	*			trans	-123.7	169.9	-155.8	-169.3	168.2	-157.6	0	0	112.2
813	E	23.2	Very low	25.5	Very low	154 Å²	154	147.4 Å²	147.4	72%	0.72	75%	0.751	S	S	*	*			trans	74.8	128.1	152.5	-113	-164.5	146.7	0	0	123.6
814	E	23.8	Very low	25.5	Very low	123 Å²	123	145.3 Å²	145.3	58%	0.575	75%	0.746	S	S	*	*				74.3	148.4	128.1	-98.9	-82.7	73.4	0	0	124.5
815	K	26.4	Very low	25.4	Very low	153 Å²	153	142.8 Å²	142.8	67%	0.665	74%	0.742	S	S	*	*			trans	67.7	161	159.3	-65	168.9	-172.9	66.6	0	120
816	K	22.9	Very low	25.6	Very low	190 Å²	190	140 Å²	140	83%	0.826	73%	0.727	S	S	*	*			cis	-175.7	169.8	-41.3	-147.7	171.6	-179.3	176.2	0	108.2
817	A	24.2	Very low	25.9	Very low	85 Å²	85	134 Å²	134	70%	0.702	71%	0.711	S	S	*	*			trans	69.2	138.1	168.9	0	0	0	0	0	115.8
818	V	24.1	Very low	26.4	Very low	125 Å²	125	131.5 Å²	131.5	76%	0.758	70%	0.702	S	S	*	*			cis	87	104.4	30.4	178.7	0	0	0	0	113.9
819	D	26.8	Very low	26.7	Very low	147 Å²	147	131.7 Å²	131.7	79%	0.786	70%	0.699	S	S	*	*				-165.1	136	115	-93.2	-42.7	0	0	0	106.8
820	A	28.3	Very low	26.8	Very low	81 Å²	81	125.7 Å²	125.7	67%	0.669	69%	0.685	S	S	*	*				79.4	147.5	52.3	0	0	0	0	0	112.4
821	P	32.6	Very low	27.5	Very low	126 Å²	126	131.9 Å²	131.9	82%	0.818	69%	0.693	S	S	*	*			cis	-128.8	-174.4	22.5	42	-25.8	0	0	0	117
822	K	26.3	Very low	28.3	Very low	201 Å²	201	128.4 Å²	128.4	87%	0.874	69%	0.691	S	S	*	*			trans	-74.4	-171.8	164	-52.2	177.4	-177.7	179.8	0	109.6
823	A	30.5	Very low	29.4	Very low	77 Å²	77	127.6 Å²	127.6	64%	0.636	70%	0.696	S	S	*	*			cis	-150.2	-155.5	14	0	0	0	0	0	108.9
824	D	27.3	Very low	30.7	Very low	143 Å²	143	125 Å²	125	77%	0.765	69%	0.692	S	S	*	*			cis	-159.9	177.4	22.2	-112.5	-41.1	0	0	0	108.2
825	T	30.1	Very low	31.2	Very low	117 Å²	117	127 Å²	127	72%	0.718	70%	0.7	S	S	*	*			cis	-161.2	156.7	23	-16.7	0	0	0	0	111.7
826	S	28.7	Very low	31.5	Very low	56 Å²	56	127.8 Å²	127.8	39%	0.392	70%	0.703	S	S	.	*			trans	66.8	135.2	147	-154.1	0	0	0	0	118.6	E1101 E1102	S826-E1101 CarbonylContact O-C 3.48Å; S826-E1102 WeakPolarHBondContact CB-O 3.43Å; S826-E1102 PolarHBondContact OG-O 3.01Å
827	L	34.1	Very low	31.9	Very low	96 Å²	96	125.5 Å²	125.5	50%	0.503	70%	0.697	S	S	.	*			cis	77.6	125.4	32.8	-51	171.7	0	0	0	114.2	E1100 E1101	L827-E1100 WeakPolarHBondContact CA-O 2.98Å; L827-E1100 PolarHBondContact N-O 2.89Å; L827-E1101 CarbonylContact C-O 3.56Å
828	Q	34	Very low	32.1	Very low	118 Å²	118	127.9 Å²	127.9	55%	0.551	70%	0.698	S	S	*	*			cis	-176.9	159.2	15.9	-132.7	170.3	16.4	0	0	114.8	E1101	Q828-E1101 PolarHBondContact N-O 3.05Å
829	H	30.4	Very low	33.5	Very low	136 Å²	136	126.5 Å²	126.5	63%	0.63	69%	0.692	S	S	*	*			trans	84.5	96.3	150.8	-63.8	121.7	0	0	0	124.5	E1100	H829-E1100 VanDerWaalsContact C-OE2 3.3Å; H829-E1100 WeakPolarHBondContact CA-OE2 3.03Å; H829-E1100 PolarHBondContact N-OE2 2.88Å
830	A	26.1	Very low	33.9	Very low	67 Å²	67	124.9 Å²	124.9	55%	0.554	68%	0.682	S	S	*	*				68.4	132.3	109.3	0	0	0	0	0	124.9	E1100	A830-E1100 PolarHBondContact N-OE1 2.85Å; A830-E1100 PolarHBondContact N-OE2 2.85Å
831	R	35.3	Very low	34.2	Very low	229 Å²	229	129.7 Å²	129.7	86%	0.864	68%	0.684	S	S	*	*			trans	-15.5	154.7	154.4	-64.7	-178.8	-173.2	174.8	6.2	118.8
832	P	38.7	Very low	34.5	Very low	126 Å²	126	131.9 Å²	131.9	82%	0.818	68%	0.676	S	S	*	*			cis	-154	178	42.9	43.9	-22.6	0	0	0	120.2
833	T	43.3	Very low	34.7	Very low	130 Å²	130	127.8 Å²	127.8	80%	0.798	67%	0.668	S	S	*	*			trans	-76.9	171.6	160.8	46.3	0	0	0	0	112.6
834	P	51.1	Low	34.9	Very low	98 Å²	98	130.4 Å²	130.4	64%	0.636	67%	0.667	S	S	*	*			cis	-142.7	-145.6	19.9	44	-21.6	0	0	0	115.3
835	F	34.5	Very low	35.1	Very low	167 Å²	167	129.6 Å²	129.6	73%	0.732	66%	0.656	S	S	*	*			trans	77.5	143.6	179.5	-63.8	-74	0	0	0	115.7
836	F	32.1	Very low	35	Very low	169 Å²	169	134.1 Å²	134.1	74%	0.741	66%	0.66	S	S	*	*			cis	-142.4	-172.1	6.2	-112.5	-45	0	0	0	108.8
837	M	31.4	Very low	35	Very low	142 Å²	142	142.3 Å²	142.3	70%	0.7	68%	0.683	S	S	*	*			cis	-150.5	-159.9	10.6	-135.1	-72	89.3	0	0	110.7
838	D	29.1	Very low	34.7	Very low	134 Å²	134	145.1 Å²	145.1	72%	0.717	70%	0.695	S	S	*	*			trans	-151.8	-165.6	-176.7	-133.9	-18.2	0	0	0	107
839	P	52.3	Low	34.2	Very low	96 Å²	96	143.9 Å²	143.9	62%	0.623	70%	0.699	S	S	*	*			cis	-144.9	179.7	8.7	42.3	-20.4	0	0	0	118.7
840	I	35.5	Very low	34.1	Very low	113 Å²	113	144.1 Å²	144.1	58%	0.579	71%	0.705	S	S	*	*			trans	56.6	141.7	160.3	15.5	169	0	0	0	119.5	R842	I840-R842 HydrophobicContact CG2-CG 4.43Å
841	Y	34.5	Very low	34.7	Very low	183 Å²	183	145.1 Å²	145.1	72%	0.718	71%	0.706	S	S	*	*			cis	-133.6	162.3	11.3	-95.8	-110.4	0	0	0	108.8
842	R	38	Very low	34.5	Very low	171 Å²	171	142.5 Å²	142.5	65%	0.645	70%	0.701	S	S	*	*			cis	172.9	-177	-21	-106.3	-176	-147.3	164.2	7.6	104.8	I840	I840-R842 HydrophobicContact CG2-CG 4.43Å
843	V	32.5	Very low	34.2	Very low	116 Å²	116	141.9 Å²	141.9	70%	0.703	69%	0.687	S	S	*	*			cis	-166	156.8	4.1	115.7	0	0	0	0	105.2
844	E	33.7	Very low	33.3	Very low	132 Å²	132	141.6 Å²	141.6	62%	0.617	69%	0.686	S	S	*	*			cis	-175.8	162.4	-28.8	-140.4	-162.3	163.4	0	0	110.5
845	K	32.3	Very low	32.2	Very low	125 Å²	125	142.3 Å²	142.3	54%	0.543	68%	0.683	S	S	.	*			trans	52.6	120.1	148.7	-79.4	179.5	-175.5	112.5	0	123.1
846	R	27.1	Very low	32	Very low	213 Å²	213	141.7 Å²	141.7	80%	0.804	68%	0.68	S	S	*	*				71.5	158.5	124.6	-67.1	175.7	174.8	171.4	-3.4	120.3
847	R	28	Very low	32	Very low	228 Å²	228	137.5 Å²	137.5	86%	0.86	67%	0.666	S	S	*	*			trans	72	155.4	174.6	-64	-171.9	-169.7	-84.8	4.7	113.4
848	M	27.7	Very low	31.9	Very low	155 Å²	155	136.4 Å²	136.4	76%	0.764	66%	0.657	S	S	*	*			cis	-161.8	-176.4	-26.7	-175	145.7	168.1	0	0	106.9
849	S	24.4	Very low	32.2	Very low	91 Å²	91	139.1 Å²	139.1	64%	0.636	66%	0.659	S	S	*	*			trans	-19.1	141.4	169.6	60.5	0	0	0	0	119.6
850	D	29.2	Very low	31.2	Very low	141 Å²	141	142.1 Å²	142.1	75%	0.754	67%	0.666	S	S	*	*				9.3	141.4	112.1	-167	60.5	0	0	0	116.4
851	P	38.3	Very low	31.4	Very low	88 Å²	88	146.9 Å²	146.9	57%	0.571	68%	0.677	S	S	*	*			cis	-137.4	-159.2	24.3	23	5	0	0	0	115.4
852	F	30.3	Very low	31.4	Very low	174 Å²	174	143.9 Å²	143.9	76%	0.763	68%	0.68	S	S	*	*			trans	82.3	134.1	170.6	-71.6	-109.2	0	0	0	116.5
853	E	32.6	Very low	31.4	Very low	113 Å²	113	140.8 Å²	140.8	53%	0.528	68%	0.68	S	S	.	*			cis	-141.2	110.7	-13.8	-133.8	-173.2	148.4	0	0	110.9	K856	E853-K856 IonicContact OE1-NZ 3.83Å; E853-K856 PolarHBondContact OE1-NZ 2.95Å
854	T	25.4	Very low	32.1	Very low	125 Å²	125	140 Å²	140	77%	0.767	68%	0.678	S	S	*	*	S	Bend	trans	-64.8	146.3	142.5	45.7	0	0	0	0	108.5
855	L	28.2	Very low	32	Very low	112 Å²	112	137.2 Å²	137.2	59%	0.586	69%	0.685	S	S	*	*			trans	67.3	133.9	-164.3	-57.1	62.7	0	0	0	109.9
856	K	29.3	Very low	32	Very low	154 Å²	154	139.7 Å²	139.7	67%	0.67	70%	0.696	S	S	*	*			cis	-147.8	151.2	41.8	-79.8	-172.3	-167.8	74.4	0	111.5	E853	E853-K856 IonicContact OE1-NZ 3.83Å; E853-K856 PolarHBondContact OE1-NZ 2.95Å
857	D	31.3	Very low	32.3	Very low	82 Å²	82	135.8 Å²	135.8	44%	0.439	69%	0.69	S	S	.	*			cis	-157.6	-179.6	-9.7	-128.3	-16.2	0	0	0	112.2
858	K	30.9	Very low	32.3	Very low	118 Å²	118	134.8 Å²	134.8	51%	0.513	69%	0.692	S	S	.	*			trans	-3	138	133.4	-49.4	161.3	-166.5	78.3	0	113.8
859	Y	34.1	Very low	32.6	Very low	191 Å²	191	135.3 Å²	135.3	75%	0.749	69%	0.693	S	S	*	*			cis	-146.9	138.1	49.9	-88.5	-86	0	0	0	115.6
860	M	31.6	Very low	33.3	Very low	159 Å²	159	136.3 Å²	136.3	78%	0.783	70%	0.697	S	S	*	*			trans	33.4	113.4	132.4	-62.8	-65	-144.1	0	0	119.4	P862	M860-P862 WeakPolarHBondContact O-CD 3.43Å
861	R	39.9	Very low	33.3	Very low	213 Å²	213	137 Å²	137	80%	0.804	70%	0.695	S	S	*	*			trans	-33.5	127.8	136.6	-174.3	-160.5	-65.1	137.4	-4.5	111.4	T863	R861-T863 WeakPolarHBondContact CD-OG1 3.48Å; R861-T863 VanDerWaalsContact CG-OG1 3.31Å; R861-T863 WeakPolarHBondContact CG-OG1 3.37Å
862	P	33.8	Very low	32.8	Very low	121 Å²	121	141.5 Å²	141.5	79%	0.786	71%	0.706	S	S	*	*				-127.9	112.4	107.8	4.1	17.2	0	0	0	111.8	M860	M860-P862 WeakPolarHBondContact O-CD 3.43Å
863	T	38.9	Very low	32.7	Very low	106 Å²	106	144.5 Å²	144.5	65%	0.65	71%	0.713	S	S	*	*				-41.9	158	95.7	31.2	0	0	0	0	116.8	R861	R861-T863 WeakPolarHBondContact CD-OG1 3.48Å; R861-T863 VanDerWaalsContact CG-OG1 3.31Å; R861-T863 WeakPolarHBondContact CG-OG1 3.37Å
864	P	46.3	Very low	32.9	Very low	99 Å²	99	147.1 Å²	147.1	64%	0.643	73%	0.729	S	S	*	*			cis	-137.6	-178.6	10.2	36.6	-16.5	0	0	0	116.6	F866	P864-F866 HydrophobicContact CB-CD2 4.26Å; P864-F866 HydrophobicContact CB-CE2 4.29Å; P864-F866 HydrophobicContact CG-CD2 3.95Å; P864-F866 HydrophobicContact CG-CE2 3.93Å
865	G	32.1	Very low	33.7	Very low	74 Å²	74	146.6 Å²	146.6	76%	0.763	73%	0.728	S	S	*	*				89	-174.8	123	0	0	0	0	0	119.3
866	F	33.2	Very low	34	Very low	177 Å²	177	148.5 Å²	148.5	78%	0.776	74%	0.739	S	S	*	*			cis	-147.3	170.7	-5.3	-128.9	-85.5	0	0	0	111.3	P864	P864-F866 HydrophobicContact CB-CD2 4.26Å; P864-F866 HydrophobicContact CB-CE2 4.29Å; P864-F866 HydrophobicContact CG-CD2 3.95Å; P864-F866 HydrophobicContact CG-CE2 3.93Å
867	L	32.5	Very low	34.6	Very low	131 Å²	131	149.7 Å²	149.7	69%	0.686	75%	0.747	S	S	*	*			trans	-37.2	157.6	179.7	-60.9	166.1	0	0	0	118.2
868	F	28.1	Very low	35.1	Very low	206 Å²	206	157.3 Å²	157.3	90%	0.904	77%	0.77	S	S	*	*				-164.1	154.7	106.8	-105.5	-71	0	0	0	114.4
869	H	33.3	Very low	35.7	Very low	167 Å²	167	156.7 Å²	156.7	77%	0.773	78%	0.775	S	S	*	*			trans	-93.5	159.8	171.7	-130.7	-31.4	0	0	0	109
870	P	39.9	Very low	35.8	Very low	112 Å²	112	159.5 Å²	159.5	73%	0.727	79%	0.785	S	S	*	*				-154.5	162.8	74.1	39.7	-19	0	0	0	118.9
871	Q	30	Very low	36.2	Very low	154 Å²	154	160 Å²	160	72%	0.72	79%	0.788	S	S	*	*			trans	17.4	146.9	146.8	-53.8	-177.1	-12.7	0	0	125.8
872	F	27.1	Very low	36.4	Very low	184 Å²	184	154.8 Å²	154.8	81%	0.807	78%	0.779	S	S	*	*			trans	92.2	137.7	143.5	-81.8	-60	0	0	0	123.5
873	R	28.6	Very low	36.5	Very low	237 Å²	237	152.1 Å²	152.1	89%	0.894	77%	0.767	S	S	*	*			trans	66.6	105.5	168.2	-71.2	-171.2	173.8	-176.6	-1.4	119.9
874	L	36.2	Very low	37.1	Very low	167 Å²	167	154.2 Å²	154.2	87%	0.874	77%	0.773	S	S	*	*			trans	-78	153.9	139.3	-69.9	164.3	0	0	0	108.8
875	P	42.8	Very low	37	Very low	114 Å²	114	156.7 Å²	156.7	74%	0.74	78%	0.776	S	S	*	*				-145.1	162	88.8	40.1	-25	0	0	0	116.9
876	D	33.5	Very low	37.6	Very low	153 Å²	153	157.5 Å²	157.5	82%	0.818	77%	0.77	S	S	*	*			trans	73.3	161.4	149.8	-108.5	-47.6	0	0	0	123.5
877	Q	42.2	Very low	37.9	Very low	179 Å²	179	156.8 Å²	156.8	84%	0.836	77%	0.771	S	S	*	*	S	Bend	trans	-121	83.5	-143.8	-170.3	-174.9	11	0	0	114.7
878	R	42.5	Very low	38.3	Very low	242 Å²	242	154.8 Å²	154.8	91%	0.913	77%	0.773	S	S	*	*			trans	-158.2	-5.7	154.9	-119.4	170.6	-161.9	-164.1	2.8	117.9	W880	R878-W880 VanDerWaalsContact C-N 3.26Å; R878-W880 PolarHBondContact O-N 3.11Å; R878-W880 VanDerWaalsContact O-N 3.15Å
879	T	42.9	Very low	39	Very low	104 Å²	104	153 Å²	153	64%	0.638	77%	0.768	S	S	*	*			trans	-74.9	-2.8	-168.9	-26.1	0	0	0	0	115.8	M881	T879-M881 PolarHBondContact O-N 3.09Å
880	W	35.6	Very low	39.5	Very low	250 Å²	250	153.3 Å²	153.3	95%	0.947	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	12.6	-166	-96.9	86.1	0	0	0	116.5	R878	R878-W880 VanDerWaalsContact C-N 3.26Å; R878-W880 PolarHBondContact O-N 3.11Å; R878-W880 VanDerWaalsContact O-N 3.15Å
881	M	40.6	Very low	39.5	Very low	170 Å²	170	155.7 Å²	155.7	84%	0.837	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.1	10.5	-177.3	-124.8	169	-177.5	0	0	115.4	T879	T879-M881 PolarHBondContact O-N 3.09Å
882	T	44.5	Very low	40	Very low	103 Å²	103	154 Å²	154	63%	0.632	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.2	-1	-174.8	-27.8	0	0	0	0	115.2
883	A	36.5	Very low	40.4	Very low	65 Å²	65	149.5 Å²	149.5	54%	0.537	75%	0.753	S	S	.	*	S	Bend	trans	-80.6	-25.2	174.5	0	0	0	0	0	113.4	E885 S886	A883-E885 VanDerWaalsContact C-N 3.33Å; A883-E885 PolarHBondContact O-N 3.47Å; A883-S886 PolarHBondContact O-N 3.48Å
884	I	51.4	Low	40.8	Very low	150 Å²	150	148 Å²	148	77%	0.769	75%	0.753	S	S	*	*	S	Bend	trans	-69.6	-30	-173.3	-65.9	176.1	0	0	0	111.8
885	E	43.7	Very low	40.5	Very low	152 Å²	152	143.5 Å²	143.5	71%	0.71	75%	0.747	S	S	*	*	S	Bend	trans	-85	-19.9	-177.4	-62.4	-179.3	134.9	0	0	113	A883 M887	A883-E885 VanDerWaalsContact C-N 3.33Å; A883-E885 PolarHBondContact O-N 3.47Å; E885-M887 PolarHBondContact O-N 2.9Å
886	S	43.7	Very low	39.8	Very low	90 Å²	90	143.7 Å²	143.7	63%	0.629	75%	0.75	S	S	*	*	S	Bend	trans	-78.7	-14.5	-174	-173.7	0	0	0	0	115.2	A883	A883-S886 PolarHBondContact O-N 3.48Å
887	M	39.4	Very low	39.7	Very low	163 Å²	163	145 Å²	145	80%	0.803	76%	0.757	S	S	*	*	S	Bend	trans	-97.2	-18.4	179.2	-78.1	-167.4	163.9	0	0	114.2	E885 E889	E885-M887 PolarHBondContact O-N 2.9Å; M887-E889 PolarHBondContact O-N 2.81Å
888	A	41.5	Very low	39.1	Very low	88 Å²	88	145.8 Å²	145.8	73%	0.727	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	-20.1	179.4	0	0	0	0	0	113.4
889	E	42.4	Very low	39.3	Very low	170 Å²	170	139.1 Å²	139.1	79%	0.794	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-10	-169.8	-156.1	171.2	-137.6	0	0	114.9	M887	M887-E889 PolarHBondContact O-N 2.81Å
890	K	45	Very low	38.6	Very low	172 Å²	172	141.7 Å²	141.7	75%	0.748	75%	0.75	S	S	*	*	S	Bend	trans	-115.2	3.1	-169.3	-89	-176.2	175.6	176.1	0	117.9
891	L	40.4	Very low	38.4	Very low	163 Å²	163	135.9 Å²	135.9	85%	0.853	74%	0.742	S	S	*	*	S	Bend	trans	-127.9	20.8	-179.4	-68.9	175.5	0	0	0	115.2
892	E	40.2	Very low	38	Very low	119 Å²	119	131.1 Å²	131.1	56%	0.556	74%	0.737	S	S	*	*	S	Bend	trans	-101.8	18.6	163.8	-147.1	-154.3	-125.7	0	0	113.3	R629 R630	R629-E892 IonicContact CZ-OE1 2.62Å; R629-E892 IonicContact CZ-OE2 3.96Å; R629-E892 IonicContact NH1-OE1 3.13Å; R629-E892 PolarHBondContact NH1-OE1 2.83Å; R629-E892 IonicContact NH1-OE2 2.68Å; R629-E892 PolarHBondContact NH1-OE2 2.75Å; R629-E892 VanDerWaalsContact NH2-CD 3.34Å; R629-E892 IonicContact NH2-OE1 2.73Å; R629-E892 PolarHBondContact NH2-OE1 2.97Å; R629-E892 IonicContact NH2-OE2 2.68Å; R629-E892 PolarHBondContact NH2-OE2 2.79Å; R630-E892 IonicContact NH2-OE2 2.67Å; R630-E892 PolarHBondContact NH2-OE2 2.62Å
893	T	35.9	Very low	37.4	Very low	89 Å²	89	134.2 Å²	134.2	55%	0.546	75%	0.745	S	S	.	*	S	Bend	trans	-128.3	95.5	175.3	36	0	0	0	0	111.2
894	F	35	Very low	37.6	Very low	206 Å²	206	137 Å²	137	90%	0.904	75%	0.75	S	S	*	*			trans	64.2	130.8	170.1	-34.2	-74.8	0	0	0	115.2
895	G	31.1	Very low	36.8	Very low	72 Å²	72	137.1 Å²	137.1	74%	0.742	75%	0.751	S	S	*	*			cis	166.5	155.6	-1.2	0	0	0	0	0	109.9
896	S	27.2	Very low	36.1	Very low	117 Å²	117	140.4 Å²	140.4	82%	0.818	76%	0.757	S	S	*	*			trans	-15.4	133.7	175.7	-52.5	0	0	0	0	118.8
897	L	31.3	Very low	35.4	Very low	181 Å²	181	140 Å²	140	95%	0.948	75%	0.754	S	S	*	*				-161.7	175.9	113.8	-101.3	165.9	0	0	0	111
898	K	29.9	Very low	35.2	Very low	195 Å²	195	138.5 Å²	138.5	85%	0.848	75%	0.754	S	S	*	*			trans	-113.8	179.4	-161.9	-116.2	-161.6	174.7	-175.8	0	112.5
899	P	47.3	Very low	35.3	Very low	103 Å²	103	139.6 Å²	139.6	67%	0.669	75%	0.753	S	S	*	*			trans	-85	-174.8	-160.7	40	-41.1	0	0	0	113
900	E	27.4	Very low	34.9	Very low	158 Å²	158	136.5 Å²	136.5	74%	0.738	75%	0.751	S	S	*	*			trans	-163.2	165.4	136.6	-105	-45.4	124.1	0	0	114.2
901	T	31.6	Very low	34.4	Very low	127 Å²	127	134.4 Å²	134.4	78%	0.779	75%	0.745	S	S	*	*			trans	-24.4	153.8	178.3	27.2	0	0	0	0	125.8
902	G	33.2	Very low	34	Very low	71 Å²	71	136.8 Å²	136.8	73%	0.732	75%	0.749	S	S	*	*				93.9	153.5	129.5	0	0	0	0	0	119.4
903	E	32.3	Very low	33.7	Very low	168 Å²	168	135.2 Å²	135.2	79%	0.785	74%	0.744	S	S	*	*			cis	172.4	153.1	-34.3	-112.5	-132.3	112.2	0	0	107.7
904	L	39.9	Very low	33.5	Very low	124 Å²	124	139.5 Å²	139.5	65%	0.649	76%	0.756	S	S	*	*			trans	74	127.4	147	-76.5	167.5	0	0	0	125.2
905	L	34.7	Very low	33.5	Very low	151 Å²	151	139.7 Å²	139.7	79%	0.791	75%	0.75	S	S	*	*			trans	77.8	152	148.4	-57.7	165.8	0	0	0	118.6
906	R	29.7	Very low	33.6	Very low	222 Å²	222	140.9 Å²	140.9	84%	0.838	75%	0.753	S	S	*	*			cis	-147.4	168	10.4	-149.5	-172	163	132.7	-1.3	114.1
907	S	28.8	Very low	34.5	Very low	80 Å²	80	141 Å²	141	56%	0.559	75%	0.751	S	S	*	*			trans	-51.2	146.8	172.9	58.8	0	0	0	0	115.7
908	V	33.7	Very low	35.1	Very low	133 Å²	133	137.9 Å²	137.9	81%	0.806	74%	0.742	S	S	*	*				58.7	125.6	62.6	-179.1	0	0	0	0	110.5
909	P	43.9	Very low	35.1	Very low	110 Å²	110	133.8 Å²	133.8	71%	0.714	74%	0.738	S	S	*	*				-135.4	-164.5	52.8	46.7	-29.3	0	0	0	113.5
910	S	34.6	Very low	34.4	Very low	106 Å²	106	134.7 Å²	134.7	74%	0.741	74%	0.742	S	S	*	*			cis	-161.3	172.3	21.2	-109.8	0	0	0	0	109.8
911	M	33.3	Very low	35.3	Very low	128 Å²	128	135.6 Å²	135.6	63%	0.631	75%	0.751	S	S	*	*			cis	-179.8	132.4	-29.3	-105	-56.8	-65	0	0	107.5	D913	M911-D913 VanDerWaalsContact CE-OD2 3.25Å; M911-D913 WeakPolarHBondContact CE-OD2 3.39Å
912	F	32.9	Very low	35.6	Very low	212 Å²	212	134.2 Å²	134.2	93%	0.93	74%	0.744	S	S	*	*			trans	175.2	129.3	142.9	-113.4	-81.7	0	0	0	111.5
913	D	33.7	Very low	35.8	Very low	87 Å²	87	140.2 Å²	140.2	47%	0.465	75%	0.753	S	S	.	*			trans	-91.2	178.2	-178.2	-59.3	-97.5	0	0	0	111.9	M911	M911-D913 VanDerWaalsContact CE-OD2 3.25Å; M911-D913 WeakPolarHBondContact CE-OD2 3.39Å
914	F	32.5	Very low	36	Very low	178 Å²	178	138.5 Å²	138.5	78%	0.781	75%	0.754	S	S	*	*			cis	-136.4	141.9	13.4	-77.9	-100.1	0	0	0	108.8
915	R	35.5	Very low	36.4	Very low	211 Å²	211	140.4 Å²	140.4	80%	0.796	76%	0.764	S	S	*	*				75.6	90.1	58.4	-168.6	-160.7	-74	-151.3	-1.9	114.8
916	A	33	Very low	36.8	Very low	96 Å²	96	141.4 Å²	141.4	79%	0.793	77%	0.769	S	S	*	*			trans	-143.7	152.1	148.2	0	0	0	0	0	109
917	P	44.6	Very low	37	Very low	120 Å²	120	142.5 Å²	142.5	78%	0.779	77%	0.773	S	S	*	*			trans	-123.3	-162	-142	50.2	-36.6	0	0	0	112.1
918	P	45.3	Very low	37.9	Very low	115 Å²	115	149 Å²	149	75%	0.747	79%	0.791	S	S	*	*			trans	-125.6	172.4	-130.5	27.4	-2	0	0	0	116
919	S	29.6	Very low	38.3	Very low	110 Å²	110	145.6 Å²	145.6	77%	0.769	78%	0.783	S	S	*	*			trans	-158	94.6	145	-5.4	0	0	0	0	111.5
920	T	31.8	Very low	38.7	Very low	122 Å²	122	150.4 Å²	150.4	75%	0.748	79%	0.793	S	S	*	*				20	106	122	54.5	0	0	0	0	117.1	P922	T920-P922 WeakPolarHBondContact O-CD 3.45Å
921	L	45.8	Very low	39.9	Very low	177 Å²	177	152 Å²	152	93%	0.927	79%	0.788	S	S	*	*			trans	-62.5	134.5	157.1	-62.6	168.6	0	0	0	110.1
922	P	38.1	Very low	42	Very low	98 Å²	98	154.1 Å²	154.1	64%	0.636	79%	0.789	S	S	*	*			trans	-112.6	112.4	159	3.7	19.1	0	0	0	110.8	T920 T924	T920-P922 WeakPolarHBondContact O-CD 3.45Å; P922-T924 PolarHBondContact O-N 3.3Å; P922-T924 PolarHBondContact O-OG1 3.23Å
923	E	39	Very low	44.6	Very low	197 Å²	197	148 Å²	148	92%	0.921	76%	0.761	S	S	*	*			trans	-1.6	82.7	139.2	-167.2	163.8	-149.9	0	0	116.8
924	T	34.9	Very low	47.1	Very low	132 Å²	132	147.7 Å²	147.7	81%	0.81	76%	0.762	S	S	*	*			trans	-113.4	11.7	172.5	40.9	0	0	0	0	113	P922 L926	P922-T924 PolarHBondContact O-N 3.3Å; P922-T924 PolarHBondContact O-OG1 3.23Å; T924-L926 VanDerWaalsContact C-N 3.33Å; T924-L926 PolarHBondContact O-N 3.08Å
925	L	48.5	Very low	49.8	Very low	163 Å²	163	139.3 Å²	139.3	85%	0.853	73%	0.726	S	S	*	*	S	Bend	trans	-88.1	57.7	170.8	-69.3	-178.3	0	0	0	112.3
926	L	44.2	Very low	52.2	Low	172 Å²	172	140.8 Å²	140.8	90%	0.901	73%	0.731	S	S	*	*			trans	173.4	95	149.3	-97.1	159.3	0	0	0	112	T924	T924-L926 VanDerWaalsContact C-N 3.33Å; T924-L926 PolarHBondContact O-N 3.08Å
927	R	34.3	Very low	54.3	Low	245 Å²	245	143.5 Å²	143.5	93%	0.925	72%	0.722	S	S	*	*	S	Bend	trans	-136.2	82.4	160.3	-151.4	165.8	-174.4	165.5	0.5	112	G929	R927-G929 PolarHBondContact O-N 3.47Å; R927-G929 VanDerWaalsContact O-N 3.13Å
928	K	47.2	Very low	56.2	Low	218 Å²	218	140.4 Å²	140.4	95%	0.948	70%	0.703	S	S	*	*	S	Bend	trans	44.8	48.1	157.5	-148.5	170.1	-174.8	176.5	0	117
929	G	42.3	Very low	58	Low	61 Å²	61	137.4 Å²	137.4	63%	0.629	69%	0.692	S	S	*	*			trans	-121	131.5	172	0	0	0	0	0	112	R927 E931	R927-G929 PolarHBondContact O-N 3.47Å; R927-G929 VanDerWaalsContact O-N 3.13Å; G929-E931 PolarHBondContact O-N 2.98Å
930	K	52.2	Low	60.7	Low	211 Å²	211	138 Å²	138	92%	0.917	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-48.4	124.1	-176.4	-166.1	161.5	-170.1	155.9	0	111.4	R932	K930-R932 PolarHBondContact O-N 3.21Å
931	E	58.8	Low	63.3	Low	139 Å²	139	136.6 Å²	136.6	65%	0.65	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-51.1	131.3	-160.8	-62.8	-176.1	144.5	0	0	113.7	G929 Y933	G929-E931 PolarHBondContact O-N 2.98Å; E931-Y933 WeakPolarHBondContact O-CD2 3.36Å; E931-Y933 VanDerWaalsContact O-CE2 3.25Å; E931-Y933 WeakPolarHBondContact O-CE2 3.48Å
932	R	78.6	Confident	65.3	Low	173 Å²	173	130.1 Å²	130.1	65%	0.653	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-97.4	116.2	177.8	-69.4	-170.6	-75	164.7	-5.3	109.4	K930 T934 I941	K930-R932 PolarHBondContact O-N 3.21Å; R932-T934 PolarHBondContact O-N 3.07Å; R932-I941 HydrophobicContact CB-CG2 3.63Å; R932-I941 HydrophobicContact CG-CG2 4.46Å
933	Y	86.7	Confident	67.4	Low	83 Å²	83	130.1 Å²	130.1	33%	0.325	63%	0.632	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.9	106.9	-170.2	-64.7	-85.6	0	0	0	111	E931 F942 R944	E931-Y933 WeakPolarHBondContact O-CD2 3.36Å; E931-Y933 VanDerWaalsContact O-CE2 3.25Å; E931-Y933 WeakPolarHBondContact O-CE2 3.48Å; Y933-F942 PolarHBondContact N-O 3.01Å; Y933-F942 PolarHBondContact O-N 3.4Å; Y933-R944 VanDerWaalsContact CD2-C 3.44Å
934	T	85.6	Confident	69.7	Low	81 Å²	81	129.2 Å²	129.2	50%	0.497	62%	0.62	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.8	142.2	-177.2	61.9	0	0	0	0	112.4	R932 I941 L948	R932-T934 PolarHBondContact O-N 3.07Å; T934-I941 HydrophobicContact CG2-CD1 4.39Å; T934-I941 HydrophobicContact CG2-CG1 4.05Å; T934-I941 HydrophobicContact CG2-CG2 4.3Å; T934-L948 WeakPolarHBondContact O-CD2 3.25Å
935	C	90.5	Very high	72.2	Confident	2 Å²	2	125.7 Å²	125.7	1%	0.014	60%	0.601	C	S	.	*			trans	-85.9	114.5	175.7	-176.1	0	0	0	0	111.3	Y937 C938 G939 K940 F942 L948 H951	C935-Y937 PolarHBondContact O-N 2.93Å; C935-C938 PolarHBondContact O-N 3.12Å; C935-G939 WeakPolarHBondContact O-CA 3.39Å; C935-G939 PolarHBondContact O-N 3.02Å; C935-K940 HydrophobicContact CB-CB 4.34Å; C935-K940 WeakPolarHBondContact CB-O 3.37Å; C935-K940 PolarHBondContact N-O 2.97Å; C935-F942 HydrophobicContact CB-CE2 4.17Å; C935-L948 HydrophobicContact CB-CD1 3.66Å; C935-H951 PolarHBondContact SG-CD2 2.73Å; C935-H951 PolarHBondContact SG-NE2 2.71Å; C935-H951 VanDerWaalsContact SG-NE2 3.41Å
936	R	85.2	Confident	73.9	Confident	242 Å²	242	120.9 Å²	120.9	91%	0.913	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-28.5	179.4	-70.3	-173.4	173.8	179.7	-2.6	113.9
937	Y	77.9	Confident	75.9	Confident	153 Å²	153	115 Å²	115	60%	0.6	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-19.8	-178.3	-63.2	-74.2	0	0	0	115.1	C935 L952 H955	C935-Y937 PolarHBondContact O-N 2.93Å; Y937-L952 HydrophobicContact CD2-CD2 3.75Å; Y937-L952 HydrophobicContact CE2-CD2 4.02Å; Y937-H955 HydrophobicContact CD2-CB 3.75Å; Y937-H955 AromaticContact CD2-CG 3.99Å; Y937-H955 HydrophobicContact CE2-CB 4.35Å; Y937-H955 HydrophobicContact CG-CB 3.86Å; Y937-H955 AromaticContact CG-CG 3.9Å
938	C	84.2	Confident	78.5	Confident	55 Å²	55	104.4 Å²	104.4	37%	0.372	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-156.7	25.7	180	75.8	0	0	0	0	115.4	C935 K940 H951 H955	C935-C938 PolarHBondContact O-N 3.12Å; C938-K940 PolarHBondContact O-N 3.26Å; C938-H951 PolarHBondContact SG-NE2 3.37Å; C938-H955 VanDerWaalsContact SG-CE1 3.54Å; C938-H955 PolarHBondContact SG-NE2 3.13Å; C938-H955 VanDerWaalsContact SG-NE2 3.37Å
939	G	82.8	Confident	80.3	Confident	51 Å²	51	97.3 Å²	97.3	53%	0.526	49%	0.491	S	S	.	.			trans	67.8	-17.7	175.2	0	0	0	0	0	117.2	C935 I941	C935-G939 WeakPolarHBondContact O-CA 3.39Å; C935-G939 PolarHBondContact O-N 3.02Å; G939-I941 WeakPolarHBondContact O-CG1 3.4Å; G939-I941 PolarHBondContact O-N 3.33Å
940	K	86.6	Confident	82.3	Confident	122 Å²	122	99.8 Å²	99.8	53%	0.53	48%	0.482	S	S	.	.			trans	-54.3	125.7	-172	-72.3	176.8	-172.4	169.5	0	111.9	C935 C938 F942	C935-K940 HydrophobicContact CB-CB 4.34Å; C935-K940 WeakPolarHBondContact CB-O 3.37Å; C935-K940 PolarHBondContact N-O 2.97Å; C938-K940 PolarHBondContact O-N 3.26Å; K940-F942 HydrophobicContact CB-CE2 3.6Å; K940-F942 HydrophobicContact CB-CZ 3.85Å; K940-F942 VanDerWaalsContact O-CD2 3.27Å; K940-F942 WeakPolarHBondContact O-CD2 3.35Å; K940-F942 WeakPolarHBondContact O-CE2 3.44Å
941	I	85.6	Confident	83.9	Confident	94 Å²	94	91 Å²	91	48%	0.482	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	125.8	-173.8	-49.1	-170.4	0	0	0	109.8	R932 T934 G939	R932-I941 HydrophobicContact CB-CG2 3.63Å; R932-I941 HydrophobicContact CG-CG2 4.46Å; T934-I941 HydrophobicContact CG2-CD1 4.39Å; T934-I941 HydrophobicContact CG2-CG1 4.05Å; T934-I941 HydrophobicContact CG2-CG2 4.3Å; G939-I941 WeakPolarHBondContact O-CG1 3.4Å; G939-I941 PolarHBondContact O-N 3.33Å
942	F	89.1	Confident	85.1	Confident	40 Å²	40	86.8 Å²	86.8	18%	0.175	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	135.6	-178.3	-63.4	-86.4	0	0	0	111.6	Y933 C935 K940 R944 N947 L948 H951	Y933-F942 PolarHBondContact N-O 3.01Å; Y933-F942 PolarHBondContact O-N 3.4Å; C935-F942 HydrophobicContact CB-CE2 4.17Å; K940-F942 HydrophobicContact CB-CE2 3.6Å; K940-F942 HydrophobicContact CB-CZ 3.85Å; K940-F942 VanDerWaalsContact O-CD2 3.27Å; K940-F942 WeakPolarHBondContact O-CD2 3.35Å; K940-F942 WeakPolarHBondContact O-CE2 3.44Å; F942-R944 PolarHBondContact O-N 3.25Å; F942-R944 VanDerWaalsContact O-N 3.16Å; F942-N947 HydrophobicContact CB-CB 4.08Å; F942-N947 HydrophobicContact CD1-CB 3.81Å; F942-N947 HydrophobicContact CG-CB 4.24Å; F942-L948 HydrophobicContact CB-CB 4.2Å; F942-L948 HydrophobicContact CD2-CB 4.05Å; F942-L948 HydrophobicContact CD2-CD1 4.01Å; F942-L948 HydrophobicContact CE2-CD1 4.32Å; F942-L948 HydrophobicContact CG-CB 4.31Å; F942-H951 HydrophobicContact CE1-CB 4.12Å; F942-H951 HydrophobicContact CE2-CB 3.98Å; F942-H951 AromaticContact CE2-CD2 3.24Å; F942-H951 WeakPolarHBondContact CE2-CD2 3.43Å; F942-H951 AromaticContact CE2-CG 3.78Å; F942-H951 HydrophobicContact CZ-CB 3.59Å; F942-H951 AromaticContact CZ-CD2 3.3Å; F942-H951 WeakPolarHBondContact CZ-CD2 3.32Å; F942-H951 AromaticContact CZ-CG 3.41Å; F942-H951 VanDerWaalsContact CZ-CG 3.41Å
943	P	82.1	Confident	85.3	Confident	98 Å²	98	81.6 Å²	81.6	64%	0.636	41%	0.406	S	S	*	.	S	Bend	trans	-76.1	2.2	-179.4	32.1	-37.1	0	0	0	114
944	R	85.7	Confident	84.8	Confident	178 Å²	178	81.8 Å²	81.8	67%	0.672	42%	0.416	S	S	*	.	S	Bend	trans	-152.4	138.5	179.4	-61.5	-175.1	-176	167.6	0.6	110.1	Y933 F942 A946 N947 L948	Y933-R944 VanDerWaalsContact CD2-C 3.44Å; F942-R944 PolarHBondContact O-N 3.25Å; F942-R944 VanDerWaalsContact O-N 3.16Å; R944-A946 VanDerWaalsContact C-N 3.33Å; R944-A946 PolarHBondContact O-N 2.68Å; R944-N947 WeakPolarHBondContact O-CB 3.41Å; R944-N947 PolarHBondContact O-N 3.39Å; R944-L948 PolarHBondContact O-N 3.05Å
945	S	87.5	Confident	84.4	Confident	59 Å²	59	81.3 Å²	81.3	41%	0.413	41%	0.408	S	S	.	.	H	α-helix	trans	-51.8	-47.6	176.1	52.4	0	0	0	0	112.5	N947 L948 T949	S945-N947 PolarHBondContact O-N 3.46Å; S945-L948 CarbonylContact O-C 3.49Å; S945-L948 WeakPolarHBondContact O-CA 3.42Å; S945-L948 WeakPolarHBondContact O-CB 3.45Å; S945-L948 PolarHBondContact O-N 2.68Å; S945-T949 PolarHBondContact O-N 2.61Å; S945-T949 PolarHBondContact O-OG1 2.96Å; S945-T949 VanDerWaalsContact O-OG1 3.11Å
946	A	84.5	Confident	83.7	Confident	62 Å²	62	84.2 Å²	84.2	51%	0.512	43%	0.426	S	S	.	.	H	α-helix	trans	-60.5	-18.8	178.4	0	0	0	0	0	115	R944 R950	R944-A946 VanDerWaalsContact C-N 3.33Å; R944-A946 PolarHBondContact O-N 2.68Å; A946-R950 VanDerWaalsContact O-CB 3.31Å; A946-R950 WeakPolarHBondContact O-CB 3.41Å
947	N	86.3	Confident	83.3	Confident	49 Å²	49	75 Å²	75	26%	0.262	41%	0.406	S	S	.	.	H	α-helix	trans	-86.6	-35.8	171.2	-71.1	-15.6	0	0	0	111.5	F942 R944 S945 H951	F942-N947 HydrophobicContact CB-CB 4.08Å; F942-N947 HydrophobicContact CD1-CB 3.81Å; F942-N947 HydrophobicContact CG-CB 4.24Å; R944-N947 WeakPolarHBondContact O-CB 3.41Å; R944-N947 PolarHBondContact O-N 3.39Å; S945-N947 PolarHBondContact O-N 3.46Å; N947-H951 WeakPolarHBondContact O-CB 3.36Å; N947-H951 PolarHBondContact O-N 3.2Å; N947-H951 VanDerWaalsContact O-N 3.16Å
948	L	89.1	Confident	83.2	Confident	22 Å²	22	73 Å²	73	12%	0.115	40%	0.402	C	S	.	.	H	α-helix	trans	-62.5	-53.4	169.1	172.1	61	0	0	0	111	T934 C935 F942 R944 S945 R950 H951 L952	T934-L948 WeakPolarHBondContact O-CD2 3.25Å; C935-L948 HydrophobicContact CB-CD1 3.66Å; F942-L948 HydrophobicContact CB-CB 4.2Å; F942-L948 HydrophobicContact CD2-CB 4.05Å; F942-L948 HydrophobicContact CD2-CD1 4.01Å; F942-L948 HydrophobicContact CE2-CD1 4.32Å; F942-L948 HydrophobicContact CG-CB 4.31Å; R944-L948 PolarHBondContact O-N 3.05Å; S945-L948 CarbonylContact O-C 3.49Å; S945-L948 WeakPolarHBondContact O-CA 3.42Å; S945-L948 WeakPolarHBondContact O-CB 3.45Å; S945-L948 PolarHBondContact O-N 2.68Å; L948-R950 PolarHBondContact O-N 3.21Å; L948-H951 CarbonylContact O-C 3.48Å; L948-H951 WeakPolarHBondContact O-CA 3.31Å; L948-H951 WeakPolarHBondContact O-CB 3.2Å; L948-H951 PolarHBondContact O-N 2.62Å; L948-L952 HydrophobicContact CD1-CD1 4.18Å; L948-L952 HydrophobicContact CD1-CD2 3.99Å; L948-L952 HydrophobicContact CD1-CG 3.81Å; L948-L952 HydrophobicContact CD2-CD1 4.47Å; L948-L952 HydrophobicContact CG-CD1 3.98Å; L948-L952 HydrophobicContact CG-CG 4.1Å; L948-L952 WeakPolarHBondContact O-CG 3.4Å; L948-L952 PolarHBondContact O-N 2.85Å
949	T	84.9	Confident	82.9	Confident	69 Å²	69	75.4 Å²	75.4	42%	0.423	41%	0.408	S	S	.	.	H	α-helix	trans	-56.6	-39.4	-178.7	-46.2	0	0	0	0	112.1	S945 H951 L952 R953	S945-T949 PolarHBondContact O-N 2.61Å; S945-T949 PolarHBondContact O-OG1 2.96Å; S945-T949 VanDerWaalsContact O-OG1 3.11Å; T949-H951 VanDerWaalsContact C-N 3.31Å; T949-H951 PolarHBondContact O-N 3.38Å; T949-L952 PolarHBondContact O-N 3.05Å; T949-R953 PolarHBondContact O-N 3.08Å
950	R	85.4	Confident	82.8	Confident	113 Å²	113	76.9 Å²	76.9	43%	0.426	41%	0.408	S	S	.	.	H	α-helix	trans	-61.1	-37.5	173	177.9	-167.2	-54.6	-163.2	3.9	112.8	A946 L948 I972	A946-R950 VanDerWaalsContact O-CB 3.31Å; A946-R950 WeakPolarHBondContact O-CB 3.41Å; L948-R950 PolarHBondContact O-N 3.21Å; R950-I972 HydrophobicContact CG-CD1 3.62Å; R950-I972 HydrophobicContact CG-CG1 3.96Å
951	H	85.2	Confident	82.6	Confident	25 Å²	25	75 Å²	75	12%	0.116	40%	0.398	C	S	.	.	H	α-helix	trans	-82.6	-29.1	179.1	174.3	51.2	0	0	0	113.1	C935 C938 F942 N947 L948 T949 R953 T954 H955	C935-H951 PolarHBondContact SG-CD2 2.73Å; C935-H951 PolarHBondContact SG-NE2 2.71Å; C935-H951 VanDerWaalsContact SG-NE2 3.41Å; C938-H951 PolarHBondContact SG-NE2 3.37Å; F942-H951 HydrophobicContact CE1-CB 4.12Å; F942-H951 HydrophobicContact CE2-CB 3.98Å; F942-H951 AromaticContact CE2-CD2 3.24Å; F942-H951 WeakPolarHBondContact CE2-CD2 3.43Å; F942-H951 AromaticContact CE2-CG 3.78Å; F942-H951 HydrophobicContact CZ-CB 3.59Å; F942-H951 AromaticContact CZ-CD2 3.3Å; F942-H951 WeakPolarHBondContact CZ-CD2 3.32Å; F942-H951 AromaticContact CZ-CG 3.41Å; F942-H951 VanDerWaalsContact CZ-CG 3.41Å; N947-H951 WeakPolarHBondContact O-CB 3.36Å; N947-H951 PolarHBondContact O-N 3.2Å; N947-H951 VanDerWaalsContact O-N 3.16Å; L948-H951 CarbonylContact O-C 3.48Å; L948-H951 WeakPolarHBondContact O-CA 3.31Å; L948-H951 WeakPolarHBondContact O-CB 3.2Å; L948-H951 PolarHBondContact O-N 2.62Å; T949-H951 VanDerWaalsContact C-N 3.31Å; T949-H951 PolarHBondContact O-N 3.38Å; H951-R953 PolarHBondContact O-N 2.9Å; H951-T954 PolarHBondContact CE1-OG1 3.04Å; H951-T954 PolarHBondContact ND1-OG1 3.24Å; H951-T954 PolarHBondContact O-N 2.85Å; H951-T954 PolarHBondContact O-OG1 3.12Å; H951-H955 AromaticContact CD2-NE2 3.95Å; H951-H955 AromaticContact CE1-CD2 3.8Å; H951-H955 AromaticContact CE1-NE2 3.12Å; H951-H955 PolarHBondContact CE1-NE2 3.23Å; H951-H955 AromaticContact NE2-CD2 3.76Å; H951-H955 AromaticContact NE2-NE2 3.03Å; H951-H955 PolarHBondContact NE2-NE2 3.43Å; H951-H955 PolarHBondContact O-CD2 2.85Å
952	L	83.3	Confident	82.4	Confident	51 Å²	51	77.9 Å²	77.9	27%	0.267	40%	0.403	S	S	.	.	H	α-helix	trans	-58.7	-34.4	171.3	-68.5	173.8	0	0	0	111.1	Y937 L948 T949 T954 H955 T956	Y937-L952 HydrophobicContact CD2-CD2 3.75Å; Y937-L952 HydrophobicContact CE2-CD2 4.02Å; L948-L952 HydrophobicContact CD1-CD1 4.18Å; L948-L952 HydrophobicContact CD1-CD2 3.99Å; L948-L952 HydrophobicContact CD1-CG 3.81Å; L948-L952 HydrophobicContact CD2-CD1 4.47Å; L948-L952 HydrophobicContact CG-CD1 3.98Å; L948-L952 HydrophobicContact CG-CG 4.1Å; L948-L952 WeakPolarHBondContact O-CG 3.4Å; L948-L952 PolarHBondContact O-N 2.85Å; T949-L952 PolarHBondContact O-N 3.05Å; L952-T954 PolarHBondContact O-N 3.46Å; L952-H955 WeakPolarHBondContact O-CA 3.48Å; L952-H955 WeakPolarHBondContact O-CB 3.47Å; L952-H955 PolarHBondContact O-N 3.12Å; L952-T956 PolarHBondContact O-N 3.2Å; L952-T956 PolarHBondContact O-OG1 3.19Å
953	R	82.8	Confident	82.3	Confident	64 Å²	64	76.4 Å²	76.4	24%	0.242	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-12.1	170.9	-63	-178.3	-164.1	137.5	7.8	115.6	T949 H951 H955 T956 E958 S971	T949-R953 PolarHBondContact O-N 3.08Å; H951-R953 PolarHBondContact O-N 2.9Å; R953-H955 VanDerWaalsContact C-N 3.32Å; R953-T956 WeakPolarHBondContact CA-OG1 3.11Å; R953-E958 HydrophobicContact CG-CB 4.37Å; R953-S971 WeakPolarHBondContact CD-O 3.16Å; R953-S971 PolarHBondContact NH1-O 3.31Å
954	T	77.4	Confident	82.2	Confident	87 Å²	87	80.8 Å²	80.8	53%	0.534	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-5.5	168.5	69.9	0	0	0	0	112.7	H951 L952	H951-T954 PolarHBondContact CE1-OG1 3.04Å; H951-T954 PolarHBondContact ND1-OG1 3.24Å; H951-T954 PolarHBondContact O-N 2.85Å; H951-T954 PolarHBondContact O-OG1 3.12Å; L952-T954 PolarHBondContact O-N 3.46Å
955	H	76.2	Confident	81.8	Confident	71 Å²	71	79.6 Å²	79.6	33%	0.329	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-41.2	173.7	-63.3	-74.1	0	0	0	111.9	Y937 C938 H951 L952 R953 G957	Y937-H955 HydrophobicContact CD2-CB 3.75Å; Y937-H955 AromaticContact CD2-CG 3.99Å; Y937-H955 HydrophobicContact CE2-CB 4.35Å; Y937-H955 HydrophobicContact CG-CB 3.86Å; Y937-H955 AromaticContact CG-CG 3.9Å; C938-H955 VanDerWaalsContact SG-CE1 3.54Å; C938-H955 PolarHBondContact SG-NE2 3.13Å; C938-H955 VanDerWaalsContact SG-NE2 3.37Å; H951-H955 AromaticContact CD2-NE2 3.95Å; H951-H955 AromaticContact CE1-CD2 3.8Å; H951-H955 AromaticContact CE1-NE2 3.12Å; H951-H955 PolarHBondContact CE1-NE2 3.23Å; H951-H955 AromaticContact NE2-CD2 3.76Å; H951-H955 AromaticContact NE2-NE2 3.03Å; H951-H955 PolarHBondContact NE2-NE2 3.43Å; H951-H955 PolarHBondContact O-CD2 2.85Å; L952-H955 WeakPolarHBondContact O-CA 3.48Å; L952-H955 WeakPolarHBondContact O-CB 3.47Å; L952-H955 PolarHBondContact O-N 3.12Å; R953-H955 VanDerWaalsContact C-N 3.32Å; H955-G957 PolarHBondContact O-N 2.75Å
956	T	76.7	Confident	81.6	Confident	64 Å²	64	78.6 Å²	78.6	39%	0.393	40%	0.396	S	S	.	.	S	Bend	trans	-74.8	-10.2	175.4	59.2	0	0	0	0	113.5	L952 R953 E958	L952-T956 PolarHBondContact O-N 3.2Å; L952-T956 PolarHBondContact O-OG1 3.19Å; R953-T956 WeakPolarHBondContact CA-OG1 3.11Å; T956-E958 PolarHBondContact O-N 3.36Å; T956-E958 VanDerWaalsContact O-N 3.09Å; T956-E958 VanDerWaalsContact OG1-CD 3.27Å; T956-E958 WeakPolarHBondContact OG1-CG 3.32Å; T956-E958 PolarHBondContact OG1-OE2 3.04Å
957	G	75.2	Confident	81.3	Confident	49 Å²	49	81.3 Å²	81.3	51%	0.505	40%	0.401	S	S	.	.			trans	69.5	-2.6	-175.2	0	0	0	0	0	114.6	H955 Q959	H955-G957 PolarHBondContact O-N 2.75Å; G957-Q959 PolarHBondContact O-N 3.19Å
958	E	76.2	Confident	81	Confident	109 Å²	109	86.7 Å²	86.7	51%	0.509	42%	0.418	S	S	.	.			trans	-62.3	125.1	-174.4	-69	167.4	146.8	0	0	112.4	R953 T956 P960 S971	R953-E958 HydrophobicContact CG-CB 4.37Å; T956-E958 PolarHBondContact O-N 3.36Å; T956-E958 VanDerWaalsContact O-N 3.09Å; T956-E958 VanDerWaalsContact OG1-CD 3.27Å; T956-E958 WeakPolarHBondContact OG1-CG 3.32Å; T956-E958 PolarHBondContact OG1-OE2 3.04Å; E958-P960 WeakPolarHBondContact O-CD 3.49Å; E958-S971 WeakPolarHBondContact O-CB 3.45Å
959	Q	78	Confident	80.7	Confident	107 Å²	107	87 Å²	87	50%	0.5	42%	0.422	S	S	.	.			trans	-123.7	74.9	177.7	-68.3	177	15.4	0	0	110.4	G957 Y961 S969 F970	G957-Q959 PolarHBondContact O-N 3.19Å; Q959-Y961 PolarHBondContact O-N 2.75Å; Q959-S969 PolarHBondContact OE1-O 2.98Å; Q959-F970 CarbonylContact C-O 3.59Å; Q959-F970 VanDerWaalsContact C-O 3.27Å; Q959-F970 WeakPolarHBondContact CA-O 2.98Å
960	P	80.7	Confident	80.6	Confident	81 Å²	81	85.8 Å²	85.8	53%	0.526	41%	0.411	S	S	.	.			trans	-63.4	-15.9	-173.1	-22.3	34.4	0	0	0	114.6	E958	E958-P960 WeakPolarHBondContact O-CD 3.49Å
961	Y	82.9	Confident	80.4	Confident	84 Å²	84	81.6 Å²	81.6	33%	0.329	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	74.7	-174.5	-54.4	-80.1	0	0	0	110.2	Q959 F970 I972	Q959-Y961 PolarHBondContact O-N 2.75Å; Y961-F970 WeakPolarHBondContact CB-O 3.16Å; Y961-F970 WeakPolarHBondContact CD2-O 3.32Å; Y961-F970 PolarHBondContact N-O 3.33Å; Y961-F970 PolarHBondContact O-N 3.14Å; Y961-I972 VanDerWaalsContact CD2-C 3.5Å
962	R	82.3	Confident	80.4	Confident	154 Å²	154	81.9 Å²	81.9	58%	0.581	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	140.5	170.4	-172.7	163.5	-179	175.9	-0.3	110.8	D967 S969 L976	R962-D967 IonicContact CZ-OD1 2.77Å; R962-D967 IonicContact NE-OD1 3.05Å; R962-D967 IonicContact NH2-OD1 3.16Å; R962-D967 PolarHBondContact NH2-OD1 3.5Å; R962-S969 WeakPolarHBondContact CA-OG 3.49Å; R962-S969 WeakPolarHBondContact CB-OG 3.36Å; R962-S969 WeakPolarHBondContact CG-OG 3.26Å; R962-L976 WeakPolarHBondContact O-CD2 3.44Å
963	C	86.3	Confident	80.4	Confident	8 Å²	8	81.9 Å²	81.9	5%	0.054	41%	0.406	C	S	.	.			trans	-73.3	142	173.4	-173	0	0	0	0	111.2	Y965 C966 R968 L976 H979	C963-Y965 PolarHBondContact O-N 2.73Å; C963-Y965 PolarHBondContact SG-N 3.48Å; C963-Y965 VanDerWaalsContact SG-N 3.41Å; C963-C966 WeakPolarHBondContact CB-O 3.27Å; C963-C966 VanDerWaalsContact O-O 3.07Å; C963-R968 WeakPolarHBondContact CB-O 3.43Å; C963-R968 PolarHBondContact N-O 3.03Å; C963-L976 VanDerWaalsContact CA-CD1 3.48Å; C963-L976 HydrophobicContact CB-CD1 3.55Å; C963-H979 WeakPolarHBondContact CB-NE2 3.4Å; C963-H979 VanDerWaalsContact SG-CD2 3.52Å; C963-H979 PolarHBondContact SG-NE2 3.47Å
964	K	79	Confident	80.5	Confident	191 Å²	191	81.9 Å²	81.9	83%	0.83	42%	0.415	S	S	*	.	S	Bend	trans	-74.5	-12.9	175	-68	-167.7	174.6	-170.1	0	113.2
965	Y	77.5	Confident	80.8	Confident	152 Å²	152	79.9 Å²	79.9	60%	0.596	40%	0.401	S	S	*	.	S	Bend	trans	-122	-5.1	-169.1	-53	-62.8	0	0	0	114	C963 I980 H984	C963-Y965 PolarHBondContact O-N 2.73Å; C963-Y965 PolarHBondContact SG-N 3.48Å; C963-Y965 VanDerWaalsContact SG-N 3.41Å; Y965-I980 HydrophobicContact CD2-CG1 4.44Å; Y965-I980 HydrophobicContact CD2-CG2 4.19Å; Y965-I980 HydrophobicContact CE2-CG2 3.92Å; Y965-H984 VanDerWaalsContact C-CE1 3.44Å; Y965-H984 VanDerWaalsContact CB-CG 3.43Å; Y965-H984 VanDerWaalsContact CB-ND1 3.26Å; Y965-H984 WeakPolarHBondContact CB-ND1 3.5Å; Y965-H984 HydrophobicContact CD2-CB 3.81Å; Y965-H984 AromaticContact CD2-CG 3.97Å; Y965-H984 HydrophobicContact CG-CB 4.18Å; Y965-H984 PolarHBondContact O-CE1 2.91Å
966	C	84.8	Confident	81.4	Confident	38 Å²	38	77.7 Å²	77.7	26%	0.257	39%	0.392	S	S	.	.	S	Bend	trans	-162.1	169.5	163	70.6	0	0	0	0	110.1	C963 R968 H979 H984	C963-C966 WeakPolarHBondContact CB-O 3.27Å; C963-C966 VanDerWaalsContact O-O 3.07Å; C966-R968 PolarHBondContact O-N 3.07Å; C966-R968 VanDerWaalsContact O-N 3.09Å; C966-H979 PolarHBondContact SG-CE1 3.43Å; C966-H979 PolarHBondContact SG-NE2 2.89Å; C966-H984 PolarHBondContact SG-NE2 2.76Å
967	D	77.8	Confident	81.7	Confident	119 Å²	119	80.4 Å²	80.4	64%	0.636	40%	0.4	S	S	*	.	S	Bend	trans	-73.9	-0.2	-173.6	-56.7	-72.3	0	0	0	115.6	R962 S969	R962-D967 IonicContact CZ-OD1 2.77Å; R962-D967 IonicContact NE-OD1 3.05Å; R962-D967 IonicContact NH2-OD1 3.16Å; R962-D967 PolarHBondContact NH2-OD1 3.5Å; D967-S969 PolarHBondContact O-N 3.31Å; D967-S969 PolarHBondContact O-OG 3.1Å
968	R	79.9	Confident	82.1	Confident	162 Å²	162	82.7 Å²	82.7	61%	0.611	39%	0.394	S	S	*	.			trans	-66.3	122.9	175.9	-73.3	-177.3	166.3	146.7	-1.4	110.7	C963 C966 F970	C963-R968 WeakPolarHBondContact CB-O 3.43Å; C963-R968 PolarHBondContact N-O 3.03Å; C966-R968 PolarHBondContact O-N 3.07Å; C966-R968 VanDerWaalsContact O-N 3.09Å; R968-F970 HydrophobicContact CB-CE2 4.03Å; R968-F970 HydrophobicContact CB-CZ 4.05Å
969	S	82.6	Confident	82.4	Confident	29 Å²	29	78.1 Å²	78.1	20%	0.203	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	159.7	175.9	-55	0	0	0	0	110.8	Q959 R962 D967	Q959-S969 PolarHBondContact OE1-O 2.98Å; R962-S969 WeakPolarHBondContact CA-OG 3.49Å; R962-S969 WeakPolarHBondContact CB-OG 3.36Å; R962-S969 WeakPolarHBondContact CG-OG 3.26Å; D967-S969 PolarHBondContact O-N 3.31Å; D967-S969 PolarHBondContact O-OG 3.1Å
970	F	83.4	Confident	82.7	Confident	44 Å²	44	75.1 Å²	75.1	19%	0.193	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	146.3	-176.5	-58.2	-87.5	0	0	0	110.9	Q959 Y961 R968 I972 N975 L976 H979	Q959-F970 CarbonylContact C-O 3.59Å; Q959-F970 VanDerWaalsContact C-O 3.27Å; Q959-F970 WeakPolarHBondContact CA-O 2.98Å; Y961-F970 WeakPolarHBondContact CB-O 3.16Å; Y961-F970 WeakPolarHBondContact CD2-O 3.32Å; Y961-F970 PolarHBondContact N-O 3.33Å; Y961-F970 PolarHBondContact O-N 3.14Å; R968-F970 HydrophobicContact CB-CE2 4.03Å; R968-F970 HydrophobicContact CB-CZ 4.05Å; F970-I972 PolarHBondContact O-N 3.23Å; F970-N975 HydrophobicContact CB-CB 4.15Å; F970-N975 HydrophobicContact CD1-CB 3.83Å; F970-N975 HydrophobicContact CG-CB 4.17Å; F970-L976 HydrophobicContact CB-CB 4.32Å; F970-L976 HydrophobicContact CD2-CB 3.81Å; F970-L976 HydrophobicContact CD2-CD1 3.78Å; F970-L976 HydrophobicContact CD2-CG 4.41Å; F970-L976 HydrophobicContact CE2-CD1 3.97Å; F970-L976 HydrophobicContact CG-CB 4.3Å; F970-H979 HydrophobicContact CE1-CB 4.2Å; F970-H979 HydrophobicContact CE2-CB 3.72Å; F970-H979 AromaticContact CE2-CD2 3.47Å; F970-H979 VanDerWaalsContact CE2-CD2 3.47Å; F970-H979 WeakPolarHBondContact CE2-CD2 3.12Å; F970-H979 AromaticContact CE2-CG 3.51Å; F970-H979 HydrophobicContact CZ-CB 3.45Å; F970-H979 VanDerWaalsContact CZ-CB 3.45Å; F970-H979 AromaticContact CZ-CD2 3.83Å; F970-H979 AromaticContact CZ-CG 3.37Å; F970-H979 AromaticContact CZ-ND1 3.78Å
971	S	79.8	Confident	82.7	Confident	24 Å²	24	77.2 Å²	77.2	17%	0.168	36%	0.357	C	S	.	.	S	Bend	trans	-77.9	-4.6	174.4	54	0	0	0	0	113.8	R953 E958	R953-S971 WeakPolarHBondContact CD-O 3.16Å; R953-S971 PolarHBondContact NH1-O 3.31Å; E958-S971 WeakPolarHBondContact O-CB 3.45Å
972	I	84.9	Confident	82.2	Confident	32 Å²	32	74.9 Å²	74.9	16%	0.164	35%	0.349	C	S	.	.	S	Bend	trans	-142.9	130.3	-175.8	-40.3	178.6	0	0	0	110.6	R950 Y961 F970 S974 N975 L976	R950-I972 HydrophobicContact CG-CD1 3.62Å; R950-I972 HydrophobicContact CG-CG1 3.96Å; Y961-I972 VanDerWaalsContact CD2-C 3.5Å; F970-I972 PolarHBondContact O-N 3.23Å; I972-S974 VanDerWaalsContact C-N 3.33Å; I972-S974 WeakPolarHBondContact CG2-OG 3.18Å; I972-S974 PolarHBondContact O-N 2.59Å; I972-N975 HydrophobicContact CB-CB 4.43Å; I972-N975 WeakPolarHBondContact O-CB 3.27Å; I972-N975 PolarHBondContact O-N 2.93Å; I972-N975 VanDerWaalsContact O-N 3.12Å; I972-L976 PolarHBondContact O-N 3.07Å
973	S	84.5	Confident	81.8	Confident	51 Å²	51	71.7 Å²	71.7	36%	0.357	34%	0.343	S	S	.	.	H	α-helix	trans	-56.1	-39.4	177.1	51.8	0	0	0	0	114.2	N975 L976 Q977	S973-N975 VanDerWaalsContact C-N 3.3Å; S973-N975 PolarHBondContact O-N 2.73Å; S973-L976 WeakPolarHBondContact O-CB 3.47Å; S973-L976 PolarHBondContact O-N 3.15Å; S973-L976 VanDerWaalsContact O-N 3.15Å; S973-Q977 WeakPolarHBondContact O-CG 3.29Å; S973-Q977 PolarHBondContact O-N 3.44Å
974	S	83.5	Confident	81.3	Confident	64 Å²	64	74 Å²	74	45%	0.448	35%	0.353	S	S	.	.	H	α-helix	trans	-68.8	-26.7	178.8	59.8	0	0	0	0	113.5	I972 R978	I972-S974 VanDerWaalsContact C-N 3.33Å; I972-S974 WeakPolarHBondContact CG2-OG 3.18Å; I972-S974 PolarHBondContact O-N 2.59Å; S974-R978 WeakPolarHBondContact O-CB 3.37Å; S974-R978 PolarHBondContact O-N 3.24Å; S974-R978 VanDerWaalsContact O-N 3.13Å
975	N	85.1	Confident	80.9	Confident	45 Å²	45	69 Å²	69	24%	0.241	34%	0.336	C	S	.	.	H	α-helix	trans	-71.6	-41.7	169.4	-81.3	-23.2	0	0	0	110.8	F970 I972 S973 R978 H979	F970-N975 HydrophobicContact CB-CB 4.15Å; F970-N975 HydrophobicContact CD1-CB 3.83Å; F970-N975 HydrophobicContact CG-CB 4.17Å; I972-N975 HydrophobicContact CB-CB 4.43Å; I972-N975 WeakPolarHBondContact O-CB 3.27Å; I972-N975 PolarHBondContact O-N 2.93Å; I972-N975 VanDerWaalsContact O-N 3.12Å; S973-N975 VanDerWaalsContact C-N 3.3Å; S973-N975 PolarHBondContact O-N 2.73Å; N975-R978 PolarHBondContact O-N 3.29Å; N975-R978 PolarHBondContact OD1-NH2 3.17Å; N975-H979 WeakPolarHBondContact O-CB 3.4Å; N975-H979 PolarHBondContact O-N 3.28Å
976	L	87.6	Confident	80	Confident	24 Å²	24	70.3 Å²	70.3	13%	0.126	34%	0.344	C	S	.	.	H	α-helix	trans	-61	-49.2	173.9	173.6	61.8	0	0	0	111.8	R962 C963 F970 I972 S973 R978 H979 I980	R962-L976 WeakPolarHBondContact O-CD2 3.44Å; C963-L976 VanDerWaalsContact CA-CD1 3.48Å; C963-L976 HydrophobicContact CB-CD1 3.55Å; F970-L976 HydrophobicContact CB-CB 4.32Å; F970-L976 HydrophobicContact CD2-CB 3.81Å; F970-L976 HydrophobicContact CD2-CD1 3.78Å; F970-L976 HydrophobicContact CD2-CG 4.41Å; F970-L976 HydrophobicContact CE2-CD1 3.97Å; F970-L976 HydrophobicContact CG-CB 4.3Å; I972-L976 PolarHBondContact O-N 3.07Å; S973-L976 WeakPolarHBondContact O-CB 3.47Å; S973-L976 PolarHBondContact O-N 3.15Å; S973-L976 VanDerWaalsContact O-N 3.15Å; L976-R978 VanDerWaalsContact C-N 3.31Å; L976-R978 PolarHBondContact O-N 3.41Å; L976-H979 CarbonylContact O-C 3.53Å; L976-H979 WeakPolarHBondContact O-CA 3.3Å; L976-H979 WeakPolarHBondContact O-CB 3.24Å; L976-H979 PolarHBondContact O-N 3.41Å; L976-I980 HydrophobicContact CD1-CD1 3.8Å; L976-I980 HydrophobicContact CD1-CG1 3.88Å; L976-I980 HydrophobicContact CD2-CD1 4.3Å; L976-I980 HydrophobicContact CG-CD1 3.79Å; L976-I980 HydrophobicContact CG-CG1 4.3Å; L976-I980 WeakPolarHBondContact O-CG1 3.13Å; L976-I980 PolarHBondContact O-N 3.38Å
977	Q	83.7	Confident	78.6	Confident	121 Å²	121	73.9 Å²	73.9	57%	0.565	36%	0.357	S	S	*	.	H	α-helix	trans	-58.9	-41.7	178.4	-74.7	177.7	-24.8	0	0	112.2	S973 R981	S973-Q977 WeakPolarHBondContact O-CG 3.29Å; S973-Q977 PolarHBondContact O-N 3.44Å; Q977-R981 WeakPolarHBondContact O-CB 3.4Å; Q977-R981 PolarHBondContact O-N 3.39Å
978	R	82.9	Confident	77.7	Confident	98 Å²	98	72.7 Å²	72.7	37%	0.37	35%	0.346	S	S	.	.	H	α-helix	trans	-63	-41.5	173.3	174.9	168.8	57.5	146.4	-2.8	111.8	S974 N975 L976 N982	S974-R978 WeakPolarHBondContact O-CB 3.37Å; S974-R978 PolarHBondContact O-N 3.24Å; S974-R978 VanDerWaalsContact O-N 3.13Å; N975-R978 PolarHBondContact O-N 3.29Å; N975-R978 PolarHBondContact OD1-NH2 3.17Å; L976-R978 VanDerWaalsContact C-N 3.31Å; L976-R978 PolarHBondContact O-N 3.41Å; R978-N982 WeakPolarHBondContact O-CB 3.33Å; R978-N982 PolarHBondContact O-N 3.13Å; R978-N982 PolarHBondContact O-OD1 2.99Å
979	H	83.8	Confident	77.1	Confident	12 Å²	12	68.8 Å²	68.8	6%	0.056	34%	0.342	C	S	.	.	H	α-helix	trans	-64.7	-48.3	176.6	160.1	77.1	0	0	0	111.9	C963 C966 F970 N975 L976 R981 N982 I983 H984	C963-H979 WeakPolarHBondContact CB-NE2 3.4Å; C963-H979 VanDerWaalsContact SG-CD2 3.52Å; C963-H979 PolarHBondContact SG-NE2 3.47Å; C966-H979 PolarHBondContact SG-CE1 3.43Å; C966-H979 PolarHBondContact SG-NE2 2.89Å; F970-H979 HydrophobicContact CE1-CB 4.2Å; F970-H979 HydrophobicContact CE2-CB 3.72Å; F970-H979 AromaticContact CE2-CD2 3.47Å; F970-H979 VanDerWaalsContact CE2-CD2 3.47Å; F970-H979 WeakPolarHBondContact CE2-CD2 3.12Å; F970-H979 AromaticContact CE2-CG 3.51Å; F970-H979 HydrophobicContact CZ-CB 3.45Å; F970-H979 VanDerWaalsContact CZ-CB 3.45Å; F970-H979 AromaticContact CZ-CD2 3.83Å; F970-H979 AromaticContact CZ-CG 3.37Å; F970-H979 AromaticContact CZ-ND1 3.78Å; N975-H979 WeakPolarHBondContact O-CB 3.4Å; N975-H979 PolarHBondContact O-N 3.28Å; L976-H979 CarbonylContact O-C 3.53Å; L976-H979 WeakPolarHBondContact O-CA 3.3Å; L976-H979 WeakPolarHBondContact O-CB 3.24Å; L976-H979 PolarHBondContact O-N 3.41Å; H979-R981 PolarHBondContact O-N 2.89Å; H979-N982 PolarHBondContact O-N 2.73Å; H979-I983 VanDerWaalsContact ND1-CD1 3.34Å; H979-I983 WeakPolarHBondContact ND1-CD1 3.2Å; H979-I983 WeakPolarHBondContact O-CB 3.26Å; H979-I983 PolarHBondContact O-N 2.71Å; H979-H984 AromaticContact CE1-CD2 3.89Å; H979-H984 AromaticContact CE1-NE2 3.48Å; H979-H984 PolarHBondContact CE1-NE2 3.12Å; H979-H984 AromaticContact NE2-CD2 3.51Å; H979-H984 AromaticContact NE2-NE2 3.23Å; H979-H984 PolarHBondContact NE2-NE2 2.98Å
980	I	83.8	Confident	76.5	Confident	45 Å²	45	70.1 Å²	70.1	23%	0.231	34%	0.344	C	S	.	.	I	π-helix	trans	-55	-52.2	176.3	-69.6	169.7	0	0	0	110.4	Y965 L976 N982 H984 N985	Y965-I980 HydrophobicContact CD2-CG1 4.44Å; Y965-I980 HydrophobicContact CD2-CG2 4.19Å; Y965-I980 HydrophobicContact CE2-CG2 3.92Å; L976-I980 HydrophobicContact CD1-CD1 3.8Å; L976-I980 HydrophobicContact CD1-CG1 3.88Å; L976-I980 HydrophobicContact CD2-CD1 4.3Å; L976-I980 HydrophobicContact CG-CD1 3.79Å; L976-I980 HydrophobicContact CG-CG1 4.3Å; L976-I980 WeakPolarHBondContact O-CG1 3.13Å; L976-I980 PolarHBondContact O-N 3.38Å; I980-N982 PolarHBondContact O-N 3.03Å; I980-H984 WeakPolarHBondContact O-CA 3.26Å; I980-H984 WeakPolarHBondContact O-CB 3.48Å; I980-H984 PolarHBondContact O-N 2.63Å; I980-N985 PolarHBondContact O-N 2.92Å
981	R	80.3	Confident	75.8	Confident	125 Å²	125	74.3 Å²	74.3	47%	0.472	36%	0.362	S	S	.	.	I	π-helix	trans	-60.8	-48.7	179.9	-166.4	-178.3	-61.6	131.7	2.7	112.2	Q977 H979	Q977-R981 WeakPolarHBondContact O-CB 3.4Å; Q977-R981 PolarHBondContact O-N 3.39Å; H979-R981 PolarHBondContact O-N 2.89Å
982	N	72.4	Confident	75.9	Confident	34 Å²	34	73.6 Å²	73.6	18%	0.182	36%	0.357	C	S	.	.	I	π-helix	trans	-78.9	-23.7	-169.6	-65.6	8.6	0	0	0	114.7	R978 H979 I980 G1000	R978-N982 WeakPolarHBondContact O-CB 3.33Å; R978-N982 PolarHBondContact O-N 3.13Å; R978-N982 PolarHBondContact O-OD1 2.99Å; H979-N982 PolarHBondContact O-N 2.73Å; I980-N982 PolarHBondContact O-N 3.03Å; N982-G1000 PolarHBondContact OD1-O 3.31Å
983	I	74.7	Confident	75.3	Confident	88 Å²	88	80.2 Å²	80.2	45%	0.451	39%	0.387	S	S	.	.	I	π-helix	trans	-115.2	-39.8	-174.2	-72.7	161.4	0	0	0	112	H979	H979-I983 VanDerWaalsContact ND1-CD1 3.34Å; H979-I983 WeakPolarHBondContact ND1-CD1 3.2Å; H979-I983 WeakPolarHBondContact O-CB 3.26Å; H979-I983 PolarHBondContact O-N 2.71Å
984	H	74.9	Confident	75	Confident	56 Å²	56	82.8 Å²	82.8	26%	0.259	40%	0.396	S	S	.	.	I	π-helix	trans	-98.4	-42.9	-174.8	-64.4	-71.2	0	0	0	113.2	Y965 C966 H979 I980 K986	Y965-H984 VanDerWaalsContact C-CE1 3.44Å; Y965-H984 VanDerWaalsContact CB-CG 3.43Å; Y965-H984 VanDerWaalsContact CB-ND1 3.26Å; Y965-H984 WeakPolarHBondContact CB-ND1 3.5Å; Y965-H984 HydrophobicContact CD2-CB 3.81Å; Y965-H984 AromaticContact CD2-CG 3.97Å; Y965-H984 HydrophobicContact CG-CB 4.18Å; Y965-H984 PolarHBondContact O-CE1 2.91Å; C966-H984 PolarHBondContact SG-NE2 2.76Å; H979-H984 AromaticContact CE1-CD2 3.89Å; H979-H984 AromaticContact CE1-NE2 3.48Å; H979-H984 PolarHBondContact CE1-NE2 3.12Å; H979-H984 AromaticContact NE2-CD2 3.51Å; H979-H984 AromaticContact NE2-NE2 3.23Å; H979-H984 PolarHBondContact NE2-NE2 2.98Å; I980-H984 WeakPolarHBondContact O-CA 3.26Å; I980-H984 WeakPolarHBondContact O-CB 3.48Å; I980-H984 PolarHBondContact O-N 2.63Å; H984-K986 PolarHBondContact O-N 3.49Å
985	N	70.1	Confident	74.8	Confident	87 Å²	87	81.9 Å²	81.9	47%	0.465	39%	0.389	S	S	.	.	S	Bend	trans	-72.4	-13.6	-178.4	-140.1	44.8	0	0	0	113.6	I980 E987	I980-N985 PolarHBondContact O-N 2.92Å; N985-E987 HydrophobicContact CB-CB 4.46Å; N985-E987 PolarHBondContact ND2-OE1 3.23Å; N985-E987 PolarHBondContact ND2-OE2 3.05Å; N985-E987 PolarHBondContact O-N 2.66Å
986	K	60.4	Low	73.9	Confident	179 Å²	179	87.2 Å²	87.2	78%	0.778	42%	0.418	S	S	*	.			trans	54.7	-13.7	-173	-70	-175.4	178.6	178.1	0	116.6	H984 K988	H984-K986 PolarHBondContact O-N 3.49Å; K986-K988 PolarHBondContact O-N 3.4Å
987	E	54.1	Low	72.9	Confident	113 Å²	113	94.2 Å²	94.2	53%	0.528	44%	0.443	S	S	.	.			trans	-51.6	96.8	161.4	-73.5	176.7	179.1	0	0	110.8	N985 P989	N985-E987 HydrophobicContact CB-CB 4.46Å; N985-E987 PolarHBondContact ND2-OE1 3.23Å; N985-E987 PolarHBondContact ND2-OE2 3.05Å; N985-E987 PolarHBondContact O-N 2.66Å; E987-P989 WeakPolarHBondContact O-CD 3.48Å
988	K	58.5	Low	72.3	Confident	93 Å²	93	90 Å²	90	40%	0.404	43%	0.426	S	S	.	.			trans	-107.9	88.4	167.3	-73.7	162.5	153.3	-149.2	0	105.9	K986 F990 C998 F999	K986-K988 PolarHBondContact O-N 3.4Å; K988-F990 PolarHBondContact O-N 2.85Å; K988-F990 VanDerWaalsContact O-N 3.11Å; K988-C998 HydrophobicContact CB-CB 3.67Å; K988-C998 HydrophobicContact CD-CB 3.77Å; K988-C998 VanDerWaalsContact CD-O 3.28Å; K988-C998 WeakPolarHBondContact CD-O 3.01Å; K988-C998 VanDerWaalsContact CE-O 3.32Å; K988-C998 WeakPolarHBondContact CE-O 3.19Å; K988-C998 HydrophobicContact CG-CB 4.38Å; K988-C998 PolarHBondContact NZ-O 3.16Å; K988-F999 CarbonylContact C-O 3.49Å; K988-F999 WeakPolarHBondContact CA-O 3.09Å
989	P	67.4	Low	72.1	Confident	80 Å²	80	87.6 Å²	87.6	52%	0.519	42%	0.418	S	S	.	.			trans	-66.7	-18.9	-169.1	-19.1	33.2	0	0	0	112.7	E987 K991	E987-P989 WeakPolarHBondContact O-CD 3.48Å; P989-K991 PolarHBondContact O-N 3.19Å
990	F	70.1	Confident	71.4	Confident	57 Å²	57	87.8 Å²	87.8	25%	0.25	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	74.9	-173.9	-47.9	-68.6	0	0	0	108.5	K988 F999 Q1001 Q1002 L1005	K988-F990 PolarHBondContact O-N 2.85Å; K988-F990 VanDerWaalsContact O-N 3.11Å; F990-F999 HydrophobicContact CB-CB 4.36Å; F990-F999 WeakPolarHBondContact CB-O 3.28Å; F990-F999 PolarHBondContact N-O 3.36Å; F990-F999 PolarHBondContact O-N 3.36Å; F990-Q1001 VanDerWaalsContact CD2-C 3.49Å; F990-Q1002 HydrophobicContact CD1-CB 4.14Å; F990-Q1002 HydrophobicContact CE1-CB 4.09Å; F990-Q1002 HydrophobicContact CG-CB 4.48Å; F990-Q1002 HydrophobicContact CZ-CB 4.39Å; F990-L1005 HydrophobicContact CB-CB 4Å; F990-L1005 HydrophobicContact CB-CD2 3.74Å; F990-L1005 HydrophobicContact CB-CG 4.49Å
991	K	68.9	Low	71	Confident	133 Å²	133	88.4 Å²	88.4	58%	0.578	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.5	146.8	168.6	-55.5	-159.9	177.6	179.3	0	109.4	P989 C998 L1005	P989-K991 PolarHBondContact O-N 3.19Å; K991-C998 HydrophobicContact CG-CB 4.4Å; K991-C998 VanDerWaalsContact CG-SG 3.57Å; K991-L1005 VanDerWaalsContact O-CD2 3.32Å; K991-L1005 WeakPolarHBondContact O-CD2 3.5Å
992	C	82.5	Confident	70.9	Confident	9 Å²	9	87 Å²	87	6%	0.061	42%	0.424	C	S	.	.			trans	-85.3	137.2	165.9	-175	0	0	0	0	109.1	L994 C995 R997 F999 L1005 H1008 L1009	C992-L994 VanDerWaalsContact C-N 3.26Å; C992-L994 PolarHBondContact SG-N 3.13Å; C992-C995 VanDerWaalsContact CB-O 3.3Å; C992-C995 WeakPolarHBondContact CB-O 3.3Å; C992-R997 WeakPolarHBondContact CB-O 3.42Å; C992-R997 PolarHBondContact N-O 2.86Å; C992-F999 HydrophobicContact CB-CE2 4.41Å; C992-L1005 HydrophobicContact CB-CD1 3.6Å; C992-H1008 PolarHBondContact SG-CD2 2.81Å; C992-H1008 PolarHBondContact SG-NE2 2.87Å; C992-H1008 VanDerWaalsContact SG-NE2 3.43Å; C992-L1009 VanDerWaalsContact SG-CD2 3.56Å
993	H	72.2	Confident	71.4	Confident	170 Å²	170	89.9 Å²	89.9	79%	0.787	44%	0.443	S	S	*	.	S	Bend	trans	-82.9	-6.7	177.4	-60.2	-81.2	0	0	0	112.6
994	L	78.1	Confident	71.7	Confident	106 Å²	106	87.7 Å²	87.7	56%	0.555	43%	0.432	S	S	*	.	S	Bend	trans	-112.4	-5.4	-176.1	-56.9	175	0	0	0	113	C992 L1009 H1012	C992-L994 VanDerWaalsContact C-N 3.26Å; C992-L994 PolarHBondContact SG-N 3.13Å; L994-L1009 HydrophobicContact CD1-CD2 4.12Å; L994-L1009 HydrophobicContact CG-CD2 4.41Å; L994-H1012 HydrophobicContact CB-CB 4.39Å; L994-H1012 HydrophobicContact CD1-CB 3.52Å; L994-H1012 PolarHBondContact O-CE1 3.02Å
995	C	79.7	Confident	72.2	Confident	44 Å²	44	85.4 Å²	85.4	30%	0.297	42%	0.422	S	S	.	.	S	Bend	trans	-169.4	161.9	158.7	65.1	0	0	0	0	110.5	C992 R997 H1008	C992-C995 VanDerWaalsContact CB-O 3.3Å; C992-C995 WeakPolarHBondContact CB-O 3.3Å; C995-R997 PolarHBondContact O-N 3.32Å; C995-H1008 PolarHBondContact SG-NE2 3.41Å; C995-H1008 VanDerWaalsContact SG-NE2 3.36Å
996	D	65.1	Low	72.9	Confident	158 Å²	158	86.1 Å²	86.1	85%	0.845	43%	0.426	S	S	*	.	S	Bend	trans	-66.8	10	-173.6	-54.7	-78.6	0	0	0	116.2	C998	D996-C998 PolarHBondContact O-N 3.42Å; D996-C998 PolarHBondContact O-SG 2.83Å
997	R	67.3	Low	74.1	Confident	171 Å²	171	85.6 Å²	85.6	65%	0.645	42%	0.419	S	S	*	.			trans	-68	102.2	174.5	-72.3	-174.9	169.2	170.2	-0.7	110	C992 C995 F999	C992-R997 WeakPolarHBondContact CB-O 3.42Å; C992-R997 PolarHBondContact N-O 2.86Å; C995-R997 PolarHBondContact O-N 3.32Å; R997-F999 HydrophobicContact CB-CE2 3.76Å; R997-F999 HydrophobicContact CB-CZ 3.99Å; R997-F999 WeakPolarHBondContact O-CD2 3.43Å; R997-F999 WeakPolarHBondContact O-CE2 3.4Å
998	C	71.5	Confident	75.5	Confident	32 Å²	32	81.4 Å²	81.4	22%	0.216	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	133.4	176.8	-57.5	0	0	0	0	111.3	K988 K991 D996	K988-C998 HydrophobicContact CB-CB 3.67Å; K988-C998 HydrophobicContact CD-CB 3.77Å; K988-C998 VanDerWaalsContact CD-O 3.28Å; K988-C998 WeakPolarHBondContact CD-O 3.01Å; K988-C998 VanDerWaalsContact CE-O 3.32Å; K988-C998 WeakPolarHBondContact CE-O 3.19Å; K988-C998 HydrophobicContact CG-CB 4.38Å; K988-C998 PolarHBondContact NZ-O 3.16Å; K991-C998 HydrophobicContact CG-CB 4.4Å; K991-C998 VanDerWaalsContact CG-SG 3.57Å; D996-C998 PolarHBondContact O-N 3.42Å; D996-C998 PolarHBondContact O-SG 2.83Å
999	F	77.9	Confident	76.7	Confident	47 Å²	47	79.4 Å²	79.4	21%	0.206	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	148.1	-175.1	-61.6	-93	0	0	0	112.6	K988 F990 C992 R997 N1004 L1005 H1008	K988-F999 CarbonylContact C-O 3.49Å; K988-F999 WeakPolarHBondContact CA-O 3.09Å; F990-F999 HydrophobicContact CB-CB 4.36Å; F990-F999 WeakPolarHBondContact CB-O 3.28Å; F990-F999 PolarHBondContact N-O 3.36Å; F990-F999 PolarHBondContact O-N 3.36Å; C992-F999 HydrophobicContact CB-CE2 4.41Å; R997-F999 HydrophobicContact CB-CE2 3.76Å; R997-F999 HydrophobicContact CB-CZ 3.99Å; R997-F999 WeakPolarHBondContact O-CD2 3.43Å; R997-F999 WeakPolarHBondContact O-CE2 3.4Å; F999-N1004 HydrophobicContact CB-CB 4.49Å; F999-N1004 HydrophobicContact CD1-CB 3.84Å; F999-N1004 HydrophobicContact CG-CB 4.45Å; F999-L1005 HydrophobicContact CB-CB 4.3Å; F999-L1005 HydrophobicContact CD2-CB 4.13Å; F999-L1005 HydrophobicContact CD2-CD1 4.09Å; F999-L1005 HydrophobicContact CE2-CD1 4.4Å; F999-L1005 HydrophobicContact CG-CB 4.35Å; F999-H1008 HydrophobicContact CE1-CB 4.3Å; F999-H1008 HydrophobicContact CE2-CB 4Å; F999-H1008 AromaticContact CE2-CD2 3.24Å; F999-H1008 WeakPolarHBondContact CE2-CD2 3.45Å; F999-H1008 AromaticContact CE2-CG 3.71Å; F999-H1008 HydrophobicContact CZ-CB 3.64Å; F999-H1008 AromaticContact CZ-CD2 3.47Å; F999-H1008 VanDerWaalsContact CZ-CD2 3.47Å; F999-H1008 WeakPolarHBondContact CZ-CD2 3.32Å; F999-H1008 AromaticContact CZ-CG 3.46Å; F999-H1008 VanDerWaalsContact CZ-CG 3.46Å
1000	G	70	Confident	77.5	Confident	16 Å²	16	81.2 Å²	81.2	17%	0.165	39%	0.393	C	S	.	.	S	Bend	trans	-90.5	4	176.3	0	0	0	0	0	115.3	N982	N982-G1000 PolarHBondContact OD1-O 3.31Å
1001	Q	74.8	Confident	77.8	Confident	58 Å²	58	86.3 Å²	86.3	27%	0.271	42%	0.415	S	S	.	.	S	Bend	trans	-149.3	135.1	174.3	-56.1	-171.2	-101.6	0	0	110.9	F990 T1003 N1004 L1005	F990-Q1001 VanDerWaalsContact CD2-C 3.49Å; Q1001-T1003 VanDerWaalsContact C-N 3.28Å; Q1001-T1003 PolarHBondContact O-N 3.47Å; Q1001-N1004 PolarHBondContact O-N 3.41Å; Q1001-L1005 PolarHBondContact O-N 3.21Å
1002	Q	79.2	Confident	78.2	Confident	96 Å²	96	82.6 Å²	82.6	45%	0.449	40%	0.399	S	S	.	.	H	α-helix	trans	-51.7	-42.8	177.7	-175.5	65.6	14.6	0	0	112.8	F990 N1004 L1005 D1006	F990-Q1002 HydrophobicContact CD1-CB 4.14Å; F990-Q1002 HydrophobicContact CE1-CB 4.09Å; F990-Q1002 HydrophobicContact CG-CB 4.48Å; F990-Q1002 HydrophobicContact CZ-CB 4.39Å; Q1002-N1004 PolarHBondContact O-N 3.33Å; Q1002-L1005 CarbonylContact O-C 3.27Å; Q1002-L1005 WeakPolarHBondContact O-CB 3.31Å; Q1002-L1005 PolarHBondContact O-N 3.37Å; Q1002-D1006 VanDerWaalsContact O-CB 3.3Å; Q1002-D1006 WeakPolarHBondContact O-CB 3.45Å; Q1002-D1006 PolarHBondContact O-N 3.48Å
1003	T	82.3	Confident	77.5	Confident	94 Å²	94	89 Å²	89	58%	0.577	43%	0.428	S	S	*	.	H	α-helix	trans	-65.1	-20.1	-179.2	52.7	0	0	0	0	114.5	Q1001 R1007	Q1001-T1003 VanDerWaalsContact C-N 3.28Å; Q1001-T1003 PolarHBondContact O-N 3.47Å; T1003-R1007 PolarHBondContact O-N 3.18Å
1004	N	81.6	Confident	77	Confident	42 Å²	42	86.8 Å²	86.8	23%	0.225	42%	0.422	C	S	.	.	H	α-helix	trans	-87.2	-31.7	173.1	-66.7	-46.6	0	0	0	111.7	F999 Q1001 Q1002 R1007 H1008	F999-N1004 HydrophobicContact CB-CB 4.49Å; F999-N1004 HydrophobicContact CD1-CB 3.84Å; F999-N1004 HydrophobicContact CG-CB 4.45Å; Q1001-N1004 PolarHBondContact O-N 3.41Å; Q1002-N1004 PolarHBondContact O-N 3.33Å; N1004-R1007 PolarHBondContact OD1-NH2 2.58Å; N1004-H1008 WeakPolarHBondContact O-CB 3.31Å; N1004-H1008 PolarHBondContact O-N 2.94Å
1005	L	85	Confident	75.8	Confident	8 Å²	8	83.8 Å²	83.8	4%	0.042	42%	0.417	C	S	.	.	H	α-helix	trans	-66.6	-47.2	169.1	170	62	0	0	0	110.7	F990 K991 C992 F999 Q1001 Q1002 R1007 H1008 L1009	F990-L1005 HydrophobicContact CB-CB 4Å; F990-L1005 HydrophobicContact CB-CD2 3.74Å; F990-L1005 HydrophobicContact CB-CG 4.49Å; K991-L1005 VanDerWaalsContact O-CD2 3.32Å; K991-L1005 WeakPolarHBondContact O-CD2 3.5Å; C992-L1005 HydrophobicContact CB-CD1 3.6Å; F999-L1005 HydrophobicContact CB-CB 4.3Å; F999-L1005 HydrophobicContact CD2-CB 4.13Å; F999-L1005 HydrophobicContact CD2-CD1 4.09Å; F999-L1005 HydrophobicContact CE2-CD1 4.4Å; F999-L1005 HydrophobicContact CG-CB 4.35Å; Q1001-L1005 PolarHBondContact O-N 3.21Å; Q1002-L1005 CarbonylContact O-C 3.27Å; Q1002-L1005 WeakPolarHBondContact O-CB 3.31Å; Q1002-L1005 PolarHBondContact O-N 3.37Å; L1005-R1007 PolarHBondContact O-N 3.43Å; L1005-H1008 CarbonylContact O-C 3.54Å; L1005-H1008 WeakPolarHBondContact O-CA 3.41Å; L1005-H1008 WeakPolarHBondContact O-CB 3.36Å; L1005-H1008 PolarHBondContact O-N 3.11Å; L1005-L1009 HydrophobicContact CD1-CD1 3.92Å; L1005-L1009 HydrophobicContact CD1-CD2 4.32Å; L1005-L1009 HydrophobicContact CD1-CG 3.78Å; L1005-L1009 HydrophobicContact CD2-CD1 4.29Å; L1005-L1009 HydrophobicContact CG-CD1 3.79Å; L1005-L1009 HydrophobicContact CG-CG 4.14Å; L1005-L1009 PolarHBondContact O-N 3.44Å
1006	D	83.8	Confident	73.8	Confident	103 Å²	103	89.8 Å²	89.8	55%	0.551	44%	0.441	S	S	*	.	H	α-helix	trans	-56.5	-51.9	-178.9	-173.7	62.1	0	0	0	112.1	Q1002 H1008 L1009 K1010	Q1002-D1006 VanDerWaalsContact O-CB 3.3Å; Q1002-D1006 WeakPolarHBondContact O-CB 3.45Å; Q1002-D1006 PolarHBondContact O-N 3.48Å; D1006-H1008 PolarHBondContact O-N 3.48Å; D1006-L1009 PolarHBondContact O-N 3.12Å; D1006-K1010 WeakPolarHBondContact O-CB 3.48Å; D1006-K1010 PolarHBondContact O-N 3.03Å
1007	R	85.9	Confident	72.8	Confident	167 Å²	167	88.7 Å²	88.7	63%	0.63	43%	0.434	S	S	*	.	H	α-helix	trans	-60.5	-25.1	171.7	-174.2	-179.8	62.7	-133.2	-15.7	113.4	T1003 N1004 L1005	T1003-R1007 PolarHBondContact O-N 3.18Å; N1004-R1007 PolarHBondContact OD1-NH2 2.58Å; L1005-R1007 PolarHBondContact O-N 3.43Å
1008	H	84.7	Confident	71.2	Confident	26 Å²	26	87 Å²	87	12%	0.12	45%	0.448	C	S	.	.	H	α-helix	trans	-85.4	-40.3	178.5	171.3	55.6	0	0	0	112.7	C992 C995 F999 N1004 L1005 D1006 K1010 K1011 H1012	C992-H1008 PolarHBondContact SG-CD2 2.81Å; C992-H1008 PolarHBondContact SG-NE2 2.87Å; C992-H1008 VanDerWaalsContact SG-NE2 3.43Å; C995-H1008 PolarHBondContact SG-NE2 3.41Å; C995-H1008 VanDerWaalsContact SG-NE2 3.36Å; F999-H1008 HydrophobicContact CE1-CB 4.3Å; F999-H1008 HydrophobicContact CE2-CB 4Å; F999-H1008 AromaticContact CE2-CD2 3.24Å; F999-H1008 WeakPolarHBondContact CE2-CD2 3.45Å; F999-H1008 AromaticContact CE2-CG 3.71Å; F999-H1008 HydrophobicContact CZ-CB 3.64Å; F999-H1008 AromaticContact CZ-CD2 3.47Å; F999-H1008 VanDerWaalsContact CZ-CD2 3.47Å; F999-H1008 WeakPolarHBondContact CZ-CD2 3.32Å; F999-H1008 AromaticContact CZ-CG 3.46Å; F999-H1008 VanDerWaalsContact CZ-CG 3.46Å; N1004-H1008 WeakPolarHBondContact O-CB 3.31Å; N1004-H1008 PolarHBondContact O-N 2.94Å; L1005-H1008 CarbonylContact O-C 3.54Å; L1005-H1008 WeakPolarHBondContact O-CA 3.41Å; L1005-H1008 WeakPolarHBondContact O-CB 3.36Å; L1005-H1008 PolarHBondContact O-N 3.11Å; D1006-H1008 PolarHBondContact O-N 3.48Å; H1008-K1010 VanDerWaalsContact C-N 3.25Å; H1008-K1010 PolarHBondContact O-N 2.94Å; H1008-K1011 WeakPolarHBondContact O-CA 3.48Å; H1008-K1011 WeakPolarHBondContact O-CB 3.32Å; H1008-K1011 PolarHBondContact O-N 3.05Å; H1008-H1012 AromaticContact CD2-NE2 3.99Å; H1008-H1012 AromaticContact CE1-CD2 3.76Å; H1008-H1012 AromaticContact CE1-NE2 3.18Å; H1008-H1012 PolarHBondContact CE1-NE2 3.44Å; H1008-H1012 AromaticContact NE2-CD2 3.78Å; H1008-H1012 AromaticContact NE2-NE2 3.1Å; H1008-H1012 PolarHBondContact NE2-NE2 2.64Å; H1008-H1012 VanDerWaalsContact NE2-NE2 3.1Å; H1008-H1012 PolarHBondContact O-CD2 3.49Å; H1008-H1012 PolarHBondContact O-N 2.99Å
1009	L	81.9	Confident	69.5	Low	50 Å²	50	88.9 Å²	88.9	26%	0.262	47%	0.473	S	S	.	.	H	α-helix	trans	-56.4	-43.6	168.9	-73.3	168.8	0	0	0	110.1	C992 L994 L1005 D1006 K1011 H1012 E1013	C992-L1009 VanDerWaalsContact SG-CD2 3.56Å; L994-L1009 HydrophobicContact CD1-CD2 4.12Å; L994-L1009 HydrophobicContact CG-CD2 4.41Å; L1005-L1009 HydrophobicContact CD1-CD1 3.92Å; L1005-L1009 HydrophobicContact CD1-CD2 4.32Å; L1005-L1009 HydrophobicContact CD1-CG 3.78Å; L1005-L1009 HydrophobicContact CD2-CD1 4.29Å; L1005-L1009 HydrophobicContact CG-CD1 3.79Å; L1005-L1009 HydrophobicContact CG-CG 4.14Å; L1005-L1009 PolarHBondContact O-N 3.44Å; D1006-L1009 PolarHBondContact O-N 3.12Å; L1009-K1011 PolarHBondContact O-N 3.16Å; L1009-H1012 WeakPolarHBondContact O-CA 3.33Å; L1009-H1012 WeakPolarHBondContact O-CB 3.46Å; L1009-H1012 PolarHBondContact O-N 3.47Å; L1009-E1013 PolarHBondContact O-N 3.11Å
1010	K	84.6	Confident	67.5	Low	118 Å²	118	93.8 Å²	93.8	51%	0.513	51%	0.508	S	S	.	.	H	α-helix	trans	-59.3	-27.1	172.6	-171.8	145.6	-167.4	150	0	114.2	D1006 H1008 H1012 E1013 N1014	D1006-K1010 WeakPolarHBondContact O-CB 3.48Å; D1006-K1010 PolarHBondContact O-N 3.03Å; H1008-K1010 VanDerWaalsContact C-N 3.25Å; H1008-K1010 PolarHBondContact O-N 2.94Å; K1010-H1012 VanDerWaalsContact C-N 3.35Å; K1010-E1013 PolarHBondContact O-N 3.26Å; K1010-N1014 WeakPolarHBondContact CG-OD1 3.32Å; K1010-N1014 WeakPolarHBondContact O-CB 3.09Å; K1010-N1014 PolarHBondContact O-N 2.81Å; K1010-N1014 PolarHBondContact O-OD1 2.92Å
1011	K	77.2	Confident	66.1	Low	165 Å²	165	97.2 Å²	97.2	72%	0.717	53%	0.534	S	S	*	.	H	α-helix	trans	-75.2	-22.8	173.4	-170.1	168.7	-178.4	179.7	0	112.9	H1008 L1009	H1008-K1011 WeakPolarHBondContact O-CA 3.48Å; H1008-K1011 WeakPolarHBondContact O-CB 3.32Å; H1008-K1011 PolarHBondContact O-N 3.05Å; L1009-K1011 PolarHBondContact O-N 3.16Å
1012	H	76.4	Confident	64.1	Low	54 Å²	54	102.8 Å²	102.8	25%	0.25	56%	0.562	C	S	.	*	H	α-helix	trans	-78.9	-42.3	167.5	-64.1	-88.6	0	0	0	111	L994 H1008 L1009 K1010 N1014 G1015	L994-H1012 HydrophobicContact CB-CB 4.39Å; L994-H1012 HydrophobicContact CD1-CB 3.52Å; L994-H1012 PolarHBondContact O-CE1 3.02Å; H1008-H1012 AromaticContact CD2-NE2 3.99Å; H1008-H1012 AromaticContact CE1-CD2 3.76Å; H1008-H1012 AromaticContact CE1-NE2 3.18Å; H1008-H1012 PolarHBondContact CE1-NE2 3.44Å; H1008-H1012 AromaticContact NE2-CD2 3.78Å; H1008-H1012 AromaticContact NE2-NE2 3.1Å; H1008-H1012 PolarHBondContact NE2-NE2 2.64Å; H1008-H1012 VanDerWaalsContact NE2-NE2 3.1Å; H1008-H1012 PolarHBondContact O-CD2 3.49Å; H1008-H1012 PolarHBondContact O-N 2.99Å; L1009-H1012 WeakPolarHBondContact O-CA 3.33Å; L1009-H1012 WeakPolarHBondContact O-CB 3.46Å; L1009-H1012 PolarHBondContact O-N 3.47Å; K1010-H1012 VanDerWaalsContact C-N 3.35Å; H1012-N1014 VanDerWaalsContact C-N 3.28Å; H1012-N1014 PolarHBondContact O-N 2.94Å; H1012-G1015 CarbonylContact O-C 3.46Å; H1012-G1015 PolarHBondContact O-N 2.63Å
1013	E	67.4	Low	61.7	Low	143 Å²	143	103.5 Å²	103.5	67%	0.668	58%	0.578	S	S	*	*	H	α-helix	trans	-56	-40.1	174.5	-174.2	-174.9	-149.5	0	0	112.2	L1009 K1010 G1015	L1009-E1013 PolarHBondContact O-N 3.11Å; K1010-E1013 PolarHBondContact O-N 3.26Å; E1013-G1015 VanDerWaalsContact C-N 3.34Å; E1013-G1015 PolarHBondContact O-N 2.93Å
1014	N	63.5	Low	59.3	Low	124 Å²	124	104.5 Å²	104.5	66%	0.663	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	17.1	176.1	-68.6	127.8	0	0	0	114.5	K1010 H1012	K1010-N1014 WeakPolarHBondContact CG-OD1 3.32Å; K1010-N1014 WeakPolarHBondContact O-CB 3.09Å; K1010-N1014 PolarHBondContact O-N 2.81Å; K1010-N1014 PolarHBondContact O-OD1 2.92Å; H1012-N1014 VanDerWaalsContact C-N 3.28Å; H1012-N1014 PolarHBondContact O-N 2.94Å
1015	G	51.3	Low	58.1	Low	44 Å²	44	108.2 Å²	108.2	45%	0.454	62%	0.615	S	S	.	*	S	Bend	trans	-162.7	85.9	-178.6	0	0	0	0	0	113	H1012 E1013 L1017	H1012-G1015 CarbonylContact O-C 3.46Å; H1012-G1015 PolarHBondContact O-N 2.63Å; E1013-G1015 VanDerWaalsContact C-N 3.34Å; E1013-G1015 PolarHBondContact O-N 2.93Å; G1015-L1017 PolarHBondContact O-N 2.85Å
1016	H	37.8	Very low	55.2	Low	169 Å²	169	116 Å²	116	78%	0.782	65%	0.651	S	S	*	*			trans	-65.1	120.6	-176.3	-174.9	-105.5	0	0	0	112.8
1017	L	44.9	Very low	52.7	Low	135 Å²	135	114.5 Å²	114.5	71%	0.707	65%	0.648	S	S	*	*			trans	34.6	108	161.8	-56.6	-176	0	0	0	118.4	G1015	G1015-L1017 PolarHBondContact O-N 2.85Å
1018	S	32.9	Very low	50.1	Low	135 Å²	135	114.2 Å²	114.2	94%	0.944	66%	0.655	S	S	*	*			trans	-110.5	73.3	149.8	-60.7	0	0	0	0	109.5
1019	G	36.3	Very low	47.7	Very low	72 Å²	72	120.4 Å²	120.4	74%	0.742	69%	0.688	S	S	*	*			trans	-106.4	99.9	167.9	0	0	0	0	0	109.9
1020	T	36.5	Very low	45.2	Very low	151 Å²	151	124.5 Å²	124.5	93%	0.926	71%	0.71	S	S	*	*			trans	-98.3	137.9	160.5	40	0	0	0	0	108.4
1021	A	40.6	Very low	42.5	Very low	87 Å²	87	124.6 Å²	124.6	72%	0.719	73%	0.725	S	S	*	*			trans	-123.3	168.9	-166.8	0	0	0	0	0	112.7
1022	M	33.2	Very low	40.4	Very low	176 Å²	176	121.8 Å²	121.8	87%	0.867	73%	0.727	S	S	*	*			trans	71.7	141.5	-179.4	-39.2	-54.9	-81.7	0	0	113.2
1023	S	27.2	Very low	38.3	Very low	110 Å²	110	125.1 Å²	125.1	77%	0.769	76%	0.756	S	S	*	*			cis	-142.1	176.3	21.7	-60.9	0	0	0	0	113.8
1024	S	33.5	Very low	37	Very low	115 Å²	115	122.8 Å²	122.8	80%	0.804	76%	0.761	S	S	*	*			trans	-161	168.7	169.4	-71.4	0	0	0	0	108.2
1025	P	54.6	Low	35.7	Very low	121 Å²	121	125 Å²	125	79%	0.786	77%	0.771	S	S	*	*			cis	-124.5	177.8	-7.6	41.4	-28	0	0	0	113.4
1026	Q	24.4	Very low	35.2	Very low	172 Å²	172	129.6 Å²	129.6	80%	0.804	78%	0.784	S	S	*	*			trans	-159.2	148.7	147.4	-169.1	50.9	42.7	0	0	109.9
1027	S	32.6	Very low	35.8	Very low	70 Å²	70	127.9 Å²	127.9	49%	0.49	78%	0.781	S	S	.	*			trans	-78.2	161.4	171.5	53.8	0	0	0	0	111.2
1028	E	30	Very low	36	Very low	162 Å²	162	128.4 Å²	128.4	76%	0.757	79%	0.785	S	S	*	*				-159.5	-179.8	69.6	-87.6	-54.9	142.6	0	0	113.8
1029	L	34.4	Very low	36.7	Very low	156 Å²	156	131 Å²	131	82%	0.817	78%	0.779	S	S	*	*			trans	-80.3	153.9	-173.1	-74.3	155.9	0	0	0	116.4
1030	D	31	Very low	37.3	Very low	135 Å²	135	134.4 Å²	134.4	72%	0.722	78%	0.776	S	S	*	*			trans	56.1	115.6	148.3	-162.8	22.8	0	0	0	121.1
1031	S	27.9	Very low	37.9	Very low	120 Å²	120	132 Å²	132	84%	0.839	76%	0.757	S	S	*	*			trans	-165.6	132.4	130.8	-83.6	0	0	0	0	110.8
1032	S	33.1	Very low	38.6	Very low	107 Å²	107	131.9 Å²	131.9	75%	0.748	75%	0.751	S	S	*	*			trans	-93.2	134.2	176.2	-65.6	0	0	0	0	112.3
1033	S	32.1	Very low	39.5	Very low	124 Å²	124	130.9 Å²	130.9	87%	0.867	74%	0.739	S	S	*	*				168.2	148.3	127.9	-77.2	0	0	0	0	114
1034	A	38.6	Very low	40.9	Very low	94 Å²	94	131.2 Å²	131.2	78%	0.777	73%	0.726	S	S	*	*			trans	-16.1	142.5	172.2	0	0	0	0	0	121.3
1035	I	38	Very low	41.8	Very low	169 Å²	169	129 Å²	129	87%	0.867	71%	0.706	S	S	*	*				-160.8	160.9	127.8	-99.6	151.5	0	0	0	108.8
1036	L	40.4	Very low	42.3	Very low	141 Å²	141	129.7 Å²	129.7	74%	0.738	70%	0.698	S	S	*	*			trans	-99.8	152	-169.8	-68.1	167.3	0	0	0	113.4
1037	D	48.8	Very low	44.1	Very low	133 Å²	133	124.9 Å²	124.9	71%	0.711	68%	0.677	S	S	*	*			trans	35.2	80.6	141.8	-50.9	-38	0	0	0	118.7
1038	D	51.1	Low	45.4	Very low	147 Å²	147	127.7 Å²	127.7	79%	0.786	68%	0.677	S	S	*	*			trans	-123.3	20	-179.3	-132	-22.3	0	0	0	113
1039	K	46.8	Very low	46.4	Very low	190 Å²	190	125.4 Å²	125.4	83%	0.826	67%	0.67	S	S	*	*	S	Bend	trans	-129	4.1	-171.8	-154.3	152.7	-170.5	163.3	0	116.1
1040	E	49.1	Very low	47.3	Very low	143 Å²	143	126 Å²	126	67%	0.668	67%	0.666	S	S	*	*	S	Bend	trans	-92	-37.4	173.8	-52.2	-159.4	168.2	0	0	111.1	S1042 Y1043	E1040-S1042 VanDerWaalsContact C-N 3.28Å; E1040-S1042 PolarHBondContact O-N 2.93Å; E1040-Y1043 PolarHBondContact O-N 3.02Å
1041	D	48.2	Very low	48.6	Very low	99 Å²	99	125.2 Å²	125.2	53%	0.529	66%	0.661	S	S	.	*	H	α-helix	trans	-68.6	-18	-177.9	-86.2	-39.3	0	0	0	115.2	Y1043 F1044 N1045	D1041-Y1043 PolarHBondContact O-N 2.89Å; D1041-F1044 PolarHBondContact O-N 3.29Å; D1041-N1045 WeakPolarHBondContact O-CB 3.42Å; D1041-N1045 PolarHBondContact O-N 3.14Å; D1041-N1045 PolarHBondContact O-ND2 2.81Å
1042	S	57	Low	49.2	Very low	85 Å²	85	124 Å²	124	59%	0.594	65%	0.653	S	S	*	*	H	α-helix	trans	-60.5	-38.2	172.1	-170	0	0	0	0	111.4	E1040 E1046	E1040-S1042 VanDerWaalsContact C-N 3.28Å; E1040-S1042 PolarHBondContact O-N 2.93Å; S1042-E1046 PolarHBondContact O-N 3.3Å; S1042-E1046 VanDerWaalsContact O-N 3.15Å
1043	Y	51.7	Low	49.3	Very low	156 Å²	156	123.6 Å²	123.6	61%	0.612	65%	0.65	S	S	*	*	H	α-helix	trans	-72.7	-39.4	-178.8	-172.3	-121.3	0	0	0	111.6	E1040 D1041 E1046 I1047	E1040-Y1043 PolarHBondContact O-N 3.02Å; D1041-Y1043 PolarHBondContact O-N 2.89Å; Y1043-E1046 PolarHBondContact O-N 2.86Å; Y1043-I1047 HydrophobicContact CD1-CD1 3.92Å; Y1043-I1047 HydrophobicContact CD2-CD1 4.48Å; Y1043-I1047 HydrophobicContact CE1-CD1 3.68Å; Y1043-I1047 HydrophobicContact CE2-CD1 4.25Å; Y1043-I1047 HydrophobicContact CG-CD1 4.32Å; Y1043-I1047 WeakPolarHBondContact O-CG1 3.34Å; Y1043-I1047 PolarHBondContact O-N 3.16Å; Y1043-I1047 VanDerWaalsContact O-N 3.09Å
1044	F	55.6	Low	49.7	Very low	117 Å²	117	121.7 Å²	121.7	51%	0.513	64%	0.642	S	S	.	*	H	α-helix	trans	-72.4	-27.4	176.9	-70.9	-71.6	0	0	0	113.8	D1041 R1048	D1041-F1044 PolarHBondContact O-N 3.29Å; F1044-R1048 PolarHBondContact O-N 3.1Å
1045	N	53.8	Low	49.5	Very low	69 Å²	69	121.3 Å²	121.3	37%	0.369	63%	0.633	S	S	.	*	H	α-helix	trans	-73.7	-39.8	171.1	-77.5	-65.2	0	0	0	112.2	D1041 R1048 N1049	D1041-N1045 WeakPolarHBondContact O-CB 3.42Å; D1041-N1045 PolarHBondContact O-N 3.14Å; D1041-N1045 PolarHBondContact O-ND2 2.81Å; N1045-R1048 PolarHBondContact O-N 3.23Å; N1045-R1048 VanDerWaalsContact OD1-CZ 3.24Å; N1045-R1048 PolarHBondContact OD1-NH1 2.77Å; N1045-R1048 PolarHBondContact OD1-NH2 3.02Å; N1045-N1049 PolarHBondContact O-N 3.35Å
1046	E	63.1	Low	49.2	Very low	134 Å²	134	121.5 Å²	121.5	63%	0.626	63%	0.63	S	S	*	*	H	α-helix	trans	-63.5	-43.2	176.8	-167.7	167.7	-138.2	0	0	111.8	S1042 Y1043 R1048 N1049 F1050	S1042-E1046 PolarHBondContact O-N 3.3Å; S1042-E1046 VanDerWaalsContact O-N 3.15Å; Y1043-E1046 PolarHBondContact O-N 2.86Å; E1046-R1048 PolarHBondContact O-N 3.4Å; E1046-N1049 PolarHBondContact O-N 2.96Å; E1046-F1050 PolarHBondContact O-N 3.45Å
1047	I	64.1	Low	48.6	Very low	71 Å²	71	121.9 Å²	121.9	36%	0.364	63%	0.633	S	S	.	*	H	α-helix	trans	-61.9	-40.8	173.8	-68.6	166.9	0	0	0	111.9	Y1043 I1051	Y1043-I1047 HydrophobicContact CD1-CD1 3.92Å; Y1043-I1047 HydrophobicContact CD2-CD1 4.48Å; Y1043-I1047 HydrophobicContact CE1-CD1 3.68Å; Y1043-I1047 HydrophobicContact CE2-CD1 4.25Å; Y1043-I1047 HydrophobicContact CG-CD1 4.32Å; Y1043-I1047 WeakPolarHBondContact O-CG1 3.34Å; Y1043-I1047 PolarHBondContact O-N 3.16Å; Y1043-I1047 VanDerWaalsContact O-N 3.09Å; I1047-I1051 HydrophobicContact CG2-CD1 4.16Å; I1047-I1051 WeakPolarHBondContact O-CG1 3.5Å; I1047-I1051 PolarHBondContact O-N 2.88Å
1048	R	58.3	Low	47.9	Very low	130 Å²	130	124.5 Å²	124.5	49%	0.491	64%	0.641	S	S	.	*	H	α-helix	trans	-63.9	-44.2	176.1	-89.7	-171.5	-82.7	98.9	-0.1	112	F1044 N1045 E1046 F1050 I1051 S1052	F1044-R1048 PolarHBondContact O-N 3.1Å; N1045-R1048 PolarHBondContact O-N 3.23Å; N1045-R1048 VanDerWaalsContact OD1-CZ 3.24Å; N1045-R1048 PolarHBondContact OD1-NH1 2.77Å; N1045-R1048 PolarHBondContact OD1-NH2 3.02Å; E1046-R1048 PolarHBondContact O-N 3.4Å; R1048-F1050 PolarHBondContact O-N 2.98Å; R1048-I1051 PolarHBondContact O-N 3.42Å; R1048-S1052 PolarHBondContact O-N 3.02Å; R1048-S1052 PolarHBondContact O-OG 3.17Å
1049	N	50.6	Low	46.9	Very low	113 Å²	113	122.3 Å²	122.3	60%	0.604	63%	0.633	S	S	*	*	H	α-helix	trans	-65.1	-36.6	179.6	-72.9	-11.2	0	0	0	112.8	N1045 E1046 I1051 S1052	N1045-N1049 PolarHBondContact O-N 3.35Å; E1046-N1049 PolarHBondContact O-N 2.96Å; N1049-I1051 VanDerWaalsContact C-N 3.28Å; N1049-I1051 PolarHBondContact O-N 2.82Å; N1049-S1052 PolarHBondContact O-N 3.2Å
1050	F	53.6	Low	46.3	Very low	169 Å²	169	116.3 Å²	116.3	74%	0.741	62%	0.615	S	S	*	*	H	α-helix	trans	-67.1	-27.5	177.2	-161	-94.2	0	0	0	113.2	E1046 R1048 S1053	E1046-F1050 PolarHBondContact O-N 3.45Å; R1048-F1050 PolarHBondContact O-N 2.98Å; F1050-S1053 PolarHBondContact O-OG 3.07Å
1051	I	58.4	Low	45.9	Very low	118 Å²	118	112.5 Å²	112.5	61%	0.605	60%	0.603	S	S	*	*	H	α-helix	trans	-77.6	-33.2	174.1	-65.8	167.2	0	0	0	110.9	I1047 R1048 N1049 S1053	I1047-I1051 HydrophobicContact CG2-CD1 4.16Å; I1047-I1051 WeakPolarHBondContact O-CG1 3.5Å; I1047-I1051 PolarHBondContact O-N 2.88Å; R1048-I1051 PolarHBondContact O-N 3.42Å; N1049-I1051 VanDerWaalsContact C-N 3.28Å; N1049-I1051 PolarHBondContact O-N 2.82Å; I1051-S1053 VanDerWaalsContact C-N 3.32Å; I1051-S1053 PolarHBondContact O-N 3.35Å
1052	S	41.8	Very low	44.9	Very low	96 Å²	96	114.1 Å²	114.1	67%	0.671	61%	0.612	S	S	*	*	H	α-helix	trans	-71.2	-16.3	-177.6	-65.2	0	0	0	0	115.7	R1048 N1049	R1048-S1052 PolarHBondContact O-N 3.02Å; R1048-S1052 PolarHBondContact O-OG 3.17Å; N1049-S1052 PolarHBondContact O-N 3.2Å
1053	S	35.4	Very low	44.1	Very low	98 Å²	98	114.7 Å²	114.7	69%	0.685	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-0.3	-178.7	54.6	0	0	0	0	115.1	F1050 I1051	F1050-S1053 PolarHBondContact O-OG 3.07Å; I1051-S1053 VanDerWaalsContact C-N 3.32Å; I1051-S1053 PolarHBondContact O-N 3.35Å
1054	A	39.7	Very low	42.9	Very low	84 Å²	84	111.8 Å²	111.8	69%	0.694	62%	0.616	S	S	*	*	S	Bend	trans	-106.9	4.8	-165	0	0	0	0	0	116.2
1055	S	33.3	Very low	41.6	Very low	86 Å²	86	113.7 Å²	113.7	60%	0.601	63%	0.626	S	S	*	*	S	Bend	trans	-148	37.5	-164.5	71.6	0	0	0	0	119.3
1056	Q	33.3	Very low	40.5	Very low	172 Å²	172	119.7 Å²	119.7	80%	0.804	65%	0.652	S	S	*	*			trans	-162.8	141.4	161.9	-124.3	92.3	52.3	0	0	108.6
1057	N	26.8	Very low	38.9	Very low	150 Å²	150	116.4 Å²	116.4	80%	0.802	65%	0.654	S	S	*	*			cis	-138.5	176.1	16.2	-69	-80.3	0	0	0	112.3
1058	Q	35.1	Very low	37.2	Very low	188 Å²	188	120.9 Å²	120.9	88%	0.879	68%	0.678	S	S	*	*			trans	-143.5	158.8	175	-63.6	-175	15.3	0	0	113
1059	T	29.7	Very low	35.5	Very low	100 Å²	100	121.8 Å²	121.8	61%	0.613	69%	0.693	S	S	*	*			trans	-166.9	139.2	147.1	33.9	0	0	0	0	113.4	A777	A777-T1059 VanDerWaalsContact N-CG2 3.26Å
1060	S	34.2	Very low	34.3	Very low	64 Å²	64	120.3 Å²	120.3	45%	0.448	70%	0.704	S	S	.	*			trans	-97.6	-153.3	173.8	58.4	0	0	0	0	111.5	A777 A778 N779	A777-S1060 CarbonylContact C-O 3.19Å; A777-S1060 WeakPolarHBondContact CA-O 3.34Å; A777-S1060 WeakPolarHBondContact CB-O 3.31Å; A778-S1060 CarbonylContact C-O 2.87Å; A778-S1060 WeakPolarHBondContact CA-O 3.39Å; A778-S1060 PolarHBondContact N-O 3.31Å; N779-S1060 PolarHBondContact N-O 3.02Å; N779-S1060 WeakPolarHBondContact OD1-CA 3.49Å
1061	P	40.3	Very low	33	Very low	64 Å²	64	115.9 Å²	115.9	42%	0.416	71%	0.706	S	S	.	*			cis	-134.1	164.6	-5	43	-22.1	0	0	0	116.5	A777 N779	A777-P1061 HydrophobicContact CB-CB 4.41Å; A777-P1061 VanDerWaalsContact CB-CD 3.44Å; A777-P1061 HydrophobicContact CB-CG 3.71Å; N779-P1061 VanDerWaalsContact CG-C 3.5Å; N779-P1061 VanDerWaalsContact CG-N 3.26Å; N779-P1061 PolarHBondContact ND2-O 3.09Å; N779-P1061 WeakPolarHBondContact OD1-CA 3.33Å
1062	D	26.6	Very low	31.4	Very low	133 Å²	133	117.9 Å²	117.9	71%	0.711	72%	0.717	S	S	*	*			trans	-52.6	165.1	-171.2	-51.1	-94.4	0	0	0	118.5
1063	P	40.1	Very low	30.6	Very low	96 Å²	96	120.2 Å²	120.2	62%	0.623	72%	0.721	S	S	*	*				-144.2	146	91.6	40.2	-26.1	0	0	0	117.2
1064	S	28.1	Very low	30.2	Very low	96 Å²	96	123.2 Å²	123.2	67%	0.671	73%	0.725	S	S	*	*			trans	47.8	165.1	142.7	62.4	0	0	0	0	121.5
1065	E	27.7	Very low	29.7	Very low	156 Å²	156	126 Å²	126	73%	0.729	72%	0.723	S	S	*	*			cis	-145.2	175.4	4	34.4	-115.1	69.2	0	0	112.7
1066	E	31.2	Very low	29.4	Very low	196 Å²	196	125.1 Å²	125.1	92%	0.916	73%	0.727	S	S	*	*			trans	4.7	151.4	157.6	-56.8	176.2	140.1	0	0	121.7
1067	G	29.3	Very low	29.4	Very low	65 Å²	65	125.1 Å²	125.1	67%	0.67	73%	0.725	S	S	*	*			cis	156.5	173	0.4	0	0	0	0	0	113
1068	L	26.9	Very low	30.2	Very low	164 Å²	164	123.4 Å²	123.4	86%	0.859	72%	0.721	S	S	*	*			trans	67.1	154.4	167.5	-54.3	-179.9	0	0	0	117.4
1069	N	24.2	Very low	29.8	Very low	150 Å²	150	122.5 Å²	122.5	80%	0.802	72%	0.722	S	S	*	*			cis	130	130.5	-4.8	-99.4	-36.4	0	0	0	110.8
1070	G	25.2	Very low	29.5	Very low	81 Å²	81	124.8 Å²	124.8	84%	0.835	73%	0.727	S	S	*	*			trans	77.4	145.5	173.4	0	0	0	0	0	115.4
1071	G	25.2	Very low	29.6	Very low	77 Å²	77	127.2 Å²	127.2	79%	0.794	74%	0.741	S	S	*	*			cis	100.2	145.7	-8.3	0	0	0	0	0	116.5
1072	L	24.7	Very low	28.9	Very low	159 Å²	159	127.6 Å²	127.6	83%	0.832	75%	0.746	S	S	*	*			trans	92.8	125.1	148.7	-164.5	60.7	0	0	0	120.4
1073	L	25.9	Very low	28.9	Very low	146 Å²	146	130 Å²	130	76%	0.764	75%	0.752	S	S	*	*			trans	67.1	153.2	160.6	-66.1	164.3	0	0	0	119.2
1074	E	26.7	Very low	28.3	Very low	161 Å²	161	129.1 Å²	129.1	75%	0.752	76%	0.761	S	S	*	*			cis	-170.5	179.2	-30.3	-119.6	-76.1	168.3	0	0	110.5
1075	E	28.7	Very low	28.2	Very low	143 Å²	143	130.3 Å²	130.3	67%	0.668	77%	0.77	S	S	*	*			trans	77.7	129.4	155.4	-72.7	-141.8	91.5	0	0	124	K1077	E1075-K1077 IonicContact OE1-NZ 2.7Å; E1075-K1077 PolarHBondContact OE1-NZ 3.13Å
1076	G	26.6	Very low	28.2	Very low	66 Å²	66	132.7 Å²	132.7	68%	0.68	77%	0.772	S	S	*	*			trans	123.7	82.4	152	0	0	0	0	0	116.5
1077	K	33.3	Very low	28	Very low	173 Å²	173	127.9 Å²	127.9	75%	0.752	75%	0.752	S	S	*	*				63.4	148.1	76.6	-67.4	170	178.8	155.2	0	115.7	E1075	E1075-K1077 IonicContact OE1-NZ 2.7Å; E1075-K1077 PolarHBondContact OE1-NZ 3.13Å
1078	P	43.7	Very low	28.4	Very low	113 Å²	113	130.9 Å²	130.9	73%	0.734	75%	0.752	S	S	*	*			cis	-143.8	167.4	-30	40	-23.6	0	0	0	115.6
1079	L	26.5	Very low	28.4	Very low	170 Å²	170	130.4 Å²	130.4	89%	0.89	75%	0.746	S	S	*	*			trans	-167.9	171.7	137.1	-127.5	74.6	0	0	0	111.9
1080	M	25.2	Very low	28.6	Very low	147 Å²	147	129.8 Å²	129.8	72%	0.724	74%	0.742	S	S	*	*			trans	-135	179.6	-168.8	-84.2	-71	-78	0	0	110.4
1081	P	36.4	Very low	29	Very low	115 Å²	115	133.8 Å²	133.8	75%	0.747	74%	0.739	S	S	*	*			cis	-136.5	-175.1	14.8	44.1	-24.4	0	0	0	115.2
1082	S	25.6	Very low	29.2	Very low	73 Å²	73	138 Å²	138	51%	0.51	74%	0.738	S	S	.	*			cis	-159.3	156.4	-6.8	-122.1	0	0	0	0	112.4
1083	H	26.3	Very low	29.5	Very low	182 Å²	182	135.4 Å²	135.4	84%	0.843	73%	0.729	S	S	*	*			trans	35.4	134.5	159	-43	-59.8	0	0	0	120.5
1084	G	26.3	Very low	29.7	Very low	78 Å²	78	137.2 Å²	137.2	80%	0.804	73%	0.733	S	S	*	*			cis	174.3	-174.3	4.8	0	0	0	0	0	108.6
1085	S	26.3	Very low	29.8	Very low	122 Å²	122	135.7 Å²	135.7	85%	0.853	73%	0.73	S	S	*	*			cis	-155.2	-150.7	-3.7	61.3	0	0	0	0	110.3
1086	R	27.2	Very low	30.1	Very low	206 Å²	206	135.5 Å²	135.5	78%	0.777	73%	0.733	S	S	*	*			trans	-142.9	172.6	175	-88.4	176.1	68.3	-176.9	-3.5	106.9
1087	D	27.6	Very low	30.3	Very low	94 Å²	94	139.3 Å²	139.3	50%	0.503	74%	0.738	S	S	.	*			cis	-163.1	166.1	6	-124.5	7.7	0	0	0	110.5
1088	L	37.3	Very low	30.7	Very low	128 Å²	128	134.3 Å²	134.3	67%	0.67	73%	0.729	S	S	*	*			trans	60.4	143.5	142.3	-64.8	166.7	0	0	0	124.8
1089	E	28.5	Very low	30.4	Very low	155 Å²	155	135.8 Å²	135.8	72%	0.724	73%	0.726	S	S	*	*			trans	84.4	150.9	137.6	-80.3	155.4	-137.5	0	0	123.6
1090	D	27.8	Very low	31	Very low	137 Å²	137	131.1 Å²	131.1	73%	0.733	70%	0.7	S	S	*	*			trans	77.9	113.2	160.6	-63.6	-5.8	0	0	0	125
1091	E	32.8	Very low	31.9	Very low	165 Å²	165	131.5 Å²	131.5	77%	0.771	70%	0.7	S	S	*	*				79.1	157.8	126.2	-60.1	-68.5	80.1	0	0	124.3
1092	E	30.7	Very low	31.9	Very low	165 Å²	165	133.1 Å²	133.1	77%	0.771	70%	0.697	S	S	*	*			trans	-62.5	168.4	176.8	-51.4	174.4	162.1	0	0	111.7
1093	V	31.1	Very low	32.4	Very low	104 Å²	104	133 Å²	133	63%	0.63	70%	0.7	S	S	*	*				177.5	151.4	64.8	174.8	0	0	0	0	109
1094	E	29.3	Very low	32.6	Very low	185 Å²	185	133.1 Å²	133.1	86%	0.864	70%	0.701	S	S	*	*			trans	53.9	-176.3	159.1	-74.5	158.9	-157.9	0	0	121
1095	D	28.4	Very low	32.5	Very low	128 Å²	128	135.8 Å²	135.8	68%	0.684	69%	0.693	S	S	*	*				179.3	151.3	-61.3	-164.9	11	0	0	0	108.8
1096	L	35.4	Very low	33.1	Very low	139 Å²	139	134.8 Å²	134.8	73%	0.728	68%	0.684	S	S	*	*			trans	58.1	174.7	174.8	-43.7	-179.3	0	0	0	115.4
1097	D	30	Very low	33	Very low	147 Å²	147	134.4 Å²	134.4	79%	0.786	68%	0.682	S	S	*	*			cis	-159.3	-173.8	-8.8	-129.6	-11.6	0	0	0	106
1098	A	42.7	Very low	32.8	Very low	68 Å²	68	136.3 Å²	136.3	56%	0.562	69%	0.692	S	S	*	*			cis	-170.7	138.5	-5.9	0	0	0	0	0	109.9
1099	E	36.3	Very low	32.1	Very low	143 Å²	143	135.7 Å²	135.7	67%	0.668	70%	0.699	S	S	*	*			trans	59.9	164.8	148	-48	-62.1	-162.2	0	0	120.3
1100	E	38.9	Very low	33.3	Very low	72 Å²	72	134 Å²	134	34%	0.336	70%	0.701	S	S	.	*			cis	-159.5	178	-9	-119	159.9	151.9	0	0	110.2	L827 H829 A830	L827-E1100 WeakPolarHBondContact CA-O 2.98Å; L827-E1100 PolarHBondContact N-O 2.89Å; H829-E1100 VanDerWaalsContact C-OE2 3.3Å; H829-E1100 WeakPolarHBondContact CA-OE2 3.03Å; H829-E1100 PolarHBondContact N-OE2 2.88Å; A830-E1100 PolarHBondContact N-OE1 2.85Å; A830-E1100 PolarHBondContact N-OE2 2.85Å
1101	E	44.9	Very low	33.8	Very low	156 Å²	156	133.8 Å²	133.8	73%	0.729	71%	0.707	S	S	*	*			trans	-106.7	-173.2	-165	-54.4	-102.9	53.7	0	0	115.8	S826 L827 Q828	S826-E1101 CarbonylContact O-C 3.48Å; L827-E1101 CarbonylContact C-O 3.56Å; Q828-E1101 PolarHBondContact N-O 3.05Å
1102	E	36.1	Very low	33.9	Very low	149 Å²	149	135 Å²	135	70%	0.696	71%	0.71	S	S	*	*			trans	98.7	141.7	168.2	-64.2	-96.4	110.8	0	0	118.7	S826	S826-E1102 WeakPolarHBondContact CB-O 3.43Å; S826-E1102 PolarHBondContact OG-O 3.01Å
1103	A	35.6	Very low	33.8	Very low	69 Å²	69	133 Å²	133	57%	0.57	71%	0.709	S	S	*	*			cis	-174.9	163.6	-9	0	0	0	0	0	116.4
1104	E	31.1	Very low	33.8	Very low	185 Å²	185	134.9 Å²	134.9	86%	0.864	72%	0.715	S	S	*	*			trans	84.5	161.8	142.7	-83	-65.5	149	0	0	126.9
1105	E	25.4	Very low	34	Very low	135 Å²	135	132 Å²	132	63%	0.631	71%	0.71	S	S	*	*			trans	-89.9	-159.7	-161.4	-130.9	-150.2	-176.5	0	0	114.7	R1107	E1105-R1107 IonicContact OE2-NE 3.52Å
1106	P	38.6	Very low	34.1	Very low	101 Å²	101	134.9 Å²	134.9	66%	0.656	72%	0.717	S	S	*	*			cis	-146.7	155.3	14.7	42.7	-19.9	0	0	0	122.4
1107	R	25.6	Very low	33.6	Very low	198 Å²	198	134.7 Å²	134.7	75%	0.747	72%	0.721	S	S	*	*			trans	66.7	140.3	131.4	-68.7	173.2	-174.3	-135.7	-4.7	128.4	E1105	E1105-R1107 IonicContact OE2-NE 3.52Å
1108	N	23	Very low	33.5	Very low	133 Å²	133	135.8 Å²	135.8	71%	0.711	72%	0.721	S	S	*	*			trans	93.2	98	132.7	-75.2	-8.6	0	0	0	126.4
1109	S	22.9	Very low	34	Very low	116 Å²	116	137.7 Å²	137.7	81%	0.811	73%	0.728	S	S	*	*				79.4	157.3	124.6	71.5	0	0	0	0	124.5
1110	P	53.2	Low	33.5	Very low	118 Å²	118	135.9 Å²	135.9	77%	0.766	73%	0.731	S	S	*	*			trans	-119.9	-179.3	-160.1	45	-33.7	0	0	0	117.5
1111	P	37.6	Very low	32.8	Very low	133 Å²	133	137.4 Å²	137.4	86%	0.864	75%	0.75	S	S	*	*				-148.6	-149.2	108.1	39.5	-20	0	0	0	116.9
1112	K	35.9	Very low	32.4	Very low	192 Å²	192	136 Å²	136	84%	0.835	75%	0.751	S	S	*	*			trans	-121.9	169.2	-157.2	-54.2	176	178.9	-179.6	0	116.7
1113	T	27.1	Very low	32.2	Very low	123 Å²	123	131.9 Å²	131.9	76%	0.755	75%	0.748	S	S	*	*			trans	132.6	122	132.8	63.5	0	0	0	0	121.5
1114	D	30.8	Very low	32	Very low	142 Å²	142	135.2 Å²	135.2	76%	0.759	76%	0.757	S	S	*	*				77.3	121.7	127.1	-65.4	-35.7	0	0	0	130.2
1115	V	34.1	Very low	32.2	Very low	124 Å²	124	134.2 Å²	134.2	75%	0.752	76%	0.757	S	S	*	*				94.8	144.8	120.1	165.6	0	0	0	0	126.4
1116	K	30.8	Very low	32.6	Very low	190 Å²	190	136.5 Å²	136.5	83%	0.826	77%	0.768	S	S	*	*			trans	93.7	154.7	157.9	-107	170.4	-178.7	172.9	0	119.4
1117	V	25.3	Very low	32.4	Very low	135 Å²	135	140.3 Å²	140.3	82%	0.818	78%	0.779	S	S	*	*			cis	-145.9	169.8	25.7	-170.9	0	0	0	0	114.7
1118	H	26.5	Very low	32.6	Very low	170 Å²	170	138.2 Å²	138.2	79%	0.787	78%	0.783	S	S	*	*			trans	-87.1	-163.3	174.9	-119.9	-117	0	0	0	113.6
1119	P	53.2	Low	32.6	Very low	108 Å²	108	140.7 Å²	140.7	70%	0.701	79%	0.788	S	S	*	*			cis	-131.8	161.6	-0.9	40.2	-22.4	0	0	0	117.8
1120	S	27.1	Very low	32.5	Very low	104 Å²	104	140.7 Å²	140.7	73%	0.727	79%	0.788	S	S	*	*				158.9	173.5	90.3	56.1	0	0	0	0	109.6
1121	S	23.2	Very low	31.1	Very low	105 Å²	105	143.3 Å²	143.3	73%	0.734	79%	0.79	S	S	*	*			cis	-161.2	154.4	-0	-135.5	0	0	0	0	114.5
1122	V	36.2	Very low	31	Very low	126 Å²	126	141.6 Å²	141.6	76%	0.764	78%	0.778	S	S	*	*			trans	-2.8	142.8	147.7	-167.7	0	0	0	0	119.9
1123	G	33	Very low	30.6	Very low	62 Å²	62	136.6 Å²	136.6	64%	0.639	77%	0.768	S	S	*	*			cis	145.2	179.6	6.7	0	0	0	0	0	112.1
1124	D	31.3	Very low	30.7	Very low	140 Å²	140	137 Å²	137	75%	0.749	77%	0.765	S	S	*	*			cis	-169.5	178.7	-14.6	-76.6	-40.7	0	0	0	110.2
1125	D	35.9	Very low	30.7	Very low	163 Å²	163	136.4 Å²	136.4	87%	0.872	76%	0.761	S	S	*	*			trans	91.2	151.5	153.2	-82.2	-30.8	0	0	0	128.3
1126	E	32.6	Very low	30.6	Very low	183 Å²	183	136.4 Å²	136.4	86%	0.855	76%	0.757	S	S	*	*			trans	82.6	160.5	165.6	-68.2	-87.8	91.2	0	0	122.2
1127	M	34.6	Very low	30.6	Very low	182 Å²	182	134 Å²	134	90%	0.897	75%	0.752	S	S	*	*			trans	-140.6	-179.4	-164.3	-64.9	-164.6	-76.7	0	0	114.9
1128	D	30	Very low	30.6	Very low	154 Å²	154	132.3 Å²	132.3	82%	0.824	75%	0.747	S	S	*	*			trans	101.1	173.7	159.6	-147.6	10.1	0	0	0	119.3
1129	F	22.6	Very low	30.5	Very low	185 Å²	185	128.7 Å²	128.7	81%	0.811	74%	0.74	S	S	*	*			trans	-70.5	160.5	-154.5	-103.5	-122	0	0	0	119.3
1130	S	22.1	Very low	29.4	Very low	115 Å²	115	133.1 Å²	133.1	80%	0.804	75%	0.748	S	S	*	*			trans	93.2	157.1	142.4	75.3	0	0	0	0	122.4
1131	E	23.4	Very low	29.4	Very low	174 Å²	174	133.4 Å²	133.4	81%	0.813	75%	0.745	S	S	*	*			trans	-56.9	171.3	173.8	-104.3	-165.9	108.1	0	0	114.9
1132	P	36.3	Very low	30.1	Very low	96 Å²	96	133.3 Å²	133.3	62%	0.623	75%	0.745	S	S	*	*			cis	-135.2	-179.1	1.2	36.6	-17.2	0	0	0	115.7
1133	S	25.9	Very low	29.9	Very low	88 Å²	88	132.4 Å²	132.4	62%	0.615	74%	0.741	S	S	*	*			trans	5.3	137.3	142.1	-53.5	0	0	0	0	119.5
1134	N	30.8	Very low	29.6	Very low	131 Å²	131	139.1 Å²	139.1	70%	0.701	75%	0.747	S	S	*	*				174.1	127	98.5	-90.3	-59.4	0	0	0	115.9
1135	L	29.7	Very low	29.4	Very low	129 Å²	129	141.4 Å²	141.4	68%	0.675	75%	0.746	S	S	*	*				64.4	136.5	127.1	-63.6	173.4	0	0	0	124.5
1136	N	31.9	Very low	28.8	Very low	124 Å²	124	142.5 Å²	142.5	66%	0.663	74%	0.739	S	S	*	*			trans	72.3	149	133.5	-69.4	-10.9	0	0	0	119.7
1137	L	31.8	Very low	28.4	Very low	139 Å²	139	138.3 Å²	138.3	73%	0.728	73%	0.729	S	S	*	*			cis	-155.7	151.7	-8.4	-104.4	157.6	0	0	0	105.3
1138	S	24.8	Very low	27.9	Very low	100 Å²	100	134.8 Å²	134.8	70%	0.699	71%	0.711	S	S	*	*			cis	-158.2	148.9	23.6	51.1	0	0	0	0	114.2
1139	C	24.9	Very low	27.8	Very low	94 Å²	94	134.6 Å²	134.6	64%	0.635	71%	0.705	S	S	*	*			trans	30	129.2	140.5	-51.2	0	0	0	0	120.3
1140	K	28.8	Very low	27.9	Very low	201 Å²	201	132.7 Å²	132.7	87%	0.874	70%	0.699	S	S	*	*			cis	-136.2	123.5	17.7	-59.3	170	-175.6	173.8	0	108.6
1141	T	27.3	Very low	28	Very low	110 Å²	110	134 Å²	134	68%	0.675	69%	0.692	S	S	*	*			cis	75.4	104.8	39	-42	0	0	0	0	110.5
1142	S	37.6	Very low	28	Very low	104 Å²	104	135 Å²	135	73%	0.727	70%	0.697	S	S	*	*			cis	72.2	146	36.1	-159.8	0	0	0	0	113.3
1143	P	32	Very low	27.3	Very low	106 Å²	106	134 Å²	134	69%	0.688	69%	0.692	S	S	*	*				-155.7	156.2	100	40.3	-22.3	0	0	0	118.2
1144	R	26.8	Very low	27.2	Very low	203 Å²	203	134.3 Å²	134.3	77%	0.766	69%	0.694	S	S	*	*			trans	64.8	155.7	152.1	-66.7	175.9	167	-152.9	-2.4	118.9
1145	R	27.3	Very low	27	Very low	189 Å²	189	137.3 Å²	137.3	71%	0.713	70%	0.701	S	S	*	*			cis	-161.5	148.1	-23.4	-102.4	176.5	179.7	-168.1	-2.7	104.8
1146	Y	23.9	Very low	26.6	Very low	186 Å²	186	136.8 Å²	136.8	73%	0.729	71%	0.708	S	S	*	*			cis	78.6	147.2	38.4	-160.8	-90.2	0	0	0	114.9
1147	S	23.8	Very low	26.4	Very low	94 Å²	94	135 Å²	135	66%	0.657	71%	0.711	S	S	*	*			trans	81.6	148	177.9	-69.7	0	0	0	0	118.5
1148	H	25.3	Very low	26.3	Very low	109 Å²	109	136.3 Å²	136.3	51%	0.505	72%	0.718	S	S	.	*			cis	-171.5	-172.7	-32	-152.7	-103.5	0	0	0	107.7	E1150	H1148-E1150 IonicContact CE1-OE2 3.6Å; H1148-E1150 PolarHBondContact CE1-OE2 3.49Å; H1148-E1150 IonicContact ND1-OE2 2.71Å
1149	E	26.1	Very low	26.4	Very low	150 Å²	150	137.3 Å²	137.3	70%	0.701	72%	0.715	S	S	*	*			trans	65.9	133.3	171.7	-16.8	-82.5	81.1	0	0	114.1
1150	E	26.4	Very low	26.7	Very low	145 Å²	145	140.8 Å²	140.8	68%	0.678	72%	0.722	S	S	*	*			cis	67.7	148	27	-47.3	173.3	126.6	0	0	113.7	H1148	H1148-E1150 IonicContact CE1-OE2 3.6Å; H1148-E1150 PolarHBondContact CE1-OE2 3.49Å; H1148-E1150 IonicContact ND1-OE2 2.71Å
1151	E	23.9	Very low	26.7	Very low	143 Å²	143	138.8 Å²	138.8	67%	0.668	72%	0.719	S	S	*	*			cis	-152.2	139.4	-29	-115.5	-162.5	170.8	0	0	108.9
1152	Q	23.4	Very low	26.8	Very low	194 Å²	194	140.5 Å²	140.5	91%	0.907	72%	0.719	S	S	*	*			trans	-170.1	94	160.7	-110	142.4	91.1	0	0	106.2
1153	S	22.2	Very low	26.5	Very low	74 Å²	74	143.9 Å²	143.9	52%	0.517	72%	0.716	S	S	.	*			cis	60.9	100.9	30	-166.7	0	0	0	0	113.4
1154	S	23.1	Very low	26.3	Very low	95 Å²	95	146.6 Å²	146.6	66%	0.664	72%	0.717	S	S	*	*			trans	89.3	144.6	151.2	-52.3	0	0	0	0	121.2
1155	F	25.8	Very low	26.6	Very low	195 Å²	195	141.7 Å²	141.7	86%	0.855	71%	0.714	S	S	*	*			trans	61.7	91.3	163.2	-62.7	-69.8	0	0	0	121.4
1156	S	22.3	Very low	26.5	Very low	118 Å²	118	140 Å²	140	83%	0.825	72%	0.719	S	S	*	*				29.1	111.1	107.4	169.8	0	0	0	0	118.9
1157	A	27.7	Very low	26.5	Very low	87 Å²	87	137 Å²	137	72%	0.719	72%	0.715	S	S	*	*			trans	-156.7	129.9	145.3	0	0	0	0	0	112.5
1158	L	29.6	Very low	26.7	Very low	165 Å²	165	142.6 Å²	142.6	86%	0.864	72%	0.722	S	S	*	*			trans	60.8	131.8	156.6	-64.1	160.9	0	0	0	118.3
1159	D	27.1	Very low	26.6	Very low	121 Å²	121	145.7 Å²	145.7	65%	0.647	73%	0.734	S	S	*	*			cis	-149.2	164.5	-0.1	-168.4	25.6	0	0	0	112.3
1160	Q	30.4	Very low	26.5	Very low	168 Å²	168	145.8 Å²	145.8	79%	0.785	74%	0.736	S	S	*	*			trans	58.8	80.8	166.8	-76.5	165.4	62.5	0	0	118.3
1161	I	29.5	Very low	26.4	Very low	158 Å²	158	145.2 Å²	145.2	81%	0.81	73%	0.734	S	S	*	*			trans	-94.7	126.2	140.7	-61.5	173.7	0	0	0	108.1
1162	H	29.5	Very low	26.4	Very low	146 Å²	146	146 Å²	146	68%	0.676	74%	0.737	S	S	*	*			trans	-168.1	116.6	142.1	-104.8	-159.1	0	0	0	108.6
1163	R	30.4	Very low	26.5	Very low	176 Å²	176	140.7 Å²	140.7	66%	0.664	72%	0.721	S	S	*	*				75.2	137.1	89.2	-74.7	-176.3	-179	-162.7	1.4	113
1164	F	28.6	Very low	26.8	Very low	162 Å²	162	144.8 Å²	144.8	71%	0.711	73%	0.732	S	S	*	*			cis	-154.7	170.8	1.6	-120.6	-36.1	0	0	0	111
1165	S	32.3	Very low	27	Very low	100 Å²	100	146.6 Å²	146.6	70%	0.699	73%	0.734	S	S	*	*			trans	-59.1	151	163.5	-31.7	0	0	0	0	111.5
1166	D	25.1	Very low	27	Very low	153 Å²	153	141.9 Å²	141.9	82%	0.818	73%	0.725	S	S	*	*				-163	174.5	121.8	-127.4	-33.2	0	0	0	116.5
1167	L	24.6	Very low	27.3	Very low	124 Å²	124	143.2 Å²	143.2	65%	0.649	72%	0.723	S	S	*	*			trans	-64.5	153.7	-173.8	-74.7	161.9	0	0	0	119.2
1168	R	27.2	Very low	27.6	Very low	211 Å²	211	149 Å²	149	80%	0.796	73%	0.726	S	S	*	*			trans	80.8	129	136.3	-75.8	159.7	-172.5	-152.6	2.9	122.7
1169	K	24.1	Very low	27.7	Very low	175 Å²	175	147.7 Å²	147.7	76%	0.761	72%	0.72	S	S	*	*			trans	70.8	152.4	131.9	-84	-166.9	167.6	-163.4	0	120.6
1170	M	23.8	Very low	28	Very low	151 Å²	151	144.9 Å²	144.9	74%	0.744	72%	0.72	S	S	*	*			trans	66.9	168.4	154.2	-75.5	156.8	114.1	0	0	114.4
1171	E	24.4	Very low	28.2	Very low	134 Å²	134	145.1 Å²	145.1	63%	0.626	73%	0.727	S	S	*	*			cis	-178.6	141.2	-32.9	177.1	154	-139.3	0	0	105.1
1172	E	24.2	Very low	28.4	Very low	159 Å²	159	140.7 Å²	140.7	74%	0.743	72%	0.72	S	S	*	*			trans	62.9	138.3	177.3	-66.2	168.8	148.9	0	0	113.8
1173	S	25.4	Very low	28.7	Very low	82 Å²	82	142 Å²	142	57%	0.573	73%	0.732	S	S	*	*			cis	74.2	128	41.8	75.4	0	0	0	0	115.3
1174	E	27.1	Very low	29.1	Very low	160 Å²	160	136.8 Å²	136.8	75%	0.748	73%	0.733	S	S	*	*			trans	71.9	156.7	177	-55.2	-158.5	146.9	0	0	114.3
1175	L	28.9	Very low	29.8	Very low	134 Å²	134	136 Å²	136	70%	0.702	74%	0.736	S	S	*	*			cis	-160.9	151.4	-22.3	-110.2	170.1	0	0	0	108.1
1176	S	24.4	Very low	30.6	Very low	96 Å²	96	140.4 Å²	140.4	67%	0.671	75%	0.746	S	S	*	*			trans	55.3	176.4	160.4	72.4	0	0	0	0	116.7
1177	D	30.1	Very low	31.3	Very low	145 Å²	145	140.1 Å²	140.1	78%	0.775	74%	0.744	S	S	*	*			cis	-134	176.4	4.7	-102.6	-59.2	0	0	0	112.6
1178	R	33	Very low	31.8	Very low	209 Å²	209	140 Å²	140	79%	0.789	74%	0.744	S	S	*	*			trans	-83.8	169.5	174.4	-52.4	163.6	98.1	-123.2	15.3	109.8
1179	D	31.7	Very low	32.1	Very low	138 Å²	138	133 Å²	133	74%	0.738	74%	0.738	S	S	*	*				177.3	167.8	66.7	-86.6	-50	0	0	0	108.8
1180	G	32.9	Very low	32.5	Very low	62 Å²	62	128.4 Å²	128.4	64%	0.639	73%	0.728	S	S	*	*			trans	140.4	95	165	0	0	0	0	0	116.3
1181	D	35.4	Very low	32.8	Very low	173 Å²	173	130.3 Å²	130.3	93%	0.925	73%	0.732	S	S	*	*			trans	47.3	139.8	144.8	-40.8	-34.8	0	0	0	121.3
1182	G	34.1	Very low	32.9	Very low	65 Å²	65	128.1 Å²	128.1	67%	0.67	74%	0.737	S	S	*	*			cis	171.3	151.3	-3.3	0	0	0	0	0	111.1
1183	D	35.1	Very low	33.4	Very low	172 Å²	172	126 Å²	126	92%	0.92	74%	0.74	S	S	*	*			trans	51.2	125.6	176.1	-50.9	-20.9	0	0	0	117.6
1184	G	39.4	Very low	34.7	Very low	67 Å²	67	127.5 Å²	127.5	69%	0.691	75%	0.748	S	S	*	*			cis	-174	-167.2	6.4	0	0	0	0	0	109.1
1185	D	41.7	Very low	35	Very low	146 Å²	146	125.4 Å²	125.4	78%	0.781	75%	0.751	S	S	*	*			cis	-159.4	165.1	-3.2	-78.3	-47.2	0	0	0	110.6
1186	E	49.9	Very low	35.3	Very low	192 Å²	192	126.7 Å²	126.7	90%	0.897	76%	0.758	S	S	*	*			trans	27.6	137.2	154.3	-61.6	179.8	179.5	0	0	123.2
1187	D	39.4	Very low	35.7	Very low	148 Å²	148	126.1 Å²	126.1	79%	0.791	76%	0.759	S	S	*	*			cis	-178.8	149.8	-11.3	177.4	61.1	0	0	0	108.3
1188	D	34.8	Very low	35.9	Very low	120 Å²	120	128.1 Å²	128.1	64%	0.642	76%	0.76	S	S	*	*			cis	-104.7	-139.7	-20.1	-171.5	22.3	0	0	0	106.9	S1190	D1188-S1190 WeakPolarHBondContact OD2-CB 3.41Å; D1188-S1190 PolarHBondContact OD2-N 3.22Å
1189	G	34.3	Very low	36	Very low	65 Å²	65	122.5 Å²	122.5	67%	0.67	76%	0.758	S	S	*	*			cis	85.7	171.2	-2.1	0	0	0	0	0	116.7
1190	S	33.4	Very low	35.9	Very low	79 Å²	79	123 Å²	123	55%	0.552	77%	0.766	S	S	*	*			cis	-158.6	170	-8.6	-151.2	0	0	0	0	107.9	D1188	D1188-S1190 WeakPolarHBondContact OD2-CB 3.41Å; D1188-S1190 PolarHBondContact OD2-N 3.22Å
1191	F	28.2	Very low	35.8	Very low	190 Å²	190	128.9 Å²	128.9	83%	0.833	77%	0.774	S	S	*	*			cis	-154.7	172	24.6	-61.7	-91.1	0	0	0	108
1192	A	26.6	Very low	35.8	Very low	88 Å²	88	129.2 Å²	129.2	73%	0.727	77%	0.77	S	S	*	*			cis	-168.3	172.7	-26.5	0	0	0	0	0	109.3
1193	S	35.1	Very low	36.3	Very low	115 Å²	115	131.4 Å²	131.4	80%	0.804	77%	0.772	S	S	*	*			trans	-94.3	-149.7	-166.9	-38.6	0	0	0	0	113.5
1194	P	53	Low	35.9	Very low	113 Å²	113	130 Å²	130	73%	0.734	77%	0.765	S	S	*	*			cis	-144.7	-169	-0	43.1	-21.7	0	0	0	118.9
1195	S	34.3	Very low	35.3	Very low	116 Å²	116	135.2 Å²	135.2	81%	0.811	77%	0.768	S	S	*	*			trans	94.6	147.8	150.1	79.4	0	0	0	0	121.4
1196	L	34.9	Very low	34.8	Very low	162 Å²	162	137.5 Å²	137.5	85%	0.848	77%	0.766	S	S	*	*			cis	-169.4	132.3	-19.3	170.8	144.3	0	0	0	115.9
1197	A	32.6	Very low	33.8	Very low	84 Å²	84	137.2 Å²	137.2	69%	0.694	76%	0.762	S	S	*	*			trans	56.7	141.3	146.1	0	0	0	0	0	130.4
1198	K	33.6	Very low	33.4	Very low	187 Å²	187	135.1 Å²	135.1	81%	0.813	76%	0.758	S	S	*	*			trans	91.9	104.1	131.4	-92.2	-174.4	175.1	-173.4	0	127.2
1199	A	34.5	Very low	33.4	Very low	90 Å²	90	138.4 Å²	138.4	74%	0.744	77%	0.767	S	S	*	*				77.3	156.2	114.7	0	0	0	0	0	127.4
1200	V	30	Very low	33.2	Very low	148 Å²	148	140 Å²	140	90%	0.897	77%	0.768	S	S	*	*			trans	119.7	152.6	158.6	-177.5	0	0	0	0	117.9
1201	K	32.2	Very low	33.1	Very low	186 Å²	186	144.9 Å²	144.9	81%	0.809	78%	0.782	S	S	*	*			trans	-106.3	170.5	-161.2	-63.1	174.7	-180	170	0	115.9
1202	Q	35.3	Very low	33.3	Very low	180 Å²	180	140 Å²	140	84%	0.841	78%	0.777	S	S	*	*			trans	-74.2	176	176.5	-55.5	-173.3	-6.6	0	0	115.2
1203	P	43.7	Very low	33.5	Very low	111 Å²	111	146.8 Å²	146.8	72%	0.721	79%	0.785	S	S	*	*				-150.4	152.6	92	38.9	-21.5	0	0	0	118.7
1204	L	27.8	Very low	33.3	Very low	144 Å²	144	145 Å²	145	75%	0.754	78%	0.777	S	S	*	*			trans	44.9	132.8	143.5	-58.4	170.1	0	0	0	121.9
1205	F	26	Very low	32.4	Very low	175 Å²	175	148.3 Å²	148.3	77%	0.768	79%	0.785	S	S	*	*				-170.6	171.2	110.4	-121.5	-111.7	0	0	0	116.4
1206	R	31.3	Very low	32.5	Very low	195 Å²	195	150.4 Å²	150.4	74%	0.736	78%	0.784	S	S	*	*			trans	-59.3	150.7	-166.4	-64.2	172.5	174.6	162.7	-2.7	120.1
1207	K	28	Very low	32.6	Very low	186 Å²	186	149.7 Å²	149.7	81%	0.809	78%	0.78	S	S	*	*				55.8	126.5	129.8	-69.7	-171.6	173.6	-170.5	0	122.2
1208	S	31.6	Very low	32.9	Very low	103 Å²	103	150.4 Å²	150.4	72%	0.72	78%	0.78	S	S	*	*				71.7	119.8	124.3	76.1	0	0	0	0	122.9
1209	K	34.2	Very low	33	Very low	190 Å²	190	150.3 Å²	150.3	83%	0.826	79%	0.788	S	S	*	*				77.7	114.7	123.1	-159.8	-178.3	-178.9	-179.3	0	119.3
1210	S	31.7	Very low	33.3	Very low	99 Å²	99	150.1 Å²	150.1	69%	0.692	79%	0.786	S	S	*	*			trans	71.5	144.7	145.7	65	0	0	0	0	122.3
1211	Q	30.1	Very low	33.5	Very low	180 Å²	180	150.3 Å²	150.3	84%	0.841	78%	0.777	S	S	*	*			trans	92.8	86.8	143.3	-152.7	163.2	18.5	0	0	119.7
1212	A	33.4	Very low	33.4	Very low	87 Å²	87	148.1 Å²	148.1	72%	0.719	77%	0.768	S	S	*	*				41.3	143.4	125.2	0	0	0	0	0	123.5
1213	Y	30	Very low	33.3	Very low	232 Å²	232	145.1 Å²	145.1	91%	0.91	76%	0.758	S	S	*	*			trans	101.9	147.3	143.9	-121	-101.4	0	0	0	120.5
1214	A	32	Very low	32.7	Very low	77 Å²	77	144.3 Å²	144.3	64%	0.636	76%	0.755	S	S	*	*			trans	67.5	100.8	163.4	0	0	0	0	0	122
1215	M	33.6	Very low	32.9	Very low	182 Å²	182	144.2 Å²	144.2	90%	0.897	75%	0.754	S	S	*	*				31.4	129.5	114.4	-61.5	175.8	156.4	0	0	121.1
1216	M	35.9	Very low	33.1	Very low	160 Å²	160	144.3 Å²	144.3	79%	0.788	76%	0.756	S	S	*	*				163.9	165.4	109.9	-93.5	-94.7	-83.1	0	0	114.8
1217	L	37.8	Very low	32.8	Very low	147 Å²	147	140.9 Å²	140.9	77%	0.77	76%	0.763	S	S	*	*			trans	75.7	139.9	170.2	-48.7	-178.7	0	0	0	117
1218	S	38.4	Very low	32.9	Very low	100 Å²	100	136 Å²	136	70%	0.699	76%	0.756	S	S	*	*			cis	147.5	132.2	-25.3	-88.6	0	0	0	0	108.7
1219	L	36.1	Very low	33.3	Very low	185 Å²	185	135.7 Å²	135.7	97%	0.969	75%	0.752	S	S	*	*			trans	-179.5	162.7	137.1	-97.6	168.2	0	0	0	110.3
1220	A	39.6	Very low	33.2	Very low	86 Å²	86	134.9 Å²	134.9	71%	0.711	75%	0.751	S	S	*	*			trans	-153	-169.7	-166.1	0	0	0	0	0	113.8
1221	E	34.5	Very low	33.1	Very low	151 Å²	151	136.4 Å²	136.4	71%	0.706	76%	0.756	S	S	*	*			trans	83.3	144.6	179.3	-53.1	-78.6	70.5	0	0	114.9
1222	K	29.8	Very low	33.8	Very low	140 Å²	140	133.8 Å²	133.8	61%	0.609	76%	0.755	S	S	*	*			cis	-158.4	161.6	-2.2	-128.7	-179.5	165	39.6	0	117.3
1223	D	33.1	Very low	33.6	Very low	118 Å²	118	133.4 Å²	133.4	63%	0.631	75%	0.752	S	S	*	*			trans	13.5	148.6	137.7	-80.5	-56.8	0	0	0	122.2
1224	S	30.9	Very low	33.6	Very low	94 Å²	94	128.7 Å²	128.7	66%	0.657	75%	0.748	S	S	*	*			cis	-168.7	-179.2	-2.5	-132.6	0	0	0	0	113.9
1225	L	32	Very low	33.5	Very low	141 Å²	141	132.2 Å²	132.2	74%	0.738	75%	0.753	S	S	*	*			trans	101	102.4	158.9	-54.5	-169.8	0	0	0	121.9
1226	H	30.1	Very low	33.3	Very low	177 Å²	177	133.5 Å²	133.5	82%	0.819	75%	0.748	S	S	*	*			trans	78.9	124	133.6	-74.5	-57.9	0	0	0	125.3
1227	S	26.3	Very low	33	Very low	124 Å²	124	133.1 Å²	133.1	87%	0.867	74%	0.743	S	S	*	*			trans	104.7	140.4	142.4	-153.1	0	0	0	0	118.4
1228	A	28.8	Very low	32.5	Very low	82 Å²	82	130.7 Å²	130.7	68%	0.678	74%	0.739	S	S	*	*			trans	-97.7	-175.8	-172.7	0	0	0	0	0	109.8
1229	P	41.8	Very low	32.1	Very low	98 Å²	98	133.5 Å²	133.5	64%	0.636	75%	0.745	S	S	*	*			cis	-144.3	-178.1	17.1	23.7	5.2	0	0	0	118.7
1230	H	30.6	Very low	31.7	Very low	173 Å²	173	129.1 Å²	129.1	80%	0.801	74%	0.736	S	S	*	*			trans	106.4	121.8	157.7	-54.1	-65.3	0	0	0	119.3
1231	T	30	Very low	31.2	Very low	130 Å²	130	136.5 Å²	136.5	80%	0.798	75%	0.745	S	S	*	*			trans	-55.6	158.8	172.2	42.5	0	0	0	0	114.7
1232	P	45.2	Very low	31.1	Very low	125 Å²	125	133.6 Å²	133.6	81%	0.812	75%	0.747	S	S	*	*			cis	-149.3	-167.1	46.5	42.8	-21.9	0	0	0	118.3
1233	A	28.5	Very low	31	Very low	80 Å²	80	131.4 Å²	131.4	66%	0.661	76%	0.755	S	S	*	*			trans	101.7	101.1	155.9	0	0	0	0	0	121
1234	T	30.2	Very low	30.9	Very low	133 Å²	133	130.3 Å²	130.3	82%	0.816	76%	0.762	S	S	*	*			trans	79.7	155.1	134.8	68	0	0	0	0	123.5
1235	M	30.1	Very low	30.8	Very low	151 Å²	151	134.4 Å²	134.4	74%	0.744	77%	0.771	S	S	*	*			trans	94.5	91.5	150.1	-66	-103.8	-90.3	0	0	121.7
1236	W	29	Very low	30.8	Very low	209 Å²	209	132.5 Å²	132.5	79%	0.792	77%	0.77	S	S	*	*			trans	60	152.8	151.1	-50.2	83.6	0	0	0	118.9
1237	H	30.6	Very low	30.7	Very low	151 Å²	151	129.9 Å²	129.9	70%	0.699	77%	0.771	S	S	*	*			cis	-160.8	160.1	29.9	-112.8	-65.5	0	0	0	112.9
1238	S	27.1	Very low	31.1	Very low	96 Å²	96	128.5 Å²	128.5	67%	0.671	77%	0.767	S	S	*	*			trans	81.2	142.8	141.5	-69.3	0	0	0	0	124.9
1239	L	29.1	Very low	31.4	Very low	160 Å²	160	132.1 Å²	132.1	84%	0.838	77%	0.774	S	S	*	*			trans	59.1	98.4	155.7	-87.8	78.6	0	0	0	122.3
1240	A	28.3	Very low	30.9	Very low	93 Å²	93	135.5 Å²	135.5	77%	0.769	78%	0.781	S	S	*	*				46.9	126	116.8	0	0	0	0	0	123
1241	R	30	Very low	30.9	Very low	241 Å²	241	131.6 Å²	131.6	91%	0.909	77%	0.773	S	S	*	*				127.2	137.8	125.1	-162.4	-168.4	-63	175.5	0.6	116.1
1242	A	31	Very low	31	Very low	90 Å²	90	133.3 Å²	133.3	74%	0.744	78%	0.777	S	S	*	*			trans	91.8	135.9	154.7	0	0	0	0	0	121.2
1243	A	28.6	Very low	30.2	Very low	94 Å²	94	132.5 Å²	132.5	78%	0.777	77%	0.774	S	S	*	*			trans	49.8	110.5	148	0	0	0	0	0	119.6
1244	A	30.8	Very low	30.4	Very low	94 Å²	94	136.4 Å²	136.4	78%	0.777	78%	0.778	S	S	*	*				103.8	159.6	83.5	0	0	0	0	0	109.9
1245	E	29	Very low	30.7	Very low	180 Å²	180	139.9 Å²	139.9	84%	0.841	80%	0.799	S	S	*	*			cis	-135.7	171.9	17.1	-61.8	-178.8	133.5	0	0	113.3
1246	S	31.7	Very low	30.7	Very low	102 Å²	102	139.4 Å²	139.4	71%	0.713	80%	0.802	S	S	*	*			trans	20.5	125.1	147.5	-58.7	0	0	0	0	120.9
1247	S	28.3	Very low	30.8	Very low	121 Å²	121	135.7 Å²	135.7	85%	0.846	80%	0.802	S	S	*	*				66.1	131.9	72.8	-59.2	0	0	0	0	114.5
1248	A	34.1	Very low	30.8	Very low	96 Å²	96	134.8 Å²	134.8	79%	0.793	81%	0.808	S	S	*	*			cis	-132.2	-130	1.2	0	0	0	0	0	111.5
1249	I	34.8	Very low	31	Very low	158 Å²	158	137.1 Å²	137.1	81%	0.81	82%	0.816	S	S	*	*			cis	-138.3	160.9	12.1	-55.8	171	0	0	0	109.5
1250	Q	32	Very low	31.2	Very low	168 Å²	168	135.7 Å²	135.7	79%	0.785	81%	0.814	S	S	*	*			trans	-59.2	149.5	171	-75.4	158.6	-52.7	0	0	113.5
1251	S	30.7	Very low	31.4	Very low	92 Å²	92	138.5 Å²	138.5	64%	0.643	82%	0.817	S	S	*	*			cis	98.1	167.7	34.4	90.4	0	0	0	0	114.9
1252	L	32.3	Very low	31.5	Very low	166 Å²	166	131.2 Å²	131.2	87%	0.869	81%	0.811	S	S	*	*			trans	75.3	151.8	-168.9	-80.7	79.6	0	0	0	115.5
1253	S	29.1	Very low	31.5	Very low	108 Å²	108	134.4 Å²	134.4	76%	0.755	82%	0.816	S	S	*	*			cis	-139.4	158.9	4.6	54.2	0	0	0	0	113.9
1254	H	31.1	Very low	31.7	Very low	162 Å²	162	137.8 Å²	137.8	75%	0.75	82%	0.819	S	S	*	*			trans	-51	143.3	164.9	-87.3	-88.7	0	0	0	114.2
1255	V	36.9	Very low	31.8	Very low	206 Å²	206	141.7 Å²	141.7	100%	1.248	82%	0.823	S	S	*	*				-123	0	108.5	175	0	0	0	0	107.1

Retrieved 1,255 of 1,255 residues in 742.4 ms (Link to these results)

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