A0A087XM18_POEFO Loading...

Protein cramped-like

AlphaFold DB , UniProt , Accession A0A087XM18, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,183 aa.

						>A0A087XM18_POEFO|A0A087XM18
MTPGSREGIGVDGKPNPSRRLEGCDEEESGEQASDERSTKGEERVEILNPSATGPSSGPAPVLPGSPPDRTGTGSNQQPQSSAESTPPCHDQHHFLRSSVRPPSKRIRKDSIGSTINGHGGAKSKGAENGSSSHGAVGQSVASSTGGVSKTPKGGQGPAEKEEQGGNQKRARRQWESWSAEDKNSFFEGLYEHGKDFEAIQNNIAMKYKKRGKPANMVKNKEQVRHFYYRTWHKISKHIDFANVYSRVLKKSSQELYGLICYAELRKKVGGLMDEKNVAKLNELIQQGATTVRSKGRNLRIKAPMCRALKKLCDPDGVSDEEDQKPVRLPLKVAVELQPRSNHSWARVQSLAYNPRLRMVVELHRKVSCLIEYLKQKWAYQDQRILKSLMEREALEGGSSSSSPDSRNKAQQQELTLFPAESSTLTTLPGVARVVHSKASCTVHWLESGKSRPNAKELPAVQILGIQSAPPPRGGNKSGRGGSTAAAANASMAIQADARRTEPPNPEPSPDGSGKVEEKKPPSVSVSCQQTEEGNGTGSTEAGPEVNGGAETQSEQCKEEQQSGGSSSDLTQAPSAKPTATSSEESASQGAAPPAKERSVEQIREEGWSARDAENVTLAELYLMFGKPGKLQLEYEWQPTAAPSGNQENGQEAPKPNRTHRVLRCLLKLVSTEINPKPLAPEVCSTATSPLKAGPDEQNQTLTPPGKSPVAGVRSPSFARQQASVRGTRTHPPNAAAAASGGRNLPRSLLGSPGDGEGSVFAVPTTLPPNSSRHSRMFSPNKEAQLAFRQQLDSISMQSDLFLSRQRKPRNRQLRKPLVVQRTLLPRTTGDTPQHVCSFSILSNSSATGTGSFRPINTRLAPTSRPPMTKTSPPASSSAAPSQLSSAIDLAAKSAGIIPGSPCRDLDSLAVNAAVLAATPIVDAAPDAQLLQQNVPEVRRTDAINVQTGLKILSFFHFSLLFVPYVLTFVHCLFTVSYRNGLPPPSPGGAGSGDSLLSPPSVASLLDISLPGPPEEALTPGEPQTHISDSIIELAINSTNYGEEAALSPAKLGNGDPSKLLASSPSVSPSRGWIPSPSHDPQWYPSDSSDSTLGCLLSSMVSPDKSRRTTLTPSGPSSGTALLGPSLLDCNSHDSFQSRGLPDVAEMDTQLACMMSESSVDYIARFNDLAQELAVTEPSIPPP
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.3	Very low	35	Very low	240 Å²	240	134.5 Å²	134.5	100%	1.182	80%	0.803	S	S	*	*				0	152.9	0	-61.3	106.1	77.7	0	0	109.1
2	T	38.8	Very low	34.7	Very low	134 Å²	134	137.2 Å²	137.2	82%	0.822	81%	0.81	S	S	*	*			trans	-73.2	172.2	152	23.1	0	0	0	0	109.7
3	P	50.9	Low	34.4	Very low	122 Å²	122	132.7 Å²	132.7	79%	0.792	81%	0.811	S	S	*	*			cis	-121.2	-165.4	10.2	44.9	-30.1	0	0	0	111.9
4	G	35.4	Very low	34.5	Very low	63 Å²	63	137.6 Å²	137.6	65%	0.649	82%	0.815	S	S	*	*			cis	112.5	101.1	-8.9	0	0	0	0	0	115.7
5	S	35.3	Very low	34.7	Very low	121 Å²	121	136.3 Å²	136.3	85%	0.846	81%	0.812	S	S	*	*			trans	160.7	166.1	159.7	-82.5	0	0	0	0	111.2
6	R	36.4	Very low	34.5	Very low	189 Å²	189	137.3 Å²	137.3	71%	0.713	81%	0.812	S	S	*	*			cis	-179.2	144	-31.6	-173.9	178.7	165.2	-162.4	-20.8	108.5
7	E	33.2	Very low	35.3	Very low	154 Å²	154	135.8 Å²	135.8	72%	0.72	81%	0.807	S	S	*	*			trans	61.4	156.3	167.4	-79.2	138.7	-172.4	0	0	118.8
8	G	33.4	Very low	35	Very low	59 Å²	59	134.1 Å²	134.1	61%	0.608	80%	0.803	S	S	*	*			cis	165.9	164.2	-10.4	0	0	0	0	0	113.9
9	I	32.3	Very low	34.8	Very low	186 Å²	186	140.5 Å²	140.5	95%	0.954	81%	0.812	S	S	*	*			trans	71.6	139.8	170.1	-47	163.9	0	0	0	114.3
10	G	29.4	Very low	34.7	Very low	62 Å²	62	143.2 Å²	143.2	64%	0.639	81%	0.808	S	S	*	*			cis	169.4	-165.3	-5.2	0	0	0	0	0	112.2
11	V	32.6	Very low	34.6	Very low	150 Å²	150	143.8 Å²	143.8	91%	0.909	81%	0.808	S	S	*	*			trans	86	138.4	170.6	-170.4	0	0	0	0	118.2
12	D	31.7	Very low	34.5	Very low	166 Å²	166	139 Å²	139	89%	0.888	78%	0.783	S	S	*	*			trans	-75.2	160.7	178.9	-83.1	-87	0	0	0	115.2
13	G	30.8	Very low	34.1	Very low	79 Å²	79	135.3 Å²	135.3	81%	0.814	77%	0.772	S	S	*	*			trans	-177.5	104.5	168.4	0	0	0	0	0	114.9
14	K	35.2	Very low	33.1	Very low	201 Å²	201	135.1 Å²	135.1	87%	0.874	77%	0.772	S	S	*	*			trans	-154	115.1	167.7	-166.8	176.3	-172.8	177.4	0	110.6
15	P	38.3	Very low	32.8	Very low	119 Å²	119	138 Å²	138	77%	0.773	77%	0.773	S	S	*	*				-148.4	159.9	119.6	39.3	-24.2	0	0	0	115.5
16	N	31.4	Very low	32.8	Very low	151 Å²	151	140.2 Å²	140.2	81%	0.807	77%	0.77	S	S	*	*			trans	-82.5	166.1	153.6	-76	-0.6	0	0	0	108.2
17	P	48.4	Very low	32.6	Very low	113 Å²	113	139.5 Å²	139.5	73%	0.734	78%	0.775	S	S	*	*			cis	-153.5	178.6	32.2	40.6	-17.5	0	0	0	119.7
18	S	30.1	Very low	32.3	Very low	105 Å²	105	141 Å²	141	73%	0.734	78%	0.781	S	S	*	*			trans	59.5	129.3	140.4	63.6	0	0	0	0	123.7
19	R	30.3	Very low	32.1	Very low	256 Å²	256	143.8 Å²	143.8	97%	0.966	79%	0.792	S	S	*	*			trans	-143.9	170.1	134.1	-115.3	-179.7	-174.2	-179.9	1.8	110.6
20	R	32.2	Very low	31.8	Very low	193 Å²	193	137.8 Å²	137.8	73%	0.728	78%	0.775	S	S	*	*			trans	-145.7	-160.8	-170	-146.7	-167.4	-164.7	-110	9.3	110	E22	R20-E22 IonicContact CZ-OE1 2.71Å; R20-E22 VanDerWaalsContact NH1-CD 3.33Å; R20-E22 IonicContact NH1-OE1 2.61Å; R20-E22 PolarHBondContact NH1-OE1 3.29Å; R20-E22 IonicContact NH1-OE2 3.78Å; R20-E22 PolarHBondContact NH1-OE2 2.71Å; R20-E22 VanDerWaalsContact NH1-OE2 3.13Å
21	L	33.9	Very low	31.8	Very low	157 Å²	157	143.8 Å²	143.8	82%	0.822	79%	0.787	S	S	*	*			trans	79.8	139.3	-166.8	-64.8	70.5	0	0	0	112.5
22	E	25.4	Very low	31.6	Very low	138 Å²	138	144.4 Å²	144.4	65%	0.645	78%	0.78	S	S	*	*			cis	-171	-172.8	-37.1	-121.4	45	-87.2	0	0	105.6	R20	R20-E22 IonicContact CZ-OE1 2.71Å; R20-E22 VanDerWaalsContact NH1-CD 3.33Å; R20-E22 IonicContact NH1-OE1 2.61Å; R20-E22 PolarHBondContact NH1-OE1 3.29Å; R20-E22 IonicContact NH1-OE2 3.78Å; R20-E22 PolarHBondContact NH1-OE2 2.71Å; R20-E22 VanDerWaalsContact NH1-OE2 3.13Å
23	G	30.6	Very low	31.6	Very low	58 Å²	58	141.2 Å²	141.2	60%	0.598	78%	0.777	S	S	*	*			cis	168.2	159.4	6.9	0	0	0	0	0	110.5
24	C	28.4	Very low	31.8	Very low	117 Å²	117	142 Å²	142	79%	0.791	77%	0.77	S	S	*	*			trans	68.1	158.3	165	-54.6	0	0	0	0	121.2
25	D	30.2	Very low	31.8	Very low	125 Å²	125	139.8 Å²	139.8	67%	0.668	77%	0.767	S	S	*	*			cis	-167.7	159.4	-41.2	-90.1	-29.4	0	0	0	110.7
26	E	34.1	Very low	31.7	Very low	166 Å²	166	141 Å²	141	78%	0.776	76%	0.763	S	S	*	*			trans	38.1	154.6	138.3	-60.9	177.4	161.4	0	0	122.4
27	E	32.2	Very low	31.7	Very low	175 Å²	175	143.5 Å²	143.5	82%	0.818	76%	0.761	S	S	*	*			cis	-163.5	-161.2	-8.2	-121.7	-163.8	158.1	0	0	112.3
28	E	28.7	Very low	31.1	Very low	184 Å²	184	142.9 Å²	142.9	86%	0.86	76%	0.759	S	S	*	*			trans	80.2	117.8	160.4	-146.5	163.6	-168.7	0	0	117.7
29	S	27.2	Very low	31.1	Very low	119 Å²	119	143.6 Å²	143.6	83%	0.832	76%	0.759	S	S	*	*				74.2	139.3	63.6	-148.7	0	0	0	0	114.9
30	G	27.1	Very low	31.2	Very low	59 Å²	59	140.4 Å²	140.4	61%	0.608	75%	0.752	S	S	*	*			cis	175.3	157.2	-6.8	0	0	0	0	0	113.3
31	E	29.4	Very low	31.1	Very low	188 Å²	188	134.5 Å²	134.5	88%	0.879	75%	0.751	S	S	*	*			trans	61	166.7	169.2	-49.2	-163.2	96.6	0	0	117.4
32	Q	27.5	Very low	30.9	Very low	164 Å²	164	135.6 Å²	135.6	77%	0.766	75%	0.752	S	S	*	*			cis	-157.9	138.6	13	-159.4	174.9	37	0	0	112.9
33	A	32.9	Very low	30.8	Very low	99 Å²	99	137.7 Å²	137.7	82%	0.818	76%	0.762	S	S	*	*			trans	51.9	158.9	156.4	0	0	0	0	0	121.3
34	S	33.6	Very low	30.7	Very low	96 Å²	96	144.9 Å²	144.9	67%	0.671	77%	0.771	S	S	*	*			cis	-150.4	144.9	4.5	54.3	0	0	0	0	112.5
35	D	35.1	Very low	30.8	Very low	153 Å²	153	143.3 Å²	143.3	82%	0.818	76%	0.758	S	S	*	*			trans	41.4	135.6	145.8	-58.8	-60.7	0	0	0	122
36	E	37.4	Very low	30.7	Very low	145 Å²	145	145.4 Å²	145.4	68%	0.678	76%	0.764	S	S	*	*			cis	-130.6	-142	13.9	-54.6	174.4	101	0	0	111.1
37	R	31.5	Very low	30.5	Very low	204 Å²	204	144.4 Å²	144.4	77%	0.77	76%	0.762	S	S	*	*			cis	-153.4	162.9	0	-146.8	173.2	166.2	85.1	15.4	114.4
38	S	35.1	Very low	30.3	Very low	99 Å²	99	143.9 Å²	143.9	69%	0.692	76%	0.764	S	S	*	*			trans	-85.7	162.9	179.1	-74.1	0	0	0	0	114.6
39	T	31	Very low	30.1	Very low	120 Å²	120	142.5 Å²	142.5	74%	0.736	76%	0.762	S	S	*	*			cis	-162.8	145.8	0.9	20.7	0	0	0	0	107.1
40	K	31	Very low	31.4	Very low	189 Å²	189	141.9 Å²	141.9	82%	0.822	76%	0.756	S	S	*	*				70.9	135.4	50.7	-166.8	179.6	-178.6	-179.8	0	113.3
41	G	31	Very low	31.2	Very low	69 Å²	69	144.8 Å²	144.8	71%	0.711	77%	0.767	S	S	*	*			cis	-178.8	-154	1	0	0	0	0	0	114.7
42	E	29.1	Very low	31.2	Very low	180 Å²	180	140 Å²	140	84%	0.841	76%	0.76	S	S	*	*			trans	-58.9	159.7	-172.4	-53.1	151.9	91.4	0	0	116.8
43	E	24.3	Very low	31.4	Very low	182 Å²	182	138.8 Å²	138.8	85%	0.85	76%	0.763	S	S	*	*				-160.3	-166.3	112.6	-131.9	-159.3	128.8	0	0	115.1
44	R	28.3	Very low	31.1	Very low	210 Å²	210	137.1 Å²	137.1	79%	0.792	76%	0.756	S	S	*	*			trans	-142	178.7	-162.5	-179	-169.3	158.8	-149.9	-6.8	109.1
45	V	31	Very low	31.5	Very low	84 Å²	84	138.4 Å²	138.4	51%	0.509	76%	0.762	S	S	.	*			trans	70.6	115.8	157.9	-97	0	0	0	0	121.9
46	E	28.2	Very low	31	Very low	169 Å²	169	136.8 Å²	136.8	79%	0.79	76%	0.763	S	S	*	*				75.7	112.8	121.8	-90.2	175.9	-173.1	0	0	124.9
47	I	29.8	Very low	30.8	Very low	144 Å²	144	136.1 Å²	136.1	74%	0.738	77%	0.774	S	S	*	*			trans	70.6	138.2	145	-9.9	-174.8	0	0	0	122.3
48	L	27.2	Very low	30.7	Very low	165 Å²	165	129.6 Å²	129.6	86%	0.864	77%	0.77	S	S	*	*			trans	100	133.9	154.6	-59.5	178.7	0	0	0	120.2
49	N	24.5	Very low	31.9	Very low	154 Å²	154	130.9 Å²	130.9	82%	0.824	78%	0.777	S	S	*	*			trans	-87.9	175	165.5	-94.4	-12	0	0	0	110
50	P	53.6	Low	31.7	Very low	107 Å²	107	129.5 Å²	129.5	70%	0.695	78%	0.777	S	S	*	*			cis	-136.7	177.7	-29.3	37.6	-21.5	0	0	0	113.2
51	S	24.3	Very low	33	Very low	119 Å²	119	126.1 Å²	126.1	83%	0.832	78%	0.775	S	S	*	*			trans	146.3	163.2	139.9	-66.6	0	0	0	0	114.8
52	A	28.7	Very low	33.2	Very low	89 Å²	89	128.5 Å²	128.5	74%	0.736	78%	0.775	S	S	*	*			trans	-86	179.3	179	0	0	0	0	0	112.2
53	T	31.1	Very low	33.3	Very low	137 Å²	137	127.3 Å²	127.3	84%	0.84	77%	0.774	S	S	*	*			cis	-154.1	160.6	19.2	-38.1	0	0	0	0	111.7
54	G	26.7	Very low	34.5	Very low	65 Å²	65	124.4 Å²	124.4	67%	0.67	77%	0.77	S	S	*	*			trans	-82	170.8	170.4	0	0	0	0	0	115.1
55	P	43.5	Very low	34.3	Very low	122 Å²	122	118 Å²	118	79%	0.792	77%	0.77	S	S	*	*			trans	-128.5	175.5	-146.8	42.8	-30.2	0	0	0	118.6
56	S	24.2	Very low	34.3	Very low	119 Å²	119	119.7 Å²	119.7	83%	0.832	79%	0.786	S	S	*	*			trans	93.1	152.1	151.3	75	0	0	0	0	120.8
57	S	33.1	Very low	35.4	Very low	131 Å²	131	117.3 Å²	117.3	92%	0.916	79%	0.785	S	S	*	*			trans	-128.8	-176.4	-167.1	-45.3	0	0	0	0	110.6
58	G	28.9	Very low	36.7	Very low	67 Å²	67	115.8 Å²	115.8	69%	0.691	78%	0.784	S	S	*	*			cis	-168.2	-132.2	11.1	0	0	0	0	0	109.2
59	P	60.6	Low	36.9	Very low	127 Å²	127	115.2 Å²	115.2	83%	0.825	78%	0.782	S	S	*	*			cis	-138.4	176.3	-1.6	43.4	-26.6	0	0	0	117.3
60	A	26.8	Very low	37.1	Very low	90 Å²	90	119.6 Å²	119.6	74%	0.744	79%	0.787	S	S	*	*			trans	89.3	157.2	142	0	0	0	0	0	120.8
61	P	58.4	Low	35.9	Very low	119 Å²	119	121.2 Å²	121.2	77%	0.773	80%	0.795	S	S	*	*			cis	-136	-163.9	-30.6	30.5	-7.9	0	0	0	114.4
62	V	35.1	Very low	35.9	Very low	118 Å²	118	119.4 Å²	119.4	72%	0.715	80%	0.795	S	S	*	*			trans	117.4	95	151.8	-175.7	0	0	0	0	119.3
63	L	31.5	Very low	36.2	Very low	156 Å²	156	122.2 Å²	122.2	82%	0.817	80%	0.803	S	S	*	*			trans	65.9	169	137.7	-54.9	-179.3	0	0	0	120.2
64	P	49.2	Very low	35.9	Very low	120 Å²	120	119.2 Å²	119.2	78%	0.779	80%	0.8	S	S	*	*				-141.6	169.2	-86.5	40.1	-19.9	0	0	0	117.5
65	G	25	Very low	35.8	Very low	77 Å²	77	121.8 Å²	121.8	79%	0.794	81%	0.807	S	S	*	*			trans	117.8	112.9	152.3	0	0	0	0	0	117.9
66	S	31.2	Very low	34.9	Very low	119 Å²	119	122.9 Å²	122.9	83%	0.832	81%	0.807	S	S	*	*			trans	-94.2	-164.6	172	-38.5	0	0	0	0	110.4
67	P	49.6	Very low	35	Very low	119 Å²	119	124.5 Å²	124.5	77%	0.773	80%	0.801	S	S	*	*			cis	-134.4	-125.8	-0.3	27.8	0.9	0	0	0	114.2
68	P	56.9	Low	34.7	Very low	111 Å²	111	126.4 Å²	126.4	72%	0.721	80%	0.795	S	S	*	*				-126.2	-166.7	-96.1	40.9	-24.3	0	0	0	116.3
69	D	32.8	Very low	35.9	Very low	153 Å²	153	128.1 Å²	128.1	82%	0.818	79%	0.794	S	S	*	*			trans	-36.1	147.2	174.1	-60.3	-82.3	0	0	0	118.4
70	R	28.3	Very low	34.2	Very low	247 Å²	247	131 Å²	131	93%	0.932	80%	0.797	S	S	*	*				-161.6	161	124.7	-117.3	175.6	-176.5	-141.9	-1.6	116.1
71	T	27.7	Very low	34.3	Very low	140 Å²	140	131.3 Å²	131.3	86%	0.859	79%	0.794	S	S	*	*			trans	-96.9	160.8	173.4	48.4	0	0	0	0	112
72	G	24.3	Very low	33	Very low	81 Å²	81	131 Å²	131	84%	0.835	79%	0.794	S	S	*	*			trans	133.5	128.8	158.7	0	0	0	0	0	116.2
73	T	36.6	Very low	32.9	Very low	149 Å²	149	129.3 Å²	129.3	91%	0.914	79%	0.792	S	S	*	*			trans	-87.8	146.8	176	49	0	0	0	0	113.2
74	G	23.6	Very low	32.8	Very low	74 Å²	74	130.2 Å²	130.2	76%	0.763	79%	0.792	S	S	*	*			trans	157.1	133.4	149.9	0	0	0	0	0	118.5
75	S	24.5	Very low	31.8	Very low	118 Å²	118	128.9 Å²	128.9	83%	0.825	79%	0.786	S	S	*	*			trans	64.4	154.8	164	-124.9	0	0	0	0	117.4
76	N	24.2	Very low	31.9	Very low	146 Å²	146	131.2 Å²	131.2	78%	0.781	79%	0.785	S	S	*	*			cis	-148.4	-176.6	10.1	-161.9	3.4	0	0	0	111.1
77	Q	26.7	Very low	32.9	Very low	152 Å²	152	131 Å²	131	71%	0.71	78%	0.78	S	S	*	*			trans	-102.9	166.9	-179.4	-50.4	-178.7	14	0	0	114.3
78	Q	27.9	Very low	33	Very low	172 Å²	172	130.3 Å²	130.3	80%	0.804	78%	0.776	S	S	*	*			trans	69.3	162.1	155.4	-73.7	-174.5	-100.9	0	0	119
79	P	53.5	Low	31.5	Very low	102 Å²	102	130.8 Å²	130.8	66%	0.662	78%	0.781	S	S	*	*			cis	-139.4	-168.9	-40.7	39.9	-22.9	0	0	0	113.8
80	Q	25	Very low	31.5	Very low	188 Å²	188	131.6 Å²	131.6	88%	0.879	78%	0.779	S	S	*	*			trans	91.8	139	175.3	-59.6	-173.6	-19.2	0	0	116.6
81	S	27.8	Very low	31.6	Very low	97 Å²	97	124.9 Å²	124.9	68%	0.678	76%	0.762	S	S	*	*			cis	-166.3	135.5	-24.2	48.8	0	0	0	0	111.6
82	S	31.4	Very low	31.8	Very low	113 Å²	113	125.2 Å²	125.2	79%	0.79	75%	0.754	S	S	*	*			trans	18	139.7	148.1	55.3	0	0	0	0	121
83	A	33.8	Very low	32.3	Very low	81 Å²	81	128.5 Å²	128.5	67%	0.669	75%	0.747	S	S	*	*			cis	-147	-159.8	10	0	0	0	0	0	110.1
84	E	29.1	Very low	32.2	Very low	176 Å²	176	128.4 Å²	128.4	82%	0.822	74%	0.736	S	S	*	*			cis	-155.2	-168.7	8.2	-150.4	35.7	102.7	0	0	106
85	S	28.8	Very low	32.5	Very low	92 Å²	92	133.7 Å²	133.7	64%	0.643	74%	0.738	S	S	*	*			cis	-157.1	-169	9.2	68.3	0	0	0	0	111.9
86	T	26.1	Very low	32.7	Very low	126 Å²	126	135.1 Å²	135.1	77%	0.773	74%	0.736	S	S	*	*			trans	-159.5	-175.3	169.5	-5.7	0	0	0	0	109.6
87	P	51.7	Low	32.9	Very low	113 Å²	113	138.7 Å²	138.7	73%	0.734	74%	0.738	S	S	*	*			cis	-144.4	-156.8	34.5	40	-13.5	0	0	0	114.8
88	P	52.8	Low	33.1	Very low	106 Å²	106	136 Å²	136	69%	0.688	74%	0.736	S	S	*	*				-140.3	165.5	-72.6	43	-27.3	0	0	0	117.3
89	C	24.6	Very low	33.3	Very low	120 Å²	120	133.3 Å²	133.3	81%	0.811	74%	0.736	S	S	*	*			trans	-177.5	115.4	135.9	-100.5	0	0	0	0	109.6
90	H	32.8	Very low	32.2	Very low	170 Å²	170	135.2 Å²	135.2	79%	0.787	75%	0.746	S	S	*	*				69.4	135.9	80.4	-96.1	29.1	0	0	0	115.9
91	D	31.1	Very low	32.5	Very low	107 Å²	107	137.1 Å²	137.1	57%	0.572	75%	0.745	S	S	*	*			cis	-168.4	173.4	-21.8	-151.3	-3.8	0	0	0	113.5
92	Q	32.3	Very low	33.6	Very low	146 Å²	146	137.9 Å²	137.9	68%	0.682	75%	0.747	S	S	*	*			trans	70	104.4	143.3	-87.4	170.9	72.5	0	0	125.7
93	H	34.6	Very low	34.1	Very low	151 Å²	151	138 Å²	138	70%	0.699	75%	0.746	S	S	*	*				68.4	141.1	110.5	-82.8	-107.5	0	0	0	126
94	H	34.6	Very low	33.9	Very low	147 Å²	147	139.5 Å²	139.5	68%	0.681	75%	0.751	S	S	*	*			trans	67.1	107.7	148.1	-70.2	-54.8	0	0	0	125.9
95	F	28.7	Very low	34	Very low	185 Å²	185	140.4 Å²	140.4	81%	0.811	75%	0.752	S	S	*	*				28.3	121.1	112.7	-79.1	-92.4	0	0	0	121.1
96	L	29	Very low	34.2	Very low	147 Å²	147	146.5 Å²	146.5	77%	0.77	76%	0.761	S	S	*	*				173.5	148.8	105.1	-99	171.6	0	0	0	115.4
97	R	28.9	Very low	34.4	Very low	222 Å²	222	147.8 Å²	147.8	84%	0.838	76%	0.762	S	S	*	*			trans	65.6	147.9	159.1	-67.7	176	-176	-161.2	0.8	118.9
98	S	30.7	Very low	33.3	Very low	95 Å²	95	153.2 Å²	153.2	66%	0.664	77%	0.768	S	S	*	*			cis	-171.7	140.8	-19.3	50.5	0	0	0	0	112.8
99	S	31.7	Very low	32.9	Very low	116 Å²	116	157.4 Å²	157.4	81%	0.811	78%	0.775	S	S	*	*			trans	63.5	148.7	154.9	-57.2	0	0	0	0	118.1
100	V	31.1	Very low	33.3	Very low	141 Å²	141	158.2 Å²	158.2	86%	0.855	77%	0.771	S	S	*	*			cis	-136.4	152	21.8	173.4	0	0	0	0	112
101	R	30.6	Very low	33.3	Very low	229 Å²	229	155 Å²	155	86%	0.864	77%	0.768	S	S	*	*			trans	-116.8	173	168.6	-91.5	-174.6	176.9	-179.2	0.3	110
102	P	51	Low	33.2	Very low	112 Å²	112	158.2 Å²	158.2	73%	0.727	78%	0.784	S	S	*	*			cis	-105.3	-88.1	-5.2	15.7	7.5	0	0	0	112.9
103	P	41.8	Very low	32.9	Very low	116 Å²	116	155 Å²	155	75%	0.753	79%	0.79	S	S	*	*			cis	-100.1	-166.1	-6.7	41.8	-34.7	0	0	0	113.6
104	S	29.2	Very low	32.6	Very low	113 Å²	113	152.9 Å²	152.9	79%	0.79	79%	0.791	S	S	*	*			trans	-168.9	154.3	174	-76.3	0	0	0	0	113.4
105	K	32.3	Very low	32.3	Very low	195 Å²	195	151.5 Å²	151.5	85%	0.848	79%	0.794	S	S	*	*			trans	168.9	152.4	140.8	-95.2	160.7	-178.4	178.9	0	111.2
106	R	31.7	Very low	32.5	Very low	220 Å²	220	149.4 Å²	149.4	83%	0.83	79%	0.79	S	S	*	*			cis	-167.8	134.8	-29.5	168.8	178.5	-85.5	-166.4	-5.6	108.9
107	I	30.9	Very low	32.5	Very low	152 Å²	152	149.8 Å²	149.8	78%	0.779	79%	0.792	S	S	*	*			trans	-1.1	131.3	151.7	-74.7	164.4	0	0	0	118.2
108	R	29.9	Very low	32.4	Very low	227 Å²	227	142 Å²	142	86%	0.857	78%	0.781	S	S	*	*				-157.6	147.8	114.7	-109.3	-175.6	-174.5	118.5	0.6	112.8	D110	R108-D110 IonicContact NE-OD2 2.71Å
109	K	42.5	Very low	32.4	Very low	194 Å²	194	147.2 Å²	147.2	84%	0.843	80%	0.795	S	S	*	*			trans	-128.7	126.5	162.4	166.1	-178.6	174.9	178.8	0	105.3
110	D	34.5	Very low	32.2	Very low	138 Å²	138	145.2 Å²	145.2	74%	0.738	79%	0.792	S	S	*	*			trans	-141.8	171	167.4	-77.7	-63.5	0	0	0	108.1	R108	R108-D110 IonicContact NE-OD2 2.71Å
111	S	31.2	Very low	32.1	Very low	103 Å²	103	142.6 Å²	142.6	72%	0.72	79%	0.794	S	S	*	*			trans	-143.2	179.7	-161.6	-166.8	0	0	0	0	112.1
112	I	29.7	Very low	32.2	Very low	174 Å²	174	136 Å²	136	89%	0.892	79%	0.788	S	S	*	*			trans	78.3	137.6	169.8	-48.5	154.1	0	0	0	114.5
113	G	26.2	Very low	31.1	Very low	79 Å²	79	140.3 Å²	140.3	81%	0.814	80%	0.795	S	S	*	*			trans	152.8	87.8	177.1	0	0	0	0	0	111.3
114	S	29.5	Very low	30.8	Very low	105 Å²	105	139.8 Å²	139.8	73%	0.734	79%	0.794	S	S	*	*			trans	-117.3	169.4	-170.4	-168.8	0	0	0	0	112.8
115	T	28	Very low	30.8	Very low	119 Å²	119	144.1 Å²	144.1	73%	0.73	80%	0.799	S	S	*	*			trans	81.5	165.7	160.4	74.4	0	0	0	0	120.8
116	I	33.1	Very low	30.6	Very low	141 Å²	141	137.9 Å²	137.9	72%	0.723	79%	0.79	S	S	*	*			trans	77.2	112.8	166.2	72.8	164.2	0	0	0	121.5
117	N	29.1	Very low	30.6	Very low	154 Å²	154	131.8 Å²	131.8	82%	0.824	79%	0.787	S	S	*	*			trans	62.4	148.3	135.8	-56.5	-4.3	0	0	0	120.1
118	G	25	Very low	30.6	Very low	59 Å²	59	132 Å²	132	61%	0.608	78%	0.784	S	S	*	*			cis	118.7	132	4.2	0	0	0	0	0	111.3
119	H	32.4	Very low	30.8	Very low	205 Å²	205	128.4 Å²	128.4	95%	0.949	78%	0.782	S	S	*	*			trans	60.8	158.3	-165.3	-64.8	-88.6	0	0	0	114.2
120	G	26.7	Very low	30.1	Very low	73 Å²	73	122.5 Å²	122.5	75%	0.753	78%	0.776	S	S	*	*			cis	157.6	136	-8.1	0	0	0	0	0	110.4
121	G	28.4	Very low	29.9	Very low	86 Å²	86	122 Å²	122	89%	0.887	78%	0.783	S	S	*	*			trans	-96	147.7	179.3	0	0	0	0	0	112.9
122	A	32.2	Very low	29.9	Very low	90 Å²	90	122.3 Å²	122.3	74%	0.744	79%	0.786	S	S	*	*			trans	-155.6	136.9	158.9	0	0	0	0	0	112.2
123	K	29	Very low	30.1	Very low	204 Å²	204	118 Å²	118	89%	0.887	77%	0.771	S	S	*	*			trans	32	138.8	135.2	-55.3	174.9	-177.9	173.8	0	117.9
124	S	34.9	Very low	30.3	Very low	104 Å²	104	123.3 Å²	123.3	73%	0.727	77%	0.774	S	S	*	*				-168.1	151.5	54.9	66.7	0	0	0	0	112.1
125	K	30.2	Very low	30.2	Very low	205 Å²	205	121.7 Å²	121.7	89%	0.891	77%	0.774	S	S	*	*				64.8	121.4	106.1	-171.3	-174.5	-179	-173.5	0	113.5
126	G	27.5	Very low	30.2	Very low	63 Å²	63	120.5 Å²	120.5	65%	0.649	78%	0.777	S	S	*	*			cis	178.5	-154.5	1.5	0	0	0	0	0	110.1
127	A	32.5	Very low	30.1	Very low	93 Å²	93	120.9 Å²	120.9	77%	0.769	79%	0.785	S	S	*	*			trans	65.6	159.7	173.6	0	0	0	0	0	116.3
128	E	31.2	Very low	30	Very low	155 Å²	155	116.7 Å²	116.7	72%	0.724	78%	0.778	S	S	*	*			cis	-163.5	150.2	-32.2	58.4	-173.4	89.9	0	0	109.9
129	N	32.4	Very low	30.4	Very low	153 Å²	153	123.2 Å²	123.2	82%	0.818	79%	0.793	S	S	*	*			trans	59.5	160.3	171.4	-54.5	-52.5	0	0	0	116
130	G	28.1	Very low	30.3	Very low	70 Å²	70	119 Å²	119	72%	0.722	79%	0.786	S	S	*	*			cis	-174.1	175.2	-9.2	0	0	0	0	0	111.8
131	S	31.6	Very low	30.6	Very low	126 Å²	126	122.9 Å²	122.9	88%	0.881	80%	0.795	S	S	*	*			trans	-20.5	163.3	158	-74.1	0	0	0	0	119.3
132	S	29.9	Very low	30.7	Very low	111 Å²	111	123.4 Å²	123.4	78%	0.776	79%	0.791	S	S	*	*			cis	-174.6	-178.7	-10.6	-178.3	0	0	0	0	108.8
133	S	33.9	Very low	30.5	Very low	84 Å²	84	124.6 Å²	124.6	59%	0.587	79%	0.794	S	S	*	*			trans	-75.7	169.9	-172.6	57.4	0	0	0	0	118.9
134	H	31	Very low	30.6	Very low	190 Å²	190	119.4 Å²	119.4	88%	0.88	78%	0.783	S	S	*	*			trans	85.1	152.4	150.7	-73.3	-63.7	0	0	0	120.9
135	G	26.4	Very low	30.3	Very low	71 Å²	71	121.5 Å²	121.5	73%	0.732	79%	0.792	S	S	*	*			trans	109.1	107.9	-176.6	0	0	0	0	0	112.5
136	A	29.4	Very low	30.1	Very low	94 Å²	94	115.6 Å²	115.6	78%	0.777	79%	0.789	S	S	*	*			cis	111.4	146	10	0	0	0	0	0	114.2
137	V	29.7	Very low	30.1	Very low	149 Å²	149	116.6 Å²	116.6	90%	0.903	80%	0.8	S	S	*	*			trans	72.1	136	180	-166.2	0	0	0	0	115
138	G	28.5	Very low	30.1	Very low	65 Å²	65	118.5 Å²	118.5	67%	0.67	80%	0.801	S	S	*	*			cis	166.2	-170.6	-11	0	0	0	0	0	115.4
139	Q	33.1	Very low	30.1	Very low	197 Å²	197	116.9 Å²	116.9	92%	0.921	81%	0.807	S	S	*	*			trans	72.5	159.3	169.9	-63.9	-169.6	-8.3	0	0	119.7
140	S	30.6	Very low	30.2	Very low	115 Å²	115	118.3 Å²	118.3	80%	0.804	81%	0.806	S	S	*	*			trans	-137.2	155.2	-171.1	-47.5	0	0	0	0	110
141	V	31.8	Very low	30.3	Very low	155 Å²	155	121.6 Å²	121.6	94%	0.939	81%	0.812	S	S	*	*			trans	-151.7	157.7	148.3	-102.1	0	0	0	0	108.9
142	A	30.2	Very low	30.7	Very low	98 Å²	98	121 Å²	121	81%	0.81	81%	0.805	S	S	*	*			trans	-139.4	135.1	-174	0	0	0	0	0	112.1
143	S	28.1	Very low	30.7	Very low	115 Å²	115	126 Å²	126	80%	0.804	81%	0.813	S	S	*	*			trans	-179.3	150	168.3	50	0	0	0	0	109.5
144	S	31.4	Very low	30.3	Very low	94 Å²	94	125.6 Å²	125.6	66%	0.657	82%	0.822	S	S	*	*			cis	-177.6	139.3	-22.5	47.5	0	0	0	0	108.1
145	T	28.5	Very low	30.1	Very low	149 Å²	149	120.1 Å²	120.1	91%	0.914	82%	0.817	S	S	*	*			trans	58.1	149.6	165	56	0	0	0	0	117.9
146	G	25.9	Very low	30.2	Very low	80 Å²	80	126.7 Å²	126.7	83%	0.825	83%	0.829	S	S	*	*			cis	166.5	178.3	-4.3	0	0	0	0	0	110.2
147	G	27.7	Very low	30.1	Very low	85 Å²	85	125.9 Å²	125.9	88%	0.876	83%	0.83	S	S	*	*			trans	117.8	132.3	163.6	0	0	0	0	0	116.4
148	V	33.1	Very low	30.6	Very low	132 Å²	132	125.1 Å²	125.1	80%	0.8	83%	0.828	S	S	*	*			trans	-115.2	143.7	175.6	160.9	0	0	0	0	109.2
149	S	30.1	Very low	30.7	Very low	122 Å²	122	126 Å²	126	85%	0.853	83%	0.829	S	S	*	*			trans	-162.9	164.4	148.7	-87.6	0	0	0	0	111.9
150	K	34.4	Very low	30.4	Very low	183 Å²	183	124.7 Å²	124.7	80%	0.796	82%	0.823	S	S	*	*			trans	-137	142.7	-174.7	-64.3	177.3	179.2	176	0	111.6
151	T	30.4	Very low	30.4	Very low	138 Å²	138	126.7 Å²	126.7	85%	0.847	82%	0.817	S	S	*	*			trans	64.3	167.4	153.6	48	0	0	0	0	116.5
152	P	40.5	Very low	30.3	Very low	113 Å²	113	126.3 Å²	126.3	73%	0.734	81%	0.805	S	S	*	*			cis	-139.2	154.9	13.1	43.1	-24.7	0	0	0	119.8
153	K	29.7	Very low	30.3	Very low	216 Å²	216	128.7 Å²	128.7	94%	0.939	80%	0.799	S	S	*	*				39	123.2	126.9	-165.3	-174	-176.5	-174.5	0	122
154	G	25.9	Very low	30.5	Very low	76 Å²	76	131 Å²	131	78%	0.784	80%	0.797	S	S	*	*			trans	156.4	143.5	148.3	0	0	0	0	0	118.1
155	G	26.6	Very low	30.2	Very low	75 Å²	75	130.5 Å²	130.5	77%	0.773	81%	0.807	S	S	*	*			trans	75.4	127	170.2	0	0	0	0	0	116
156	Q	28.8	Very low	30.1	Very low	209 Å²	209	127 Å²	127	98%	0.977	80%	0.8	S	S	*	*			cis	71.6	125.8	29.5	-68.1	-174	-39.6	0	0	116.9
157	G	26.8	Very low	30.2	Very low	78 Å²	78	129.7 Å²	129.7	80%	0.804	80%	0.796	S	S	*	*			trans	128.1	126.7	167.6	0	0	0	0	0	115.1
158	P	41.3	Very low	30.9	Very low	133 Å²	133	134.5 Å²	134.5	86%	0.864	80%	0.795	S	S	*	*			trans	-119.2	-179.6	179.8	42.3	-32.3	0	0	0	115.1
159	A	29.2	Very low	31.2	Very low	83 Å²	83	137.2 Å²	137.2	69%	0.686	80%	0.796	S	S	*	*			trans	116.1	115	150.9	0	0	0	0	0	119.3
160	E	27.9	Very low	31.6	Very low	170 Å²	170	142 Å²	142	79%	0.794	80%	0.796	S	S	*	*			trans	85.8	144.2	134.3	-73.2	176.9	-137.7	0	0	124.9
161	K	31.1	Very low	31.9	Very low	157 Å²	157	137.6 Å²	137.6	68%	0.683	79%	0.794	S	S	*	*			trans	70.8	138.4	161.9	-73.6	174.6	166.5	-73.2	0	119
162	E	29.3	Very low	32.2	Very low	146 Å²	146	142.8 Å²	142.8	68%	0.682	80%	0.798	S	S	*	*			cis	-156	161.7	-7.9	-145	149.8	179.9	0	0	113.6
163	E	29.1	Very low	32.5	Very low	148 Å²	148	147.8 Å²	147.8	69%	0.692	80%	0.802	S	S	*	*			trans	31.3	130.9	164	-79.6	-135.3	102.1	0	0	126.8
164	Q	32.3	Very low	32.6	Very low	164 Å²	164	145.4 Å²	145.4	77%	0.766	79%	0.794	S	S	*	*				32.1	129	127.7	-90.2	70.9	-73.2	0	0	123
165	G	25.8	Very low	33.4	Very low	83 Å²	83	152.3 Å²	152.3	86%	0.856	80%	0.797	S	S	*	*			trans	166	137.3	144.3	0	0	0	0	0	116.5
166	G	25.4	Very low	34.6	Very low	75 Å²	75	153.1 Å²	153.1	77%	0.773	78%	0.78	S	S	*	*			trans	100.6	58.7	151.7	0	0	0	0	0	120.6	Q168	G166-Q168 PolarHBondContact O-N 2.85Å
167	N	28.4	Very low	36.6	Very low	137 Å²	137	147.3 Å²	147.3	73%	0.733	76%	0.763	S	S	*	*			trans	9.3	103.5	144.3	178.9	17.9	0	0	0	118.6	K169	N167-K169 PolarHBondContact OD1-N 2.98Å
168	Q	42.9	Very low	39.2	Very low	186 Å²	186	145.4 Å²	145.4	87%	0.869	73%	0.732	S	S	*	*			trans	-104.8	125.9	143.6	-73.9	-156.5	0.5	0	0	110.4	G166 R170	G166-Q168 PolarHBondContact O-N 2.85Å; Q168-R170 PolarHBondContact O-N 3.34Å; Q168-R170 VanDerWaalsContact O-N 3.15Å
169	K	38.5	Very low	41.1	Very low	189 Å²	189	140.6 Å²	140.6	82%	0.822	70%	0.701	S	S	*	*			trans	-54.9	117	-175.4	-65.2	172.4	-178.4	173.1	0	110.2	N167 A171	N167-K169 PolarHBondContact OD1-N 2.98Å; K169-A171 PolarHBondContact O-N 3.1Å
170	R	40	Very low	43.4	Very low	223 Å²	223	139.1 Å²	139.1	84%	0.842	69%	0.689	S	S	*	*			trans	-59	103.5	171.5	-77.8	-176.3	175.9	174.4	1.6	109.3	Q168 R172	Q168-R170 PolarHBondContact O-N 3.34Å; Q168-R170 VanDerWaalsContact O-N 3.15Å; R170-R172 PolarHBondContact O-N 3.03Å; R170-R172 VanDerWaalsContact O-N 3.16Å
171	A	40.2	Very low	45.9	Very low	91 Å²	91	135.2 Å²	135.2	75%	0.752	67%	0.671	S	S	*	*			trans	-50.8	123.8	163.3	0	0	0	0	0	108	K169 R173	K169-A171 PolarHBondContact O-N 3.1Å; A171-R173 PolarHBondContact O-N 3.27Å
172	R	37.2	Very low	48.5	Very low	246 Å²	246	128 Å²	128	93%	0.928	64%	0.639	S	S	*	*			trans	-55.3	111.5	-171.8	-169.3	-179.1	-167.9	-138	6.5	108.6	R170 Q174	R170-R172 PolarHBondContact O-N 3.03Å; R170-R172 VanDerWaalsContact O-N 3.16Å; R172-Q174 PolarHBondContact O-N 3.32Å
173	R	46.3	Very low	51.2	Low	219 Å²	219	124 Å²	124	83%	0.826	62%	0.62	S	S	*	*			trans	-48.5	103.4	-172	-73.9	-178	177.9	168.8	-2.2	110	A171 W175	A171-R173 PolarHBondContact O-N 3.27Å; R173-W175 PolarHBondContact O-N 3.32Å
174	Q	32.3	Very low	53.9	Low	166 Å²	166	120.1 Å²	120.1	78%	0.776	60%	0.604	S	S	*	*			trans	-65.1	121.3	-179.3	-172.5	175.5	10	0	0	107.6	R172 E176	R172-Q174 PolarHBondContact O-N 3.32Å; Q174-E176 PolarHBondContact O-N 3.2Å
175	W	42.1	Very low	56.5	Low	220 Å²	220	112.8 Å²	112.8	83%	0.833	57%	0.571	S	S	*	*			trans	-54.9	118.4	-173.9	-174.6	-79.2	0	0	0	109.8	R173 S177	R173-W175 PolarHBondContact O-N 3.32Å; W175-S177 PolarHBondContact O-N 3.38Å
176	E	52	Low	59.4	Low	92 Å²	92	108.9 Å²	108.9	43%	0.43	53%	0.53	S	S	.	.			trans	-58.1	105.8	-151.5	-163.5	-178.5	-131.2	0	0	112	Q174 W178 K219	Q174-E176 PolarHBondContact O-N 3.2Å; E176-W178 PolarHBondContact O-N 2.74Å; E176-K219 VanDerWaalsContact CD-NZ 3.28Å; E176-K219 IonicContact OE2-NZ 3.3Å; E176-K219 PolarHBondContact OE2-NZ 2.71Å
177	S	71.3	Confident	62.3	Low	88 Å²	88	105.4 Å²	105.4	62%	0.615	49%	0.494	S	S	*	.			trans	-71.4	118.8	-164.8	50.8	0	0	0	0	110.6	W175 S179	W175-S177 PolarHBondContact O-N 3.38Å; S177-S179 PolarHBondContact O-N 2.85Å
178	W	80.4	Confident	64.9	Low	37 Å²	37	103 Å²	103	14%	0.14	48%	0.478	C	S	.	.			trans	-56	113.8	173.8	-80.3	77.1	0	0	0	109.7	E176 D182 K183 F186 K219 Q223 V224 F227	E176-W178 PolarHBondContact O-N 2.74Å; W178-D182 HydrophobicContact CE3-CB 3.64Å; W178-D182 HydrophobicContact CZ3-CB 4.1Å; W178-K183 HydrophobicContact CB-CD 4.39Å; W178-K183 HydrophobicContact CB-CG 4.07Å; W178-K183 WeakPolarHBondContact O-CE 3.39Å; W178-K183 PolarHBondContact O-NZ 2.87Å; W178-F186 HydrophobicContact CZ3-CB 4.04Å; W178-K219 HydrophobicContact CH2-CB 4.06Å; W178-K219 HydrophobicContact CH2-CG 3.89Å; W178-K219 HydrophobicContact CZ2-CB 4.23Å; W178-K219 HydrophobicContact CZ2-CD 4.43Å; W178-K219 HydrophobicContact CZ2-CG 4.02Å; W178-K219 HydrophobicContact CZ3-CG 4.29Å; W178-Q223 HydrophobicContact CZ2-CB 4.42Å; W178-Q223 WeakPolarHBondContact CZ2-O 3.35Å; W178-V224 HydrophobicContact CH2-CG2 4.34Å; W178-F227 HydrophobicContact CB-CE2 4.38Å; W178-F227 AromaticContact CD1-CD2 3.93Å; W178-F227 HydrophobicContact CD2-CB 4.41Å; W178-F227 AromaticContact CD2-CD2 3.66Å; W178-F227 HydrophobicContact CD2-CD2 3.66Å; W178-F227 HydrophobicContact CD2-CE2 4.1Å; W178-F227 AromaticContact CD2-CG 3.91Å; W178-F227 HydrophobicContact CD2-CG 3.91Å; W178-F227 AromaticContact CE2-CD2 3.7Å; W178-F227 AromaticContact CE2-CG 3.73Å; W178-F227 HydrophobicContact CE3-CD1 4.29Å; W178-F227 HydrophobicContact CE3-CD2 4.2Å; W178-F227 HydrophobicContact CE3-CE2 4.46Å; W178-F227 HydrophobicContact CE3-CG 4.14Å; W178-F227 AromaticContact CG-CD2 3.85Å; W178-F227 HydrophobicContact CG-CD2 3.85Å; W178-F227 HydrophobicContact CG-CE2 4.06Å; W178-F227 HydrophobicContact CH2-CB 3.92Å; W178-F227 HydrophobicContact CH2-CD1 4.32Å; W178-F227 HydrophobicContact CH2-CG 4.08Å; W178-F227 HydrophobicContact CZ2-CB 3.46Å; W178-F227 VanDerWaalsContact CZ2-CB 3.46Å; W178-F227 HydrophobicContact CZ2-CD2 4.29Å; W178-F227 AromaticContact CZ2-CG 3.84Å; W178-F227 HydrophobicContact CZ2-CG 3.84Å; W178-F227 HydrophobicContact CZ3-CD1 4.2Å; W178-F227 HydrophobicContact CZ3-CG 4.22Å; W178-F227 AromaticContact NE1-CD2 3.81Å
179	S	80.3	Confident	66.9	Low	33 Å²	33	94.2 Å²	94.2	23%	0.231	44%	0.437	C	S	.	.			trans	-68.1	171.5	-178.8	69.1	0	0	0	0	111.6	S177 E181 D182 K183	S177-S179 PolarHBondContact O-N 2.85Å; S179-E181 WeakPolarHBondContact CB-OE2 3.27Å; S179-E181 PolarHBondContact O-N 3.36Å; S179-E181 PolarHBondContact OG-OE2 3.49Å; S179-D182 WeakPolarHBondContact CB-OD2 3.49Å; S179-D182 PolarHBondContact N-OD2 3.49Å; S179-D182 PolarHBondContact O-N 3.14Å; S179-D182 PolarHBondContact OG-N 2.81Å; S179-D182 PolarHBondContact OG-OD1 2.9Å; S179-D182 VanDerWaalsContact OG-OD1 3.12Å; S179-D182 PolarHBondContact OG-OD2 3.34Å; S179-K183 WeakPolarHBondContact O-CD 3.23Å; S179-K183 VanDerWaalsContact O-CG 3.29Å; S179-K183 WeakPolarHBondContact O-CG 3.42Å; S179-K183 PolarHBondContact O-N 3.14Å
180	A	78.3	Confident	69.1	Low	51 Å²	51	85.2 Å²	85.2	42%	0.421	40%	0.398	S	S	.	.	H	α-helix	trans	-62.9	-37.5	174.4	0	0	0	0	0	110.4	N184	A180-N184 WeakPolarHBondContact O-CB 3.4Å; A180-N184 PolarHBondContact O-N 3.2Å; A180-N184 PolarHBondContact O-ND2 3.02Å; A180-N184 PolarHBondContact O-OD1 3.3Å; A180-N184 VanDerWaalsContact O-OD1 3.11Å
181	E	81.1	Confident	71.1	Confident	88 Å²	88	76 Å²	76	41%	0.411	36%	0.363	S	S	.	.	H	α-helix	trans	-67.4	-41.9	179.2	-62.8	63	-141.2	0	0	111.8	S179 N184 S185	S179-E181 WeakPolarHBondContact CB-OE2 3.27Å; S179-E181 PolarHBondContact O-N 3.36Å; S179-E181 PolarHBondContact OG-OE2 3.49Å; E181-N184 PolarHBondContact O-N 2.95Å; E181-S185 WeakPolarHBondContact O-CB 3.49Å; E181-S185 PolarHBondContact O-N 3.42Å; E181-S185 PolarHBondContact O-OG 3.37Å
182	D	85.8	Confident	73	Confident	5 Å²	5	75 Å²	75	3%	0.027	34%	0.343	C	S	.	.	H	α-helix	trans	-67.2	-44.7	178.9	-55.5	-29	0	0	0	110.8	W178 S179 N184 S185 F186 Y208	W178-D182 HydrophobicContact CE3-CB 3.64Å; W178-D182 HydrophobicContact CZ3-CB 4.1Å; S179-D182 WeakPolarHBondContact CB-OD2 3.49Å; S179-D182 PolarHBondContact N-OD2 3.49Å; S179-D182 PolarHBondContact O-N 3.14Å; S179-D182 PolarHBondContact OG-N 2.81Å; S179-D182 PolarHBondContact OG-OD1 2.9Å; S179-D182 VanDerWaalsContact OG-OD1 3.12Å; S179-D182 PolarHBondContact OG-OD2 3.34Å; D182-N184 VanDerWaalsContact C-N 3.31Å; D182-N184 PolarHBondContact O-N 3.29Å; D182-S185 PolarHBondContact O-N 3.03Å; D182-F186 VanDerWaalsContact O-CB 3.3Å; D182-F186 WeakPolarHBondContact O-CB 3.4Å; D182-F186 PolarHBondContact O-N 3.25Å; D182-Y208 VanDerWaalsContact OD1-CE2 3.31Å; D182-Y208 WeakPolarHBondContact OD1-CE2 3.49Å; D182-Y208 PolarHBondContact OD1-OH 3.43Å
183	K	85.9	Confident	74.9	Confident	64 Å²	64	67.5 Å²	67.5	28%	0.278	32%	0.319	S	S	.	.	H	α-helix	trans	-60.2	-44.3	175.4	-70.1	167.4	173.7	138.9	0	110.4	W178 S179 F186 F187 F227	W178-K183 HydrophobicContact CB-CD 4.39Å; W178-K183 HydrophobicContact CB-CG 4.07Å; W178-K183 WeakPolarHBondContact O-CE 3.39Å; W178-K183 PolarHBondContact O-NZ 2.87Å; S179-K183 WeakPolarHBondContact O-CD 3.23Å; S179-K183 VanDerWaalsContact O-CG 3.29Å; S179-K183 WeakPolarHBondContact O-CG 3.42Å; S179-K183 PolarHBondContact O-N 3.14Å; K183-F186 PolarHBondContact O-N 3.07Å; K183-F187 HydrophobicContact CB-CE2 4.39Å; K183-F187 WeakPolarHBondContact O-CD2 3.42Å; K183-F187 WeakPolarHBondContact O-CG 3.48Å; K183-F187 PolarHBondContact O-N 3.37Å; K183-F227 HydrophobicContact CD-CZ 4.49Å; K183-F227 HydrophobicContact CG-CE1 4.48Å; K183-F227 HydrophobicContact CG-CE2 4.31Å; K183-F227 HydrophobicContact CG-CZ 3.79Å
184	N	85.8	Confident	76.6	Confident	65 Å²	65	57.3 Å²	57.3	35%	0.348	28%	0.281	S	S	.	.	H	α-helix	trans	-64.9	-42.2	177.5	-66.2	-4.2	0	0	0	111.6	A180 E181 D182 F187 E188 R266	A180-N184 WeakPolarHBondContact O-CB 3.4Å; A180-N184 PolarHBondContact O-N 3.2Å; A180-N184 PolarHBondContact O-ND2 3.02Å; A180-N184 PolarHBondContact O-OD1 3.3Å; A180-N184 VanDerWaalsContact O-OD1 3.11Å; E181-N184 PolarHBondContact O-N 2.95Å; D182-N184 VanDerWaalsContact C-N 3.31Å; D182-N184 PolarHBondContact O-N 3.29Å; N184-F187 PolarHBondContact O-N 3.07Å; N184-E188 WeakPolarHBondContact O-CB 3.48Å; N184-E188 WeakPolarHBondContact O-CG 3.35Å; N184-E188 PolarHBondContact O-N 2.66Å; N184-R266 PolarHBondContact OD1-NH1 3.24Å; N184-R266 PolarHBondContact OD1-NH2 2.68Å
185	S	85.6	Confident	79	Confident	11 Å²	11	52.4 Å²	52.4	8%	0.077	26%	0.258	C	S	.	.	H	α-helix	trans	-67.2	-37.8	177.8	-54.7	0	0	0	0	112.5	E181 D182 G189	E181-S185 WeakPolarHBondContact O-CB 3.49Å; E181-S185 PolarHBondContact O-N 3.42Å; E181-S185 PolarHBondContact O-OG 3.37Å; D182-S185 PolarHBondContact O-N 3.03Å; S185-G189 PolarHBondContact O-N 3.05Å
186	F	87	Confident	80.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.4	-49.4	171.5	168.6	-89.6	0	0	0	111.2	W178 D182 K183 G189 L190 I200 I204 V224 F227 Y228	W178-F186 HydrophobicContact CZ3-CB 4.04Å; D182-F186 VanDerWaalsContact O-CB 3.3Å; D182-F186 WeakPolarHBondContact O-CB 3.4Å; D182-F186 PolarHBondContact O-N 3.25Å; K183-F186 PolarHBondContact O-N 3.07Å; F186-G189 PolarHBondContact O-N 2.85Å; F186-L190 HydrophobicContact CE1-CD2 4.18Å; F186-L190 WeakPolarHBondContact O-CB 3.47Å; F186-L190 PolarHBondContact O-N 3.47Å; F186-I200 HydrophobicContact CD2-CG2 3.78Å; F186-I200 HydrophobicContact CE2-CG2 4.25Å; F186-I204 HydrophobicContact CB-CD1 4.11Å; F186-V224 HydrophobicContact CD2-CG1 4.05Å; F186-V224 HydrophobicContact CE2-CG1 3.89Å; F186-F227 AromaticContact CD1-CD1 3.64Å; F186-F227 HydrophobicContact CD1-CD1 3.64Å; F186-F227 AromaticContact CD1-CE1 3.54Å; F186-F227 HydrophobicContact CD1-CE1 3.54Å; F186-F227 AromaticContact CD2-CD1 3.89Å; F186-F227 HydrophobicContact CD2-CD1 3.89Å; F186-F227 AromaticContact CE1-CD1 3.69Å; F186-F227 HydrophobicContact CE1-CD1 3.69Å; F186-F227 AromaticContact CE1-CE1 3.77Å; F186-F227 HydrophobicContact CE1-CE1 3.77Å; F186-F227 AromaticContact CE2-CD1 3.93Å; F186-F227 HydrophobicContact CE2-CD1 3.93Å; F186-F227 AromaticContact CG-CD1 3.76Å; F186-F227 HydrophobicContact CG-CD1 3.76Å; F186-F227 AromaticContact CG-CE1 3.99Å; F186-F227 HydrophobicContact CG-CE1 3.99Å; F186-F227 AromaticContact CZ-CD1 3.84Å; F186-F227 HydrophobicContact CZ-CD1 3.84Å; F186-F227 HydrophobicContact CZ-CE1 4.39Å; F186-Y228 HydrophobicContact CZ-CD2 4.38Å
187	F	86.1	Confident	82.6	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.009	22%	0.222	C	C	.	.	H	α-helix	trans	-66.7	-38.2	178.8	-69.6	-56.9	0	0	0	111.9	K183 N184 G189 L190 Y191 F227 T231 Y262 A263	K183-F187 HydrophobicContact CB-CE2 4.39Å; K183-F187 WeakPolarHBondContact O-CD2 3.42Å; K183-F187 WeakPolarHBondContact O-CG 3.48Å; K183-F187 PolarHBondContact O-N 3.37Å; N184-F187 PolarHBondContact O-N 3.07Å; F187-G189 VanDerWaalsContact C-N 3.33Å; F187-G189 PolarHBondContact O-N 2.91Å; F187-L190 HydrophobicContact CD1-CD2 3.93Å; F187-L190 HydrophobicContact CE1-CD2 4.3Å; F187-L190 WeakPolarHBondContact O-CB 3.46Å; F187-L190 PolarHBondContact O-N 3.19Å; F187-L190 VanDerWaalsContact O-N 3.08Å; F187-Y191 HydrophobicContact CB-CE2 4.08Å; F187-Y191 WeakPolarHBondContact O-CD2 3.04Å; F187-Y191 PolarHBondContact O-N 3.01Å; F187-F227 HydrophobicContact CE2-CE1 4.46Å; F187-F227 HydrophobicContact CZ-CE1 4.16Å; F187-T231 HydrophobicContact CZ-CG2 4.24Å; F187-Y262 HydrophobicContact CE1-CD1 4.38Å; F187-Y262 HydrophobicContact CE1-CE1 4.49Å; F187-Y262 HydrophobicContact CE2-CE1 4.43Å; F187-Y262 HydrophobicContact CZ-CD1 4.12Å; F187-Y262 AromaticContact CZ-CE1 3.79Å; F187-Y262 HydrophobicContact CZ-CE1 3.79Å; F187-A263 HydrophobicContact CB-CB 4.03Å; F187-A263 HydrophobicContact CD1-CB 3.41Å; F187-A263 VanDerWaalsContact CD1-CB 3.41Å; F187-A263 HydrophobicContact CD2-CB 4.28Å; F187-A263 HydrophobicContact CE1-CB 3.92Å; F187-A263 HydrophobicContact CG-CB 3.64Å
188	E	84.3	Confident	83.3	Confident	88 Å²	88	42.8 Å²	42.8	41%	0.411	21%	0.214	S	C	.	.	H	α-helix	trans	-56.2	-44.8	170.2	-78.1	175.5	-161.8	0	0	112.3	N184 E192 K207	N184-E188 WeakPolarHBondContact O-CB 3.48Å; N184-E188 WeakPolarHBondContact O-CG 3.35Å; N184-E188 PolarHBondContact O-N 2.66Å; E188-E192 PolarHBondContact O-N 3.25Å; E188-K207 IonicContact OE2-NZ 2.67Å; E188-K207 PolarHBondContact OE2-NZ 2.98Å
189	G	84.1	Confident	83.4	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61.3	-41.6	171.3	0	0	0	0	0	112.9	S185 F186 F187 Y191 E192 H193	S185-G189 PolarHBondContact O-N 3.05Å; F186-G189 PolarHBondContact O-N 2.85Å; F187-G189 VanDerWaalsContact C-N 3.33Å; F187-G189 PolarHBondContact O-N 2.91Å; G189-Y191 PolarHBondContact O-N 3.21Å; G189-E192 PolarHBondContact O-N 2.77Å; G189-H193 PolarHBondContact O-CD2 3.16Å; G189-H193 PolarHBondContact O-N 2.98Å
190	L	85.1	Confident	83.7	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-64.1	-39	-179.8	-168.1	70.4	0	0	0	112.7	F186 F187 E192 G194 I200 Y228 L256 L259 A308	F186-L190 HydrophobicContact CE1-CD2 4.18Å; F186-L190 WeakPolarHBondContact O-CB 3.47Å; F186-L190 PolarHBondContact O-N 3.47Å; F187-L190 HydrophobicContact CD1-CD2 3.93Å; F187-L190 HydrophobicContact CE1-CD2 4.3Å; F187-L190 WeakPolarHBondContact O-CB 3.46Å; F187-L190 PolarHBondContact O-N 3.19Å; F187-L190 VanDerWaalsContact O-N 3.08Å; L190-E192 VanDerWaalsContact C-N 3.26Å; L190-E192 PolarHBondContact O-N 2.93Å; L190-G194 WeakPolarHBondContact CD1-O 3.4Å; L190-G194 WeakPolarHBondContact O-CA 3.29Å; L190-G194 PolarHBondContact O-N 3.02Å; L190-G194 VanDerWaalsContact O-N 3.08Å; L190-I200 HydrophobicContact CB-CD1 4.4Å; L190-I200 HydrophobicContact CD1-CD1 3.87Å; L190-Y228 HydrophobicContact CD1-CD2 3.96Å; L190-Y228 HydrophobicContact CD1-CE2 4.01Å; L190-L256 HydrophobicContact CD1-CD1 3.67Å; L190-L256 HydrophobicContact CG-CD1 4.1Å; L190-L259 HydrophobicContact CD2-CB 4.02Å; L190-A308 WeakPolarHBondContact O-CB 3.49Å
191	Y	81.4	Confident	84.1	Confident	28 Å²	28	40 Å²	40	11%	0.11	19%	0.194	C	C	.	.	H	α-helix	trans	-66.4	-26.4	175.2	-67.2	-70.9	0	0	0	113.1	F187 G189 I260 A263 E264 K267 P304 C306 R307 A308	F187-Y191 HydrophobicContact CB-CE2 4.08Å; F187-Y191 WeakPolarHBondContact O-CD2 3.04Å; F187-Y191 PolarHBondContact O-N 3.01Å; G189-Y191 PolarHBondContact O-N 3.21Å; Y191-I260 HydrophobicContact CD1-CG1 4.45Å; Y191-I260 HydrophobicContact CD1-CG2 4.27Å; Y191-I260 HydrophobicContact CE1-CG2 3.96Å; Y191-A263 HydrophobicContact CE2-CB 4.27Å; Y191-A263 VanDerWaalsContact OH-C 3.24Å; Y191-A263 WeakPolarHBondContact OH-CB 3.41Å; Y191-E264 WeakPolarHBondContact OH-CA 3.4Å; Y191-E264 PolarHBondContact OH-N 3.5Å; Y191-E264 VanDerWaalsContact OH-N 3.07Å; Y191-E264 PolarHBondContact OH-OE2 2.92Å; Y191-K267 VanDerWaalsContact CE2-CE 3.5Å; Y191-K267 VanDerWaalsContact OH-CE 3.31Å; Y191-K267 WeakPolarHBondContact OH-CE 3.45Å; Y191-K267 PolarHBondContact OH-NZ 3.04Å; Y191-P304 HydrophobicContact CE1-CG 4Å; Y191-C306 HydrophobicContact CD1-CB 3.76Å; Y191-C306 HydrophobicContact CG-CB 4.32Å; Y191-R307 PolarHBondContact O-N 3.49Å; Y191-A308 PolarHBondContact O-N 2.83Å; Y191-A308 VanDerWaalsContact O-N 3.15Å
192	E	80.6	Confident	84.3	Confident	70 Å²	70	40 Å²	40	33%	0.327	20%	0.197	S	C	.	.	H	α-helix	trans	-95.8	-39.7	-175.4	-172.1	166.7	-132.2	0	0	113.2	E188 G189 L190 N203 R307	E188-E192 PolarHBondContact O-N 3.25Å; G189-E192 PolarHBondContact O-N 2.77Å; L190-E192 VanDerWaalsContact C-N 3.26Å; L190-E192 PolarHBondContact O-N 2.93Å; E192-N203 PolarHBondContact OE2-ND2 2.84Å; E192-R307 IonicContact OE1-NH1 3.71Å; E192-R307 PolarHBondContact OE1-NH1 3.18Å
193	H	77.4	Confident	84.2	Confident	90 Å²	90	40.8 Å²	40.8	42%	0.417	20%	0.201	S	C	.	.	H	α-helix	trans	-116.2	-12.7	-170	-54.8	-72.5	0	0	0	114.5	G189 D196 A199 N203	G189-H193 PolarHBondContact O-CD2 3.16Å; G189-H193 PolarHBondContact O-N 2.98Å; H193-D196 HydrophobicContact CB-CB 4.43Å; H193-A199 HydrophobicContact CB-CB 3.69Å; H193-A199 VanDerWaalsContact CG-CB 3.49Å; H193-N203 PolarHBondContact NE2-ND2 3.41Å
194	G	82.5	Confident	84.1	Confident	4 Å²	4	37.7 Å²	37.7	4%	0.041	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	-139.1	178.3	0	0	0	0	0	113.3	L190 D196 I200 A308	L190-G194 WeakPolarHBondContact CD1-O 3.4Å; L190-G194 WeakPolarHBondContact O-CA 3.29Å; L190-G194 PolarHBondContact O-N 3.02Å; L190-G194 VanDerWaalsContact O-N 3.08Å; G194-D196 PolarHBondContact O-N 3.46Å; G194-I200 VanDerWaalsContact O-CD1 3.24Å; G194-I200 WeakPolarHBondContact O-CD1 3.18Å; G194-A308 VanDerWaalsContact CA-CB 3.45Å
195	K	81.6	Confident	84	Confident	64 Å²	64	35.9 Å²	35.9	28%	0.278	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	6.4	-175.1	-156.7	166.2	177.7	173.7	0	113.9	F197 Y228 Y229 E255	K195-F197 HydrophobicContact CG-CE1 4.43Å; K195-F197 HydrophobicContact CG-CE2 4.28Å; K195-F197 HydrophobicContact CG-CZ 3.8Å; K195-F197 WeakPolarHBondContact O-CE2 3.4Å; K195-F197 PolarHBondContact O-N 2.78Å; K195-F197 VanDerWaalsContact O-N 3.14Å; K195-Y228 HydrophobicContact CG-CE2 4.25Å; K195-Y229 VanDerWaalsContact CE-OH 3.24Å; K195-Y229 WeakPolarHBondContact CE-OH 3.29Å; K195-Y229 PolarHBondContact NZ-OH 3.09Å; K195-E255 WeakPolarHBondContact CE-OE2 3.06Å; K195-E255 IonicContact NZ-OE1 2.66Å; K195-E255 PolarHBondContact NZ-OE1 3.45Å; K195-E255 IonicContact NZ-OE2 2.69Å; K195-E255 PolarHBondContact NZ-OE2 2.83Å
196	D	83.5	Confident	83.8	Confident	80 Å²	80	40 Å²	40	43%	0.428	20%	0.201	S	C	.	.			trans	-75.4	95.2	171.8	-176.1	-10.5	0	0	0	111.7	H193 G194 E198 A199 I200	H193-D196 HydrophobicContact CB-CB 4.43Å; G194-D196 PolarHBondContact O-N 3.46Å; D196-E198 PolarHBondContact O-N 2.86Å; D196-E198 WeakPolarHBondContact OD1-CA 3.29Å; D196-E198 WeakPolarHBondContact OD1-CB 3.43Å; D196-E198 PolarHBondContact OD1-N 3.48Å; D196-A199 HydrophobicContact CB-CB 4.12Å; D196-A199 VanDerWaalsContact CG-CB 3.47Å; D196-A199 PolarHBondContact OD1-N 3.25Å; D196-A199 WeakPolarHBondContact OD2-CB 3.47Å; D196-I200 VanDerWaalsContact O-CG1 3.25Å; D196-I200 WeakPolarHBondContact O-CG1 3.39Å; D196-I200 PolarHBondContact O-N 3.41Å
197	F	85.9	Confident	83.4	Confident	22 Å²	22	43.4 Å²	43.4	10%	0.096	22%	0.216	C	C	.	.	H	α-helix	trans	-64.7	-22.4	177.5	-52.3	-61	0	0	0	114.1	K195 Q201 K221 V224 R225 Y228 Y229	K195-F197 HydrophobicContact CG-CE1 4.43Å; K195-F197 HydrophobicContact CG-CE2 4.28Å; K195-F197 HydrophobicContact CG-CZ 3.8Å; K195-F197 WeakPolarHBondContact O-CE2 3.4Å; K195-F197 PolarHBondContact O-N 2.78Å; K195-F197 VanDerWaalsContact O-N 3.14Å; F197-Q201 WeakPolarHBondContact O-CB 3.37Å; F197-Q201 PolarHBondContact O-N 2.9Å; F197-K221 HydrophobicContact CB-CG 4.13Å; F197-V224 HydrophobicContact CB-CG1 4.25Å; F197-V224 HydrophobicContact CD1-CG1 4.26Å; F197-R225 HydrophobicContact CD1-CB 4.19Å; F197-R225 HydrophobicContact CD1-CG 4.45Å; F197-R225 HydrophobicContact CD2-CB 4.25Å; F197-R225 HydrophobicContact CD2-CG 4.03Å; F197-R225 HydrophobicContact CE1-CB 4.45Å; F197-R225 HydrophobicContact CE1-CG 4.3Å; F197-R225 HydrophobicContact CE2-CB 4.5Å; F197-R225 HydrophobicContact CE2-CG 3.85Å; F197-R225 HydrophobicContact CG-CB 4.09Å; F197-R225 HydrophobicContact CG-CG 4.32Å; F197-R225 HydrophobicContact CZ-CG 3.99Å; F197-Y228 HydrophobicContact CE1-CD1 4.05Å; F197-Y228 AromaticContact CE1-CD2 3.86Å; F197-Y228 HydrophobicContact CE1-CD2 3.86Å; F197-Y228 AromaticContact CE1-CG 3.61Å; F197-Y228 HydrophobicContact CE1-CG 3.61Å; F197-Y228 HydrophobicContact CZ-CD1 4.17Å; F197-Y228 HydrophobicContact CZ-CG 4.2Å; F197-Y229 HydrophobicContact CZ-CE2 4.06Å
198	E	86.7	Confident	82.9	Confident	95 Å²	95	43.8 Å²	43.8	44%	0.444	22%	0.217	S	C	.	.	H	α-helix	trans	-84.1	-43.6	-178.7	-169.8	165.5	148.7	0	0	111.3	D196 I200 Q201 N202 K221	D196-E198 PolarHBondContact O-N 2.86Å; D196-E198 WeakPolarHBondContact OD1-CA 3.29Å; D196-E198 WeakPolarHBondContact OD1-CB 3.43Å; D196-E198 PolarHBondContact OD1-N 3.48Å; E198-I200 VanDerWaalsContact C-N 3.32Å; E198-I200 PolarHBondContact O-N 3.26Å; E198-Q201 PolarHBondContact O-N 2.77Å; E198-N202 WeakPolarHBondContact O-CB 3.47Å; E198-N202 PolarHBondContact O-N 3.49Å; E198-N202 PolarHBondContact O-ND2 2.95Å; E198-K221 HydrophobicContact CB-CD 4.24Å; E198-K221 IonicContact OE2-NZ 3.33Å; E198-K221 PolarHBondContact OE2-NZ 2.85Å
199	A	83.5	Confident	82.6	Confident	21 Å²	21	47.2 Å²	47.2	17%	0.174	23%	0.231	C	C	.	.	H	α-helix	trans	-63.2	-37.5	169.8	0	0	0	0	0	111.9	H193 D196 N202 N203	H193-A199 HydrophobicContact CB-CB 3.69Å; H193-A199 VanDerWaalsContact CG-CB 3.49Å; D196-A199 HydrophobicContact CB-CB 4.12Å; D196-A199 VanDerWaalsContact CG-CB 3.47Å; D196-A199 PolarHBondContact OD1-N 3.25Å; D196-A199 WeakPolarHBondContact OD2-CB 3.47Å; A199-N202 PolarHBondContact O-N 2.85Å; A199-N203 WeakPolarHBondContact O-CB 3.24Å; A199-N203 PolarHBondContact O-N 3.48Å
200	I	86.1	Confident	82.3	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-48.3	171.1	-68.3	166.4	0	0	0	111.3	F186 L190 G194 D196 E198 N202 N203 I204 V224	F186-I200 HydrophobicContact CD2-CG2 3.78Å; F186-I200 HydrophobicContact CE2-CG2 4.25Å; L190-I200 HydrophobicContact CB-CD1 4.4Å; L190-I200 HydrophobicContact CD1-CD1 3.87Å; G194-I200 VanDerWaalsContact O-CD1 3.24Å; G194-I200 WeakPolarHBondContact O-CD1 3.18Å; D196-I200 VanDerWaalsContact O-CG1 3.25Å; D196-I200 WeakPolarHBondContact O-CG1 3.39Å; D196-I200 PolarHBondContact O-N 3.41Å; E198-I200 VanDerWaalsContact C-N 3.32Å; E198-I200 PolarHBondContact O-N 3.26Å; I200-N202 VanDerWaalsContact C-N 3.32Å; I200-N202 PolarHBondContact O-N 3.17Å; I200-N203 WeakPolarHBondContact O-CB 3.44Å; I200-N203 PolarHBondContact O-N 2.92Å; I200-I204 HydrophobicContact CG2-CD1 3.82Å; I200-I204 HydrophobicContact CG2-CG1 4.43Å; I200-I204 WeakPolarHBondContact O-CG1 3.29Å; I200-I204 PolarHBondContact O-N 3.15Å; I200-V224 HydrophobicContact CB-CG1 3.96Å; I200-V224 HydrophobicContact CG2-CG1 3.53Å
201	Q	86.1	Confident	81.6	Confident	42 Å²	42	63.7 Å²	63.7	20%	0.196	30%	0.297	C	S	.	.	H	α-helix	trans	-56.4	-47.3	175.9	174.3	179.2	11	0	0	111.1	F197 E198 N203 I204 A205 K219 K221 V224	F197-Q201 WeakPolarHBondContact O-CB 3.37Å; F197-Q201 PolarHBondContact O-N 2.9Å; E198-Q201 PolarHBondContact O-N 2.77Å; Q201-N203 VanDerWaalsContact C-N 3.31Å; Q201-N203 PolarHBondContact O-N 3.22Å; Q201-I204 PolarHBondContact O-N 3.38Å; Q201-A205 VanDerWaalsContact O-CB 3.32Å; Q201-A205 WeakPolarHBondContact O-CB 3.48Å; Q201-A205 PolarHBondContact O-N 3.22Å; Q201-K219 WeakPolarHBondContact CG-O 3.29Å; Q201-K221 VanDerWaalsContact CD-N 3.31Å; Q201-K221 VanDerWaalsContact OE1-CB 3.24Å; Q201-V224 HydrophobicContact CB-CG2 4.38Å
202	N	85.3	Confident	80.8	Confident	87 Å²	87	65.8 Å²	65.8	47%	0.465	33%	0.328	S	S	.	.	H	α-helix	trans	-63.5	-35.8	179.5	-78.5	-50.6	0	0	0	112.3	E198 A199 I200 M206	E198-N202 WeakPolarHBondContact O-CB 3.47Å; E198-N202 PolarHBondContact O-N 3.49Å; E198-N202 PolarHBondContact O-ND2 2.95Å; A199-N202 PolarHBondContact O-N 2.85Å; I200-N202 VanDerWaalsContact C-N 3.32Å; I200-N202 PolarHBondContact O-N 3.17Å; N202-M206 VanDerWaalsContact O-CB 3.29Å; N202-M206 WeakPolarHBondContact O-CB 3.44Å; N202-M206 VanDerWaalsContact O-CG 3.23Å; N202-M206 WeakPolarHBondContact O-CG 3.33Å; N202-M206 PolarHBondContact O-N 3.1Å
203	N	83.8	Confident	80.3	Confident	22 Å²	22	66.6 Å²	66.6	12%	0.118	33%	0.33	C	S	.	.	H	α-helix	trans	-63.1	-50.3	172.7	-153.1	-48.1	0	0	0	110.8	E192 H193 A199 I200 Q201 A205 M206 K207	E192-N203 PolarHBondContact OE2-ND2 2.84Å; H193-N203 PolarHBondContact NE2-ND2 3.41Å; A199-N203 WeakPolarHBondContact O-CB 3.24Å; A199-N203 PolarHBondContact O-N 3.48Å; I200-N203 WeakPolarHBondContact O-CB 3.44Å; I200-N203 PolarHBondContact O-N 2.92Å; Q201-N203 VanDerWaalsContact C-N 3.31Å; Q201-N203 PolarHBondContact O-N 3.22Å; N203-A205 PolarHBondContact O-N 3.37Å; N203-M206 PolarHBondContact O-N 3.4Å; N203-K207 WeakPolarHBondContact O-CG 3.11Å; N203-K207 PolarHBondContact O-N 3.12Å; N203-K207 WeakPolarHBondContact OD1-CE 3.14Å
204	I	84.7	Confident	79.3	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-58.5	-48.3	176.4	-64.6	166.4	0	0	0	110.8	F186 I200 Q201 M206 K207 Y208 V224	F186-I204 HydrophobicContact CB-CD1 4.11Å; I200-I204 HydrophobicContact CG2-CD1 3.82Å; I200-I204 HydrophobicContact CG2-CG1 4.43Å; I200-I204 WeakPolarHBondContact O-CG1 3.29Å; I200-I204 PolarHBondContact O-N 3.15Å; Q201-I204 PolarHBondContact O-N 3.38Å; I204-M206 VanDerWaalsContact C-N 3.33Å; I204-M206 PolarHBondContact O-N 2.88Å; I204-K207 PolarHBondContact O-N 3.39Å; I204-K207 VanDerWaalsContact O-N 3.15Å; I204-Y208 HydrophobicContact CG2-CD2 3.98Å; I204-Y208 HydrophobicContact CG2-CE2 4.24Å; I204-Y208 WeakPolarHBondContact O-CB 3.39Å; I204-Y208 PolarHBondContact O-N 3.27Å; I204-V224 HydrophobicContact CD1-CG2 3.94Å
205	A	82.2	Confident	78.3	Confident	26 Å²	26	69.7 Å²	69.7	22%	0.215	37%	0.365	C	S	.	.	H	α-helix	trans	-58.3	-42.8	178	0	0	0	0	0	112.2	Q201 N203 Y208 K209 V218	Q201-A205 VanDerWaalsContact O-CB 3.32Å; Q201-A205 WeakPolarHBondContact O-CB 3.48Å; Q201-A205 PolarHBondContact O-N 3.22Å; N203-A205 PolarHBondContact O-N 3.37Å; A205-Y208 WeakPolarHBondContact O-CB 3.44Å; A205-Y208 PolarHBondContact O-N 3.3Å; A205-K209 WeakPolarHBondContact O-CB 3.46Å; A205-K209 PolarHBondContact O-N 2.93Å; A205-V218 HydrophobicContact CB-CG1 3.58Å; A205-V218 HydrophobicContact CB-CG2 4.43Å
206	M	82	Confident	77.3	Confident	99 Å²	99	73 Å²	73	49%	0.488	39%	0.386	S	S	.	.	H	α-helix	trans	-69.3	-34.4	176.4	-75.6	-71.2	-77.3	0	0	112.7	N202 N203 I204 K210	N202-M206 VanDerWaalsContact O-CB 3.29Å; N202-M206 WeakPolarHBondContact O-CB 3.44Å; N202-M206 VanDerWaalsContact O-CG 3.23Å; N202-M206 WeakPolarHBondContact O-CG 3.33Å; N202-M206 PolarHBondContact O-N 3.1Å; N203-M206 PolarHBondContact O-N 3.4Å; I204-M206 VanDerWaalsContact C-N 3.33Å; I204-M206 PolarHBondContact O-N 2.88Å; M206-K210 WeakPolarHBondContact O-CB 3.36Å; M206-K210 VanDerWaalsContact O-CG 3.28Å; M206-K210 WeakPolarHBondContact O-CG 3.29Å; M206-K210 PolarHBondContact O-N 3.24Å
207	K	78.5	Confident	76.4	Confident	70 Å²	70	72.4 Å²	72.4	30%	0.304	38%	0.381	S	S	.	.	H	α-helix	trans	-68.8	-39.7	173.9	-59.7	-101.1	179.5	169.7	0	111	E188 N203 I204 K210 R211	E188-K207 IonicContact OE2-NZ 2.67Å; E188-K207 PolarHBondContact OE2-NZ 2.98Å; N203-K207 WeakPolarHBondContact O-CG 3.11Å; N203-K207 PolarHBondContact O-N 3.12Å; N203-K207 WeakPolarHBondContact OD1-CE 3.14Å; I204-K207 PolarHBondContact O-N 3.39Å; I204-K207 VanDerWaalsContact O-N 3.15Å; K207-K210 PolarHBondContact O-N 3.33Å; K207-R211 WeakPolarHBondContact O-CG 3.4Å; K207-R211 PolarHBondContact O-N 3.21Å
208	Y	76.3	Confident	75.8	Confident	11 Å²	11	73.1 Å²	73.1	4%	0.043	39%	0.387	C	S	.	.	H	α-helix	trans	-60.8	-51.6	172.3	-102	-101	0	0	0	112	D182 I204 A205 K210 R211 G212 K213 M217 V218	D182-Y208 VanDerWaalsContact OD1-CE2 3.31Å; D182-Y208 WeakPolarHBondContact OD1-CE2 3.49Å; D182-Y208 PolarHBondContact OD1-OH 3.43Å; I204-Y208 HydrophobicContact CG2-CD2 3.98Å; I204-Y208 HydrophobicContact CG2-CE2 4.24Å; I204-Y208 WeakPolarHBondContact O-CB 3.39Å; I204-Y208 PolarHBondContact O-N 3.27Å; A205-Y208 WeakPolarHBondContact O-CB 3.44Å; A205-Y208 PolarHBondContact O-N 3.3Å; Y208-K210 VanDerWaalsContact C-N 3.32Å; Y208-K210 PolarHBondContact O-N 3.48Å; Y208-R211 CarbonylContact O-C 3.54Å; Y208-R211 WeakPolarHBondContact O-CA 3.3Å; Y208-R211 PolarHBondContact O-N 2.74Å; Y208-G212 PolarHBondContact O-N 3.43Å; Y208-K213 HydrophobicContact CD1-CB 3.49Å; Y208-K213 VanDerWaalsContact CD1-CB 3.49Å; Y208-K213 HydrophobicContact CD1-CD 4.11Å; Y208-K213 HydrophobicContact CD1-CG 4.42Å; Y208-K213 HydrophobicContact CE1-CB 3.8Å; Y208-K213 HydrophobicContact CE1-CD 3.67Å; Y208-K213 HydrophobicContact CE1-CG 4.39Å; Y208-K213 HydrophobicContact CG-CB 4.47Å; Y208-K213 PolarHBondContact O-N 3.41Å; Y208-M217 HydrophobicContact CD1-CB 4.14Å; Y208-M217 HydrophobicContact CE1-CB 3.39Å; Y208-M217 HydrophobicContact CE1-CG 4.45Å; Y208-M217 HydrophobicContact CE1-SD 4.39Å; Y208-V218 HydrophobicContact CD1-CG2 4.25Å; Y208-V218 HydrophobicContact CG-CG2 4.08Å
209	K	78.3	Confident	75.3	Confident	160 Å²	160	68.8 Å²	68.8	70%	0.696	37%	0.366	S	S	*	.	H	α-helix	trans	-59.1	-40.1	177.1	-176.8	165.6	-176.9	160.1	0	112.5	A205 R211 G212	A205-K209 WeakPolarHBondContact O-CB 3.46Å; A205-K209 PolarHBondContact O-N 2.93Å; K209-R211 PolarHBondContact O-N 2.87Å; K209-G212 PolarHBondContact O-N 3.43Å
210	K	76	Confident	75.4	Confident	174 Å²	174	72.1 Å²	72.1	76%	0.757	38%	0.381	S	S	*	.	H	α-helix	trans	-68.5	-14.3	174.1	-76.9	178.6	177	-175.4	0	114.3	M206 K207 Y208	M206-K210 WeakPolarHBondContact O-CB 3.36Å; M206-K210 VanDerWaalsContact O-CG 3.28Å; M206-K210 WeakPolarHBondContact O-CG 3.29Å; M206-K210 PolarHBondContact O-N 3.24Å; K207-K210 PolarHBondContact O-N 3.33Å; Y208-K210 VanDerWaalsContact C-N 3.32Å; Y208-K210 PolarHBondContact O-N 3.48Å
211	R	72.1	Confident	75.3	Confident	172 Å²	172	75.4 Å²	75.4	65%	0.649	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	10.1	176.4	-69.7	-174.2	-179.2	-148.1	3.7	113.5	K207 Y208 K209 K213	K207-R211 WeakPolarHBondContact O-CG 3.4Å; K207-R211 PolarHBondContact O-N 3.21Å; Y208-R211 CarbonylContact O-C 3.54Å; Y208-R211 WeakPolarHBondContact O-CA 3.3Å; Y208-R211 PolarHBondContact O-N 2.74Å; K209-R211 PolarHBondContact O-N 2.87Å; R211-K213 PolarHBondContact O-N 3.46Å; R211-K213 VanDerWaalsContact O-N 3.1Å
212	G	63.6	Low	75.3	Confident	72 Å²	72	77.4 Å²	77.4	74%	0.742	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.3	10.3	177.8	0	0	0	0	0	115.4	Y208 K209	Y208-G212 PolarHBondContact O-N 3.43Å; K209-G212 PolarHBondContact O-N 3.43Å
213	K	70.2	Confident	75.3	Confident	87 Å²	87	77.1 Å²	77.1	38%	0.378	40%	0.401	S	S	.	.			trans	-76.1	144.1	178.3	-73.2	-167.9	176.5	-171.5	0	110.7	Y208 R211	Y208-K213 HydrophobicContact CD1-CB 3.49Å; Y208-K213 VanDerWaalsContact CD1-CB 3.49Å; Y208-K213 HydrophobicContact CD1-CD 4.11Å; Y208-K213 HydrophobicContact CD1-CG 4.42Å; Y208-K213 HydrophobicContact CE1-CB 3.8Å; Y208-K213 HydrophobicContact CE1-CD 3.67Å; Y208-K213 HydrophobicContact CE1-CG 4.39Å; Y208-K213 HydrophobicContact CG-CB 4.47Å; Y208-K213 PolarHBondContact O-N 3.41Å; R211-K213 PolarHBondContact O-N 3.46Å; R211-K213 VanDerWaalsContact O-N 3.1Å
214	P	56.4	Low	75.5	Confident	76 Å²	76	76.1 Å²	76.1	49%	0.494	40%	0.395	S	S	.	.			trans	-66.5	149.5	-175.7	28.3	-35.9	0	0	0	112.4	N216 M217	P214-N216 VanDerWaalsContact CB-OD1 3.31Å; P214-N216 WeakPolarHBondContact CB-OD1 3.25Å; P214-N216 VanDerWaalsContact CG-OD1 3.31Å; P214-N216 WeakPolarHBondContact CG-OD1 3.29Å; P214-N216 PolarHBondContact O-N 3.31Å; P214-M217 HydrophobicContact CG-CG 4.39Å; P214-M217 PolarHBondContact O-N 2.83Å
215	A	60.8	Low	75.7	Confident	84 Å²	84	79.5 Å²	79.5	69%	0.694	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-66.6	-21.8	-171.6	0	0	0	0	0	114.1	M217 V218	A215-M217 PolarHBondContact O-N 2.97Å; A215-V218 WeakPolarHBondContact O-CB 3.45Å; A215-V218 WeakPolarHBondContact O-CG2 3.26Å; A215-V218 PolarHBondContact O-N 2.82Å; A215-V218 VanDerWaalsContact O-N 3.11Å
216	N	61.3	Low	76	Confident	134 Å²	134	83.4 Å²	83.4	72%	0.717	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-64.8	-17.8	176	65.8	-21	0	0	0	114	P214	P214-N216 VanDerWaalsContact CB-OD1 3.31Å; P214-N216 WeakPolarHBondContact CB-OD1 3.25Å; P214-N216 VanDerWaalsContact CG-OD1 3.31Å; P214-N216 WeakPolarHBondContact CG-OD1 3.29Å; P214-N216 PolarHBondContact O-N 3.31Å
217	M	64.2	Low	76.2	Confident	67 Å²	67	80 Å²	80	33%	0.33	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-89.4	-4.1	174.7	-64.5	-163.6	83.7	0	0	113.8	Y208 P214 A215 K219	Y208-M217 HydrophobicContact CD1-CB 4.14Å; Y208-M217 HydrophobicContact CE1-CB 3.39Å; Y208-M217 HydrophobicContact CE1-CG 4.45Å; Y208-M217 HydrophobicContact CE1-SD 4.39Å; P214-M217 HydrophobicContact CG-CG 4.39Å; P214-M217 PolarHBondContact O-N 2.83Å; A215-M217 PolarHBondContact O-N 2.97Å; M217-K219 PolarHBondContact O-N 3.3Å
218	V	73.2	Confident	76.7	Confident	36 Å²	36	76.6 Å²	76.6	22%	0.218	39%	0.39	C	S	.	.	S	Bend	trans	-72.7	121.6	179.1	175.3	0	0	0	0	109.3	A205 Y208 A215	A205-V218 HydrophobicContact CB-CG1 3.58Å; A205-V218 HydrophobicContact CB-CG2 4.43Å; Y208-V218 HydrophobicContact CD1-CG2 4.25Å; Y208-V218 HydrophobicContact CG-CG2 4.08Å; A215-V218 WeakPolarHBondContact O-CB 3.45Å; A215-V218 WeakPolarHBondContact O-CG2 3.26Å; A215-V218 PolarHBondContact O-N 2.82Å; A215-V218 VanDerWaalsContact O-N 3.11Å
219	K	76.6	Confident	77.3	Confident	4 Å²	4	79.9 Å²	79.9	2%	0.017	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-68.2	133.4	-178.3	-53.5	-61.8	173.1	173.9	0	111.1	E176 W178 Q201 M217 Q223 V224	E176-K219 VanDerWaalsContact CD-NZ 3.28Å; E176-K219 IonicContact OE2-NZ 3.3Å; E176-K219 PolarHBondContact OE2-NZ 2.71Å; W178-K219 HydrophobicContact CH2-CB 4.06Å; W178-K219 HydrophobicContact CH2-CG 3.89Å; W178-K219 HydrophobicContact CZ2-CB 4.23Å; W178-K219 HydrophobicContact CZ2-CD 4.43Å; W178-K219 HydrophobicContact CZ2-CG 4.02Å; W178-K219 HydrophobicContact CZ3-CG 4.29Å; Q201-K219 WeakPolarHBondContact CG-O 3.29Å; M217-K219 PolarHBondContact O-N 3.3Å; K219-Q223 VanDerWaalsContact CA-OE1 3.22Å; K219-Q223 HydrophobicContact CB-CB 4.24Å; K219-V224 HydrophobicContact CB-CG2 4.28Å
220	N	85	Confident	77.7	Confident	91 Å²	91	80.5 Å²	80.5	49%	0.487	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-72	157.3	179.8	-166.1	-4.2	0	0	0	111.6	E222 Q223 V224	N220-E222 PolarHBondContact O-N 2.67Å; N220-Q223 HydrophobicContact CB-CG 4.42Å; N220-Q223 WeakPolarHBondContact O-CA 3.27Å; N220-Q223 WeakPolarHBondContact O-CB 3.5Å; N220-Q223 PolarHBondContact O-N 3.5Å; N220-V224 WeakPolarHBondContact O-CG2 3.49Å; N220-V224 PolarHBondContact O-N 3.43Å
221	K	85.3	Confident	78.2	Confident	70 Å²	70	72.9 Å²	72.9	30%	0.304	37%	0.368	S	S	.	.	H	α-helix	trans	-43.3	-42.6	172.4	-164.1	169.2	176.9	174.3	0	111.4	F197 E198 Q201 V224 R225	F197-K221 HydrophobicContact CB-CG 4.13Å; E198-K221 HydrophobicContact CB-CD 4.24Å; E198-K221 IonicContact OE2-NZ 3.33Å; E198-K221 PolarHBondContact OE2-NZ 2.85Å; Q201-K221 VanDerWaalsContact CD-N 3.31Å; Q201-K221 VanDerWaalsContact OE1-CB 3.24Å; K221-V224 PolarHBondContact O-N 3Å; K221-R225 WeakPolarHBondContact O-CB 3.4Å; K221-R225 PolarHBondContact O-N 2.82Å
222	E	84.8	Confident	78.9	Confident	83 Å²	83	65.7 Å²	65.7	39%	0.388	34%	0.341	S	S	.	.	H	α-helix	trans	-69.9	-38	179.7	-160.4	55.8	-95.3	0	0	113.5	N220 R225 H226	N220-E222 PolarHBondContact O-N 2.67Å; E222-R225 IonicContact OE1-CZ 2.99Å; E222-R225 IonicContact OE1-NH1 2.86Å; E222-R225 PolarHBondContact OE1-NH1 3.13Å; E222-R225 IonicContact OE2-CZ 3.42Å; E222-R225 IonicContact OE2-NH1 2.75Å; E222-R225 PolarHBondContact OE2-NH1 2.96Å; E222-H226 WeakPolarHBondContact O-CB 3.4Å; E222-H226 PolarHBondContact O-N 3.3Å; E222-H226 PolarHBondContact O-ND1 3.49Å; E222-H226 IonicContact OE1-CE1 3.65Å; E222-H226 PolarHBondContact OE1-CE1 2.74Å; E222-H226 IonicContact OE1-ND1 3.12Å; E222-H226 PolarHBondContact OE1-ND1 3.18Å
223	Q	85.6	Confident	79.9	Confident	82 Å²	82	67.9 Å²	67.9	38%	0.383	33%	0.332	S	S	.	.	H	α-helix	trans	-70.3	-36.9	175.1	-66.8	173.4	-33.8	0	0	111.1	W178 K219 N220 F227	W178-Q223 HydrophobicContact CZ2-CB 4.42Å; W178-Q223 WeakPolarHBondContact CZ2-O 3.35Å; K219-Q223 VanDerWaalsContact CA-OE1 3.22Å; K219-Q223 HydrophobicContact CB-CB 4.24Å; N220-Q223 HydrophobicContact CB-CG 4.42Å; N220-Q223 WeakPolarHBondContact O-CA 3.27Å; N220-Q223 WeakPolarHBondContact O-CB 3.5Å; N220-Q223 PolarHBondContact O-N 3.5Å; Q223-F227 VanDerWaalsContact O-CB 3.31Å; Q223-F227 WeakPolarHBondContact O-CB 3.34Å; Q223-F227 PolarHBondContact O-N 3.15Å
224	V	87.8	Confident	80.6	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-63.1	-47.4	173.3	171.1	0	0	0	0	110.8	W178 F186 F197 I200 Q201 I204 K219 N220 K221 F227 Y228	W178-V224 HydrophobicContact CH2-CG2 4.34Å; F186-V224 HydrophobicContact CD2-CG1 4.05Å; F186-V224 HydrophobicContact CE2-CG1 3.89Å; F197-V224 HydrophobicContact CB-CG1 4.25Å; F197-V224 HydrophobicContact CD1-CG1 4.26Å; I200-V224 HydrophobicContact CB-CG1 3.96Å; I200-V224 HydrophobicContact CG2-CG1 3.53Å; Q201-V224 HydrophobicContact CB-CG2 4.38Å; I204-V224 HydrophobicContact CD1-CG2 3.94Å; K219-V224 HydrophobicContact CB-CG2 4.28Å; N220-V224 WeakPolarHBondContact O-CG2 3.49Å; N220-V224 PolarHBondContact O-N 3.43Å; K221-V224 PolarHBondContact O-N 3Å; V224-F227 PolarHBondContact O-N 3.23Å; V224-Y228 PolarHBondContact O-N 3.33Å
225	R	88.8	Confident	81.8	Confident	71 Å²	71	65.8 Å²	65.8	27%	0.268	32%	0.315	S	S	.	.	H	α-helix	trans	-60.8	-49.2	175.3	-171.3	-170.4	-66.6	107.9	-17.3	111.7	F197 K221 E222 F227 Y228 Y229	F197-R225 HydrophobicContact CD1-CB 4.19Å; F197-R225 HydrophobicContact CD1-CG 4.45Å; F197-R225 HydrophobicContact CD2-CB 4.25Å; F197-R225 HydrophobicContact CD2-CG 4.03Å; F197-R225 HydrophobicContact CE1-CB 4.45Å; F197-R225 HydrophobicContact CE1-CG 4.3Å; F197-R225 HydrophobicContact CE2-CB 4.5Å; F197-R225 HydrophobicContact CE2-CG 3.85Å; F197-R225 HydrophobicContact CG-CB 4.09Å; F197-R225 HydrophobicContact CG-CG 4.32Å; F197-R225 HydrophobicContact CZ-CG 3.99Å; K221-R225 WeakPolarHBondContact O-CB 3.4Å; K221-R225 PolarHBondContact O-N 2.82Å; E222-R225 IonicContact OE1-CZ 2.99Å; E222-R225 IonicContact OE1-NH1 2.86Å; E222-R225 PolarHBondContact OE1-NH1 3.13Å; E222-R225 IonicContact OE2-CZ 3.42Å; E222-R225 IonicContact OE2-NH1 2.75Å; E222-R225 PolarHBondContact OE2-NH1 2.96Å; R225-F227 VanDerWaalsContact C-N 3.28Å; R225-F227 PolarHBondContact O-N 3.41Å; R225-Y228 WeakPolarHBondContact O-CB 3.25Å; R225-Y228 PolarHBondContact O-N 3.05Å; R225-Y229 HydrophobicContact CG-CD2 3.82Å; R225-Y229 HydrophobicContact CG-CE2 3.69Å; R225-Y229 WeakPolarHBondContact O-CD2 3.38Å; R225-Y229 PolarHBondContact O-N 3.27Å
226	H	88.4	Confident	82.8	Confident	108 Å²	108	63.5 Å²	63.5	50%	0.5	29%	0.294	S	S	.	.	H	α-helix	trans	-60.8	-35.4	175.2	-79	100.9	0	0	0	112.6	E222 R230	E222-H226 WeakPolarHBondContact O-CB 3.4Å; E222-H226 PolarHBondContact O-N 3.3Å; E222-H226 PolarHBondContact O-ND1 3.49Å; E222-H226 IonicContact OE1-CE1 3.65Å; E222-H226 PolarHBondContact OE1-CE1 2.74Å; E222-H226 IonicContact OE1-ND1 3.12Å; E222-H226 PolarHBondContact OE1-ND1 3.18Å; H226-R230 VanDerWaalsContact O-CB 3.22Å; H226-R230 WeakPolarHBondContact O-CB 3.36Å; H226-R230 VanDerWaalsContact O-CG 3.23Å; H226-R230 WeakPolarHBondContact O-CG 3.3Å; H226-R230 PolarHBondContact O-N 3.45Å
227	F	87.3	Confident	83.6	Confident	27 Å²	27	65.4 Å²	65.4	12%	0.118	30%	0.296	C	S	.	.	H	α-helix	trans	-71	-39.7	176.8	-174.3	-98.6	0	0	0	112.6	W178 K183 F186 F187 Q223 V224 R225 T231	W178-F227 HydrophobicContact CB-CE2 4.38Å; W178-F227 AromaticContact CD1-CD2 3.93Å; W178-F227 HydrophobicContact CD2-CB 4.41Å; W178-F227 AromaticContact CD2-CD2 3.66Å; W178-F227 HydrophobicContact CD2-CD2 3.66Å; W178-F227 HydrophobicContact CD2-CE2 4.1Å; W178-F227 AromaticContact CD2-CG 3.91Å; W178-F227 HydrophobicContact CD2-CG 3.91Å; W178-F227 AromaticContact CE2-CD2 3.7Å; W178-F227 AromaticContact CE2-CG 3.73Å; W178-F227 HydrophobicContact CE3-CD1 4.29Å; W178-F227 HydrophobicContact CE3-CD2 4.2Å; W178-F227 HydrophobicContact CE3-CE2 4.46Å; W178-F227 HydrophobicContact CE3-CG 4.14Å; W178-F227 AromaticContact CG-CD2 3.85Å; W178-F227 HydrophobicContact CG-CD2 3.85Å; W178-F227 HydrophobicContact CG-CE2 4.06Å; W178-F227 HydrophobicContact CH2-CB 3.92Å; W178-F227 HydrophobicContact CH2-CD1 4.32Å; W178-F227 HydrophobicContact CH2-CG 4.08Å; W178-F227 HydrophobicContact CZ2-CB 3.46Å; W178-F227 VanDerWaalsContact CZ2-CB 3.46Å; W178-F227 HydrophobicContact CZ2-CD2 4.29Å; W178-F227 AromaticContact CZ2-CG 3.84Å; W178-F227 HydrophobicContact CZ2-CG 3.84Å; W178-F227 HydrophobicContact CZ3-CD1 4.2Å; W178-F227 HydrophobicContact CZ3-CG 4.22Å; W178-F227 AromaticContact NE1-CD2 3.81Å; K183-F227 HydrophobicContact CD-CZ 4.49Å; K183-F227 HydrophobicContact CG-CE1 4.48Å; K183-F227 HydrophobicContact CG-CE2 4.31Å; K183-F227 HydrophobicContact CG-CZ 3.79Å; F186-F227 AromaticContact CD1-CD1 3.64Å; F186-F227 HydrophobicContact CD1-CD1 3.64Å; F186-F227 AromaticContact CD1-CE1 3.54Å; F186-F227 HydrophobicContact CD1-CE1 3.54Å; F186-F227 AromaticContact CD2-CD1 3.89Å; F186-F227 HydrophobicContact CD2-CD1 3.89Å; F186-F227 AromaticContact CE1-CD1 3.69Å; F186-F227 HydrophobicContact CE1-CD1 3.69Å; F186-F227 AromaticContact CE1-CE1 3.77Å; F186-F227 HydrophobicContact CE1-CE1 3.77Å; F186-F227 AromaticContact CE2-CD1 3.93Å; F186-F227 HydrophobicContact CE2-CD1 3.93Å; F186-F227 AromaticContact CG-CD1 3.76Å; F186-F227 HydrophobicContact CG-CD1 3.76Å; F186-F227 AromaticContact CG-CE1 3.99Å; F186-F227 HydrophobicContact CG-CE1 3.99Å; F186-F227 AromaticContact CZ-CD1 3.84Å; F186-F227 HydrophobicContact CZ-CD1 3.84Å; F186-F227 HydrophobicContact CZ-CE1 4.39Å; F187-F227 HydrophobicContact CE2-CE1 4.46Å; F187-F227 HydrophobicContact CZ-CE1 4.16Å; Q223-F227 VanDerWaalsContact O-CB 3.31Å; Q223-F227 WeakPolarHBondContact O-CB 3.34Å; Q223-F227 PolarHBondContact O-N 3.15Å; V224-F227 PolarHBondContact O-N 3.23Å; R225-F227 VanDerWaalsContact C-N 3.28Å; R225-F227 PolarHBondContact O-N 3.41Å; F227-T231 WeakPolarHBondContact CZ-OG1 3.28Å; F227-T231 VanDerWaalsContact O-CB 3.26Å; F227-T231 WeakPolarHBondContact O-CB 3.48Å; F227-T231 PolarHBondContact O-N 3.41Å; F227-T231 PolarHBondContact O-OG1 2.91Å
228	Y	89.2	Confident	83.9	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-54.3	-58	169.9	176.3	-81.5	0	0	0	110.3	F186 L190 K195 F197 V224 R225 R230 T231 W232 E255 L256 L259	F186-Y228 HydrophobicContact CZ-CD2 4.38Å; L190-Y228 HydrophobicContact CD1-CD2 3.96Å; L190-Y228 HydrophobicContact CD1-CE2 4.01Å; K195-Y228 HydrophobicContact CG-CE2 4.25Å; F197-Y228 HydrophobicContact CE1-CD1 4.05Å; F197-Y228 AromaticContact CE1-CD2 3.86Å; F197-Y228 HydrophobicContact CE1-CD2 3.86Å; F197-Y228 AromaticContact CE1-CG 3.61Å; F197-Y228 HydrophobicContact CE1-CG 3.61Å; F197-Y228 HydrophobicContact CZ-CD1 4.17Å; F197-Y228 HydrophobicContact CZ-CG 4.2Å; V224-Y228 PolarHBondContact O-N 3.33Å; R225-Y228 WeakPolarHBondContact O-CB 3.25Å; R225-Y228 PolarHBondContact O-N 3.05Å; Y228-R230 PolarHBondContact O-N 3.26Å; Y228-T231 PolarHBondContact O-N 3.45Å; Y228-W232 PolarHBondContact O-N 3.42Å; Y228-E255 PolarHBondContact OH-OE2 3.13Å; Y228-L256 HydrophobicContact CE2-CD1 4.2Å; Y228-L259 HydrophobicContact CD1-CD1 4.34Å; Y228-L259 HydrophobicContact CD2-CD1 3.6Å; Y228-L259 HydrophobicContact CE1-CD1 4.01Å; Y228-L259 HydrophobicContact CE2-CD1 3.24Å; Y228-L259 HydrophobicContact CG-CD1 4.13Å; Y228-L259 VanDerWaalsContact CZ-CD1 3.45Å
229	Y	88.7	Confident	84.1	Confident	79 Å²	79	64.9 Å²	64.9	31%	0.31	29%	0.29	S	S	.	.	H	α-helix	trans	-68.9	-39.2	-174.6	-73.7	-65.8	0	0	0	112.7	K195 F197 R225 T231 W232 H233	K195-Y229 VanDerWaalsContact CE-OH 3.24Å; K195-Y229 WeakPolarHBondContact CE-OH 3.29Å; K195-Y229 PolarHBondContact NZ-OH 3.09Å; F197-Y229 HydrophobicContact CZ-CE2 4.06Å; R225-Y229 HydrophobicContact CG-CD2 3.82Å; R225-Y229 HydrophobicContact CG-CE2 3.69Å; R225-Y229 WeakPolarHBondContact O-CD2 3.38Å; R225-Y229 PolarHBondContact O-N 3.27Å; Y229-T231 VanDerWaalsContact C-N 3.28Å; Y229-T231 PolarHBondContact O-N 3.33Å; Y229-W232 PolarHBondContact O-N 2.82Å; Y229-H233 WeakPolarHBondContact O-CB 3.43Å; Y229-H233 PolarHBondContact O-N 3.23Å; Y229-H233 PolarHBondContact O-ND1 2.64Å
230	R	87.3	Confident	83.5	Confident	174 Å²	174	69 Å²	69	66%	0.657	31%	0.312	S	S	*	.	H	α-helix	trans	-67.6	-28	175.5	-70.5	-179.3	71.7	163.3	4.7	113	H226 Y228 K234	H226-R230 VanDerWaalsContact O-CB 3.22Å; H226-R230 WeakPolarHBondContact O-CB 3.36Å; H226-R230 VanDerWaalsContact O-CG 3.23Å; H226-R230 WeakPolarHBondContact O-CG 3.3Å; H226-R230 PolarHBondContact O-N 3.45Å; Y228-R230 PolarHBondContact O-N 3.26Å; R230-K234 PolarHBondContact O-N 3.25Å
231	T	86.8	Confident	82.5	Confident	13 Å²	13	68.3 Å²	68.3	8%	0.08	31%	0.305	C	S	.	.	H	α-helix	trans	-72	-47.8	170.6	-57.2	0	0	0	0	110.3	F187 F227 Y228 Y229 H233 K234 I235 L259 Y262	F187-T231 HydrophobicContact CZ-CG2 4.24Å; F227-T231 WeakPolarHBondContact CZ-OG1 3.28Å; F227-T231 VanDerWaalsContact O-CB 3.26Å; F227-T231 WeakPolarHBondContact O-CB 3.48Å; F227-T231 PolarHBondContact O-N 3.41Å; F227-T231 PolarHBondContact O-OG1 2.91Å; Y228-T231 PolarHBondContact O-N 3.45Å; Y229-T231 VanDerWaalsContact C-N 3.28Å; Y229-T231 PolarHBondContact O-N 3.33Å; T231-H233 PolarHBondContact O-N 3.44Å; T231-K234 WeakPolarHBondContact O-CB 3.23Å; T231-K234 PolarHBondContact O-N 2.86Å; T231-I235 PolarHBondContact O-N 3.04Å; T231-L259 HydrophobicContact CG2-CD2 3.64Å; T231-Y262 HydrophobicContact CG2-CD1 3.83Å; T231-Y262 HydrophobicContact CG2-CE1 3.49Å; T231-Y262 VanDerWaalsContact CG2-CE1 3.49Å
232	W	86.8	Confident	81	Confident	22 Å²	22	69.9 Å²	69.9	8%	0.083	33%	0.332	C	S	.	.	H	α-helix	trans	-56.7	-50.1	177	177.7	-116.7	0	0	0	112	Y228 Y229 K234 I235 S236 I239 F241 E255 L259	Y228-W232 PolarHBondContact O-N 3.42Å; Y229-W232 PolarHBondContact O-N 2.82Å; W232-K234 PolarHBondContact O-N 2.81Å; W232-I235 HydrophobicContact CE3-CD1 3.9Å; W232-I235 HydrophobicContact CE3-CG1 3.79Å; W232-I235 HydrophobicContact CZ3-CD1 4.16Å; W232-I235 HydrophobicContact CZ3-CG1 4.16Å; W232-I235 WeakPolarHBondContact O-CG1 3.3Å; W232-I235 PolarHBondContact O-N 3.11Å; W232-S236 WeakPolarHBondContact O-CB 3.45Å; W232-S236 PolarHBondContact O-N 2.85Å; W232-I239 HydrophobicContact CH2-CD1 4.28Å; W232-I239 HydrophobicContact CZ3-CD1 3.95Å; W232-F241 AromaticContact CH2-CE1 3.99Å; W232-F241 HydrophobicContact CH2-CE1 3.99Å; W232-F241 AromaticContact CH2-CZ 3.87Å; W232-F241 HydrophobicContact CH2-CZ 3.87Å; W232-F241 AromaticContact CZ2-CE1 3.9Å; W232-F241 HydrophobicContact CZ2-CE1 3.9Å; W232-F241 AromaticContact CZ2-CZ 3.64Å; W232-F241 HydrophobicContact CZ2-CZ 3.64Å; W232-E255 HydrophobicContact CD2-CB 4.33Å; W232-E255 HydrophobicContact CD2-CG 4.26Å; W232-E255 HydrophobicContact CZ2-CB 4.3Å; W232-E255 HydrophobicContact CZ2-CG 3.94Å; W232-E255 WeakPolarHBondContact CZ3-O 3.4Å; W232-L259 HydrophobicContact CB-CD1 4.38Å; W232-L259 HydrophobicContact CB-CD2 4.42Å; W232-L259 HydrophobicContact CE3-CG 4.08Å
233	H	84.1	Confident	79.5	Confident	118 Å²	118	72.5 Å²	72.5	55%	0.546	35%	0.348	S	S	.	.	H	α-helix	trans	-62	-16.6	177.3	-74.2	78.6	0	0	0	114	Y229 T231	Y229-H233 WeakPolarHBondContact O-CB 3.43Å; Y229-H233 PolarHBondContact O-N 3.23Å; Y229-H233 PolarHBondContact O-ND1 2.64Å; T231-H233 PolarHBondContact O-N 3.44Å
234	K	83.5	Confident	78	Confident	116 Å²	116	69.3 Å²	69.3	50%	0.504	33%	0.334	S	S	.	.	H	α-helix	trans	-83	-38.1	171.8	-176.7	167.6	179.9	170.3	0	112.5	R230 T231 W232 H238	R230-K234 PolarHBondContact O-N 3.25Å; T231-K234 WeakPolarHBondContact O-CB 3.23Å; T231-K234 PolarHBondContact O-N 2.86Å; W232-K234 PolarHBondContact O-N 2.81Å; K234-H238 PolarHBondContact O-CD2 2.63Å; K234-H238 VanDerWaalsContact O-CD2 3.25Å
235	I	83.3	Confident	76.4	Confident	3 Å²	3	70.8 Å²	70.8	2%	0.015	34%	0.34	C	S	.	.	H	α-helix	trans	-89.1	-30.2	179.4	58.4	178.6	0	0	0	113.4	T231 W232 K237 H238 I239 L259 Y262 L281	T231-I235 PolarHBondContact O-N 3.04Å; W232-I235 HydrophobicContact CE3-CD1 3.9Å; W232-I235 HydrophobicContact CE3-CG1 3.79Å; W232-I235 HydrophobicContact CZ3-CD1 4.16Å; W232-I235 HydrophobicContact CZ3-CG1 4.16Å; W232-I235 WeakPolarHBondContact O-CG1 3.3Å; W232-I235 PolarHBondContact O-N 3.11Å; I235-K237 PolarHBondContact O-N 2.79Å; I235-K237 VanDerWaalsContact O-N 3.12Å; I235-H238 CarbonylContact O-C 3.57Å; I235-H238 WeakPolarHBondContact O-CA 3.47Å; I235-H238 WeakPolarHBondContact O-CB 3.19Å; I235-H238 PolarHBondContact O-N 3.35Å; I235-I239 HydrophobicContact CB-CD1 4.07Å; I235-I239 HydrophobicContact CD1-CD1 4.3Å; I235-I239 HydrophobicContact CG1-CD1 4.12Å; I235-I239 WeakPolarHBondContact O-CG1 3.36Å; I235-I239 PolarHBondContact O-N 3.09Å; I235-L259 HydrophobicContact CD1-CD2 3.89Å; I235-L259 HydrophobicContact CD1-CG 4.18Å; I235-Y262 HydrophobicContact CD1-CD1 4.46Å; I235-Y262 HydrophobicContact CD1-CG 4.06Å; I235-Y262 HydrophobicContact CG2-CD2 3.53Å; I235-Y262 HydrophobicContact CG2-CE2 4.01Å; I235-Y262 HydrophobicContact CG2-CG 3.83Å; I235-L281 HydrophobicContact CB-CD2 4.2Å; I235-L281 HydrophobicContact CG2-CD2 4.01Å
236	S	80.4	Confident	74.5	Confident	35 Å²	35	73.3 Å²	73.3	25%	0.245	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-17	178.5	-176.9	0	0	0	0	113.9	W232 F241	W232-S236 WeakPolarHBondContact O-CB 3.45Å; W232-S236 PolarHBondContact O-N 2.85Å; S236-F241 WeakPolarHBondContact O-CE2 3.47Å; S236-F241 WeakPolarHBondContact OG-CZ 3.27Å
237	K	79.7	Confident	72.8	Confident	175 Å²	175	77.9 Å²	77.9	76%	0.761	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-4.1	171.6	-67.5	-170.6	175.3	-160.2	0	113.7	I235	I235-K237 PolarHBondContact O-N 2.79Å; I235-K237 VanDerWaalsContact O-N 3.12Å
238	H	70.5	Confident	71	Confident	84 Å²	84	83.7 Å²	83.7	39%	0.389	42%	0.419	S	S	.	.	S	Bend	trans	-134.2	8.5	-168.1	-65.3	-48.2	0	0	0	112.1	K234 I235 V278 N282	K234-H238 PolarHBondContact O-CD2 2.63Å; K234-H238 VanDerWaalsContact O-CD2 3.25Å; I235-H238 CarbonylContact O-C 3.57Å; I235-H238 WeakPolarHBondContact O-CA 3.47Å; I235-H238 WeakPolarHBondContact O-CB 3.19Å; I235-H238 PolarHBondContact O-N 3.35Å; H238-V278 HydrophobicContact CB-CB 4.39Å; H238-V278 HydrophobicContact CB-CG1 3.7Å; H238-V278 HydrophobicContact CB-CG2 3.81Å; H238-N282 VanDerWaalsContact O-CG 3.3Å; H238-N282 PolarHBondContact O-ND2 3.33Å; H238-N282 PolarHBondContact O-OD1 3.17Å
239	I	75.5	Confident	69.8	Low	7 Å²	7	85.2 Å²	85.2	4%	0.036	43%	0.427	C	S	.	.			trans	-113.6	118.9	178.8	-68.7	166.1	0	0	0	108	W232 I235 F241 V244 I285	W232-I239 HydrophobicContact CH2-CD1 4.28Å; W232-I239 HydrophobicContact CZ3-CD1 3.95Å; I235-I239 HydrophobicContact CB-CD1 4.07Å; I235-I239 HydrophobicContact CD1-CD1 4.3Å; I235-I239 HydrophobicContact CG1-CD1 4.12Å; I235-I239 WeakPolarHBondContact O-CG1 3.36Å; I235-I239 PolarHBondContact O-N 3.09Å; I239-F241 WeakPolarHBondContact O-CD2 3.45Å; I239-F241 WeakPolarHBondContact O-CE2 3.35Å; I239-F241 PolarHBondContact O-N 2.64Å; I239-V244 HydrophobicContact CG2-CG2 4.21Å; I239-I285 HydrophobicContact CD1-CD1 3.93Å; I239-I285 HydrophobicContact CG1-CD1 4.04Å
240	D	64.6	Low	68.9	Low	91 Å²	91	88 Å²	88	49%	0.487	44%	0.44	S	S	.	.			trans	-81.7	78.8	-173.5	-52.7	-51.2	0	0	0	111.3	A242 N243 V244 N282	D240-A242 PolarHBondContact O-N 3.23Å; D240-N243 PolarHBondContact O-N 2.85Å; D240-V244 WeakPolarHBondContact O-CB 3.47Å; D240-V244 WeakPolarHBondContact O-CG2 3.47Å; D240-V244 PolarHBondContact O-N 3.12Å; D240-V244 VanDerWaalsContact O-N 3.08Å; D240-N282 PolarHBondContact OD2-ND2 2.97Å
241	F	63.5	Low	68.3	Low	76 Å²	76	87.9 Å²	87.9	33%	0.333	45%	0.445	S	S	.	.	H	α-helix	trans	-47.8	-33.7	-174	-67.2	-86.1	0	0	0	114.6	W232 S236 I239 Y245	W232-F241 AromaticContact CH2-CE1 3.99Å; W232-F241 HydrophobicContact CH2-CE1 3.99Å; W232-F241 AromaticContact CH2-CZ 3.87Å; W232-F241 HydrophobicContact CH2-CZ 3.87Å; W232-F241 AromaticContact CZ2-CE1 3.9Å; W232-F241 HydrophobicContact CZ2-CE1 3.9Å; W232-F241 AromaticContact CZ2-CZ 3.64Å; W232-F241 HydrophobicContact CZ2-CZ 3.64Å; S236-F241 WeakPolarHBondContact O-CE2 3.47Å; S236-F241 WeakPolarHBondContact OG-CZ 3.27Å; I239-F241 WeakPolarHBondContact O-CD2 3.45Å; I239-F241 WeakPolarHBondContact O-CE2 3.35Å; I239-F241 PolarHBondContact O-N 2.64Å; F241-Y245 HydrophobicContact CD1-CD2 4.33Å; F241-Y245 AromaticContact CD1-CE2 3.9Å; F241-Y245 HydrophobicContact CD1-CE2 3.9Å; F241-Y245 HydrophobicContact CE1-CE2 4.42Å
242	A	55	Low	67.7	Low	104 Å²	104	89.8 Å²	89.8	86%	0.86	46%	0.459	S	S	*	.	H	α-helix	trans	-66.1	-40.1	179.2	0	0	0	0	0	114	D240	D240-A242 PolarHBondContact O-N 3.23Å
243	N	53.1	Low	67.3	Low	138 Å²	138	89 Å²	89	74%	0.738	46%	0.457	S	S	*	.	H	α-helix	trans	-96.2	-13.5	-178.4	-107.7	18.3	0	0	0	113.4	D240	D240-N243 PolarHBondContact O-N 2.85Å
244	V	52.9	Low	66.8	Low	15 Å²	15	85 Å²	85	9%	0.091	44%	0.438	C	S	.	.	H	α-helix	trans	-82.1	-35.9	-173.4	162.8	0	0	0	0	113.3	I239 D240 I285 Q286	I239-V244 HydrophobicContact CG2-CG2 4.21Å; D240-V244 WeakPolarHBondContact O-CB 3.47Å; D240-V244 WeakPolarHBondContact O-CG2 3.47Å; D240-V244 PolarHBondContact O-N 3.12Å; D240-V244 VanDerWaalsContact O-N 3.08Å; V244-I285 HydrophobicContact CB-CG2 4.16Å; V244-I285 HydrophobicContact CG1-CG2 3.21Å; V244-I285 HydrophobicContact CG2-CG2 3.81Å; V244-Q286 HydrophobicContact CG2-CG 3.87Å
245	Y	55.9	Low	66.9	Low	30 Å²	30	80.9 Å²	80.9	12%	0.118	42%	0.42	C	S	.	.			trans	-110.6	62	-165.8	-66.1	-65.6	0	0	0	113.8	F241 R247 L249 Q254 Y257	F241-Y245 HydrophobicContact CD1-CD2 4.33Å; F241-Y245 AromaticContact CD1-CE2 3.9Å; F241-Y245 HydrophobicContact CD1-CE2 3.9Å; F241-Y245 HydrophobicContact CE1-CE2 4.42Å; Y245-R247 PolarHBondContact O-N 2.93Å; Y245-R247 VanDerWaalsContact O-N 3.15Å; Y245-L249 HydrophobicContact CD1-CD1 4.23Å; Y245-L249 HydrophobicContact CE1-CD1 4.24Å; Y245-Q254 HydrophobicContact CD1-CG 3.95Å; Y245-Q254 VanDerWaalsContact CD2-CD 3.44Å; Y245-Q254 HydrophobicContact CD2-CG 3.96Å; Y245-Q254 HydrophobicContact CE1-CB 4.05Å; Y245-Q254 HydrophobicContact CE1-CG 3.7Å; Y245-Q254 HydrophobicContact CE2-CB 3.76Å; Y245-Q254 HydrophobicContact CE2-CG 3.7Å; Y245-Q254 HydrophobicContact CG-CG 4.09Å; Y245-Q254 WeakPolarHBondContact OH-CA 3.35Å; Y245-Q254 PolarHBondContact OH-O 3.22Å; Y245-Y257 HydrophobicContact CE1-CD1 4.05Å
246	S	47.3	Very low	66.9	Low	124 Å²	124	80.7 Å²	80.7	87%	0.867	42%	0.42	S	S	*	.	S	Bend	trans	-59.5	-16.3	165.1	161.7	0	0	0	0	113.2
247	R	52.9	Low	67	Low	204 Å²	204	80.8 Å²	80.8	77%	0.77	42%	0.415	S	S	*	.	S	Bend	trans	-102.3	129.6	165.6	-60.9	-175.3	-176.1	-144.5	-2.1	109.5	Y245 L249	Y245-R247 PolarHBondContact O-N 2.93Å; Y245-R247 VanDerWaalsContact O-N 3.15Å; R247-L249 HydrophobicContact CB-CG 4.48Å; R247-L249 PolarHBondContact O-N 3.31Å
248	V	50.6	Low	67.2	Low	149 Å²	149	72.5 Å²	72.5	90%	0.903	38%	0.379	S	S	*	.			trans	-71.7	75	-178.8	-172.2	0	0	0	0	111.1
249	L	64	Low	68	Low	32 Å²	32	68.5 Å²	68.5	17%	0.168	36%	0.36	C	S	.	.			trans	-86.7	137.1	176.1	-69.5	176.5	0	0	0	110.9	Y245 R247 Q254	Y245-L249 HydrophobicContact CD1-CD1 4.23Å; Y245-L249 HydrophobicContact CE1-CD1 4.24Å; R247-L249 HydrophobicContact CB-CG 4.48Å; R247-L249 PolarHBondContact O-N 3.31Å; L249-Q254 HydrophobicContact CB-CG 4.01Å; L249-Q254 PolarHBondContact O-NE2 2.92Å
250	K	68.7	Low	68.4	Low	138 Å²	138	68.2 Å²	68.2	60%	0.6	36%	0.359	S	S	*	.			trans	-56.8	142.9	174.7	-66	174.3	-177.9	172	0	110.2	S252 S253 Q254	K250-S252 PolarHBondContact O-N 3.2Å; K250-S252 VanDerWaalsContact O-N 3.07Å; K250-S253 WeakPolarHBondContact O-CA 3.3Å; K250-S253 WeakPolarHBondContact O-CB 3.48Å; K250-S253 PolarHBondContact O-N 2.95Å; K250-Q254 PolarHBondContact O-N 2.78Å
251	K	75.4	Confident	69.2	Low	172 Å²	172	63.9 Å²	63.9	75%	0.748	34%	0.336	S	S	*	.	H	α-helix	trans	-52.7	-35.9	-173	-163.3	169.6	-174.9	171.7	0	113.5	Q254 E255	K251-Q254 WeakPolarHBondContact O-CB 3.44Å; K251-Q254 PolarHBondContact O-N 2.93Å; K251-E255 WeakPolarHBondContact O-CG 3.02Å; K251-E255 PolarHBondContact O-N 2.8Å
252	S	75	Confident	70.1	Confident	53 Å²	53	61.4 Å²	61.4	37%	0.371	32%	0.324	S	S	.	.	H	α-helix	trans	-67.3	-34.3	173.5	47.2	0	0	0	0	114.5	K250 L256	K250-S252 PolarHBondContact O-N 3.2Å; K250-S252 VanDerWaalsContact O-N 3.07Å; S252-L256 PolarHBondContact O-N 3.12Å
253	S	76.8	Confident	71.5	Confident	6 Å²	6	56.5 Å²	56.5	4%	0.042	28%	0.284	C	S	.	.	H	α-helix	trans	-71.1	-37.5	172.6	-52.8	0	0	0	0	111.3	K250 L256 Y257 L312	K250-S253 WeakPolarHBondContact O-CA 3.3Å; K250-S253 WeakPolarHBondContact O-CB 3.48Å; K250-S253 PolarHBondContact O-N 2.95Å; S253-L256 PolarHBondContact O-N 2.83Å; S253-Y257 WeakPolarHBondContact O-CB 3.48Å; S253-Y257 PolarHBondContact O-N 2.97Å; S253-L312 WeakPolarHBondContact CB-O 3.47Å; S253-L312 PolarHBondContact OG-O 3.17Å
254	Q	75.4	Confident	72.8	Confident	32 Å²	32	51 Å²	51	15%	0.15	25%	0.254	C	S	.	.	H	α-helix	trans	-61.8	-45.6	173.9	-60	-175.2	6.5	0	0	112	Y245 L249 K250 K251 L256 Y257 G258	Y245-Q254 HydrophobicContact CD1-CG 3.95Å; Y245-Q254 VanDerWaalsContact CD2-CD 3.44Å; Y245-Q254 HydrophobicContact CD2-CG 3.96Å; Y245-Q254 HydrophobicContact CE1-CB 4.05Å; Y245-Q254 HydrophobicContact CE1-CG 3.7Å; Y245-Q254 HydrophobicContact CE2-CB 3.76Å; Y245-Q254 HydrophobicContact CE2-CG 3.7Å; Y245-Q254 HydrophobicContact CG-CG 4.09Å; Y245-Q254 WeakPolarHBondContact OH-CA 3.35Å; Y245-Q254 PolarHBondContact OH-O 3.22Å; L249-Q254 HydrophobicContact CB-CG 4.01Å; L249-Q254 PolarHBondContact O-NE2 2.92Å; K250-Q254 PolarHBondContact O-N 2.78Å; K251-Q254 WeakPolarHBondContact O-CB 3.44Å; K251-Q254 PolarHBondContact O-N 2.93Å; Q254-L256 VanDerWaalsContact C-N 3.32Å; Q254-L256 PolarHBondContact O-N 3.01Å; Q254-Y257 PolarHBondContact O-N 3.33Å; Q254-G258 PolarHBondContact O-N 3.44Å; Q254-G258 VanDerWaalsContact O-N 3.08Å
255	E	85.1	Confident	74	Confident	30 Å²	30	50.3 Å²	50.3	14%	0.14	25%	0.249	C	C	.	.	H	α-helix	trans	-53.2	-48.9	172.9	-71.7	175.7	-155.9	0	0	111.8	K195 Y228 W232 K251 L259	K195-E255 WeakPolarHBondContact CE-OE2 3.06Å; K195-E255 IonicContact NZ-OE1 2.66Å; K195-E255 PolarHBondContact NZ-OE1 3.45Å; K195-E255 IonicContact NZ-OE2 2.69Å; K195-E255 PolarHBondContact NZ-OE2 2.83Å; Y228-E255 PolarHBondContact OH-OE2 3.13Å; W232-E255 HydrophobicContact CD2-CB 4.33Å; W232-E255 HydrophobicContact CD2-CG 4.26Å; W232-E255 HydrophobicContact CZ2-CB 4.3Å; W232-E255 HydrophobicContact CZ2-CG 3.94Å; W232-E255 WeakPolarHBondContact CZ3-O 3.4Å; K251-E255 WeakPolarHBondContact O-CG 3.02Å; K251-E255 PolarHBondContact O-N 2.8Å; E255-L259 WeakPolarHBondContact O-CG 3.16Å; E255-L259 PolarHBondContact O-N 3.35Å; E255-L259 VanDerWaalsContact O-N 3.12Å
256	L	83.7	Confident	75	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-69.8	-42.3	-175.9	-163.5	77.3	0	0	0	111.5	L190 Y228 S252 S253 Q254 G258 L259 I260 A308 L312	L190-L256 HydrophobicContact CD1-CD1 3.67Å; L190-L256 HydrophobicContact CG-CD1 4.1Å; Y228-L256 HydrophobicContact CE2-CD1 4.2Å; S252-L256 PolarHBondContact O-N 3.12Å; S253-L256 PolarHBondContact O-N 2.83Å; Q254-L256 VanDerWaalsContact C-N 3.32Å; Q254-L256 PolarHBondContact O-N 3.01Å; L256-G258 PolarHBondContact O-N 3.17Å; L256-L259 PolarHBondContact O-N 2.9Å; L256-I260 HydrophobicContact CD2-CD1 3.81Å; L256-I260 HydrophobicContact CG-CD1 3.64Å; L256-I260 HydrophobicContact CG-CG1 4.33Å; L256-I260 WeakPolarHBondContact O-CB 3.48Å; L256-I260 WeakPolarHBondContact O-CD1 3.19Å; L256-I260 WeakPolarHBondContact O-CG1 3.48Å; L256-I260 PolarHBondContact O-N 3.27Å; L256-A308 HydrophobicContact CD2-CB 3.92Å; L256-A308 WeakPolarHBondContact CD2-O 3.47Å; L256-L312 HydrophobicContact CB-CD1 3.91Å; L256-L312 HydrophobicContact CD2-CD1 3.52Å; L256-L312 HydrophobicContact CD2-CG 4.22Å; L256-L312 HydrophobicContact CG-CD1 4.29Å
257	Y	81.5	Confident	76.4	Confident	37 Å²	37	49.2 Å²	49.2	15%	0.145	23%	0.229	C	C	.	.	H	α-helix	trans	-58.8	-47.9	177.5	-178.6	-123.6	0	0	0	111.8	Y245 S253 Q254 L259 I260 C261 I285 A303 L309	Y245-Y257 HydrophobicContact CE1-CD1 4.05Å; S253-Y257 WeakPolarHBondContact O-CB 3.48Å; S253-Y257 PolarHBondContact O-N 2.97Å; Q254-Y257 PolarHBondContact O-N 3.33Å; Y257-L259 PolarHBondContact O-N 2.99Å; Y257-I260 PolarHBondContact O-N 2.84Å; Y257-C261 PolarHBondContact O-N 2.96Å; Y257-I285 HydrophobicContact CD1-CG2 4.42Å; Y257-I285 HydrophobicContact CE1-CB 4.31Å; Y257-I285 HydrophobicContact CE1-CG1 4.38Å; Y257-I285 HydrophobicContact CE1-CG2 3.93Å; Y257-I285 WeakPolarHBondContact CE1-O 3.41Å; Y257-I285 PolarHBondContact OH-O 2.56Å; Y257-A303 HydrophobicContact CE2-CB 4.29Å; Y257-L309 HydrophobicContact CD2-CD1 3.76Å; Y257-L309 HydrophobicContact CD2-CD2 3.71Å; Y257-L309 HydrophobicContact CD2-CG 4.41Å; Y257-L309 HydrophobicContact CE2-CD2 4.06Å; Y257-L309 HydrophobicContact CG-CD1 4.27Å
258	G	84.1	Confident	77.1	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.4	-41.5	176.5	0	0	0	0	0	113	Q254 L256 Y262	Q254-G258 PolarHBondContact O-N 3.44Å; Q254-G258 VanDerWaalsContact O-N 3.08Å; L256-G258 PolarHBondContact O-N 3.17Å; G258-Y262 VanDerWaalsContact O-CB 3.24Å; G258-Y262 WeakPolarHBondContact O-CB 3.46Å; G258-Y262 PolarHBondContact O-N 2.94Å
259	L	86.4	Confident	78	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.2	-37	174.1	-79.5	168.1	0	0	0	113.4	L190 Y228 T231 W232 I235 E255 L256 Y257 A263	L190-L259 HydrophobicContact CD2-CB 4.02Å; Y228-L259 HydrophobicContact CD1-CD1 4.34Å; Y228-L259 HydrophobicContact CD2-CD1 3.6Å; Y228-L259 HydrophobicContact CE1-CD1 4.01Å; Y228-L259 HydrophobicContact CE2-CD1 3.24Å; Y228-L259 HydrophobicContact CG-CD1 4.13Å; Y228-L259 VanDerWaalsContact CZ-CD1 3.45Å; T231-L259 HydrophobicContact CG2-CD2 3.64Å; W232-L259 HydrophobicContact CB-CD1 4.38Å; W232-L259 HydrophobicContact CB-CD2 4.42Å; W232-L259 HydrophobicContact CE3-CG 4.08Å; I235-L259 HydrophobicContact CD1-CD2 3.89Å; I235-L259 HydrophobicContact CD1-CG 4.18Å; E255-L259 WeakPolarHBondContact O-CG 3.16Å; E255-L259 PolarHBondContact O-N 3.35Å; E255-L259 VanDerWaalsContact O-N 3.12Å; L256-L259 PolarHBondContact O-N 2.9Å; Y257-L259 PolarHBondContact O-N 2.99Å; L259-A263 VanDerWaalsContact O-CB 3.24Å; L259-A263 WeakPolarHBondContact O-CB 3.37Å; L259-A263 PolarHBondContact O-N 3.48Å
260	I	84.6	Confident	77.9	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-69.7	-45.1	179.7	-77.5	167	0	0	0	111.2	Y191 L256 Y257 A263 E264 P304 C306 L309	Y191-I260 HydrophobicContact CD1-CG1 4.45Å; Y191-I260 HydrophobicContact CD1-CG2 4.27Å; Y191-I260 HydrophobicContact CE1-CG2 3.96Å; L256-I260 HydrophobicContact CD2-CD1 3.81Å; L256-I260 HydrophobicContact CG-CD1 3.64Å; L256-I260 HydrophobicContact CG-CG1 4.33Å; L256-I260 WeakPolarHBondContact O-CB 3.48Å; L256-I260 WeakPolarHBondContact O-CD1 3.19Å; L256-I260 WeakPolarHBondContact O-CG1 3.48Å; L256-I260 PolarHBondContact O-N 3.27Å; Y257-I260 PolarHBondContact O-N 2.84Å; I260-A263 PolarHBondContact O-N 2.94Å; I260-E264 PolarHBondContact O-N 2.91Å; I260-E264 VanDerWaalsContact O-N 3.1Å; I260-P304 HydrophobicContact CG2-CG 3.81Å; I260-C306 VanDerWaalsContact CD1-SG 3.51Å; I260-L309 HydrophobicContact CD1-CB 3.94Å; I260-L309 HydrophobicContact CD1-CD1 4.4Å
261	C	81.3	Confident	77.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.3	-42.3	174.3	-71.7	0	0	0	0	111.3	Y257 A263 E264 L265 L281 L284 I285	Y257-C261 PolarHBondContact O-N 2.96Å; C261-A263 VanDerWaalsContact C-N 3.34Å; C261-A263 PolarHBondContact O-N 3.44Å; C261-E264 PolarHBondContact O-N 2.91Å; C261-L265 WeakPolarHBondContact O-CB 3.34Å; C261-L265 PolarHBondContact O-N 3.42Å; C261-L281 HydrophobicContact CB-CD1 3.92Å; C261-L284 HydrophobicContact CB-CD2 4.16Å; C261-L284 HydrophobicContact CB-CG 4.36Å; C261-I285 HydrophobicContact CB-CD1 4.27Å; C261-I285 HydrophobicContact CB-CG1 3.66Å
262	Y	83.7	Confident	76.6	Confident	24 Å²	24	32.2 Å²	32.2	9%	0.094	18%	0.184	C	C	.	.	H	α-helix	trans	-58.3	-44.3	171.9	168.5	-104.3	0	0	0	112.2	F187 T231 I235 G258 E264 L265 R266 M273 L281	F187-Y262 HydrophobicContact CE1-CD1 4.38Å; F187-Y262 HydrophobicContact CE1-CE1 4.49Å; F187-Y262 HydrophobicContact CE2-CE1 4.43Å; F187-Y262 HydrophobicContact CZ-CD1 4.12Å; F187-Y262 AromaticContact CZ-CE1 3.79Å; F187-Y262 HydrophobicContact CZ-CE1 3.79Å; T231-Y262 HydrophobicContact CG2-CD1 3.83Å; T231-Y262 HydrophobicContact CG2-CE1 3.49Å; T231-Y262 VanDerWaalsContact CG2-CE1 3.49Å; I235-Y262 HydrophobicContact CD1-CD1 4.46Å; I235-Y262 HydrophobicContact CD1-CG 4.06Å; I235-Y262 HydrophobicContact CG2-CD2 3.53Å; I235-Y262 HydrophobicContact CG2-CE2 4.01Å; I235-Y262 HydrophobicContact CG2-CG 3.83Å; G258-Y262 VanDerWaalsContact O-CB 3.24Å; G258-Y262 WeakPolarHBondContact O-CB 3.46Å; G258-Y262 PolarHBondContact O-N 2.94Å; Y262-E264 PolarHBondContact O-N 3.2Å; Y262-L265 PolarHBondContact O-N 2.79Å; Y262-R266 WeakPolarHBondContact O-CB 3.33Å; Y262-R266 PolarHBondContact O-N 3.32Å; Y262-M273 HydrophobicContact CD2-CE 4.13Å; Y262-M273 HydrophobicContact CD2-SD 3.98Å; Y262-M273 HydrophobicContact CE2-CE 3.8Å; Y262-M273 HydrophobicContact CE2-CG 3.72Å; Y262-M273 HydrophobicContact CE2-SD 3.6Å; Y262-L281 HydrophobicContact CD2-CD2 4.4Å
263	A	83.1	Confident	76	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-63.4	-39.7	-179.4	0	0	0	0	0	112.3	F187 Y191 L259 I260 C261 K267	F187-A263 HydrophobicContact CB-CB 4.03Å; F187-A263 HydrophobicContact CD1-CB 3.41Å; F187-A263 VanDerWaalsContact CD1-CB 3.41Å; F187-A263 HydrophobicContact CD2-CB 4.28Å; F187-A263 HydrophobicContact CE1-CB 3.92Å; F187-A263 HydrophobicContact CG-CB 3.64Å; Y191-A263 HydrophobicContact CE2-CB 4.27Å; Y191-A263 VanDerWaalsContact OH-C 3.24Å; Y191-A263 WeakPolarHBondContact OH-CB 3.41Å; L259-A263 VanDerWaalsContact O-CB 3.24Å; L259-A263 WeakPolarHBondContact O-CB 3.37Å; L259-A263 PolarHBondContact O-N 3.48Å; I260-A263 PolarHBondContact O-N 2.94Å; C261-A263 VanDerWaalsContact C-N 3.34Å; C261-A263 PolarHBondContact O-N 3.44Å; A263-K267 WeakPolarHBondContact O-CG 3.4Å; A263-K267 PolarHBondContact O-N 3.12Å; A263-K267 VanDerWaalsContact O-N 3.14Å
264	E	81.5	Confident	75.6	Confident	23 Å²	23	34.4 Å²	34.4	11%	0.107	19%	0.19	C	C	.	.	H	α-helix	trans	-74.4	-41.5	178.7	-164.5	59.9	-148.7	0	0	111.5	Y191 I260 C261 Y262 R266 K267 K268 I301 P304	Y191-E264 WeakPolarHBondContact OH-CA 3.4Å; Y191-E264 PolarHBondContact OH-N 3.5Å; Y191-E264 VanDerWaalsContact OH-N 3.07Å; Y191-E264 PolarHBondContact OH-OE2 2.92Å; I260-E264 PolarHBondContact O-N 2.91Å; I260-E264 VanDerWaalsContact O-N 3.1Å; C261-E264 PolarHBondContact O-N 2.91Å; Y262-E264 PolarHBondContact O-N 3.2Å; E264-R266 VanDerWaalsContact C-N 3.31Å; E264-R266 PolarHBondContact O-N 3.1Å; E264-K267 WeakPolarHBondContact O-CB 3.37Å; E264-K267 PolarHBondContact O-N 3.38Å; E264-K267 WeakPolarHBondContact OE2-CD 3.32Å; E264-K267 WeakPolarHBondContact OE2-CE 3.38Å; E264-K267 IonicContact OE2-NZ 2.97Å; E264-K267 PolarHBondContact OE2-NZ 2.57Å; E264-K268 WeakPolarHBondContact O-CG 3.35Å; E264-K268 PolarHBondContact O-N 3.04Å; E264-K268 WeakPolarHBondContact OE1-CE 3.27Å; E264-K268 IonicContact OE1-NZ 3.7Å; E264-K268 PolarHBondContact OE1-NZ 3.04Å; E264-I301 HydrophobicContact CG-CG2 3.99Å; E264-P304 HydrophobicContact CB-CG 3.92Å; E264-P304 HydrophobicContact CG-CG 4.12Å
265	L	76.9	Confident	75.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-56.5	-46.6	171.1	-174.4	68.6	0	0	0	110.9	C261 Y262 K267 K268 V269 M273 N277 K280 L281 L284 V292 I301	C261-L265 WeakPolarHBondContact O-CB 3.34Å; C261-L265 PolarHBondContact O-N 3.42Å; Y262-L265 PolarHBondContact O-N 2.79Å; L265-K267 VanDerWaalsContact C-N 3.3Å; L265-K267 PolarHBondContact O-N 2.91Å; L265-K268 PolarHBondContact O-N 3.04Å; L265-K268 VanDerWaalsContact O-N 3.12Å; L265-V269 HydrophobicContact CD1-CG2 3.62Å; L265-V269 HydrophobicContact CG-CG2 4.12Å; L265-V269 WeakPolarHBondContact O-CB 3.43Å; L265-V269 WeakPolarHBondContact O-CG2 3.14Å; L265-V269 PolarHBondContact O-N 3.38Å; L265-M273 HydrophobicContact CD2-CE 4.16Å; L265-N277 WeakPolarHBondContact CD2-O 3.43Å; L265-K280 HydrophobicContact CD1-CB 4.48Å; L265-L281 HydrophobicContact CD2-CB 3.82Å; L265-L281 HydrophobicContact CD2-CD1 4.23Å; L265-L284 HydrophobicContact CB-CD2 4.32Å; L265-V292 HydrophobicContact CD1-CG2 4.09Å; L265-I301 HydrophobicContact CD1-CD1 3.86Å
266	R	77.8	Confident	74.9	Confident	31 Å²	31	47.5 Å²	47.5	12%	0.117	25%	0.249	C	C	.	.	H	α-helix	trans	-56.3	-40.6	176.7	179.4	-179.9	166	-84	-12.1	112.4	N184 Y262 E264 G270 G271	N184-R266 PolarHBondContact OD1-NH1 3.24Å; N184-R266 PolarHBondContact OD1-NH2 2.68Å; Y262-R266 WeakPolarHBondContact O-CB 3.33Å; Y262-R266 PolarHBondContact O-N 3.32Å; E264-R266 VanDerWaalsContact C-N 3.31Å; E264-R266 PolarHBondContact O-N 3.1Å; R266-G270 PolarHBondContact O-N 3.17Å; R266-G270 VanDerWaalsContact O-N 3.13Å; R266-G271 PolarHBondContact O-N 3.28Å
267	K	75.5	Confident	74.4	Confident	101 Å²	101	48 Å²	48	44%	0.439	25%	0.252	S	S	.	.	H	α-helix	trans	-65.4	-36.6	177.2	-71.5	175.9	-159.1	163.1	0	113.2	Y191 A263 E264 L265	Y191-K267 VanDerWaalsContact CE2-CE 3.5Å; Y191-K267 VanDerWaalsContact OH-CE 3.31Å; Y191-K267 WeakPolarHBondContact OH-CE 3.45Å; Y191-K267 PolarHBondContact OH-NZ 3.04Å; A263-K267 WeakPolarHBondContact O-CG 3.4Å; A263-K267 PolarHBondContact O-N 3.12Å; A263-K267 VanDerWaalsContact O-N 3.14Å; E264-K267 WeakPolarHBondContact O-CB 3.37Å; E264-K267 PolarHBondContact O-N 3.38Å; E264-K267 WeakPolarHBondContact OE2-CD 3.32Å; E264-K267 WeakPolarHBondContact OE2-CE 3.38Å; E264-K267 IonicContact OE2-NZ 2.97Å; E264-K267 PolarHBondContact OE2-NZ 2.57Å; L265-K267 VanDerWaalsContact C-N 3.3Å; L265-K267 PolarHBondContact O-N 2.91Å
268	K	68.9	Low	74.2	Confident	79 Å²	79	47.6 Å²	47.6	34%	0.343	25%	0.253	S	S	.	.	H	α-helix	trans	-88.2	-34.8	-175.4	-53.4	-54.7	-172.2	-153.7	0	113.5	E264 L265 S294 L299 I301	E264-K268 WeakPolarHBondContact O-CG 3.35Å; E264-K268 PolarHBondContact O-N 3.04Å; E264-K268 WeakPolarHBondContact OE1-CE 3.27Å; E264-K268 IonicContact OE1-NZ 3.7Å; E264-K268 PolarHBondContact OE1-NZ 3.04Å; L265-K268 PolarHBondContact O-N 3.04Å; L265-K268 VanDerWaalsContact O-N 3.12Å; K268-S294 WeakPolarHBondContact O-CB 3.42Å; K268-S294 PolarHBondContact O-OG 2.87Å; K268-L299 HydrophobicContact CD-CD2 4.41Å; K268-I301 HydrophobicContact CB-CD1 3.68Å; K268-I301 HydrophobicContact CB-CG1 4.35Å; K268-I301 HydrophobicContact CG-CD1 3.66Å; K268-I301 HydrophobicContact CG-CG1 3.96Å
269	V	69.3	Low	73.9	Confident	43 Å²	43	50.6 Å²	50.6	26%	0.261	28%	0.278	S	S	.	.	H	α-helix	trans	-94.6	-27.8	-173.1	-172.5	0	0	0	0	112.4	L265 V292	L265-V269 HydrophobicContact CD1-CG2 3.62Å; L265-V269 HydrophobicContact CG-CG2 4.12Å; L265-V269 WeakPolarHBondContact O-CB 3.43Å; L265-V269 WeakPolarHBondContact O-CG2 3.14Å; L265-V269 PolarHBondContact O-N 3.38Å; V269-V292 HydrophobicContact CG2-CB 4.25Å; V269-V292 HydrophobicContact CG2-CG1 3.7Å; V269-V292 HydrophobicContact CG2-CG2 4.38Å
270	G	62.5	Low	73.4	Confident	59 Å²	59	53.4 Å²	53.4	61%	0.608	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.4	58	171.8	0	0	0	0	0	114.9	R266 L272	R266-G270 PolarHBondContact O-N 3.17Å; R266-G270 VanDerWaalsContact O-N 3.13Å; G270-L272 VanDerWaalsContact C-N 3.27Å; G270-L272 PolarHBondContact O-N 3.13Å
271	G	58.2	Low	73.1	Confident	41 Å²	41	53.4 Å²	53.4	42%	0.423	29%	0.29	S	S	.	.	S	Bend	trans	80.5	-32.9	158.1	0	0	0	0	0	118.2	R266	R266-G271 PolarHBondContact O-N 3.28Å
272	L	56.5	Low	73	Confident	116 Å²	116	54 Å²	54	61%	0.607	29%	0.293	S	S	*	.			trans	-81.8	144.8	-178.1	-163	61.1	0	0	0	111.9	G270 D274 N277	G270-L272 VanDerWaalsContact C-N 3.27Å; G270-L272 PolarHBondContact O-N 3.13Å; L272-D274 WeakPolarHBondContact CD2-OD1 3.47Å; L272-D274 WeakPolarHBondContact CG-OD1 3.38Å; L272-N277 PolarHBondContact O-ND2 3.49Å
273	M	62.6	Low	72.9	Confident	35 Å²	35	55.5 Å²	55.5	17%	0.172	30%	0.301	C	S	.	.			trans	-115.6	92.1	177.8	-85.3	-71.9	106.6	0	0	109.1	Y262 L265 N277	Y262-M273 HydrophobicContact CD2-CE 4.13Å; Y262-M273 HydrophobicContact CD2-SD 3.98Å; Y262-M273 HydrophobicContact CE2-CE 3.8Å; Y262-M273 HydrophobicContact CE2-CG 3.72Å; Y262-M273 HydrophobicContact CE2-SD 3.6Å; L265-M273 HydrophobicContact CD2-CE 4.16Å; M273-N277 HydrophobicContact CE-CB 3.72Å
274	D	69.5	Low	72.7	Confident	70 Å²	70	55.4 Å²	55.4	37%	0.374	30%	0.3	S	S	.	.			trans	-99.5	160.3	173.3	-41.8	-66.7	0	0	0	109.2	L272 K276 N277 V278	L272-D274 WeakPolarHBondContact CD2-OD1 3.47Å; L272-D274 WeakPolarHBondContact CG-OD1 3.38Å; D274-K276 PolarHBondContact O-N 3.46Å; D274-N277 CarbonylContact O-C 3.54Å; D274-N277 WeakPolarHBondContact O-CA 3.31Å; D274-N277 WeakPolarHBondContact O-CB 3.5Å; D274-N277 PolarHBondContact O-N 3.35Å; D274-N277 PolarHBondContact OD2-ND2 3.35Å; D274-V278 PolarHBondContact O-N 3.37Å
275	E	73.9	Confident	72.4	Confident	174 Å²	174	54.5 Å²	54.5	81%	0.813	30%	0.296	S	S	*	.	H	α-helix	trans	-56.3	-35.8	177.1	-65.4	156.6	175.2	0	0	112.2	N277 V278 A279	E275-N277 PolarHBondContact O-N 3.38Å; E275-V278 WeakPolarHBondContact O-CB 3.25Å; E275-V278 PolarHBondContact O-N 3.34Å; E275-V278 VanDerWaalsContact O-N 3.12Å; E275-A279 PolarHBondContact O-N 3.25Å
276	K	70.7	Confident	72.3	Confident	162 Å²	162	58.6 Å²	58.6	70%	0.704	32%	0.315	S	S	*	.	H	α-helix	trans	-65.6	-18.3	174.5	-65.4	175.7	-177.5	173.2	0	113.6	D274 K280	D274-K276 PolarHBondContact O-N 3.46Å; K276-K280 WeakPolarHBondContact O-CD 3.37Å; K276-K280 WeakPolarHBondContact O-CG 3.48Å; K276-K280 PolarHBondContact O-NZ 3.14Å
277	N	74.4	Confident	71.6	Confident	12 Å²	12	63.8 Å²	63.8	6%	0.064	34%	0.341	C	S	.	.	H	α-helix	trans	-96.9	-26.6	174.2	-54.9	-20.4	0	0	0	111	L265 L272 M273 D274 E275 L281	L265-N277 WeakPolarHBondContact CD2-O 3.43Å; L272-N277 PolarHBondContact O-ND2 3.49Å; M273-N277 HydrophobicContact CE-CB 3.72Å; D274-N277 CarbonylContact O-C 3.54Å; D274-N277 WeakPolarHBondContact O-CA 3.31Å; D274-N277 WeakPolarHBondContact O-CB 3.5Å; D274-N277 PolarHBondContact O-N 3.35Å; D274-N277 PolarHBondContact OD2-ND2 3.35Å; E275-N277 PolarHBondContact O-N 3.38Å; N277-L281 WeakPolarHBondContact O-CB 3.39Å; N277-L281 PolarHBondContact O-N 3.43Å
278	V	77.3	Confident	71.1	Confident	28 Å²	28	60 Å²	60	17%	0.17	33%	0.33	C	S	.	.	H	α-helix	trans	-62.6	-52.5	167.8	159.8	0	0	0	0	111	H238 D274 E275 K280 L281 N282	H238-V278 HydrophobicContact CB-CB 4.39Å; H238-V278 HydrophobicContact CB-CG1 3.7Å; H238-V278 HydrophobicContact CB-CG2 3.81Å; D274-V278 PolarHBondContact O-N 3.37Å; E275-V278 WeakPolarHBondContact O-CB 3.25Å; E275-V278 PolarHBondContact O-N 3.34Å; E275-V278 VanDerWaalsContact O-N 3.12Å; V278-K280 PolarHBondContact O-N 3.14Å; V278-L281 WeakPolarHBondContact O-CA 3.49Å; V278-L281 WeakPolarHBondContact O-CB 3.32Å; V278-L281 PolarHBondContact O-N 3.1Å; V278-N282 PolarHBondContact O-N 2.84Å
279	A	78.4	Confident	71.2	Confident	63 Å²	63	57 Å²	57	52%	0.521	32%	0.32	S	S	.	.	H	α-helix	trans	-56.3	-41.9	177.9	0	0	0	0	0	111.9	E275 L281 N282 E283	E275-A279 PolarHBondContact O-N 3.25Å; A279-L281 VanDerWaalsContact C-N 3.32Å; A279-L281 PolarHBondContact O-N 3.49Å; A279-N282 PolarHBondContact O-N 2.67Å; A279-E283 WeakPolarHBondContact O-CB 3.15Å; A279-E283 PolarHBondContact O-N 2.83Å
280	K	75.5	Confident	71.4	Confident	59 Å²	59	55 Å²	55	26%	0.257	31%	0.308	S	S	.	.	H	α-helix	trans	-70.9	-20.9	175.3	-74.2	178.8	174.9	102.7	0	114.5	L265 K276 V278 L284 T290 V292	L265-K280 HydrophobicContact CD1-CB 4.48Å; K276-K280 WeakPolarHBondContact O-CD 3.37Å; K276-K280 WeakPolarHBondContact O-CG 3.48Å; K276-K280 PolarHBondContact O-NZ 3.14Å; V278-K280 PolarHBondContact O-N 3.14Å; K280-L284 WeakPolarHBondContact O-CB 3.25Å; K280-L284 PolarHBondContact O-N 2.88Å; K280-L284 VanDerWaalsContact O-N 3.14Å; K280-T290 HydrophobicContact CB-CG2 3.93Å; K280-T290 HydrophobicContact CD-CG2 4.47Å; K280-T290 HydrophobicContact CG-CG2 4Å; K280-V292 HydrophobicContact CD-CB 4.38Å; K280-V292 HydrophobicContact CD-CG1 3.83Å; K280-V292 HydrophobicContact CD-CG2 3.87Å
281	L	78.8	Confident	71.9	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-74.9	-42.8	171.3	-177.7	56.3	0	0	0	109.8	I235 C261 Y262 L265 N277 V278 A279 L284 I285	I235-L281 HydrophobicContact CB-CD2 4.2Å; I235-L281 HydrophobicContact CG2-CD2 4.01Å; C261-L281 HydrophobicContact CB-CD1 3.92Å; Y262-L281 HydrophobicContact CD2-CD2 4.4Å; L265-L281 HydrophobicContact CD2-CB 3.82Å; L265-L281 HydrophobicContact CD2-CD1 4.23Å; N277-L281 WeakPolarHBondContact O-CB 3.39Å; N277-L281 PolarHBondContact O-N 3.43Å; V278-L281 WeakPolarHBondContact O-CA 3.49Å; V278-L281 WeakPolarHBondContact O-CB 3.32Å; V278-L281 PolarHBondContact O-N 3.1Å; A279-L281 VanDerWaalsContact C-N 3.32Å; A279-L281 PolarHBondContact O-N 3.49Å; L281-L284 PolarHBondContact O-N 2.96Å; L281-I285 HydrophobicContact CD1-CD1 3.79Å; L281-I285 HydrophobicContact CD1-CG1 4.19Å; L281-I285 HydrophobicContact CG-CD1 3.79Å; L281-I285 VanDerWaalsContact O-CB 3.22Å; L281-I285 WeakPolarHBondContact O-CB 3.47Å; L281-I285 WeakPolarHBondContact O-CG1 3.32Å; L281-I285 PolarHBondContact O-N 2.88Å
282	N	78.4	Confident	72.4	Confident	11 Å²	11	54.7 Å²	54.7	6%	0.059	29%	0.287	C	S	.	.	H	α-helix	trans	-69.3	-40.7	177.5	-66.6	0.1	0	0	0	111.3	H238 D240 V278 A279 L284 I285 Q286	H238-N282 VanDerWaalsContact O-CG 3.3Å; H238-N282 PolarHBondContact O-ND2 3.33Å; H238-N282 PolarHBondContact O-OD1 3.17Å; D240-N282 PolarHBondContact OD2-ND2 2.97Å; V278-N282 PolarHBondContact O-N 2.84Å; A279-N282 PolarHBondContact O-N 2.67Å; N282-L284 PolarHBondContact O-N 3.34Å; N282-I285 PolarHBondContact O-N 2.9Å; N282-Q286 VanDerWaalsContact O-CB 3.28Å; N282-Q286 WeakPolarHBondContact O-CB 3.37Å; N282-Q286 WeakPolarHBondContact O-CG 3.5Å; N282-Q286 PolarHBondContact O-N 2.78Å
283	E	81.4	Confident	72.8	Confident	56 Å²	56	57.6 Å²	57.6	26%	0.262	29%	0.289	S	S	.	.	H	α-helix	trans	-54.5	-48.6	169.2	-167.9	-159	129	0	0	111.3	A279 I285 Q286 Q287 T290	A279-E283 WeakPolarHBondContact O-CB 3.15Å; A279-E283 PolarHBondContact O-N 2.83Å; E283-I285 VanDerWaalsContact C-N 3.33Å; E283-I285 PolarHBondContact O-N 3.33Å; E283-Q286 PolarHBondContact O-N 2.83Å; E283-Q287 VanDerWaalsContact O-CB 3.31Å; E283-Q287 WeakPolarHBondContact O-CB 3.4Å; E283-Q287 PolarHBondContact O-N 2.81Å; E283-T290 VanDerWaalsContact C-OG1 3.25Å; E283-T290 WeakPolarHBondContact CB-OG1 3.49Å; E283-T290 HydrophobicContact CG-CG2 4.46Å; E283-T290 WeakPolarHBondContact CG-OG1 3.45Å; E283-T290 WeakPolarHBondContact OE1-CA 3.36Å; E283-T290 WeakPolarHBondContact OE1-CB 3.11Å; E283-T290 WeakPolarHBondContact OE1-CG2 3.26Å; E283-T290 PolarHBondContact OE1-OG1 2.91Å
284	L	78.3	Confident	72.7	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-66.7	-34.8	-178.5	178.8	61.7	0	0	0	112.5	C261 L265 K280 L281 N282 G288 T290 I301 A303	C261-L284 HydrophobicContact CB-CD2 4.16Å; C261-L284 HydrophobicContact CB-CG 4.36Å; L265-L284 HydrophobicContact CB-CD2 4.32Å; K280-L284 WeakPolarHBondContact O-CB 3.25Å; K280-L284 PolarHBondContact O-N 2.88Å; K280-L284 VanDerWaalsContact O-N 3.14Å; L281-L284 PolarHBondContact O-N 2.96Å; N282-L284 PolarHBondContact O-N 3.34Å; L284-G288 CarbonylContact O-C 3.57Å; L284-G288 VanDerWaalsContact O-CA 3.23Å; L284-G288 WeakPolarHBondContact O-CA 3.31Å; L284-G288 PolarHBondContact O-N 3.23Å; L284-T290 WeakPolarHBondContact CA-OG1 3.5Å; L284-T290 PolarHBondContact N-OG1 3.19Å; L284-I301 HydrophobicContact CD1-CB 4.32Å; L284-I301 HydrophobicContact CD1-CG2 4.08Å; L284-I301 HydrophobicContact CD2-CG2 4.05Å; L284-A303 HydrophobicContact CD1-CB 4.36Å
285	I	76.4	Confident	72.1	Confident	4 Å²	4	63.9 Å²	63.9	2%	0.021	32%	0.316	C	S	.	.	H	α-helix	trans	-74.1	-45	179.3	-80.3	173.9	0	0	0	111	I239 V244 Y257 C261 L281 N282 E283	I239-I285 HydrophobicContact CD1-CD1 3.93Å; I239-I285 HydrophobicContact CG1-CD1 4.04Å; V244-I285 HydrophobicContact CB-CG2 4.16Å; V244-I285 HydrophobicContact CG1-CG2 3.21Å; V244-I285 HydrophobicContact CG2-CG2 3.81Å; Y257-I285 HydrophobicContact CD1-CG2 4.42Å; Y257-I285 HydrophobicContact CE1-CB 4.31Å; Y257-I285 HydrophobicContact CE1-CG1 4.38Å; Y257-I285 HydrophobicContact CE1-CG2 3.93Å; Y257-I285 WeakPolarHBondContact CE1-O 3.41Å; Y257-I285 PolarHBondContact OH-O 2.56Å; C261-I285 HydrophobicContact CB-CD1 4.27Å; C261-I285 HydrophobicContact CB-CG1 3.66Å; L281-I285 HydrophobicContact CD1-CD1 3.79Å; L281-I285 HydrophobicContact CD1-CG1 4.19Å; L281-I285 HydrophobicContact CG-CD1 3.79Å; L281-I285 VanDerWaalsContact O-CB 3.22Å; L281-I285 WeakPolarHBondContact O-CB 3.47Å; L281-I285 WeakPolarHBondContact O-CG1 3.32Å; L281-I285 PolarHBondContact O-N 2.88Å; N282-I285 PolarHBondContact O-N 2.9Å; E283-I285 VanDerWaalsContact C-N 3.33Å; E283-I285 PolarHBondContact O-N 3.33Å
286	Q	73.1	Confident	71.3	Confident	85 Å²	85	58.1 Å²	58.1	40%	0.397	30%	0.303	S	S	.	.	H	α-helix	trans	-76	-50.1	-178.3	-69	167.3	7.5	0	0	112.5	V244 N282 E283	V244-Q286 HydrophobicContact CG2-CG 3.87Å; N282-Q286 VanDerWaalsContact O-CB 3.28Å; N282-Q286 WeakPolarHBondContact O-CB 3.37Å; N282-Q286 WeakPolarHBondContact O-CG 3.5Å; N282-Q286 PolarHBondContact O-N 2.78Å; E283-Q286 PolarHBondContact O-N 2.83Å
287	Q	63.8	Low	70.9	Confident	140 Å²	140	59.9 Å²	59.9	65%	0.654	31%	0.305	S	S	*	.	S	Bend	trans	-90	-7.8	-173.9	-53.9	-174.7	13	0	0	112.9	E283 A289	E283-Q287 VanDerWaalsContact O-CB 3.31Å; E283-Q287 WeakPolarHBondContact O-CB 3.4Å; E283-Q287 PolarHBondContact O-N 2.81Å; Q287-A289 PolarHBondContact O-N 3.12Å; Q287-A289 VanDerWaalsContact O-N 3.08Å
288	G	65.5	Low	70.6	Confident	21 Å²	21	64.7 Å²	64.7	22%	0.216	33%	0.331	C	S	.	.	S	Bend	trans	67.3	1.6	-175.1	0	0	0	0	0	114.5	L284 K302 A303	L284-G288 CarbonylContact O-C 3.57Å; L284-G288 VanDerWaalsContact O-CA 3.23Å; L284-G288 WeakPolarHBondContact O-CA 3.31Å; L284-G288 PolarHBondContact O-N 3.23Å; G288-K302 VanDerWaalsContact O-CG 3.25Å; G288-K302 WeakPolarHBondContact O-CG 3.42Å; G288-A303 WeakPolarHBondContact O-CB 3.31Å; G288-A303 PolarHBondContact O-N 2.91Å
289	A	70.7	Confident	70.1	Confident	16 Å²	16	66.3 Å²	66.3	13%	0.132	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	146.8	173.9	0	0	0	0	0	111.6	Q287 I301 K302	Q287-A289 PolarHBondContact O-N 3.12Å; Q287-A289 VanDerWaalsContact O-N 3.08Å; A289-I301 CarbonylContact C-O 3.53Å; A289-I301 WeakPolarHBondContact CA-O 3.42Å; A289-I301 WeakPolarHBondContact CB-O 3.25Å; A289-K302 HydrophobicContact CB-CG 4.41Å
290	T	73.4	Confident	69.6	Low	1 Å²	1	73 Å²	73	1%	0.006	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	147.5	-179	-76.4	0	0	0	0	111.5	K280 E283 L284 V292 I301	K280-T290 HydrophobicContact CB-CG2 3.93Å; K280-T290 HydrophobicContact CD-CG2 4.47Å; K280-T290 HydrophobicContact CG-CG2 4Å; E283-T290 VanDerWaalsContact C-OG1 3.25Å; E283-T290 WeakPolarHBondContact CB-OG1 3.49Å; E283-T290 HydrophobicContact CG-CG2 4.46Å; E283-T290 WeakPolarHBondContact CG-OG1 3.45Å; E283-T290 WeakPolarHBondContact OE1-CA 3.36Å; E283-T290 WeakPolarHBondContact OE1-CB 3.11Å; E283-T290 WeakPolarHBondContact OE1-CG2 3.26Å; E283-T290 PolarHBondContact OE1-OG1 2.91Å; L284-T290 WeakPolarHBondContact CA-OG1 3.5Å; L284-T290 PolarHBondContact N-OG1 3.19Å; T290-V292 HydrophobicContact CG2-CG2 3.79Å; T290-I301 PolarHBondContact N-O 2.81Å; T290-I301 PolarHBondContact O-N 2.99Å
291	T	72.1	Confident	69.4	Low	88 Å²	88	70.4 Å²	70.4	54%	0.54	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	125.8	174	68.3	0	0	0	0	111.7	L299 R300	T291-L299 WeakPolarHBondContact CA-O 3.39Å; T291-R300 HydrophobicContact CG2-CB 4.18Å; T291-R300 HydrophobicContact CG2-CG 4.13Å
292	V	70.6	Confident	69.1	Low	7 Å²	7	77.5 Å²	77.5	4%	0.042	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	123.3	178.8	-158.6	0	0	0	0	110.6	L265 V269 K280 T290 S294 L299 I301	L265-V292 HydrophobicContact CD1-CG2 4.09Å; V269-V292 HydrophobicContact CG2-CB 4.25Å; V269-V292 HydrophobicContact CG2-CG1 3.7Å; V269-V292 HydrophobicContact CG2-CG2 4.38Å; K280-V292 HydrophobicContact CD-CB 4.38Å; K280-V292 HydrophobicContact CD-CG1 3.83Å; K280-V292 HydrophobicContact CD-CG2 3.87Å; T290-V292 HydrophobicContact CG2-CG2 3.79Å; V292-S294 PolarHBondContact O-N 2.81Å; V292-L299 PolarHBondContact N-O 2.64Å; V292-L299 PolarHBondContact O-N 2.92Å; V292-I301 HydrophobicContact CB-CD1 4.25Å; V292-I301 HydrophobicContact CG2-CD1 3.55Å; V292-I301 HydrophobicContact CG2-CG1 4.15Å
293	R	63.3	Low	68.7	Low	176 Å²	176	77.7 Å²	77.7	66%	0.664	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.9	112.4	173.8	-167.4	172.4	-176.3	96.2	-10.8	109.2	G296 R297 N298	R293-G296 PolarHBondContact NH2-O 3.27Å; R293-R297 CarbonylContact C-O 3.58Å; R293-R297 VanDerWaalsContact CA-O 3.3Å; R293-R297 WeakPolarHBondContact CA-O 3.49Å; R293-N298 WeakPolarHBondContact CD-OD1 3.25Å; R293-N298 VanDerWaalsContact CG-OD1 3.3Å; R293-N298 WeakPolarHBondContact CG-OD1 3.09Å; R293-N298 PolarHBondContact NH1-OD1 2.78Å
294	S	60.3	Low	67.9	Low	27 Å²	27	76.4 Å²	76.4	19%	0.189	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	134.1	-180	-176.5	0	0	0	0	109.2	K268 V292 G296 R297	K268-S294 WeakPolarHBondContact O-CB 3.42Å; K268-S294 PolarHBondContact O-OG 2.87Å; V292-S294 PolarHBondContact O-N 2.81Å; S294-G296 PolarHBondContact O-N 2.89Å; S294-R297 PolarHBondContact N-O 3.47Å; S294-R297 PolarHBondContact O-N 2.84Å; S294-R297 VanDerWaalsContact O-N 3.12Å; S294-R297 VanDerWaalsContact O-O 3.1Å
295	K	57.3	Low	66.7	Low	210 Å²	210	83.1 Å²	83.1	91%	0.913	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.1	45.6	-174.5	-58.6	-172.1	177.8	-172.6	0	113.4	R297	K295-R297 VanDerWaalsContact C-N 3.28Å; K295-R297 PolarHBondContact O-N 3.05Å
296	G	58.7	Low	66.2	Low	53 Å²	53	83.8 Å²	83.8	55%	0.546	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	-9	176.5	0	0	0	0	0	116.6	R293 S294	R293-G296 PolarHBondContact NH2-O 3.27Å; S294-G296 PolarHBondContact O-N 2.89Å
297	R	61.4	Low	65.9	Low	200 Å²	200	87.7 Å²	87.7	76%	0.755	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.4	145.7	178.9	-64.8	-176.9	178.7	179.9	-0.7	111.2	R293 S294 K295 L299	R293-R297 CarbonylContact C-O 3.58Å; R293-R297 VanDerWaalsContact CA-O 3.3Å; R293-R297 WeakPolarHBondContact CA-O 3.49Å; S294-R297 PolarHBondContact N-O 3.47Å; S294-R297 PolarHBondContact O-N 2.84Å; S294-R297 VanDerWaalsContact O-N 3.12Å; S294-R297 VanDerWaalsContact O-O 3.1Å; K295-R297 VanDerWaalsContact C-N 3.28Å; K295-R297 PolarHBondContact O-N 3.05Å; R297-L299 HydrophobicContact CB-CD1 4.04Å; R297-L299 WeakPolarHBondContact O-CD1 3.42Å; R297-L299 PolarHBondContact O-N 2.81Å
298	N	68.8	Low	66	Low	112 Å²	112	81.2 Å²	81.2	60%	0.599	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.8	112.8	174.1	-65.1	-5.9	0	0	0	108.9	R293	R293-N298 WeakPolarHBondContact CD-OD1 3.25Å; R293-N298 VanDerWaalsContact CG-OD1 3.3Å; R293-N298 WeakPolarHBondContact CG-OD1 3.09Å; R293-N298 PolarHBondContact NH1-OD1 2.78Å
299	L	66.5	Low	65.9	Low	62 Å²	62	81 Å²	81	33%	0.325	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	123.3	175.9	-80	70.8	0	0	0	109.5	K268 T291 V292 R297 I301	K268-L299 HydrophobicContact CD-CD2 4.41Å; T291-L299 WeakPolarHBondContact CA-O 3.39Å; V292-L299 PolarHBondContact N-O 2.64Å; V292-L299 PolarHBondContact O-N 2.92Å; R297-L299 HydrophobicContact CB-CD1 4.04Å; R297-L299 WeakPolarHBondContact O-CD1 3.42Å; R297-L299 PolarHBondContact O-N 2.81Å; L299-I301 PolarHBondContact O-N 3.09Å
300	R	67.7	Low	65.6	Low	205 Å²	205	82.2 Å²	82.2	77%	0.774	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	112.2	167.4	-170.8	175.2	-179.1	-168.2	0.6	109.1	T291	T291-R300 HydrophobicContact CG2-CB 4.18Å; T291-R300 HydrophobicContact CG2-CG 4.13Å
301	I	71.6	Confident	65.1	Low	4 Å²	4	90 Å²	90	2%	0.021	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	129.9	172.1	-45.8	-174.8	0	0	0	106.8	E264 L265 K268 L284 A289 T290 V292 L299	E264-I301 HydrophobicContact CG-CG2 3.99Å; L265-I301 HydrophobicContact CD1-CD1 3.86Å; K268-I301 HydrophobicContact CB-CD1 3.68Å; K268-I301 HydrophobicContact CB-CG1 4.35Å; K268-I301 HydrophobicContact CG-CD1 3.66Å; K268-I301 HydrophobicContact CG-CG1 3.96Å; L284-I301 HydrophobicContact CD1-CB 4.32Å; L284-I301 HydrophobicContact CD1-CG2 4.08Å; L284-I301 HydrophobicContact CD2-CG2 4.05Å; A289-I301 CarbonylContact C-O 3.53Å; A289-I301 WeakPolarHBondContact CA-O 3.42Å; A289-I301 WeakPolarHBondContact CB-O 3.25Å; T290-I301 PolarHBondContact N-O 2.81Å; T290-I301 PolarHBondContact O-N 2.99Å; V292-I301 HydrophobicContact CB-CD1 4.25Å; V292-I301 HydrophobicContact CG2-CD1 3.55Å; V292-I301 HydrophobicContact CG2-CG1 4.15Å; L299-I301 PolarHBondContact O-N 3.09Å
302	K	72.4	Confident	64.3	Low	149 Å²	149	88.4 Å²	88.4	65%	0.648	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	144.9	165.6	-166.7	-173.8	177.7	-171.4	0	107.9	G288 A289 P304	G288-K302 VanDerWaalsContact O-CG 3.25Å; G288-K302 WeakPolarHBondContact O-CG 3.42Å; A289-K302 HydrophobicContact CB-CG 4.41Å; K302-P304 WeakPolarHBondContact O-CD 3.2Å
303	A	70.2	Confident	63.6	Low	15 Å²	15	90.4 Å²	90.4	12%	0.124	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-56	119.7	169.1	0	0	0	0	0	108.6	Y257 L284 G288 M305	Y257-A303 HydrophobicContact CE2-CB 4.29Å; L284-A303 HydrophobicContact CD1-CB 4.36Å; G288-A303 WeakPolarHBondContact O-CB 3.31Å; G288-A303 PolarHBondContact O-N 2.91Å; A303-M305 PolarHBondContact O-N 3.25Å
304	P	62.9	Low	63.1	Low	30 Å²	30	85.6 Å²	85.6	20%	0.195	41%	0.408	C	S	.	.			trans	-82.7	113.8	-170.2	31.1	-33.9	0	0	0	111	Y191 I260 E264 K302 C306	Y191-P304 HydrophobicContact CE1-CG 4Å; I260-P304 HydrophobicContact CG2-CG 3.81Å; E264-P304 HydrophobicContact CB-CG 3.92Å; E264-P304 HydrophobicContact CG-CG 4.12Å; K302-P304 WeakPolarHBondContact O-CD 3.2Å; P304-C306 VanDerWaalsContact C-N 3.34Å; P304-C306 PolarHBondContact O-N 2.71Å
305	M	54.4	Low	62.6	Low	141 Å²	141	87.3 Å²	87.3	70%	0.695	42%	0.418	S	S	*	.			trans	-65.7	92.1	165.4	59.4	-158	-66.1	0	0	109.9	A303	A303-M305 PolarHBondContact O-N 3.25Å
306	C	66.1	Low	61.8	Low	18 Å²	18	83.8 Å²	83.8	12%	0.122	41%	0.41	C	S	.	.			trans	-98.6	166.1	176.7	74.2	0	0	0	0	111.4	Y191 I260 P304 A308 L309 K310	Y191-C306 HydrophobicContact CD1-CB 3.76Å; Y191-C306 HydrophobicContact CG-CB 4.32Å; I260-C306 VanDerWaalsContact CD1-SG 3.51Å; P304-C306 VanDerWaalsContact C-N 3.34Å; P304-C306 PolarHBondContact O-N 2.71Å; C306-A308 PolarHBondContact O-N 3.42Å; C306-L309 PolarHBondContact O-N 3.36Å; C306-L309 PolarHBondContact SG-N 2.89Å; C306-L309 VanDerWaalsContact SG-N 3.36Å; C306-K310 PolarHBondContact O-N 2.92Å
307	R	65.9	Low	61.1	Low	166 Å²	166	85 Å²	85	63%	0.626	42%	0.422	S	S	*	.	H	α-helix	trans	-53.3	-41.5	179.8	-72.8	176.9	166.1	169.9	-6.2	112.7	Y191 E192 K311	Y191-R307 PolarHBondContact O-N 3.49Å; E192-R307 IonicContact OE1-NH1 3.71Å; E192-R307 PolarHBondContact OE1-NH1 3.18Å; R307-K311 WeakPolarHBondContact O-CG 3.26Å; R307-K311 PolarHBondContact O-N 2.61Å
308	A	65.4	Low	60	Low	4 Å²	4	80.8 Å²	80.8	3%	0.033	42%	0.418	C	S	.	.	H	α-helix	trans	-71.7	-31.5	-180	0	0	0	0	0	113.8	L190 Y191 G194 L256 C306	L190-A308 WeakPolarHBondContact O-CB 3.49Å; Y191-A308 PolarHBondContact O-N 2.83Å; Y191-A308 VanDerWaalsContact O-N 3.15Å; G194-A308 VanDerWaalsContact CA-CB 3.45Å; L256-A308 HydrophobicContact CD2-CB 3.92Å; L256-A308 WeakPolarHBondContact CD2-O 3.47Å; C306-A308 PolarHBondContact O-N 3.42Å
309	L	64.7	Low	58.5	Low	16 Å²	16	78.7 Å²	78.7	8%	0.084	41%	0.412	C	S	.	.	H	α-helix	trans	-74.4	-44	175.3	-172.3	61.6	0	0	0	111.2	Y257 I260 C306 K311 L312 C313	Y257-L309 HydrophobicContact CD2-CD1 3.76Å; Y257-L309 HydrophobicContact CD2-CD2 3.71Å; Y257-L309 HydrophobicContact CD2-CG 4.41Å; Y257-L309 HydrophobicContact CE2-CD2 4.06Å; Y257-L309 HydrophobicContact CG-CD1 4.27Å; I260-L309 HydrophobicContact CD1-CB 3.94Å; I260-L309 HydrophobicContact CD1-CD1 4.4Å; C306-L309 PolarHBondContact O-N 3.36Å; C306-L309 PolarHBondContact SG-N 2.89Å; C306-L309 VanDerWaalsContact SG-N 3.36Å; L309-K311 VanDerWaalsContact C-N 3.34Å; L309-K311 PolarHBondContact O-N 3.31Å; L309-L312 CarbonylContact O-C 3.5Å; L309-L312 PolarHBondContact O-N 3.16Å; L309-C313 PolarHBondContact O-N 3.19Å
310	K	64.6	Low	57.6	Low	42 Å²	42	78.1 Å²	78.1	18%	0.183	41%	0.41	C	S	.	.	H	α-helix	trans	-51.6	-54.1	175.6	-168.8	169.1	-178.5	168.8	0	110.2	C306 L312 C313 D314 D320 E321	C306-K310 PolarHBondContact O-N 2.92Å; K310-L312 PolarHBondContact O-N 3.1Å; K310-C313 PolarHBondContact O-N 3.35Å; K310-D314 VanDerWaalsContact O-CG 3.31Å; K310-D314 PolarHBondContact O-N 3.43Å; K310-D314 VanDerWaalsContact O-OD2 3.11Å; K310-D320 WeakPolarHBondContact CE-OD2 3.42Å; K310-D320 PolarHBondContact NZ-O 2.87Å; K310-D320 IonicContact NZ-OD2 2.75Å; K310-D320 PolarHBondContact NZ-OD2 2.96Å; K310-E321 WeakPolarHBondContact CE-OE1 3.38Å; K310-E321 IonicContact NZ-OE1 2.64Å; K310-E321 PolarHBondContact NZ-OE1 3.25Å
311	K	61.8	Low	56.4	Low	164 Å²	164	75.4 Å²	75.4	71%	0.713	41%	0.406	S	S	*	.	H	α-helix	trans	-57.2	-12.1	174	-73.3	-177.2	174	-169.4	0	117	R307 L309	R307-K311 WeakPolarHBondContact O-CG 3.26Å; R307-K311 PolarHBondContact O-N 2.61Å; L309-K311 VanDerWaalsContact C-N 3.34Å; L309-K311 PolarHBondContact O-N 3.31Å
312	L	55.7	Low	55	Low	56 Å²	56	79.8 Å²	79.8	29%	0.293	43%	0.426	S	S	.	.	H	α-helix	trans	-120	-9.1	179.8	-73.4	-162.5	0	0	0	114.4	S253 L256 L309 K310	S253-L312 WeakPolarHBondContact CB-O 3.47Å; S253-L312 PolarHBondContact OG-O 3.17Å; L256-L312 HydrophobicContact CB-CD1 3.91Å; L256-L312 HydrophobicContact CD2-CD1 3.52Å; L256-L312 HydrophobicContact CD2-CG 4.22Å; L256-L312 HydrophobicContact CG-CD1 4.29Å; L309-L312 CarbonylContact O-C 3.5Å; L309-L312 PolarHBondContact O-N 3.16Å; K310-L312 PolarHBondContact O-N 3.1Å
313	C	55.2	Low	53.8	Low	48 Å²	48	76.8 Å²	76.8	32%	0.324	42%	0.417	S	S	.	.	H	α-helix	trans	-91.9	-8.3	172.1	-76.3	0	0	0	0	113	L309 K310 P315	L309-C313 PolarHBondContact O-N 3.19Å; K310-C313 PolarHBondContact O-N 3.35Å; C313-P315 WeakPolarHBondContact O-CD 3.45Å
314	D	53.7	Low	52.8	Low	75 Å²	75	83.5 Å²	83.5	40%	0.401	45%	0.446	S	S	.	.			trans	-106.4	74.8	179.6	-53.2	-23.7	0	0	0	110.9	K310 D316	K310-D314 VanDerWaalsContact O-CG 3.31Å; K310-D314 PolarHBondContact O-N 3.43Å; K310-D314 VanDerWaalsContact O-OD2 3.11Å; D314-D316 VanDerWaalsContact C-N 3.34Å
315	P	48.7	Very low	52.1	Low	63 Å²	63	89.5 Å²	89.5	41%	0.409	47%	0.469	S	S	.	.	S	Bend	trans	-74.5	-25	171.3	30.6	-33.2	0	0	0	112.7	C313	C313-P315 WeakPolarHBondContact O-CD 3.45Å
316	D	41.6	Very low	52.4	Low	137 Å²	137	85.4 Å²	85.4	73%	0.733	45%	0.453	S	S	*	.	S	Bend	trans	-120.4	53.8	-166.1	-56.8	-48.4	0	0	0	112.7	D314 V318	D314-D316 VanDerWaalsContact C-N 3.34Å; D316-V318 VanDerWaalsContact C-N 3.3Å; D316-V318 PolarHBondContact O-N 3.07Å
317	G	43	Very low	52.8	Low	78 Å²	78	85 Å²	85	80%	0.804	45%	0.45	S	S	*	.			trans	69.9	-10.5	154.8	0	0	0	0	0	120.5	S319	G317-S319 PolarHBondContact O-N 3.34Å
318	V	38.4	Very low	53.4	Low	111 Å²	111	84.9 Å²	84.9	67%	0.673	45%	0.449	S	S	*	.			trans	-80.8	107.4	-178.1	-172.5	0	0	0	0	111.7	D316 D320	D316-V318 VanDerWaalsContact C-N 3.3Å; D316-V318 PolarHBondContact O-N 3.07Å; V318-D320 PolarHBondContact O-N 2.88Å
319	S	37.8	Very low	54.4	Low	69 Å²	69	85 Å²	85	48%	0.483	45%	0.45	S	S	.	.			trans	-84	85.4	-173	173	0	0	0	0	114.4	G317 E321 E322	G317-S319 PolarHBondContact O-N 3.34Å; S319-E321 PolarHBondContact O-N 3.11Å; S319-E322 PolarHBondContact O-N 2.83Å
320	D	47.6	Very low	55.4	Low	50 Å²	50	86.9 Å²	86.9	27%	0.267	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	1.3	170.1	173	58.8	0	0	0	113.6	K310 V318 E322	K310-D320 WeakPolarHBondContact CE-OD2 3.42Å; K310-D320 PolarHBondContact NZ-O 2.87Å; K310-D320 IonicContact NZ-OD2 2.75Å; K310-D320 PolarHBondContact NZ-OD2 2.96Å; V318-D320 PolarHBondContact O-N 2.88Å; D320-E322 VanDerWaalsContact C-N 3.32Å
321	E	43	Very low	56.6	Low	147 Å²	147	87.3 Å²	87.3	69%	0.687	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-13.6	164.2	-72.2	-74.7	93.9	0	0	113.1	K310 S319	K310-E321 WeakPolarHBondContact CE-OE1 3.38Å; K310-E321 IonicContact NZ-OE1 2.64Å; K310-E321 PolarHBondContact NZ-OE1 3.25Å; S319-E321 PolarHBondContact O-N 3.11Å
322	E	42.7	Very low	57.9	Low	96 Å²	96	84.4 Å²	84.4	45%	0.449	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-34.4	177.5	-158.1	165.7	149	0	0	112.4	S319 D320 Q324 K325 K627	S319-E322 PolarHBondContact O-N 2.83Å; D320-E322 VanDerWaalsContact C-N 3.32Å; E322-Q324 PolarHBondContact O-N 3.27Å; E322-K325 PolarHBondContact O-N 2.96Å; E322-K325 VanDerWaalsContact O-O 3.11Å; E322-K627 IonicContact OE1-NZ 3.95Å; E322-K627 PolarHBondContact OE1-NZ 2.92Å
323	D	47	Very low	59.7	Low	87 Å²	87	82.2 Å²	82.2	47%	0.465	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-13.9	-172.3	-79.7	-48.5	0	0	0	116.4
324	Q	48.3	Very low	61.6	Low	155 Å²	155	80.8 Å²	80.8	72%	0.724	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	8.8	174.9	-71.5	168.4	63.2	0	0	113.4	E322	E322-Q324 PolarHBondContact O-N 3.27Å
325	K	47.9	Very low	63.5	Low	157 Å²	157	77.2 Å²	77.2	68%	0.683	42%	0.416	S	S	*	.	S	Bend	trans	-124.8	111.1	177.1	-169.2	178.1	-177.2	-177.4	0	109.2	E322 V327	E322-K325 PolarHBondContact O-N 2.96Å; E322-K325 VanDerWaalsContact O-O 3.11Å; K325-V327 PolarHBondContact O-N 3.16Å
326	P	61.3	Low	65.7	Low	54 Å²	54	75.6 Å²	75.6	35%	0.351	40%	0.403	S	S	.	.			trans	-58.1	123.8	-167.2	23.8	-34.8	0	0	0	111.4	R328 V443	P326-R328 PolarHBondContact O-N 2.77Å; P326-R328 VanDerWaalsContact O-N 3.1Å; P326-V443 CarbonylContact C-O 3.56Å; P326-V443 VanDerWaalsContact CA-O 3.26Å; P326-V443 WeakPolarHBondContact CA-O 3.46Å; P326-V443 WeakPolarHBondContact CB-O 3.23Å
327	V	73.9	Confident	68.2	Low	11 Å²	11	69.1 Å²	69.1	7%	0.067	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	115.9	-163.2	-175.2	0	0	0	0	109.8	K325 L329 T442 V443 W445 L623	K325-V327 PolarHBondContact O-N 3.16Å; V327-L329 HydrophobicContact CG1-CD2 3.91Å; V327-L329 PolarHBondContact O-N 3.44Å; V327-T442 WeakPolarHBondContact O-CA 3.38Å; V327-V443 PolarHBondContact N-O 3.32Å; V327-V443 PolarHBondContact O-N 2.94Å; V327-V443 VanDerWaalsContact O-N 3.07Å; V327-W445 HydrophobicContact CG2-CZ2 3.89Å; V327-L623 HydrophobicContact CG1-CD2 4.22Å
328	R	78.9	Confident	70.7	Confident	162 Å²	162	68.3 Å²	68.3	61%	0.611	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	101.2	-172.2	-172.1	-175.8	175.1	96.2	4.9	110.4	P326 A439 S440 C441 T442	P326-R328 PolarHBondContact O-N 2.77Å; P326-R328 VanDerWaalsContact O-N 3.1Å; R328-A439 PolarHBondContact NH2-O 2.87Å; R328-A439 VanDerWaalsContact NH2-O 3.14Å; R328-S440 VanDerWaalsContact CZ-CB 3.45Å; R328-S440 PolarHBondContact NH1-OG 3.41Å; R328-S440 VanDerWaalsContact NH1-OG 3.14Å; R328-S440 PolarHBondContact NH2-OG 2.89Å; R328-C441 CarbonylContact C-O 3.57Å; R328-C441 WeakPolarHBondContact CA-O 3.48Å; R328-T442 HydrophobicContact CB-CG2 4.3Å; R328-T442 HydrophobicContact CG-CG2 4.29Å
329	L	86.8	Confident	73.3	Confident	8 Å²	8	64.2 Å²	64.2	4%	0.042	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	163.4	179.4	-55	-175.9	0	0	0	111.9	V327 L363 S440 C441 V443 A619 Y622 L623	V327-L329 HydrophobicContact CG1-CD2 3.91Å; V327-L329 PolarHBondContact O-N 3.44Å; L329-L363 HydrophobicContact CB-CD1 3.84Å; L329-L363 HydrophobicContact CD1-CD1 4.11Å; L329-S440 WeakPolarHBondContact O-CA 3.39Å; L329-S440 VanDerWaalsContact O-CB 3.27Å; L329-S440 WeakPolarHBondContact O-CB 3.48Å; L329-C441 HydrophobicContact CB-CB 4.26Å; L329-C441 PolarHBondContact N-O 3.41Å; L329-C441 PolarHBondContact O-N 3.41Å; L329-C441 VanDerWaalsContact O-N 3.1Å; L329-V443 HydrophobicContact CD1-CG2 3.6Å; L329-V443 HydrophobicContact CG-CG2 4.2Å; L329-A619 HydrophobicContact CD1-CB 3.77Å; L329-Y622 HydrophobicContact CD1-CD1 4.02Å; L329-Y622 HydrophobicContact CD2-CD1 3.89Å; L329-Y622 HydrophobicContact CD2-CE1 3.95Å; L329-Y622 HydrophobicContact CG-CD1 4.38Å; L329-L623 HydrophobicContact CD1-CD1 4.1Å; L329-L623 HydrophobicContact CD1-CG 4.14Å; L329-L623 HydrophobicContact CD2-CD2 4.01Å; L329-L623 HydrophobicContact CD2-CG 4.23Å
330	P	86.6	Confident	75.9	Confident	54 Å²	54	65.3 Å²	65.3	35%	0.351	31%	0.312	S	S	.	.			trans	-50.9	156.9	165.5	-26.2	35.8	0	0	0	112.4	V333 L363 C441 Y622	P330-V333 HydrophobicContact CB-CG2 4.19Å; P330-V333 HydrophobicContact CG-CG2 4.43Å; P330-L363 WeakPolarHBondContact O-CD1 3.04Å; P330-C441 PolarHBondContact O-N 3.11Å; P330-Y622 HydrophobicContact CG-CE1 4.43Å
331	L	88.3	Confident	77.9	Confident	51 Å²	51	64.3 Å²	64.3	27%	0.267	31%	0.309	S	S	.	.	S	Bend	trans	-74.9	-36.3	172.8	-178.9	59.8	0	0	0	111.7	E362 L363	L331-E362 WeakPolarHBondContact O-CA 3.29Å; L331-L363 PolarHBondContact O-N 2.95Å
332	K	90.8	Very high	80.3	Confident	103 Å²	103	64.2 Å²	64.2	45%	0.448	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	150	-178.3	-45.4	-159.9	-173.4	-149.2	0	111	V360 V361 E362	K332-V360 HydrophobicContact CB-CG1 3.66Å; K332-V360 HydrophobicContact CD-CG1 4.12Å; K332-V361 CarbonylContact C-O 3.5Å; K332-V361 WeakPolarHBondContact CA-O 3.22Å; K332-V361 WeakPolarHBondContact CB-O 3.44Å; K332-E362 HydrophobicContact CD-CG 3.81Å; K332-E362 VanDerWaalsContact CE-OE1 3.26Å; K332-E362 WeakPolarHBondContact CE-OE1 3.35Å; K332-E362 HydrophobicContact CG-CG 3.78Å; K332-E362 IonicContact NZ-OE1 3.83Å; K332-E362 PolarHBondContact NZ-OE1 2.83Å
333	V	92.8	Very high	82.6	Confident	10 Å²	10	65 Å²	65	6%	0.061	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	148.8	178.3	174.3	0	0	0	0	109.3	P330 V335 V360 V361 L363 Y622 L631	P330-V333 HydrophobicContact CB-CG2 4.19Å; P330-V333 HydrophobicContact CG-CG2 4.43Å; V333-V335 PolarHBondContact O-N 3.42Å; V333-V360 WeakPolarHBondContact O-CA 2.99Å; V333-V361 PolarHBondContact N-O 3.26Å; V333-V361 PolarHBondContact O-N 3.48Å; V333-L363 HydrophobicContact CB-CD2 3.92Å; V333-L363 HydrophobicContact CB-CG 4.43Å; V333-L363 HydrophobicContact CG2-CD1 3.77Å; V333-L363 HydrophobicContact CG2-CD2 3.7Å; V333-L363 HydrophobicContact CG2-CG 3.82Å; V333-Y622 HydrophobicContact CB-CD2 4.38Å; V333-Y622 HydrophobicContact CB-CE2 4.42Å; V333-Y622 HydrophobicContact CG1-CD2 4.04Å; V333-Y622 HydrophobicContact CG1-CE2 4.03Å; V333-Y622 HydrophobicContact CG2-CD2 3.7Å; V333-Y622 HydrophobicContact CG2-CE2 3.51Å; V333-L631 HydrophobicContact CG1-CD1 4.24Å; V333-L631 HydrophobicContact CG1-CG 4.04Å
334	A	93.9	Very high	84.7	Confident	18 Å²	18	60.8 Å²	60.8	15%	0.149	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	121	171.8	0	0	0	0	0	109.9	M359 K630 L631	A334-M359 CarbonylContact C-O 3.5Å; A334-M359 WeakPolarHBondContact CA-O 3.43Å; A334-K630 HydrophobicContact CB-CB 4.29Å; A334-K630 CarbonylContact O-C 3.43Å; A334-K630 VanDerWaalsContact O-CA 3.31Å; A334-K630 WeakPolarHBondContact O-CA 3.13Å; A334-K630 WeakPolarHBondContact O-CB 3.37Å; A334-L631 PolarHBondContact O-N 3.05Å
335	V	94.8	Very high	86.8	Confident	1 Å²	1	59 Å²	59	1%	0.006	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	122.2	170.3	-172.6	0	0	0	0	107.8	V333 L337 R358 M359 V361 L631 L633	V333-V335 PolarHBondContact O-N 3.42Å; V335-L337 HydrophobicContact CG1-CG 4.25Å; V335-R358 WeakPolarHBondContact O-CA 3.44Å; V335-M359 HydrophobicContact CB-CG 4.32Å; V335-M359 PolarHBondContact N-O 2.87Å; V335-M359 PolarHBondContact O-N 3.27Å; V335-V361 HydrophobicContact CB-CG2 4.28Å; V335-V361 HydrophobicContact CG2-CB 4.09Å; V335-V361 HydrophobicContact CG2-CG2 3.71Å; V335-L631 CarbonylContact C-O 3.57Å; V335-L631 WeakPolarHBondContact CA-O 3.49Å; V335-L631 HydrophobicContact CG1-CB 4.41Å; V335-L631 HydrophobicContact CG2-CB 4.22Å; V335-L631 HydrophobicContact CG2-CD1 4.1Å; V335-L633 HydrophobicContact CG1-CD1 4.03Å
336	E	94.9	Very high	88.8	Confident	29 Å²	29	53.7 Å²	53.7	14%	0.136	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	130.8	168.1	-72.3	177.4	-176.6	0	0	108.8	L357 R358 K630 L631 Q632 L633	E336-L357 CarbonylContact C-O 3.53Å; E336-L357 WeakPolarHBondContact CA-O 3.39Å; E336-R358 HydrophobicContact CG-CB 4.15Å; E336-R358 HydrophobicContact CG-CG 3.8Å; E336-R358 IonicContact OE1-CZ 3.94Å; E336-R358 IonicContact OE1-NE 2.64Å; E336-R358 IonicContact OE1-NH1 3.58Å; E336-K630 VanDerWaalsContact CD-CD 3.41Å; E336-K630 HydrophobicContact CG-CD 4.3Å; E336-K630 VanDerWaalsContact OE1-CD 3.25Å; E336-K630 WeakPolarHBondContact OE1-CD 3.43Å; E336-K630 IonicContact OE1-NZ 3.75Å; E336-K630 PolarHBondContact OE1-NZ 2.85Å; E336-K630 WeakPolarHBondContact OE2-CD 3.35Å; E336-K630 WeakPolarHBondContact OE2-CE 3.35Å; E336-K630 IonicContact OE2-NZ 3.39Å; E336-K630 PolarHBondContact OE2-NZ 3.3Å; E336-L631 PolarHBondContact N-O 3.05Å; E336-Q632 HydrophobicContact CB-CG 4.4Å; E336-Q632 PolarHBondContact OE2-NE2 3.04Å; E336-L633 PolarHBondContact O-N 3.26Å
337	L	94.8	Very high	90.2	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	128.2	-178.6	-76	159.4	0	0	0	109.6	V335 R356 L357 M359 L374 L417 L633 Y635	V335-L337 HydrophobicContact CG1-CG 4.25Å; L337-R356 WeakPolarHBondContact O-CA 3.35Å; L337-L357 HydrophobicContact CB-CB 4.28Å; L337-L357 HydrophobicContact CB-CD1 3.78Å; L337-L357 PolarHBondContact N-O 3.17Å; L337-L357 PolarHBondContact O-N 3.49Å; L337-M359 HydrophobicContact CD1-CE 4Å; L337-L374 HydrophobicContact CD1-CD1 3.76Å; L337-L374 HydrophobicContact CD1-CD2 3.98Å; L337-L374 HydrophobicContact CD1-CG 4.47Å; L337-L374 HydrophobicContact CD2-CD1 4.44Å; L337-L417 HydrophobicContact CD2-CD2 3.72Å; L337-L633 VanDerWaalsContact CA-O 3.32Å; L337-L633 WeakPolarHBondContact CA-O 3.46Å; L337-L633 HydrophobicContact CD2-CB 3.89Å; L337-Y635 HydrophobicContact CB-CD1 4.32Å
338	Q	93.9	Very high	90.9	Very high	61 Å²	61	52.1 Å²	52.1	29%	0.285	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	147.9	177.2	-57.7	-162.4	73.2	0	0	111.1	R356 L633 E634 Y635	Q338-R356 HydrophobicContact CG-CG 4.37Å; Q338-L633 PolarHBondContact N-O 3.42Å; Q338-E634 CarbonylContact O-C 3.58Å; Q338-E634 WeakPolarHBondContact O-CA 3.34Å; Q338-Y635 VanDerWaalsContact C-CD1 3.42Å; Q338-Y635 VanDerWaalsContact C-CE1 3.44Å; Q338-Y635 WeakPolarHBondContact O-CD1 3.22Å; Q338-Y635 PolarHBondContact O-N 3.44Å
339	P	93.9	Very high	91.5	Very high	25 Å²	25	48.5 Å²	48.5	16%	0.162	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	128.5	176.5	24.8	-24.9	0	0	0	110.5	W345 P355 Y635	P339-W345 HydrophobicContact CB-CB 3.91Å; P339-W345 HydrophobicContact CG-CB 3.64Å; P339-W345 HydrophobicContact CG-CG 4.04Å; P339-P355 WeakPolarHBondContact CD-O 3.46Å; P339-P355 HydrophobicContact CG-CB 4.13Å; P339-Y635 WeakPolarHBondContact CA-O 3.29Å; P339-Y635 HydrophobicContact CB-CE1 3.96Å; P339-Y635 HydrophobicContact CB-CE2 4.06Å; P339-Y635 HydrophobicContact CG-CE1 4.39Å
340	R	91.8	Very high	91.6	Very high	91 Å²	91	51.8 Å²	51.8	34%	0.343	27%	0.266	S	S	.	.	S	Bend	trans	-68.9	-36	175.6	-168	170.3	-164.4	-171.8	5.4	112.4	E634 Y635 E636	R340-E634 HydrophobicContact CB-CB 4.21Å; R340-E634 WeakPolarHBondContact CG-OE2 3.33Å; R340-Y635 PolarHBondContact N-O 3.22Å; R340-E636 HydrophobicContact CB-CB 4.41Å
341	S	90.3	Very high	91.6	Very high	29 Å²	29	50.8 Å²	50.8	20%	0.203	26%	0.258	C	S	.	.	S	Bend	trans	-125.9	149.1	-175.6	56	0	0	0	0	113.2	H343 S344 W345 E636	S341-H343 PolarHBondContact O-N 3.13Å; S341-S344 WeakPolarHBondContact O-CA 3.01Å; S341-S344 WeakPolarHBondContact O-CB 3.32Å; S341-S344 PolarHBondContact O-N 2.86Å; S341-S344 PolarHBondContact OG-OG 3.04Å; S341-W345 PolarHBondContact O-N 2.98Å; S341-E636 WeakPolarHBondContact CB-OE1 3.48Å; S341-E636 PolarHBondContact OG-OE1 3.06Å
342	N	92.7	Very high	91.7	Very high	145 Å²	145	52.8 Å²	52.8	78%	0.775	28%	0.282	S	S	*	.	H	α-helix	trans	-59	-30.1	179.4	-72.3	-28.6	0	0	0	113	W345 A346	N342-W345 PolarHBondContact O-N 2.84Å; N342-A346 VanDerWaalsContact O-CB 3.25Å; N342-A346 WeakPolarHBondContact O-CB 3.47Å; N342-A346 PolarHBondContact O-N 3.28Å
343	H	90.3	Very high	91.6	Very high	112 Å²	112	52.6 Å²	52.6	52%	0.519	28%	0.279	S	S	.	.	H	α-helix	trans	-60.7	-45.3	170.4	179.7	67.4	0	0	0	111.6	S341 A346 R347 Q413	S341-H343 PolarHBondContact O-N 3.13Å; H343-A346 PolarHBondContact O-N 3.4Å; H343-R347 VanDerWaalsContact O-CB 3.3Å; H343-R347 WeakPolarHBondContact O-CB 3.37Å; H343-R347 PolarHBondContact O-N 2.75Å; H343-Q413 PolarHBondContact NE2-NE2 3.33Å; H343-Q413 PolarHBondContact NE2-OE1 2.85Å
344	S	92	Very high	91.5	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-70.7	-32.6	-179.8	-55	0	0	0	0	112.9	S341 V348 Y635 E636 W637	S341-S344 WeakPolarHBondContact O-CA 3.01Å; S341-S344 WeakPolarHBondContact O-CB 3.32Å; S341-S344 PolarHBondContact O-N 2.86Å; S341-S344 PolarHBondContact OG-OG 3.04Å; S344-V348 WeakPolarHBondContact O-CG2 3.39Å; S344-V348 PolarHBondContact O-N 3.23Å; S344-Y635 PolarHBondContact O-OH 3.37Å; S344-E636 WeakPolarHBondContact OG-CA 3.34Å; S344-W637 PolarHBondContact OG-N 2.89Å
345	W	93.5	Very high	91.3	Very high	117 Å²	117	56.7 Å²	56.7	44%	0.443	30%	0.298	S	S	.	.	H	α-helix	trans	-64.6	-54	168.6	-176.1	95.7	0	0	0	110.6	P339 S341 N342 R347 V348 Q349 P355	P339-W345 HydrophobicContact CB-CB 3.91Å; P339-W345 HydrophobicContact CG-CB 3.64Å; P339-W345 HydrophobicContact CG-CG 4.04Å; S341-W345 PolarHBondContact O-N 2.98Å; N342-W345 PolarHBondContact O-N 2.84Å; W345-R347 PolarHBondContact O-N 3.45Å; W345-V348 PolarHBondContact O-N 3Å; W345-Q349 HydrophobicContact CE3-CB 4.25Å; W345-Q349 HydrophobicContact CH2-CB 4.24Å; W345-Q349 HydrophobicContact CH2-CG 3.76Å; W345-Q349 HydrophobicContact CZ2-CG 4.19Å; W345-Q349 HydrophobicContact CZ3-CB 4.11Å; W345-Q349 HydrophobicContact CZ3-CG 4Å; W345-Q349 WeakPolarHBondContact O-CB 3.2Å; W345-Q349 PolarHBondContact O-N 3.26Å; W345-P355 HydrophobicContact CD2-CG 4.33Å; W345-P355 HydrophobicContact CG-CB 4.1Å; W345-P355 HydrophobicContact CG-CG 4.17Å
346	A	89.9	Confident	91.3	Very high	46 Å²	46	64.4 Å²	64.4	38%	0.38	33%	0.327	S	S	.	.	H	α-helix	trans	-63.3	-40	-176	0	0	0	0	0	112.7	N342 H343 Q349 S350	N342-A346 VanDerWaalsContact O-CB 3.25Å; N342-A346 WeakPolarHBondContact O-CB 3.47Å; N342-A346 PolarHBondContact O-N 3.28Å; H343-A346 PolarHBondContact O-N 3.4Å; A346-Q349 PolarHBondContact O-N 2.66Å; A346-S350 VanDerWaalsContact O-CB 3.3Å; A346-S350 WeakPolarHBondContact O-CB 3.32Å; A346-S350 PolarHBondContact O-N 3.01Å; A346-S350 PolarHBondContact O-OG 3.13Å
347	R	88.9	Confident	91.1	Very high	31 Å²	31	64.9 Å²	64.9	12%	0.117	33%	0.33	C	S	.	.	H	α-helix	trans	-58	-49.3	174.8	-178.7	177.3	168.8	94.8	10.2	111.4	H343 W345 S350 L351	H343-R347 VanDerWaalsContact O-CB 3.3Å; H343-R347 WeakPolarHBondContact O-CB 3.37Å; H343-R347 PolarHBondContact O-N 2.75Å; W345-R347 PolarHBondContact O-N 3.45Å; R347-S350 PolarHBondContact O-N 3.33Å; R347-S350 PolarHBondContact O-OG 2.86Å; R347-L351 PolarHBondContact O-N 3.49Å
348	V	90.4	Very high	91.1	Very high	0 Å²	0	73.6 Å²	73.6	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-70.1	-38.9	-179.9	175.4	0	0	0	0	111.7	S344 W345 S350 L351 Y353 P355 W378 Y635	S344-V348 WeakPolarHBondContact O-CG2 3.39Å; S344-V348 PolarHBondContact O-N 3.23Å; W345-V348 PolarHBondContact O-N 3Å; V348-S350 VanDerWaalsContact C-N 3.34Å; V348-S350 PolarHBondContact O-N 3.46Å; V348-L351 PolarHBondContact O-N 2.9Å; V348-Y353 PolarHBondContact O-N 3.49Å; V348-P355 HydrophobicContact CB-CB 4.38Å; V348-P355 HydrophobicContact CB-CG 4.39Å; V348-P355 HydrophobicContact CG1-CB 4.31Å; V348-P355 HydrophobicContact CG1-CG 4.29Å; V348-W378 HydrophobicContact CB-CZ2 4.44Å; V348-W378 HydrophobicContact CG1-CD2 4.46Å; V348-W378 HydrophobicContact CG1-CZ2 3.77Å; V348-W378 HydrophobicContact CG2-CD2 3.81Å; V348-W378 HydrophobicContact CG2-CE3 4.15Å; V348-W378 HydrophobicContact CG2-CG 4.21Å; V348-W378 HydrophobicContact CG2-CH2 4.12Å; V348-W378 HydrophobicContact CG2-CZ2 3.8Å; V348-W378 HydrophobicContact CG2-CZ3 4.3Å; V348-Y635 HydrophobicContact CG2-CE2 3.83Å; V348-Y635 WeakPolarHBondContact CG2-OH 3.34Å
349	Q	90.6	Very high	91	Very high	87 Å²	87	72.6 Å²	72.6	41%	0.407	36%	0.359	S	S	.	.	H	α-helix	trans	-63	-38	175.2	-173.2	66.3	30.5	0	0	112.2	W345 A346 L351 A352 P355	W345-Q349 HydrophobicContact CE3-CB 4.25Å; W345-Q349 HydrophobicContact CH2-CB 4.24Å; W345-Q349 HydrophobicContact CH2-CG 3.76Å; W345-Q349 HydrophobicContact CZ2-CG 4.19Å; W345-Q349 HydrophobicContact CZ3-CB 4.11Å; W345-Q349 HydrophobicContact CZ3-CG 4Å; W345-Q349 WeakPolarHBondContact O-CB 3.2Å; W345-Q349 PolarHBondContact O-N 3.26Å; A346-Q349 PolarHBondContact O-N 2.66Å; Q349-L351 PolarHBondContact O-N 3.42Å; Q349-A352 WeakPolarHBondContact O-CA 3.42Å; Q349-A352 PolarHBondContact O-N 3.1Å; Q349-P355 HydrophobicContact CB-CG 3.94Å; Q349-P355 VanDerWaalsContact OE1-CD 3.24Å
350	S	87.9	Confident	91	Very high	77 Å²	77	76.4 Å²	76.4	54%	0.538	38%	0.382	S	S	.	.	H	α-helix	trans	-65.5	-21.3	177.5	75.3	0	0	0	0	113.6	A346 R347 V348 A352 Y380	A346-S350 VanDerWaalsContact O-CB 3.3Å; A346-S350 WeakPolarHBondContact O-CB 3.32Å; A346-S350 PolarHBondContact O-N 3.01Å; A346-S350 PolarHBondContact O-OG 3.13Å; R347-S350 PolarHBondContact O-N 3.33Å; R347-S350 PolarHBondContact O-OG 2.86Å; V348-S350 VanDerWaalsContact C-N 3.34Å; V348-S350 PolarHBondContact O-N 3.46Å; S350-A352 VanDerWaalsContact C-N 3.28Å; S350-Y380 PolarHBondContact OG-OH 2.63Å
351	L	87.9	Confident	91.1	Very high	32 Å²	32	73.2 Å²	73.2	17%	0.168	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	10.7	172.8	-62.1	173.1	0	0	0	112.9	R347 V348 Q349 Y353 W378 Y380	R347-L351 PolarHBondContact O-N 3.49Å; V348-L351 PolarHBondContact O-N 2.9Å; Q349-L351 PolarHBondContact O-N 3.42Å; L351-Y353 HydrophobicContact CB-CD2 3.76Å; L351-Y353 HydrophobicContact CB-CE2 4.31Å; L351-Y353 WeakPolarHBondContact O-CD2 3.4Å; L351-Y353 PolarHBondContact O-N 2.79Å; L351-Y353 VanDerWaalsContact O-N 3.12Å; L351-W378 HydrophobicContact CD1-CB 4.13Å; L351-W378 VanDerWaalsContact CD1-O 3.29Å; L351-W378 WeakPolarHBondContact CD1-O 3.43Å; L351-Y380 HydrophobicContact CD2-CD1 3.62Å; L351-Y380 HydrophobicContact CD2-CD2 4Å; L351-Y380 HydrophobicContact CD2-CE1 3.72Å; L351-Y380 HydrophobicContact CD2-CE2 4.11Å; L351-Y380 HydrophobicContact CD2-CG 3.74Å
352	A	89.1	Confident	91.2	Very high	94 Å²	94	73.8 Å²	73.8	78%	0.777	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	18.2	-175.2	0	0	0	0	0	115.4	Q349 S350	Q349-A352 WeakPolarHBondContact O-CA 3.42Å; Q349-A352 PolarHBondContact O-N 3.1Å; S350-A352 VanDerWaalsContact C-N 3.28Å
353	Y	89.1	Confident	91.1	Very high	99 Å²	99	67 Å²	67	39%	0.388	34%	0.335	S	S	.	.	S	Bend	trans	-91.7	148.9	170.6	-71	-72.6	0	0	0	110.9	V348 L351 P355 K377 W378	V348-Y353 PolarHBondContact O-N 3.49Å; L351-Y353 HydrophobicContact CB-CD2 3.76Å; L351-Y353 HydrophobicContact CB-CE2 4.31Å; L351-Y353 WeakPolarHBondContact O-CD2 3.4Å; L351-Y353 PolarHBondContact O-N 2.79Å; L351-Y353 VanDerWaalsContact O-N 3.12Å; Y353-P355 VanDerWaalsContact O-CD 3.25Å; Y353-P355 WeakPolarHBondContact O-CD 3.11Å; Y353-K377 WeakPolarHBondContact CE2-O 3.48Å; Y353-K377 PolarHBondContact OH-O 3.01Å; Y353-W378 AromaticContact CD2-CD1 3.69Å; Y353-W378 AromaticContact CG-CD1 3.97Å
354	N	90.5	Very high	91	Very high	111 Å²	111	63.9 Å²	63.9	59%	0.594	32%	0.321	S	S	*	.			trans	-65.7	121.2	170.8	-175.4	-8.5	0	0	0	110.2	R356	N354-R356 PolarHBondContact ND2-O 3.45Å; N354-R356 PolarHBondContact O-N 2.97Å; N354-R356 PolarHBondContact OD1-N 3.3Å; N354-R356 PolarHBondContact OD1-O 3.3Å
355	P	91	Very high	91	Very high	3 Å²	3	69.8 Å²	69.8	2%	0.019	34%	0.343	C	S	.	.	S	Bend	trans	-67.9	-18.3	177	-22.3	36.1	0	0	0	114.1	P339 W345 V348 Q349 Y353 L357 Y635	P339-P355 WeakPolarHBondContact CD-O 3.46Å; P339-P355 HydrophobicContact CG-CB 4.13Å; W345-P355 HydrophobicContact CD2-CG 4.33Å; W345-P355 HydrophobicContact CG-CB 4.1Å; W345-P355 HydrophobicContact CG-CG 4.17Å; V348-P355 HydrophobicContact CB-CB 4.38Å; V348-P355 HydrophobicContact CB-CG 4.39Å; V348-P355 HydrophobicContact CG1-CB 4.31Å; V348-P355 HydrophobicContact CG1-CG 4.29Å; Q349-P355 HydrophobicContact CB-CG 3.94Å; Q349-P355 VanDerWaalsContact OE1-CD 3.24Å; Y353-P355 VanDerWaalsContact O-CD 3.25Å; Y353-P355 WeakPolarHBondContact O-CD 3.11Å; P355-L357 WeakPolarHBondContact O-CD1 3.37Å; P355-Y635 VanDerWaalsContact O-CE1 3.3Å; P355-Y635 WeakPolarHBondContact O-CE1 3.31Å; P355-Y635 PolarHBondContact O-OH 3.4Å
356	R	93.1	Very high	90.9	Very high	162 Å²	162	67.6 Å²	67.6	61%	0.611	34%	0.337	S	S	*	.	S	Bend	trans	-104.7	111.2	173.7	-72.2	-178.6	170.3	155.8	1.7	109.7	L337 Q338 N354	L337-R356 WeakPolarHBondContact O-CA 3.35Å; Q338-R356 HydrophobicContact CG-CG 4.37Å; N354-R356 PolarHBondContact ND2-O 3.45Å; N354-R356 PolarHBondContact O-N 2.97Å; N354-R356 PolarHBondContact OD1-N 3.3Å; N354-R356 PolarHBondContact OD1-O 3.3Å
357	L	92.4	Very high	91	Very high	39 Å²	39	65.4 Å²	65.4	20%	0.204	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	146.3	-174.1	-41.2	88.6	0	0	0	110.5	E336 L337 P355 L374 W378 Y635	E336-L357 CarbonylContact C-O 3.53Å; E336-L357 WeakPolarHBondContact CA-O 3.39Å; L337-L357 HydrophobicContact CB-CB 4.28Å; L337-L357 HydrophobicContact CB-CD1 3.78Å; L337-L357 PolarHBondContact N-O 3.17Å; L337-L357 PolarHBondContact O-N 3.49Å; P355-L357 WeakPolarHBondContact O-CD1 3.37Å; L357-L374 HydrophobicContact CD2-CD2 4.46Å; L357-W378 HydrophobicContact CD1-CH2 3.66Å; L357-W378 HydrophobicContact CD1-CZ2 3.37Å; L357-W378 HydrophobicContact CD2-CH2 4.41Å; L357-W378 HydrophobicContact CD2-CZ2 3.6Å; L357-W378 HydrophobicContact CG-CZ2 4.05Å; L357-Y635 HydrophobicContact CD1-CE1 4.09Å
358	R	93.1	Very high	91.2	Very high	185 Å²	185	64.3 Å²	64.3	70%	0.698	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.8	124.4	169.1	-176.2	170.1	166.2	-174.3	-7.7	108.8	V335 E336	V335-R358 WeakPolarHBondContact O-CA 3.44Å; E336-R358 HydrophobicContact CG-CB 4.15Å; E336-R358 HydrophobicContact CG-CG 3.8Å; E336-R358 IonicContact OE1-CZ 3.94Å; E336-R358 IonicContact OE1-NE 2.64Å; E336-R358 IonicContact OE1-NH1 3.58Å
359	M	93.4	Very high	91.3	Very high	40 Å²	40	67.1 Å²	67.1	20%	0.197	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	153.7	-178.1	59.4	174.3	80.1	0	0	110.9	A334 V335 L337 V361 L370 Y373 L374	A334-M359 CarbonylContact C-O 3.5Å; A334-M359 WeakPolarHBondContact CA-O 3.43Å; V335-M359 HydrophobicContact CB-CG 4.32Å; V335-M359 PolarHBondContact N-O 2.87Å; V335-M359 PolarHBondContact O-N 3.27Å; L337-M359 HydrophobicContact CD1-CE 4Å; M359-V361 HydrophobicContact CB-CG2 4.48Å; M359-V361 HydrophobicContact CG-CG2 3.7Å; M359-V361 HydrophobicContact SD-CG2 3.83Å; M359-L370 HydrophobicContact CE-CD1 4.46Å; M359-L370 HydrophobicContact SD-CD1 3.74Å; M359-Y373 HydrophobicContact CE-CE1 4.09Å; M359-Y373 HydrophobicContact SD-CE1 4.23Å; M359-L374 HydrophobicContact CE-CD2 4.05Å
360	V	94.1	Very high	91.3	Very high	104 Å²	104	63.4 Å²	63.4	63%	0.63	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	112.3	178.4	176.1	0	0	0	0	108.7	K332 V333	K332-V360 HydrophobicContact CB-CG1 3.66Å; K332-V360 HydrophobicContact CD-CG1 4.12Å; V333-V360 WeakPolarHBondContact O-CA 2.99Å
361	V	92.7	Very high	91.5	Very high	24 Å²	24	59.8 Å²	59.8	15%	0.145	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	148.2	-171.1	-162.7	0	0	0	0	110.4	K332 V333 V335 M359 R365 L618	K332-V361 CarbonylContact C-O 3.5Å; K332-V361 WeakPolarHBondContact CA-O 3.22Å; K332-V361 WeakPolarHBondContact CB-O 3.44Å; V333-V361 PolarHBondContact N-O 3.26Å; V333-V361 PolarHBondContact O-N 3.48Å; V335-V361 HydrophobicContact CB-CG2 4.28Å; V335-V361 HydrophobicContact CG2-CB 4.09Å; V335-V361 HydrophobicContact CG2-CG2 3.71Å; M359-V361 HydrophobicContact CB-CG2 4.48Å; M359-V361 HydrophobicContact CG-CG2 3.7Å; M359-V361 HydrophobicContact SD-CG2 3.83Å; V361-R365 HydrophobicContact CG1-CG 4.39Å; V361-L618 HydrophobicContact CB-CD1 3.89Å; V361-L618 HydrophobicContact CG1-CD1 3.38Å
362	E	92.4	Very high	91.6	Very high	42 Å²	42	63.3 Å²	63.3	20%	0.196	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	129.8	177.1	-73.1	160.6	-179.9	0	0	110.8	L331 K332 H364 R365	L331-E362 WeakPolarHBondContact O-CA 3.29Å; K332-E362 HydrophobicContact CD-CG 3.81Å; K332-E362 VanDerWaalsContact CE-OE1 3.26Å; K332-E362 WeakPolarHBondContact CE-OE1 3.35Å; K332-E362 HydrophobicContact CG-CG 3.78Å; K332-E362 IonicContact NZ-OE1 3.83Å; K332-E362 PolarHBondContact NZ-OE1 2.83Å; E362-H364 PolarHBondContact O-N 3.22Å; E362-H364 VanDerWaalsContact O-N 3.13Å; E362-H364 IonicContact OE2-CE1 2.79Å; E362-H364 PolarHBondContact OE2-CE1 2.88Å; E362-H364 VanDerWaalsContact OE2-CE1 3.23Å; E362-H364 IonicContact OE2-NE2 2.67Å; E362-R365 HydrophobicContact CB-CG 4.06Å; E362-R365 WeakPolarHBondContact O-CB 3.47Å; E362-R365 VanDerWaalsContact O-CG 3.27Å; E362-R365 WeakPolarHBondContact O-CG 3.36Å; E362-R365 PolarHBondContact O-N 3.41Å; E362-R365 VanDerWaalsContact O-N 3.12Å; E362-R365 IonicContact OE2-CZ 3.9Å; E362-R365 IonicContact OE2-NE 2.74Å; E362-R365 PolarHBondContact OE2-NE 2.89Å; E362-R365 VanDerWaalsContact OE2-NE 3.15Å; E362-R365 IonicContact OE2-NH2 3.39Å; E362-R365 PolarHBondContact OE2-NH2 3.37Å
363	L	91.1	Very high	91.7	Very high	2 Å²	2	63.3 Å²	63.3	1%	0.01	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-19.8	-171.9	-71.6	-174.6	0	0	0	114.2	L329 P330 L331 V333 R365 C441 L618 A619 Y622 L631	L329-L363 HydrophobicContact CB-CD1 3.84Å; L329-L363 HydrophobicContact CD1-CD1 4.11Å; P330-L363 WeakPolarHBondContact O-CD1 3.04Å; L331-L363 PolarHBondContact O-N 2.95Å; V333-L363 HydrophobicContact CB-CD2 3.92Å; V333-L363 HydrophobicContact CB-CG 4.43Å; V333-L363 HydrophobicContact CG2-CD1 3.77Å; V333-L363 HydrophobicContact CG2-CD2 3.7Å; V333-L363 HydrophobicContact CG2-CG 3.82Å; L363-R365 PolarHBondContact O-N 3.28Å; L363-C441 HydrophobicContact CB-CB 4.29Å; L363-L618 HydrophobicContact CD2-CB 4.13Å; L363-L618 CarbonylContact O-C 3.47Å; L363-A619 HydrophobicContact CB-CB 4.03Å; L363-A619 WeakPolarHBondContact O-CB 3.44Å; L363-A619 PolarHBondContact O-N 3.44Å; L363-Y622 HydrophobicContact CD1-CD1 3.96Å; L363-Y622 HydrophobicContact CD1-CD2 4.27Å; L363-Y622 HydrophobicContact CD1-CE1 4.45Å; L363-Y622 HydrophobicContact CD1-CG 3.86Å; L363-Y622 HydrophobicContact CD2-CD2 4.3Å; L363-Y622 HydrophobicContact CD2-CG 4.2Å; L363-L631 HydrophobicContact CD2-CD1 4.34Å
364	H	88.9	Confident	91.8	Very high	47 Å²	47	58.7 Å²	58.7	22%	0.218	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-2.8	176.6	75.3	-96.3	0	0	0	114.4	E362 V434 H436	E362-H364 PolarHBondContact O-N 3.22Å; E362-H364 VanDerWaalsContact O-N 3.13Å; E362-H364 IonicContact OE2-CE1 2.79Å; E362-H364 PolarHBondContact OE2-CE1 2.88Å; E362-H364 VanDerWaalsContact OE2-CE1 3.23Å; E362-H364 IonicContact OE2-NE2 2.67Å; H364-V434 HydrophobicContact CB-CG1 4.42Å; H364-H436 HydrophobicContact CB-CB 4Å
365	R	90.8	Very high	91.7	Very high	124 Å²	124	56.1 Å²	56.1	47%	0.468	25%	0.254	S	S	.	.	S	Bend	trans	-79.4	141.4	-179.8	-57.3	-66.5	176.9	163.7	-4.1	110.3	V361 E362 L363 T617 L618	V361-R365 HydrophobicContact CG1-CG 4.39Å; E362-R365 HydrophobicContact CB-CG 4.06Å; E362-R365 WeakPolarHBondContact O-CB 3.47Å; E362-R365 VanDerWaalsContact O-CG 3.27Å; E362-R365 WeakPolarHBondContact O-CG 3.36Å; E362-R365 PolarHBondContact O-N 3.41Å; E362-R365 VanDerWaalsContact O-N 3.12Å; E362-R365 IonicContact OE2-CZ 3.9Å; E362-R365 IonicContact OE2-NE 2.74Å; E362-R365 PolarHBondContact OE2-NE 2.89Å; E362-R365 VanDerWaalsContact OE2-NE 3.15Å; E362-R365 IonicContact OE2-NH2 3.39Å; E362-R365 PolarHBondContact OE2-NH2 3.37Å; L363-R365 PolarHBondContact O-N 3.28Å; R365-T617 WeakPolarHBondContact O-CA 3.43Å; R365-L618 HydrophobicContact CB-CD1 4.27Å; R365-L618 PolarHBondContact O-N 3.19Å
366	K	92.4	Very high	91.5	Very high	71 Å²	71	62.6 Å²	62.6	31%	0.309	28%	0.284	S	S	.	.	B	Isolated β-bridge	trans	-63.3	146.8	169.6	-69.6	179.9	165.3	-145.1	0	110.3	C369 E614 V616	K366-C369 PolarHBondContact O-N 2.62Å; K366-E614 WeakPolarHBondContact CD-O 3.23Å; K366-E614 WeakPolarHBondContact CE-O 3.48Å; K366-E614 PolarHBondContact NZ-O 2.78Å; K366-E614 IonicContact NZ-OE1 3.13Å; K366-E614 PolarHBondContact NZ-OE1 2.91Å; K366-V616 CarbonylContact C-O 3.57Å; K366-V616 WeakPolarHBondContact CA-O 3.43Å
367	V	92.4	Very high	91.2	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-68.7	-36.3	174.9	175.3	0	0	0	0	110.6	C369 L370 I371 L417 W608 A613 V616 L618 L621	V367-C369 VanDerWaalsContact C-N 3.32Å; V367-C369 PolarHBondContact O-N 3.33Å; V367-L370 WeakPolarHBondContact O-CB 3.04Å; V367-L370 PolarHBondContact O-N 3.07Å; V367-I371 HydrophobicContact CG1-CD1 4.15Å; V367-I371 WeakPolarHBondContact O-CG1 3.43Å; V367-I371 PolarHBondContact O-N 3.19Å; V367-I371 VanDerWaalsContact O-N 3.11Å; V367-L417 HydrophobicContact CG1-CD1 4.3Å; V367-W608 HydrophobicContact CG1-CB 4.09Å; V367-W608 HydrophobicContact CG1-CG 4.34Å; V367-A613 HydrophobicContact CB-CB 3.9Å; V367-A613 HydrophobicContact CG1-CB 3.81Å; V367-V616 HydrophobicContact CG2-CB 4.3Å; V367-V616 HydrophobicContact CG2-CG1 3.95Å; V367-V616 PolarHBondContact N-O 3.27Å; V367-L618 HydrophobicContact CG2-CD2 4.04Å; V367-L618 HydrophobicContact CG2-CG 4.38Å; V367-L621 HydrophobicContact CG2-CD1 3.68Å; V367-L621 HydrophobicContact CG2-CG 3.94Å
368	S	91.7	Very high	91	Very high	7 Å²	7	57.9 Å²	57.9	5%	0.049	27%	0.266	C	S	.	.	H	α-helix	trans	-53	-46	172.4	61.2	0	0	0	0	112.9	L370 I371 E372 A610 A613	S368-L370 VanDerWaalsContact C-N 3.26Å; S368-L370 PolarHBondContact O-N 2.66Å; S368-I371 WeakPolarHBondContact O-CA 3.34Å; S368-I371 WeakPolarHBondContact O-CB 3.28Å; S368-I371 PolarHBondContact O-N 2.97Å; S368-E372 WeakPolarHBondContact O-CG 3.33Å; S368-E372 PolarHBondContact O-N 2.95Å; S368-A610 WeakPolarHBondContact CB-O 3.38Å; S368-A613 PolarHBondContact N-O 3.07Å
369	C	92	Very high	90.4	Very high	60 Å²	60	50.2 Å²	50.2	41%	0.405	24%	0.242	S	C	.	.	H	α-helix	trans	-64.1	-27.8	178.9	-60.8	0	0	0	0	113.5	K366 V367 Y373	K366-C369 PolarHBondContact O-N 2.62Å; V367-C369 VanDerWaalsContact C-N 3.32Å; V367-C369 PolarHBondContact O-N 3.33Å; C369-Y373 VanDerWaalsContact O-CB 3.29Å; C369-Y373 WeakPolarHBondContact O-CB 3.29Å; C369-Y373 PolarHBondContact O-N 3.28Å; C369-Y373 VanDerWaalsContact O-N 3.13Å
370	L	92	Very high	89.2	Confident	9 Å²	9	51.7 Å²	51.7	5%	0.047	25%	0.246	C	C	.	.	H	α-helix	trans	-70.8	-42.9	171.6	176.8	60.7	0	0	0	110.5	M359 V367 S368 Y373 L374 L417 L618	M359-L370 HydrophobicContact CE-CD1 4.46Å; M359-L370 HydrophobicContact SD-CD1 3.74Å; V367-L370 WeakPolarHBondContact O-CB 3.04Å; V367-L370 PolarHBondContact O-N 3.07Å; S368-L370 VanDerWaalsContact C-N 3.26Å; S368-L370 PolarHBondContact O-N 2.66Å; L370-Y373 HydrophobicContact CD1-CD1 4.41Å; L370-Y373 PolarHBondContact O-N 2.9Å; L370-L374 HydrophobicContact CD1-CD1 4.3Å; L370-L374 HydrophobicContact CD1-CG 4.37Å; L370-L374 HydrophobicContact CG-CD1 4.18Å; L370-L374 WeakPolarHBondContact O-CB 3.37Å; L370-L374 VanDerWaalsContact O-CG 3.27Å; L370-L374 WeakPolarHBondContact O-CG 3.45Å; L370-L374 PolarHBondContact O-N 2.94Å; L370-L417 HydrophobicContact CD2-CD1 4.16Å; L370-L417 HydrophobicContact CG-CD1 4.42Å; L370-L618 HydrophobicContact CD2-CD2 4.25Å
371	I	91.8	Very high	87.7	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.4	-45.5	176.7	-62.4	167.2	0	0	0	110.7	V367 S368 L374 K375 L415 L417 W608 S609 A610 A613	V367-I371 HydrophobicContact CG1-CD1 4.15Å; V367-I371 WeakPolarHBondContact O-CG1 3.43Å; V367-I371 PolarHBondContact O-N 3.19Å; V367-I371 VanDerWaalsContact O-N 3.11Å; S368-I371 WeakPolarHBondContact O-CA 3.34Å; S368-I371 WeakPolarHBondContact O-CB 3.28Å; S368-I371 PolarHBondContact O-N 2.97Å; I371-L374 PolarHBondContact O-N 2.86Å; I371-K375 HydrophobicContact CG2-CD 4.24Å; I371-K375 HydrophobicContact CG2-CG 4.44Å; I371-K375 WeakPolarHBondContact O-CB 3.17Å; I371-K375 WeakPolarHBondContact O-CG 3.37Å; I371-K375 PolarHBondContact O-N 2.85Å; I371-L415 HydrophobicContact CG2-CB 4.16Å; I371-L415 HydrophobicContact CG2-CD2 4.29Å; I371-L415 HydrophobicContact CG2-CG 4.26Å; I371-L415 VanDerWaalsContact CG2-O 3.28Å; I371-L415 WeakPolarHBondContact CG2-O 3.41Å; I371-L417 HydrophobicContact CD1-CD1 4.24Å; I371-L417 HydrophobicContact CD1-CG 4.3Å; I371-L417 HydrophobicContact CG1-CD1 3.59Å; I371-L417 HydrophobicContact CG1-CG 3.83Å; I371-W608 HydrophobicContact CD1-CB 4.44Å; I371-W608 WeakPolarHBondContact CD1-O 2.99Å; I371-S609 WeakPolarHBondContact CD1-O 3.4Å; I371-A610 HydrophobicContact CG2-CB 3.89Å; I371-A613 HydrophobicContact CD1-CB 4.23Å
372	E	90.7	Very high	86	Confident	106 Å²	106	56 Å²	56	50%	0.495	26%	0.262	S	S	.	.	H	α-helix	trans	-61.3	-44.7	176.8	-70.3	171.3	155.8	0	0	112.2	S368 L374 K375 Q376	S368-E372 WeakPolarHBondContact O-CG 3.33Å; S368-E372 PolarHBondContact O-N 2.95Å; E372-L374 PolarHBondContact O-N 2.75Å; E372-K375 PolarHBondContact O-N 2.9Å; E372-Q376 WeakPolarHBondContact O-CB 3.25Å; E372-Q376 PolarHBondContact O-N 3.38Å
373	Y	90.8	Very high	84.8	Confident	95 Å²	95	58.4 Å²	58.4	37%	0.373	27%	0.273	S	S	.	.	H	α-helix	trans	-63.5	-38.5	175.9	168.5	-108.6	0	0	0	112.5	M359 C369 L370 Q376 K377	M359-Y373 HydrophobicContact CE-CE1 4.09Å; M359-Y373 HydrophobicContact SD-CE1 4.23Å; C369-Y373 VanDerWaalsContact O-CB 3.29Å; C369-Y373 WeakPolarHBondContact O-CB 3.29Å; C369-Y373 PolarHBondContact O-N 3.28Å; C369-Y373 VanDerWaalsContact O-N 3.13Å; L370-Y373 HydrophobicContact CD1-CD1 4.41Å; L370-Y373 PolarHBondContact O-N 2.9Å; Y373-Q376 PolarHBondContact O-N 2.99Å; Y373-K377 HydrophobicContact CE1-CD 4.16Å; Y373-K377 HydrophobicContact CE2-CD 3.9Å; Y373-K377 HydrophobicContact CE2-CG 4.21Å; Y373-K377 WeakPolarHBondContact O-CB 3.37Å; Y373-K377 PolarHBondContact O-N 2.75Å; Y373-K377 WeakPolarHBondContact OH-CE 3.3Å; Y373-K377 PolarHBondContact OH-NZ 3.12Å
374	L	90.6	Very high	83.6	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-67	-45.7	172.8	-70.5	169.3	0	0	0	111.4	L337 L357 M359 L370 I371 E372 Q376 K377 W378 L415 L417	L337-L374 HydrophobicContact CD1-CD1 3.76Å; L337-L374 HydrophobicContact CD1-CD2 3.98Å; L337-L374 HydrophobicContact CD1-CG 4.47Å; L337-L374 HydrophobicContact CD2-CD1 4.44Å; L357-L374 HydrophobicContact CD2-CD2 4.46Å; M359-L374 HydrophobicContact CE-CD2 4.05Å; L370-L374 HydrophobicContact CD1-CD1 4.3Å; L370-L374 HydrophobicContact CD1-CG 4.37Å; L370-L374 HydrophobicContact CG-CD1 4.18Å; L370-L374 WeakPolarHBondContact O-CB 3.37Å; L370-L374 VanDerWaalsContact O-CG 3.27Å; L370-L374 WeakPolarHBondContact O-CG 3.45Å; L370-L374 PolarHBondContact O-N 2.94Å; I371-L374 PolarHBondContact O-N 2.86Å; E372-L374 PolarHBondContact O-N 2.75Å; L374-Q376 VanDerWaalsContact C-N 3.26Å; L374-Q376 PolarHBondContact O-N 3.18Å; L374-K377 PolarHBondContact O-N 3.29Å; L374-W378 HydrophobicContact CB-CE3 3.92Å; L374-W378 HydrophobicContact CB-CZ3 4.01Å; L374-W378 HydrophobicContact CD1-CZ3 4.42Å; L374-W378 HydrophobicContact CD2-CE3 4.36Å; L374-W378 HydrophobicContact CD2-CH2 4.06Å; L374-W378 HydrophobicContact CD2-CZ2 4.37Å; L374-W378 HydrophobicContact CD2-CZ3 4.03Å; L374-W378 HydrophobicContact CG-CZ3 4.38Å; L374-W378 WeakPolarHBondContact O-CB 3.45Å; L374-W378 PolarHBondContact O-N 3Å; L374-L415 HydrophobicContact CB-CD2 3.51Å; L374-L415 HydrophobicContact CD1-CD2 4.33Å; L374-L417 HydrophobicContact CD1-CD2 4.23Å
375	K	88.7	Confident	82.7	Confident	58 Å²	58	66.6 Å²	66.6	25%	0.252	31%	0.307	S	S	.	.	H	α-helix	trans	-57.1	-38.1	172.8	-75.4	179	178.4	-177.6	0	112	I371 E372 W378 A379 E414 L415 W637	I371-K375 HydrophobicContact CG2-CD 4.24Å; I371-K375 HydrophobicContact CG2-CG 4.44Å; I371-K375 WeakPolarHBondContact O-CB 3.17Å; I371-K375 WeakPolarHBondContact O-CG 3.37Å; I371-K375 PolarHBondContact O-N 2.85Å; E372-K375 PolarHBondContact O-N 2.9Å; K375-W378 CarbonylContact O-C 3.55Å; K375-A379 PolarHBondContact O-N 3.43Å; K375-E414 IonicContact NZ-OE1 2.64Å; K375-E414 PolarHBondContact NZ-OE1 3.5Å; K375-L415 HydrophobicContact CD-CB 4.33Å; K375-L415 HydrophobicContact CG-CB 3.78Å; K375-L415 HydrophobicContact CG-CD2 3.99Å; K375-W637 HydrophobicContact CG-CH2 4.19Å; K375-W637 HydrophobicContact CG-CZ3 4.4Å
376	Q	86.6	Confident	81.8	Confident	139 Å²	139	65.3 Å²	65.3	65%	0.65	31%	0.309	S	S	*	.	H	α-helix	trans	-73	-40.1	177.6	-168.3	-175.7	27.2	0	0	112.5	E372 Y373 L374 A379	E372-Q376 WeakPolarHBondContact O-CB 3.25Å; E372-Q376 PolarHBondContact O-N 3.38Å; Y373-Q376 PolarHBondContact O-N 2.99Å; L374-Q376 VanDerWaalsContact C-N 3.26Å; L374-Q376 PolarHBondContact O-N 3.18Å; Q376-A379 WeakPolarHBondContact O-CB 3.47Å
377	K	87	Confident	80.9	Confident	98 Å²	98	69.1 Å²	69.1	43%	0.426	33%	0.325	S	S	.	.	H	α-helix	trans	-69.7	-34.9	176.7	-83.1	-162.8	155.7	-176.5	0	113.2	Y353 Y373 L374	Y353-K377 WeakPolarHBondContact CE2-O 3.48Å; Y353-K377 PolarHBondContact OH-O 3.01Å; Y373-K377 HydrophobicContact CE1-CD 4.16Å; Y373-K377 HydrophobicContact CE2-CD 3.9Å; Y373-K377 HydrophobicContact CE2-CG 4.21Å; Y373-K377 WeakPolarHBondContact O-CB 3.37Å; Y373-K377 PolarHBondContact O-N 2.75Å; Y373-K377 WeakPolarHBondContact OH-CE 3.3Å; Y373-K377 PolarHBondContact OH-NZ 3.12Å; L374-K377 PolarHBondContact O-N 3.29Å
378	W	88.5	Confident	80	Confident	3 Å²	3	70.9 Å²	70.9	1%	0.011	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	20.1	176.9	-61	-35.1	0	0	0	113.5	V348 L351 Y353 L357 L374 K375 L415 Y635 W637	V348-W378 HydrophobicContact CB-CZ2 4.44Å; V348-W378 HydrophobicContact CG1-CD2 4.46Å; V348-W378 HydrophobicContact CG1-CZ2 3.77Å; V348-W378 HydrophobicContact CG2-CD2 3.81Å; V348-W378 HydrophobicContact CG2-CE3 4.15Å; V348-W378 HydrophobicContact CG2-CG 4.21Å; V348-W378 HydrophobicContact CG2-CH2 4.12Å; V348-W378 HydrophobicContact CG2-CZ2 3.8Å; V348-W378 HydrophobicContact CG2-CZ3 4.3Å; L351-W378 HydrophobicContact CD1-CB 4.13Å; L351-W378 VanDerWaalsContact CD1-O 3.29Å; L351-W378 WeakPolarHBondContact CD1-O 3.43Å; Y353-W378 AromaticContact CD2-CD1 3.69Å; Y353-W378 AromaticContact CG-CD1 3.97Å; L357-W378 HydrophobicContact CD1-CH2 3.66Å; L357-W378 HydrophobicContact CD1-CZ2 3.37Å; L357-W378 HydrophobicContact CD2-CH2 4.41Å; L357-W378 HydrophobicContact CD2-CZ2 3.6Å; L357-W378 HydrophobicContact CG-CZ2 4.05Å; L374-W378 HydrophobicContact CB-CE3 3.92Å; L374-W378 HydrophobicContact CB-CZ3 4.01Å; L374-W378 HydrophobicContact CD1-CZ3 4.42Å; L374-W378 HydrophobicContact CD2-CE3 4.36Å; L374-W378 HydrophobicContact CD2-CH2 4.06Å; L374-W378 HydrophobicContact CD2-CZ2 4.37Å; L374-W378 HydrophobicContact CD2-CZ3 4.03Å; L374-W378 HydrophobicContact CG-CZ3 4.38Å; L374-W378 WeakPolarHBondContact O-CB 3.45Å; L374-W378 PolarHBondContact O-N 3Å; K375-W378 CarbonylContact O-C 3.55Å; W378-L415 HydrophobicContact CE3-CD2 4.1Å; W378-L415 HydrophobicContact CZ3-CD1 4.27Å; W378-L415 HydrophobicContact CZ3-CD2 4.07Å; W378-Y635 AromaticContact CH2-CD1 3.9Å; W378-Y635 HydrophobicContact CH2-CD1 3.9Å; W378-Y635 AromaticContact CH2-CD2 3.96Å; W378-Y635 HydrophobicContact CH2-CD2 3.96Å; W378-Y635 AromaticContact CH2-CE1 3.62Å; W378-Y635 HydrophobicContact CH2-CE1 3.62Å; W378-Y635 AromaticContact CH2-CE2 3.7Å; W378-Y635 HydrophobicContact CH2-CE2 3.7Å; W378-Y635 HydrophobicContact CH2-CG 4.07Å; W378-Y635 AromaticContact CH2-CZ 3.53Å; W378-Y635 HydrophobicContact CZ2-CE1 4.34Å; W378-Y635 HydrophobicContact CZ3-CD1 4.47Å; W378-Y635 AromaticContact CZ3-CD2 3.87Å; W378-Y635 HydrophobicContact CZ3-CD2 3.87Å; W378-Y635 HydrophobicContact CZ3-CE1 4.47Å; W378-Y635 AromaticContact CZ3-CE2 3.89Å; W378-Y635 HydrophobicContact CZ3-CE2 3.89Å; W378-Y635 HydrophobicContact CZ3-CG 4.18Å; W378-W637 HydrophobicContact CB-CH2 4.46Å; W378-W637 HydrophobicContact CB-CZ2 3.79Å; W378-W637 HydrophobicContact CD2-CZ2 4.45Å; W378-W637 AromaticContact CE3-CZ2 3.82Å; W378-W637 HydrophobicContact CE3-CZ2 3.82Å
379	A	79	Confident	79.3	Confident	24 Å²	24	74.2 Å²	74.2	20%	0.198	35%	0.354	C	S	.	.	S	Bend	trans	-63.5	134.7	162.8	0	0	0	0	0	108.1	K375 Q376 Q381 R384	K375-A379 PolarHBondContact O-N 3.43Å; Q376-A379 WeakPolarHBondContact O-CB 3.47Å; A379-Q381 PolarHBondContact O-N 3.44Å; A379-R384 HydrophobicContact CB-CG 3.89Å
380	Y	69.3	Low	78.6	Confident	71 Å²	71	76.7 Å²	76.7	28%	0.278	36%	0.362	S	S	.	.			trans	-54.7	137.1	172.4	-89.8	-101.1	0	0	0	109.1	S350 L351 D382 Q383 R384	S350-Y380 PolarHBondContact OG-OH 2.63Å; L351-Y380 HydrophobicContact CD2-CD1 3.62Å; L351-Y380 HydrophobicContact CD2-CD2 4Å; L351-Y380 HydrophobicContact CD2-CE1 3.72Å; L351-Y380 HydrophobicContact CD2-CE2 4.11Å; L351-Y380 HydrophobicContact CD2-CG 3.74Å; Y380-D382 PolarHBondContact O-N 2.76Å; Y380-Q383 WeakPolarHBondContact O-CA 3.43Å; Y380-Q383 WeakPolarHBondContact O-CB 3.3Å; Y380-Q383 PolarHBondContact O-N 3.17Å; Y380-R384 PolarHBondContact O-N 3.26Å
381	Q	61.9	Low	78	Confident	109 Å²	109	81.9 Å²	81.9	51%	0.509	39%	0.386	S	S	.	.	H	α-helix	trans	-57.7	-36.5	176.5	-176.3	62.8	7.2	0	0	110.1	A379 Q383 R384 I385	A379-Q381 PolarHBondContact O-N 3.44Å; Q381-Q383 PolarHBondContact O-N 2.96Å; Q381-R384 WeakPolarHBondContact O-CB 3.49Å; Q381-R384 PolarHBondContact O-N 3.34Å; Q381-R384 VanDerWaalsContact O-N 3.17Å; Q381-I385 HydrophobicContact CG-CD1 4.05Å; Q381-I385 VanDerWaalsContact O-CG1 3.29Å; Q381-I385 WeakPolarHBondContact O-CG1 3.39Å; Q381-I385 PolarHBondContact O-N 3.37Å
382	D	56.9	Low	77.2	Confident	111 Å²	111	87.7 Å²	87.7	59%	0.594	41%	0.407	S	S	*	.	H	α-helix	trans	-66.3	-33.2	173.8	-46.2	-49.6	0	0	0	113	Y380 I385 L386	Y380-D382 PolarHBondContact O-N 2.76Å; D382-I385 PolarHBondContact O-N 3.47Å; D382-L386 WeakPolarHBondContact O-CB 3.48Å; D382-L386 PolarHBondContact O-N 3.22Å
383	Q	67.5	Low	76.6	Confident	91 Å²	91	88.7 Å²	88.7	43%	0.425	41%	0.412	S	S	.	.	H	α-helix	trans	-71.4	-32.3	172	-76.7	-179.1	-26.5	0	0	112	Y380 Q381 K387	Y380-Q383 WeakPolarHBondContact O-CA 3.43Å; Y380-Q383 WeakPolarHBondContact O-CB 3.3Å; Y380-Q383 PolarHBondContact O-N 3.17Å; Q381-Q383 PolarHBondContact O-N 2.96Å; Q383-K387 VanDerWaalsContact O-CB 3.24Å; Q383-K387 WeakPolarHBondContact O-CB 3.37Å; Q383-K387 PolarHBondContact O-N 3.01Å
384	R	67.1	Low	75.8	Confident	138 Å²	138	88.1 Å²	88.1	52%	0.521	43%	0.427	S	S	.	.	H	α-helix	trans	-70.7	-39.9	172.8	-63.9	-179.1	65.9	-165.1	-0.1	111.5	A379 Y380 Q381 S388	A379-R384 HydrophobicContact CB-CG 3.89Å; Y380-R384 PolarHBondContact O-N 3.26Å; Q381-R384 WeakPolarHBondContact O-CB 3.49Å; Q381-R384 PolarHBondContact O-N 3.34Å; Q381-R384 VanDerWaalsContact O-N 3.17Å; R384-S388 VanDerWaalsContact O-CB 3.29Å; R384-S388 WeakPolarHBondContact O-CB 3.48Å; R384-S388 PolarHBondContact O-N 2.95Å
385	I	69.9	Low	74.9	Confident	83 Å²	83	95 Å²	95	43%	0.426	46%	0.463	S	S	.	.	H	α-helix	trans	-65.4	-50.5	173.6	-68.6	164	0	0	0	110	Q381 D382 K387 S388 L389	Q381-I385 HydrophobicContact CG-CD1 4.05Å; Q381-I385 VanDerWaalsContact O-CG1 3.29Å; Q381-I385 WeakPolarHBondContact O-CG1 3.39Å; Q381-I385 PolarHBondContact O-N 3.37Å; D382-I385 PolarHBondContact O-N 3.47Å; I385-K387 PolarHBondContact O-N 2.97Å; I385-S388 CarbonylContact O-C 3.53Å; I385-S388 WeakPolarHBondContact O-CA 3.06Å; I385-S388 WeakPolarHBondContact O-CB 3.42Å; I385-S388 PolarHBondContact O-N 2.62Å; I385-S388 VanDerWaalsContact O-N 3.09Å; I385-L389 HydrophobicContact CG2-CD1 3.87Å; I385-L389 HydrophobicContact CG2-CG 4.35Å; I385-L389 WeakPolarHBondContact O-CG 3.32Å; I385-L389 PolarHBondContact O-N 3.33Å
386	L	71.6	Confident	73.8	Confident	98 Å²	98	99.2 Å²	99.2	51%	0.513	48%	0.484	S	S	.	.	H	α-helix	trans	-60.6	-43.3	178.5	-179.1	63.3	0	0	0	112	D382 S388 L389 M390	D382-L386 WeakPolarHBondContact O-CB 3.48Å; D382-L386 PolarHBondContact O-N 3.22Å; L386-S388 VanDerWaalsContact C-N 3.32Å; L386-S388 PolarHBondContact O-N 2.66Å; L386-L389 PolarHBondContact O-N 3.4Å; L386-M390 WeakPolarHBondContact O-CB 3.48Å; L386-M390 PolarHBondContact O-N 3.15Å
387	K	72.3	Confident	72.5	Confident	151 Å²	151	96.5 Å²	96.5	66%	0.657	49%	0.493	S	S	*	.	H	α-helix	trans	-62.3	-40.8	173.6	-176.3	171.9	179.5	176	0	111.5	Q383 I385 L389 M390 E391	Q383-K387 VanDerWaalsContact O-CB 3.24Å; Q383-K387 WeakPolarHBondContact O-CB 3.37Å; Q383-K387 PolarHBondContact O-N 3.01Å; I385-K387 PolarHBondContact O-N 2.97Å; K387-L389 VanDerWaalsContact C-N 3.35Å; K387-M390 PolarHBondContact O-N 3.4Å; K387-E391 WeakPolarHBondContact O-CB 3.2Å; K387-E391 PolarHBondContact O-N 3.22Å
388	S	74.1	Confident	70.7	Confident	36 Å²	36	94.6 Å²	94.6	25%	0.252	50%	0.502	S	S	.	.	H	α-helix	trans	-67.7	-32.5	175.9	-179.9	0	0	0	0	112.7	R384 I385 L386 R392	R384-S388 VanDerWaalsContact O-CB 3.29Å; R384-S388 WeakPolarHBondContact O-CB 3.48Å; R384-S388 PolarHBondContact O-N 2.95Å; I385-S388 CarbonylContact O-C 3.53Å; I385-S388 WeakPolarHBondContact O-CA 3.06Å; I385-S388 WeakPolarHBondContact O-CB 3.42Å; I385-S388 PolarHBondContact O-N 2.62Å; I385-S388 VanDerWaalsContact O-N 3.09Å; L386-S388 VanDerWaalsContact C-N 3.32Å; L386-S388 PolarHBondContact O-N 2.66Å; S388-R392 WeakPolarHBondContact O-CG 2.88Å; S388-R392 PolarHBondContact O-N 3.17Å; S388-R392 VanDerWaalsContact O-N 3.16Å; S388-R392 PolarHBondContact O-NH1 3.36Å; S388-R392 PolarHBondContact OG-NH1 2.96Å; S388-R392 PolarHBondContact OG-NH2 3.06Å
389	L	77.8	Confident	68.9	Low	77 Å²	77	100.8 Å²	100.8	40%	0.403	55%	0.545	S	S	.	.	H	α-helix	trans	-68.9	-50.5	172.9	-72.5	167.9	0	0	0	110.4	I385 L386 K387 E391 R392 E393	I385-L389 HydrophobicContact CG2-CD1 3.87Å; I385-L389 HydrophobicContact CG2-CG 4.35Å; I385-L389 WeakPolarHBondContact O-CG 3.32Å; I385-L389 PolarHBondContact O-N 3.33Å; L386-L389 PolarHBondContact O-N 3.4Å; K387-L389 VanDerWaalsContact C-N 3.35Å; L389-E391 PolarHBondContact O-N 3.46Å; L389-R392 CarbonylContact O-C 3.38Å; L389-R392 WeakPolarHBondContact O-CA 3.36Å; L389-R392 WeakPolarHBondContact O-CB 3.4Å; L389-R392 PolarHBondContact O-N 3.41Å; L389-E393 WeakPolarHBondContact O-CG 3.38Å; L389-E393 PolarHBondContact O-N 2.92Å
390	M	76	Confident	67.1	Low	113 Å²	113	104.3 Å²	104.3	56%	0.557	57%	0.569	S	S	*	*	H	α-helix	trans	-59.2	-32.8	174.9	-169.5	-178.4	-175.4	0	0	112.7	L386 K387 E393 A394	L386-M390 WeakPolarHBondContact O-CB 3.48Å; L386-M390 PolarHBondContact O-N 3.15Å; K387-M390 PolarHBondContact O-N 3.4Å; M390-E393 PolarHBondContact O-N 3.2Å; M390-A394 VanDerWaalsContact O-CB 3.29Å; M390-A394 WeakPolarHBondContact O-CB 3.4Å; M390-A394 PolarHBondContact O-N 3.45Å
391	E	79.8	Confident	65.9	Low	118 Å²	118	107.4 Å²	107.4	55%	0.551	60%	0.601	S	S	*	*	H	α-helix	trans	-71.1	-29.8	173.4	-174.8	169.9	-151.8	0	0	112.5	K387 L389 L395	K387-E391 WeakPolarHBondContact O-CB 3.2Å; K387-E391 PolarHBondContact O-N 3.22Å; L389-E391 PolarHBondContact O-N 3.46Å; E391-L395 WeakPolarHBondContact O-CD1 3.44Å; E391-L395 VanDerWaalsContact O-CG 3.29Å; E391-L395 WeakPolarHBondContact O-CG 3.17Å; E391-L395 PolarHBondContact O-N 3.23Å
392	R	76.3	Confident	65	Low	122 Å²	122	106.8 Å²	106.8	46%	0.46	61%	0.608	S	S	.	*	H	α-helix	trans	-74.3	-45.3	167.6	-69	-179.2	-159.4	79.7	5.5	111.6	S388 L389 A394 L395 E396	S388-R392 WeakPolarHBondContact O-CG 2.88Å; S388-R392 PolarHBondContact O-N 3.17Å; S388-R392 VanDerWaalsContact O-N 3.16Å; S388-R392 PolarHBondContact O-NH1 3.36Å; S388-R392 PolarHBondContact OG-NH1 2.96Å; S388-R392 PolarHBondContact OG-NH2 3.06Å; L389-R392 CarbonylContact O-C 3.38Å; L389-R392 WeakPolarHBondContact O-CA 3.36Å; L389-R392 WeakPolarHBondContact O-CB 3.4Å; L389-R392 PolarHBondContact O-N 3.41Å; R392-A394 PolarHBondContact O-N 3.31Å; R392-L395 CarbonylContact O-C 3.57Å; R392-L395 WeakPolarHBondContact O-CA 3.47Å; R392-L395 PolarHBondContact O-N 3.05Å; R392-E396 WeakPolarHBondContact O-CB 3.47Å; R392-E396 PolarHBondContact O-N 2.7Å
393	E	78.1	Confident	64.2	Low	126 Å²	126	105.5 Å²	105.5	59%	0.589	61%	0.608	S	S	*	*	H	α-helix	trans	-60.3	-25.8	176.3	-67.3	164.3	-178.4	0	0	112.4	L389 M390 E396	L389-E393 WeakPolarHBondContact O-CG 3.38Å; L389-E393 PolarHBondContact O-N 2.92Å; M390-E393 PolarHBondContact O-N 3.2Å; E393-E396 VanDerWaalsContact O-O 3.1Å
394	A	73.9	Confident	63.3	Low	84 Å²	84	104.9 Å²	104.9	69%	0.694	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-15.9	172.7	0	0	0	0	0	114.3	M390 R392	M390-A394 VanDerWaalsContact O-CB 3.29Å; M390-A394 WeakPolarHBondContact O-CB 3.4Å; M390-A394 PolarHBondContact O-N 3.45Å; R392-A394 PolarHBondContact O-N 3.31Å
395	L	71.5	Confident	62.2	Low	146 Å²	146	103.8 Å²	103.8	76%	0.764	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-38.1	176	-71.4	167.6	0	0	0	111.5	E391 R392 G397	E391-L395 WeakPolarHBondContact O-CD1 3.44Å; E391-L395 VanDerWaalsContact O-CG 3.29Å; E391-L395 WeakPolarHBondContact O-CG 3.17Å; E391-L395 PolarHBondContact O-N 3.23Å; R392-L395 CarbonylContact O-C 3.57Å; R392-L395 WeakPolarHBondContact O-CA 3.47Å; R392-L395 PolarHBondContact O-N 3.05Å; L395-G397 PolarHBondContact O-N 2.89Å
396	E	64.4	Low	60.7	Low	145 Å²	145	104.8 Å²	104.8	68%	0.678	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	82.1	169.1	-66.8	176.4	-165.9	0	0	108.4	R392 E393 G398	R392-E396 WeakPolarHBondContact O-CB 3.47Å; R392-E396 PolarHBondContact O-N 2.7Å; E393-E396 VanDerWaalsContact O-O 3.1Å; E396-G398 PolarHBondContact O-N 2.71Å
397	G	60.1	Low	59.3	Low	82 Å²	82	110.1 Å²	110.1	85%	0.845	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	67.5	-172	0	0	0	0	0	115.9	L395	L395-G397 PolarHBondContact O-N 2.89Å
398	G	48.4	Very low	57.6	Low	59 Å²	59	108 Å²	108	61%	0.608	64%	0.639	S	S	*	*			trans	-95.4	122.4	-179.4	0	0	0	0	0	112.5	E396 S400	E396-G398 PolarHBondContact O-N 2.71Å; G398-S400 PolarHBondContact O-N 3.34Å
399	S	51	Low	56	Low	132 Å²	132	114.9 Å²	114.9	92%	0.923	67%	0.665	S	S	*	*			trans	-75.7	88.7	177.4	56.6	0	0	0	0	112.1
400	S	40.8	Very low	54.4	Low	99 Å²	99	114.5 Å²	114.5	69%	0.692	67%	0.673	S	S	*	*			trans	-116.6	107.4	168.9	61.8	0	0	0	0	111.6	G398 S402	G398-S400 PolarHBondContact O-N 3.34Å; S400-S402 PolarHBondContact O-N 3.03Å
401	S	44.4	Very low	53.3	Low	136 Å²	136	115.3 Å²	115.3	95%	0.951	68%	0.675	S	S	*	*			trans	-80.9	71.2	-172.4	58.5	0	0	0	0	113.7
402	S	42.8	Very low	52.6	Low	96 Å²	96	116.3 Å²	116.3	67%	0.671	68%	0.68	S	S	*	*			trans	-110.5	125.1	166.8	63.3	0	0	0	0	111	S400	S400-S402 PolarHBondContact O-N 3.03Å
403	S	40.5	Very low	52.8	Low	84 Å²	84	111.5 Å²	111.5	59%	0.587	66%	0.663	S	S	*	*			trans	-56.5	127.1	-178.1	164.6	0	0	0	0	112.2	D405	S403-D405 VanDerWaalsContact C-N 3.32Å; S403-D405 PolarHBondContact OG-N 2.78Å; S403-D405 PolarHBondContact OG-OD2 3.46Å
404	P	49.1	Very low	53.3	Low	77 Å²	77	106.7 Å²	106.7	50%	0.5	64%	0.64	S	S	.	*	S	Bend	trans	-76.9	-17	179.1	31.7	-35.4	0	0	0	113.4	S406 N408	P404-S406 PolarHBondContact O-N 2.82Å; P404-N408 PolarHBondContact O-ND2 3.19Å
405	D	42.7	Very low	54.1	Low	116 Å²	116	102.7 Å²	102.7	62%	0.62	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-28.7	-167	-54.3	-68.8	0	0	0	113.7	S403	S403-D405 VanDerWaalsContact C-N 3.32Å; S403-D405 PolarHBondContact OG-N 2.78Å; S403-D405 PolarHBondContact OG-OD2 3.46Å
406	S	40.2	Very low	55.1	Low	103 Å²	103	96 Å²	96	72%	0.72	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-39.3	-177.6	-169.9	0	0	0	0	112.6	P404	P404-S406 PolarHBondContact O-N 2.82Å
407	R	40.3	Very low	56.5	Low	210 Å²	210	89 Å²	89	79%	0.792	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-84.1	-19.9	-175.2	-166.2	168.8	-73	164.1	-1.3	113.7	K409	R407-K409 PolarHBondContact O-N 2.81Å
408	N	38.5	Very low	58	Low	106 Å²	106	85.2 Å²	85.2	57%	0.567	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-74.2	-5.7	178.1	-83.2	-68.6	0	0	0	114.6	P404 A410	P404-N408 PolarHBondContact O-ND2 3.19Å; N408-A410 PolarHBondContact O-N 3.25Å; N408-A410 VanDerWaalsContact O-N 3.1Å
409	K	40.3	Very low	60	Low	182 Å²	182	82.7 Å²	82.7	79%	0.791	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-74.9	16.4	171.6	-71.2	-173.5	177.1	178.9	0	114.5	R407 Q411	R407-K409 PolarHBondContact O-N 2.81Å; K409-Q411 PolarHBondContact O-N 2.91Å
410	A	43.6	Very low	61.7	Low	69 Å²	69	76.6 Å²	76.6	57%	0.57	43%	0.431	S	S	*	.	S	Bend	trans	-71.4	69.2	171.9	0	0	0	0	0	112	N408 Q412	N408-A410 PolarHBondContact O-N 3.25Å; N408-A410 VanDerWaalsContact O-N 3.1Å; A410-Q412 PolarHBondContact O-N 3.12Å
411	Q	53.2	Low	63.6	Low	130 Å²	130	78.5 Å²	78.5	61%	0.607	43%	0.428	S	S	*	.			trans	24.7	87.5	175.1	-65.4	-173.8	2.9	0	0	114.6	K409 Q413	K409-Q411 PolarHBondContact O-N 2.91Å; Q411-Q413 HydrophobicContact CB-CG 4.34Å; Q411-Q413 PolarHBondContact O-N 3.45Å
412	Q	64.6	Low	65.1	Low	139 Å²	139	77 Å²	77	65%	0.65	42%	0.418	S	S	*	.			trans	-58.5	113.5	161.8	-67	-173.7	5.3	0	0	107.4	A410 T640	A410-Q412 PolarHBondContact O-N 3.12Å; Q412-T640 VanDerWaalsContact O-CB 3.3Å; Q412-T640 WeakPolarHBondContact O-CB 3.34Å; Q412-T640 PolarHBondContact O-N 3.28Å; Q412-T640 PolarHBondContact O-OG1 3.12Å; Q412-T640 VanDerWaalsContact O-OG1 3.09Å
413	Q	81.2	Confident	67	Low	20 Å²	20	73.6 Å²	73.6	9%	0.093	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	119	175.4	-69.5	-176.5	2.8	0	0	107.9	H343 Q411 W637 Q638	H343-Q413 PolarHBondContact NE2-NE2 3.33Å; H343-Q413 PolarHBondContact NE2-OE1 2.85Å; Q411-Q413 HydrophobicContact CB-CG 4.34Å; Q411-Q413 PolarHBondContact O-N 3.45Å; Q413-W637 HydrophobicContact CB-CE3 3.85Å; Q413-Q638 CarbonylContact C-O 3.54Å; Q413-Q638 VanDerWaalsContact CA-O 3.23Å; Q413-Q638 WeakPolarHBondContact CA-O 3.4Å
414	E	88.4	Confident	69	Low	25 Å²	25	75.1 Å²	75.1	12%	0.117	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	135.2	171.4	-166.6	72.5	-101.9	0	0	107.5	K375 T416 R611 W637 Q638 T640	K375-E414 IonicContact NZ-OE1 2.64Å; K375-E414 PolarHBondContact NZ-OE1 3.5Å; E414-T416 HydrophobicContact CG-CG2 4.3Å; E414-R611 IonicContact OE2-CZ 3.15Å; E414-R611 IonicContact OE2-NE 3.23Å; E414-R611 PolarHBondContact OE2-NE 2.98Å; E414-R611 IonicContact OE2-NH2 3.23Å; E414-W637 WeakPolarHBondContact O-CA 3.31Å; E414-Q638 PolarHBondContact N-O 2.89Å; E414-Q638 PolarHBondContact O-N 2.81Å; E414-T640 PolarHBondContact N-OG1 3.08Å
415	L	90.8	Very high	70.7	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	115.9	170.2	175.9	64.4	0	0	0	106.5	I371 L374 K375 W378 Y635 E636 W637	I371-L415 HydrophobicContact CG2-CB 4.16Å; I371-L415 HydrophobicContact CG2-CD2 4.29Å; I371-L415 HydrophobicContact CG2-CG 4.26Å; I371-L415 VanDerWaalsContact CG2-O 3.28Å; I371-L415 WeakPolarHBondContact CG2-O 3.41Å; L374-L415 HydrophobicContact CB-CD2 3.51Å; L374-L415 HydrophobicContact CD1-CD2 4.33Å; K375-L415 HydrophobicContact CD-CB 4.33Å; K375-L415 HydrophobicContact CG-CB 3.78Å; K375-L415 HydrophobicContact CG-CD2 3.99Å; W378-L415 HydrophobicContact CE3-CD2 4.1Å; W378-L415 HydrophobicContact CZ3-CD1 4.27Å; W378-L415 HydrophobicContact CZ3-CD2 4.07Å; L415-Y635 HydrophobicContact CD1-CD2 3.91Å; L415-Y635 HydrophobicContact CD1-CG 4.4Å; L415-E636 WeakPolarHBondContact CA-O 3.37Å; L415-E636 WeakPolarHBondContact CD1-O 3.45Å; L415-W637 HydrophobicContact CB-CD2 4.37Å; L415-W637 HydrophobicContact CB-CE3 4.07Å; L415-W637 HydrophobicContact CB-CH2 4.3Å; L415-W637 HydrophobicContact CB-CZ3 4.04Å; L415-W637 HydrophobicContact CD1-CD2 4.07Å; L415-W637 HydrophobicContact CD1-CG 4.33Å; L415-W637 HydrophobicContact CD1-CZ2 4.35Å; L415-W637 HydrophobicContact CD2-CZ2 4.34Å
416	T	92	Very high	72.7	Confident	5 Å²	5	70.5 Å²	70.5	3%	0.031	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	147.2	173.8	48.7	0	0	0	0	110	E414 F418 W608 Y635 E636	E414-T416 HydrophobicContact CG-CG2 4.3Å; T416-F418 VanDerWaalsContact OG1-CE2 3.32Å; T416-F418 WeakPolarHBondContact OG1-CE2 3.19Å; T416-W608 WeakPolarHBondContact CA-O 3.35Å; T416-Y635 WeakPolarHBondContact O-CA 3.21Å; T416-E636 PolarHBondContact N-O 3.11Å; T416-E636 PolarHBondContact O-N 3.1Å; T416-E636 PolarHBondContact OG1-O 3.19Å
417	L	92.8	Very high	74.6	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	144.3	170	-62.2	178.6	0	0	0	109.8	L337 V367 L370 I371 L374 G607 W608 E634	L337-L417 HydrophobicContact CD2-CD2 3.72Å; V367-L417 HydrophobicContact CG1-CD1 4.3Å; L370-L417 HydrophobicContact CD2-CD1 4.16Å; L370-L417 HydrophobicContact CG-CD1 4.42Å; I371-L417 HydrophobicContact CD1-CD1 4.24Å; I371-L417 HydrophobicContact CD1-CG 4.3Å; I371-L417 HydrophobicContact CG1-CD1 3.59Å; I371-L417 HydrophobicContact CG1-CG 3.83Å; L374-L417 HydrophobicContact CD1-CD2 4.23Å; L417-G607 CarbonylContact O-C 3.59Å; L417-G607 WeakPolarHBondContact O-CA 3.24Å; L417-W608 HydrophobicContact CB-CB 4.39Å; L417-W608 HydrophobicContact CB-CE3 4.34Å; L417-W608 PolarHBondContact N-O 3.36Å; L417-W608 PolarHBondContact O-N 2.9Å; L417-E634 CarbonylContact C-O 3.57Å; L417-E634 VanDerWaalsContact CA-O 3.31Å; L417-E634 WeakPolarHBondContact CA-O 3.44Å
418	F	92.1	Very high	76.4	Confident	1 Å²	1	62.4 Å²	62.4	0%	0.004	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	153.7	-179.8	-69.3	-78	0	0	0	111.2	T416 E605 E606 L633 E634 E636	T416-F418 VanDerWaalsContact OG1-CE2 3.32Å; T416-F418 WeakPolarHBondContact OG1-CE2 3.19Å; F418-E605 WeakPolarHBondContact CE1-O 3.5Å; F418-E606 VanDerWaalsContact CE1-C 3.47Å; F418-E606 WeakPolarHBondContact CE1-O 3.31Å; F418-L633 WeakPolarHBondContact O-CA 3.37Å; F418-L633 WeakPolarHBondContact O-CD2 3.41Å; F418-E634 HydrophobicContact CB-CB 4.21Å; F418-E634 PolarHBondContact N-O 3.06Å; F418-E634 PolarHBondContact O-N 3.14Å; F418-E636 HydrophobicContact CD2-CB 4.39Å; F418-E636 HydrophobicContact CE2-CB 3.89Å
419	P	91.1	Very high	77.9	Confident	7 Å²	7	61 Å²	61	5%	0.045	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	141.9	161.4	29.6	-35.5	0	0	0	109.5	L425 R604 W608 F625	P419-L425 HydrophobicContact CB-CD1 3.71Å; P419-L425 HydrophobicContact CB-CG 4.17Å; P419-L425 HydrophobicContact CG-CD1 3.73Å; P419-R604 HydrophobicContact CG-CB 4.43Å; P419-R604 HydrophobicContact CG-CG 3.78Å; P419-W608 HydrophobicContact CB-CH2 4.35Å; P419-W608 HydrophobicContact CB-CZ3 4.43Å; P419-F625 HydrophobicContact CB-CE1 3.76Å; P419-F625 HydrophobicContact CB-CZ 3.79Å
420	A	87.4	Confident	79.6	Confident	4 Å²	4	53.2 Å²	53.2	3%	0.033	31%	0.31	C	S	.	.			trans	-62.9	145.3	176.1	0	0	0	0	0	111.1	S422 S423 Q632 E634	A420-S422 PolarHBondContact O-N 2.86Å; A420-S422 VanDerWaalsContact O-N 3.1Å; A420-S423 PolarHBondContact N-OG 3.42Å; A420-S423 WeakPolarHBondContact O-CB 3.21Å; A420-S423 PolarHBondContact O-N 3.15Å; A420-S423 PolarHBondContact O-OG 3.39Å; A420-Q632 HydrophobicContact CB-CB 4.07Å; A420-E634 VanDerWaalsContact CA-OE1 3.22Å; A420-E634 WeakPolarHBondContact CA-OE1 3.43Å; A420-E634 HydrophobicContact CB-CG 4.44Å
421	E	80.7	Confident	81.2	Confident	138 Å²	138	51.8 Å²	51.8	65%	0.645	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-32.7	-173.3	-65.3	-167.1	151	0	0	113.5	S423 R604 E634	E421-S423 VanDerWaalsContact C-N 3.33Å; E421-S423 PolarHBondContact O-N 2.89Å; E421-R604 PolarHBondContact O-NH2 3Å; E421-E634 PolarHBondContact N-OE1 3.48Å
422	S	75.6	Confident	82.2	Confident	106 Å²	106	48.3 Å²	48.3	74%	0.741	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-0.3	176.8	58.4	0	0	0	0	115.4	A420	A420-S422 PolarHBondContact O-N 2.86Å; A420-S422 VanDerWaalsContact O-N 3.1Å
423	S	82.3	Confident	82.8	Confident	23 Å²	23	49.3 Å²	49.3	16%	0.161	29%	0.286	C	S	.	.			trans	-91.5	135	-175.4	67.2	0	0	0	0	112.9	A420 E421 F625	A420-S423 PolarHBondContact N-OG 3.42Å; A420-S423 WeakPolarHBondContact O-CB 3.21Å; A420-S423 PolarHBondContact O-N 3.15Å; A420-S423 PolarHBondContact O-OG 3.39Å; E421-S423 VanDerWaalsContact C-N 3.33Å; E421-S423 PolarHBondContact O-N 2.89Å; S423-F625 VanDerWaalsContact OG-CE1 3.29Å; S423-F625 WeakPolarHBondContact OG-CE1 3.49Å
424	T	82.8	Confident	82.9	Confident	117 Å²	117	49.8 Å²	49.8	72%	0.718	29%	0.29	S	S	*	.			trans	-82.1	129.5	168.3	43.6	0	0	0	0	109.7
425	L	84.8	Confident	82.6	Confident	25 Å²	25	51.3 Å²	51.3	13%	0.131	30%	0.301	C	S	.	.			trans	-110.3	131.4	172.9	-82.1	175.2	0	0	0	109.6	P419 V600 I603 R604 M624 F625	P419-L425 HydrophobicContact CB-CD1 3.71Å; P419-L425 HydrophobicContact CB-CG 4.17Å; P419-L425 HydrophobicContact CG-CD1 3.73Å; L425-V600 HydrophobicContact CB-CG1 3.55Å; L425-V600 HydrophobicContact CB-CG2 4.22Å; L425-V600 HydrophobicContact CD1-CG1 4.12Å; L425-I603 HydrophobicContact CD1-CG2 3.99Å; L425-R604 HydrophobicContact CD1-CG 3.95Å; L425-M624 WeakPolarHBondContact CA-O 3.45Å; L425-M624 HydrophobicContact CD2-CB 3.76Å; L425-M624 HydrophobicContact CD2-CE 4.06Å; L425-F625 HydrophobicContact CD2-CD1 3.63Å; L425-F625 HydrophobicContact CD2-CE1 3.32Å; L425-F625 HydrophobicContact CD2-CE2 4.39Å; L425-F625 HydrophobicContact CD2-CG 4.28Å; L425-F625 HydrophobicContact CD2-CZ 3.76Å; L425-F625 HydrophobicContact CG-CD1 4.23Å; L425-F625 HydrophobicContact CG-CE1 3.81Å
426	T	83.8	Confident	82.2	Confident	70 Å²	70	57.1 Å²	57.1	43%	0.429	33%	0.328	S	S	.	.			trans	-103.9	144.6	167.9	59.6	0	0	0	0	110.3	M624	T426-M624 PolarHBondContact N-O 3.3Å; T426-M624 PolarHBondContact OG1-O 2.86Å; T426-M624 VanDerWaalsContact OG1-O 3.13Å
427	T	79.9	Confident	81.7	Confident	106 Å²	106	59.7 Å²	59.7	65%	0.65	35%	0.346	S	S	*	.			trans	-61	145.1	160.5	44.9	0	0	0	0	109.5	V600	T427-V600 HydrophobicContact CG2-CG2 3.81Å
428	L	78	Confident	80.7	Confident	38 Å²	38	69.4 Å²	69.4	20%	0.199	39%	0.388	C	S	.	.			trans	-112	148.8	170	-62.4	-179.5	0	0	0	108.8	G430 W445 E620 L623 M624	L428-G430 PolarHBondContact O-N 3.26Å; L428-W445 HydrophobicContact CB-CZ3 4.28Å; L428-W445 HydrophobicContact CD2-CH2 4.34Å; L428-E620 HydrophobicContact CD1-CB 4.29Å; L428-E620 WeakPolarHBondContact CD1-O 3.35Å; L428-L623 HydrophobicContact CD1-CB 3.56Å; L428-L623 HydrophobicContact CD2-CB 3.85Å; L428-L623 HydrophobicContact CG-CB 4.36Å; L428-M624 HydrophobicContact CD1-CG 3.63Å; L428-M624 HydrophobicContact CG-CG 3.76Å
429	P	71.6	Confident	80	Confident	75 Å²	75	72.7 Å²	72.7	49%	0.487	42%	0.416	S	S	.	.			trans	-62.2	133.3	159.3	28.7	-31.7	0	0	0	108.4	V431 W445	P429-V431 PolarHBondContact O-N 3.46Å; P429-W445 HydrophobicContact CG-CD2 4.07Å; P429-W445 HydrophobicContact CG-CE3 3.84Å; P429-W445 HydrophobicContact CG-CH2 4.35Å; P429-W445 HydrophobicContact CG-CZ3 3.99Å; P429-W445 VanDerWaalsContact O-CE3 3.24Å; P429-W445 WeakPolarHBondContact O-CZ3 3.18Å
430	G	74.1	Confident	79.6	Confident	20 Å²	20	72.4 Å²	72.4	21%	0.206	41%	0.414	C	S	.	.			trans	-43.6	135.8	-175.6	0	0	0	0	0	114.4	L428 L446 E597	L428-G430 PolarHBondContact O-N 3.26Å; G430-L446 WeakPolarHBondContact O-CB 3.22Å; G430-L446 PolarHBondContact O-N 2.8Å; G430-E597 WeakPolarHBondContact CA-OE1 3.34Å; G430-E597 PolarHBondContact N-OE1 2.93Å
431	V	77.8	Confident	79.5	Confident	38 Å²	38	72.2 Å²	72.2	23%	0.23	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	123.5	-177.5	169.4	0	0	0	0	110.2	P429 V434 V443 W445 E620	P429-V431 PolarHBondContact O-N 3.46Å; V431-V434 HydrophobicContact CG1-CG2 3.9Å; V431-V443 HydrophobicContact CB-CG1 4.4Å; V431-V443 HydrophobicContact CG1-CG1 3.75Å; V431-V443 HydrophobicContact CG2-CG1 3.73Å; V431-W445 HydrophobicContact CG2-CE3 3.67Å; V431-W445 HydrophobicContact CG2-CZ3 3.55Å; V431-E620 HydrophobicContact CB-CG 3.88Å; V431-E620 HydrophobicContact CG1-CG 4.21Å; V431-E620 HydrophobicContact CG2-CG 3.64Å
432	A	75	Confident	79.7	Confident	58 Å²	58	66.8 Å²	66.8	48%	0.479	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	-36.7	177.9	0	0	0	0	0	112.8	H444 L446	A432-H444 PolarHBondContact N-O 3.46Å; A432-L446 HydrophobicContact CB-CB 4.27Å; A432-L446 HydrophobicContact CB-CD1 4.18Å
433	R	77.2	Confident	80.2	Confident	159 Å²	159	61.7 Å²	61.7	60%	0.6	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-168.7	153.6	172.6	58.1	-178	-176.4	-155.7	-3.3	113	V435 H444	R433-V435 HydrophobicContact CG-CG2 4.35Å; R433-H444 HydrophobicContact CG-CB 3.84Å; R433-H444 PolarHBondContact N-O 2.8Å; R433-H444 PolarHBondContact O-N 3.06Å
434	V	83.8	Confident	80.1	Confident	31 Å²	31	63.4 Å²	63.4	19%	0.188	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	116.9	169.2	-177	0	0	0	0	109.7	H364 V431 C441 V443 T617 A619	H364-V434 HydrophobicContact CB-CG1 4.42Å; V431-V434 HydrophobicContact CG1-CG2 3.9Å; V434-C441 HydrophobicContact CG1-CB 4.4Å; V434-V443 HydrophobicContact CG1-CG2 4.35Å; V434-V443 HydrophobicContact CG2-CG1 4.43Å; V434-V443 HydrophobicContact CG2-CG2 4.13Å; V434-T617 HydrophobicContact CG2-CG2 4.22Å; V434-T617 WeakPolarHBondContact CG2-OG1 3.34Å; V434-A619 HydrophobicContact CB-CB 4.46Å; V434-A619 HydrophobicContact CG1-CB 3.7Å; V434-A619 HydrophobicContact CG2-CB 3.98Å
435	V	80.9	Confident	80.1	Confident	57 Å²	57	60.6 Å²	60.6	35%	0.345	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.5	179.2	176.2	0	0	0	0	109.1	R433 T442	R433-V435 HydrophobicContact CG-CG2 4.35Å; V435-T442 PolarHBondContact N-O 3.39Å; V435-T442 PolarHBondContact O-N 2.86Å; V435-T442 PolarHBondContact O-OG1 3.48Å
436	H	83	Confident	79.7	Confident	122 Å²	122	64.9 Å²	64.9	57%	0.565	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90	146.8	172.7	78.3	-100	0	0	0	111.2	H364	H364-H436 HydrophobicContact CB-CB 4Å
437	S	80.9	Confident	78.9	Confident	58 Å²	58	70.2 Å²	70.2	41%	0.406	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	162.2	172.4	-173.2	0	0	0	0	109.7	A439 S440	S437-A439 PolarHBondContact O-N 3.2Å; S437-S440 CarbonylContact C-O 3.5Å; S437-S440 WeakPolarHBondContact CA-O 2.98Å; S437-S440 WeakPolarHBondContact CB-O 3.47Å; S437-S440 PolarHBondContact N-O 2.97Å; S437-S440 PolarHBondContact O-N 3.24Å; S437-S440 VanDerWaalsContact O-O 3.05Å
438	K	72.4	Confident	77.1	Confident	204 Å²	204	71.5 Å²	71.5	89%	0.887	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-16.6	-173.4	-173.5	169.9	178.9	-177.7	0	114.1
439	A	77	Confident	75.1	Confident	71 Å²	71	71.9 Å²	71.9	59%	0.587	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.1	14.5	-177.3	0	0	0	0	0	114.6	R328 S437	R328-A439 PolarHBondContact NH2-O 2.87Å; R328-A439 VanDerWaalsContact NH2-O 3.14Å; S437-A439 PolarHBondContact O-N 3.2Å
440	S	82.3	Confident	73.3	Confident	1 Å²	1	78.7 Å²	78.7	1%	0.007	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.8	158.7	179.1	55.7	0	0	0	0	111.9	R328 L329 S437	R328-S440 VanDerWaalsContact CZ-CB 3.45Å; R328-S440 PolarHBondContact NH1-OG 3.41Å; R328-S440 VanDerWaalsContact NH1-OG 3.14Å; R328-S440 PolarHBondContact NH2-OG 2.89Å; L329-S440 WeakPolarHBondContact O-CA 3.39Å; L329-S440 VanDerWaalsContact O-CB 3.27Å; L329-S440 WeakPolarHBondContact O-CB 3.48Å; S437-S440 CarbonylContact C-O 3.5Å; S437-S440 WeakPolarHBondContact CA-O 2.98Å; S437-S440 WeakPolarHBondContact CB-O 3.47Å; S437-S440 PolarHBondContact N-O 2.97Å; S437-S440 PolarHBondContact O-N 3.24Å; S437-S440 VanDerWaalsContact O-O 3.05Å
441	C	85.9	Confident	70.9	Confident	0 Å²	0	83 Å²	83	0%	0	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	153.5	153.1	-71.1	0	0	0	0	109.8	R328 L329 P330 L363 V434	R328-C441 CarbonylContact C-O 3.57Å; R328-C441 WeakPolarHBondContact CA-O 3.48Å; L329-C441 HydrophobicContact CB-CB 4.26Å; L329-C441 PolarHBondContact N-O 3.41Å; L329-C441 PolarHBondContact O-N 3.41Å; L329-C441 VanDerWaalsContact O-N 3.1Å; P330-C441 PolarHBondContact O-N 3.11Å; L363-C441 HydrophobicContact CB-CB 4.29Å; V434-C441 HydrophobicContact CG1-CB 4.4Å
442	T	84.8	Confident	68.6	Low	23 Å²	23	92.5 Å²	92.5	14%	0.141	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	120.1	176.8	40.9	0	0	0	0	109.6	V327 R328 V435	V327-T442 WeakPolarHBondContact O-CA 3.38Å; R328-T442 HydrophobicContact CB-CG2 4.3Å; R328-T442 HydrophobicContact CG-CG2 4.29Å; V435-T442 PolarHBondContact N-O 3.39Å; V435-T442 PolarHBondContact O-N 2.86Å; V435-T442 PolarHBondContact O-OG1 3.48Å
443	V	85.4	Confident	66.5	Low	0 Å²	0	95.8 Å²	95.8	0%	0	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	136	-177.8	-177.3	0	0	0	0	110	P326 V327 L329 V431 V434 W445 A619 L623	P326-V443 CarbonylContact C-O 3.56Å; P326-V443 VanDerWaalsContact CA-O 3.26Å; P326-V443 WeakPolarHBondContact CA-O 3.46Å; P326-V443 WeakPolarHBondContact CB-O 3.23Å; V327-V443 PolarHBondContact N-O 3.32Å; V327-V443 PolarHBondContact O-N 2.94Å; V327-V443 VanDerWaalsContact O-N 3.07Å; L329-V443 HydrophobicContact CD1-CG2 3.6Å; L329-V443 HydrophobicContact CG-CG2 4.2Å; V431-V443 HydrophobicContact CB-CG1 4.4Å; V431-V443 HydrophobicContact CG1-CG1 3.75Å; V431-V443 HydrophobicContact CG2-CG1 3.73Å; V434-V443 HydrophobicContact CG1-CG2 4.35Å; V434-V443 HydrophobicContact CG2-CG1 4.43Å; V434-V443 HydrophobicContact CG2-CG2 4.13Å; V443-W445 HydrophobicContact CG1-CE3 4.32Å; V443-W445 HydrophobicContact CG1-CZ3 4.32Å; V443-A619 HydrophobicContact CG2-CB 4.08Å; V443-L623 HydrophobicContact CB-CD1 4.13Å; V443-L623 HydrophobicContact CG1-CD1 4.05Å; V443-L623 HydrophobicContact CG2-CD1 3.77Å
444	H	80.9	Confident	64	Low	58 Å²	58	95.7 Å²	95.7	27%	0.269	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	120.5	171.4	-65.9	-95.7	0	0	0	109.2	A432 R433	A432-H444 PolarHBondContact N-O 3.46Å; R433-H444 HydrophobicContact CG-CB 3.84Å; R433-H444 PolarHBondContact N-O 2.8Å; R433-H444 PolarHBondContact O-N 3.06Å
445	W	81.9	Confident	61.6	Low	59 Å²	59	98.3 Å²	98.3	22%	0.223	54%	0.537	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	156	173.6	-53.2	128.6	0	0	0	112	V327 L428 P429 V431 V443 L623	V327-W445 HydrophobicContact CG2-CZ2 3.89Å; L428-W445 HydrophobicContact CB-CZ3 4.28Å; L428-W445 HydrophobicContact CD2-CH2 4.34Å; P429-W445 HydrophobicContact CG-CD2 4.07Å; P429-W445 HydrophobicContact CG-CE3 3.84Å; P429-W445 HydrophobicContact CG-CH2 4.35Å; P429-W445 HydrophobicContact CG-CZ3 3.99Å; P429-W445 VanDerWaalsContact O-CE3 3.24Å; P429-W445 WeakPolarHBondContact O-CZ3 3.18Å; V431-W445 HydrophobicContact CG2-CE3 3.67Å; V431-W445 HydrophobicContact CG2-CZ3 3.55Å; V443-W445 HydrophobicContact CG1-CE3 4.32Å; V443-W445 HydrophobicContact CG1-CZ3 4.32Å; W445-L623 HydrophobicContact CH2-CD1 3.81Å; W445-L623 HydrophobicContact CZ2-CD1 4.49Å; W445-L623 HydrophobicContact CZ3-CD1 4.38Å
446	L	77.7	Confident	59.6	Low	115 Å²	115	105.4 Å²	105.4	60%	0.602	56%	0.563	S	S	*	*			trans	-77.5	124	167.4	-172.4	65.3	0	0	0	108.7	G430 A432 S448	G430-L446 WeakPolarHBondContact O-CB 3.22Å; G430-L446 PolarHBondContact O-N 2.8Å; A432-L446 HydrophobicContact CB-CB 4.27Å; A432-L446 HydrophobicContact CB-CD1 4.18Å; L446-S448 PolarHBondContact O-N 2.99Å
447	E	66.7	Low	56.9	Low	181 Å²	181	108.8 Å²	108.8	85%	0.846	58%	0.579	S	S	*	*			trans	-69.4	103.8	-176.3	-169.9	175.9	173	0	0	109.9	G449	E447-G449 PolarHBondContact O-N 2.75Å
448	S	41.4	Very low	54.5	Low	134 Å²	134	113.9 Å²	113.9	94%	0.937	60%	0.601	S	S	*	*			trans	-75.1	62.3	-178.4	-164.2	0	0	0	0	111.9	L446	L446-S448 PolarHBondContact O-N 2.99Å
449	G	35.5	Very low	52.6	Low	45 Å²	45	109.4 Å²	109.4	46%	0.464	59%	0.593	S	S	.	*	S	Bend	trans	-138.8	125.5	180	0	0	0	0	0	110.1	E447 S451	E447-G449 PolarHBondContact O-N 2.75Å; G449-S451 PolarHBondContact O-N 3.21Å
450	K	33.8	Very low	50.3	Low	219 Å²	219	110.9 Å²	110.9	95%	0.952	61%	0.605	S	S	*	*			trans	-52.1	103	-176.3	-70.5	170.1	179.1	174.6	0	111.1	R452	K450-R452 PolarHBondContact O-N 3.44Å
451	S	25.6	Very low	47.9	Very low	110 Å²	110	116.7 Å²	116.7	77%	0.769	64%	0.64	S	S	*	*			trans	-72.1	111.9	-168.2	49.9	0	0	0	0	111.5	G449	G449-S451 PolarHBondContact O-N 3.21Å
452	R	29	Very low	45.3	Very low	237 Å²	237	124.9 Å²	124.9	89%	0.894	68%	0.678	S	S	*	*			trans	-70.4	127.9	155.9	-72.2	-175.6	171.2	-152.7	-6.1	107.2	K450 N454	K450-R452 PolarHBondContact O-N 3.44Å; R452-N454 PolarHBondContact O-N 3.36Å
453	P	30.9	Very low	42.9	Very low	127 Å²	127	131 Å²	131	83%	0.825	71%	0.709	S	S	*	*			trans	-65.1	112.4	-179.5	25.5	-33.4	0	0	0	110.1	A455	P453-A455 PolarHBondContact O-N 2.85Å
454	N	25.1	Very low	40.4	Very low	157 Å²	157	138.5 Å²	138.5	84%	0.84	75%	0.748	S	S	*	*			trans	-82.8	93.7	173	-173.8	10.9	0	0	0	109.1	R452 K456	R452-N454 PolarHBondContact O-N 3.36Å; N454-K456 PolarHBondContact O-N 3.49Å
455	A	33.1	Very low	37.8	Very low	87 Å²	87	138.8 Å²	138.8	72%	0.719	77%	0.767	S	S	*	*			trans	-70.4	90	-177	0	0	0	0	0	112.2	P453	P453-A455 PolarHBondContact O-N 2.85Å
456	K	37.5	Very low	35.3	Very low	205 Å²	205	144.1 Å²	144.1	89%	0.891	80%	0.798	S	S	*	*			trans	-177	72.7	151.8	-100.1	150.8	-170.5	175	0	113.1	N454	N454-K456 PolarHBondContact O-N 3.49Å
457	E	27.3	Very low	32.9	Very low	194 Å²	194	147.7 Å²	147.7	91%	0.907	81%	0.811	S	S	*	*			trans	-139.1	127.6	150.9	-162.7	157.3	-142.7	0	0	107.6
458	L	29.7	Very low	30.9	Very low	164 Å²	164	144 Å²	144	86%	0.859	81%	0.806	S	S	*	*			trans	-97.2	142.5	-176.9	-74.8	169.8	0	0	0	109.7
459	P	33.4	Very low	30.1	Very low	110 Å²	110	142.3 Å²	142.3	71%	0.714	80%	0.8	S	S	*	*			trans	-69.5	145	-175.7	29.1	-35.3	0	0	0	111.9	V461	P459-V461 PolarHBondContact O-N 3.18Å
460	A	28.8	Very low	29.9	Very low	102 Å²	102	146 Å²	146	84%	0.843	82%	0.815	S	S	*	*			trans	-71.1	114.6	167.7	0	0	0	0	0	109.4	Q462	A460-Q462 PolarHBondContact O-N 3.08Å
461	V	31.4	Very low	30.8	Very low	124 Å²	124	141.1 Å²	141.1	75%	0.752	81%	0.806	S	S	*	*			trans	-72.2	129.1	179.4	178.9	0	0	0	0	110.3	P459 I463	P459-V461 PolarHBondContact O-N 3.18Å; V461-I463 HydrophobicContact CG1-CD1 4.43Å; V461-I463 HydrophobicContact CG1-CG1 4.09Å
462	Q	31.9	Very low	31.2	Very low	171 Å²	171	141.5 Å²	141.5	80%	0.799	81%	0.806	S	S	*	*			trans	-96.9	127.1	178.3	-171.3	172.5	-0.3	0	0	109.2	A460	A460-Q462 PolarHBondContact O-N 3.08Å
463	I	33.1	Very low	31.1	Very low	152 Å²	152	142.1 Å²	142.1	78%	0.779	81%	0.808	S	S	*	*			trans	-130.6	141.5	175.7	-56.8	-177.6	0	0	0	108.5	V461	V461-I463 HydrophobicContact CG1-CD1 4.43Å; V461-I463 HydrophobicContact CG1-CG1 4.09Å
464	L	33.1	Very low	30.8	Very low	158 Å²	158	140.1 Å²	140.1	83%	0.827	81%	0.81	S	S	*	*			trans	-136.6	141.1	-168.9	-122.4	163.3	0	0	0	110.4
465	G	26	Very low	30.9	Very low	64 Å²	64	136 Å²	136	66%	0.66	81%	0.805	S	S	*	*			trans	88.5	161.4	-176.1	0	0	0	0	0	114
466	I	29.8	Very low	30.6	Very low	171 Å²	171	138.9 Å²	138.9	88%	0.877	81%	0.808	S	S	*	*			cis	-134.8	-174.9	2.4	-59	177.9	0	0	0	108.9
467	Q	28.2	Very low	30.5	Very low	190 Å²	190	137.9 Å²	137.9	89%	0.888	80%	0.804	S	S	*	*			trans	-73.5	-157.5	-164.9	-52.2	-177.3	43.4	0	0	116.7
468	S	24.9	Very low	30.6	Very low	104 Å²	104	134.3 Å²	134.3	73%	0.727	80%	0.8	S	S	*	*			trans	-116	148.3	-144.6	55.9	0	0	0	0	118.6
469	A	23.8	Very low	30.6	Very low	98 Å²	98	129.6 Å²	129.6	81%	0.81	79%	0.791	S	S	*	*			trans	66.7	167.7	154.4	0	0	0	0	0	117.9
470	P	32.2	Very low	30.4	Very low	122 Å²	122	136 Å²	136	79%	0.792	80%	0.801	S	S	*	*			cis	-120	-178.9	-7.2	32.4	-12.1	0	0	0	114.4
471	P	51	Low	30.4	Very low	117 Å²	117	134.8 Å²	134.8	76%	0.76	80%	0.798	S	S	*	*			trans	-104.2	169.6	-173	41.2	-35.9	0	0	0	114.6
472	P	35.8	Very low	30.2	Very low	117 Å²	117	131.9 Å²	131.9	76%	0.76	79%	0.794	S	S	*	*				-155.7	159.8	99.6	40.1	-21.7	0	0	0	119.3
473	R	25.1	Very low	30.1	Very low	251 Å²	251	129 Å²	129	95%	0.947	79%	0.792	S	S	*	*			trans	45.2	133.1	142.2	-66.8	176.7	176.8	163.6	-0.6	123.6
474	G	25.5	Very low	30	Very low	84 Å²	84	128.3 Å²	128.3	87%	0.866	80%	0.796	S	S	*	*			trans	103.5	145.9	144.7	0	0	0	0	0	116.4
475	G	26.6	Very low	30	Very low	70 Å²	70	124.7 Å²	124.7	72%	0.722	79%	0.788	S	S	*	*			cis	161.5	131.3	-12.7	0	0	0	0	0	113.9
476	N	28.4	Very low	30.3	Very low	149 Å²	149	125.4 Å²	125.4	80%	0.797	79%	0.788	S	S	*	*			trans	66	162.6	165.2	-68	-15.8	0	0	0	118.5
477	K	34	Very low	30.4	Very low	184 Å²	184	120.5 Å²	120.5	80%	0.8	77%	0.773	S	S	*	*			cis	-172.9	155.8	-47.3	-119	176	-170.6	167.1	0	109.9
478	S	29.8	Very low	30.5	Very low	119 Å²	119	114.7 Å²	114.7	83%	0.832	76%	0.757	S	S	*	*			trans	68	145.8	161.4	-127.7	0	0	0	0	117.1
479	G	29.7	Very low	30.5	Very low	64 Å²	64	118 Å²	118	66%	0.66	77%	0.767	S	S	*	*			cis	105.2	134.7	-14.6	0	0	0	0	0	116.7
480	R	28.9	Very low	30.7	Very low	245 Å²	245	117.4 Å²	117.4	93%	0.925	76%	0.762	S	S	*	*			trans	-165.5	147.3	162.1	-123	170.1	168.1	178.1	-7.7	106.5
481	G	28.5	Very low	30.5	Very low	76 Å²	76	116 Å²	116	78%	0.784	76%	0.756	S	S	*	*			cis	109.8	133.4	11.3	0	0	0	0	0	109.9
482	G	28.3	Very low	29.7	Very low	64 Å²	64	118.2 Å²	118.2	66%	0.66	76%	0.758	S	S	*	*			cis	-146.5	172.6	2.2	0	0	0	0	0	111.8
483	S	29.2	Very low	29.6	Very low	110 Å²	110	115.4 Å²	115.4	77%	0.769	74%	0.744	S	S	*	*				73.1	101.2	84	-55.7	0	0	0	0	113
484	T	32.2	Very low	30	Very low	138 Å²	138	110.5 Å²	110.5	85%	0.847	74%	0.735	S	S	*	*				72.4	124	62.5	67.4	0	0	0	0	116.4
485	A	31.9	Very low	30.1	Very low	81 Å²	81	114.9 Å²	114.9	67%	0.669	73%	0.733	S	S	*	*			trans	-177.2	162.9	135.2	0	0	0	0	0	111.6
486	A	33.4	Very low	30	Very low	80 Å²	80	116 Å²	116	66%	0.661	74%	0.735	S	S	*	*			trans	-133	-153.9	-166.2	0	0	0	0	0	113.7
487	A	30.3	Very low	29.8	Very low	67 Å²	67	116.4 Å²	116.4	55%	0.554	74%	0.737	S	S	*	*			trans	88.2	158.7	174.9	0	0	0	0	0	116	S491	A487-S491 VanDerWaalsContact CB-O 3.29Å; A487-S491 WeakPolarHBondContact CB-O 3.21Å
488	A	32.1	Very low	29.5	Very low	68 Å²	68	111.3 Å²	111.3	56%	0.562	73%	0.729	S	S	*	*			cis	-137.4	172	8.9	0	0	0	0	0	109.9
489	N	24.5	Very low	29.4	Very low	173 Å²	173	116 Å²	116	93%	0.925	73%	0.729	S	S	*	*	S	Bend	cis	-74.2	135.8	11	-58.7	-26.9	0	0	0	114
490	A	27.9	Very low	29.3	Very low	86 Å²	86	123 Å²	123	71%	0.711	74%	0.735	S	S	*	*	S	Bend	cis	-150.7	134	-20.6	0	0	0	0	0	106.9
491	S	28.5	Very low	29.2	Very low	94 Å²	94	117.2 Å²	117.2	66%	0.657	73%	0.727	S	S	*	*			cis	-136	157.3	9	-65.8	0	0	0	0	112.7	A487	A487-S491 VanDerWaalsContact CB-O 3.29Å; A487-S491 WeakPolarHBondContact CB-O 3.21Å
492	M	33.5	Very low	29	Very low	163 Å²	163	121.7 Å²	121.7	80%	0.803	73%	0.728	S	S	*	*			trans	9.6	153.3	153.3	-63.6	174.4	178.5	0	0	121.5
493	A	32.7	Very low	30.1	Very low	57 Å²	57	123.2 Å²	123.2	47%	0.471	73%	0.726	S	S	.	*			cis	-173.5	162.9	-16.2	0	0	0	0	0	110.9
494	I	33.3	Very low	30.4	Very low	148 Å²	148	124 Å²	124	76%	0.759	73%	0.728	S	S	*	*			trans	39.1	104.6	142.6	-57.8	169.4	0	0	0	119.8
495	Q	27.7	Very low	30	Very low	177 Å²	177	123.3 Å²	123.3	83%	0.827	72%	0.719	S	S	*	*				40	138.1	116.2	-145.6	178.8	100.5	0	0	123.2
496	A	26.1	Very low	30.6	Very low	92 Å²	92	125.2 Å²	125.2	76%	0.76	73%	0.725	S	S	*	*			trans	105.3	134.9	145.5	0	0	0	0	0	122.5
497	D	23.7	Very low	30	Very low	159 Å²	159	127.5 Å²	127.5	85%	0.85	72%	0.722	S	S	*	*			trans	64.3	164.7	151.9	-143.6	8.6	0	0	0	124
498	A	27.3	Very low	30.5	Very low	76 Å²	76	129.8 Å²	129.8	63%	0.628	73%	0.731	S	S	*	*			trans	65.4	137.4	177.8	0	0	0	0	0	116.6
499	R	28.4	Very low	30.3	Very low	219 Å²	219	130.5 Å²	130.5	83%	0.826	73%	0.732	S	S	*	*			cis	61.5	137.3	49.7	-59.4	-168.3	-171.6	-142.4	6.3	111.5
500	R	27	Very low	31.1	Very low	211 Å²	211	127.4 Å²	127.4	80%	0.796	72%	0.722	S	S	*	*			cis	-155.1	160.2	11.4	-145.7	-169.9	-149.8	-82.4	8.6	106.2
501	T	27.1	Very low	31	Very low	123 Å²	123	130.8 Å²	130.8	76%	0.755	73%	0.728	S	S	*	*				178.7	171.8	68.9	-74.2	0	0	0	0	109
502	E	24.9	Very low	30.8	Very low	170 Å²	170	129.3 Å²	129.3	79%	0.794	73%	0.727	S	S	*	*			trans	-103.9	-146.3	-171.8	-151.8	-157.8	148	0	0	113.1
503	P	49.5	Very low	30.4	Very low	96 Å²	96	128.1 Å²	128.1	62%	0.623	74%	0.735	S	S	*	*			trans	-109	-155.9	-137.9	38.3	-17.6	0	0	0	113.7
504	P	36.3	Very low	30	Very low	126 Å²	126	129 Å²	129	82%	0.818	75%	0.749	S	S	*	*				-139.2	167.6	98.4	40.3	-29.5	0	0	0	116.1
505	N	24.1	Very low	29.6	Very low	123 Å²	123	131.2 Å²	131.2	66%	0.658	75%	0.753	S	S	*	*			trans	-81.6	179.1	163.5	-158.5	20.1	0	0	0	109.7	E507	N505-E507 PolarHBondContact ND2-N 2.84Å
506	P	44.5	Very low	29.4	Very low	121 Å²	121	127.8 Å²	127.8	79%	0.786	75%	0.745	S	S	*	*				-142.8	157.4	77.9	38	-20.8	0	0	0	116.6
507	E	21.4	Very low	29.2	Very low	129 Å²	129	131.3 Å²	131.3	60%	0.603	75%	0.745	S	S	*	*			trans	-83.5	-175.3	163.2	-139.2	-160.9	113.2	0	0	109.7	N505 S509	N505-E507 PolarHBondContact ND2-N 2.84Å; E507-S509 PolarHBondContact OE1-N 3.37Å; E507-S509 PolarHBondContact OE1-OG 3.27Å
508	P	39.3	Very low	29.2	Very low	114 Å²	114	129.9 Å²	129.9	74%	0.74	73%	0.733	S	S	*	*				-148.3	141.9	53	37.8	-15.6	0	0	0	119.1
509	S	27.8	Very low	29	Very low	83 Å²	83	133.2 Å²	133.2	58%	0.58	73%	0.734	S	S	*	*				53.7	-165.7	122.4	-38.2	0	0	0	0	120.6	E507	E507-S509 PolarHBondContact OE1-N 3.37Å; E507-S509 PolarHBondContact OE1-OG 3.27Å
510	P	43	Very low	28.7	Very low	109 Å²	109	131.6 Å²	131.6	71%	0.708	73%	0.733	S	S	*	*				-105.7	-174.4	-85.1	39.2	-25.6	0	0	0	111.1
511	D	24.2	Very low	29.1	Very low	157 Å²	157	126.6 Å²	126.6	84%	0.84	73%	0.727	S	S	*	*			cis	-167.1	176.3	35.1	-109.8	-46.4	0	0	0	106.4
512	G	25.9	Very low	29.6	Very low	63 Å²	63	126.2 Å²	126.2	65%	0.649	73%	0.727	S	S	*	*			cis	-175.3	177.3	2.3	0	0	0	0	0	112.6
513	S	24.7	Very low	29.5	Very low	137 Å²	137	123.8 Å²	123.8	96%	0.958	73%	0.729	S	S	*	*			trans	-51.8	156.2	-177.1	-169.4	0	0	0	0	117.3
514	G	24	Very low	28.1	Very low	75 Å²	75	125.3 Å²	125.3	77%	0.773	74%	0.736	S	S	*	*			trans	172.9	114.1	165.1	0	0	0	0	0	113.9
515	K	24.4	Very low	27.5	Very low	195 Å²	195	124.6 Å²	124.6	85%	0.848	73%	0.734	S	S	*	*			trans	-145.2	143.5	178.5	-145.1	-159.7	-179.5	-171.2	0	110.6
516	V	24.1	Very low	27.5	Very low	106 Å²	106	125 Å²	125	64%	0.642	74%	0.741	S	S	*	*			trans	79.9	128	150	151.9	0	0	0	0	120.1
517	E	22.3	Very low	26.4	Very low	165 Å²	165	124.2 Å²	124.2	77%	0.771	74%	0.738	S	S	*	*			trans	97.1	142.3	142.8	-95.9	171	76.6	0	0	127.5
518	E	22.3	Very low	26.4	Very low	129 Å²	129	123 Å²	123	60%	0.603	74%	0.743	S	S	*	*			trans	75.6	126	144.7	-64.7	-120.8	-58.8	0	0	126.1
519	K	24.1	Very low	25.8	Very low	147 Å²	147	124.6 Å²	124.6	64%	0.639	74%	0.741	S	S	*	*			trans	67.4	110.9	143.4	-94.7	101.6	166.1	-177.9	0	123.2
520	K	22.6	Very low	25.7	Very low	184 Å²	184	128.6 Å²	128.6	80%	0.8	75%	0.75	S	S	*	*				60.4	151.1	92	-175.2	-175.7	176.2	-176.5	0	118.7
521	P	34.8	Very low	24.9	Very low	106 Å²	106	128.6 Å²	128.6	69%	0.688	75%	0.748	S	S	*	*			cis	-121.6	-132.1	-10	27.6	-1.4	0	0	0	112.9
522	P	37	Very low	25	Very low	115 Å²	115	129.3 Å²	129.3	75%	0.747	75%	0.747	S	S	*	*				-129.9	168.4	-98	42	-25	0	0	0	116.5
523	S	22.5	Very low	25.1	Very low	120 Å²	120	134.7 Å²	134.7	84%	0.839	76%	0.755	S	S	*	*			trans	-163.3	149.8	154.5	55.4	0	0	0	0	111.6
524	V	20.5	Very low	25.1	Very low	128 Å²	128	130.7 Å²	130.7	78%	0.776	74%	0.735	S	S	*	*			trans	-143.8	135.7	-171.7	170.8	0	0	0	0	111.6
525	S	23.6	Very low	25.2	Very low	110 Å²	110	134.6 Å²	134.6	77%	0.769	74%	0.739	S	S	*	*			trans	65.4	172.8	166.4	-61.6	0	0	0	0	116.2
526	V	24.3	Very low	25.3	Very low	131 Å²	131	127.8 Å²	127.8	79%	0.794	72%	0.724	S	S	*	*			cis	-146.3	168.1	20.6	-165.3	0	0	0	0	111.9
527	S	21.8	Very low	25.3	Very low	105 Å²	105	130 Å²	130	73%	0.734	74%	0.737	S	S	*	*			trans	82.7	135.9	164	-63.1	0	0	0	0	117.1
528	C	22.4	Very low	25.6	Very low	103 Å²	103	125 Å²	125	70%	0.696	73%	0.731	S	S	*	*			cis	-153.7	167.4	-2.1	-104.3	0	0	0	0	108
529	Q	26.5	Very low	25.6	Very low	149 Å²	149	124.9 Å²	124.9	70%	0.696	74%	0.744	S	S	*	*			cis	-163	151.3	15	-133.4	156.9	37.4	0	0	110.3
530	Q	25.2	Very low	25.6	Very low	166 Å²	166	124.8 Å²	124.8	78%	0.776	76%	0.756	S	S	*	*			trans	57.2	138.4	143.1	-78	170.2	-6.7	0	0	121
531	T	25.7	Very low	25.6	Very low	110 Å²	110	124.6 Å²	124.6	68%	0.675	76%	0.758	S	S	*	*			cis	-152.6	156.2	-1.4	-68.7	0	0	0	0	110.1
532	E	26	Very low	25.1	Very low	172 Å²	172	124.6 Å²	124.6	80%	0.804	77%	0.767	S	S	*	*			trans	-16.7	145.4	164	-60.1	161.3	-165.2	0	0	118
533	E	27.5	Very low	24.4	Very low	175 Å²	175	122.2 Å²	122.2	82%	0.818	76%	0.763	S	S	*	*			cis	-163.9	176.8	-5.5	-112.4	-58.7	82.2	0	0	107.6	N535	E533-N535 PolarHBondContact OE2-N 2.86Å
534	G	25.5	Very low	25	Very low	54 Å²	54	122.5 Å²	122.5	56%	0.557	76%	0.762	S	S	*	*			cis	165.7	-171.1	4.3	0	0	0	0	0	117.4
535	N	25.6	Very low	25.1	Very low	157 Å²	157	124.8 Å²	124.8	84%	0.84	76%	0.764	S	S	*	*			trans	60.3	170.1	178.3	-156	15.1	0	0	0	116.8	E533	E533-N535 PolarHBondContact OE2-N 2.86Å
536	G	26.5	Very low	25.2	Very low	52 Å²	52	124.4 Å²	124.4	54%	0.536	76%	0.757	S	S	.	*			trans	-157.6	-141.6	-179.4	0	0	0	0	0	113.4
537	T	25.4	Very low	25.2	Very low	151 Å²	151	125.7 Å²	125.7	93%	0.926	76%	0.759	S	S	*	*			trans	78	168.2	-174.9	-26.1	0	0	0	0	114.1
538	G	27	Very low	25.3	Very low	62 Å²	62	124.1 Å²	124.1	64%	0.639	76%	0.76	S	S	*	*			trans	-153.1	165.2	177	0	0	0	0	0	113.5
539	S	22.2	Very low	25.4	Very low	126 Å²	126	122.6 Å²	122.6	88%	0.881	76%	0.762	S	S	*	*			trans	59.1	98.4	173.1	-66.4	0	0	0	0	119.1
540	T	25.3	Very low	25.2	Very low	144 Å²	144	120.1 Å²	120.1	88%	0.883	77%	0.767	S	S	*	*			trans	-147.4	176.2	142.3	-18.4	0	0	0	0	111.1
541	E	22.3	Very low	25.1	Very low	181 Å²	181	120.6 Å²	120.6	85%	0.846	77%	0.769	S	S	*	*			trans	-94.2	176.5	-154.8	-55.8	172.7	95.6	0	0	117.2
542	A	23.8	Very low	24.9	Very low	105 Å²	105	120.5 Å²	120.5	87%	0.868	77%	0.769	S	S	*	*			trans	79.4	149.1	151.5	0	0	0	0	0	118.8
543	G	22.6	Very low	24.7	Very low	65 Å²	65	120.8 Å²	120.8	67%	0.67	77%	0.77	S	S	*	*			cis	-128.9	175.2	6.8	0	0	0	0	0	115.8
544	P	35.6	Very low	24.3	Very low	126 Å²	126	116.1 Å²	116.1	82%	0.818	76%	0.757	S	S	*	*			trans	-74.1	179.9	168.5	38.1	-38.1	0	0	0	110.1
545	E	22.2	Very low	24.2	Very low	177 Å²	177	121.8 Å²	121.8	83%	0.827	77%	0.769	S	S	*	*			cis	-145.8	-175.4	28.6	-49.4	178.5	86.4	0	0	110.2
546	V	25.6	Very low	24	Very low	102 Å²	102	122.6 Å²	122.6	62%	0.618	77%	0.768	S	S	*	*			cis	-155.7	147.6	7.5	83.2	0	0	0	0	110.3
547	N	25.4	Very low	23.6	Very low	157 Å²	157	125.2 Å²	125.2	84%	0.84	78%	0.776	S	S	*	*			trans	54.8	156.8	163.1	-59.6	-29.7	0	0	0	119.1
548	G	23.7	Very low	23.5	Very low	73 Å²	73	125.2 Å²	125.2	75%	0.753	76%	0.763	S	S	*	*			cis	146.2	133.5	-2.3	0	0	0	0	0	110.6
549	G	23.8	Very low	23.3	Very low	70 Å²	70	128.5 Å²	128.5	72%	0.722	76%	0.762	S	S	*	*			trans	90.7	156	-171.3	0	0	0	0	0	113.1
550	A	23.3	Very low	23.3	Very low	98 Å²	98	128.9 Å²	128.9	81%	0.81	75%	0.75	S	S	*	*			cis	64.6	133.9	19.5	0	0	0	0	0	112.4
551	E	22.4	Very low	23.4	Very low	175 Å²	175	128.8 Å²	128.8	82%	0.818	74%	0.74	S	S	*	*			cis	-139.4	151	14.9	-72	-169.9	106.3	0	0	110.1
552	T	20.7	Very low	23.4	Very low	109 Å²	109	128.5 Å²	128.5	67%	0.669	74%	0.738	S	S	*	*				60.2	133.7	85	-35.3	0	0	0	0	115.6
553	Q	21.9	Very low	23.2	Very low	177 Å²	177	129.3 Å²	129.3	83%	0.827	74%	0.737	S	S	*	*			trans	66	161.2	165.9	-85	166.5	81.3	0	0	116.8
554	S	20.6	Very low	23.1	Very low	78 Å²	78	129.6 Å²	129.6	55%	0.545	74%	0.741	S	S	.	*			cis	-158.8	158.9	-31	-150	0	0	0	0	109.5
555	E	21.5	Very low	22.5	Very low	172 Å²	172	127.4 Å²	127.4	80%	0.804	74%	0.741	S	S	*	*			trans	51.7	159.3	148.9	-74.3	156.5	107.6	0	0	122.3
556	Q	21.5	Very low	22.5	Very low	175 Å²	175	124.6 Å²	124.6	82%	0.818	74%	0.741	S	S	*	*			trans	151.8	103.4	149.9	172.5	175.9	5	0	0	111.6
557	C	20	Very low	22.4	Very low	106 Å²	106	124.8 Å²	124.8	72%	0.716	75%	0.746	S	S	*	*			trans	-54.6	175	169.3	-51.6	0	0	0	0	112.2
558	K	22.9	Very low	22.4	Very low	151 Å²	151	121.9 Å²	121.9	66%	0.657	74%	0.739	S	S	*	*				178.4	173.6	52.2	-158.4	162.4	147.5	-97.8	0	110.6
559	E	21.5	Very low	22.4	Very low	131 Å²	131	125 Å²	125	61%	0.612	74%	0.738	S	S	*	*			trans	68.7	151.9	160.2	-96	121	-176.1	0	0	117.8
560	E	23.1	Very low	22.6	Very low	134 Å²	134	128.2 Å²	128.2	63%	0.626	74%	0.738	S	S	*	*			cis	-161.1	-176.1	-8.4	-142.9	-173	116.2	0	0	112.1
561	Q	27	Very low	22.7	Very low	143 Å²	143	128.7 Å²	128.7	67%	0.668	73%	0.731	S	S	*	*			trans	68.6	134.5	155.8	-69	141.7	22.9	0	0	118
562	Q	22.8	Very low	22.9	Very low	174 Å²	174	129.5 Å²	129.5	81%	0.813	74%	0.735	S	S	*	*			cis	70	121.9	38.9	-60.2	-168.4	-8.3	0	0	112.6
563	S	19.6	Very low	22.9	Very low	122 Å²	122	128.6 Å²	128.6	85%	0.853	74%	0.738	S	S	*	*				54.9	124.2	73.8	-176.7	0	0	0	0	112.7
564	G	21.2	Very low	23.4	Very low	72 Å²	72	126 Å²	126	74%	0.742	74%	0.737	S	S	*	*			cis	160.3	162.4	0.2	0	0	0	0	0	111.7
565	G	22.2	Very low	23.5	Very low	80 Å²	80	127.6 Å²	127.6	83%	0.825	75%	0.748	S	S	*	*			trans	84.2	173.4	-179	0	0	0	0	0	114.7
566	S	22.8	Very low	23.6	Very low	117 Å²	117	123.7 Å²	123.7	82%	0.818	75%	0.745	S	S	*	*			cis	-160.1	163.9	-0.9	-164.7	0	0	0	0	112.6
567	S	23.5	Very low	23.7	Very low	106 Å²	106	124.6 Å²	124.6	74%	0.741	75%	0.746	S	S	*	*			trans	66.6	146.6	160.1	-107.3	0	0	0	0	119.5
568	S	25.2	Very low	23.8	Very low	97 Å²	97	125.6 Å²	125.6	68%	0.678	75%	0.751	S	S	*	*			cis	-173.6	147.8	-22.2	35.4	0	0	0	0	109
569	D	23.6	Very low	23.7	Very low	139 Å²	139	124.5 Å²	124.5	74%	0.743	76%	0.758	S	S	*	*				163.8	154.5	98.8	-144.6	-2.8	0	0	0	115.3
570	L	27.8	Very low	23.8	Very low	137 Å²	137	122.6 Å²	122.6	72%	0.717	76%	0.764	S	S	*	*			trans	40.7	113	152.6	-83.8	164.6	0	0	0	124.9
571	T	24.8	Very low	23.7	Very low	107 Å²	107	122.4 Å²	122.4	66%	0.656	77%	0.772	S	S	*	*				106.1	119.8	128.5	-42	0	0	0	0	122.1
572	Q	27.3	Very low	23.4	Very low	192 Å²	192	121 Å²	121	90%	0.897	78%	0.778	S	S	*	*			trans	62.4	151.1	156.1	-77.1	-179.9	-24.2	0	0	122.7
573	A	20.3	Very low	23.5	Very low	90 Å²	90	117.6 Å²	117.6	74%	0.744	77%	0.774	S	S	*	*			trans	-113.1	178.7	-179.9	0	0	0	0	0	108.8
574	P	33.1	Very low	23.7	Very low	122 Å²	122	120.6 Å²	120.6	79%	0.792	77%	0.774	S	S	*	*			cis	-145.4	176.5	15.8	43.3	-23.7	0	0	0	119
575	S	21.6	Very low	24	Very low	113 Å²	113	125.3 Å²	125.3	79%	0.79	78%	0.777	S	S	*	*			trans	92.9	115.4	143.8	-150	0	0	0	0	121.7
576	A	23.4	Very low	24	Very low	89 Å²	89	127.5 Å²	127.5	74%	0.736	78%	0.78	S	S	*	*			trans	76.2	120.6	139.1	0	0	0	0	0	123.4
577	K	23.2	Very low	24.2	Very low	194 Å²	194	126.1 Å²	126.1	84%	0.843	78%	0.775	S	S	*	*			trans	68.1	113.9	152.2	-79.3	-171.3	172.7	-176.9	0	121.2
578	P	22.9	Very low	24.3	Very low	127 Å²	127	126.4 Å²	126.4	83%	0.825	78%	0.777	S	S	*	*			trans	-89.3	172	144.5	36.8	-32.4	0	0	0	112.3
579	T	20.1	Very low	24.3	Very low	129 Å²	129	130.9 Å²	130.9	79%	0.791	79%	0.788	S	S	*	*			trans	-143.8	133.9	-179.7	-57.2	0	0	0	0	111.7
580	A	23.8	Very low	24.5	Very low	90 Å²	90	128.3 Å²	128.3	74%	0.744	79%	0.794	S	S	*	*			trans	61.9	157.6	163	0	0	0	0	0	118.9
581	T	22.5	Very low	24.4	Very low	130 Å²	130	126.1 Å²	126.1	80%	0.798	80%	0.796	S	S	*	*			cis	-110.6	-104.7	5.7	-49.3	0	0	0	0	113.7
582	S	20.9	Very low	24.6	Very low	114 Å²	114	125.6 Å²	125.6	80%	0.797	80%	0.802	S	S	*	*			cis	-154.5	172.3	1.4	61.1	0	0	0	0	112.3
583	S	24.1	Very low	24.6	Very low	103 Å²	103	121.6 Å²	121.6	72%	0.72	79%	0.793	S	S	*	*			trans	-105.7	178.6	-171.8	-41.6	0	0	0	0	112.2
584	E	24.3	Very low	25.2	Very low	184 Å²	184	123.1 Å²	123.1	86%	0.86	80%	0.795	S	S	*	*			cis	-135.2	137.3	6.9	-64.9	179	109.2	0	0	109.6
585	E	26.1	Very low	25.6	Very low	171 Å²	171	120.7 Å²	120.7	80%	0.799	79%	0.785	S	S	*	*				56.1	120.9	93.8	-165.6	158	144.9	0	0	119.1
586	S	23.5	Very low	26.6	Very low	126 Å²	126	124.2 Å²	124.2	88%	0.881	79%	0.786	S	S	*	*			trans	-163.4	141.9	149.2	-83.2	0	0	0	0	109.8
587	A	26	Very low	28.3	Very low	88 Å²	88	126.9 Å²	126.9	73%	0.727	78%	0.783	S	S	*	*			trans	-115.2	151.9	-161.1	0	0	0	0	0	115.6
588	S	25.3	Very low	30.5	Very low	112 Å²	112	120.5 Å²	120.5	78%	0.783	75%	0.754	S	S	*	*			trans	-166.4	120	148	-89	0	0	0	0	114.7
589	Q	26.4	Very low	32.9	Very low	192 Å²	192	116.9 Å²	116.9	90%	0.897	73%	0.732	S	S	*	*			trans	46.6	124.6	146.5	-53.6	-172.2	9.9	0	0	121.6
590	G	28.3	Very low	35.7	Very low	84 Å²	84	111.5 Å²	111.5	87%	0.866	70%	0.699	S	S	*	*				112	16.2	103.4	0	0	0	0	0	120.3
591	A	25.3	Very low	38.3	Very low	92 Å²	92	112.9 Å²	112.9	76%	0.76	69%	0.69	S	S	*	*			trans	-136.9	135.6	168.6	0	0	0	0	0	112
592	A	27.8	Very low	41.1	Very low	96 Å²	96	110 Å²	110	79%	0.793	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-65.3	129.5	166.2	0	0	0	0	0	108.4
593	P	27.1	Very low	44.2	Very low	108 Å²	108	105.1 Å²	105.1	70%	0.701	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-63	142.4	179.3	26.5	-33.8	0	0	0	109.6	A595	P593-A595 PolarHBondContact O-N 3.35Å
594	P	33.3	Very low	47	Very low	121 Å²	121	105.8 Å²	105.8	79%	0.786	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-55.3	131.8	166	26.3	-33.3	0	0	0	107.6	K596	P594-K596 PolarHBondContact O-N 3.46Å
595	A	41.7	Very low	49.9	Very low	71 Å²	71	104.5 Å²	104.5	59%	0.587	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-53.8	118.9	-172.9	0	0	0	0	0	109.6	P593 E597	P593-A595 PolarHBondContact O-N 3.35Å; A595-E597 PolarHBondContact O-N 2.92Å; A595-E597 VanDerWaalsContact O-N 3.13Å
596	K	42.9	Very low	52.7	Low	188 Å²	188	101 Å²	101	82%	0.817	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-56.4	122.9	176.2	-72.1	-176.5	178.3	179.6	0	107.6	P594 R598	P594-K596 PolarHBondContact O-N 3.46Å; K596-R598 VanDerWaalsContact C-N 3.31Å; K596-R598 PolarHBondContact O-N 3Å
597	E	57.9	Low	55.7	Low	144 Å²	144	95 Å²	95	67%	0.673	56%	0.555	S	S	*	*			trans	-66.2	91.9	178.2	-161.5	162.8	-126.4	0	0	107.3	G430 A595	G430-E597 WeakPolarHBondContact CA-OE1 3.34Å; G430-E597 PolarHBondContact N-OE1 2.93Å; A595-E597 PolarHBondContact O-N 2.92Å; A595-E597 VanDerWaalsContact O-N 3.13Å
598	R	69.4	Low	58.7	Low	60 Å²	60	90.9 Å²	90.9	23%	0.226	52%	0.521	C	S	.	.			trans	-60.6	138.1	-175.3	-65.7	-164.6	-166.8	85.9	9.3	109.3	K596 Q602 I603 E606 D612	K596-R598 VanDerWaalsContact C-N 3.31Å; K596-R598 PolarHBondContact O-N 3Å; R598-Q602 HydrophobicContact CB-CB 4.46Å; R598-I603 HydrophobicContact CB-CD1 4.05Å; R598-I603 HydrophobicContact CB-CG1 3.83Å; R598-E606 IonicContact NE-OE2 3.97Å; R598-D612 IonicContact CZ-OD1 3.35Å; R598-D612 PolarHBondContact NH1-O 3.35Å; R598-D612 PolarHBondContact NH2-O 3.45Å; R598-D612 VanDerWaalsContact NH2-O 3.09Å; R598-D612 IonicContact NH2-OD1 2.64Å; R598-D612 PolarHBondContact NH2-OD1 3.08Å
599	S	73.9	Confident	61.7	Low	51 Å²	51	86 Å²	86	36%	0.357	49%	0.487	S	S	.	.			trans	-67.7	160.6	175.6	91.2	0	0	0	0	110.9	E601 Q602 I603	S599-E601 WeakPolarHBondContact CB-OE2 3.19Å; S599-E601 PolarHBondContact O-N 2.85Å; S599-E601 PolarHBondContact OG-N 2.94Å; S599-E601 PolarHBondContact OG-OE2 2.94Å; S599-Q602 PolarHBondContact O-N 2.97Å; S599-Q602 PolarHBondContact OG-N 2.78Å; S599-I603 WeakPolarHBondContact O-CG1 3.19Å; S599-I603 PolarHBondContact O-N 3.19Å
600	V	79.3	Confident	64.5	Low	17 Å²	17	77.7 Å²	77.7	10%	0.103	45%	0.451	C	S	.	.	H	α-helix	trans	-62	-33.1	178.8	164.1	0	0	0	0	111	L425 T427 I603 R604	L425-V600 HydrophobicContact CB-CG1 3.55Å; L425-V600 HydrophobicContact CB-CG2 4.22Å; L425-V600 HydrophobicContact CD1-CG1 4.12Å; T427-V600 HydrophobicContact CG2-CG2 3.81Å; V600-I603 PolarHBondContact O-N 2.89Å; V600-R604 WeakPolarHBondContact O-CG 3.32Å; V600-R604 PolarHBondContact O-N 3.12Å; V600-R604 VanDerWaalsContact O-N 3.11Å
601	E	77.5	Confident	67.1	Low	118 Å²	118	81.6 Å²	81.6	55%	0.551	44%	0.439	S	S	*	.	H	α-helix	trans	-66	-51.2	177.5	-55.3	65.6	-137	0	0	110.2	S599 I603 R604 E605	S599-E601 WeakPolarHBondContact CB-OE2 3.19Å; S599-E601 PolarHBondContact O-N 2.85Å; S599-E601 PolarHBondContact OG-N 2.94Å; S599-E601 PolarHBondContact OG-OE2 2.94Å; E601-I603 PolarHBondContact O-N 2.76Å; E601-R604 PolarHBondContact O-N 3.24Å; E601-E605 PolarHBondContact O-N 3.17Å
602	Q	81.5	Confident	69.7	Low	69 Å²	69	80.5 Å²	80.5	32%	0.322	42%	0.421	S	S	.	.	H	α-helix	trans	-56.9	-39.4	175.8	-171.2	179.9	14.5	0	0	111.6	R598 S599 R604 E605 E606	R598-Q602 HydrophobicContact CB-CB 4.46Å; S599-Q602 PolarHBondContact O-N 2.97Å; S599-Q602 PolarHBondContact OG-N 2.78Å; Q602-R604 VanDerWaalsContact C-N 3.31Å; Q602-R604 PolarHBondContact O-N 3.3Å; Q602-E605 PolarHBondContact O-N 3.31Å; Q602-E606 HydrophobicContact CG-CG 4.06Å; Q602-E606 WeakPolarHBondContact CG-OE1 3.31Å; Q602-E606 WeakPolarHBondContact CG-OE2 3.31Å; Q602-E606 PolarHBondContact NE2-OE1 3.14Å; Q602-E606 PolarHBondContact NE2-OE2 3.36Å; Q602-E606 WeakPolarHBondContact O-CB 3.13Å; Q602-E606 PolarHBondContact O-N 3.07Å
603	I	85.4	Confident	72.3	Confident	12 Å²	12	76 Å²	76	6%	0.062	38%	0.383	C	S	.	.	H	α-helix	trans	-67.5	-26.8	176.6	-70.3	172.6	0	0	0	112.8	L425 R598 S599 V600 E601 G607 W608 M624	L425-I603 HydrophobicContact CD1-CG2 3.99Å; R598-I603 HydrophobicContact CB-CD1 4.05Å; R598-I603 HydrophobicContact CB-CG1 3.83Å; S599-I603 WeakPolarHBondContact O-CG1 3.19Å; S599-I603 PolarHBondContact O-N 3.19Å; V600-I603 PolarHBondContact O-N 2.89Å; E601-I603 PolarHBondContact O-N 2.76Å; I603-G607 VanDerWaalsContact O-CA 3.26Å; I603-G607 WeakPolarHBondContact O-CA 3.48Å; I603-G607 PolarHBondContact O-N 3.13Å; I603-W608 HydrophobicContact CG2-CH2 3.8Å; I603-W608 HydrophobicContact CG2-CZ2 3.29Å; I603-M624 HydrophobicContact CD1-CE 3.67Å
604	R	84.9	Confident	74.8	Confident	117 Å²	117	76 Å²	76	44%	0.442	37%	0.374	S	S	.	.	H	α-helix	trans	-82.2	-26.9	174.5	-68.1	176.8	94.6	-169.3	5.8	112.8	P419 E421 L425 V600 E601 Q602	P419-R604 HydrophobicContact CG-CB 4.43Å; P419-R604 HydrophobicContact CG-CG 3.78Å; E421-R604 PolarHBondContact O-NH2 3Å; L425-R604 HydrophobicContact CD1-CG 3.95Å; V600-R604 WeakPolarHBondContact O-CG 3.32Å; V600-R604 PolarHBondContact O-N 3.12Å; V600-R604 VanDerWaalsContact O-N 3.11Å; E601-R604 PolarHBondContact O-N 3.24Å; Q602-R604 VanDerWaalsContact C-N 3.31Å; Q602-R604 PolarHBondContact O-N 3.3Å
605	E	84	Confident	77.1	Confident	158 Å²	158	75.8 Å²	75.8	74%	0.738	37%	0.366	S	S	*	.	H	α-helix	trans	-87.8	-52.5	179.8	-67.5	-172.9	175.2	0	0	113.1	F418 E601 Q602	F418-E605 WeakPolarHBondContact CE1-O 3.5Å; E601-E605 PolarHBondContact O-N 3.17Å; Q602-E605 PolarHBondContact O-N 3.31Å
606	E	84.5	Confident	79.3	Confident	96 Å²	96	73.5 Å²	73.5	45%	0.449	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-34.6	-179.3	-62.5	175.8	179.2	0	0	112.8	F418 R598 Q602	F418-E606 VanDerWaalsContact CE1-C 3.47Å; F418-E606 WeakPolarHBondContact CE1-O 3.31Å; R598-E606 IonicContact NE-OE2 3.97Å; Q602-E606 HydrophobicContact CG-CG 4.06Å; Q602-E606 WeakPolarHBondContact CG-OE1 3.31Å; Q602-E606 WeakPolarHBondContact CG-OE2 3.31Å; Q602-E606 PolarHBondContact NE2-OE1 3.14Å; Q602-E606 PolarHBondContact NE2-OE2 3.36Å; Q602-E606 WeakPolarHBondContact O-CB 3.13Å; Q602-E606 PolarHBondContact O-N 3.07Å
607	G	87.1	Confident	81.6	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.01	31%	0.311	C	S	.	.			trans	71.1	-151	-174.2	0	0	0	0	0	113.6	L417 I603	L417-G607 CarbonylContact O-C 3.59Å; L417-G607 WeakPolarHBondContact O-CA 3.24Å; I603-G607 VanDerWaalsContact O-CA 3.26Å; I603-G607 WeakPolarHBondContact O-CA 3.48Å; I603-G607 PolarHBondContact O-N 3.13Å
608	W	89.8	Confident	83.2	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.008	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-118.9	103.2	-179.5	-64.5	-66.7	0	0	0	109.4	V367 I371 T416 L417 P419 I603 A613 L621 F625 L633	V367-W608 HydrophobicContact CG1-CB 4.09Å; V367-W608 HydrophobicContact CG1-CG 4.34Å; I371-W608 HydrophobicContact CD1-CB 4.44Å; I371-W608 WeakPolarHBondContact CD1-O 2.99Å; T416-W608 WeakPolarHBondContact CA-O 3.35Å; L417-W608 HydrophobicContact CB-CB 4.39Å; L417-W608 HydrophobicContact CB-CE3 4.34Å; L417-W608 PolarHBondContact N-O 3.36Å; L417-W608 PolarHBondContact O-N 2.9Å; P419-W608 HydrophobicContact CB-CH2 4.35Å; P419-W608 HydrophobicContact CB-CZ3 4.43Å; I603-W608 HydrophobicContact CG2-CH2 3.8Å; I603-W608 HydrophobicContact CG2-CZ2 3.29Å; W608-A613 HydrophobicContact CB-CB 3.89Å; W608-A613 HydrophobicContact CG-CB 4.41Å; W608-L621 HydrophobicContact CD2-CD2 4.43Å; W608-L621 HydrophobicContact CE3-CD1 4.42Å; W608-L621 HydrophobicContact CH2-CD1 4.26Å; W608-L621 HydrophobicContact CH2-CD2 3.76Å; W608-L621 HydrophobicContact CZ2-CD1 4.41Å; W608-L621 HydrophobicContact CZ2-CD2 3.26Å; W608-L621 HydrophobicContact CZ2-CG 4.47Å; W608-L621 HydrophobicContact CZ3-CD1 4.26Å; W608-L621 HydrophobicContact CZ3-CD2 4.49Å; W608-F625 HydrophobicContact CH2-CE2 4.44Å; W608-F625 HydrophobicContact CH2-CZ 4.09Å; W608-L633 HydrophobicContact CZ3-CD2 3.81Å
609	S	88.3	Confident	84.2	Confident	10 Å²	10	55.7 Å²	55.7	7%	0.07	27%	0.268	C	S	.	.			trans	-80.2	167.9	167.6	96.8	0	0	0	0	111.2	I371 R611 D612 A613	I371-S609 WeakPolarHBondContact CD1-O 3.4Å; S609-R611 PolarHBondContact O-N 2.82Å; S609-R611 PolarHBondContact OG-N 2.93Å; S609-R611 VanDerWaalsContact OG-N 3.12Å; S609-D612 WeakPolarHBondContact CB-OD2 3.31Å; S609-D612 PolarHBondContact O-N 3.42Å; S609-D612 WeakPolarHBondContact OG-CB 3.46Å; S609-D612 PolarHBondContact OG-N 3.46Å; S609-D612 PolarHBondContact OG-OD2 3.1Å; S609-A613 WeakPolarHBondContact O-CB 3.44Å; S609-A613 PolarHBondContact O-N 3.44Å; S609-A613 VanDerWaalsContact O-N 3.1Å
610	A	83.8	Confident	85	Confident	17 Å²	17	54.5 Å²	54.5	14%	0.14	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-32.3	175.1	0	0	0	0	0	112.9	S368 I371	S368-A610 WeakPolarHBondContact CB-O 3.38Å; I371-A610 HydrophobicContact CG2-CB 3.89Å
611	R	82.8	Confident	85.5	Confident	165 Å²	165	53.7 Å²	53.7	62%	0.623	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-46.3	179	-44.6	178	-162.8	-137.8	2.3	110.5	E414 S609 A613	E414-R611 IonicContact OE2-CZ 3.15Å; E414-R611 IonicContact OE2-NE 3.23Å; E414-R611 PolarHBondContact OE2-NE 2.98Å; E414-R611 IonicContact OE2-NH2 3.23Å; S609-R611 PolarHBondContact O-N 2.82Å; S609-R611 PolarHBondContact OG-N 2.93Å; S609-R611 VanDerWaalsContact OG-N 3.12Å; R611-A613 VanDerWaalsContact C-N 3.26Å; R611-A613 PolarHBondContact O-N 2.96Å
612	D	80.4	Confident	86.1	Confident	70 Å²	70	49.1 Å²	49.1	37%	0.374	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-15.9	-171.9	-74.7	-71.6	0	0	0	114.7	R598 S609	R598-D612 IonicContact CZ-OD1 3.35Å; R598-D612 PolarHBondContact NH1-O 3.35Å; R598-D612 PolarHBondContact NH2-O 3.45Å; R598-D612 VanDerWaalsContact NH2-O 3.09Å; R598-D612 IonicContact NH2-OD1 2.64Å; R598-D612 PolarHBondContact NH2-OD1 3.08Å; S609-D612 WeakPolarHBondContact CB-OD2 3.31Å; S609-D612 PolarHBondContact O-N 3.42Å; S609-D612 WeakPolarHBondContact OG-CB 3.46Å; S609-D612 PolarHBondContact OG-N 3.46Å; S609-D612 PolarHBondContact OG-OD2 3.1Å
613	A	81.6	Confident	86.5	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112	14.5	-175.7	0	0	0	0	0	113.4	V367 S368 I371 W608 S609 R611 N615 V616	V367-A613 HydrophobicContact CB-CB 3.9Å; V367-A613 HydrophobicContact CG1-CB 3.81Å; S368-A613 PolarHBondContact N-O 3.07Å; I371-A613 HydrophobicContact CD1-CB 4.23Å; W608-A613 HydrophobicContact CB-CB 3.89Å; W608-A613 HydrophobicContact CG-CB 4.41Å; S609-A613 WeakPolarHBondContact O-CB 3.44Å; S609-A613 PolarHBondContact O-N 3.44Å; S609-A613 VanDerWaalsContact O-N 3.1Å; R611-A613 VanDerWaalsContact C-N 3.26Å; R611-A613 PolarHBondContact O-N 2.96Å; A613-N615 VanDerWaalsContact C-N 3.3Å; A613-N615 PolarHBondContact O-N 3.29Å; A613-V616 PolarHBondContact O-N 3.32Å
614	E	79.9	Confident	86.6	Confident	110 Å²	110	46.8 Å²	46.8	51%	0.514	22%	0.219	S	C	.	.	S	Bend	trans	-61.4	-38.7	177.3	177.5	170.1	-168.5	0	0	112.1	K366	K366-E614 WeakPolarHBondContact CD-O 3.23Å; K366-E614 WeakPolarHBondContact CE-O 3.48Å; K366-E614 PolarHBondContact NZ-O 2.78Å; K366-E614 IonicContact NZ-OE1 3.13Å; K366-E614 PolarHBondContact NZ-OE1 2.91Å
615	N	81.3	Confident	86.7	Confident	115 Å²	115	42.1 Å²	42.1	62%	0.615	20%	0.202	S	C	*	.	S	Bend	trans	-90	-9	-177.8	-66.5	-38.3	0	0	0	113.5	A613	A613-N615 VanDerWaalsContact C-N 3.3Å; A613-N615 PolarHBondContact O-N 3.29Å
616	V	88.8	Confident	86.7	Confident	24 Å²	24	37.3 Å²	37.3	15%	0.145	20%	0.195	C	C	.	.			trans	-90.8	128.9	-175.6	-174.6	0	0	0	0	110.6	K366 V367 A613 E620 L621	K366-V616 CarbonylContact C-O 3.57Å; K366-V616 WeakPolarHBondContact CA-O 3.43Å; V367-V616 HydrophobicContact CG2-CB 4.3Å; V367-V616 HydrophobicContact CG2-CG1 3.95Å; V367-V616 PolarHBondContact N-O 3.27Å; A613-V616 PolarHBondContact O-N 3.32Å; V616-E620 VanDerWaalsContact CA-OE2 3.25Å; V616-E620 WeakPolarHBondContact CA-OE2 3.44Å; V616-L621 HydrophobicContact CG1-CD2 3.77Å; V616-L621 HydrophobicContact CG1-CG 4.31Å
617	T	91.8	Very high	86.8	Confident	17 Å²	17	37.4 Å²	37.4	10%	0.104	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-100.7	158	173	77.2	0	0	0	0	113.1	R365 V434 A619 E620 L621	R365-T617 WeakPolarHBondContact O-CA 3.43Å; V434-T617 HydrophobicContact CG2-CG2 4.22Å; V434-T617 WeakPolarHBondContact CG2-OG1 3.34Å; T617-A619 PolarHBondContact O-N 3.14Å; T617-A619 PolarHBondContact OG1-N 3.46Å; T617-E620 WeakPolarHBondContact CB-OE1 3.5Å; T617-E620 VanDerWaalsContact CG2-OE1 3.31Å; T617-E620 WeakPolarHBondContact CG2-OE1 3.44Å; T617-E620 PolarHBondContact N-OE1 3.13Å; T617-E620 PolarHBondContact N-OE2 3.24Å; T617-E620 PolarHBondContact O-N 3.41Å; T617-E620 VanDerWaalsContact O-N 3.12Å; T617-E620 VanDerWaalsContact OG1-CD 3.25Å; T617-E620 PolarHBondContact OG1-N 2.88Å; T617-E620 PolarHBondContact OG1-OE1 2.84Å; T617-L621 PolarHBondContact O-N 3.2Å
618	L	91.4	Very high	86.7	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.8	-22.6	172.7	-69.4	172.6	0	0	0	112.8	V361 L363 R365 V367 L370 L621 Y622 L631	V361-L618 HydrophobicContact CB-CD1 3.89Å; V361-L618 HydrophobicContact CG1-CD1 3.38Å; L363-L618 HydrophobicContact CD2-CB 4.13Å; L363-L618 CarbonylContact O-C 3.47Å; R365-L618 HydrophobicContact CB-CD1 4.27Å; R365-L618 PolarHBondContact O-N 3.19Å; V367-L618 HydrophobicContact CG2-CD2 4.04Å; V367-L618 HydrophobicContact CG2-CG 4.38Å; L370-L618 HydrophobicContact CD2-CD2 4.25Å; L618-L621 HydrophobicContact CD2-CD1 4.23Å; L618-Y622 VanDerWaalsContact O-CB 3.25Å; L618-Y622 WeakPolarHBondContact O-CB 2.95Å; L618-Y622 PolarHBondContact O-N 2.93Å; L618-L631 HydrophobicContact CD2-CD1 4.46Å
619	A	90.4	Very high	86.4	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-70.1	-36.4	173	0	0	0	0	0	112.6	L329 L363 V434 V443 T617 L623	L329-A619 HydrophobicContact CD1-CB 3.77Å; L363-A619 HydrophobicContact CB-CB 4.03Å; L363-A619 WeakPolarHBondContact O-CB 3.44Å; L363-A619 PolarHBondContact O-N 3.44Å; V434-A619 HydrophobicContact CB-CB 4.46Å; V434-A619 HydrophobicContact CG1-CB 3.7Å; V434-A619 HydrophobicContact CG2-CB 3.98Å; V443-A619 HydrophobicContact CG2-CB 4.08Å; T617-A619 PolarHBondContact O-N 3.14Å; T617-A619 PolarHBondContact OG1-N 3.46Å; A619-L623 WeakPolarHBondContact O-CG 3.3Å; A619-L623 PolarHBondContact O-N 3.39Å; A619-L623 VanDerWaalsContact O-N 3.11Å
620	E	90	Very high	86.6	Confident	26 Å²	26	46.1 Å²	46.1	12%	0.121	26%	0.257	C	S	.	.	H	α-helix	trans	-65.3	-49.2	170	-70.8	124.8	-120.8	0	0	110.2	L428 V431 V616 T617 Y622 L623 M624	L428-E620 HydrophobicContact CD1-CB 4.29Å; L428-E620 WeakPolarHBondContact CD1-O 3.35Å; V431-E620 HydrophobicContact CB-CG 3.88Å; V431-E620 HydrophobicContact CG1-CG 4.21Å; V431-E620 HydrophobicContact CG2-CG 3.64Å; V616-E620 VanDerWaalsContact CA-OE2 3.25Å; V616-E620 WeakPolarHBondContact CA-OE2 3.44Å; T617-E620 WeakPolarHBondContact CB-OE1 3.5Å; T617-E620 VanDerWaalsContact CG2-OE1 3.31Å; T617-E620 WeakPolarHBondContact CG2-OE1 3.44Å; T617-E620 PolarHBondContact N-OE1 3.13Å; T617-E620 PolarHBondContact N-OE2 3.24Å; T617-E620 PolarHBondContact O-N 3.41Å; T617-E620 VanDerWaalsContact O-N 3.12Å; T617-E620 VanDerWaalsContact OG1-CD 3.25Å; T617-E620 PolarHBondContact OG1-N 2.88Å; T617-E620 PolarHBondContact OG1-OE1 2.84Å; E620-Y622 VanDerWaalsContact C-N 3.27Å; E620-Y622 PolarHBondContact O-N 2.86Å; E620-L623 CarbonylContact O-C 3.56Å; E620-L623 WeakPolarHBondContact O-CA 3.24Å; E620-L623 WeakPolarHBondContact O-CB 3.25Å; E620-L623 PolarHBondContact O-N 2.92Å; E620-M624 WeakPolarHBondContact O-CG 3.45Å; E620-M624 PolarHBondContact O-N 2.79Å
621	L	90.2	Very high	87	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-55.4	-45.3	176.2	-60.5	-160.7	0	0	0	111.5	V367 W608 V616 T617 L618 L623 M624 F625 L631 L633	V367-L621 HydrophobicContact CG2-CD1 3.68Å; V367-L621 HydrophobicContact CG2-CG 3.94Å; W608-L621 HydrophobicContact CD2-CD2 4.43Å; W608-L621 HydrophobicContact CE3-CD1 4.42Å; W608-L621 HydrophobicContact CH2-CD1 4.26Å; W608-L621 HydrophobicContact CH2-CD2 3.76Å; W608-L621 HydrophobicContact CZ2-CD1 4.41Å; W608-L621 HydrophobicContact CZ2-CD2 3.26Å; W608-L621 HydrophobicContact CZ2-CG 4.47Å; W608-L621 HydrophobicContact CZ3-CD1 4.26Å; W608-L621 HydrophobicContact CZ3-CD2 4.49Å; V616-L621 HydrophobicContact CG1-CD2 3.77Å; V616-L621 HydrophobicContact CG1-CG 4.31Å; T617-L621 PolarHBondContact O-N 3.2Å; L618-L621 HydrophobicContact CD2-CD1 4.23Å; L621-L623 PolarHBondContact O-N 3.27Å; L621-M624 HydrophobicContact CD2-SD 3.99Å; L621-M624 PolarHBondContact O-N 3.22Å; L621-M624 VanDerWaalsContact O-N 3.16Å; L621-F625 HydrophobicContact CB-CD2 4.3Å; L621-F625 HydrophobicContact CB-CE2 4.13Å; L621-F625 WeakPolarHBondContact O-CD2 3.29Å; L621-F625 PolarHBondContact O-N 3.23Å; L621-L631 HydrophobicContact CB-CD2 4.4Å; L621-L633 HydrophobicContact CD1-CD1 4.34Å; L621-L633 HydrophobicContact CD1-CD2 4.4Å
622	Y	90.6	Very high	87.5	Confident	22 Å²	22	40.4 Å²	40.4	9%	0.086	23%	0.234	C	C	.	.	H	α-helix	trans	-58.5	-32.7	176.5	-174.4	-96.8	0	0	0	113.8	L329 P330 V333 L363 L618 E620 K627 P628 L631	L329-Y622 HydrophobicContact CD1-CD1 4.02Å; L329-Y622 HydrophobicContact CD2-CD1 3.89Å; L329-Y622 HydrophobicContact CD2-CE1 3.95Å; L329-Y622 HydrophobicContact CG-CD1 4.38Å; P330-Y622 HydrophobicContact CG-CE1 4.43Å; V333-Y622 HydrophobicContact CB-CD2 4.38Å; V333-Y622 HydrophobicContact CB-CE2 4.42Å; V333-Y622 HydrophobicContact CG1-CD2 4.04Å; V333-Y622 HydrophobicContact CG1-CE2 4.03Å; V333-Y622 HydrophobicContact CG2-CD2 3.7Å; V333-Y622 HydrophobicContact CG2-CE2 3.51Å; L363-Y622 HydrophobicContact CD1-CD1 3.96Å; L363-Y622 HydrophobicContact CD1-CD2 4.27Å; L363-Y622 HydrophobicContact CD1-CE1 4.45Å; L363-Y622 HydrophobicContact CD1-CG 3.86Å; L363-Y622 HydrophobicContact CD2-CD2 4.3Å; L363-Y622 HydrophobicContact CD2-CG 4.2Å; L618-Y622 VanDerWaalsContact O-CB 3.25Å; L618-Y622 WeakPolarHBondContact O-CB 2.95Å; L618-Y622 PolarHBondContact O-N 2.93Å; E620-Y622 VanDerWaalsContact C-N 3.27Å; E620-Y622 PolarHBondContact O-N 2.86Å; Y622-K627 HydrophobicContact CD1-CB 4.41Å; Y622-K627 HydrophobicContact CD1-CG 4.45Å; Y622-K627 HydrophobicContact CE1-CB 3.7Å; Y622-K627 HydrophobicContact CE1-CG 4Å; Y622-K627 VanDerWaalsContact O-CA 3.25Å; Y622-K627 WeakPolarHBondContact O-CA 3.49Å; Y622-K627 PolarHBondContact O-N 3.11Å; Y622-K627 PolarHBondContact OH-O 2.64Å; Y622-P628 HydrophobicContact CD2-CG 4.47Å; Y622-P628 WeakPolarHBondContact CE2-O 3.44Å; Y622-P628 WeakPolarHBondContact O-CD 3.4Å; Y622-L631 HydrophobicContact CD2-CG 4.48Å
623	L	89.6	Confident	88.2	Confident	14 Å²	14	37.1 Å²	37.1	7%	0.073	22%	0.217	C	C	.	.	H	α-helix	trans	-78.3	-42.3	173.7	-78.2	164.6	0	0	0	111.9	V327 L329 L428 V443 W445 A619 E620 L621 F625 G626 K627	V327-L623 HydrophobicContact CG1-CD2 4.22Å; L329-L623 HydrophobicContact CD1-CD1 4.1Å; L329-L623 HydrophobicContact CD1-CG 4.14Å; L329-L623 HydrophobicContact CD2-CD2 4.01Å; L329-L623 HydrophobicContact CD2-CG 4.23Å; L428-L623 HydrophobicContact CD1-CB 3.56Å; L428-L623 HydrophobicContact CD2-CB 3.85Å; L428-L623 HydrophobicContact CG-CB 4.36Å; V443-L623 HydrophobicContact CB-CD1 4.13Å; V443-L623 HydrophobicContact CG1-CD1 4.05Å; V443-L623 HydrophobicContact CG2-CD1 3.77Å; W445-L623 HydrophobicContact CH2-CD1 3.81Å; W445-L623 HydrophobicContact CZ2-CD1 4.49Å; W445-L623 HydrophobicContact CZ3-CD1 4.38Å; A619-L623 WeakPolarHBondContact O-CG 3.3Å; A619-L623 PolarHBondContact O-N 3.39Å; A619-L623 VanDerWaalsContact O-N 3.11Å; E620-L623 CarbonylContact O-C 3.56Å; E620-L623 WeakPolarHBondContact O-CA 3.24Å; E620-L623 WeakPolarHBondContact O-CB 3.25Å; E620-L623 PolarHBondContact O-N 2.92Å; L621-L623 PolarHBondContact O-N 3.27Å; L623-F625 VanDerWaalsContact C-N 3.27Å; L623-F625 PolarHBondContact O-N 3.01Å; L623-G626 PolarHBondContact O-N 2.92Å; L623-K627 HydrophobicContact CD2-CG 4.25Å
624	M	88	Confident	88.8	Confident	19 Å²	19	38.4 Å²	38.4	9%	0.094	22%	0.223	C	C	.	.	H	α-helix	trans	-59.5	-35	176.7	-66.3	178.7	83	0	0	112.8	L425 T426 L428 I603 E620 L621 G626	L425-M624 WeakPolarHBondContact CA-O 3.45Å; L425-M624 HydrophobicContact CD2-CB 3.76Å; L425-M624 HydrophobicContact CD2-CE 4.06Å; T426-M624 PolarHBondContact N-O 3.3Å; T426-M624 PolarHBondContact OG1-O 2.86Å; T426-M624 VanDerWaalsContact OG1-O 3.13Å; L428-M624 HydrophobicContact CD1-CG 3.63Å; L428-M624 HydrophobicContact CG-CG 3.76Å; I603-M624 HydrophobicContact CD1-CE 3.67Å; E620-M624 WeakPolarHBondContact O-CG 3.45Å; E620-M624 PolarHBondContact O-N 2.79Å; L621-M624 HydrophobicContact CD2-SD 3.99Å; L621-M624 PolarHBondContact O-N 3.22Å; L621-M624 VanDerWaalsContact O-N 3.16Å; M624-G626 VanDerWaalsContact C-N 3.27Å; M624-G626 PolarHBondContact O-N 2.7Å
625	F	86.9	Confident	89.4	Confident	19 Å²	19	33.1 Å²	33.1	8%	0.083	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	13.5	176	-64.8	-63.1	0	0	0	113.7	P419 S423 L425 W608 L621 L623 P628 L631 L633	P419-F625 HydrophobicContact CB-CE1 3.76Å; P419-F625 HydrophobicContact CB-CZ 3.79Å; S423-F625 VanDerWaalsContact OG-CE1 3.29Å; S423-F625 WeakPolarHBondContact OG-CE1 3.49Å; L425-F625 HydrophobicContact CD2-CD1 3.63Å; L425-F625 HydrophobicContact CD2-CE1 3.32Å; L425-F625 HydrophobicContact CD2-CE2 4.39Å; L425-F625 HydrophobicContact CD2-CG 4.28Å; L425-F625 HydrophobicContact CD2-CZ 3.76Å; L425-F625 HydrophobicContact CG-CD1 4.23Å; L425-F625 HydrophobicContact CG-CE1 3.81Å; W608-F625 HydrophobicContact CH2-CE2 4.44Å; W608-F625 HydrophobicContact CH2-CZ 4.09Å; L621-F625 HydrophobicContact CB-CD2 4.3Å; L621-F625 HydrophobicContact CB-CE2 4.13Å; L621-F625 WeakPolarHBondContact O-CD2 3.29Å; L621-F625 PolarHBondContact O-N 3.23Å; L623-F625 VanDerWaalsContact C-N 3.27Å; L623-F625 PolarHBondContact O-N 3.01Å; F625-P628 HydrophobicContact CB-CG 3.78Å; F625-P628 WeakPolarHBondContact O-CD 3.19Å; F625-L631 HydrophobicContact CD2-CD2 3.41Å; F625-L631 VanDerWaalsContact CD2-CD2 3.41Å; F625-L631 HydrophobicContact CE2-CD2 3.99Å; F625-L631 HydrophobicContact CG-CD2 4.37Å; F625-L633 HydrophobicContact CE2-CD2 3.87Å; F625-L633 HydrophobicContact CZ-CD2 3.89Å
626	G	83.8	Confident	90	Very high	57 Å²	57	29.6 Å²	29.6	59%	0.588	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.5	33.4	174.9	0	0	0	0	0	115.6	L623 M624	L623-G626 PolarHBondContact O-N 2.92Å; M624-G626 VanDerWaalsContact C-N 3.27Å; M624-G626 PolarHBondContact O-N 2.7Å
627	K	85.8	Confident	90.1	Very high	98 Å²	98	29 Å²	29	43%	0.426	17%	0.173	S	C	.	.	S	Bend	trans	60.9	49	-179.7	-52.8	169.5	-177.9	171.1	0	113.7	E322 Y622 L623	E322-K627 IonicContact OE1-NZ 3.95Å; E322-K627 PolarHBondContact OE1-NZ 2.92Å; Y622-K627 HydrophobicContact CD1-CB 4.41Å; Y622-K627 HydrophobicContact CD1-CG 4.45Å; Y622-K627 HydrophobicContact CE1-CB 3.7Å; Y622-K627 HydrophobicContact CE1-CG 4Å; Y622-K627 VanDerWaalsContact O-CA 3.25Å; Y622-K627 WeakPolarHBondContact O-CA 3.49Å; Y622-K627 PolarHBondContact O-N 3.11Å; Y622-K627 PolarHBondContact OH-O 2.64Å; L623-K627 HydrophobicContact CD2-CG 4.25Å
628	P	84.8	Confident	89.8	Confident	33 Å²	33	31.6 Å²	31.6	21%	0.214	18%	0.184	C	C	.	.			trans	-71.9	156.6	-169.6	34.5	-38.2	0	0	0	112.7	Y622 F625 K630 L631	Y622-P628 HydrophobicContact CD2-CG 4.47Å; Y622-P628 WeakPolarHBondContact CE2-O 3.44Å; Y622-P628 WeakPolarHBondContact O-CD 3.4Å; F625-P628 HydrophobicContact CB-CG 3.78Å; F625-P628 WeakPolarHBondContact O-CD 3.19Å; P628-K630 WeakPolarHBondContact CB-O 3.24Å; P628-K630 WeakPolarHBondContact CG-O 3.32Å; P628-K630 PolarHBondContact O-N 3.12Å; P628-K630 VanDerWaalsContact O-N 3.16Å; P628-L631 HydrophobicContact CG-CD2 4.27Å
629	G	84.8	Confident	89.3	Confident	81 Å²	81	36.2 Å²	36.2	84%	0.835	21%	0.214	S	C	*	.	S	Bend	trans	-63.3	-21.3	176.4	0	0	0	0	0	114.4
630	K	91.3	Very high	88.3	Confident	82 Å²	82	38.2 Å²	38.2	36%	0.357	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	144.7	173	51.5	168.9	178.4	172.3	0	109.8	A334 E336 P628 Q632	A334-K630 HydrophobicContact CB-CB 4.29Å; A334-K630 CarbonylContact O-C 3.43Å; A334-K630 VanDerWaalsContact O-CA 3.31Å; A334-K630 WeakPolarHBondContact O-CA 3.13Å; A334-K630 WeakPolarHBondContact O-CB 3.37Å; E336-K630 VanDerWaalsContact CD-CD 3.41Å; E336-K630 HydrophobicContact CG-CD 4.3Å; E336-K630 VanDerWaalsContact OE1-CD 3.25Å; E336-K630 WeakPolarHBondContact OE1-CD 3.43Å; E336-K630 IonicContact OE1-NZ 3.75Å; E336-K630 PolarHBondContact OE1-NZ 2.85Å; E336-K630 WeakPolarHBondContact OE2-CD 3.35Å; E336-K630 WeakPolarHBondContact OE2-CE 3.35Å; E336-K630 IonicContact OE2-NZ 3.39Å; E336-K630 PolarHBondContact OE2-NZ 3.3Å; P628-K630 WeakPolarHBondContact CB-O 3.24Å; P628-K630 WeakPolarHBondContact CG-O 3.32Å; P628-K630 PolarHBondContact O-N 3.12Å; P628-K630 VanDerWaalsContact O-N 3.16Å; K630-Q632 HydrophobicContact CD-CG 4.14Å; K630-Q632 HydrophobicContact CG-CG 4.34Å; K630-Q632 VanDerWaalsContact NZ-NE2 3.14Å
631	L	92.7	Very high	86.6	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	120.4	169.5	-74.8	169	0	0	0	108.2	V333 A334 V335 E336 L363 L618 L621 Y622 F625 P628	V333-L631 HydrophobicContact CG1-CD1 4.24Å; V333-L631 HydrophobicContact CG1-CG 4.04Å; A334-L631 PolarHBondContact O-N 3.05Å; V335-L631 CarbonylContact C-O 3.57Å; V335-L631 WeakPolarHBondContact CA-O 3.49Å; V335-L631 HydrophobicContact CG1-CB 4.41Å; V335-L631 HydrophobicContact CG2-CB 4.22Å; V335-L631 HydrophobicContact CG2-CD1 4.1Å; E336-L631 PolarHBondContact N-O 3.05Å; L363-L631 HydrophobicContact CD2-CD1 4.34Å; L618-L631 HydrophobicContact CD2-CD1 4.46Å; L621-L631 HydrophobicContact CB-CD2 4.4Å; Y622-L631 HydrophobicContact CD2-CG 4.48Å; F625-L631 HydrophobicContact CD2-CD2 3.41Å; F625-L631 VanDerWaalsContact CD2-CD2 3.41Å; F625-L631 HydrophobicContact CE2-CD2 3.99Å; F625-L631 HydrophobicContact CG-CD2 4.37Å; P628-L631 HydrophobicContact CG-CD2 4.27Å
632	Q	93.3	Very high	84.1	Confident	60 Å²	60	45.2 Å²	45.2	28%	0.28	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	117.3	171.6	-62	-163.8	-66.5	0	0	108.6	E336 A420 K630	E336-Q632 HydrophobicContact CB-CG 4.4Å; E336-Q632 PolarHBondContact OE2-NE2 3.04Å; A420-Q632 HydrophobicContact CB-CB 4.07Å; K630-Q632 HydrophobicContact CD-CG 4.14Å; K630-Q632 HydrophobicContact CG-CG 4.34Å; K630-Q632 VanDerWaalsContact NZ-NE2 3.14Å
633	L	94.7	Very high	81.6	Confident	2 Å²	2	50 Å²	50	1%	0.01	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	147.5	-179.4	-65.4	177	0	0	0	109.4	V335 E336 L337 Q338 F418 W608 L621 F625	V335-L633 HydrophobicContact CG1-CD1 4.03Å; E336-L633 PolarHBondContact O-N 3.26Å; L337-L633 VanDerWaalsContact CA-O 3.32Å; L337-L633 WeakPolarHBondContact CA-O 3.46Å; L337-L633 HydrophobicContact CD2-CB 3.89Å; Q338-L633 PolarHBondContact N-O 3.42Å; F418-L633 WeakPolarHBondContact O-CA 3.37Å; F418-L633 WeakPolarHBondContact O-CD2 3.41Å; W608-L633 HydrophobicContact CZ3-CD2 3.81Å; L621-L633 HydrophobicContact CD1-CD1 4.34Å; L621-L633 HydrophobicContact CD1-CD2 4.4Å; F625-L633 HydrophobicContact CE2-CD2 3.87Å; F625-L633 HydrophobicContact CZ-CD2 3.89Å
634	E	94.4	Very high	79	Confident	26 Å²	26	54.8 Å²	54.8	12%	0.121	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	158.9	169.4	-72.2	170.9	-147.4	0	0	110	Q338 R340 L417 F418 A420 E421	Q338-E634 CarbonylContact O-C 3.58Å; Q338-E634 WeakPolarHBondContact O-CA 3.34Å; R340-E634 HydrophobicContact CB-CB 4.21Å; R340-E634 WeakPolarHBondContact CG-OE2 3.33Å; L417-E634 CarbonylContact C-O 3.57Å; L417-E634 VanDerWaalsContact CA-O 3.31Å; L417-E634 WeakPolarHBondContact CA-O 3.44Å; F418-E634 HydrophobicContact CB-CB 4.21Å; F418-E634 PolarHBondContact N-O 3.06Å; F418-E634 PolarHBondContact O-N 3.14Å; A420-E634 VanDerWaalsContact CA-OE1 3.22Å; A420-E634 WeakPolarHBondContact CA-OE1 3.43Å; A420-E634 HydrophobicContact CB-CG 4.44Å; E421-E634 PolarHBondContact N-OE1 3.48Å
635	Y	94.1	Very high	76.2	Confident	0 Å²	0	57 Å²	57	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	147.4	176.7	75.3	-95.3	0	0	0	112	L337 Q338 P339 R340 S344 V348 P355 L357 W378 L415 T416	L337-Y635 HydrophobicContact CB-CD1 4.32Å; Q338-Y635 VanDerWaalsContact C-CD1 3.42Å; Q338-Y635 VanDerWaalsContact C-CE1 3.44Å; Q338-Y635 WeakPolarHBondContact O-CD1 3.22Å; Q338-Y635 PolarHBondContact O-N 3.44Å; P339-Y635 WeakPolarHBondContact CA-O 3.29Å; P339-Y635 HydrophobicContact CB-CE1 3.96Å; P339-Y635 HydrophobicContact CB-CE2 4.06Å; P339-Y635 HydrophobicContact CG-CE1 4.39Å; R340-Y635 PolarHBondContact N-O 3.22Å; S344-Y635 PolarHBondContact O-OH 3.37Å; V348-Y635 HydrophobicContact CG2-CE2 3.83Å; V348-Y635 WeakPolarHBondContact CG2-OH 3.34Å; P355-Y635 VanDerWaalsContact O-CE1 3.3Å; P355-Y635 WeakPolarHBondContact O-CE1 3.31Å; P355-Y635 PolarHBondContact O-OH 3.4Å; L357-Y635 HydrophobicContact CD1-CE1 4.09Å; W378-Y635 AromaticContact CH2-CD1 3.9Å; W378-Y635 HydrophobicContact CH2-CD1 3.9Å; W378-Y635 AromaticContact CH2-CD2 3.96Å; W378-Y635 HydrophobicContact CH2-CD2 3.96Å; W378-Y635 AromaticContact CH2-CE1 3.62Å; W378-Y635 HydrophobicContact CH2-CE1 3.62Å; W378-Y635 AromaticContact CH2-CE2 3.7Å; W378-Y635 HydrophobicContact CH2-CE2 3.7Å; W378-Y635 HydrophobicContact CH2-CG 4.07Å; W378-Y635 AromaticContact CH2-CZ 3.53Å; W378-Y635 HydrophobicContact CZ2-CE1 4.34Å; W378-Y635 HydrophobicContact CZ3-CD1 4.47Å; W378-Y635 AromaticContact CZ3-CD2 3.87Å; W378-Y635 HydrophobicContact CZ3-CD2 3.87Å; W378-Y635 HydrophobicContact CZ3-CE1 4.47Å; W378-Y635 AromaticContact CZ3-CE2 3.89Å; W378-Y635 HydrophobicContact CZ3-CE2 3.89Å; W378-Y635 HydrophobicContact CZ3-CG 4.18Å; L415-Y635 HydrophobicContact CD1-CD2 3.91Å; L415-Y635 HydrophobicContact CD1-CG 4.4Å; T416-Y635 WeakPolarHBondContact O-CA 3.21Å
636	E	93.4	Very high	73.9	Confident	40 Å²	40	64 Å²	64	19%	0.187	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	143.1	176.2	-172.1	159.9	-124.9	0	0	112.6	R340 S341 S344 L415 T416 F418 Q638	R340-E636 HydrophobicContact CB-CB 4.41Å; S341-E636 WeakPolarHBondContact CB-OE1 3.48Å; S341-E636 PolarHBondContact OG-OE1 3.06Å; S344-E636 WeakPolarHBondContact OG-CA 3.34Å; L415-E636 WeakPolarHBondContact CA-O 3.37Å; L415-E636 WeakPolarHBondContact CD1-O 3.45Å; T416-E636 PolarHBondContact N-O 3.11Å; T416-E636 PolarHBondContact O-N 3.1Å; T416-E636 PolarHBondContact OG1-O 3.19Å; F418-E636 HydrophobicContact CD2-CB 4.39Å; F418-E636 HydrophobicContact CE2-CB 3.89Å; E636-Q638 HydrophobicContact CB-CG 4.36Å; E636-Q638 HydrophobicContact CG-CG 3.74Å; E636-Q638 PolarHBondContact OE2-NE2 3.19Å
637	W	90.2	Very high	71.5	Confident	13 Å²	13	70 Å²	70	5%	0.049	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	103.4	168.6	-70.7	96.3	0	0	0	109.9	S344 K375 W378 Q413 E414 L415	S344-W637 PolarHBondContact OG-N 2.89Å; K375-W637 HydrophobicContact CG-CH2 4.19Å; K375-W637 HydrophobicContact CG-CZ3 4.4Å; W378-W637 HydrophobicContact CB-CH2 4.46Å; W378-W637 HydrophobicContact CB-CZ2 3.79Å; W378-W637 HydrophobicContact CD2-CZ2 4.45Å; W378-W637 AromaticContact CE3-CZ2 3.82Å; W378-W637 HydrophobicContact CE3-CZ2 3.82Å; Q413-W637 HydrophobicContact CB-CE3 3.85Å; E414-W637 WeakPolarHBondContact O-CA 3.31Å; L415-W637 HydrophobicContact CB-CD2 4.37Å; L415-W637 HydrophobicContact CB-CE3 4.07Å; L415-W637 HydrophobicContact CB-CH2 4.3Å; L415-W637 HydrophobicContact CB-CZ3 4.04Å; L415-W637 HydrophobicContact CD1-CD2 4.07Å; L415-W637 HydrophobicContact CD1-CG 4.33Å; L415-W637 HydrophobicContact CD1-CZ2 4.35Å; L415-W637 HydrophobicContact CD2-CZ2 4.34Å
638	Q	85.1	Confident	69.3	Low	71 Å²	71	74.5 Å²	74.5	33%	0.332	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	142	-179.7	-60	-173.7	-4.8	0	0	110.4	Q413 E414 E636 T640	Q413-Q638 CarbonylContact C-O 3.54Å; Q413-Q638 VanDerWaalsContact CA-O 3.23Å; Q413-Q638 WeakPolarHBondContact CA-O 3.4Å; E414-Q638 PolarHBondContact N-O 2.89Å; E414-Q638 PolarHBondContact O-N 2.81Å; E636-Q638 HydrophobicContact CB-CG 4.36Å; E636-Q638 HydrophobicContact CG-CG 3.74Å; E636-Q638 PolarHBondContact OE2-NE2 3.19Å; Q638-T640 PolarHBondContact O-N 3.44Å
639	P	80.9	Confident	66.7	Low	97 Å²	97	80.4 Å²	80.4	63%	0.63	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62	127	171.8	-19.9	32.6	0	0	0	110.8	A641	P639-A641 PolarHBondContact O-N 2.87Å
640	T	69.4	Low	64.7	Low	41 Å²	41	80 Å²	80	25%	0.252	48%	0.483	S	S	.	.			trans	-68.7	104.4	174.4	-54	0	0	0	0	109.1	Q412 E414 Q638	Q412-T640 VanDerWaalsContact O-CB 3.3Å; Q412-T640 WeakPolarHBondContact O-CB 3.34Å; Q412-T640 PolarHBondContact O-N 3.28Å; Q412-T640 PolarHBondContact O-OG1 3.12Å; Q412-T640 VanDerWaalsContact O-OG1 3.09Å; E414-T640 PolarHBondContact N-OG1 3.08Å; Q638-T640 PolarHBondContact O-N 3.44Å
641	A	54.4	Low	61.8	Low	87 Å²	87	85.3 Å²	85.3	72%	0.719	51%	0.509	S	S	*	.			trans	-61.9	134.6	163	0	0	0	0	0	108.9	P639	P639-A641 PolarHBondContact O-N 2.87Å
642	A	37.3	Very low	58.8	Low	86 Å²	86	92.1 Å²	92.1	71%	0.711	54%	0.541	S	S	*	.			trans	-65.1	142.4	172.1	0	0	0	0	0	109.4	S644	A642-S644 PolarHBondContact O-N 2.92Å
643	P	39.7	Very low	55.8	Low	123 Å²	123	93 Å²	93	80%	0.799	56%	0.559	S	S	*	*			trans	-63.7	111.9	175	26.9	-33.2	0	0	0	109.1	G645	P643-G645 PolarHBondContact O-N 3.49Å; P643-G645 VanDerWaalsContact O-N 3.12Å
644	S	33.7	Very low	52.9	Low	114 Å²	114	99.1 Å²	99.1	80%	0.797	60%	0.599	S	S	*	*			trans	-68.7	105.4	174.5	50.6	0	0	0	0	109.4	A642	A642-S644 PolarHBondContact O-N 2.92Å
645	G	30.3	Very low	50	Low	66 Å²	66	104.3 Å²	104.3	68%	0.68	62%	0.621	S	S	*	*			trans	-62	152.3	161.9	0	0	0	0	0	110.3	P643 Q647	P643-G645 PolarHBondContact O-N 3.49Å; P643-G645 VanDerWaalsContact O-N 3.12Å; G645-Q647 PolarHBondContact O-N 3.42Å
646	N	38	Very low	47.2	Very low	166 Å²	166	109.1 Å²	109.1	89%	0.888	65%	0.652	S	S	*	*			trans	-56.2	111.2	-172.4	-63.8	-5.6	0	0	0	112.2
647	Q	34.2	Very low	45	Very low	184 Å²	184	113.3 Å²	113.3	86%	0.86	68%	0.676	S	S	*	*			trans	-134.2	115.7	152.4	-76.9	-163	-7.1	0	0	109.1	G645 N649	G645-Q647 PolarHBondContact O-N 3.42Å; Q647-N649 PolarHBondContact O-N 3.32Å
648	E	37.9	Very low	43.1	Very low	192 Å²	192	123.3 Å²	123.3	90%	0.897	71%	0.714	S	S	*	*			trans	-77.2	92	169.7	-175.5	-177.3	142.5	0	0	108.9
649	N	30.5	Very low	41.8	Very low	157 Å²	157	124.4 Å²	124.4	84%	0.84	73%	0.725	S	S	*	*			trans	-153.1	148	157.8	-150	-23.6	0	0	0	111.2	Q647 Q651	Q647-N649 PolarHBondContact O-N 3.32Å; N649-Q651 PolarHBondContact O-N 3.4Å
650	G	43.7	Very low	40.6	Very low	71 Å²	71	124.5 Å²	124.5	73%	0.732	72%	0.717	S	S	*	*			trans	-78.1	100	-168.8	0	0	0	0	0	114.1
651	Q	29.9	Very low	40.3	Very low	194 Å²	194	131.6 Å²	131.6	91%	0.907	74%	0.739	S	S	*	*			trans	-130.2	143.8	156.6	-77.2	-166.9	-21.1	0	0	111.3	N649	N649-Q651 PolarHBondContact O-N 3.4Å
652	E	29.1	Very low	41.3	Very low	144 Å²	144	131.3 Å²	131.3	67%	0.673	73%	0.729	S	S	*	*			trans	-67.8	138.2	-172.9	-61.7	-178.3	114.7	0	0	112.5	K655	E652-K655 VanDerWaalsContact CD-CE 3.46Å; E652-K655 WeakPolarHBondContact OE1-CE 3.42Å; E652-K655 IonicContact OE1-NZ 3.81Å; E652-K655 PolarHBondContact OE1-NZ 3.07Å; E652-K655 WeakPolarHBondContact OE2-CE 3.2Å; E652-K655 IonicContact OE2-NZ 3.81Å; E652-K655 PolarHBondContact OE2-NZ 3.31Å
653	A	29.8	Very low	43	Very low	80 Å²	80	132.4 Å²	132.4	66%	0.661	72%	0.722	S	S	*	*			trans	-54.7	145.4	164.1	0	0	0	0	0	110.7	K655	A653-K655 PolarHBondContact O-N 3.39Å
654	P	35.3	Very low	44.2	Very low	129 Å²	129	134.8 Å²	134.8	84%	0.838	72%	0.715	S	S	*	*			trans	-60.5	105.8	-175.1	24	-34.2	0	0	0	110.9
655	K	32.2	Very low	45.7	Very low	135 Å²	135	132.9 Å²	132.9	59%	0.587	70%	0.701	S	S	*	*			trans	-53.6	124.4	-176.3	-77.1	164.3	170.8	156.6	0	110.4	E652 A653 N657	E652-K655 VanDerWaalsContact CD-CE 3.46Å; E652-K655 WeakPolarHBondContact OE1-CE 3.42Å; E652-K655 IonicContact OE1-NZ 3.81Å; E652-K655 PolarHBondContact OE1-NZ 3.07Å; E652-K655 WeakPolarHBondContact OE2-CE 3.2Å; E652-K655 IonicContact OE2-NZ 3.81Å; E652-K655 PolarHBondContact OE2-NZ 3.31Å; A653-K655 PolarHBondContact O-N 3.39Å; K655-N657 PolarHBondContact O-N 2.81Å
656	P	37	Very low	48.1	Very low	102 Å²	102	134 Å²	134	66%	0.662	69%	0.691	S	S	*	*			trans	-58.6	136	173.6	24.8	-33.3	0	0	0	109.2
657	N	46.5	Very low	49.9	Very low	128 Å²	128	132 Å²	132	68%	0.684	68%	0.679	S	S	*	*			trans	-43.6	143.5	-164.9	-80	-62.4	0	0	0	114.1	K655 T659 H660	K655-N657 PolarHBondContact O-N 2.81Å; N657-T659 PolarHBondContact O-N 2.93Å; N657-H660 WeakPolarHBondContact O-CA 3.28Å; N657-H660 VanDerWaalsContact O-CB 3.29Å; N657-H660 WeakPolarHBondContact O-CB 3.39Å; N657-H660 PolarHBondContact O-N 3.19Å
658	R	50.4	Low	51.6	Low	222 Å²	222	130.7 Å²	130.7	84%	0.838	67%	0.671	S	S	*	*	H	α-helix	trans	-49.6	-34	-179.2	-172.2	174.8	178.9	170.9	-1.3	113	H660 R661 V662	R658-H660 VanDerWaalsContact C-N 3.31Å; R658-H660 PolarHBondContact O-N 2.8Å; R658-R661 PolarHBondContact O-N 3.06Å; R658-V662 PolarHBondContact O-N 2.94Å
659	T	57	Low	53.3	Low	94 Å²	94	126.5 Å²	126.5	58%	0.577	65%	0.654	S	S	*	*	H	α-helix	trans	-56.1	-38.7	172.1	49.9	0	0	0	0	113.5	N657 R661 V662 L663	N657-T659 PolarHBondContact O-N 2.93Å; T659-R661 VanDerWaalsContact C-N 3.33Å; T659-R661 PolarHBondContact O-N 2.88Å; T659-V662 PolarHBondContact O-N 3.08Å; T659-L663 WeakPolarHBondContact O-CB 3.48Å; T659-L663 WeakPolarHBondContact O-CG 3.47Å; T659-L663 PolarHBondContact O-N 2.91Å
660	H	55.5	Low	55.3	Low	100 Å²	100	122.4 Å²	122.4	46%	0.463	63%	0.634	S	S	.	*	H	α-helix	trans	-73	-23.4	-178.2	-145.6	-65.9	0	0	0	113.1	N657 R658 R664	N657-H660 WeakPolarHBondContact O-CA 3.28Å; N657-H660 VanDerWaalsContact O-CB 3.29Å; N657-H660 WeakPolarHBondContact O-CB 3.39Å; N657-H660 PolarHBondContact O-N 3.19Å; R658-H660 VanDerWaalsContact C-N 3.31Å; R658-H660 PolarHBondContact O-N 2.8Å; H660-R664 WeakPolarHBondContact O-CB 3.49Å; H660-R664 WeakPolarHBondContact O-CG 3.47Å; H660-R664 PolarHBondContact O-N 3.46Å
661	R	64.2	Low	56.2	Low	190 Å²	190	123.4 Å²	123.4	72%	0.717	63%	0.63	S	S	*	*	H	α-helix	trans	-72.4	-49.3	165.8	-77.5	-170.7	172.6	-158.7	-2.2	110.8	R658 T659 L663 R664 C665	R658-R661 PolarHBondContact O-N 3.06Å; T659-R661 VanDerWaalsContact C-N 3.33Å; T659-R661 PolarHBondContact O-N 2.88Å; R661-L663 VanDerWaalsContact C-N 3.34Å; R661-L663 PolarHBondContact O-N 3.45Å; R661-R664 PolarHBondContact O-N 3.24Å; R661-R664 VanDerWaalsContact O-N 3.17Å; R661-C665 PolarHBondContact O-N 2.84Å; R661-C665 PolarHBondContact O-SG 2.93Å; R661-C665 VanDerWaalsContact O-SG 3.37Å
662	V	74.8	Confident	57.7	Low	81 Å²	81	119.5 Å²	119.5	49%	0.491	62%	0.62	S	S	.	*	H	α-helix	trans	-58.4	-45.1	178.6	177.6	0	0	0	0	111.2	R658 T659 R664 C665 L666	R658-V662 PolarHBondContact O-N 2.94Å; T659-V662 PolarHBondContact O-N 3.08Å; V662-R664 PolarHBondContact O-N 2.91Å; V662-C665 PolarHBondContact O-N 3.3Å; V662-L666 HydrophobicContact CG1-CD1 3.97Å; V662-L666 HydrophobicContact CG1-CG 4.45Å; V662-L666 WeakPolarHBondContact O-CG 3.34Å; V662-L666 PolarHBondContact O-N 2.63Å
663	L	74.2	Confident	58.9	Low	108 Å²	108	120.2 Å²	120.2	57%	0.565	62%	0.623	S	S	*	*	H	α-helix	trans	-63.2	-39.8	176	-72.6	168.4	0	0	0	112.8	T659 R661 L666 L667	T659-L663 WeakPolarHBondContact O-CB 3.48Å; T659-L663 WeakPolarHBondContact O-CG 3.47Å; T659-L663 PolarHBondContact O-N 2.91Å; R661-L663 VanDerWaalsContact C-N 3.34Å; R661-L663 PolarHBondContact O-N 3.45Å; L663-L666 PolarHBondContact O-N 3.31Å; L663-L667 VanDerWaalsContact O-CB 3.32Å; L663-L667 WeakPolarHBondContact O-CB 3.37Å; L663-L667 PolarHBondContact O-N 3.15Å
664	R	63.4	Low	59.8	Low	173 Å²	173	122.6 Å²	122.6	65%	0.653	62%	0.624	S	S	*	*	H	α-helix	trans	-67.6	-33.4	173.1	-79.7	-176.2	177.6	178.7	0.9	112.8	H660 R661 V662 K668	H660-R664 WeakPolarHBondContact O-CB 3.49Å; H660-R664 WeakPolarHBondContact O-CG 3.47Å; H660-R664 PolarHBondContact O-N 3.46Å; R661-R664 PolarHBondContact O-N 3.24Å; R661-R664 VanDerWaalsContact O-N 3.17Å; V662-R664 PolarHBondContact O-N 2.91Å; R664-K668 WeakPolarHBondContact O-CB 3.26Å; R664-K668 WeakPolarHBondContact O-CG 3.46Å; R664-K668 PolarHBondContact O-N 2.87Å
665	C	65.6	Low	59.8	Low	75 Å²	75	122.8 Å²	122.8	51%	0.507	62%	0.618	S	S	.	*	H	α-helix	trans	-69.3	-44.7	173.8	-69.8	0	0	0	0	111.6	R661 V662 K668 L669	R661-C665 PolarHBondContact O-N 2.84Å; R661-C665 PolarHBondContact O-SG 2.93Å; R661-C665 VanDerWaalsContact O-SG 3.37Å; V662-C665 PolarHBondContact O-N 3.3Å; C665-K668 PolarHBondContact O-N 2.93Å; C665-L669 WeakPolarHBondContact O-CG 3.31Å; C665-L669 PolarHBondContact O-N 3.05Å
666	L	80.4	Confident	60.7	Low	90 Å²	90	121.9 Å²	121.9	47%	0.471	63%	0.625	S	S	.	*	H	α-helix	trans	-60.2	-46.9	173.4	-74.7	167.1	0	0	0	111.6	V662 L663 K668 L669 V670	V662-L666 HydrophobicContact CG1-CD1 3.97Å; V662-L666 HydrophobicContact CG1-CG 4.45Å; V662-L666 WeakPolarHBondContact O-CG 3.34Å; V662-L666 PolarHBondContact O-N 2.63Å; L663-L666 PolarHBondContact O-N 3.31Å; L666-K668 VanDerWaalsContact C-N 3.26Å; L666-K668 PolarHBondContact O-N 3.05Å; L666-L669 PolarHBondContact O-N 3.06Å; L666-V670 WeakPolarHBondContact O-CB 3.24Å; L666-V670 VanDerWaalsContact O-CG2 3.31Å; L666-V670 WeakPolarHBondContact O-CG2 3.47Å; L666-V670 PolarHBondContact O-N 2.86Å
667	L	76	Confident	60.4	Low	123 Å²	123	125.9 Å²	125.9	64%	0.644	63%	0.632	S	S	*	*	H	α-helix	trans	-62.9	-34.7	178.5	-156.9	76.2	0	0	0	111.8	L663 S671	L663-L667 VanDerWaalsContact O-CB 3.32Å; L663-L667 WeakPolarHBondContact O-CB 3.37Å; L663-L667 PolarHBondContact O-N 3.15Å; L667-S671 WeakPolarHBondContact O-CB 3.47Å; L667-S671 PolarHBondContact O-N 2.9Å; L667-S671 PolarHBondContact O-OG 3.42Å
668	K	69.4	Low	60.1	Low	157 Å²	157	125.2 Å²	125.2	68%	0.683	64%	0.635	S	S	*	*	H	α-helix	trans	-67.1	-46.6	172	-81.2	-173.1	172.1	-161.3	0	112.6	R664 C665 L666 S671 T672	R664-K668 WeakPolarHBondContact O-CB 3.26Å; R664-K668 WeakPolarHBondContact O-CG 3.46Å; R664-K668 PolarHBondContact O-N 2.87Å; C665-K668 PolarHBondContact O-N 2.93Å; L666-K668 VanDerWaalsContact C-N 3.26Å; L666-K668 PolarHBondContact O-N 3.05Å; K668-S671 WeakPolarHBondContact O-CB 3.46Å; K668-S671 PolarHBondContact O-N 2.71Å; K668-S671 VanDerWaalsContact O-N 3.12Å; K668-T672 PolarHBondContact O-N 2.73Å; K668-T672 PolarHBondContact O-OG1 3.5Å
669	L	74.4	Confident	59.1	Low	104 Å²	104	123 Å²	123	55%	0.545	64%	0.639	S	S	.	*	H	α-helix	trans	-57.8	-51	177.2	-75.4	163.7	0	0	0	111	C665 L666 S671 T672 E673	C665-L669 WeakPolarHBondContact O-CG 3.31Å; C665-L669 PolarHBondContact O-N 3.05Å; L666-L669 PolarHBondContact O-N 3.06Å; L669-S671 VanDerWaalsContact C-N 3.26Å; L669-S671 PolarHBondContact O-N 2.97Å; L669-T672 WeakPolarHBondContact CA-OG1 3.46Å; L669-T672 PolarHBondContact O-N 2.87Å; L669-T672 PolarHBondContact O-OG1 3.23Å; L669-E673 WeakPolarHBondContact O-CB 3.42Å; L669-E673 PolarHBondContact O-N 2.85Å
670	V	73.6	Confident	57.8	Low	70 Å²	70	123 Å²	123	42%	0.424	65%	0.648	S	S	.	*	H	α-helix	trans	-58.5	-37	174.9	173.9	0	0	0	0	111.6	L666 T672 E673 I674	L666-V670 WeakPolarHBondContact O-CB 3.24Å; L666-V670 VanDerWaalsContact O-CG2 3.31Å; L666-V670 WeakPolarHBondContact O-CG2 3.47Å; L666-V670 PolarHBondContact O-N 2.86Å; V670-T672 VanDerWaalsContact C-N 3.31Å; V670-T672 PolarHBondContact O-N 3.24Å; V670-E673 PolarHBondContact O-N 2.94Å; V670-I674 HydrophobicContact CG1-CD1 3.7Å; V670-I674 WeakPolarHBondContact O-CD1 3.45Å; V670-I674 WeakPolarHBondContact O-CG1 3.39Å
671	S	62	Low	57.2	Low	92 Å²	92	123.5 Å²	123.5	64%	0.643	66%	0.661	S	S	*	*	H	α-helix	trans	-69.4	-24.7	175.3	-57.4	0	0	0	0	113.8	L667 K668 L669	L667-S671 WeakPolarHBondContact O-CB 3.47Å; L667-S671 PolarHBondContact O-N 2.9Å; L667-S671 PolarHBondContact O-OG 3.42Å; K668-S671 WeakPolarHBondContact O-CB 3.46Å; K668-S671 PolarHBondContact O-N 2.71Å; K668-S671 VanDerWaalsContact O-N 3.12Å; L669-S671 VanDerWaalsContact C-N 3.26Å; L669-S671 PolarHBondContact O-N 2.97Å
672	T	61.3	Low	55.7	Low	113 Å²	113	120.8 Å²	120.8	69%	0.693	66%	0.656	S	S	*	*	H	α-helix	trans	-90.7	-14.8	176.5	46.5	0	0	0	0	114	K668 L669 V670	K668-T672 PolarHBondContact O-N 2.73Å; K668-T672 PolarHBondContact O-OG1 3.5Å; L669-T672 WeakPolarHBondContact CA-OG1 3.46Å; L669-T672 PolarHBondContact O-N 2.87Å; L669-T672 PolarHBondContact O-OG1 3.23Å; V670-T672 VanDerWaalsContact C-N 3.31Å; V670-T672 PolarHBondContact O-N 3.24Å
673	E	53.4	Low	53.5	Low	158 Å²	158	122 Å²	122	74%	0.738	66%	0.663	S	S	*	*	H	α-helix	trans	-97.8	-16.1	-170.3	-163	163.4	-138.3	0	0	113.5	L669 V670	L669-E673 WeakPolarHBondContact O-CB 3.42Å; L669-E673 PolarHBondContact O-N 2.85Å; V670-E673 PolarHBondContact O-N 2.94Å
674	I	48.6	Very low	51.2	Low	131 Å²	131	121.6 Å²	121.6	67%	0.672	67%	0.668	S	S	*	*	S	Bend	trans	-107.1	42.3	-176.2	-39.7	162.4	0	0	0	112.2	V670	V670-I674 HydrophobicContact CG1-CD1 3.7Å; V670-I674 WeakPolarHBondContact O-CD1 3.45Å; V670-I674 WeakPolarHBondContact O-CG1 3.39Å
675	N	35	Very low	49.6	Very low	133 Å²	133	118.7 Å²	118.7	71%	0.711	68%	0.675	S	S	*	*			trans	-142.8	78.8	171.6	-171.4	24.2	0	0	0	114.8
676	P	51.3	Low	47.8	Very low	116 Å²	116	121.6 Å²	121.6	75%	0.753	69%	0.69	S	S	*	*			trans	-94.8	98.3	173.1	34.7	-30.4	0	0	0	112.4
677	K	30.3	Very low	45.3	Very low	186 Å²	186	121.7 Å²	121.7	81%	0.809	70%	0.704	S	S	*	*			trans	-149.3	154.6	161.9	-125.7	98.7	-173.4	166.7	0	108.8
678	P	40.3	Very low	43.1	Very low	113 Å²	113	121.5 Å²	121.5	73%	0.734	71%	0.708	S	S	*	*			trans	-113.5	162.3	-135.1	13	12.2	0	0	0	112.9
679	L	29.8	Very low	41	Very low	175 Å²	175	119.7 Å²	119.7	92%	0.916	72%	0.715	S	S	*	*			trans	-109.9	141.2	162.4	-93.6	70.4	0	0	0	110
680	A	29.6	Very low	40	Very low	94 Å²	94	120 Å²	120	78%	0.777	72%	0.724	S	S	*	*			trans	-86.8	166.6	166.5	0	0	0	0	0	110.3
681	P	43.3	Very low	37.8	Very low	112 Å²	112	124.5 Å²	124.5	73%	0.727	74%	0.744	S	S	*	*			trans	-102.7	-179.3	-159.3	40.2	-36.8	0	0	0	115.9
682	E	31.9	Very low	36.1	Very low	133 Å²	133	129.6 Å²	129.6	62%	0.621	76%	0.755	S	S	*	*			trans	69.5	146.8	177.2	-61.8	-51.3	129.2	0	0	116.2	P1183	E682-P1183 HydrophobicContact CB-CG 4.19Å
683	V	28.9	Very low	34.5	Very low	106 Å²	106	129.3 Å²	129.3	64%	0.642	76%	0.764	S	S	*	*			cis	-133.3	162.2	24.4	-139.7	0	0	0	0	114.7	P1183	V683-P1183 HydrophobicContact CB-CB 4.14Å; V683-P1183 HydrophobicContact CG1-CB 3.38Å; V683-P1183 HydrophobicContact CG1-CG 4.48Å; V683-P1183 HydrophobicContact CG2-CB 3.64Å; V683-P1183 HydrophobicContact CG2-CG 4.4Å
684	C	27.2	Very low	33.2	Very low	99 Å²	99	125.1 Å²	125.1	67%	0.669	76%	0.763	S	S	*	*			trans	-95.3	153.2	177.4	-61.3	0	0	0	0	114.6
685	S	28.6	Very low	32.9	Very low	113 Å²	113	124.1 Å²	124.1	79%	0.79	77%	0.765	S	S	*	*				177.9	115.1	125.7	-84	0	0	0	0	116.7
686	T	27.7	Very low	32.7	Very low	135 Å²	135	124.8 Å²	124.8	83%	0.828	77%	0.769	S	S	*	*				35.9	122	127.8	-49.5	0	0	0	0	122.4
687	A	28.5	Very low	31.7	Very low	93 Å²	93	126.4 Å²	126.4	77%	0.769	77%	0.766	S	S	*	*			trans	-145.4	88.2	157	0	0	0	0	0	114.3
688	T	30	Very low	31.8	Very low	118 Å²	118	124.3 Å²	124.3	72%	0.724	76%	0.759	S	S	*	*			trans	45	111.5	134.4	59.3	0	0	0	0	123.7
689	S	25.4	Very low	31.2	Very low	119 Å²	119	124.8 Å²	124.8	83%	0.832	76%	0.756	S	S	*	*				77.8	158.2	119.8	-68.5	0	0	0	0	123.2
690	P	53	Low	31.1	Very low	111 Å²	111	124 Å²	124	72%	0.721	75%	0.747	S	S	*	*			trans	-128.1	-166.2	-155.3	44.1	-27.8	0	0	0	114
691	L	26.9	Very low	30.7	Very low	164 Å²	164	124.8 Å²	124.8	86%	0.859	74%	0.743	S	S	*	*				179.7	138.8	126	-101	170.6	0	0	0	115.2
692	K	27.6	Very low	30.1	Very low	200 Å²	200	127.3 Å²	127.3	87%	0.87	75%	0.749	S	S	*	*				124.2	109.2	125.9	-155.5	164.4	-171.2	173.7	0	117.7
693	A	28	Very low	30	Very low	107 Å²	107	126.9 Å²	126.9	88%	0.884	76%	0.756	S	S	*	*			trans	-149.7	162.8	157.6	0	0	0	0	0	109.2
694	G	25.6	Very low	31	Very low	70 Å²	70	127.2 Å²	127.2	72%	0.722	76%	0.76	S	S	*	*			trans	155.9	171.1	-178.5	0	0	0	0	0	110.4
695	P	42.1	Very low	31.7	Very low	109 Å²	109	128.9 Å²	128.9	71%	0.708	77%	0.77	S	S	*	*			cis	-117	167.1	12.9	8.1	17.2	0	0	0	115.4
696	D	31.2	Very low	31.6	Very low	147 Å²	147	126.8 Å²	126.8	79%	0.786	77%	0.766	S	S	*	*			trans	59.8	150.8	137	-57.5	-25.3	0	0	0	121.6
697	E	30.1	Very low	31.8	Very low	151 Å²	151	130.7 Å²	130.7	71%	0.706	77%	0.771	S	S	*	*			cis	-153.9	153.6	6.8	-137.8	-177.8	143.7	0	0	115
698	Q	31.2	Very low	31.9	Very low	142 Å²	142	131.9 Å²	131.9	66%	0.664	77%	0.774	S	S	*	*			trans	73.4	107.7	138.1	-128.3	170	92	0	0	124.8
699	N	28.8	Very low	32.3	Very low	122 Å²	122	131.9 Å²	131.9	65%	0.652	78%	0.776	S	S	*	*			trans	61.9	156.8	130.3	-66.1	-13.8	0	0	0	122.5
700	Q	27.8	Very low	32.5	Very low	158 Å²	158	132.6 Å²	132.6	74%	0.738	78%	0.775	S	S	*	*			cis	-153.8	152.1	-9.5	-122.5	171.3	64.2	0	0	112.8
701	T	21.9	Very low	31.2	Very low	111 Å²	111	132.3 Å²	132.3	68%	0.681	78%	0.782	S	S	*	*			trans	-0.7	130.7	150.3	-41.5	0	0	0	0	120.6
702	L	29.8	Very low	31.2	Very low	165 Å²	165	128.1 Å²	128.1	86%	0.864	78%	0.779	S	S	*	*				-176	163.7	116.4	-96.6	170.2	0	0	0	114.5
703	T	29	Very low	31.2	Very low	124 Å²	124	125.2 Å²	125.2	76%	0.761	78%	0.777	S	S	*	*			trans	-110.1	179.3	-150.4	15.5	0	0	0	0	115.1
704	P	51.6	Low	31.1	Very low	113 Å²	113	130.9 Å²	130.9	73%	0.734	78%	0.776	S	S	*	*			trans	-98.8	179	-156	44.2	-41.8	0	0	0	114.7
705	P	40.9	Very low	31.4	Very low	135 Å²	135	132.8 Å²	132.8	88%	0.877	78%	0.778	S	S	*	*				-139.2	179.6	82.3	31.4	-11.9	0	0	0	112.9
706	G	27	Very low	31.3	Very low	68 Å²	68	133.8 Å²	133.8	70%	0.701	79%	0.785	S	S	*	*			cis	155.6	142.1	-7.9	0	0	0	0	0	113
707	K	31.7	Very low	31.1	Very low	218 Å²	218	131.6 Å²	131.6	95%	0.948	78%	0.781	S	S	*	*			trans	70.3	106.6	166.8	-53.9	178.3	-177.9	178.6	0	120.2
708	S	29.3	Very low	30.9	Very low	117 Å²	117	134.2 Å²	134.2	82%	0.818	79%	0.79	S	S	*	*				-151.4	154.3	123.2	62.4	0	0	0	0	109.8
709	P	40.2	Very low	30.6	Very low	119 Å²	119	132 Å²	132	77%	0.773	80%	0.797	S	S	*	*			trans	-106.2	136.5	-156.7	37.3	-32.8	0	0	0	117.4
710	V	27.9	Very low	30.7	Very low	134 Å²	134	135.7 Å²	135.7	81%	0.812	80%	0.801	S	S	*	*				36.7	107	129.8	-175	0	0	0	0	119.6
711	A	26.5	Very low	30.8	Very low	104 Å²	104	134.6 Å²	134.6	86%	0.86	80%	0.796	S	S	*	*			trans	48.3	168.7	131.1	0	0	0	0	0	122.8
712	G	27.1	Very low	31.2	Very low	77 Å²	77	137.1 Å²	137.1	79%	0.794	80%	0.8	S	S	*	*			trans	130.4	90.3	153	0	0	0	0	0	116.7
713	V	26.8	Very low	31.2	Very low	139 Å²	139	133 Å²	133	84%	0.842	79%	0.79	S	S	*	*			trans	-62	132.6	173.8	-167.5	0	0	0	0	112.4
714	R	26	Very low	31.1	Very low	225 Å²	225	132.2 Å²	132.2	85%	0.849	79%	0.789	S	S	*	*				163.1	151.7	123.4	-90.1	176.7	-174.5	-101.3	-0.1	115.5
715	S	32.4	Very low	30.1	Very low	111 Å²	111	133 Å²	133	78%	0.776	79%	0.791	S	S	*	*			trans	71.1	165	158.2	-58	0	0	0	0	117.3
716	P	39.8	Very low	29.5	Very low	130 Å²	130	138.1 Å²	138.1	84%	0.844	79%	0.793	S	S	*	*			cis	-123.5	-149.8	1.6	43.4	-27.8	0	0	0	114.1
717	S	27.1	Very low	29.5	Very low	101 Å²	101	138 Å²	138	71%	0.706	79%	0.793	S	S	*	*			trans	-107.9	167.5	-159.6	-44.3	0	0	0	0	116.4
718	F	26	Very low	29.3	Very low	206 Å²	206	134 Å²	134	90%	0.904	79%	0.787	S	S	*	*			trans	79.4	148.2	155.4	-84.6	-74.7	0	0	0	122.1
719	A	25.1	Very low	29.1	Very low	96 Å²	96	140 Å²	140	79%	0.793	79%	0.792	S	S	*	*			trans	73.3	158.9	156.4	0	0	0	0	0	119.1
720	R	30.6	Very low	28.6	Very low	198 Å²	198	140.4 Å²	140.4	75%	0.747	79%	0.792	S	S	*	*			cis	-176.2	145.3	-27.8	168	172.9	-101.1	-90.5	0.7	110.5
721	Q	30.3	Very low	28.5	Very low	136 Å²	136	139.5 Å²	139.5	64%	0.636	78%	0.779	S	S	*	*			trans	69.8	152.9	160.1	-83	170.3	-46.6	0	0	120
722	Q	30.8	Very low	29.6	Very low	164 Å²	164	138.8 Å²	138.8	77%	0.766	77%	0.765	S	S	*	*			cis	-166.4	170.3	-21.7	-128.2	178.5	-106.9	0	0	107.6
723	A	28.9	Very low	30	Very low	78 Å²	78	141.2 Å²	141.2	65%	0.645	77%	0.767	S	S	*	*			cis	-131.6	-93.7	-2.4	0	0	0	0	0	112.5
724	S	27.7	Very low	30	Very low	107 Å²	107	141.9 Å²	141.9	75%	0.748	77%	0.766	S	S	*	*			cis	-173	149.7	-10.2	-150.9	0	0	0	0	109.5
725	V	30.2	Very low	30.1	Very low	129 Å²	129	135.5 Å²	135.5	78%	0.782	76%	0.761	S	S	*	*			cis	-168.3	163.4	-30.1	67.6	0	0	0	0	110
726	R	28.7	Very low	29.8	Very low	243 Å²	243	134.6 Å²	134.6	92%	0.917	76%	0.761	S	S	*	*			trans	81	110	164.5	-105.7	-174.7	-172.6	177.9	4.2	121.6
727	G	26.7	Very low	29.1	Very low	67 Å²	67	133.2 Å²	133.2	69%	0.691	76%	0.76	S	S	*	*			trans	94.2	137.3	138.1	0	0	0	0	0	118.7
728	T	26.7	Very low	29.1	Very low	134 Å²	134	133.3 Å²	133.3	82%	0.822	77%	0.767	S	S	*	*			cis	157.8	132.8	-25.4	33.9	0	0	0	0	107.9
729	R	26.5	Very low	29.1	Very low	243 Å²	243	127.9 Å²	127.9	92%	0.917	76%	0.76	S	S	*	*			trans	67.7	160	171.3	-80.1	179.6	168.6	-174.5	-4	116.3
730	T	28	Very low	29.3	Very low	127 Å²	127	129.7 Å²	129.7	78%	0.779	77%	0.767	S	S	*	*			cis	-151.5	177.9	15.8	-10.4	0	0	0	0	113.6
731	H	25.6	Very low	29.1	Very low	115 Å²	115	124 Å²	124	53%	0.532	77%	0.77	S	S	.	*			trans	-60.7	169.6	177	-76.3	-78.4	0	0	0	117.8	D927	H731-D927 PolarHBondContact CE1-O 2.67Å; H731-D927 VanDerWaalsContact CE1-O 3.23Å; H731-D927 PolarHBondContact ND1-O 3.32Å
732	P	49.8	Very low	28.9	Very low	89 Å²	89	120.8 Å²	120.8	58%	0.578	77%	0.773	S	S	*	*			trans	-84.3	-176.3	179.8	39.1	-40.6	0	0	0	113.8
733	P	36.8	Very low	28.9	Very low	128 Å²	128	124.2 Å²	124.2	83%	0.831	78%	0.779	S	S	*	*				-155.1	-173	93.7	42.8	-23.2	0	0	0	117.5
734	N	25.8	Very low	28.9	Very low	152 Å²	152	127.1 Å²	127.1	81%	0.813	78%	0.784	S	S	*	*			trans	-76.6	154.3	177.4	167.5	41	0	0	0	115.2
735	A	28.2	Very low	28.9	Very low	92 Å²	92	129.5 Å²	129.5	76%	0.76	79%	0.787	S	S	*	*			trans	-158.4	152.7	158.1	0	0	0	0	0	115.3
736	A	25.7	Very low	29.8	Very low	92 Å²	92	128.3 Å²	128.3	76%	0.76	78%	0.782	S	S	*	*			trans	-51.9	158.7	-177.9	0	0	0	0	0	117
737	A	26.5	Very low	29.8	Very low	101 Å²	101	127.9 Å²	127.9	84%	0.835	78%	0.781	S	S	*	*			cis	80.8	85.9	25.6	0	0	0	0	0	116.8
738	A	26.6	Very low	29.8	Very low	102 Å²	102	128.6 Å²	128.6	84%	0.843	78%	0.775	S	S	*	*			trans	-165.7	160.9	157.9	0	0	0	0	0	109
739	A	26.4	Very low	30	Very low	93 Å²	93	129.8 Å²	129.8	77%	0.769	78%	0.775	S	S	*	*			cis	159	124.6	-32.4	0	0	0	0	0	107.2
740	S	29.1	Very low	30.2	Very low	134 Å²	134	126 Å²	126	94%	0.937	77%	0.773	S	S	*	*			trans	42.5	121.6	150	-162.6	0	0	0	0	122.1
741	G	25.8	Very low	30.1	Very low	79 Å²	79	123 Å²	123	81%	0.814	77%	0.767	S	S	*	*			trans	141	128.9	159	0	0	0	0	0	111.9
742	G	26.3	Very low	30.2	Very low	68 Å²	68	123.1 Å²	123.1	70%	0.701	78%	0.781	S	S	*	*			cis	130.6	158.6	6.4	0	0	0	0	0	110.4
743	R	31.1	Very low	30	Very low	236 Å²	236	125 Å²	125	89%	0.891	79%	0.793	S	S	*	*			trans	75.7	146.4	-178.8	-56.9	173	170.9	-168.9	-5.6	114.1
744	N	28.2	Very low	29.5	Very low	139 Å²	139	122.2 Å²	122.2	74%	0.743	79%	0.787	S	S	*	*			cis	-153.4	157.2	-3.6	-107.7	-8.3	0	0	0	113.8
745	L	27.7	Very low	29.7	Very low	157 Å²	157	123.2 Å²	123.2	82%	0.822	79%	0.793	S	S	*	*			trans	-42.8	-177.8	161.3	-68.6	165.8	0	0	0	117.7
746	P	48.9	Very low	29.9	Very low	103 Å²	103	121.7 Å²	121.7	67%	0.669	79%	0.786	S	S	*	*			cis	-139.2	-165.5	-3.6	25.2	1	0	0	0	116.4
747	R	28.9	Very low	30.1	Very low	235 Å²	235	127.2 Å²	127.2	89%	0.887	80%	0.796	S	S	*	*			trans	98.3	132	142.4	-129.9	159.3	-161.1	141.7	8.6	116.3
748	S	27.1	Very low	30.4	Very low	82 Å²	82	125.9 Å²	125.9	57%	0.573	79%	0.792	S	S	*	*			cis	-171.2	133.2	-6.5	147.9	0	0	0	0	113.8
749	L	31.9	Very low	30.7	Very low	158 Å²	158	127 Å²	127	83%	0.827	79%	0.794	S	S	*	*			trans	55.9	148.1	148.1	-52.8	173.7	0	0	0	118.2
750	L	29.4	Very low	31	Very low	165 Å²	165	128.1 Å²	128.1	86%	0.864	79%	0.791	S	S	*	*			cis	-152.8	161.2	13.7	-164.7	56.3	0	0	0	107.3
751	G	26	Very low	31	Very low	64 Å²	64	131.3 Å²	131.3	66%	0.66	79%	0.788	S	S	*	*			cis	-166.6	-123.2	6.8	0	0	0	0	0	113
752	S	29	Very low	31.3	Very low	117 Å²	117	130.9 Å²	130.9	82%	0.818	78%	0.777	S	S	*	*			trans	-164.2	178.8	-171.6	-134.2	0	0	0	0	110.7
753	P	43.8	Very low	31.7	Very low	129 Å²	129	134 Å²	134	84%	0.838	78%	0.782	S	S	*	*			cis	-141.8	143.1	46.9	38	-17.4	0	0	0	119.8
754	G	28.1	Very low	31.9	Very low	68 Å²	68	127.6 Å²	127.6	70%	0.701	77%	0.771	S	S	*	*			trans	83.9	153.4	138.8	0	0	0	0	0	120
755	D	29.6	Very low	32.1	Very low	174 Å²	174	126.9 Å²	126.9	93%	0.93	77%	0.772	S	S	*	*			cis	-163.8	160.8	-20.4	-160.9	4.6	0	0	0	110.5
756	G	31.2	Very low	32.2	Very low	60 Å²	60	125.1 Å²	125.1	62%	0.619	77%	0.768	S	S	*	*			trans	101.4	105.8	159.3	0	0	0	0	0	120.2
757	E	31.4	Very low	31.2	Very low	207 Å²	207	127.6 Å²	127.6	97%	0.967	78%	0.775	S	S	*	*			trans	58.8	158.2	158.4	-60.6	-157.1	125	0	0	119.9
758	G	32.8	Very low	31.7	Very low	73 Å²	73	121.5 Å²	121.5	75%	0.753	77%	0.765	S	S	*	*			cis	-169.1	165.2	-0.3	0	0	0	0	0	111.6
759	S	32.5	Very low	32.6	Very low	127 Å²	127	122.9 Å²	122.9	89%	0.888	77%	0.772	S	S	*	*			trans	-96	157.1	-160.4	-166.5	0	0	0	0	118
760	V	32.6	Very low	32.3	Very low	116 Å²	116	122.8 Å²	122.8	70%	0.703	77%	0.773	S	S	*	*			trans	-61.1	133.8	172	151.3	0	0	0	0	114.7
761	F	29	Very low	32.4	Very low	200 Å²	200	119.4 Å²	119.4	88%	0.877	76%	0.763	S	S	*	*			trans	56.7	147.9	150.2	-78.2	-123.9	0	0	0	119.3
762	A	30.8	Very low	32.7	Very low	70 Å²	70	121.1 Å²	121.1	58%	0.579	77%	0.765	S	S	*	*			cis	-174.3	155.4	0.2	0	0	0	0	0	113.5
763	V	35	Very low	33	Very low	134 Å²	134	126.3 Å²	126.3	81%	0.812	77%	0.766	S	S	*	*			trans	66.6	175.2	144.9	168.9	0	0	0	0	114.6
764	P	36	Very low	32.5	Very low	102 Å²	102	127.8 Å²	127.8	66%	0.662	76%	0.762	S	S	*	*			cis	-122.5	147.4	-17.8	20.1	2.9	0	0	0	117.5
765	T	32.6	Very low	32.5	Very low	124 Å²	124	130.4 Å²	130.4	76%	0.761	77%	0.769	S	S	*	*				59.9	166.4	124.5	-42	0	0	0	0	122.8
766	T	30.4	Very low	32.8	Very low	120 Å²	120	132.1 Å²	132.1	74%	0.736	76%	0.763	S	S	*	*			trans	87.8	146.6	163.5	75.6	0	0	0	0	118.3
767	L	27.5	Very low	32.8	Very low	155 Å²	155	137.9 Å²	137.9	81%	0.812	78%	0.776	S	S	*	*			cis	-157.2	161.5	-27.1	-101.8	176.9	0	0	0	107.7
768	P	39.2	Very low	32.8	Very low	107 Å²	107	138.2 Å²	138.2	70%	0.695	77%	0.774	S	S	*	*			trans	-94	-162.8	171	43.5	-36.8	0	0	0	110.1
769	P	45.9	Very low	33.1	Very low	110 Å²	110	139.5 Å²	139.5	71%	0.714	77%	0.772	S	S	*	*			cis	-131.5	162.7	-12.6	39.5	-24.3	0	0	0	115.2
770	N	25.8	Very low	33.6	Very low	157 Å²	157	138.8 Å²	138.8	84%	0.84	76%	0.764	S	S	*	*				-160.2	-170.8	128.3	-132.7	-68.2	0	0	0	113.4
771	S	31.1	Very low	34.6	Very low	93 Å²	93	137.9 Å²	137.9	65%	0.65	76%	0.755	S	S	*	*			trans	-122.2	163.5	-145.1	62.6	0	0	0	0	117.1
772	S	32.8	Very low	35.7	Very low	101 Å²	101	136.2 Å²	136.2	71%	0.706	75%	0.748	S	S	*	*			trans	88.5	152	160.2	87.9	0	0	0	0	119.2
773	R	34.2	Very low	37.4	Very low	225 Å²	225	139.5 Å²	139.5	85%	0.849	75%	0.751	S	S	*	*			trans	63.7	69.3	162.7	-57.5	173.9	-177.4	-105.3	1.5	118.5
774	H	33.2	Very low	38.7	Very low	161 Å²	161	136 Å²	136	75%	0.745	74%	0.736	S	S	*	*				-172.2	122.1	105.6	-115.5	-123.4	0	0	0	112.9
775	S	29.8	Very low	39.7	Very low	122 Å²	122	137.4 Å²	137.4	85%	0.853	73%	0.734	S	S	*	*			trans	-123.8	103.9	154.4	-178.6	0	0	0	0	107.7
776	R	34.5	Very low	41.2	Very low	210 Å²	210	136.3 Å²	136.3	79%	0.792	72%	0.723	S	S	*	*			trans	-129.8	140.4	164.5	-75.7	-165.8	178.9	-166.5	1	107.5
777	M	31.6	Very low	43	Very low	181 Å²	181	132.8 Å²	132.8	89%	0.892	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-74.1	137.6	-167	-52	173.2	-62.5	0	0	111
778	F	32.3	Very low	44.8	Very low	214 Å²	214	131.9 Å²	131.9	94%	0.939	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-81.9	126.9	145.6	-86.7	-83	0	0	0	108
779	S	38.8	Very low	45.9	Very low	100 Å²	100	134.6 Å²	134.6	70%	0.699	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-81.3	143.7	-175.6	50.4	0	0	0	0	112
780	P	42.5	Very low	46.8	Very low	112 Å²	112	135.9 Å²	135.9	73%	0.727	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-54.7	139.5	165.1	-23	33.8	0	0	0	111.2	K782	P780-K782 PolarHBondContact O-N 3.39Å
781	N	53.9	Low	48.4	Very low	98 Å²	98	134.2 Å²	134.2	52%	0.524	68%	0.676	S	S	.	*	P	Polyproline II helix	trans	-64.1	120.8	179.6	-175.4	-3.6	0	0	0	110.4	E783 A784 Q785	N781-E783 PolarHBondContact O-N 3.03Å; N781-E783 WeakPolarHBondContact OD1-CB 3.17Å; N781-E783 PolarHBondContact OD1-N 3.23Å; N781-A784 HydrophobicContact CB-CB 4.33Å; N781-A784 PolarHBondContact O-N 3.42Å; N781-Q785 PolarHBondContact O-N 3.27Å
782	K	52.7	Low	49.7	Very low	164 Å²	164	134.1 Å²	134.1	71%	0.713	67%	0.667	S	S	*	*	H	α-helix	trans	-65.3	-26.7	-178.2	-160.8	173.6	-175.5	-178.9	0	112.7	P780 L786	P780-K782 PolarHBondContact O-N 3.39Å; K782-L786 WeakPolarHBondContact O-CG 3.42Å; K782-L786 PolarHBondContact O-N 3.12Å; K782-L786 VanDerWaalsContact O-N 3.1Å
783	E	65.3	Low	50.4	Low	140 Å²	140	134 Å²	134	65%	0.654	66%	0.659	S	S	*	*	H	α-helix	trans	-70.7	-46.3	175.8	-173.4	172.4	-139.5	0	0	111.7	N781 Q785 L786 A787	N781-E783 PolarHBondContact O-N 3.03Å; N781-E783 WeakPolarHBondContact OD1-CB 3.17Å; N781-E783 PolarHBondContact OD1-N 3.23Å; E783-Q785 VanDerWaalsContact C-N 3.27Å; E783-Q785 PolarHBondContact O-N 3.05Å; E783-L786 WeakPolarHBondContact O-CB 3.21Å; E783-L786 PolarHBondContact O-N 2.89Å; E783-A787 PolarHBondContact O-N 2.8Å
784	A	62.1	Low	51.3	Low	59 Å²	59	127.1 Å²	127.1	49%	0.488	65%	0.645	S	S	.	*	H	α-helix	trans	-60.6	-36.8	174.8	0	0	0	0	0	112.2	N781 L786 F788	N781-A784 HydrophobicContact CB-CB 4.33Å; N781-A784 PolarHBondContact O-N 3.42Å; A784-L786 VanDerWaalsContact C-N 3.34Å; A784-F788 WeakPolarHBondContact O-CB 3.32Å; A784-F788 PolarHBondContact O-N 3.46Å
785	Q	58.5	Low	52.3	Low	133 Å²	133	125.6 Å²	125.6	62%	0.621	64%	0.641	S	S	*	*	H	α-helix	trans	-72.8	-25.2	175.5	-162.7	174.7	63.5	0	0	113.1	N781 E783 R789	N781-Q785 PolarHBondContact O-N 3.27Å; E783-Q785 VanDerWaalsContact C-N 3.27Å; E783-Q785 PolarHBondContact O-N 3.05Å; Q785-R789 VanDerWaalsContact O-CB 3.23Å; Q785-R789 WeakPolarHBondContact O-CB 3.42Å; Q785-R789 PolarHBondContact O-N 3.07Å
786	L	62.6	Low	53	Low	101 Å²	101	123.5 Å²	123.5	53%	0.529	63%	0.626	S	S	.	*	H	α-helix	trans	-76.8	-43.1	170.5	-78.4	167.7	0	0	0	111.7	K782 E783 A784 F788 R789 Q790	K782-L786 WeakPolarHBondContact O-CG 3.42Å; K782-L786 PolarHBondContact O-N 3.12Å; K782-L786 VanDerWaalsContact O-N 3.1Å; E783-L786 WeakPolarHBondContact O-CB 3.21Å; E783-L786 PolarHBondContact O-N 2.89Å; A784-L786 VanDerWaalsContact C-N 3.34Å; L786-F788 PolarHBondContact O-N 3.28Å; L786-R789 PolarHBondContact O-N 2.84Å; L786-R789 VanDerWaalsContact O-N 3.14Å; L786-Q790 WeakPolarHBondContact O-CG 3.3Å; L786-Q790 PolarHBondContact O-N 2.99Å
787	A	67.8	Low	53.4	Low	46 Å²	46	121 Å²	121	38%	0.38	63%	0.625	S	S	.	*	H	α-helix	trans	-59.3	-47.4	175.7	0	0	0	0	0	111.7	E783 R789 Q790 Q791	E783-A787 PolarHBondContact O-N 2.8Å; A787-R789 PolarHBondContact O-N 2.96Å; A787-Q790 PolarHBondContact O-N 3.19Å; A787-Q791 WeakPolarHBondContact O-CG 3.41Å; A787-Q791 PolarHBondContact O-N 2.98Å
788	F	65.3	Low	53.9	Low	135 Å²	135	121 Å²	121	59%	0.592	62%	0.623	S	S	*	*	H	α-helix	trans	-62.6	-31.1	176.3	-165.8	-101.9	0	0	0	112.8	A784 L786 L792	A784-F788 WeakPolarHBondContact O-CB 3.32Å; A784-F788 PolarHBondContact O-N 3.46Å; L786-F788 PolarHBondContact O-N 3.28Å; F788-L792 HydrophobicContact CD1-CD1 3.93Å; F788-L792 HydrophobicContact CE1-CD1 3.81Å; F788-L792 HydrophobicContact CE1-CG 4.41Å; F788-L792 WeakPolarHBondContact O-CG 3.45Å; F788-L792 PolarHBondContact O-N 2.99Å
789	R	63.2	Low	53.8	Low	164 Å²	164	115.7 Å²	115.7	62%	0.619	61%	0.612	S	S	*	*	H	α-helix	trans	-79.9	-37.5	178.9	-169.6	164.2	174.8	167.1	-4.5	112.5	Q785 L786 A787 Q791 L792 D793	Q785-R789 VanDerWaalsContact O-CB 3.23Å; Q785-R789 WeakPolarHBondContact O-CB 3.42Å; Q785-R789 PolarHBondContact O-N 3.07Å; L786-R789 PolarHBondContact O-N 2.84Å; L786-R789 VanDerWaalsContact O-N 3.14Å; A787-R789 PolarHBondContact O-N 2.96Å; R789-Q791 VanDerWaalsContact C-N 3.32Å; R789-L792 PolarHBondContact O-N 2.82Å; R789-D793 PolarHBondContact O-N 3.22Å
790	Q	65.2	Low	53.6	Low	138 Å²	138	118.6 Å²	118.6	65%	0.645	62%	0.62	S	S	*	*	H	α-helix	trans	-62.4	-38.2	167.7	-75.4	179.1	-31.5	0	0	111.7	L786 A787 D793 S794	L786-Q790 WeakPolarHBondContact O-CG 3.3Å; L786-Q790 PolarHBondContact O-N 2.99Å; A787-Q790 PolarHBondContact O-N 3.19Å; Q790-D793 PolarHBondContact O-N 2.99Å; Q790-S794 WeakPolarHBondContact O-CB 3.35Å; Q790-S794 PolarHBondContact O-N 3.08Å
791	Q	58.1	Low	53.1	Low	122 Å²	122	120.4 Å²	120.4	57%	0.57	62%	0.623	S	S	*	*	H	α-helix	trans	-59.3	-49.4	169.9	-75.8	-173.5	-92.6	0	0	111.1	A787 R789 D793 S794 I795	A787-Q791 WeakPolarHBondContact O-CG 3.41Å; A787-Q791 PolarHBondContact O-N 2.98Å; R789-Q791 VanDerWaalsContact C-N 3.32Å; Q791-D793 PolarHBondContact O-N 2.76Å; Q791-S794 PolarHBondContact O-N 3Å; Q791-S794 VanDerWaalsContact O-N 3.14Å; Q791-S794 PolarHBondContact O-OG 3.16Å; Q791-I795 WeakPolarHBondContact O-CG1 3.42Å; Q791-I795 PolarHBondContact O-N 3.32Å
792	L	58.7	Low	52	Low	90 Å²	90	124.5 Å²	124.5	47%	0.471	64%	0.637	S	S	.	*	H	α-helix	trans	-60.9	-42.7	178	-73.7	169.5	0	0	0	113.3	F788 R789 S794 I795 S796	F788-L792 HydrophobicContact CD1-CD1 3.93Å; F788-L792 HydrophobicContact CE1-CD1 3.81Å; F788-L792 HydrophobicContact CE1-CG 4.41Å; F788-L792 WeakPolarHBondContact O-CG 3.45Å; F788-L792 PolarHBondContact O-N 2.99Å; R789-L792 PolarHBondContact O-N 2.82Å; L792-S794 VanDerWaalsContact C-N 3.29Å; L792-S794 PolarHBondContact O-N 3.4Å; L792-I795 HydrophobicContact CD2-CD1 4.25Å; L792-I795 PolarHBondContact O-N 3.12Å; L792-S796 WeakPolarHBondContact O-CB 3.03Å; L792-S796 PolarHBondContact O-N 3.02Å
793	D	48.3	Very low	51	Low	100 Å²	100	125.2 Å²	125.2	54%	0.535	65%	0.647	S	S	.	*	H	α-helix	trans	-64.1	-34.2	175.1	-71.4	-34.6	0	0	0	111.7	R789 Q790 Q791 S796	R789-D793 PolarHBondContact O-N 3.22Å; Q790-D793 PolarHBondContact O-N 2.99Å; Q791-D793 PolarHBondContact O-N 2.76Å; D793-S796 PolarHBondContact O-N 3.08Å
794	S	52.8	Low	49.3	Very low	79 Å²	79	124.2 Å²	124.2	55%	0.552	66%	0.656	S	S	*	*	H	α-helix	trans	-67.6	-35.4	177.6	77.8	0	0	0	0	113.8	Q790 Q791 L792	Q790-S794 WeakPolarHBondContact O-CB 3.35Å; Q790-S794 PolarHBondContact O-N 3.08Å; Q791-S794 PolarHBondContact O-N 3Å; Q791-S794 VanDerWaalsContact O-N 3.14Å; Q791-S794 PolarHBondContact O-OG 3.16Å; L792-S794 VanDerWaalsContact C-N 3.29Å; L792-S794 PolarHBondContact O-N 3.4Å
795	I	54.2	Low	47.7	Very low	130 Å²	130	132.1 Å²	132.1	67%	0.667	67%	0.673	S	S	*	*	H	α-helix	trans	-79.1	-22	173.1	7.9	171.4	0	0	0	112.2	Q791 L792 M797	Q791-I795 WeakPolarHBondContact O-CG1 3.42Å; Q791-I795 PolarHBondContact O-N 3.32Å; L792-I795 HydrophobicContact CD2-CD1 4.25Å; L792-I795 PolarHBondContact O-N 3.12Å; I795-M797 VanDerWaalsContact C-N 3.26Å; I795-M797 PolarHBondContact O-N 3.12Å
796	S	45	Very low	46.3	Very low	77 Å²	77	133.6 Å²	133.6	54%	0.538	68%	0.68	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.4	-5.1	179.3	-166.5	0	0	0	0	114.5	L792 D793	L792-S796 WeakPolarHBondContact O-CB 3.03Å; L792-S796 PolarHBondContact O-N 3.02Å; D793-S796 PolarHBondContact O-N 3.08Å
797	M	42.8	Very low	44.7	Very low	158 Å²	158	140.1 Å²	140.1	78%	0.778	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.3	14.1	-174.2	-74.6	-75.6	101.7	0	0	114.8	I795	I795-M797 VanDerWaalsContact C-N 3.26Å; I795-M797 PolarHBondContact O-N 3.12Å
798	Q	41.2	Very low	43.1	Very low	182 Å²	182	146.5 Å²	146.5	85%	0.85	72%	0.717	S	S	*	*			trans	-117.8	66.1	173.3	-72.6	-163.3	-12.7	0	0	113.1
799	S	31.3	Very low	41.4	Very low	101 Å²	101	145.8 Å²	145.8	71%	0.706	73%	0.726	S	S	*	*			trans	-142.7	66.1	170.5	67.7	0	0	0	0	113.1
800	D	34.1	Very low	39.8	Very low	161 Å²	161	149.4 Å²	149.4	86%	0.861	74%	0.739	S	S	*	*			trans	-164.3	40.2	153.9	-114.2	-14.4	0	0	0	116.3
801	L	33.1	Very low	38.1	Very low	151 Å²	151	148.9 Å²	148.9	79%	0.791	74%	0.741	S	S	*	*	S	Bend	trans	-143.1	113.5	168.2	-65.4	175.3	0	0	0	109.1
802	F	30.6	Very low	36.7	Very low	184 Å²	184	155 Å²	155	81%	0.807	76%	0.759	S	S	*	*			cis	-139.4	140.3	-3.4	-80.8	-94.3	0	0	0	110.9
803	L	31.4	Very low	35.6	Very low	178 Å²	178	158.8 Å²	158.8	93%	0.932	77%	0.774	S	S	*	*			trans	-95.5	110.1	157.5	-89.4	171.9	0	0	0	110.6	R805	L803-R805 PolarHBondContact O-N 2.84Å
804	S	28.1	Very low	34.9	Very low	120 Å²	120	161 Å²	161	84%	0.839	79%	0.785	S	S	*	*			trans	-86.4	88.2	178.2	51.7	0	0	0	0	112.5
805	R	29.3	Very low	34.2	Very low	225 Å²	225	167.9 Å²	167.9	85%	0.849	80%	0.799	S	S	*	*			trans	-142.5	91	169	-150.4	169	-161.7	-79.5	-2.7	117.1	L803	L803-R805 PolarHBondContact O-N 2.84Å
806	Q	29.5	Very low	33.5	Very low	163 Å²	163	171 Å²	171	76%	0.762	81%	0.807	S	S	*	*			trans	52.8	88.9	136	-100.2	-82.3	-16	0	0	118.2
807	R	28.5	Very low	33.6	Very low	239 Å²	239	172.8 Å²	172.8	90%	0.902	82%	0.817	S	S	*	*			trans	-148	144.6	152.2	-68	-170.8	179.9	178.7	0.7	109.6
808	K	33.8	Very low	33.3	Very low	180 Å²	180	172.3 Å²	172.3	78%	0.783	82%	0.817	S	S	*	*			cis	-165.6	169.5	-27.9	-119.9	-172.4	179.1	-175.3	0	106
809	P	29.3	Very low	32.9	Very low	120 Å²	120	169 Å²	169	78%	0.779	81%	0.809	S	S	*	*			trans	-73.7	141.4	-172.6	29.6	-34.6	0	0	0	114.6
810	R	30.7	Very low	32.8	Very low	239 Å²	239	170.1 Å²	170.1	90%	0.902	81%	0.811	S	S	*	*			trans	42.4	81.6	141.2	-152.5	173.2	-163.6	153.4	3.1	119.1
811	N	29	Very low	32.9	Very low	128 Å²	128	168.5 Å²	168.5	68%	0.684	80%	0.799	S	S	*	*				28.6	110.5	126	-169.5	-6.2	0	0	0	119.2	Q813	N811-Q813 PolarHBondContact OD1-N 3.44Å
812	R	28.3	Very low	33.1	Very low	250 Å²	250	171.1 Å²	171.1	94%	0.943	80%	0.798	S	S	*	*				-132.1	135.1	115.1	-94.7	-171.8	174.6	179.3	-1.3	109.5
813	Q	35.7	Very low	33.2	Very low	169 Å²	169	168.4 Å²	168.4	79%	0.79	80%	0.797	S	S	*	*			trans	-120.8	158.6	177	-72.5	-174.6	-18.9	0	0	110.8	N811	N811-Q813 PolarHBondContact OD1-N 3.44Å
814	L	34.8	Very low	33.2	Very low	146 Å²	146	167 Å²	167	76%	0.764	79%	0.79	S	S	*	*			trans	176.9	147.4	140.9	-89	-179.3	0	0	0	106.6
815	R	37.3	Very low	33.6	Very low	225 Å²	225	169 Å²	169	85%	0.849	79%	0.79	S	S	*	*			cis	-158.2	168.4	-34.7	-127.5	-177.1	-156.6	148	0.7	108.5
816	K	39.3	Very low	34.7	Very low	194 Å²	194	163.7 Å²	163.7	84%	0.843	78%	0.784	S	S	*	*			trans	-102.9	-170.2	165.7	-52.5	-177.2	179	-178	0	108.9
817	P	46.5	Very low	34.8	Very low	115 Å²	115	168 Å²	168	75%	0.747	79%	0.793	S	S	*	*			cis	-134.7	-149.7	-4.8	45.2	-24.1	0	0	0	111.9
818	L	38.4	Very low	35.3	Very low	148 Å²	148	163 Å²	163	78%	0.775	79%	0.79	S	S	*	*			cis	-163.2	162.5	-8.3	-159.1	67.7	0	0	0	110.1
819	V	31.6	Very low	35.2	Very low	114 Å²	114	161.6 Å²	161.6	69%	0.691	80%	0.797	S	S	*	*			trans	70.1	140.4	165.5	-149	0	0	0	0	114.1
820	V	28.8	Very low	35.2	Very low	123 Å²	123	159.4 Å²	159.4	75%	0.745	80%	0.796	S	S	*	*				-148.8	131.5	50.9	173.1	0	0	0	0	114.8
821	Q	36.3	Very low	35.2	Very low	127 Å²	127	155 Å²	155	59%	0.593	79%	0.79	S	S	*	*			trans	15.7	132.5	145.9	-52.8	178	13.1	0	0	124.5
822	R	37.7	Very low	36	Very low	207 Å²	207	154 Å²	154	78%	0.781	79%	0.789	S	S	*	*			trans	69.1	158.1	136.2	-61.2	164.9	-177.4	149.3	-7.2	117.1
823	T	33.3	Very low	36.7	Very low	127 Å²	127	147.6 Å²	147.6	78%	0.779	78%	0.78	S	S	*	*			cis	-149.5	170.5	12.1	-21.8	0	0	0	0	113.7
824	L	31.3	Very low	37	Very low	149 Å²	149	146.3 Å²	146.3	78%	0.78	77%	0.774	S	S	*	*			trans	-50	139.8	-175.7	-58.6	158.7	0	0	0	120.8
825	L	36.6	Very low	37.1	Very low	161 Å²	161	147.2 Å²	147.2	84%	0.843	77%	0.773	S	S	*	*			trans	51.1	155.4	138.2	-90.1	70.9	0	0	0	124
826	P	51.3	Low	36.8	Very low	113 Å²	113	143.3 Å²	143.3	73%	0.734	77%	0.774	S	S	*	*			trans	-104.4	166.4	-169.5	41.2	-36.4	0	0	0	116.2
827	R	31.8	Very low	36.4	Very low	253 Å²	253	139.4 Å²	139.4	96%	0.955	77%	0.77	S	S	*	*			trans	-145.8	166.4	160.8	-76.8	-163.9	171.9	177.4	-2.4	111.6
828	T	39.4	Very low	35.6	Very low	134 Å²	134	138.9 Å²	138.9	82%	0.822	77%	0.769	S	S	*	*			trans	-136.3	145.3	-156.3	49.1	0	0	0	0	116.3
829	T	31.8	Very low	35.5	Very low	152 Å²	152	141.2 Å²	141.2	93%	0.933	77%	0.773	S	S	*	*			trans	-157	151.7	150.5	46.1	0	0	0	0	106.3
830	G	30.3	Very low	35.6	Very low	73 Å²	73	140.4 Å²	140.4	75%	0.753	77%	0.773	S	S	*	*			cis	171.9	168.4	-1.4	0	0	0	0	0	107.9
831	D	30.2	Very low	35.8	Very low	148 Å²	148	141.8 Å²	141.8	79%	0.791	78%	0.775	S	S	*	*			cis	-150.5	-76.2	-2.9	178.8	-98.6	0	0	0	111.5
832	T	45.4	Very low	35.9	Very low	107 Å²	107	143 Å²	143	66%	0.656	79%	0.785	S	S	*	*			trans	-133.7	160.3	-174.1	40.8	0	0	0	0	112.6
833	P	43.1	Very low	35.5	Very low	115 Å²	115	137.9 Å²	137.9	75%	0.747	78%	0.78	S	S	*	*			cis	-120.2	156.2	9.8	39.7	-27.1	0	0	0	117.1
834	Q	40.9	Very low	35.3	Very low	142 Å²	142	138.7 Å²	138.7	66%	0.664	78%	0.78	S	S	*	*			trans	6.7	131.6	150	-46.6	-66	-18	0	0	117.9
835	H	36.8	Very low	35.6	Very low	164 Å²	164	136.6 Å²	136.6	76%	0.759	78%	0.778	S	S	*	*			cis	-140.5	128.4	24.4	-65.1	-98.8	0	0	0	113.6
836	V	31.1	Very low	35.4	Very low	143 Å²	143	134.4 Å²	134.4	87%	0.867	78%	0.776	S	S	*	*			trans	38.6	120.6	155.6	-159.6	0	0	0	0	119.7
837	C	31.9	Very low	34.5	Very low	113 Å²	113	133.4 Å²	133.4	76%	0.764	78%	0.777	S	S	*	*			trans	-126.2	151.7	-170.4	-49.8	0	0	0	0	116.5
838	S	30.2	Very low	34.7	Very low	103 Å²	103	128.6 Å²	128.6	72%	0.72	78%	0.776	S	S	*	*			trans	37.2	119.8	134.2	-57.8	0	0	0	0	124.1
839	F	36.4	Very low	34.2	Very low	197 Å²	197	125 Å²	125	86%	0.864	77%	0.765	S	S	*	*				61.2	130.7	129.6	-78.7	-82.8	0	0	0	124.5
840	S	33	Very low	34.2	Very low	98 Å²	98	125.2 Å²	125.2	69%	0.685	77%	0.766	S	S	*	*			trans	98.9	122.5	130.7	-75.6	0	0	0	0	124.6
841	I	33.4	Very low	34.1	Very low	152 Å²	152	125.3 Å²	125.3	78%	0.779	77%	0.768	S	S	*	*			trans	90.7	107.9	141	-61	161.4	0	0	0	121.8
842	L	37.4	Very low	34	Very low	153 Å²	153	123.4 Å²	123.4	80%	0.801	77%	0.766	S	S	*	*			trans	37.9	124.7	138.9	-60.6	175.3	0	0	0	125.6
843	S	30	Very low	33.3	Very low	99 Å²	99	126.6 Å²	126.6	69%	0.692	77%	0.771	S	S	*	*				86.5	116.4	126.8	-69.1	0	0	0	0	124.6
844	N	29.2	Very low	33.3	Very low	144 Å²	144	131.2 Å²	131.2	77%	0.77	77%	0.774	S	S	*	*			trans	75.1	93.8	137.2	-69	22.2	0	0	0	123.6
845	S	38.3	Very low	33.7	Very low	105 Å²	105	129.6 Å²	129.6	73%	0.734	78%	0.775	S	S	*	*				86.3	143.7	111.6	-56.1	0	0	0	0	123.9
846	S	31.7	Very low	33.5	Very low	115 Å²	115	129.7 Å²	129.7	80%	0.804	78%	0.78	S	S	*	*			trans	93.8	89	147.3	-60.8	0	0	0	0	122.3
847	A	33	Very low	33.3	Very low	91 Å²	91	129.3 Å²	129.3	75%	0.752	77%	0.773	S	S	*	*				57.4	124.5	117.5	0	0	0	0	0	123.4
848	T	34.3	Very low	33.1	Very low	153 Å²	153	129 Å²	129	94%	0.939	77%	0.768	S	S	*	*				177.7	150.5	124.7	24.3	0	0	0	0	109.5
849	G	29.5	Very low	33	Very low	57 Å²	57	134.3 Å²	134.3	59%	0.588	77%	0.772	S	S	*	*			cis	174	178.3	-9.1	0	0	0	0	0	112.8
850	T	31.8	Very low	32.6	Very low	157 Å²	157	132.2 Å²	132.2	96%	0.963	77%	0.769	S	S	*	*			trans	67.3	150.9	161.9	64.4	0	0	0	0	121.1
851	G	28.7	Very low	32.5	Very low	76 Å²	76	131.8 Å²	131.8	78%	0.784	77%	0.771	S	S	*	*			trans	93.4	87.7	167	0	0	0	0	0	115.7
852	S	28.4	Very low	32.9	Very low	108 Å²	108	129.9 Å²	129.9	76%	0.755	77%	0.769	S	S	*	*				91.9	89.5	52.6	-172.7	0	0	0	0	115.8
853	F	29.5	Very low	32.4	Very low	174 Å²	174	128.9 Å²	128.9	76%	0.763	77%	0.769	S	S	*	*			trans	69.7	127.2	140.6	-86.6	-56.1	0	0	0	124
854	R	43.9	Very low	32.3	Very low	212 Å²	212	129.2 Å²	129.2	80%	0.8	77%	0.771	S	S	*	*			trans	99.8	152.9	136.6	-74.7	-174	-169.2	-77.8	-9.2	120.1
855	P	48.3	Very low	32.3	Very low	107 Å²	107	133.9 Å²	133.9	70%	0.695	78%	0.778	S	S	*	*			trans	-127	-169.9	-150.5	44.9	-30.3	0	0	0	113.5
856	I	32.6	Very low	33.2	Very low	167 Å²	167	133.6 Å²	133.6	86%	0.856	77%	0.774	S	S	*	*			trans	-167.1	167.5	135	-103.5	155.1	0	0	0	113.5
857	N	28.5	Very low	33.8	Very low	134 Å²	134	133.6 Å²	133.6	72%	0.717	77%	0.771	S	S	*	*			trans	-58.6	148.3	-165.1	-83.8	-60.3	0	0	0	121.3
858	T	27	Very low	33.6	Very low	108 Å²	108	137.7 Å²	137.7	66%	0.663	78%	0.777	S	S	*	*			trans	4.5	135.9	131	63	0	0	0	0	120.8
859	R	28.4	Very low	33.4	Very low	213 Å²	213	136 Å²	136	80%	0.804	77%	0.766	S	S	*	*				166.2	147.7	107.8	-93.4	-174.1	-179.5	-124.3	-0.2	115.2
860	L	28	Very low	33.4	Very low	154 Å²	154	141.9 Å²	141.9	81%	0.806	78%	0.776	S	S	*	*			trans	63.4	146	147	-65.6	165.6	0	0	0	121.6
861	A	31.6	Very low	33.2	Very low	88 Å²	88	139.7 Å²	139.7	73%	0.727	76%	0.763	S	S	*	*			trans	-98.7	172.1	163.2	0	0	0	0	0	109.9
862	P	40.8	Very low	33.1	Very low	113 Å²	113	141 Å²	141	73%	0.734	76%	0.76	S	S	*	*				-160.4	159.9	78.5	41.6	-20.5	0	0	0	120.2
863	T	27.6	Very low	34.3	Very low	131 Å²	131	141.1 Å²	141.1	80%	0.804	76%	0.758	S	S	*	*			trans	65.6	172.7	137.7	-147.1	0	0	0	0	124.5
864	S	26.4	Very low	35.1	Very low	106 Å²	106	138.1 Å²	138.1	74%	0.741	76%	0.756	S	S	*	*			trans	65.9	114.3	177.8	50.3	0	0	0	0	117.2
865	R	29.2	Very low	34.4	Very low	243 Å²	243	132.5 Å²	132.5	92%	0.917	76%	0.755	S	S	*	*			cis	92.3	169.2	33.3	-132.3	-156.7	-177.3	-164.7	3.9	113.2
866	P	58.9	Low	33.5	Very low	99 Å²	99	132.7 Å²	132.7	64%	0.643	76%	0.759	S	S	*	*				-117.5	-166.1	-109.6	42.9	-26.8	0	0	0	114.4
867	P	43.3	Very low	33.5	Very low	115 Å²	115	130.1 Å²	130.1	75%	0.747	76%	0.755	S	S	*	*				-147.7	145.8	117.1	35.9	-19.8	0	0	0	118.2
868	M	29	Very low	33.6	Very low	177 Å²	177	129.1 Å²	129.1	87%	0.872	76%	0.759	S	S	*	*			trans	57.7	138.3	136.7	-66.9	-169.6	160.7	0	0	122.5
869	T	30.8	Very low	33.7	Very low	117 Å²	117	128.7 Å²	128.7	72%	0.718	77%	0.766	S	S	*	*			cis	-143.2	-141.2	-15.5	37.4	0	0	0	0	107.7
870	K	29.2	Very low	33.9	Very low	180 Å²	180	123.1 Å²	123.1	78%	0.783	77%	0.766	S	S	*	*			cis	-165.5	165.7	-1.7	-137.2	-172.8	175	-176.2	0	106.2
871	T	26.5	Very low	34.6	Very low	112 Å²	112	121.2 Å²	121.2	69%	0.687	76%	0.763	S	S	*	*			cis	-138.4	-136.7	2.1	-38.7	0	0	0	0	109.4
872	S	28.2	Very low	34.9	Very low	103 Å²	103	122.1 Å²	122.1	72%	0.72	76%	0.764	S	S	*	*			trans	-174.4	-170.6	-171.8	61.7	0	0	0	0	109.4
873	P	53.5	Low	34.6	Very low	110 Å²	110	125.8 Å²	125.8	71%	0.714	77%	0.771	S	S	*	*			cis	-135.2	-154.2	-3.1	47.9	-29.9	0	0	0	112
874	P	45.9	Very low	35	Very low	112 Å²	112	126.4 Å²	126.4	73%	0.727	77%	0.769	S	S	*	*			cis	-133.2	148.1	-14	34.2	-14.7	0	0	0	118.1
875	A	29.2	Very low	35.7	Very low	94 Å²	94	128 Å²	128	78%	0.777	78%	0.78	S	S	*	*			trans	65.4	150.4	142	0	0	0	0	0	120.8
876	S	29	Very low	36.8	Very low	111 Å²	111	120.1 Å²	120.1	78%	0.776	76%	0.762	S	S	*	*			cis	-140.4	154.5	11.3	-66.7	0	0	0	0	114.2
877	S	32.1	Very low	36.1	Very low	112 Å²	112	119.3 Å²	119.3	78%	0.783	76%	0.763	S	S	*	*			trans	-8.1	151.5	159.7	58.6	0	0	0	0	120.7
878	S	30.4	Very low	36.6	Very low	114 Å²	114	121.2 Å²	121.2	80%	0.797	77%	0.766	S	S	*	*			cis	-171	163.4	48.3	-161.6	0	0	0	0	116.4
879	A	29.6	Very low	37.6	Very low	98 Å²	98	117.7 Å²	117.7	81%	0.81	75%	0.75	S	S	*	*			trans	69.1	165.2	155.9	0	0	0	0	0	120.8
880	A	32.1	Very low	38.7	Very low	96 Å²	96	118.2 Å²	118.2	79%	0.793	75%	0.748	S	S	*	*			trans	-136.2	-147.8	-171	0	0	0	0	0	112.1
881	P	43.7	Very low	39.7	Very low	115 Å²	115	112.4 Å²	112.4	75%	0.747	73%	0.734	S	S	*	*				-119	176.7	-111.1	38.8	-23	0	0	0	116.8
882	S	36.6	Very low	41	Very low	107 Å²	107	109.4 Å²	109.4	75%	0.748	72%	0.72	S	S	*	*			trans	59.1	100.4	153.9	58.8	0	0	0	0	119.8
883	Q	34.8	Very low	41.9	Very low	189 Å²	189	111.6 Å²	111.6	88%	0.883	72%	0.717	S	S	*	*			trans	-151.3	-176.3	150.5	-78.3	-149.8	-0.1	0	0	110.7
884	L	37.4	Very low	41.6	Very low	145 Å²	145	111.2 Å²	111.2	76%	0.759	72%	0.717	S	S	*	*			trans	93.1	34.6	167.4	-52.2	-175.7	0	0	0	120.6	S886	L884-S886 PolarHBondContact O-N 3.48Å; L884-S886 VanDerWaalsContact O-N 3.13Å
885	S	40.1	Very low	42.2	Very low	140 Å²	140	108.8 Å²	108.8	98%	0.979	71%	0.706	S	S	*	*			trans	-78.1	68.3	141.1	-69.1	0	0	0	0	109.8
886	S	51.9	Low	43.1	Very low	76 Å²	76	107.6 Å²	107.6	53%	0.531	70%	0.703	S	S	.	*			trans	-143.7	-2	-170.9	-164.7	0	0	0	0	116.1	L884	L884-S886 PolarHBondContact O-N 3.48Å; L884-S886 VanDerWaalsContact O-N 3.13Å
887	A	44.1	Very low	44.3	Very low	82 Å²	82	109 Å²	109	68%	0.678	70%	0.7	S	S	*	*	S	Bend	trans	-83.2	-28.8	-174.6	0	0	0	0	0	114.4
888	I	55.2	Low	45	Very low	155 Å²	155	110.1 Å²	110.1	80%	0.795	70%	0.696	S	S	*	*	H	α-helix	trans	-81.4	-40.6	-169.5	-58.4	175	0	0	0	111.7	L890 A891	I888-L890 VanDerWaalsContact C-N 3.29Å; I888-L890 PolarHBondContact O-N 3.32Å; I888-A891 PolarHBondContact O-N 3.14Å
889	D	48.7	Very low	45.1	Very low	103 Å²	103	110.9 Å²	110.9	55%	0.551	70%	0.699	S	S	*	*	H	α-helix	trans	-70.8	-23.2	-177.4	-168.1	68.1	0	0	0	113.3	K893	D889-K893 IonicContact OD1-NZ 2.67Å; D889-K893 IonicContact OD2-NZ 2.63Å; D889-K893 PolarHBondContact OD2-NZ 3.43Å
890	L	54.8	Low	45.5	Very low	129 Å²	129	109.1 Å²	109.1	68%	0.675	69%	0.69	S	S	*	*	H	α-helix	trans	-75.3	-38.3	178.7	-158.8	70.5	0	0	0	112	I888 K893 S894	I888-L890 VanDerWaalsContact C-N 3.29Å; I888-L890 PolarHBondContact O-N 3.32Å; L890-K893 PolarHBondContact O-N 2.88Å; L890-S894 PolarHBondContact O-N 3Å
891	A	50.8	Low	45.6	Very low	58 Å²	58	110.4 Å²	110.4	48%	0.479	69%	0.693	S	S	.	*	H	α-helix	trans	-68.6	-34.4	179.8	0	0	0	0	0	112.9	I888 K893 S894 A895	I888-A891 PolarHBondContact O-N 3.14Å; A891-K893 VanDerWaalsContact C-N 3.26Å; A891-K893 PolarHBondContact O-N 3.28Å; A891-S894 WeakPolarHBondContact CA-OG 3.37Å; A891-S894 PolarHBondContact O-N 2.88Å; A891-S894 PolarHBondContact O-OG 3.11Å; A891-A895 PolarHBondContact O-N 3.26Å
892	A	53.1	Low	45	Very low	48 Å²	48	110.6 Å²	110.6	40%	0.397	69%	0.694	S	S	.	*	H	α-helix	trans	-63.6	-32	176.6	0	0	0	0	0	112.7
893	K	45.9	Very low	44.8	Very low	149 Å²	149	111 Å²	111	65%	0.648	70%	0.695	S	S	*	*	H	α-helix	trans	-79	-27.2	179	-75	162.5	179.8	157.9	0	113.4	D889 L890 A891	D889-K893 IonicContact OD1-NZ 2.67Å; D889-K893 IonicContact OD2-NZ 2.63Å; D889-K893 PolarHBondContact OD2-NZ 3.43Å; L890-K893 PolarHBondContact O-N 2.88Å; A891-K893 VanDerWaalsContact C-N 3.26Å; A891-K893 PolarHBondContact O-N 3.28Å
894	S	48.6	Very low	44.6	Very low	102 Å²	102	113 Å²	113	71%	0.713	70%	0.695	S	S	*	*	H	α-helix	trans	-81.7	-9.5	174.3	50.6	0	0	0	0	114.9	L890 A891	L890-S894 PolarHBondContact O-N 3Å; A891-S894 WeakPolarHBondContact CA-OG 3.37Å; A891-S894 PolarHBondContact O-N 2.88Å; A891-S894 PolarHBondContact O-OG 3.11Å
895	A	57.9	Low	44.3	Very low	62 Å²	62	112.8 Å²	112.8	51%	0.512	70%	0.695	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.8	0.7	-170.9	0	0	0	0	0	115.3	A891 I897	A891-A895 PolarHBondContact O-N 3.26Å; A895-I897 HydrophobicContact CB-CD1 4.2Å; A895-I897 HydrophobicContact CB-CG1 4.3Å; A895-I897 PolarHBondContact O-N 3.27Å
896	G	47.5	Very low	43.8	Very low	69 Å²	69	113.6 Å²	113.6	71%	0.711	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.7	17	171.9	0	0	0	0	0	116.7	I898	G896-I898 VanDerWaalsContact C-N 3.3Å; G896-I898 PolarHBondContact O-N 2.91Å
897	I	54.2	Low	42.4	Very low	139 Å²	139	116.2 Å²	116.2	71%	0.713	70%	0.695	S	S	*	*			trans	-80.5	-3.7	-171.6	-61.9	177	0	0	0	113.4	A895	A895-I897 HydrophobicContact CB-CD1 4.2Å; A895-I897 HydrophobicContact CB-CG1 4.3Å; A895-I897 PolarHBondContact O-N 3.27Å
898	I	46.8	Very low	41.6	Very low	137 Å²	137	117 Å²	117	70%	0.703	70%	0.696	S	S	*	*	S	Bend	trans	-122.2	124.7	-180	-56.8	179.5	0	0	0	110.7	G896 G900	G896-I898 VanDerWaalsContact C-N 3.3Å; G896-I898 PolarHBondContact O-N 2.91Å; I898-G900 PolarHBondContact O-N 2.96Å
899	P	32.5	Very low	40.3	Very low	130 Å²	130	117.6 Å²	117.6	84%	0.844	70%	0.699	S	S	*	*			trans	-75.2	122.3	173.7	-15.4	30.3	0	0	0	112.9
900	G	38.8	Very low	39.2	Very low	61 Å²	61	116.6 Å²	116.6	63%	0.629	71%	0.706	S	S	*	*			trans	110.4	140.3	156.6	0	0	0	0	0	117.2	I898	I898-G900 PolarHBondContact O-N 2.96Å
901	S	33.3	Very low	38.2	Very low	123 Å²	123	117.2 Å²	117.2	86%	0.86	72%	0.715	S	S	*	*			trans	76.2	154.1	176.3	89.3	0	0	0	0	115.3
902	P	33	Very low	37.1	Very low	118 Å²	118	121.7 Å²	121.7	77%	0.766	73%	0.73	S	S	*	*				-133.3	152.8	-97	29.2	-8.6	0	0	0	116
903	C	31.2	Very low	36	Very low	115 Å²	115	124.2 Å²	124.2	78%	0.777	75%	0.752	S	S	*	*			trans	-70.5	151	169.4	-55.9	0	0	0	0	112.1
904	R	30.1	Very low	35	Very low	233 Å²	233	121.5 Å²	121.5	88%	0.879	76%	0.756	S	S	*	*			trans	-141	118.1	157.8	-73.9	-134.4	71.1	158.7	4.6	110.5
905	D	30.9	Very low	34	Very low	140 Å²	140	123.1 Å²	123.1	75%	0.749	76%	0.762	S	S	*	*			trans	-86.4	163.2	174.1	-48.3	-90.6	0	0	0	112.4
906	L	30.3	Very low	32.6	Very low	156 Å²	156	127.5 Å²	127.5	82%	0.817	78%	0.776	S	S	*	*			trans	175.5	137.6	160.6	-93.5	157.4	0	0	0	107.9
907	D	23.5	Very low	31.6	Very low	132 Å²	132	128.7 Å²	128.7	71%	0.706	78%	0.779	S	S	*	*			cis	-161.7	158.7	-27.8	-143.2	-29.3	0	0	0	112.7
908	S	25.8	Very low	30.2	Very low	98 Å²	98	125.9 Å²	125.9	69%	0.685	78%	0.777	S	S	*	*			trans	9.1	133	154.9	-61.8	0	0	0	0	124.3
909	L	28.1	Very low	29.2	Very low	167 Å²	167	125.5 Å²	125.5	87%	0.874	78%	0.781	S	S	*	*			trans	-164.6	119.9	141.7	-114.8	156.2	0	0	0	108.1
910	A	26.7	Very low	29.2	Very low	82 Å²	82	123.8 Å²	123.8	68%	0.678	77%	0.77	S	S	*	*			cis	98.9	82	17.2	0	0	0	0	0	116.5
911	V	33.9	Very low	28.6	Very low	143 Å²	143	128.3 Å²	128.3	87%	0.867	78%	0.778	S	S	*	*			trans	-147.2	173.5	155.8	-136	0	0	0	0	111
912	N	28.1	Very low	28.3	Very low	151 Å²	151	127.7 Å²	127.7	81%	0.807	77%	0.768	S	S	*	*			trans	-127.9	155.7	-152.1	-68.8	-71.9	0	0	0	117.3
913	A	28.2	Very low	27.9	Very low	102 Å²	102	129 Å²	129	84%	0.843	77%	0.769	S	S	*	*			trans	62.8	119.6	140.7	0	0	0	0	0	122.4
914	A	26.8	Very low	27.6	Very low	91 Å²	91	127.6 Å²	127.6	75%	0.752	77%	0.765	S	S	*	*				-167.2	133.7	107.7	0	0	0	0	0	112.7
915	V	26.9	Very low	27.5	Very low	137 Å²	137	120.9 Å²	120.9	83%	0.83	76%	0.76	S	S	*	*			trans	55.9	124.1	152	177.9	0	0	0	0	118.6
916	L	27.6	Very low	27.9	Very low	154 Å²	154	118.3 Å²	118.3	81%	0.806	75%	0.751	S	S	*	*			cis	-160.9	147.4	-5.4	-118.6	178.9	0	0	0	109.8
917	A	27	Very low	27.8	Very low	94 Å²	94	116.8 Å²	116.8	78%	0.777	74%	0.744	S	S	*	*			trans	53.9	136.8	157.2	0	0	0	0	0	120.3
918	A	25.3	Very low	28.3	Very low	80 Å²	80	113.2 Å²	113.2	66%	0.661	73%	0.733	S	S	*	*			cis	-162.6	114	-6.1	0	0	0	0	0	111.1
919	T	25.2	Very low	28.4	Very low	128 Å²	128	116.1 Å²	116.1	79%	0.785	74%	0.735	S	S	*	*				34.7	157.6	116.1	60.6	0	0	0	0	121.3
920	P	32.2	Very low	28.4	Very low	95 Å²	95	114.8 Å²	114.8	62%	0.617	73%	0.728	S	S	*	*			cis	-151.5	-170.4	-29.5	38.7	-17.7	0	0	0	116.1
921	I	26.3	Very low	28.4	Very low	156 Å²	156	118.1 Å²	118.1	80%	0.8	73%	0.734	S	S	*	*			trans	69.7	146.1	136.3	-84.5	160.4	0	0	0	118.4
922	V	26.9	Very low	27.9	Very low	109 Å²	109	118.6 Å²	118.6	66%	0.661	73%	0.726	S	S	*	*			cis	-158.1	144.6	-3.3	122.1	0	0	0	0	105.3
923	D	25.1	Very low	27.8	Very low	147 Å²	147	118.5 Å²	118.5	79%	0.786	72%	0.721	S	S	*	*			cis	88.8	155.6	42	-170.2	39.4	0	0	0	115.2
924	A	25.3	Very low	27.5	Very low	84 Å²	84	119.6 Å²	119.6	69%	0.694	71%	0.713	S	S	*	*			trans	73.4	129.1	168.3	0	0	0	0	0	121.2
925	A	28.5	Very low	27.3	Very low	92 Å²	92	120.8 Å²	120.8	76%	0.76	71%	0.711	S	S	*	*			trans	-84.1	-171.7	155.6	0	0	0	0	0	110.4
926	P	38.9	Very low	28	Very low	87 Å²	87	119.7 Å²	119.7	57%	0.565	71%	0.706	S	S	*	*				-158.7	173.7	83.2	41	-20.1	0	0	0	117.9
927	D	28.3	Very low	27.9	Very low	124 Å²	124	118.2 Å²	118.2	66%	0.663	70%	0.695	S	S	*	*			trans	44.2	127.7	141.9	-71.1	-43.2	0	0	0	122.8	H731	H731-D927 PolarHBondContact CE1-O 2.67Å; H731-D927 VanDerWaalsContact CE1-O 3.23Å; H731-D927 PolarHBondContact ND1-O 3.32Å
928	A	32.5	Very low	28	Very low	57 Å²	57	120.2 Å²	120.2	47%	0.471	70%	0.697	S	S	.	*				79.7	171.5	81.1	0	0	0	0	0	113.9
929	Q	28.7	Very low	28.1	Very low	159 Å²	159	124 Å²	124	74%	0.743	70%	0.695	S	S	*	*			cis	-164.4	173.4	10.7	-146.7	-175.3	8	0	0	111
930	L	27.9	Very low	28.1	Very low	138 Å²	138	125.8 Å²	125.8	72%	0.723	69%	0.687	S	S	*	*			trans	67.1	165.7	156.2	-63.2	174	0	0	0	118.9
931	L	26.3	Very low	27.8	Very low	152 Å²	152	128.1 Å²	128.1	80%	0.796	70%	0.7	S	S	*	*			cis	-136	-148.2	7.2	-139.6	178.3	0	0	0	112.1
932	Q	24.1	Very low	27.7	Very low	153 Å²	153	127.1 Å²	127.1	72%	0.715	70%	0.696	S	S	*	*			trans	-166.4	-177.2	-167.4	-153.1	-177.7	95.4	0	0	112.5
933	Q	25.1	Very low	27.5	Very low	149 Å²	149	126.7 Å²	126.7	70%	0.696	70%	0.704	S	S	*	*			trans	81.1	152.2	149.6	-83.6	-171.1	11.4	0	0	120.4
934	N	23.7	Very low	27.7	Very low	125 Å²	125	128.2 Å²	128.2	67%	0.668	71%	0.71	S	S	*	*			cis	-168.2	159.2	-19.3	-145.4	3.8	0	0	0	114.7
935	V	22.3	Very low	27.7	Very low	117 Å²	117	130.9 Å²	130.9	71%	0.709	71%	0.713	S	S	*	*			trans	62.9	159	141.2	146.3	0	0	0	0	119.9
936	P	41.5	Very low	27.7	Very low	113 Å²	113	131.7 Å²	131.7	73%	0.734	71%	0.708	S	S	*	*			cis	-117.5	-163.5	5.8	47.3	-35.6	0	0	0	113.5
937	E	25.6	Very low	27.1	Very low	123 Å²	123	134.8 Å²	134.8	58%	0.575	72%	0.715	S	S	*	*			cis	-125.8	-104.8	-8	-165.9	-161.7	86.6	0	0	112.6	R939	E937-R939 IonicContact OE1-CZ 3.46Å; E937-R939 IonicContact OE1-NE 2.74Å; E937-R939 PolarHBondContact OE1-NE 3.11Å; E937-R939 IonicContact OE1-NH2 3.38Å; E937-R939 PolarHBondContact OE1-NH2 2.64Å; E937-R939 IonicContact OE2-CZ 3.55Å; E937-R939 IonicContact OE2-NE 3.58Å; E937-R939 IonicContact OE2-NH2 2.71Å; E937-R939 PolarHBondContact OE2-NH2 2.75Å
938	V	27.3	Very low	27.2	Very low	136 Å²	136	134.6 Å²	134.6	82%	0.824	72%	0.718	S	S	*	*			cis	-152.6	175.1	0.5	75.8	0	0	0	0	113
939	R	27.8	Very low	27	Very low	159 Å²	159	135.9 Å²	135.9	60%	0.6	74%	0.737	S	S	*	*			trans	-129.2	155.8	-163.5	-93	180	-78	167	-10.6	113.2	E937	E937-R939 IonicContact OE1-CZ 3.46Å; E937-R939 IonicContact OE1-NE 2.74Å; E937-R939 PolarHBondContact OE1-NE 3.11Å; E937-R939 IonicContact OE1-NH2 3.38Å; E937-R939 PolarHBondContact OE1-NH2 2.64Å; E937-R939 IonicContact OE2-CZ 3.55Å; E937-R939 IonicContact OE2-NE 3.58Å; E937-R939 IonicContact OE2-NH2 2.71Å; E937-R939 PolarHBondContact OE2-NH2 2.75Å
940	R	26.4	Very low	27	Very low	166 Å²	166	135.5 Å²	135.5	63%	0.626	74%	0.74	S	S	*	*			cis	-163.8	146.9	-2.3	-157.8	-170.3	-76.8	107.6	-18.1	111.5	D942	R940-D942 VanDerWaalsContact CD-OD2 3.27Å; R940-D942 WeakPolarHBondContact CD-OD2 3.47Å; R940-D942 WeakPolarHBondContact CG-OD2 3.34Å
941	T	24.4	Very low	26.9	Very low	145 Å²	145	137.6 Å²	137.6	89%	0.89	74%	0.743	S	S	*	*			trans	-169.4	150.8	136.8	21	0	0	0	0	108.8
942	D	25.1	Very low	27.1	Very low	135 Å²	135	137.3 Å²	137.3	72%	0.722	74%	0.74	S	S	*	*			trans	-121.2	168	-147	-60	-76.9	0	0	0	117.2	R940	R940-D942 VanDerWaalsContact CD-OD2 3.27Å; R940-D942 WeakPolarHBondContact CD-OD2 3.47Å; R940-D942 WeakPolarHBondContact CG-OD2 3.34Å
943	A	23.7	Very low	27.5	Very low	99 Å²	99	137.7 Å²	137.7	82%	0.818	75%	0.747	S	S	*	*			trans	81.1	86.7	162	0	0	0	0	0	120.6
944	I	29.1	Very low	27.7	Very low	180 Å²	180	135.2 Å²	135.2	92%	0.923	75%	0.746	S	S	*	*			trans	-132.7	147.8	151.5	-65.7	-178.5	0	0	0	108.7
945	N	24.8	Very low	27.9	Very low	139 Å²	139	137.8 Å²	137.8	74%	0.743	75%	0.751	S	S	*	*			trans	-116.6	111.4	-170.8	-164.3	19.4	0	0	0	112.9
946	V	27.4	Very low	28.2	Very low	110 Å²	110	140.6 Å²	140.6	67%	0.667	75%	0.754	S	S	*	*			trans	38.5	122.8	135.5	-173.9	0	0	0	0	117.1
947	Q	27.9	Very low	27.7	Very low	151 Å²	151	142.2 Å²	142.2	71%	0.706	75%	0.752	S	S	*	*				-172.2	152.2	57.8	-159.4	32	-34.3	0	0	115.3
948	T	30.3	Very low	28	Very low	120 Å²	120	144.4 Å²	144.4	74%	0.736	76%	0.76	S	S	*	*			trans	36.2	145.7	154.9	52.9	0	0	0	0	124.6
949	G	28.7	Very low	28.4	Very low	84 Å²	84	139.9 Å²	139.9	87%	0.866	73%	0.734	S	S	*	*			trans	150.2	85.2	137.4	0	0	0	0	0	117.8
950	L	26.7	Very low	28.5	Very low	152 Å²	152	140.3 Å²	140.3	80%	0.796	75%	0.747	S	S	*	*			trans	-112.5	126.4	-178.9	-172.4	81.5	0	0	0	112.8
951	K	27.7	Very low	28.7	Very low	181 Å²	181	137.1 Å²	137.1	79%	0.787	74%	0.743	S	S	*	*			trans	162.8	109.1	135.4	-89.6	161.1	-176	179.4	0	115.3
952	I	30.3	Very low	28.9	Very low	146 Å²	146	138.8 Å²	138.8	75%	0.749	74%	0.738	S	S	*	*				36.6	122	114.3	-60.1	168.4	0	0	0	119.2
953	L	32.6	Very low	29.4	Very low	161 Å²	161	138 Å²	138	84%	0.843	74%	0.737	S	S	*	*			trans	42.5	118.8	155.5	-101.8	67.2	0	0	0	120.4
954	S	27.7	Very low	30.4	Very low	97 Å²	97	138.4 Å²	138.4	68%	0.678	73%	0.732	S	S	*	*				174.7	153.5	94.4	56	0	0	0	0	113.8
955	F	29	Very low	30.4	Very low	180 Å²	180	140.5 Å²	140.5	79%	0.789	73%	0.73	S	S	*	*			trans	58.8	161.9	167.7	-63.4	-72.9	0	0	0	118
956	F	27.6	Very low	30.8	Very low	175 Å²	175	140.1 Å²	140.1	77%	0.768	73%	0.732	S	S	*	*			cis	-122.4	136.5	4.6	-100.3	-82.2	0	0	0	113.5	F958	F956-F958 HydrophobicContact CD1-CD2 4.29Å; F956-F958 HydrophobicContact CE1-CD2 4.47Å
957	H	30.8	Very low	31.2	Very low	148 Å²	148	142.9 Å²	142.9	69%	0.685	74%	0.742	S	S	*	*			trans	-92.2	128.2	150.7	158.7	-69.4	0	0	0	107.3	S959	H957-S959 PolarHBondContact CE1-OG 3.33Å
958	F	32.2	Very low	31.6	Very low	168 Å²	168	141.7 Å²	141.7	74%	0.737	75%	0.745	S	S	*	*			trans	-160.5	155	160	-130.7	-88.9	0	0	0	114.5	F956 L961	F956-F958 HydrophobicContact CD1-CD2 4.29Å; F956-F958 HydrophobicContact CE1-CD2 4.47Å; F958-L961 HydrophobicContact CE1-CD1 3.85Å; F958-L961 HydrophobicContact CZ-CD1 4.08Å
959	S	36	Very low	31.7	Very low	42 Å²	42	145.7 Å²	145.7	29%	0.294	75%	0.753	S	S	.	*				-172.5	157.9	-55.7	-148.9	0	0	0	0	109.6	H957 L961	H957-S959 PolarHBondContact CE1-OG 3.33Å; S959-L961 WeakPolarHBondContact OG-CG 3.23Å
960	L	29.3	Very low	32.2	Very low	167 Å²	167	148.6 Å²	148.6	87%	0.874	75%	0.754	S	S	*	*			trans	-175.6	83.8	147.3	-102.9	157.6	0	0	0	107
961	L	32.1	Very low	32.4	Very low	100 Å²	100	150.7 Å²	150.7	52%	0.524	76%	0.759	S	S	.	*				70.2	124.5	71.8	-66.6	149.3	0	0	0	113.4	F958 S959	F958-L961 HydrophobicContact CE1-CD1 3.85Å; F958-L961 HydrophobicContact CZ-CD1 4.08Å; S959-L961 WeakPolarHBondContact OG-CG 3.23Å
962	F	28.1	Very low	32.6	Very low	179 Å²	179	147.6 Å²	147.6	79%	0.785	76%	0.759	S	S	*	*			cis	-162.2	169.6	-14.5	-147.8	-125.3	0	0	0	112.7
963	V	36.3	Very low	32.7	Very low	118 Å²	118	148.4 Å²	148.4	72%	0.715	76%	0.764	S	S	*	*			trans	-155	175.2	-178.2	-63.4	0	0	0	0	109.1
964	P	44.7	Very low	32.6	Very low	108 Å²	108	150.4 Å²	150.4	70%	0.701	77%	0.766	S	S	*	*			cis	-129	-164.1	-5.6	43.6	-27.8	0	0	0	113.1
965	Y	27.7	Very low	32.6	Very low	225 Å²	225	152.5 Å²	152.5	88%	0.882	78%	0.775	S	S	*	*			trans	-147.1	159.8	144.3	-116.7	-80.9	0	0	0	111.7
966	V	32.9	Very low	32.5	Very low	130 Å²	130	150.8 Å²	150.8	79%	0.788	78%	0.779	S	S	*	*			trans	66.2	69.8	177.9	-160	0	0	0	0	116.1
967	L	35.9	Very low	32.5	Very low	168 Å²	168	147.8 Å²	147.8	88%	0.88	78%	0.78	S	S	*	*			trans	-142.5	41.3	160.4	-160.9	71.6	0	0	0	112.6
968	T	36.4	Very low	32.2	Very low	126 Å²	126	151.5 Å²	151.5	77%	0.773	79%	0.789	S	S	*	*			trans	-141.8	50.8	-170.9	54.2	0	0	0	0	113.3
969	F	34.1	Very low	32	Very low	204 Å²	204	154.8 Å²	154.8	90%	0.895	80%	0.797	S	S	*	*	S	Bend	trans	-145.5	-1.5	175.2	-125.7	-84.6	0	0	0	117.2
970	V	37.5	Very low	31.6	Very low	146 Å²	146	160.5 Å²	160.5	89%	0.885	82%	0.824	S	S	*	*	S	Bend	trans	-108	-15	-172.8	-174.4	0	0	0	0	113.4	C972	V970-C972 PolarHBondContact O-N 3.3Å
971	H	32.2	Very low	31.5	Very low	195 Å²	195	155.8 Å²	155.8	90%	0.903	82%	0.816	S	S	*	*	S	Bend	trans	-99.6	29.7	-168.5	-152.3	-72.6	0	0	0	114.9
972	C	30.9	Very low	31.5	Very low	116 Å²	116	159.4 Å²	159.4	78%	0.784	84%	0.835	S	S	*	*	S	Bend	trans	-132.6	14.7	-172.8	-154.8	0	0	0	0	115.7	V970	V970-C972 PolarHBondContact O-N 3.3Å
973	L	32.3	Very low	31.9	Very low	164 Å²	164	156.3 Å²	156.3	86%	0.859	83%	0.833	S	S	*	*	S	Bend	trans	-139.8	25.5	-177.3	-87.6	-179.5	0	0	0	115.7
974	F	30.8	Very low	31.9	Very low	203 Å²	203	156.7 Å²	156.7	89%	0.89	84%	0.837	S	S	*	*			trans	-142.2	48	178.1	-130	-86.3	0	0	0	116.3
975	T	27	Very low	32	Very low	140 Å²	140	157 Å²	157	86%	0.859	84%	0.84	S	S	*	*			trans	-138.2	75.1	168.5	43	0	0	0	0	112.1
976	V	27.9	Very low	32.1	Very low	145 Å²	145	151.8 Å²	151.8	88%	0.879	84%	0.836	S	S	*	*			trans	-134.8	133.8	157.3	-179.4	0	0	0	0	107.9
977	S	27.6	Very low	32.6	Very low	112 Å²	112	151.4 Å²	151.4	78%	0.783	84%	0.836	S	S	*	*			trans	-81.6	139.3	-166	-54.1	0	0	0	0	114.1
978	Y	24.7	Very low	32.2	Very low	226 Å²	226	147.4 Å²	147.4	89%	0.886	84%	0.836	S	S	*	*			trans	-74.2	120.7	152	-93.2	-90.9	0	0	0	109.3
979	R	27.4	Very low	31.8	Very low	237 Å²	237	145.5 Å²	145.5	89%	0.894	84%	0.841	S	S	*	*			trans	-148.7	92	166.2	-145.5	179.1	-162	-112.3	3.1	110.9
980	N	26.9	Very low	31.6	Very low	161 Å²	161	141.1 Å²	141.1	86%	0.861	84%	0.842	S	S	*	*			trans	-78.7	133.4	168.5	-76.4	-9	0	0	0	109.7
981	G	28.3	Very low	31.2	Very low	69 Å²	69	137.6 Å²	137.6	71%	0.711	84%	0.836	S	S	*	*			trans	-176.9	129.2	173.5	0	0	0	0	0	110.2
982	L	33	Very low	31	Very low	176 Å²	176	134.9 Å²	134.9	92%	0.921	84%	0.839	S	S	*	*			trans	-81.3	150	-175.3	-66.4	87	0	0	0	112.3
983	P	36.4	Very low	30.9	Very low	114 Å²	114	132.8 Å²	132.8	74%	0.74	84%	0.836	S	S	*	*			trans	-103.7	162.6	153.3	36.3	-29	0	0	0	112.8
984	P	36.4	Very low	30.8	Very low	125 Å²	125	132.5 Å²	132.5	81%	0.812	84%	0.836	S	S	*	*			trans	-87.3	178.3	-177.7	-7.6	28.7	0	0	0	114.6
985	P	45.8	Very low	30.9	Very low	115 Å²	115	128 Å²	128	75%	0.747	83%	0.829	S	S	*	*			trans	-103.2	162.1	-164.1	39.2	-36.4	0	0	0	117.5
986	S	29.6	Very low	31.1	Very low	115 Å²	115	130 Å²	130	80%	0.804	83%	0.834	S	S	*	*			trans	72.9	162.8	155.9	-58.5	0	0	0	0	118.5
987	P	43.2	Very low	31.4	Very low	122 Å²	122	130.9 Å²	130.9	79%	0.792	83%	0.833	S	S	*	*			cis	-131.4	159	-5.6	38.2	-21.9	0	0	0	117
988	G	28	Very low	31.7	Very low	85 Å²	85	130.7 Å²	130.7	88%	0.876	83%	0.832	S	S	*	*			trans	84.2	150.6	137.6	0	0	0	0	0	121
989	G	28.1	Very low	32.2	Very low	85 Å²	85	125.5 Å²	125.5	88%	0.876	83%	0.825	S	S	*	*			trans	130.4	110.9	169.3	0	0	0	0	0	114.1
990	A	30.1	Very low	32.8	Very low	112 Å²	112	120.1 Å²	120.1	93%	0.926	82%	0.821	S	S	*	*			trans	-94.7	158.4	-171.9	0	0	0	0	0	114.7
991	G	28.3	Very low	33.1	Very low	72 Å²	72	117.9 Å²	117.9	74%	0.742	82%	0.818	S	S	*	*			trans	134.7	109.4	139.1	0	0	0	0	0	119.6
992	S	28.3	Very low	33.5	Very low	139 Å²	139	121.7 Å²	121.7	97%	0.972	83%	0.828	S	S	*	*			trans	70.3	151.5	148.6	-152.3	0	0	0	0	120.6
993	G	29.4	Very low	33.7	Very low	71 Å²	71	117.3 Å²	117.3	73%	0.732	82%	0.816	S	S	*	*			trans	125.2	107.7	163.6	0	0	0	0	0	115.7
994	D	29.6	Very low	33.9	Very low	159 Å²	159	117.7 Å²	117.7	85%	0.85	82%	0.822	S	S	*	*			trans	-86.1	174.5	178.8	-69.3	-70.7	0	0	0	114.8
995	S	32.3	Very low	34.1	Very low	107 Å²	107	119.4 Å²	119.4	75%	0.748	82%	0.823	S	S	*	*			trans	73.8	90.3	159	-57.2	0	0	0	0	118.3	L997	S995-L997 PolarHBondContact O-N 3.35Å
996	L	32.4	Very low	33.7	Very low	183 Å²	183	121.9 Å²	121.9	96%	0.958	83%	0.829	S	S	*	*			trans	-72.1	106.2	161.3	-69.1	172.3	0	0	0	110.7
997	L	34.7	Very low	33.7	Very low	163 Å²	163	123.3 Å²	123.3	85%	0.853	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-84.9	151.5	170.7	-75.9	169.9	0	0	0	112.3	S995	S995-L997 PolarHBondContact O-N 3.35Å
998	S	33.2	Very low	33.3	Very low	109 Å²	109	125.4 Å²	125.4	76%	0.762	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-68.4	152.3	-169.9	-51.8	0	0	0	0	114.8
999	P	35	Very low	33.7	Very low	116 Å²	116	126.5 Å²	126.5	75%	0.753	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-65.5	155.4	165.2	30.3	-35.4	0	0	0	111.6
1000	P	39	Very low	33.8	Very low	125 Å²	125	130.4 Å²	130.4	81%	0.812	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-69.4	145.2	-172.7	27.7	-35.4	0	0	0	113.7
1001	S	33.8	Very low	34.1	Very low	113 Å²	113	131 Å²	131	79%	0.79	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-80.2	149.1	179.2	-170.6	0	0	0	0	112.7	A1003	S1001-A1003 PolarHBondContact O-N 3.05Å
1002	V	37.7	Very low	34.2	Very low	150 Å²	150	130.9 Å²	130.9	91%	0.909	82%	0.818	S	S	*	*			trans	-97.3	79	-177.3	-156.1	0	0	0	0	110.1
1003	A	37.2	Very low	34.8	Very low	83 Å²	83	130.1 Å²	130.1	69%	0.686	81%	0.81	S	S	*	*			trans	-134.6	74.7	-178.5	0	0	0	0	0	110.7	S1001	S1001-A1003 PolarHBondContact O-N 3.05Å
1004	S	39.4	Very low	35.4	Very low	123 Å²	123	132.8 Å²	132.8	86%	0.86	81%	0.814	S	S	*	*			trans	-153	36.3	-177.6	-54.8	0	0	0	0	112.7
1005	L	41.2	Very low	35.6	Very low	160 Å²	160	134.4 Å²	134.4	84%	0.838	82%	0.817	S	S	*	*	S	Bend	trans	-151.7	135.5	176.6	-114	158.5	0	0	0	108.5
1006	L	36.5	Very low	35.5	Very low	167 Å²	167	138.7 Å²	138.7	87%	0.874	83%	0.825	S	S	*	*			trans	72.1	85.2	-178.2	-47.6	-178	0	0	0	116.3
1007	D	30.9	Very low	35.4	Very low	146 Å²	146	133.9 Å²	133.9	78%	0.781	81%	0.812	S	S	*	*			trans	-154.5	-179.7	145.4	-156.9	-6	0	0	0	109.6
1008	I	34.9	Very low	35.1	Very low	166 Å²	166	134.3 Å²	134.3	85%	0.851	81%	0.814	S	S	*	*			trans	89.9	105.1	-173.6	-52.5	172.5	0	0	0	113.1
1009	S	35.1	Very low	34.8	Very low	107 Å²	107	135.2 Å²	135.2	75%	0.748	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-95.7	171.1	-172.2	-62.7	0	0	0	0	114.6
1010	L	31.2	Very low	35	Very low	168 Å²	168	135.8 Å²	135.8	88%	0.88	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-76.4	153.8	167.5	-67.6	169.6	0	0	0	111.8
1011	P	36.3	Very low	34.4	Very low	124 Å²	124	133.6 Å²	133.6	81%	0.805	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-85.2	156.8	-177	34.6	-36.3	0	0	0	114.2
1012	G	30.1	Very low	33.9	Very low	69 Å²	69	137.1 Å²	137.1	71%	0.711	82%	0.823	S	S	*	*			trans	-101.6	174.3	175.3	0	0	0	0	0	115.1
1013	P	41.7	Very low	34.1	Very low	123 Å²	123	134.3 Å²	134.3	80%	0.799	81%	0.808	S	S	*	*			trans	-91.6	169	-175.9	37.8	-36.5	0	0	0	114.3
1014	P	41.8	Very low	33.5	Very low	128 Å²	128	138 Å²	138	83%	0.831	81%	0.81	S	S	*	*			trans	-89.4	162.6	175.9	36.2	-35.4	0	0	0	114.5
1015	E	33.9	Very low	33	Very low	193 Å²	193	137.3 Å²	137.3	90%	0.902	80%	0.801	S	S	*	*			trans	-106.6	150.8	175.8	-62.9	-178.2	112	0	0	113.3
1016	E	28.7	Very low	32.5	Very low	197 Å²	197	137.6 Å²	137.6	92%	0.921	80%	0.798	S	S	*	*			trans	-170.3	148.5	151.5	-102.4	178.8	-167.7	0	0	107.7
1017	A	30.7	Very low	32.2	Very low	82 Å²	82	136.7 Å²	136.7	68%	0.678	79%	0.792	S	S	*	*			cis	-165.3	143.6	-28.5	0	0	0	0	0	111.4
1018	L	27.9	Very low	32.3	Very low	172 Å²	172	134.7 Å²	134.7	90%	0.901	79%	0.79	S	S	*	*			trans	71.4	169.9	158.7	-62.2	172	0	0	0	120.7
1019	T	28.5	Very low	32.2	Very low	128 Å²	128	134 Å²	134	79%	0.785	79%	0.788	S	S	*	*			trans	-129.3	-167.7	-158.2	60.4	0	0	0	0	110.4
1020	P	38.1	Very low	32.1	Very low	127 Å²	127	133.9 Å²	133.9	83%	0.825	79%	0.787	S	S	*	*			cis	-133.9	-175.8	-5.6	43.4	-26.6	0	0	0	115.2
1021	G	26	Very low	32.5	Very low	79 Å²	79	132.8 Å²	132.8	81%	0.814	78%	0.781	S	S	*	*			trans	154.1	114.8	158.1	0	0	0	0	0	117.8
1022	E	24.8	Very low	32.6	Very low	188 Å²	188	133.5 Å²	133.5	88%	0.879	78%	0.776	S	S	*	*			trans	-106.1	172.3	159.1	-126	-159.1	125.9	0	0	108
1023	P	40.4	Very low	32.9	Very low	91 Å²	91	138.1 Å²	138.1	59%	0.591	78%	0.779	S	S	*	*			cis	-142.4	-168	-4	41.7	-21	0	0	0	115.5
1024	Q	25.6	Very low	32.6	Very low	159 Å²	159	139.2 Å²	139.2	74%	0.743	78%	0.778	S	S	*	*			trans	69.2	90.8	135.4	-163.4	160.3	11.8	0	0	123.6
1025	T	28.5	Very low	32.1	Very low	109 Å²	109	137.2 Å²	137.2	67%	0.669	77%	0.772	S	S	*	*				65.5	159.2	130	65.7	0	0	0	0	124.9
1026	H	31.2	Very low	31.8	Very low	167 Å²	167	135.8 Å²	135.8	77%	0.773	77%	0.769	S	S	*	*			trans	97.2	142.5	138.2	-88.6	-56.3	0	0	0	123.3
1027	I	30.4	Very low	31.7	Very low	147 Å²	147	133.3 Å²	133.3	75%	0.754	76%	0.762	S	S	*	*			trans	95.5	89.2	153.9	-65	149.5	0	0	0	120.1
1028	S	32.4	Very low	31.6	Very low	105 Å²	105	133.5 Å²	133.5	73%	0.734	76%	0.758	S	S	*	*				57.9	151	111	-43.1	0	0	0	0	125.7
1029	D	31.7	Very low	31.5	Very low	151 Å²	151	131 Å²	131	81%	0.807	75%	0.751	S	S	*	*			trans	-58.6	159.4	169.8	-43.2	-97.9	0	0	0	116.6
1030	S	34.7	Very low	31.6	Very low	104 Å²	104	131.2 Å²	131.2	73%	0.727	75%	0.747	S	S	*	*			trans	-177.5	117.9	142.7	-88.2	0	0	0	0	111.8
1031	I	38.8	Very low	31.2	Very low	146 Å²	146	135.9 Å²	135.9	75%	0.749	75%	0.749	S	S	*	*				84.4	128.9	94.8	-77.7	171.2	0	0	0	113.1
1032	I	38.9	Very low	31.2	Very low	138 Å²	138	135.3 Å²	135.3	71%	0.708	74%	0.744	S	S	*	*			cis	-167	178.8	-4.1	-140.1	168.2	0	0	0	112.2
1033	E	35.5	Very low	31.2	Very low	166 Å²	166	134.9 Å²	134.9	78%	0.776	74%	0.742	S	S	*	*			trans	108.4	121.7	147.1	-113	166.6	-137.6	0	0	125.8
1034	L	36.8	Very low	30.5	Very low	147 Å²	147	139 Å²	139	77%	0.77	75%	0.753	S	S	*	*			trans	55.1	97.1	144.9	-74.3	167.3	0	0	0	126.2
1035	A	30.1	Very low	30.7	Very low	86 Å²	86	134.9 Å²	134.9	71%	0.711	75%	0.747	S	S	*	*				79.3	164.1	104	0	0	0	0	0	125.9
1036	I	27.2	Very low	30.9	Very low	162 Å²	162	134 Å²	134	83%	0.831	75%	0.751	S	S	*	*			trans	93.1	88.3	162.4	-48	-172.6	0	0	0	119.6
1037	N	26.5	Very low	30.7	Very low	146 Å²	146	134.2 Å²	134.2	78%	0.781	76%	0.757	S	S	*	*				57.5	125	124.6	-103.8	20.4	0	0	0	125.8
1038	S	29	Very low	30.6	Very low	85 Å²	85	132.4 Å²	132.4	59%	0.594	76%	0.757	S	S	*	*				76.6	110.9	121.1	73.9	0	0	0	0	124.8
1039	T	26.5	Very low	31.6	Very low	121 Å²	121	133.6 Å²	133.6	74%	0.742	76%	0.762	S	S	*	*				62.1	132.2	125.1	62.4	0	0	0	0	124.7
1040	N	31.1	Very low	31.4	Very low	132 Å²	132	130.9 Å²	130.9	71%	0.706	76%	0.761	S	S	*	*			trans	82.6	148.7	138.9	-71.1	10.9	0	0	0	122.5
1041	Y	28.7	Very low	31	Very low	224 Å²	224	134.5 Å²	134.5	88%	0.878	76%	0.763	S	S	*	*			trans	66	143.2	174.2	-61	-77.6	0	0	0	116.6
1042	G	26.5	Very low	30.5	Very low	68 Å²	68	135.3 Å²	135.3	70%	0.701	77%	0.768	S	S	*	*			cis	-174.5	-160.3	-0.8	0	0	0	0	0	113.9
1043	E	24.8	Very low	29.8	Very low	179 Å²	179	132.1 Å²	132.1	84%	0.836	77%	0.77	S	S	*	*			trans	-53.6	167.2	171.8	-74.8	157.9	96.6	0	0	114.4
1044	E	26.3	Very low	29.7	Very low	176 Å²	176	132.6 Å²	132.6	82%	0.822	78%	0.777	S	S	*	*			cis	-152.5	-160.2	11	-142.2	-154.2	157.8	0	0	113.9
1045	A	29.7	Very low	29.2	Very low	74 Å²	74	129 Å²	129	61%	0.612	78%	0.775	S	S	*	*			trans	-57	152.7	-172	0	0	0	0	0	119.6
1046	A	31.4	Very low	29.1	Very low	91 Å²	91	132.3 Å²	132.3	75%	0.752	78%	0.781	S	S	*	*			trans	48.6	130	136.9	0	0	0	0	0	121.8
1047	L	28	Very low	29.8	Very low	171 Å²	171	129.8 Å²	129.8	90%	0.895	78%	0.775	S	S	*	*				-162.2	148.9	119	-106.5	172	0	0	0	114.2
1048	S	28.7	Very low	29.9	Very low	108 Å²	108	127.8 Å²	127.8	76%	0.755	77%	0.773	S	S	*	*			trans	-46.8	172.1	-170.8	-59.7	0	0	0	0	121.4
1049	P	53	Low	29.9	Very low	130 Å²	130	132.9 Å²	132.9	84%	0.844	78%	0.784	S	S	*	*			trans	-113.5	167.5	-158.4	42.2	-34.3	0	0	0	117
1050	A	27.1	Very low	30.1	Very low	95 Å²	95	134.2 Å²	134.2	79%	0.785	79%	0.786	S	S	*	*			trans	-150.7	166.4	155.3	0	0	0	0	0	107.7
1051	K	26.7	Very low	30	Very low	179 Å²	179	135.7 Å²	135.7	78%	0.778	79%	0.793	S	S	*	*			cis	-165.8	120.4	27.6	-166.1	168	-174.6	174.4	0	113.1
1052	L	28.6	Very low	30.1	Very low	164 Å²	164	129.7 Å²	129.7	86%	0.859	79%	0.79	S	S	*	*			trans	60	159.1	153.6	-57.6	174.9	0	0	0	118.5
1053	G	24.4	Very low	30.3	Very low	71 Å²	71	131.3 Å²	131.3	73%	0.732	79%	0.79	S	S	*	*			cis	173.6	155.6	-5.7	0	0	0	0	0	110.8
1054	N	33.3	Very low	30.7	Very low	176 Å²	176	128.4 Å²	128.4	94%	0.941	79%	0.79	S	S	*	*			trans	-116.1	138.9	-169.7	-168.7	85.6	0	0	0	112.4
1055	G	26.1	Very low	31.7	Very low	70 Å²	70	125.6 Å²	125.6	72%	0.722	79%	0.787	S	S	*	*			trans	180	134	175	0	0	0	0	0	117.1
1056	D	28.1	Very low	31.7	Very low	157 Å²	157	127.4 Å²	127.4	84%	0.84	80%	0.795	S	S	*	*			trans	-73	179.6	161.6	-108.8	-56.9	0	0	0	111.1
1057	P	41.3	Very low	31.7	Very low	109 Å²	109	129.5 Å²	129.5	71%	0.708	80%	0.798	S	S	*	*			cis	-144.3	167.2	16.9	42.9	-23.2	0	0	0	119.7
1058	S	27.9	Very low	31.9	Very low	103 Å²	103	126.3 Å²	126.3	72%	0.72	79%	0.79	S	S	*	*			trans	47.9	125.9	135.1	-64.7	0	0	0	0	125.4
1059	K	29.2	Very low	33.1	Very low	192 Å²	192	126.3 Å²	126.3	84%	0.835	79%	0.787	S	S	*	*				91.9	123.7	129.1	-107.1	179.9	-177	175.4	0	124
1060	L	31	Very low	32.2	Very low	150 Å²	150	125.7 Å²	125.7	79%	0.785	79%	0.786	S	S	*	*			trans	108.5	142.4	139.2	-65.8	175.6	0	0	0	122.9
1061	L	28.9	Very low	32.5	Very low	162 Å²	162	133.1 Å²	133.1	85%	0.848	79%	0.794	S	S	*	*			trans	94.5	136.2	155.9	-57.7	-168.4	0	0	0	122.7
1062	A	31.2	Very low	32.6	Very low	98 Å²	98	127.9 Å²	127.9	81%	0.81	79%	0.791	S	S	*	*			trans	65.3	146.3	157.1	0	0	0	0	0	120.3
1063	S	30.6	Very low	32.6	Very low	103 Å²	103	132.8 Å²	132.8	72%	0.72	80%	0.799	S	S	*	*			cis	-169	154.4	-20.4	50.4	0	0	0	0	112.3
1064	S	34.3	Very low	32.9	Very low	118 Å²	118	137.3 Å²	137.3	83%	0.825	80%	0.804	S	S	*	*			trans	81.5	150.5	162.9	-57.3	0	0	0	0	119.1
1065	P	45.4	Very low	33.1	Very low	117 Å²	117	134 Å²	134	76%	0.76	79%	0.793	S	S	*	*			trans	-125.1	170	-151.7	40.6	-24.9	0	0	0	115.4
1066	S	30.2	Very low	33.4	Very low	111 Å²	111	136.3 Å²	136.3	78%	0.776	80%	0.797	S	S	*	*			cis	-163.8	-77.3	-19.6	49.1	0	0	0	0	110.8
1067	V	32.8	Very low	34.2	Very low	135 Å²	135	134.3 Å²	134.3	82%	0.818	79%	0.793	S	S	*	*			trans	73	160.1	174	-168.5	0	0	0	0	115.7
1068	S	30.7	Very low	33.5	Very low	104 Å²	104	134 Å²	134	73%	0.727	79%	0.793	S	S	*	*			trans	-159.9	169.3	-151.7	-67.4	0	0	0	0	111.7
1069	P	53.3	Low	33.5	Very low	108 Å²	108	137.6 Å²	137.6	70%	0.701	80%	0.798	S	S	*	*			cis	-135.3	152.1	5.5	37.2	-19	0	0	0	118.2
1070	S	36.1	Very low	33.5	Very low	118 Å²	118	135.4 Å²	135.4	83%	0.825	80%	0.796	S	S	*	*			trans	69.4	152.1	153.8	79.5	0	0	0	0	118.6
1071	R	32	Very low	34.6	Very low	250 Å²	250	132.8 Å²	132.8	94%	0.943	79%	0.788	S	S	*	*			cis	-147.4	132.5	6.2	-161.5	-179	-168.9	-172.5	4.7	109
1072	G	29	Very low	34.5	Very low	70 Å²	70	132.3 Å²	132.3	72%	0.722	78%	0.781	S	S	*	*			trans	-120.1	-171.8	-170.8	0	0	0	0	0	116.4
1073	W	29.8	Very low	34.4	Very low	267 Å²	267	138.7 Å²	138.7	100%	1.011	79%	0.785	S	S	*	*			trans	-144.6	171.4	174.5	-104.9	21.5	0	0	0	111.6
1074	I	28.7	Very low	34.5	Very low	166 Å²	166	142.5 Å²	142.5	85%	0.851	78%	0.784	S	S	*	*			trans	-125.3	149.3	-160.3	-60.3	173.7	0	0	0	112
1075	P	37.5	Very low	34.7	Very low	107 Å²	107	142.5 Å²	142.5	70%	0.695	78%	0.781	S	S	*	*			trans	-106.6	144.8	-174	38.2	-33.3	0	0	0	118
1076	S	33.3	Very low	34	Very low	118 Å²	118	140.7 Å²	140.7	83%	0.825	77%	0.772	S	S	*	*			trans	62.2	170.2	146.9	-50.2	0	0	0	0	120.1
1077	P	45.3	Very low	34.1	Very low	114 Å²	114	141.5 Å²	141.5	74%	0.74	77%	0.767	S	S	*	*			cis	-135.1	-174.9	-7.9	43.9	-27.1	0	0	0	116.8
1078	S	26.2	Very low	34.4	Very low	103 Å²	103	139.9 Å²	139.9	72%	0.72	76%	0.762	S	S	*	*			trans	83.2	120.9	143.2	-64.3	0	0	0	0	125.6
1079	H	27.2	Very low	34.7	Very low	178 Å²	178	139.8 Å²	139.8	82%	0.824	76%	0.761	S	S	*	*			trans	61.5	110.8	140	-77	-83.7	0	0	0	124.8
1080	D	30.7	Very low	33.7	Very low	147 Å²	147	141 Å²	141	79%	0.786	76%	0.762	S	S	*	*				10.7	152.3	121.3	-139.9	37.8	0	0	0	120.4
1081	P	53.1	Low	33.7	Very low	94 Å²	94	140 Å²	140	61%	0.61	76%	0.755	S	S	*	*			cis	-132.5	-173.8	6.5	28.6	-4.4	0	0	0	115.9
1082	Q	27.5	Very low	33.8	Very low	153 Å²	153	134.7 Å²	134.7	72%	0.715	75%	0.75	S	S	*	*				141.6	122.4	129	-74.8	-166.5	-112.6	0	0	118.5
1083	W	29	Very low	33.9	Very low	232 Å²	232	139 Å²	139	88%	0.879	76%	0.756	S	S	*	*			trans	79.8	140.5	137.5	-76	56.5	0	0	0	123.5
1084	Y	31.5	Very low	34.3	Very low	183 Å²	183	129.7 Å²	129.7	72%	0.718	74%	0.742	S	S	*	*			trans	-93.4	162.8	167.9	-127.2	-113.9	0	0	0	109.8	S1086	Y1084-S1086 VanDerWaalsContact CD1-N 3.35Å; Y1084-S1086 WeakPolarHBondContact CD1-OG 3.22Å
1085	P	39.8	Very low	34.8	Very low	117 Å²	117	127.5 Å²	127.5	76%	0.76	74%	0.741	S	S	*	*				-134.9	151.5	93	14.5	7.8	0	0	0	113.4
1086	S	30.9	Very low	35	Very low	80 Å²	80	129.9 Å²	129.9	56%	0.559	75%	0.747	S	S	*	*			cis	86.5	143.3	36.9	-72.2	0	0	0	0	114	Y1084	Y1084-S1086 VanDerWaalsContact CD1-N 3.35Å; Y1084-S1086 WeakPolarHBondContact CD1-OG 3.22Å
1087	D	32	Very low	35.3	Very low	128 Å²	128	132.4 Å²	132.4	68%	0.684	75%	0.75	S	S	*	*			cis	-168.4	165.5	-14.4	-117.4	-73.8	0	0	0	108.4
1088	S	39.2	Very low	34.9	Very low	101 Å²	101	132.6 Å²	132.6	71%	0.706	75%	0.754	S	S	*	*			cis	-124.7	-126.9	-8.4	-65.5	0	0	0	0	107.7
1089	S	37.8	Very low	35.2	Very low	101 Å²	101	132.7 Å²	132.7	71%	0.706	76%	0.755	S	S	*	*			cis	-165.6	171.1	-13.7	37.7	0	0	0	0	106.6
1090	D	30.9	Very low	35.3	Very low	133 Å²	133	132.5 Å²	132.5	71%	0.711	76%	0.757	S	S	*	*			cis	-133.4	133.7	-4.7	-105.3	-53.8	0	0	0	106.5
1091	S	35.8	Very low	35.3	Very low	97 Å²	97	132.8 Å²	132.8	68%	0.678	76%	0.763	S	S	*	*				69.4	133	85.5	-48.3	0	0	0	0	113.6
1092	T	34.8	Very low	34.1	Very low	139 Å²	139	133.8 Å²	133.8	85%	0.853	77%	0.772	S	S	*	*			cis	-150.3	155.2	16.8	-42.8	0	0	0	0	111.9
1093	L	30.2	Very low	35.2	Very low	162 Å²	162	132 Å²	132	85%	0.848	77%	0.774	S	S	*	*			trans	-75.1	139.2	170	-72.8	164.1	0	0	0	112.4
1094	G	39	Very low	35.2	Very low	70 Å²	70	126.8 Å²	126.8	72%	0.722	76%	0.763	S	S	*	*			trans	-129.1	4.4	-177.2	0	0	0	0	0	117.3
1095	C	40.1	Very low	35	Very low	121 Å²	121	126 Å²	126	82%	0.818	76%	0.763	S	S	*	*	S	Bend	trans	-118.6	4.8	-161.6	-60.8	0	0	0	0	116.9
1096	L	39.9	Very low	34.4	Very low	157 Å²	157	125 Å²	125	82%	0.822	76%	0.759	S	S	*	*	S	Bend	trans	-115.2	7.6	-171.8	-67.8	177.7	0	0	0	115.8
1097	L	40.2	Very low	34.4	Very low	170 Å²	170	131.6 Å²	131.6	89%	0.89	77%	0.772	S	S	*	*	S	Bend	trans	-130.8	67.9	175.4	-68.7	175.9	0	0	0	110.9
1098	S	37	Very low	34.3	Very low	118 Å²	118	135.1 Å²	135.1	83%	0.825	78%	0.776	S	S	*	*	S	Bend	trans	-147.2	25.4	176.7	-67.3	0	0	0	0	113.9
1099	S	32.9	Very low	34	Very low	105 Å²	105	136.2 Å²	136.2	73%	0.734	78%	0.778	S	S	*	*	S	Bend	trans	-143	160.8	163.6	-165.6	0	0	0	0	108.9
1100	M	29.5	Very low	33.5	Very low	175 Å²	175	137.5 Å²	137.5	86%	0.862	78%	0.782	S	S	*	*			trans	71.7	65.4	178	-47.4	-61.9	-83.1	0	0	117.2
1101	V	30.3	Very low	33.4	Very low	153 Å²	153	139.2 Å²	139.2	93%	0.927	79%	0.79	S	S	*	*			trans	-133.8	141.3	146.8	178.4	0	0	0	0	109
1102	S	27.9	Very low	33.1	Very low	115 Å²	115	140.6 Å²	140.6	80%	0.804	80%	0.795	S	S	*	*			trans	-85.6	171.2	-167.8	-107.6	0	0	0	0	115.5
1103	P	50.6	Low	33.2	Very low	114 Å²	114	139.3 Å²	139.3	74%	0.74	79%	0.789	S	S	*	*			trans	-99.6	160.2	-165.8	38.3	-36	0	0	0	115.5
1104	D	28	Very low	33.2	Very low	123 Å²	123	137.2 Å²	137.2	66%	0.658	79%	0.788	S	S	*	*				-165.8	162.3	124.1	-137.2	-23.2	0	0	0	116.3
1105	K	28.7	Very low	32.7	Very low	166 Å²	166	137.4 Å²	137.4	72%	0.722	79%	0.79	S	S	*	*			trans	26.7	113.5	155.1	-76.4	143.6	-156.1	150.6	0	123
1106	S	25.8	Very low	33	Very low	97 Å²	97	138 Å²	138	68%	0.678	79%	0.792	S	S	*	*				86.5	121.1	111.2	-179.7	0	0	0	0	123.7
1107	R	31.1	Very low	32.5	Very low	219 Å²	219	135.9 Å²	135.9	83%	0.826	79%	0.791	S	S	*	*			trans	80.2	98.2	143.3	-76.6	176.1	-171.6	-138.4	7.1	123.1
1108	R	31.6	Very low	32.1	Very low	202 Å²	202	133.4 Å²	133.4	76%	0.762	79%	0.788	S	S	*	*				60.5	129.7	99	-160.7	-147.3	-81.3	-134.5	-11.7	121.3
1109	T	31.8	Very low	31.8	Very low	123 Å²	123	131.1 Å²	131.1	76%	0.755	78%	0.783	S	S	*	*			trans	78	128.7	151.5	27.4	0	0	0	0	120.2
1110	T	27.5	Very low	31.7	Very low	128 Å²	128	132.8 Å²	132.8	79%	0.785	79%	0.788	S	S	*	*			trans	-72	140	159.1	42.1	0	0	0	0	112
1111	L	28.1	Very low	31.8	Very low	169 Å²	169	128.6 Å²	128.6	89%	0.885	78%	0.782	S	S	*	*			trans	-174.5	148.4	130.3	-99.9	166.6	0	0	0	110.1
1112	T	29.3	Very low	31.9	Very low	127 Å²	127	128.9 Å²	128.9	78%	0.779	78%	0.777	S	S	*	*			trans	-79.7	161.2	174.6	31.8	0	0	0	0	111.1
1113	P	37.6	Very low	32	Very low	111 Å²	111	131.4 Å²	131.4	72%	0.721	78%	0.781	S	S	*	*			cis	-152.6	169.6	48.2	43.9	-22.9	0	0	0	120.6
1114	S	29.5	Very low	31	Very low	119 Å²	119	129.6 Å²	129.6	83%	0.832	78%	0.783	S	S	*	*			trans	41.4	126	145	64	0	0	0	0	123.4
1115	G	28.4	Very low	32.4	Very low	74 Å²	74	129.6 Å²	129.6	76%	0.763	79%	0.789	S	S	*	*			trans	145.8	135.1	154.7	0	0	0	0	0	115.1
1116	P	48.1	Very low	32.4	Very low	132 Å²	132	126.5 Å²	126.5	86%	0.857	79%	0.789	S	S	*	*			trans	-110.4	-178.3	-175	41.6	-35.5	0	0	0	115.8
1117	S	28.2	Very low	32.7	Very low	114 Å²	114	128.8 Å²	128.8	80%	0.797	79%	0.793	S	S	*	*			trans	92	140.4	176.5	-165.4	0	0	0	0	115.2
1118	S	32.4	Very low	33	Very low	118 Å²	118	125.1 Å²	125.1	83%	0.825	79%	0.789	S	S	*	*			cis	157.4	136	-23.7	-87.3	0	0	0	0	106.7
1119	G	29.6	Very low	32.9	Very low	70 Å²	70	121.8 Å²	121.8	72%	0.722	79%	0.786	S	S	*	*			trans	117.9	132.2	159.3	0	0	0	0	0	119.3
1120	T	32.8	Very low	32.8	Very low	139 Å²	139	120.4 Å²	120.4	85%	0.853	78%	0.781	S	S	*	*			trans	29.8	133.2	145	49.6	0	0	0	0	121.2
1121	A	31.5	Very low	33	Very low	88 Å²	88	121.6 Å²	121.6	73%	0.727	78%	0.782	S	S	*	*			cis	72.4	142	44.3	0	0	0	0	0	113.9
1122	L	30.7	Very low	33.3	Very low	158 Å²	158	117.6 Å²	117.6	83%	0.827	77%	0.768	S	S	*	*			cis	-165.6	-176.6	2	-129.2	175.8	0	0	0	111.3
1123	L	31.8	Very low	33.4	Very low	169 Å²	169	120 Å²	120	89%	0.885	77%	0.77	S	S	*	*			trans	76.7	152.1	163.3	-64.1	168.6	0	0	0	121.7
1124	G	27.9	Very low	33	Very low	76 Å²	76	121.7 Å²	121.7	78%	0.784	77%	0.773	S	S	*	*			trans	118.8	121.6	134.7	0	0	0	0	0	119.6
1125	P	57.5	Low	33.1	Very low	122 Å²	122	119.9 Å²	119.9	79%	0.792	76%	0.76	S	S	*	*			trans	-126.1	176.9	176.7	42.7	-31.1	0	0	0	117
1126	S	29	Very low	33.1	Very low	101 Å²	101	126.4 Å²	126.4	71%	0.706	77%	0.768	S	S	*	*			trans	94.9	121.4	146.8	-70.4	0	0	0	0	123.9
1127	L	32	Very low	32.3	Very low	146 Å²	146	128.9 Å²	128.9	76%	0.764	77%	0.768	S	S	*	*				92.8	138.6	123.4	-77.7	174.4	0	0	0	124.7
1128	L	36.8	Very low	32.5	Very low	142 Å²	142	129.3 Å²	129.3	74%	0.743	77%	0.771	S	S	*	*			trans	74.1	147.2	153.3	-63.4	161.5	0	0	0	118.5
1129	D	30.6	Very low	32.5	Very low	131 Å²	131	136.2 Å²	136.2	70%	0.701	78%	0.779	S	S	*	*			cis	-159.8	169.8	-6.2	-142	-23.9	0	0	0	115.4
1130	C	29.7	Very low	32.7	Very low	95 Å²	95	136.1 Å²	136.1	64%	0.642	78%	0.778	S	S	*	*			trans	67.1	120.9	145.9	-80.7	0	0	0	0	126.2
1131	N	31.3	Very low	33.1	Very low	152 Å²	152	137.2 Å²	137.2	81%	0.813	78%	0.778	S	S	*	*			trans	52.2	150	130.2	-78	4.7	0	0	0	124.4
1132	S	34.5	Very low	33.5	Very low	85 Å²	85	136.6 Å²	136.6	59%	0.594	77%	0.766	S	S	*	*			cis	-175.3	157.6	-13.8	52.5	0	0	0	0	113.2
1133	H	32.3	Very low	33.6	Very low	177 Å²	177	135.1 Å²	135.1	82%	0.819	76%	0.759	S	S	*	*			trans	61.7	135.9	170.2	-74.3	-87	0	0	0	117
1134	D	27.9	Very low	34.3	Very low	147 Å²	147	133.1 Å²	133.1	79%	0.786	75%	0.754	S	S	*	*			cis	-144.4	-160	41.4	-162.1	1.2	0	0	0	113.4
1135	S	32.2	Very low	35.1	Very low	81 Å²	81	133 Å²	133	57%	0.566	75%	0.746	S	S	*	*			trans	-120.9	136.4	-143.9	-47.2	0	0	0	0	115
1136	F	28.6	Very low	34.5	Very low	211 Å²	211	133 Å²	133	93%	0.925	74%	0.735	S	S	*	*			trans	-168.9	162.3	135.3	-102	-64	0	0	0	110.9
1137	Q	31.4	Very low	35.5	Very low	185 Å²	185	135.6 Å²	135.6	86%	0.864	74%	0.738	S	S	*	*			trans	-74.8	128.6	-159.3	-63.7	173	-2.9	0	0	115
1138	S	32.6	Very low	36.3	Very low	122 Å²	122	134.6 Å²	134.6	85%	0.853	73%	0.733	S	S	*	*			trans	-157.9	116.7	153.8	-79.5	0	0	0	0	109.9
1139	R	32	Very low	37.1	Very low	264 Å²	264	131.8 Å²	131.8	100%	0.996	72%	0.723	S	S	*	*			trans	-73	141.2	172.9	-71.3	-177.2	175.8	-176.8	-2.3	110.1
1140	G	33.3	Very low	38.1	Very low	68 Å²	68	132.6 Å²	132.6	70%	0.701	72%	0.722	S	S	*	*			trans	-137.8	143.5	165.3	0	0	0	0	0	110.7
1141	L	41.7	Very low	39.3	Very low	161 Å²	161	132 Å²	132	84%	0.843	71%	0.712	S	S	*	*			trans	58.1	128.4	175	-68.2	157.9	0	0	0	116.1
1142	P	40.1	Very low	40.1	Very low	75 Å²	75	127.3 Å²	127.3	49%	0.487	70%	0.695	S	S	.	*				-96.5	155	89	29.9	-36.7	0	0	0	111.5	E1146	P1142-E1146 VanDerWaalsContact CG-CD 3.48Å; P1142-E1146 HydrophobicContact CG-CG 4.02Å; P1142-E1146 WeakPolarHBondContact CG-OE1 3.46Å
1143	D	33.1	Very low	40.8	Very low	127 Å²	127	126.1 Å²	126.1	68%	0.679	69%	0.686	S	S	*	*			cis	81	141.9	32.7	-158.3	23.5	0	0	0	114.5	A1145	D1143-A1145 VanDerWaalsContact C-N 3.26Å; D1143-A1145 PolarHBondContact O-N 2.95Å; D1143-A1145 VanDerWaalsContact O-N 3.16Å
1144	V	46.5	Very low	41.6	Very low	127 Å²	127	123.8 Å²	123.8	77%	0.77	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-4	-150.4	-178.7	0	0	0	0	113.6	E1146	V1144-E1146 PolarHBondContact O-N 3.35Å
1145	A	43.9	Very low	42.8	Very low	75 Å²	75	123.4 Å²	123.4	62%	0.62	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-20.4	-178.5	0	0	0	0	0	115.2	D1143 M1147	D1143-A1145 VanDerWaalsContact C-N 3.26Å; D1143-A1145 PolarHBondContact O-N 2.95Å; D1143-A1145 VanDerWaalsContact O-N 3.16Å; A1145-M1147 VanDerWaalsContact C-N 3.27Å; A1145-M1147 PolarHBondContact O-N 3.23Å
1146	E	45.6	Very low	43.7	Very low	122 Å²	122	122.7 Å²	122.7	57%	0.57	67%	0.667	S	S	*	*	H	α-helix	trans	-71.7	-16.1	-177.3	-70.6	-168.7	150.4	0	0	114.2	P1142 V1144 T1149 Q1150	P1142-E1146 VanDerWaalsContact CG-CD 3.48Å; P1142-E1146 HydrophobicContact CG-CG 4.02Å; P1142-E1146 WeakPolarHBondContact CG-OE1 3.46Å; V1144-E1146 PolarHBondContact O-N 3.35Å; E1146-T1149 WeakPolarHBondContact CA-OG1 3.17Å; E1146-T1149 PolarHBondContact O-OG1 2.79Å; E1146-T1149 VanDerWaalsContact O-OG1 3.12Å; E1146-Q1150 WeakPolarHBondContact O-CB 3.46Å; E1146-Q1150 PolarHBondContact O-N 2.89Å
1147	M	48.6	Very low	45.1	Very low	154 Å²	154	119.2 Å²	119.2	76%	0.759	65%	0.653	S	S	*	*	H	α-helix	trans	-77.9	-34.9	-174.1	-157.3	164.3	-165.1	0	0	113.1	A1145 L1151	A1145-M1147 VanDerWaalsContact C-N 3.27Å; A1145-M1147 PolarHBondContact O-N 3.23Å; M1147-L1151 WeakPolarHBondContact O-CB 3.48Å; M1147-L1151 PolarHBondContact O-N 2.9Å; M1147-L1151 VanDerWaalsContact O-N 3.08Å
1148	D	49.1	Very low	46.2	Very low	125 Å²	125	113.3 Å²	113.3	67%	0.668	63%	0.633	S	S	*	*	H	α-helix	trans	-76.2	-33.3	174.3	-82.3	-33.5	0	0	0	112	L1151 A1152	D1148-L1151 PolarHBondContact O-N 3.03Å; D1148-A1152 VanDerWaalsContact O-CB 3.3Å; D1148-A1152 WeakPolarHBondContact O-CB 3.44Å; D1148-A1152 PolarHBondContact O-N 3.28Å
1149	T	55.2	Low	46.8	Very low	84 Å²	84	110.4 Å²	110.4	52%	0.515	61%	0.612	S	S	.	*	H	α-helix	trans	-69.5	-39	172.8	49.3	0	0	0	0	111.8	E1146 L1151 A1152 C1153	E1146-T1149 WeakPolarHBondContact CA-OG1 3.17Å; E1146-T1149 PolarHBondContact O-OG1 2.79Å; E1146-T1149 VanDerWaalsContact O-OG1 3.12Å; T1149-L1151 VanDerWaalsContact C-N 3.33Å; T1149-L1151 PolarHBondContact O-N 3.06Å; T1149-A1152 PolarHBondContact O-N 2.77Å; T1149-C1153 PolarHBondContact O-N 3.25Å; T1149-C1153 PolarHBondContact O-SG 3.16Å; T1149-C1153 VanDerWaalsContact O-SG 3.32Å
1150	Q	49.9	Very low	47.9	Very low	148 Å²	148	102.6 Å²	102.6	69%	0.692	59%	0.594	S	S	*	*	H	α-helix	trans	-67.8	-32.9	174.5	-168	165	41.3	0	0	112.5	E1146 M1154	E1146-Q1150 WeakPolarHBondContact O-CB 3.46Å; E1146-Q1150 PolarHBondContact O-N 2.89Å; Q1150-M1154 WeakPolarHBondContact O-CB 3.42Å; Q1150-M1154 PolarHBondContact O-N 3.48Å; Q1150-M1154 VanDerWaalsContact O-N 3.14Å
1151	L	55.4	Low	49	Very low	81 Å²	81	103.2 Å²	103.2	42%	0.424	58%	0.581	S	S	.	*	H	α-helix	trans	-68.2	-42.3	170.7	-177.6	58.3	0	0	0	111.8	M1147 D1148 T1149 M1154 M1155	M1147-L1151 WeakPolarHBondContact O-CB 3.48Å; M1147-L1151 PolarHBondContact O-N 2.9Å; M1147-L1151 VanDerWaalsContact O-N 3.08Å; D1148-L1151 PolarHBondContact O-N 3.03Å; T1149-L1151 VanDerWaalsContact C-N 3.33Å; T1149-L1151 PolarHBondContact O-N 3.06Å; L1151-M1154 HydrophobicContact CD1-CE 3.81Å; L1151-M1154 PolarHBondContact O-N 2.83Å; L1151-M1155 HydrophobicContact CD1-CG 4.48Å; L1151-M1155 HydrophobicContact CD1-SD 4.36Å; L1151-M1155 HydrophobicContact CG-SD 4.36Å; L1151-M1155 WeakPolarHBondContact O-CG 3.45Å; L1151-M1155 PolarHBondContact O-N 3.41Å
1152	A	49.2	Very low	49.7	Very low	55 Å²	55	103.3 Å²	103.3	46%	0.455	57%	0.571	S	S	.	*	H	α-helix	trans	-61.5	-47.3	176	0	0	0	0	0	112	D1148 T1149 M1154 M1155 S1156	D1148-A1152 VanDerWaalsContact O-CB 3.3Å; D1148-A1152 WeakPolarHBondContact O-CB 3.44Å; D1148-A1152 PolarHBondContact O-N 3.28Å; T1149-A1152 PolarHBondContact O-N 2.77Å; A1152-M1154 VanDerWaalsContact C-N 3.35Å; A1152-M1154 PolarHBondContact O-N 3.32Å; A1152-M1155 CarbonylContact O-C 3.59Å; A1152-M1155 PolarHBondContact O-N 2.85Å; A1152-M1155 VanDerWaalsContact O-N 3.11Å; A1152-S1156 PolarHBondContact O-N 2.76Å; A1152-S1156 PolarHBondContact O-OG 3.04Å
1153	C	47.7	Very low	51	Low	60 Å²	60	104.8 Å²	104.8	41%	0.405	57%	0.574	S	S	.	*	H	α-helix	trans	-56.8	-46.4	174	-70	0	0	0	0	111.7	T1149 M1155 S1156 E1157	T1149-C1153 PolarHBondContact O-N 3.25Å; T1149-C1153 PolarHBondContact O-SG 3.16Å; T1149-C1153 VanDerWaalsContact O-SG 3.32Å; C1153-M1155 PolarHBondContact O-N 2.89Å; C1153-S1156 WeakPolarHBondContact CA-OG 3.16Å; C1153-S1156 PolarHBondContact O-N 3.31Å; C1153-S1156 VanDerWaalsContact O-N 3.11Å; C1153-S1156 PolarHBondContact O-OG 3.09Å; C1153-E1157 WeakPolarHBondContact O-CB 3.48Å; C1153-E1157 WeakPolarHBondContact O-CG 3.4Å; C1153-E1157 PolarHBondContact O-N 3.32Å
1154	M	50.1	Low	52.5	Low	127 Å²	127	100.8 Å²	100.8	63%	0.626	56%	0.559	S	S	*	*	H	α-helix	trans	-63.4	-29.3	178.1	-169.1	173.2	63.6	0	0	113	Q1150 L1151 A1152 S1158	Q1150-M1154 WeakPolarHBondContact O-CB 3.42Å; Q1150-M1154 PolarHBondContact O-N 3.48Å; Q1150-M1154 VanDerWaalsContact O-N 3.14Å; L1151-M1154 HydrophobicContact CD1-CE 3.81Å; L1151-M1154 PolarHBondContact O-N 2.83Å; A1152-M1154 VanDerWaalsContact C-N 3.35Å; A1152-M1154 PolarHBondContact O-N 3.32Å; M1154-S1158 PolarHBondContact O-OG 2.98Å
1155	M	52.6	Low	53.5	Low	140 Å²	140	100.2 Å²	100.2	69%	0.69	54%	0.543	S	S	*	.	H	α-helix	trans	-83	-23.3	174	-69.7	-175.5	69.5	0	0	113.9	L1151 A1152 C1153	L1151-M1155 HydrophobicContact CD1-CG 4.48Å; L1151-M1155 HydrophobicContact CD1-SD 4.36Å; L1151-M1155 HydrophobicContact CG-SD 4.36Å; L1151-M1155 WeakPolarHBondContact O-CG 3.45Å; L1151-M1155 PolarHBondContact O-N 3.41Å; A1152-M1155 CarbonylContact O-C 3.59Å; A1152-M1155 PolarHBondContact O-N 2.85Å; A1152-M1155 VanDerWaalsContact O-N 3.11Å; C1153-M1155 PolarHBondContact O-N 2.89Å
1156	S	52.1	Low	55	Low	65 Å²	65	104.1 Å²	104.1	46%	0.455	55%	0.546	S	S	.	.	H	α-helix	trans	-90.2	-46.9	176.9	61.6	0	0	0	0	113.3	A1152 C1153 S1158 S1159	A1152-S1156 PolarHBondContact O-N 2.76Å; A1152-S1156 PolarHBondContact O-OG 3.04Å; C1153-S1156 WeakPolarHBondContact CA-OG 3.16Å; C1153-S1156 PolarHBondContact O-N 3.31Å; C1153-S1156 VanDerWaalsContact O-N 3.11Å; C1153-S1156 PolarHBondContact O-OG 3.09Å; S1156-S1158 VanDerWaalsContact C-N 3.28Å; S1156-S1158 PolarHBondContact O-N 3.33Å; S1156-S1159 PolarHBondContact O-N 2.96Å; S1156-S1159 PolarHBondContact O-OG 3.22Å
1157	E	57.5	Low	56.2	Low	139 Å²	139	102.4 Å²	102.4	65%	0.65	54%	0.541	S	S	*	.	H	α-helix	trans	-66.2	-29.8	-174.2	-69.1	-177	117	0	0	112.5	C1153 S1159	C1153-E1157 WeakPolarHBondContact O-CB 3.48Å; C1153-E1157 WeakPolarHBondContact O-CG 3.4Å; C1153-E1157 PolarHBondContact O-N 3.32Å; E1157-S1159 VanDerWaalsContact C-N 3.3Å; E1157-S1159 PolarHBondContact O-N 3.3Å
1158	S	53.1	Low	57.5	Low	61 Å²	61	99.6 Å²	99.6	43%	0.427	53%	0.529	S	S	.	.	H	α-helix	trans	-71.5	-17.2	-179.6	55.7	0	0	0	0	114.8	M1154 S1156 Y1162	M1154-S1158 PolarHBondContact O-OG 2.98Å; S1156-S1158 VanDerWaalsContact C-N 3.28Å; S1156-S1158 PolarHBondContact O-N 3.33Å; S1158-Y1162 WeakPolarHBondContact O-CD2 3.37Å
1159	S	46.6	Very low	58.6	Low	60 Å²	60	98.3 Å²	98.3	42%	0.42	52%	0.521	S	S	.	.	H	α-helix	trans	-92.3	-48	-173.5	65	0	0	0	0	113.7	S1156 E1157 D1161 Y1162 I1163	S1156-S1159 PolarHBondContact O-N 2.96Å; S1156-S1159 PolarHBondContact O-OG 3.22Å; E1157-S1159 VanDerWaalsContact C-N 3.3Å; E1157-S1159 PolarHBondContact O-N 3.3Å; S1159-D1161 PolarHBondContact O-N 3.16Å; S1159-Y1162 PolarHBondContact O-N 3.23Å; S1159-I1163 PolarHBondContact O-N 2.83Å
1160	V	53.7	Low	59.2	Low	101 Å²	101	96.6 Å²	96.6	61%	0.612	52%	0.515	S	S	*	.	H	α-helix	trans	-58.8	-39.9	179.4	-175.6	0	0	0	0	111	Y1162 I1163 A1164	V1160-Y1162 VanDerWaalsContact C-N 3.28Å; V1160-Y1162 PolarHBondContact O-N 2.69Å; V1160-I1163 PolarHBondContact O-N 2.72Å; V1160-I1163 VanDerWaalsContact O-N 3.09Å; V1160-A1164 PolarHBondContact O-N 3.21Å
1161	D	57.7	Low	59.8	Low	81 Å²	81	96 Å²	96	43%	0.433	51%	0.513	S	S	.	.	H	α-helix	trans	-69.1	-22.9	-175.8	-145.3	44.2	0	0	0	113	S1159 R1165	S1159-D1161 PolarHBondContact O-N 3.16Å; D1161-R1165 VanDerWaalsContact CG-NH1 3.28Å; D1161-R1165 VanDerWaalsContact CG-NH2 3.33Å; D1161-R1165 WeakPolarHBondContact O-CG 3.48Å; D1161-R1165 PolarHBondContact O-N 3.45Å; D1161-R1165 PolarHBondContact O-NE 3.17Å; D1161-R1165 VanDerWaalsContact O-NE 3.16Å; D1161-R1165 PolarHBondContact O-NH2 2.95Å; D1161-R1165 IonicContact OD1-NH1 2.7Å; D1161-R1165 IonicContact OD2-CZ 2.72Å; D1161-R1165 IonicContact OD2-NH1 2.62Å; D1161-R1165 PolarHBondContact OD2-NH1 3.44Å; D1161-R1165 IonicContact OD2-NH2 3.99Å; D1161-R1165 PolarHBondContact OD2-NH2 3.48Å
1162	Y	56.2	Low	60.3	Low	162 Å²	162	98.8 Å²	98.8	64%	0.635	52%	0.523	S	S	*	.	H	α-helix	trans	-85	-30.9	168.7	-74.7	-58.6	0	0	0	113	S1158 S1159 V1160 F1166	S1158-Y1162 WeakPolarHBondContact O-CD2 3.37Å; S1159-Y1162 PolarHBondContact O-N 3.23Å; V1160-Y1162 VanDerWaalsContact C-N 3.28Å; V1160-Y1162 PolarHBondContact O-N 2.69Å; Y1162-F1166 WeakPolarHBondContact O-CB 3.2Å; Y1162-F1166 PolarHBondContact O-N 3.27Å
1163	I	67.3	Low	60.6	Low	106 Å²	106	101.7 Å²	101.7	54%	0.544	53%	0.531	S	S	.	.	H	α-helix	trans	-68.4	-40.7	175.9	-64.6	167.8	0	0	0	110.2	S1159 V1160 F1166 N1167	S1159-I1163 PolarHBondContact O-N 2.83Å; V1160-I1163 PolarHBondContact O-N 2.72Å; V1160-I1163 VanDerWaalsContact O-N 3.09Å; I1163-F1166 PolarHBondContact O-N 3.18Å; I1163-N1167 PolarHBondContact O-N 2.87Å; I1163-N1167 PolarHBondContact O-ND2 3.15Å; I1163-N1167 VanDerWaalsContact O-ND2 3.16Å
1164	A	65.2	Low	61	Low	44 Å²	44	102.6 Å²	102.6	36%	0.364	54%	0.543	S	S	.	.	H	α-helix	trans	-57.6	-59.1	170.6	0	0	0	0	0	111	V1160 F1166 N1167 D1168	V1160-A1164 PolarHBondContact O-N 3.21Å; A1164-F1166 PolarHBondContact O-N 3.46Å; A1164-F1166 VanDerWaalsContact O-N 3.15Å; A1164-N1167 PolarHBondContact O-N 3.06Å; A1164-D1168 VanDerWaalsContact O-CG 3.26Å; A1164-D1168 PolarHBondContact O-N 3.16Å
1165	R	65.9	Low	61.4	Low	115 Å²	115	102.6 Å²	102.6	43%	0.434	55%	0.549	S	S	.	.	H	α-helix	trans	-61.4	-26.2	-179.6	-75.2	-173.5	-73.4	-94.1	-0.3	114.7	D1161 L1169	D1161-R1165 VanDerWaalsContact CG-NH1 3.28Å; D1161-R1165 VanDerWaalsContact CG-NH2 3.33Å; D1161-R1165 WeakPolarHBondContact O-CG 3.48Å; D1161-R1165 PolarHBondContact O-N 3.45Å; D1161-R1165 PolarHBondContact O-NE 3.17Å; D1161-R1165 VanDerWaalsContact O-NE 3.16Å; D1161-R1165 PolarHBondContact O-NH2 2.95Å; D1161-R1165 IonicContact OD1-NH1 2.7Å; D1161-R1165 IonicContact OD2-CZ 2.72Å; D1161-R1165 IonicContact OD2-NH1 2.62Å; D1161-R1165 PolarHBondContact OD2-NH1 3.44Å; D1161-R1165 IonicContact OD2-NH2 3.99Å; D1161-R1165 PolarHBondContact OD2-NH2 3.48Å; R1165-L1169 VanDerWaalsContact O-CB 3.25Å; R1165-L1169 WeakPolarHBondContact O-CB 3.25Å; R1165-L1169 PolarHBondContact O-N 3.21Å; R1165-L1169 VanDerWaalsContact O-N 3.17Å
1166	F	76.8	Confident	61.4	Low	156 Å²	156	100.9 Å²	100.9	68%	0.684	55%	0.547	S	S	*	.	H	α-helix	trans	-75.5	-38.6	173.9	-173.2	-94.5	0	0	0	111.8	Y1162 I1163 A1164 A1170	Y1162-F1166 WeakPolarHBondContact O-CB 3.2Å; Y1162-F1166 PolarHBondContact O-N 3.27Å; I1163-F1166 PolarHBondContact O-N 3.18Å; A1164-F1166 PolarHBondContact O-N 3.46Å; A1164-F1166 VanDerWaalsContact O-N 3.15Å; F1166-A1170 VanDerWaalsContact O-CB 3.3Å; F1166-A1170 WeakPolarHBondContact O-CB 3.3Å; F1166-A1170 PolarHBondContact O-N 3.39Å
1167	N	69.9	Low	61	Low	87 Å²	87	106.1 Å²	106.1	47%	0.465	56%	0.564	S	S	.	*	H	α-helix	trans	-68	-41.9	172.5	-76.4	-41.3	0	0	0	111.9	I1163 A1164 L1169 A1170 Q1171	I1163-N1167 PolarHBondContact O-N 2.87Å; I1163-N1167 PolarHBondContact O-ND2 3.15Å; I1163-N1167 VanDerWaalsContact O-ND2 3.16Å; A1164-N1167 PolarHBondContact O-N 3.06Å; N1167-L1169 VanDerWaalsContact C-N 3.33Å; N1167-L1169 PolarHBondContact O-N 3.39Å; N1167-A1170 PolarHBondContact O-N 3.15Å; N1167-Q1171 WeakPolarHBondContact O-CG 3.45Å; N1167-Q1171 PolarHBondContact O-N 3.04Å
1168	D	76.4	Confident	60.8	Low	94 Å²	94	104.9 Å²	104.9	50%	0.503	57%	0.568	S	S	.	*	H	α-helix	trans	-58.4	-46	175.7	-61.7	-26.9	0	0	0	110.8	A1164 Q1171 E1172	A1164-D1168 VanDerWaalsContact O-CG 3.26Å; A1164-D1168 PolarHBondContact O-N 3.16Å; D1168-Q1171 PolarHBondContact O-N 2.98Å; D1168-E1172 PolarHBondContact O-N 3.26Å
1169	L	73	Confident	60.7	Low	99 Å²	99	107.8 Å²	107.8	52%	0.518	59%	0.588	S	S	.	*	H	α-helix	trans	-73.6	-27.2	-179.2	-159.4	143.2	0	0	0	112.5	R1165 N1167 L1173	R1165-L1169 VanDerWaalsContact O-CB 3.25Å; R1165-L1169 WeakPolarHBondContact O-CB 3.25Å; R1165-L1169 PolarHBondContact O-N 3.21Å; R1165-L1169 VanDerWaalsContact O-N 3.17Å; N1167-L1169 VanDerWaalsContact C-N 3.33Å; N1167-L1169 PolarHBondContact O-N 3.39Å; L1169-L1173 HydrophobicContact CD2-CD1 4.05Å; L1169-L1173 WeakPolarHBondContact O-CG 3.33Å; L1169-L1173 PolarHBondContact O-N 3.02Å
1170	A	67.8	Low	60.7	Low	47 Å²	47	112 Å²	112	39%	0.388	61%	0.605	S	S	.	*	H	α-helix	trans	-70.8	-36.6	168.7	0	0	0	0	0	112.3	F1166 N1167 A1174	F1166-A1170 VanDerWaalsContact O-CB 3.3Å; F1166-A1170 WeakPolarHBondContact O-CB 3.3Å; F1166-A1170 PolarHBondContact O-N 3.39Å; N1167-A1170 PolarHBondContact O-N 3.15Å; A1170-A1174 WeakPolarHBondContact O-CB 3.36Å; A1170-A1174 PolarHBondContact O-N 3.16Å
1171	Q	62.5	Low	60.5	Low	136 Å²	136	112.3 Å²	112.3	64%	0.636	61%	0.609	S	S	*	*	H	α-helix	trans	-69.8	-39.7	172.9	-74.1	-175.6	-5.1	0	0	111.9	N1167 D1168 L1173 A1174 V1175	N1167-Q1171 WeakPolarHBondContact O-CG 3.45Å; N1167-Q1171 PolarHBondContact O-N 3.04Å; D1168-Q1171 PolarHBondContact O-N 2.98Å; Q1171-L1173 VanDerWaalsContact C-N 3.34Å; Q1171-L1173 PolarHBondContact O-N 2.87Å; Q1171-A1174 PolarHBondContact O-N 3.23Å; Q1171-V1175 WeakPolarHBondContact O-CG2 3.33Å; Q1171-V1175 PolarHBondContact O-N 2.87Å; Q1171-V1175 VanDerWaalsContact O-N 3.17Å
1172	E	64.7	Low	60.5	Low	139 Å²	139	114.1 Å²	114.1	65%	0.65	63%	0.625	S	S	*	*	H	α-helix	trans	-60.4	-43.2	175.8	-169.7	172	-153.2	0	0	111.4	D1168 V1175	D1168-E1172 PolarHBondContact O-N 3.26Å; E1172-V1175 PolarHBondContact O-N 3.17Å
1173	L	56.5	Low	60.5	Low	117 Å²	117	113.3 Å²	113.3	61%	0.613	64%	0.64	S	S	*	*	H	α-helix	trans	-65.9	-41.5	173.9	-71.6	169.8	0	0	0	112.5	L1169 Q1171 V1175 T1176	L1169-L1173 HydrophobicContact CD2-CD1 4.05Å; L1169-L1173 WeakPolarHBondContact O-CG 3.33Å; L1169-L1173 PolarHBondContact O-N 3.02Å; Q1171-L1173 VanDerWaalsContact C-N 3.34Å; Q1171-L1173 PolarHBondContact O-N 2.87Å; L1173-V1175 PolarHBondContact O-N 2.86Å; L1173-T1176 PolarHBondContact O-N 3.23Å; L1173-T1176 PolarHBondContact O-OG1 3.46Å
1174	A	55.8	Low	60.2	Low	79 Å²	79	113.7 Å²	113.7	65%	0.653	65%	0.645	S	S	*	*	H	α-helix	trans	-67.1	-14.3	179.7	0	0	0	0	0	114.8	A1170 Q1171	A1170-A1174 WeakPolarHBondContact O-CB 3.36Å; A1170-A1174 PolarHBondContact O-N 3.16Å; Q1171-A1174 PolarHBondContact O-N 3.23Å
1175	V	57.7	Low	59.9	Low	126 Å²	126	117.4 Å²	117.4	76%	0.764	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-10.4	179.1	169.1	0	0	0	0	112.7	Q1171 E1172 L1173	Q1171-V1175 WeakPolarHBondContact O-CG2 3.33Å; Q1171-V1175 PolarHBondContact O-N 2.87Å; Q1171-V1175 VanDerWaalsContact O-N 3.17Å; E1172-V1175 PolarHBondContact O-N 3.17Å; L1173-V1175 PolarHBondContact O-N 2.86Å
1176	T	53.4	Low	59.6	Low	105 Å²	105	117.5 Å²	117.5	64%	0.644	67%	0.672	S	S	*	*	S	Bend	trans	-96.4	1.7	-174.1	55.4	0	0	0	0	116.1	L1173 P1178	L1173-T1176 PolarHBondContact O-N 3.23Å; L1173-T1176 PolarHBondContact O-OG1 3.46Å; T1176-P1178 WeakPolarHBondContact O-CD 3.47Å
1177	E	44.2	Very low	58.6	Low	174 Å²	174	115.2 Å²	115.2	81%	0.813	67%	0.671	S	S	*	*			trans	-104.3	110.3	179	-170.7	162.8	-141.1	0	0	112.2	S1179	E1177-S1179 PolarHBondContact O-N 3.48Å
1178	P	52.4	Low	57.9	Low	114 Å²	114	117 Å²	117	74%	0.74	68%	0.684	S	S	*	*			trans	-79.4	119.3	177.8	30.7	-32.8	0	0	0	111.6	T1176 I1180	T1176-P1178 WeakPolarHBondContact O-CD 3.47Å; P1178-I1180 PolarHBondContact O-N 3.4Å
1179	S	50.7	Low	56.6	Low	121 Å²	121	118.5 Å²	118.5	85%	0.846	70%	0.696	S	S	*	*			trans	-65.3	124.8	175	-178.9	0	0	0	0	112.4	E1177	E1177-S1179 PolarHBondContact O-N 3.48Å
1180	I	46.5	Very low	55.5	Low	148 Å²	148	119.9 Å²	119.9	76%	0.759	71%	0.709	S	S	*	*			trans	-127.4	136.5	163.6	-67.7	-177.7	0	0	0	106.4	P1178	P1178-I1180 PolarHBondContact O-N 3.4Å
1181	P	50.8	Low	54.5	Low	109 Å²	109	125.5 Å²	125.5	71%	0.708	73%	0.734	S	S	*	*			trans	-66.1	160	-167.7	23.1	-34.3	0	0	0	115.7
1182	P	56.1	Low	53.8	Low	119 Å²	119	124.7 Å²	124.7	77%	0.773	74%	0.742	S	S	*	*			trans	-78.5	-178.8	179.2	40.9	-41.2	0	0	0	111.4
1183	P	57.3	Low	52.9	Low	145 Å²	145	123.4 Å²	123.4	94%	0.942	75%	0.75	S	S	*	*			trans	-75.5	0	-154.2	30.4	-34.4	0	0	0	116.9	E682 V683	E682-P1183 HydrophobicContact CB-CG 4.19Å; V683-P1183 HydrophobicContact CB-CB 4.14Å; V683-P1183 HydrophobicContact CG1-CB 3.38Å; V683-P1183 HydrophobicContact CG1-CG 4.48Å; V683-P1183 HydrophobicContact CG2-CB 3.64Å; V683-P1183 HydrophobicContact CG2-CG 4.4Å

Retrieved 1,183 of 1,183 residues in 371.1 ms (Link to these results)

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