A0A5K4F487_SCHMA Loading...

Serine/threonine-protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F487, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,164 aa.

						>A0A5K4F487_SCHMA|A0A5K4F487
MTKVDVCKWSPISFNRFLSHENNVKDNIPNYGFSCQSSASENANSSKSSRCSESINKFMFECSVEESKSKRNHTNSQKVVSSPLVSGNKVAKSVFILKDTRSHQLNKGATLKRNGNSDITIHEDLIKAKSTEELTRNVSIKDETKINNKTKSTQLKSLSFQKSDEYCIRDSNDILNQLNQKKSYKMVNKLSLSETRNTEYKIHISTDSTDSKLINHSDNNSSLLHKTSNNSYHLANSNGEKMKSDKSTKRKSYLKQNTTLLPNVLRAVDFVLPTESAGPSKENDGSIIHPNKLRHTGRGVKTLSASWKPTMLSNEEKQRRPINRKQRRDSMYEKGYGKLSSYKIYEKLGEGTYATVYKGYSLVSKQLVALKRIRMRKSEGAPCTAIREISLLRGLNHANIVKLHDVIYEAGSLTLVFEYGGSDLKSYMRMYNNRLPMNIVRLFTFQIFRGLEYCHAKQILHRDLKPQNLLISKTGDLKLADFGLARSQSVPIRTYSSEVVTLWYRPPDVLLGDKNYSGHIDIWGVGCILYEMTTGYSLFPGTSKEDQIKIIFRKFGIPPESYWPNLRTNPKFLEYLNSNRHKEKCESTKPNYSQSSTNLNLIDSKKPSSQLNKQLYDENVDSIDTYNEKIKNTLSCSAARLNSDGQQLLFECLALVGNRRITATDALKHVYFKCILPPGINVHDLLPEQSITLLAIEQNSINFSQPSRIHTTNTVTTSKNNGKKHKNKNNSTSYDNKLYGNEQLSKSLTNLSTVRSYPSNDSNPRNASIILPNCKNKLTTTKHKSDNEHQMQAFKLGKTKSSIQLCYNERNNTSTTTTTTTTTTTHHQHEHNSKSGDNNNNNNNSILTDQSSDIDTSFSSNSQYFIPYEKVCSQQHQPEQVSFSSVKKPTKLNEKMKRPVRKYLTISSGHMHKILYYQNIIGNNVSDNNNNDNNNHNNTDIKNKSISITSTNNLTALVKRKLYSLQTKAKESRNRLRSLSTDQFKIISLSSPSSDSLKEIELINANGFGDDNHSDELNSSNTFVNLHGALKNKINDGKFGQNMNQNRLYIDVNINKSLLDLPKSIQIINSPSYKSPNKKIIKSNYSTISNNSMNRLNHHKHSQLLSSAFIRINRPNSFNLKGIQQNYCFQSNNSLVHSNSHRKSWNSSGSSNLDTPFDEQSVFK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.2	Very low	28.3	Very low	232 Å²	232	150.9 Å²	150.9	100%	1.143	80%	0.797	S	S	*	*				0	103.4	0	-61.7	157	90.8	0	0	107.2
2	T	25.1	Very low	28.6	Very low	126 Å²	126	150.1 Å²	150.1	77%	0.773	79%	0.791	S	S	*	*				77.3	104.7	64.1	60.5	0	0	0	0	114.4
3	K	23.3	Very low	28.5	Very low	200 Å²	200	146.3 Å²	146.3	87%	0.87	78%	0.784	S	S	*	*			trans	33.8	111.6	153.4	-60.8	176.5	-178.9	173.3	0	118.6
4	V	32.1	Very low	28.4	Very low	149 Å²	149	145.7 Å²	145.7	90%	0.903	77%	0.771	S	S	*	*			trans	-131.4	149.7	144.1	-176.8	0	0	0	0	107.9
5	D	29.9	Very low	28.5	Very low	141 Å²	141	144.3 Å²	144.3	75%	0.754	76%	0.764	S	S	*	*			trans	-84.9	159.5	-138.7	-74.3	-77.1	0	0	0	120.2	C7	D5-C7 PolarHBondContact O-N 2.78Å
6	V	26.9	Very low	28.5	Very low	126 Å²	126	145.9 Å²	145.9	76%	0.764	76%	0.757	S	S	*	*			trans	-69.4	91.6	168.4	-178.8	0	0	0	0	109.9	K8	V6-K8 PolarHBondContact O-N 3.37Å
7	C	29.1	Very low	28.5	Very low	105 Å²	105	145.9 Å²	145.9	71%	0.709	75%	0.75	S	S	*	*			trans	-61.3	89.9	173.8	-100.1	0	0	0	0	112.6	D5 W9	D5-C7 PolarHBondContact O-N 2.78Å; C7-W9 PolarHBondContact O-N 3.23Å; C7-W9 VanDerWaalsContact O-N 3.13Å
8	K	24.2	Very low	28.6	Very low	196 Å²	196	147.9 Å²	147.9	85%	0.852	76%	0.761	S	S	*	*			trans	-73.3	90.9	172.9	-67.2	167.6	-175.6	159.7	0	110.9	V6	V6-K8 PolarHBondContact O-N 3.37Å
9	W	29.2	Very low	28.6	Very low	202 Å²	202	143.7 Å²	143.7	77%	0.765	75%	0.746	S	S	*	*			trans	-95.4	140.5	175.8	-76.5	75.6	0	0	0	113.9	C7	C7-W9 PolarHBondContact O-N 3.23Å; C7-W9 VanDerWaalsContact O-N 3.13Å
10	S	28.3	Very low	28.6	Very low	84 Å²	84	143 Å²	143	59%	0.587	74%	0.739	S	S	*	*			trans	-88.8	141.7	176.6	50	0	0	0	0	111.6	I12	S10-I12 PolarHBondContact O-N 3.02Å
11	P	31.9	Very low	28.6	Very low	99 Å²	99	144.4 Å²	144.4	64%	0.643	74%	0.742	S	S	*	*			trans	-74.8	95.7	172.1	30.8	-32.9	0	0	0	110.4
12	I	31.4	Very low	28.5	Very low	141 Å²	141	140.9 Å²	140.9	72%	0.723	73%	0.728	S	S	*	*			trans	-61.2	151.9	169.1	-67.7	176.4	0	0	0	110	S10 F14	S10-I12 PolarHBondContact O-N 3.02Å; I12-F14 PolarHBondContact O-N 2.98Å
13	S	27.8	Very low	28.7	Very low	101 Å²	101	142.6 Å²	142.6	71%	0.706	73%	0.732	S	S	*	*			trans	-66.6	90.9	-166.9	-56.6	0	0	0	0	115	N15	S13-N15 VanDerWaalsContact C-N 3.33Å; S13-N15 PolarHBondContact O-N 2.81Å
14	F	27.5	Very low	29.1	Very low	138 Å²	138	139.5 Å²	139.5	61%	0.605	73%	0.73	S	S	*	*			trans	-91.8	67.7	164.1	-138.6	-93.7	0	0	0	111.5	I12 F17	I12-F14 PolarHBondContact O-N 2.98Å; F14-F17 HydrophobicContact CD1-CB 4.29Å; F14-F17 HydrophobicContact CE1-CB 3.49Å; F14-F17 VanDerWaalsContact CE1-CB 3.49Å; F14-F17 HydrophobicContact CE1-CD2 4.33Å; F14-F17 HydrophobicContact CE1-CG 4.01Å; F14-F17 HydrophobicContact CE2-CD2 4.09Å; F14-F17 HydrophobicContact CZ-CB 3.7Å; F14-F17 AromaticContact CZ-CD2 3.63Å; F14-F17 HydrophobicContact CZ-CD2 3.63Å; F14-F17 HydrophobicContact CZ-CE2 4.43Å; F14-F17 AromaticContact CZ-CG 3.69Å; F14-F17 HydrophobicContact CZ-CG 3.69Å
15	N	29.3	Very low	29	Very low	124 Å²	124	140.5 Å²	140.5	66%	0.663	72%	0.722	S	S	*	*			trans	-131.6	19.4	177.6	-122.2	79.3	0	0	0	111.1	S13 S19	S13-N15 VanDerWaalsContact C-N 3.33Å; S13-N15 PolarHBondContact O-N 2.81Å; N15-S19 PolarHBondContact O-OG 2.76Å; N15-S19 VanDerWaalsContact O-OG 3.11Å
16	R	29.1	Very low	29	Very low	171 Å²	171	140.3 Å²	140.3	65%	0.645	72%	0.721	S	S	*	*	S	Bend	trans	-136.3	40.3	-173.3	-156.4	-179.3	-169.2	160.9	8.1	112.1	S19 H20	R16-S19 WeakPolarHBondContact CA-OG 3.45Å; R16-H20 PolarHBondContact NE-CD2 3.1Å; R16-H20 PolarHBondContact NH2-NE2 3.48Å
17	F	28.5	Very low	29.2	Very low	145 Å²	145	141.1 Å²	141.1	64%	0.636	72%	0.721	S	S	*	*	S	Bend	trans	-140.9	15.9	179.5	-122.2	-77.6	0	0	0	113.6	F14	F14-F17 HydrophobicContact CD1-CB 4.29Å; F14-F17 HydrophobicContact CE1-CB 3.49Å; F14-F17 VanDerWaalsContact CE1-CB 3.49Å; F14-F17 HydrophobicContact CE1-CD2 4.33Å; F14-F17 HydrophobicContact CE1-CG 4.01Å; F14-F17 HydrophobicContact CE2-CD2 4.09Å; F14-F17 HydrophobicContact CZ-CB 3.7Å; F14-F17 AromaticContact CZ-CD2 3.63Å; F14-F17 HydrophobicContact CZ-CD2 3.63Å; F14-F17 HydrophobicContact CZ-CE2 4.43Å; F14-F17 AromaticContact CZ-CG 3.69Å; F14-F17 HydrophobicContact CZ-CG 3.69Å
18	L	30.4	Very low	29.3	Very low	182 Å²	182	143.2 Å²	143.2	95%	0.953	72%	0.723	S	S	*	*	S	Bend	trans	-141.6	37.3	160	-75.6	179.3	0	0	0	108
19	S	28.3	Very low	29.7	Very low	68 Å²	68	138.5 Å²	138.5	48%	0.476	71%	0.713	S	S	.	*	S	Bend	trans	-167.6	34.2	-165.6	48.2	0	0	0	0	112.4	N15 R16	N15-S19 PolarHBondContact O-OG 2.76Å; N15-S19 VanDerWaalsContact O-OG 3.11Å; R16-S19 WeakPolarHBondContact CA-OG 3.45Å
20	H	28.2	Very low	29.6	Very low	130 Å²	130	134.3 Å²	134.3	60%	0.602	71%	0.706	S	S	*	*	S	Bend	trans	-167.8	44.8	168.4	-112.3	-70.8	0	0	0	113.3	R16	R16-H20 PolarHBondContact NE-CD2 3.1Å; R16-H20 PolarHBondContact NH2-NE2 3.48Å
21	E	29.5	Very low	29.7	Very low	172 Å²	172	139 Å²	139	80%	0.804	71%	0.712	S	S	*	*			trans	-120.1	165.1	154.1	-74.6	-177.1	148.8	0	0	107.5
22	N	29.4	Very low	29.3	Very low	159 Å²	159	137.9 Å²	137.9	85%	0.85	72%	0.718	S	S	*	*	S	Bend	trans	64.1	62.4	-164	-58.2	-1.6	0	0	0	114
23	N	27.7	Very low	29.2	Very low	162 Å²	162	140.5 Å²	140.5	87%	0.866	72%	0.724	S	S	*	*			trans	-156.2	51.8	144.3	-119.9	-10.6	0	0	0	112.4
24	V	32.1	Very low	29	Very low	135 Å²	135	140.6 Å²	140.6	82%	0.818	73%	0.725	S	S	*	*	S	Bend	trans	-131.3	94.6	160.1	-179.6	0	0	0	0	108.2
25	K	30.9	Very low	29	Very low	170 Å²	170	139.7 Å²	139.7	74%	0.739	74%	0.735	S	S	*	*			trans	51.8	112	142.1	-57.3	-165.7	171.9	-167.7	0	120.7
26	D	29.5	Very low	28.8	Very low	136 Å²	136	142.3 Å²	142.3	73%	0.727	74%	0.743	S	S	*	*				55.4	140.4	107.6	-40	-34.4	0	0	0	120.4
27	N	31.2	Very low	28.7	Very low	143 Å²	143	139.1 Å²	139.1	77%	0.765	75%	0.747	S	S	*	*			trans	83.7	92.5	179.3	-55.5	-14.1	0	0	0	114.7
28	I	31.7	Very low	28.6	Very low	149 Å²	149	137.4 Å²	137.4	76%	0.764	75%	0.753	S	S	*	*				83.8	128	68.4	-73.6	167.5	0	0	0	111.3
29	P	30.9	Very low	28.5	Very low	98 Å²	98	133.3 Å²	133.3	64%	0.636	75%	0.746	S	S	*	*			cis	-143.7	-168.9	-16	38.3	-17.3	0	0	0	116.1
30	N	28.1	Very low	28.6	Very low	114 Å²	114	134.9 Å²	134.9	61%	0.61	76%	0.756	S	S	*	*			trans	106	133.1	134.6	-85.4	-6.4	0	0	0	123
31	Y	29.5	Very low	28.6	Very low	183 Å²	183	136.7 Å²	136.7	72%	0.718	77%	0.765	S	S	*	*			trans	44.5	103.6	159.8	-53.8	-57.6	0	0	0	120.5	F33	Y31-F33 HydrophobicContact CD1-CD2 4.28Å; Y31-F33 HydrophobicContact CD1-CE2 4.18Å
32	G	24.7	Very low	28.7	Very low	75 Å²	75	135.1 Å²	135.1	77%	0.773	76%	0.762	S	S	*	*			trans	-90.8	150.1	132.7	0	0	0	0	0	110.1
33	F	28.8	Very low	28.8	Very low	195 Å²	195	131.4 Å²	131.4	86%	0.855	75%	0.754	S	S	*	*			trans	-143.3	148.2	165.6	-110.8	-78.4	0	0	0	110.6	Y31	Y31-F33 HydrophobicContact CD1-CD2 4.28Å; Y31-F33 HydrophobicContact CD1-CE2 4.18Å
34	S	23.7	Very low	29	Very low	103 Å²	103	130.7 Å²	130.7	72%	0.72	75%	0.75	S	S	*	*			trans	-120.5	122.2	176.4	56.7	0	0	0	0	111
35	C	28.1	Very low	29	Very low	120 Å²	120	129.2 Å²	129.2	81%	0.811	75%	0.746	S	S	*	*			trans	-160	136.1	154.3	-93.1	0	0	0	0	105.7
36	Q	24.3	Very low	28.9	Very low	178 Å²	178	126 Å²	126	83%	0.832	75%	0.745	S	S	*	*				65.5	130.8	58.7	-79.3	-163	-25.1	0	0	115.5
37	S	26.5	Very low	29	Very low	104 Å²	104	129 Å²	129	73%	0.727	75%	0.751	S	S	*	*			trans	61.4	100.7	158.7	51.3	0	0	0	0	120.8
38	S	25.9	Very low	28.9	Very low	109 Å²	109	127.1 Å²	127.1	76%	0.762	75%	0.749	S	S	*	*				62.5	138	120.5	64.3	0	0	0	0	123.2
39	A	29.1	Very low	28.8	Very low	97 Å²	97	125.1 Å²	125.1	80%	0.802	75%	0.749	S	S	*	*			trans	68.4	147.7	157.9	0	0	0	0	0	117
40	S	30.6	Very low	28.7	Very low	100 Å²	100	132.1 Å²	132.1	70%	0.699	76%	0.762	S	S	*	*			cis	-162.5	139.3	-12.8	41.7	0	0	0	0	111.2
41	E	29	Very low	28.6	Very low	168 Å²	168	133.5 Å²	133.5	79%	0.785	78%	0.779	S	S	*	*			trans	58.4	158.3	147.3	-62	-170	165	0	0	123.4
42	N	30.6	Very low	28.6	Very low	140 Å²	140	129.8 Å²	129.8	75%	0.749	78%	0.78	S	S	*	*			trans	74.5	97	152.5	-62.8	-33.3	0	0	0	121.5
43	A	32.6	Very low	28.7	Very low	81 Å²	81	135.1 Å²	135.1	67%	0.669	79%	0.785	S	S	*	*				109.3	122.3	107.9	0	0	0	0	0	120.5
44	N	31.3	Very low	28.7	Very low	147 Å²	147	131.5 Å²	131.5	79%	0.786	78%	0.784	S	S	*	*			trans	72.2	111.1	136.2	-62.8	-11.7	0	0	0	122.8
45	S	31.7	Very low	29	Very low	104 Å²	104	134.7 Å²	134.7	73%	0.727	79%	0.791	S	S	*	*				86.5	98.5	125.5	71.7	0	0	0	0	120.9
46	S	28.2	Very low	29	Very low	103 Å²	103	137.1 Å²	137.1	72%	0.72	80%	0.796	S	S	*	*				43.1	116.8	127.9	63	0	0	0	0	121.3
47	K	31.3	Very low	29.2	Very low	198 Å²	198	137.9 Å²	137.9	86%	0.861	80%	0.796	S	S	*	*				-171	161.9	120.9	-100.9	150.7	-173	172.6	0	112.3
48	S	30.8	Very low	29.2	Very low	103 Å²	103	142.4 Å²	142.4	72%	0.72	80%	0.803	S	S	*	*			trans	34.1	102.3	159.5	53.3	0	0	0	0	118.6
49	S	29.3	Very low	29.2	Very low	108 Å²	108	143.7 Å²	143.7	76%	0.755	80%	0.799	S	S	*	*				72.6	136.8	74.6	77.3	0	0	0	0	116
50	R	27.6	Very low	29.2	Very low	244 Å²	244	145.2 Å²	145.2	92%	0.921	79%	0.788	S	S	*	*			trans	74.6	88.3	-179.8	-62.3	178.5	167.4	165.2	-4.4	116.5
51	C	27.6	Very low	29	Very low	143 Å²	143	149.4 Å²	149.4	97%	0.966	80%	0.796	S	S	*	*			trans	-159.7	86.9	130	-128.5	0	0	0	0	110.7
52	S	27.9	Very low	28.8	Very low	106 Å²	106	147.6 Å²	147.6	74%	0.741	80%	0.801	S	S	*	*			trans	-124.6	150.8	167.8	54	0	0	0	0	108.2
53	E	27.3	Very low	28.8	Very low	187 Å²	187	146.1 Å²	146.1	87%	0.874	80%	0.801	S	S	*	*			trans	71.3	75.7	-179	-49.3	-170.4	124.8	0	0	116.6
54	S	29.2	Very low	28.7	Very low	118 Å²	118	149.4 Å²	149.4	83%	0.825	81%	0.812	S	S	*	*			trans	-165.8	105.9	140.7	-87.5	0	0	0	0	112.8
55	I	29.9	Very low	28.4	Very low	171 Å²	171	150.6 Å²	150.6	88%	0.877	81%	0.814	S	S	*	*	S	Bend	trans	162.2	74.8	151.9	-83.4	153.9	0	0	0	105.5
56	N	28.2	Very low	28.4	Very low	170 Å²	170	155.3 Å²	155.3	91%	0.909	82%	0.824	S	S	*	*			trans	-159.4	48.7	176.9	-132.9	-17.6	0	0	0	111.1
57	K	28.1	Very low	28.5	Very low	195 Å²	195	154.6 Å²	154.6	85%	0.848	82%	0.819	S	S	*	*			trans	-153.4	72.2	-175.1	-165.6	-173.7	178.6	-174.5	0	113.2
58	F	26.1	Very low	28.6	Very low	198 Å²	198	155.3 Å²	155.3	87%	0.868	82%	0.822	S	S	*	*	S	Bend	trans	-164	166.2	141.7	-123	-89	0	0	0	109.4
59	M	27.8	Very low	28.8	Very low	137 Å²	137	154.3 Å²	154.3	68%	0.675	82%	0.815	S	S	*	*	S	Bend	trans	67.6	53.7	177	-55.8	-58.4	-85.3	0	0	117.3
60	F	27.5	Very low	29.1	Very low	129 Å²	129	152.2 Å²	152.2	57%	0.566	79%	0.792	S	S	*	*			trans	-147	81.9	156.4	-150.1	-70.2	0	0	0	112.6
61	E	26.6	Very low	29.4	Very low	188 Å²	188	150.8 Å²	150.8	88%	0.879	79%	0.787	S	S	*	*			trans	-155.5	107.3	165.1	-126.4	157.8	-137.5	0	0	113
62	C	25.8	Very low	29.9	Very low	130 Å²	130	149.7 Å²	149.7	88%	0.878	77%	0.772	S	S	*	*			trans	-167.6	71.2	164	-101.3	0	0	0	0	108.1
63	S	29.8	Very low	30.5	Very low	108 Å²	108	152 Å²	152	76%	0.755	77%	0.771	S	S	*	*	S	Bend	trans	-145.1	139.9	168.9	-70	0	0	0	0	107.1
64	V	31	Very low	30.9	Very low	150 Å²	150	148 Å²	148	91%	0.909	76%	0.759	S	S	*	*			trans	-63.7	135.8	-161.3	179.2	0	0	0	0	111.5
65	E	25.8	Very low	31.2	Very low	173 Å²	173	149.5 Å²	149.5	81%	0.808	76%	0.757	S	S	*	*			trans	-67.2	136.4	174.7	-57.4	176.5	99.9	0	0	111.2
66	E	30.3	Very low	31.3	Very low	203 Å²	203	145.9 Å²	145.9	95%	0.949	75%	0.748	S	S	*	*			trans	-146.5	139	131.2	-127	178.5	-151	0	0	109.4
67	S	31.3	Very low	31.5	Very low	88 Å²	88	145.1 Å²	145.1	62%	0.615	74%	0.739	S	S	*	*			trans	-135.2	134.4	-156.1	60.1	0	0	0	0	114.2
68	K	32.7	Very low	31.7	Very low	212 Å²	212	144.2 Å²	144.2	92%	0.922	74%	0.735	S	S	*	*			trans	-145.3	128.6	145.3	-95.5	109.2	-157.8	163.5	0	111
69	S	34.1	Very low	31.9	Very low	83 Å²	83	140.8 Å²	140.8	58%	0.58	73%	0.729	S	S	*	*			trans	-70.7	-177.1	173	-176.8	0	0	0	0	108.9
70	K	35.9	Very low	32	Very low	63 Å²	63	140.3 Å²	140.3	27%	0.274	73%	0.734	S	S	.	*			cis	-164.8	169.2	38.7	-29.7	163.2	-169	168	0	112.7	V94 I96	K70-V94 HydrophobicContact CB-CB 4.31Å; K70-V94 HydrophobicContact CB-CG2 3.67Å; K70-V94 HydrophobicContact CD-CB 3.81Å; K70-V94 HydrophobicContact CD-CG1 3.69Å; K70-V94 HydrophobicContact CD-CG2 3.81Å; K70-V94 WeakPolarHBondContact CD-O 3.43Å; K70-V94 HydrophobicContact CG-CB 4.3Å; K70-V94 HydrophobicContact CG-CG1 4.45Å; K70-V94 HydrophobicContact CG-CG2 3.74Å; K70-V94 PolarHBondContact NZ-O 3.13Å; K70-I96 HydrophobicContact CD-CB 3.68Å; K70-I96 HydrophobicContact CD-CD1 3.96Å; K70-I96 HydrophobicContact CD-CG1 3.83Å; K70-I96 HydrophobicContact CG-CB 4.35Å; K70-I96 HydrophobicContact CG-CD1 3.82Å; K70-I96 HydrophobicContact CG-CG1 3.92Å
71	R	35.2	Very low	32.3	Very low	214 Å²	214	138.6 Å²	138.6	81%	0.808	74%	0.738	S	S	*	*			trans	-101.6	172.4	-173.5	-71.8	177.6	170.3	157.1	-5.3	114.4
72	N	37.7	Very low	32.5	Very low	120 Å²	120	135.5 Å²	135.5	64%	0.642	74%	0.737	S	S	*	*			trans	-176.5	129.9	130.4	-89.2	3.7	0	0	0	109.4
73	H	40.6	Very low	33	Very low	156 Å²	156	134.8 Å²	134.8	72%	0.722	73%	0.731	S	S	*	*				75	133.7	78.7	-84	-73.4	0	0	0	114.5
74	T	36.3	Very low	32.9	Very low	102 Å²	102	137.4 Å²	137.4	63%	0.626	74%	0.736	S	S	*	*			cis	-166.5	168.1	-13.9	-8.5	0	0	0	0	111
75	N	34.1	Very low	32.9	Very low	149 Å²	149	135.8 Å²	135.8	80%	0.797	73%	0.726	S	S	*	*			trans	69.1	152.5	157.1	-67.4	-1.4	0	0	0	118.9
76	S	32.3	Very low	33.2	Very low	96 Å²	96	133.4 Å²	133.4	67%	0.671	73%	0.728	S	S	*	*			cis	-168.9	159.7	-16	51.5	0	0	0	0	113.8
77	Q	32.7	Very low	33.1	Very low	154 Å²	154	126.9 Å²	126.9	72%	0.72	72%	0.716	S	S	*	*			trans	78	124.7	158.9	-67	-160.8	38.1	0	0	122.4
78	K	31.7	Very low	33.2	Very low	176 Å²	176	131.1 Å²	131.1	77%	0.765	73%	0.731	S	S	*	*			trans	77.9	115.9	134.2	-74.3	179.6	178.5	166.2	0	123.3
79	V	30.4	Very low	33	Very low	125 Å²	125	130.4 Å²	130.4	76%	0.758	73%	0.728	S	S	*	*				87.1	101.4	122.5	174.7	0	0	0	0	120
80	V	30.5	Very low	32.8	Very low	127 Å²	127	133.7 Å²	133.7	77%	0.77	75%	0.745	S	S	*	*			trans	82.8	143.5	135.4	171.4	0	0	0	0	121.2
81	S	32.6	Very low	32.6	Very low	94 Å²	94	134.5 Å²	134.5	66%	0.657	76%	0.763	S	S	*	*			trans	59	103.3	162.3	61.9	0	0	0	0	121.5
82	S	32.3	Very low	32.3	Very low	122 Å²	122	133.7 Å²	133.7	85%	0.853	77%	0.765	S	S	*	*				75.2	155.9	124.7	-57.2	0	0	0	0	119.7
83	P	35	Very low	32	Very low	116 Å²	116	132.1 Å²	132.1	75%	0.753	76%	0.764	S	S	*	*			trans	-113.7	162.2	-152.7	40.6	-32.5	0	0	0	115.3
84	L	29.1	Very low	31.6	Very low	162 Å²	162	127.9 Å²	127.9	85%	0.848	75%	0.749	S	S	*	*			trans	-175.1	128.3	136.3	-97.8	158.3	0	0	0	112.4
85	V	30.5	Very low	31.3	Very low	117 Å²	117	131 Å²	131	71%	0.709	75%	0.754	S	S	*	*			trans	52.9	123.5	145.5	177.3	0	0	0	0	122.1
86	S	31.5	Very low	31.1	Very low	122 Å²	122	128.9 Å²	128.9	85%	0.853	74%	0.741	S	S	*	*			trans	67.7	157	159	76.7	0	0	0	0	118
87	G	29.1	Very low	31	Very low	67 Å²	67	131.5 Å²	131.5	69%	0.691	75%	0.747	S	S	*	*			cis	178	163.8	-8.4	0	0	0	0	0	113.4
88	N	32.6	Very low	30.9	Very low	176 Å²	176	132.7 Å²	132.7	94%	0.941	75%	0.75	S	S	*	*			trans	72.1	163.2	173.1	-75.2	-29.1	0	0	0	120.4
89	K	28.9	Very low	31	Very low	197 Å²	197	129.6 Å²	129.6	86%	0.857	74%	0.742	S	S	*	*			trans	-123.5	145.3	-165.7	-47.1	162.1	-179	171.8	0	110.9
90	V	30.9	Very low	31	Very low	152 Å²	152	128 Å²	128	92%	0.921	73%	0.732	S	S	*	*			trans	-147.8	154.2	141.8	179.7	0	0	0	0	108.1
91	A	30.1	Very low	31	Very low	80 Å²	80	132.2 Å²	132.2	66%	0.661	74%	0.735	S	S	*	*			trans	-140.5	156.6	177.4	0	0	0	0	0	111.8
92	K	30.1	Very low	31	Very low	197 Å²	197	132.7 Å²	132.7	86%	0.857	74%	0.738	S	S	*	*			trans	168.3	148.4	140.8	-93	156	-175.2	176.1	0	115
93	S	30.7	Very low	31.1	Very low	88 Å²	88	134 Å²	134	62%	0.615	73%	0.73	S	S	*	*			trans	86.6	155	134.6	56.8	0	0	0	0	125.5
94	V	32.2	Very low	31.1	Very low	67 Å²	67	135.4 Å²	135.4	41%	0.406	73%	0.726	S	S	.	*			cis	-177.3	91.6	-48.2	130	0	0	0	0	119.1	K70	K70-V94 HydrophobicContact CB-CB 4.31Å; K70-V94 HydrophobicContact CB-CG2 3.67Å; K70-V94 HydrophobicContact CD-CB 3.81Å; K70-V94 HydrophobicContact CD-CG1 3.69Å; K70-V94 HydrophobicContact CD-CG2 3.81Å; K70-V94 WeakPolarHBondContact CD-O 3.43Å; K70-V94 HydrophobicContact CG-CB 4.3Å; K70-V94 HydrophobicContact CG-CG1 4.45Å; K70-V94 HydrophobicContact CG-CG2 3.74Å; K70-V94 PolarHBondContact NZ-O 3.13Å
95	F	29.7	Very low	31.4	Very low	168 Å²	168	133.5 Å²	133.5	74%	0.737	72%	0.716	S	S	*	*			trans	-155.4	150.4	155.7	-95.4	-72.9	0	0	0	113.6
96	I	31.3	Very low	31.6	Very low	103 Å²	103	134 Å²	134	53%	0.528	72%	0.715	S	S	.	*			cis	98.3	118.4	-11.1	-82.9	-174.7	0	0	0	125.2	K70	K70-I96 HydrophobicContact CD-CB 3.68Å; K70-I96 HydrophobicContact CD-CD1 3.96Å; K70-I96 HydrophobicContact CD-CG1 3.83Å; K70-I96 HydrophobicContact CG-CB 4.35Å; K70-I96 HydrophobicContact CG-CD1 3.82Å; K70-I96 HydrophobicContact CG-CG1 3.92Å
97	L	29.5	Very low	31.8	Very low	152 Å²	152	137 Å²	137	80%	0.796	71%	0.713	S	S	*	*			trans	-161.2	140.3	150	-86.1	169.7	0	0	0	106.6
98	K	30.3	Very low	32.1	Very low	179 Å²	179	137.5 Å²	137.5	78%	0.778	72%	0.718	S	S	*	*				75.3	144.3	64.4	-78.1	-170.6	167.9	-163.1	0	114.6
99	D	33.6	Very low	32.3	Very low	111 Å²	111	133.4 Å²	133.4	59%	0.594	71%	0.708	S	S	*	*			cis	-151.9	178.4	28	-150.3	37.5	0	0	0	117.5
100	T	30.6	Very low	32.7	Very low	90 Å²	90	130.1 Å²	130.1	55%	0.552	71%	0.705	S	S	*	*			trans	-21.9	165.2	169.1	57.7	0	0	0	0	120.6
101	R	31.4	Very low	32.6	Very low	217 Å²	217	130.4 Å²	130.4	82%	0.819	70%	0.701	S	S	*	*			cis	-141.2	171.1	29.3	-83.8	95.8	-151.9	-93.3	2.7	109.4
102	S	32.7	Very low	32.8	Very low	103 Å²	103	136.7 Å²	136.7	72%	0.72	71%	0.713	S	S	*	*			cis	-173.5	-168.3	-16.2	56.8	0	0	0	0	106.7
103	H	34.4	Very low	32.9	Very low	151 Å²	151	138 Å²	138	70%	0.699	71%	0.713	S	S	*	*			cis	-163.9	161.3	2.7	-148.6	14.3	0	0	0	110.3
104	Q	34.5	Very low	33.1	Very low	144 Å²	144	141.2 Å²	141.2	67%	0.673	72%	0.723	S	S	*	*			trans	56.9	137.1	159.3	-56.3	-161.1	9.4	0	0	121.1
105	L	34.2	Very low	33.1	Very low	122 Å²	122	141.1 Å²	141.1	64%	0.639	74%	0.735	S	S	*	*			cis	-160.1	132.2	-3.1	-114.5	171.3	0	0	0	112.1
106	N	35.4	Very low	33.2	Very low	127 Å²	127	141 Å²	141	68%	0.679	74%	0.742	S	S	*	*			trans	52.7	150.4	143.3	-76.4	-3.6	0	0	0	122.5
107	K	36.1	Very low	33.3	Very low	187 Å²	187	140.7 Å²	140.7	81%	0.813	75%	0.749	S	S	*	*			cis	-148.8	143	-0.5	-104.4	150.6	-179.5	-178	0	105.9
108	G	36	Very low	33.2	Very low	77 Å²	77	140.8 Å²	140.8	79%	0.794	75%	0.751	S	S	*	*				107.5	143.8	73.1	0	0	0	0	0	110.1
109	A	36.3	Very low	33.1	Very low	89 Å²	89	139.4 Å²	139.4	74%	0.736	75%	0.75	S	S	*	*			cis	-160.9	161	2.1	0	0	0	0	0	113.7
110	T	35.9	Very low	32.8	Very low	129 Å²	129	140.1 Å²	140.1	79%	0.791	76%	0.759	S	S	*	*			trans	52.6	136.3	154.2	50	0	0	0	0	122.3
111	L	29	Very low	32.8	Very low	158 Å²	158	143.5 Å²	143.5	83%	0.827	77%	0.772	S	S	*	*			cis	97.8	111.5	20.7	-83.3	163.5	0	0	0	118.4
112	K	35.1	Very low	32.6	Very low	212 Å²	212	140.3 Å²	140.3	92%	0.922	77%	0.766	S	S	*	*				-169.7	-179.8	126.9	-103.5	171.7	-177.3	-177.3	0	111.6
113	R	31.6	Very low	32.4	Very low	224 Å²	224	142.7 Å²	142.7	85%	0.845	77%	0.766	S	S	*	*			trans	-157.4	168.6	-148.7	-151.8	-177.1	-164.3	161.4	2	114.5
114	N	35.5	Very low	32	Very low	155 Å²	155	142.1 Å²	142.1	83%	0.829	77%	0.768	S	S	*	*			trans	85.4	148.9	170.6	-46.2	-9.5	0	0	0	115.3
115	G	31.8	Very low	31.5	Very low	65 Å²	65	142.4 Å²	142.4	67%	0.67	77%	0.773	S	S	*	*			cis	157.7	133.7	-13.4	0	0	0	0	0	114.2
116	N	31.6	Very low	31.2	Very low	166 Å²	166	144.1 Å²	144.1	89%	0.888	78%	0.781	S	S	*	*			trans	68.1	152	176.5	-60.8	5.5	0	0	0	115.9
117	S	33.4	Very low	30.8	Very low	96 Å²	96	146.9 Å²	146.9	67%	0.671	79%	0.787	S	S	*	*			cis	-162.3	139.9	-10.1	40.7	0	0	0	0	112.4
118	D	26.6	Very low	30.4	Very low	155 Å²	155	142.5 Å²	142.5	83%	0.829	79%	0.786	S	S	*	*			trans	57.6	167.5	150	-56.3	-25.6	0	0	0	123.4
119	I	28.9	Very low	30.1	Very low	149 Å²	149	149.2 Å²	149.2	76%	0.764	79%	0.793	S	S	*	*			trans	85.4	85.5	168.2	-50	-176.6	0	0	0	118
120	T	28.3	Very low	29.9	Very low	126 Å²	126	150 Å²	150	77%	0.773	79%	0.793	S	S	*	*			trans	73.8	167.4	143.8	65.5	0	0	0	0	121.9
121	I	29.4	Very low	29.6	Very low	161 Å²	161	149.1 Å²	149.1	83%	0.826	79%	0.788	S	S	*	*			trans	87.9	125.4	167.4	-48.3	-176.5	0	0	0	118
122	H	28.5	Very low	29.8	Very low	150 Å²	150	148.9 Å²	148.9	69%	0.694	78%	0.783	S	S	*	*			trans	-36.8	150.3	176	-107.8	-117.4	0	0	0	120.8
123	E	28.6	Very low	29.6	Very low	153 Å²	153	146.7 Å²	146.7	72%	0.715	78%	0.776	S	S	*	*			trans	46.2	120	135.9	-73.7	178.3	154.7	0	0	122.6
124	D	26.1	Very low	29.5	Very low	139 Å²	139	142.2 Å²	142.2	74%	0.743	77%	0.768	S	S	*	*				61.7	133.2	128.9	-80.7	23	0	0	0	124.3
125	L	23.8	Very low	29.3	Very low	150 Å²	150	139.3 Å²	139.3	79%	0.785	76%	0.756	S	S	*	*			trans	66.3	104.6	149.9	-65.7	166.7	0	0	0	119.8
126	I	27.2	Very low	29.2	Very low	159 Å²	159	146.2 Å²	146.2	82%	0.815	76%	0.761	S	S	*	*			trans	-160.6	110.3	132.1	-100	146.2	0	0	0	107
127	K	27.4	Very low	29.2	Very low	185 Å²	185	145.4 Å²	145.4	80%	0.804	76%	0.757	S	S	*	*				58.1	108.3	81.8	-76.9	-170.9	175.2	-175.3	0	114.7
128	A	28	Very low	29.2	Very low	94 Å²	94	147.8 Å²	147.8	78%	0.777	77%	0.767	S	S	*	*			trans	-154.5	137.7	147.2	0	0	0	0	0	110.9
129	K	28.8	Very low	29.4	Very low	218 Å²	218	144.9 Å²	144.9	95%	0.948	76%	0.759	S	S	*	*	S	Bend	trans	67	103.1	178.5	-55.4	178.5	-178.1	178.5	0	113.7
130	S	32	Very low	29.7	Very low	106 Å²	106	145 Å²	145	74%	0.741	76%	0.76	S	S	*	*	S	Bend	cis	-125.9	155.6	9.8	55.3	0	0	0	0	113.7
131	T	30.4	Very low	29.8	Very low	110 Å²	110	146.5 Å²	146.5	68%	0.675	76%	0.756	S	S	*	*			trans	-10.2	128.3	151.9	72.9	0	0	0	0	114.6
132	E	31.9	Very low	30	Very low	154 Å²	154	144.1 Å²	144.1	72%	0.72	75%	0.745	S	S	*	*				-155.5	-177.7	55.5	-116.4	63	-124.9	0	0	110.3
133	E	31.5	Very low	30.2	Very low	166 Å²	166	144.1 Å²	144.1	78%	0.776	75%	0.745	S	S	*	*			cis	-150.5	-128.2	-14.3	-163	-148	-126.8	0	0	110.1
134	L	29.4	Very low	30.3	Very low	130 Å²	130	141.1 Å²	141.1	68%	0.681	74%	0.737	S	S	*	*			trans	-133.2	127.9	-156.1	-76.5	166.4	0	0	0	119.3
135	T	30.6	Very low	30.5	Very low	94 Å²	94	143.3 Å²	143.3	58%	0.577	74%	0.74	S	S	*	*			trans	84.5	130.3	133.6	61.1	0	0	0	0	126.4
136	R	31.2	Very low	31	Very low	209 Å²	209	144.2 Å²	144.2	79%	0.789	74%	0.744	S	S	*	*			trans	87.2	174.5	164.3	-55.9	170.1	-163.8	76.6	5.5	117.8
137	N	30.3	Very low	31.2	Very low	149 Å²	149	142.8 Å²	142.8	80%	0.797	74%	0.738	S	S	*	*				-145.9	-177	-79.1	-79.1	-13.9	0	0	0	107.8
138	V	34	Very low	31.4	Very low	146 Å²	146	139.9 Å²	139.9	89%	0.885	73%	0.731	S	S	*	*			cis	-148.7	-173.2	11.3	-156.2	0	0	0	0	109.1
139	S	31.4	Very low	31.4	Very low	95 Å²	95	144 Å²	144	66%	0.664	73%	0.732	S	S	*	*			trans	-87.6	-176.7	175.6	-153.9	0	0	0	0	114.1
140	I	35.8	Very low	31.6	Very low	151 Å²	151	139.4 Å²	139.4	77%	0.774	72%	0.722	S	S	*	*				-167	141.9	61.8	-77.4	178.5	0	0	0	106.8
141	K	29.9	Very low	31.6	Very low	158 Å²	158	143.4 Å²	143.4	69%	0.687	73%	0.726	S	S	*	*				68.1	152.6	68.1	-82.1	-173.3	146.1	-71.7	0	115.3
142	D	34.3	Very low	31.5	Very low	110 Å²	110	142.7 Å²	142.7	59%	0.588	73%	0.726	S	S	*	*			cis	-152.9	167	-7.3	-93.9	-29.7	0	0	0	107.9
143	E	31	Very low	31.3	Very low	151 Å²	151	141.4 Å²	141.4	71%	0.706	73%	0.728	S	S	*	*			cis	89.5	128.7	27.8	-68.8	-65.8	112.9	0	0	116.5
144	T	32.2	Very low	31.2	Very low	90 Å²	90	141.8 Å²	141.8	55%	0.552	73%	0.73	S	S	*	*			cis	-168	168.3	-16.9	6.3	0	0	0	0	115
145	K	30.1	Very low	31.3	Very low	185 Å²	185	143.2 Å²	143.2	80%	0.804	74%	0.738	S	S	*	*			trans	83.4	165.1	147.8	-75.6	157	-175.4	164.9	0	123.7
146	I	34.6	Very low	31	Very low	169 Å²	169	143.7 Å²	143.7	87%	0.867	73%	0.732	S	S	*	*			trans	107.4	148.6	164.1	-61.4	167	0	0	0	116.4
147	N	31.5	Very low	30.9	Very low	129 Å²	129	138.9 Å²	138.9	69%	0.69	73%	0.73	S	S	*	*				-163.7	148.6	-55.7	-159.8	3.4	0	0	0	111.7
148	N	30.3	Very low	31.1	Very low	123 Å²	123	140.1 Å²	140.1	66%	0.658	74%	0.736	S	S	*	*			trans	60.3	128.2	153.3	-86.5	-35.2	0	0	0	125.6
149	K	28.1	Very low	30.8	Very low	182 Å²	182	137.9 Å²	137.9	79%	0.791	73%	0.726	S	S	*	*			trans	88.2	142.6	132.2	-79.1	-176	176.4	179.6	0	124.9
150	T	32.9	Very low	30.6	Very low	120 Å²	120	143 Å²	143	74%	0.736	74%	0.737	S	S	*	*			trans	86	132.6	146.9	21.7	0	0	0	0	123.1
151	K	32.8	Very low	30.1	Very low	190 Å²	190	142.8 Å²	142.8	83%	0.826	73%	0.733	S	S	*	*			trans	60.9	117.2	159.1	-61	174.7	-177.4	178.4	0	116.9
152	S	27.5	Very low	30	Very low	96 Å²	96	145.2 Å²	145.2	67%	0.671	74%	0.744	S	S	*	*			cis	105.1	126.4	24.1	73.5	0	0	0	0	114.2
153	T	27.1	Very low	29.5	Very low	127 Å²	127	143.8 Å²	143.8	78%	0.779	74%	0.742	S	S	*	*			trans	71.4	146.6	167	66.8	0	0	0	0	118.9
154	Q	30.1	Very low	29.3	Very low	173 Å²	173	143.8 Å²	143.8	81%	0.808	75%	0.747	S	S	*	*			trans	71.1	128.5	177.3	-52.8	-169.3	20.9	0	0	114.5
155	L	31.2	Very low	29.1	Very low	161 Å²	161	148.1 Å²	148.1	84%	0.843	76%	0.761	S	S	*	*			cis	-132	168.2	3.7	-97.9	132	0	0	0	112.6
156	K	25.9	Very low	28.9	Very low	104 Å²	104	150 Å²	150	45%	0.452	76%	0.764	S	S	.	*			trans	-88.7	172.2	178.8	-70.9	175.5	171.1	176.6	0	112.4	P590 N591	K156-P590 PolarHBondContact NZ-O 3.27Å; K156-N591 PolarHBondContact NZ-O 2.76Å
157	S	28.8	Very low	28.5	Very low	108 Å²	108	145.9 Å²	145.9	76%	0.755	75%	0.75	S	S	*	*			trans	77.5	141	170.7	80.6	0	0	0	0	115.1
158	L	34	Very low	28.4	Very low	175 Å²	175	148.3 Å²	148.3	92%	0.916	76%	0.761	S	S	*	*			cis	-105.3	143.7	-1.5	-64.9	96.2	0	0	0	111.8
159	S	28	Very low	28.2	Very low	98 Å²	98	152.2 Å²	152.2	69%	0.685	77%	0.767	S	S	*	*			trans	-150.6	133.3	-177.2	61.9	0	0	0	0	112.1
160	F	26	Very low	28.2	Very low	204 Å²	204	149.7 Å²	149.7	90%	0.895	76%	0.762	S	S	*	*			trans	53	114.4	168.7	-72.7	-89.8	0	0	0	118.7
161	Q	24.8	Very low	28.1	Very low	145 Å²	145	148.9 Å²	148.9	68%	0.678	76%	0.761	S	S	*	*				-175.3	125	114.1	-103.4	178.3	-2.9	0	0	112	N600	Q161-N600 PolarHBondContact OE1-ND2 2.91Å
162	K	27.9	Very low	27.9	Very low	210 Å²	210	145 Å²	145	91%	0.913	75%	0.749	S	S	*	*			trans	-166.4	80.7	138.8	-113.8	-175.9	-179.5	-170.3	0	110.8
163	S	25.7	Very low	27.9	Very low	80 Å²	80	146 Å²	146	56%	0.559	75%	0.747	S	S	*	*			trans	-74.7	164.5	155.2	45	0	0	0	0	110.3
164	D	25.1	Very low	28.1	Very low	151 Å²	151	147.3 Å²	147.3	81%	0.807	75%	0.748	S	S	*	*			trans	35.4	119.7	152	-47.5	-27	0	0	0	120.2
165	E	28	Very low	28	Very low	180 Å²	180	145.4 Å²	145.4	84%	0.841	74%	0.743	S	S	*	*			trans	-153.2	163.9	132.4	-130.5	168.1	-163.3	0	0	112.9
166	Y	27.4	Very low	27.9	Very low	224 Å²	224	145.3 Å²	145.3	88%	0.878	74%	0.743	S	S	*	*			trans	-96.1	179.9	-170.4	-113.1	-109.3	0	0	0	113.1
167	C	25.4	Very low	27.9	Very low	84 Å²	84	147.2 Å²	147.2	57%	0.568	75%	0.753	S	S	*	*			trans	-58.5	142.6	175	-51.7	0	0	0	0	113.6
168	I	28.8	Very low	27.7	Very low	180 Å²	180	148.4 Å²	148.4	92%	0.923	75%	0.751	S	S	*	*			trans	-155.2	-174.4	137.2	-104.8	153.7	0	0	0	108.8
169	R	27	Very low	27.6	Very low	204 Å²	204	147.5 Å²	147.5	77%	0.77	75%	0.746	S	S	*	*			trans	-123.9	155.7	-138.5	-115.5	174.3	162.2	169.2	-10.7	115.6
170	D	28.2	Very low	27.5	Very low	129 Å²	129	150.3 Å²	150.3	69%	0.69	75%	0.749	S	S	*	*			trans	71.7	159.3	143.4	-58.8	-28.3	0	0	0	122
171	S	30.7	Very low	27.6	Very low	103 Å²	103	149.1 Å²	149.1	72%	0.72	74%	0.743	S	S	*	*			trans	77.9	77.7	165.4	-61.1	0	0	0	0	120.8
172	N	28.2	Very low	27.9	Very low	109 Å²	109	152 Å²	152	58%	0.583	75%	0.754	S	S	*	*				21.3	156.6	129.9	-58.7	-50.6	0	0	0	123.9	F865	N172-F865 HydrophobicContact CB-CD1 3.91Å; N172-F865 HydrophobicContact CB-CD2 3.97Å; N172-F865 HydrophobicContact CB-CE1 3.96Å; N172-F865 HydrophobicContact CB-CE2 4.01Å; N172-F865 HydrophobicContact CB-CG 3.92Å; N172-F865 HydrophobicContact CB-CZ 4.01Å; N172-F865 WeakPolarHBondContact ND2-CB 3.3Å; N172-F865 WeakPolarHBondContact ND2-CG 3.45Å
173	D	28.5	Very low	27.9	Very low	117 Å²	117	146.8 Å²	146.8	63%	0.626	74%	0.743	S	S	*	*			trans	66.4	110.1	154.3	-81.8	34.4	0	0	0	120	F865	D173-F865 HydrophobicContact CB-CE1 4.14Å; D173-F865 HydrophobicContact CB-CZ 3.73Å; D173-F865 VanDerWaalsContact CG-CZ 3.48Å; D173-F865 WeakPolarHBondContact OD2-CE1 3.35Å
174	I	29.8	Very low	27.8	Very low	155 Å²	155	152.6 Å²	152.6	80%	0.795	75%	0.754	S	S	*	*				-162.6	142.9	94.6	-98.4	163.6	0	0	0	111.9
175	L	27.9	Very low	28	Very low	133 Å²	133	153.5 Å²	153.5	70%	0.696	75%	0.751	S	S	*	*			trans	60.4	95.8	164.5	-113.8	53	0	0	0	121	Q177	L175-Q177 PolarHBondContact O-N 2.95Å
176	N	29.2	Very low	27.9	Very low	159 Å²	159	153.6 Å²	153.6	85%	0.85	75%	0.754	S	S	*	*				-49.1	122.8	127.9	-92.2	-59.1	0	0	0	110.5
177	Q	26.6	Very low	27.8	Very low	144 Å²	144	148 Å²	148	67%	0.673	74%	0.743	S	S	*	*			trans	-168.4	135.4	140.2	-107.8	156.5	100.2	0	0	114.4	L175	L175-Q177 PolarHBondContact O-N 2.95Å
178	L	25	Very low	27.8	Very low	133 Å²	133	150.3 Å²	150.3	70%	0.696	75%	0.75	S	S	*	*			trans	53.1	99.1	146.9	-58.9	164.9	0	0	0	118.6
179	N	31.1	Very low	27.7	Very low	155 Å²	155	150.3 Å²	150.3	83%	0.829	74%	0.743	S	S	*	*				-173.7	150.5	83.2	-98.1	-56.8	0	0	0	116.2
180	Q	27.3	Very low	27.7	Very low	157 Å²	157	147.3 Å²	147.3	73%	0.734	74%	0.741	S	S	*	*			trans	-95.9	172.6	175.4	-54.6	171.1	-7.3	0	0	111.3
181	K	26.2	Very low	27.4	Very low	180 Å²	180	145.8 Å²	145.8	78%	0.783	74%	0.741	S	S	*	*			trans	73.5	107.9	158.4	-57.9	170.3	-175.6	173.4	0	119
182	K	32.4	Very low	27.3	Very low	206 Å²	206	148 Å²	148	90%	0.896	74%	0.744	S	S	*	*			trans	164.1	117.1	140	-91.7	157.7	-176.2	179.5	0	107.1
183	S	27	Very low	27.1	Very low	99 Å²	99	147.6 Å²	147.6	69%	0.692	75%	0.75	S	S	*	*			cis	83.6	104.3	10.9	-134.1	0	0	0	0	117
184	Y	25.1	Very low	27.2	Very low	202 Å²	202	151.2 Å²	151.2	79%	0.792	76%	0.763	S	S	*	*			trans	72.5	119.2	157.3	-70.3	-70	0	0	0	124
185	K	28	Very low	26.9	Very low	170 Å²	170	149.8 Å²	149.8	74%	0.739	76%	0.761	S	S	*	*				44.1	128.4	129.1	-73	177.1	-179.7	-179.4	0	122.2	V187	K185-V187 HydrophobicContact CB-CG2 4.32Å
186	M	26.2	Very low	27	Very low	183 Å²	183	154.9 Å²	154.9	90%	0.901	77%	0.771	S	S	*	*				-132	145.6	119.9	-69	-171.3	-177.3	0	0	108.2
187	V	24.8	Very low	26.8	Very low	107 Å²	107	154.4 Å²	154.4	65%	0.648	77%	0.769	S	S	*	*			cis	98.5	143	16.5	-178.9	0	0	0	0	114.1	K185	K185-V187 HydrophobicContact CB-CG2 4.32Å
188	N	26	Very low	27	Very low	132 Å²	132	154.4 Å²	154.4	71%	0.706	78%	0.779	S	S	*	*			trans	80.8	144.1	-167.3	-54.1	-54.1	0	0	0	114
189	K	26.1	Very low	27	Very low	179 Å²	179	156 Å²	156	78%	0.778	78%	0.783	S	S	*	*			cis	-163.6	159.6	-12.8	-105.4	175.3	-178	-177.9	0	105.3
190	L	26.9	Very low	26.9	Very low	141 Å²	141	158.5 Å²	158.5	74%	0.738	78%	0.782	S	S	*	*			cis	-115.5	175.7	-5.7	-73.2	93.7	0	0	0	108.6
191	S	23.5	Very low	27	Very low	97 Å²	97	159.2 Å²	159.2	68%	0.678	78%	0.783	S	S	*	*			cis	89.5	48.1	9.4	86.5	0	0	0	0	119.9
192	L	27.7	Very low	27.1	Very low	151 Å²	151	157.2 Å²	157.2	79%	0.791	78%	0.779	S	S	*	*			trans	-144.7	118.2	149.2	-89.7	129.5	0	0	0	105.6
193	S	24.2	Very low	26.9	Very low	100 Å²	100	155.8 Å²	155.8	70%	0.699	78%	0.775	S	S	*	*			cis	72.9	83.3	45.9	82.2	0	0	0	0	114.5
194	E	29.3	Very low	26.9	Very low	193 Å²	193	157 Å²	157	90%	0.902	77%	0.773	S	S	*	*			trans	-153.7	142.1	146.7	-125.7	166.8	-135.8	0	0	111.1
195	T	25.1	Very low	27	Very low	125 Å²	125	152.8 Å²	152.8	77%	0.767	77%	0.773	S	S	*	*			trans	-111.3	145	-177	45.9	0	0	0	0	110.5
196	R	28.5	Very low	26.9	Very low	239 Å²	239	149.8 Å²	149.8	90%	0.902	77%	0.769	S	S	*	*			trans	-167.9	135.1	145.2	-105	143.4	-173	165	3.2	111.2
197	N	24.9	Very low	27.2	Very low	149 Å²	149	148.5 Å²	148.5	80%	0.797	77%	0.766	S	S	*	*			trans	-89.1	148.8	172.7	-64.1	-16.3	0	0	0	109.8
198	T	31.1	Very low	27.5	Very low	145 Å²	145	147.8 Å²	147.8	89%	0.89	77%	0.765	S	S	*	*			trans	-139.7	91.8	157.2	52.1	0	0	0	0	109.7
199	E	25.5	Very low	27.7	Very low	166 Å²	166	146.8 Å²	146.8	78%	0.776	76%	0.764	S	S	*	*			trans	-92.9	144.1	161	-61	-179.8	119.9	0	0	109.6
200	Y	29.3	Very low	27.8	Very low	207 Å²	207	145.2 Å²	145.2	81%	0.812	76%	0.764	S	S	*	*			trans	-139.4	125.4	151.2	-94.5	-93.3	0	0	0	107.3
201	K	29.7	Very low	28	Very low	172 Å²	172	143.8 Å²	143.8	75%	0.748	77%	0.766	S	S	*	*				66.2	137.6	60.2	-72.1	179.3	172.1	-179.5	0	112.4
202	I	28.6	Very low	28.1	Very low	138 Å²	138	148.3 Å²	148.3	71%	0.708	77%	0.773	S	S	*	*			cis	-125.7	154.1	2.5	-26.5	168.5	0	0	0	108
203	H	27.7	Very low	28	Very low	177 Å²	177	148 Å²	148	82%	0.819	77%	0.772	S	S	*	*				-153.5	139.9	79.5	-106.1	-85.6	0	0	0	112.7
204	I	25.7	Very low	28.1	Very low	125 Å²	125	149.8 Å²	149.8	64%	0.641	77%	0.772	S	S	*	*			trans	-137.4	141.9	179.8	-66.6	173.3	0	0	0	108.7	T206	I204-T206 HydrophobicContact CG2-CG2 3.66Å
205	S	28.6	Very low	28	Very low	112 Å²	112	146.5 Å²	146.5	78%	0.783	76%	0.761	S	S	*	*			trans	-152.3	95.1	154.3	-47	0	0	0	0	104.5
206	T	26.3	Very low	28.3	Very low	107 Å²	107	147.6 Å²	147.6	66%	0.656	76%	0.757	S	S	*	*				35	97.4	69.8	56.9	0	0	0	0	112.8	I204	I204-T206 HydrophobicContact CG2-CG2 3.66Å
207	D	30.6	Very low	28.2	Very low	157 Å²	157	140.1 Å²	140.1	84%	0.84	74%	0.741	S	S	*	*				-168.2	159.8	110	-79	-22.4	0	0	0	107.5
208	S	32	Very low	28.6	Very low	91 Å²	91	138.8 Å²	138.8	64%	0.636	73%	0.734	S	S	*	*			cis	-165	144.7	-27	53.7	0	0	0	0	108.2
209	T	30.8	Very low	28.4	Very low	112 Å²	112	137.7 Å²	137.7	69%	0.687	72%	0.723	S	S	*	*			trans	41.8	113.2	147.6	58.8	0	0	0	0	122.1
210	D	28.3	Very low	28.6	Very low	146 Å²	146	137.2 Å²	137.2	78%	0.781	73%	0.726	S	S	*	*				67.1	167.8	121.9	-61.7	-63	0	0	0	123.5
211	S	30.7	Very low	28.6	Very low	110 Å²	110	131.8 Å²	131.8	77%	0.769	72%	0.718	S	S	*	*			trans	57.2	107.3	178.5	40.2	0	0	0	0	116.2
212	K	26.5	Very low	28.5	Very low	192 Å²	192	127.9 Å²	127.9	84%	0.835	71%	0.712	S	S	*	*				49.7	122.6	67.5	-80.3	-171.3	176.6	177.3	0	115.2
213	L	24.9	Very low	28.3	Very low	145 Å²	145	128.3 Å²	128.3	76%	0.759	72%	0.715	S	S	*	*			trans	81.4	122.3	146.3	-65.4	166.8	0	0	0	119.4
214	I	26.4	Very low	28.2	Very low	137 Å²	137	126.4 Å²	126.4	70%	0.703	71%	0.71	S	S	*	*				91.4	130.5	128.2	-75.2	172.8	0	0	0	119.3
215	N	27.7	Very low	28.4	Very low	124 Å²	124	126.5 Å²	126.5	66%	0.663	71%	0.708	S	S	*	*			trans	85	136.6	153.7	-82.8	1.3	0	0	0	123.1
216	H	31.1	Very low	28.3	Very low	148 Å²	148	128.2 Å²	128.2	69%	0.685	70%	0.701	S	S	*	*			trans	55.1	129	158.6	-58.7	-57.5	0	0	0	117.4
217	S	27	Very low	28.3	Very low	82 Å²	82	129.4 Å²	129.4	57%	0.573	71%	0.708	S	S	*	*			cis	64.5	135.8	45.8	99.2	0	0	0	0	111.2
218	D	31.3	Very low	28.1	Very low	122 Å²	122	126 Å²	126	65%	0.652	70%	0.697	S	S	*	*			cis	-142.1	165.1	19.6	-96.4	-69.1	0	0	0	114.2
219	N	28.8	Very low	27.9	Very low	122 Å²	122	128.4 Å²	128.4	65%	0.652	70%	0.703	S	S	*	*			trans	24.1	150.6	142.7	-50.6	-44.6	0	0	0	122.4
220	N	28.4	Very low	27.8	Very low	156 Å²	156	129.9 Å²	129.9	83%	0.834	71%	0.706	S	S	*	*			trans	73.6	150.5	152.4	-63.2	-26	0	0	0	117.2
221	S	28.9	Very low	27.7	Very low	92 Å²	92	126 Å²	126	64%	0.643	69%	0.691	S	S	*	*			cis	-163.4	-169.2	-21	59	0	0	0	0	110.1
222	S	28.3	Very low	27.6	Very low	90 Å²	90	130.1 Å²	130.1	63%	0.629	69%	0.691	S	S	*	*			trans	46.5	104.4	146.5	58.9	0	0	0	0	120.9
223	L	25	Very low	27.9	Very low	148 Å²	148	128.5 Å²	128.5	78%	0.775	69%	0.686	S	S	*	*				51.5	132.7	108.5	-93	77.4	0	0	0	121.1
224	L	25.5	Very low	27.9	Very low	137 Å²	137	128.8 Å²	128.8	72%	0.717	69%	0.687	S	S	*	*			trans	71.9	160.4	152.5	-52.2	162.4	0	0	0	114.6
225	H	29	Very low	28.1	Very low	127 Å²	127	125.9 Å²	125.9	59%	0.588	68%	0.684	S	S	*	*			cis	-145.9	154.8	-10.4	-132.8	0.9	0	0	0	111.5
226	K	26.9	Very low	28.2	Very low	148 Å²	148	127.2 Å²	127.2	64%	0.643	69%	0.691	S	S	*	*			trans	28.5	145.9	144.6	-69.2	167.9	179.2	154	0	122.2
227	T	26.1	Very low	28.4	Very low	131 Å²	131	126 Å²	126	80%	0.804	70%	0.699	S	S	*	*			trans	69.7	148.4	142	46.5	0	0	0	0	118.8
228	S	27	Very low	28.5	Very low	86 Å²	86	130 Å²	130	60%	0.601	71%	0.714	S	S	*	*			cis	-169	143.9	-10	43.2	0	0	0	0	114.6
229	N	26.6	Very low	28.5	Very low	142 Å²	142	127.8 Å²	127.8	76%	0.759	72%	0.72	S	S	*	*			trans	70.4	154.6	134.8	-64.9	0.9	0	0	0	123.1
230	N	29.5	Very low	28.6	Very low	142 Å²	142	129.1 Å²	129.1	76%	0.759	72%	0.722	S	S	*	*			trans	72.8	150.1	153.2	-66.3	-4.1	0	0	0	119.3
231	S	26.1	Very low	29	Very low	65 Å²	65	129.7 Å²	129.7	46%	0.455	72%	0.717	S	S	.	*			cis	-174.8	-170.9	-35.7	45.5	0	0	0	0	109.1
232	Y	28.3	Very low	29	Very low	197 Å²	197	133.4 Å²	133.4	77%	0.773	73%	0.726	S	S	*	*			trans	71.9	152.9	172	-33	-71.4	0	0	0	115
233	H	32.8	Very low	29.4	Very low	158 Å²	158	138.5 Å²	138.5	73%	0.731	74%	0.737	S	S	*	*			cis	-123	145	-6.5	-94.9	-89.5	0	0	0	108.8
234	L	26.1	Very low	29.6	Very low	151 Å²	151	136.1 Å²	136.1	79%	0.791	73%	0.733	S	S	*	*				60.4	145.6	84.8	-94.6	76.6	0	0	0	115.5
235	A	30.1	Very low	30	Very low	76 Å²	76	135 Å²	135	63%	0.628	73%	0.727	S	S	*	*			cis	-147.6	155.1	15.6	0	0	0	0	0	114.7
236	N	29.3	Very low	30.1	Very low	152 Å²	152	136.6 Å²	136.6	81%	0.813	73%	0.733	S	S	*	*				177.2	137	125.4	-95.5	-16.4	0	0	0	113.7
237	S	35.1	Very low	30.2	Very low	122 Å²	122	134.2 Å²	134.2	85%	0.853	74%	0.735	S	S	*	*			trans	64.8	152.6	165.8	64.6	0	0	0	0	119.9
238	N	29.8	Very low	30.4	Very low	166 Å²	166	133.7 Å²	133.7	89%	0.888	73%	0.732	S	S	*	*			trans	-100	138.3	-172.3	-63.3	-27.6	0	0	0	113.1
239	G	30.2	Very low	30.6	Very low	75 Å²	75	138.8 Å²	138.8	77%	0.773	74%	0.743	S	S	*	*			trans	74	149.2	160.1	0	0	0	0	0	117.2
240	E	32.5	Very low	30.6	Very low	151 Å²	151	143.1 Å²	143.1	71%	0.706	75%	0.749	S	S	*	*			cis	-154.3	167	-9.1	-81.4	-160.8	109.4	0	0	110.3
241	K	35.5	Very low	30.4	Very low	168 Å²	168	145.3 Å²	145.3	73%	0.73	75%	0.751	S	S	*	*			trans	56.7	86.1	158.1	-67	145.3	-175.3	158.7	0	115.8
242	M	29.7	Very low	30.6	Very low	169 Å²	169	146.6 Å²	146.6	83%	0.833	76%	0.761	S	S	*	*			cis	72.5	111.1	42.9	-71.9	-155.2	74.8	0	0	119
243	K	36	Very low	30.5	Very low	197 Å²	197	148.5 Å²	148.5	86%	0.857	77%	0.768	S	S	*	*			trans	164	102.5	137.1	-90.3	163.7	-176.2	177.8	0	107.9
244	S	29.9	Very low	30.2	Very low	98 Å²	98	149 Å²	149	69%	0.685	78%	0.775	S	S	*	*				57.5	143	68.5	80.4	0	0	0	0	113.3
245	D	32.7	Very low	30.2	Very low	113 Å²	113	150.1 Å²	150.1	60%	0.604	77%	0.774	S	S	*	*			cis	-167.9	171.1	27.1	-161.3	2.7	0	0	0	113.5
246	K	32.4	Very low	30	Very low	161 Å²	161	154.2 Å²	154.2	70%	0.7	78%	0.78	S	S	*	*			trans	59.6	129.7	164.7	-69	133.6	-179.2	145.6	0	118.7
247	S	28.8	Very low	29.8	Very low	99 Å²	99	154.7 Å²	154.7	69%	0.692	78%	0.782	S	S	*	*			cis	89.3	156.1	33.2	86.3	0	0	0	0	116.5
248	T	30	Very low	29.3	Very low	120 Å²	120	155 Å²	155	74%	0.736	78%	0.779	S	S	*	*			trans	89.5	146.9	162.8	-20.5	0	0	0	0	119.2
249	K	31.8	Very low	29.1	Very low	192 Å²	192	152.4 Å²	152.4	84%	0.835	77%	0.77	S	S	*	*			trans	71.5	114.2	172.5	-57.6	171.3	-174	170.4	0	114.2
250	R	25.6	Very low	28.8	Very low	233 Å²	233	155.9 Å²	155.9	88%	0.879	77%	0.77	S	S	*	*			cis	66	122.8	23.2	-155	-175.1	-174.9	-174.4	3.8	114.2
251	K	26.6	Very low	28.8	Very low	188 Å²	188	152.4 Å²	152.4	82%	0.817	76%	0.756	S	S	*	*			trans	106	137.5	166.9	-61.2	-177.3	178.2	-177	0	117.7
252	S	29.3	Very low	28.6	Very low	93 Å²	93	148.3 Å²	148.3	65%	0.65	75%	0.746	S	S	*	*			trans	52.4	115.1	148.6	58.2	0	0	0	0	121.1
253	Y	26.4	Very low	28.3	Very low	237 Å²	237	145.7 Å²	145.7	93%	0.929	74%	0.735	S	S	*	*				-144.1	69.1	109.1	-93.2	-66.9	0	0	0	111.6
254	L	26	Very low	27.9	Very low	168 Å²	168	140.9 Å²	140.9	88%	0.88	72%	0.723	S	S	*	*			trans	-111.1	90.7	157.1	-176.7	72.6	0	0	0	108.6
255	K	27.4	Very low	27.6	Very low	175 Å²	175	144.2 Å²	144.2	76%	0.761	73%	0.732	S	S	*	*			trans	-154.1	111.6	155.7	-98.8	-173.3	174.9	-175.8	0	104.9
256	Q	24.6	Very low	27.3	Very low	162 Å²	162	149.8 Å²	149.8	76%	0.757	74%	0.744	S	S	*	*				50	92.7	87.8	-69.9	-176.9	-21.9	0	0	111.8
257	N	24.7	Very low	27.1	Very low	161 Å²	161	145.9 Å²	145.9	86%	0.861	74%	0.742	S	S	*	*			trans	-141.1	84.7	139.8	-118.5	-5.4	0	0	0	108.6	T259	N257-T259 PolarHBondContact O-N 3.04Å
258	T	24.7	Very low	27	Very low	129 Å²	129	147.2 Å²	147.2	79%	0.791	75%	0.746	S	S	*	*			trans	-69.5	116.4	166.2	40.1	0	0	0	0	109.4
259	T	25.7	Very low	26.8	Very low	112 Å²	112	147.1 Å²	147.1	69%	0.687	74%	0.741	S	S	*	*			trans	-163.6	131.1	152.7	5.6	0	0	0	0	112.1	N257	N257-T259 PolarHBondContact O-N 3.04Å
260	L	25.6	Very low	26.6	Very low	148 Å²	148	148.1 Å²	148.1	78%	0.775	75%	0.746	S	S	*	*				20	117.8	126.2	-49.9	178.6	0	0	0	115.4
261	L	31.9	Very low	26.8	Very low	78 Å²	78	142.4 Å²	142.4	41%	0.408	74%	0.736	S	S	.	*				48.9	101.9	62.2	-144.4	169.2	0	0	0	109	K895	L261-K895 HydrophobicContact CD1-CD 3.7Å; L261-K895 HydrophobicContact CD1-CG 4.31Å; L261-K895 HydrophobicContact CG-CD 3.78Å; L261-K895 HydrophobicContact CG-CG 4.18Å
262	P	30	Very low	26.9	Very low	82 Å²	82	139.6 Å²	139.6	53%	0.532	73%	0.729	S	S	.	*				-154.9	-172.5	62.3	44.8	-25.3	0	0	0	117
263	N	25.3	Very low	27	Very low	113 Å²	113	141 Å²	141	60%	0.604	74%	0.736	S	S	*	*			trans	63.6	168.7	150	-63.4	-13.4	0	0	0	118.9
264	V	26.2	Very low	27.3	Very low	97 Å²	97	135.7 Å²	135.7	59%	0.588	73%	0.729	S	S	*	*			cis	-142.6	131.8	-43.6	133.2	0	0	0	0	105.2	R266	V264-R266 HydrophobicContact CG1-CB 4.47Å
265	L	24.5	Very low	27.4	Very low	167 Å²	167	136.8 Å²	136.8	87%	0.874	73%	0.729	S	S	*	*			trans	-97.8	96.7	171.8	-83.4	174.6	0	0	0	111
266	R	26.3	Very low	27.7	Very low	230 Å²	230	133.7 Å²	133.7	87%	0.868	73%	0.73	S	S	*	*			trans	-135.4	148.7	154.8	-91	-163.8	-176.7	-172.7	2.8	106.2	V264	V264-R266 HydrophobicContact CG1-CB 4.47Å
267	A	27.6	Very low	28.2	Very low	79 Å²	79	131.1 Å²	131.1	65%	0.653	74%	0.736	S	S	*	*			cis	-156	-148.5	-12.7	0	0	0	0	0	106.2
268	V	27	Very low	28.7	Very low	127 Å²	127	127 Å²	127	77%	0.77	73%	0.731	S	S	*	*			trans	70.1	125.7	160	-165.6	0	0	0	0	115.5
269	D	26.4	Very low	29.5	Very low	119 Å²	119	124.9 Å²	124.9	64%	0.636	72%	0.72	S	S	*	*			cis	-153.9	165.6	-28.2	-105.4	-20.8	0	0	0	107.4
270	F	26.8	Very low	29.8	Very low	213 Å²	213	124.7 Å²	124.7	93%	0.934	72%	0.723	S	S	*	*			trans	-148	102.6	144.2	-123	-78.1	0	0	0	108.8
271	V	30.7	Very low	30.4	Very low	112 Å²	112	125.1 Å²	125.1	68%	0.679	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-67.8	147.7	-177.8	176.5	0	0	0	0	109.6
272	L	28.9	Very low	30.4	Very low	130 Å²	130	127.9 Å²	127.9	68%	0.681	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-70.5	140.3	173.7	-67.8	165.3	0	0	0	109.6	T274	L272-T274 PolarHBondContact O-N 3.14Å; L272-T274 VanDerWaalsContact O-N 3.17Å
273	P	29.6	Very low	30.7	Very low	122 Å²	122	129.9 Å²	129.9	79%	0.792	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-64.4	118.7	168.9	27.9	-32.6	0	0	0	109.2
274	T	32.9	Very low	31.3	Very low	126 Å²	126	131.3 Å²	131.3	77%	0.773	74%	0.744	S	S	*	*			trans	-108.5	102.7	171.2	50.4	0	0	0	0	108.5	L272	L272-T274 PolarHBondContact O-N 3.14Å; L272-T274 VanDerWaalsContact O-N 3.17Å
275	E	28.9	Very low	31.6	Very low	190 Å²	190	130.4 Å²	130.4	89%	0.888	75%	0.754	S	S	*	*			trans	-86	120.7	175.4	-63.5	176.8	147.1	0	0	110.2
276	S	33.1	Very low	32.1	Very low	110 Å²	110	127.6 Å²	127.6	77%	0.769	75%	0.748	S	S	*	*			trans	-165.9	108.2	162	59	0	0	0	0	112.8
277	A	35.8	Very low	32.3	Very low	108 Å²	108	124 Å²	124	89%	0.893	74%	0.744	S	S	*	*			trans	54.9	137.9	156.6	0	0	0	0	0	121.6
278	G	34.9	Very low	32.6	Very low	74 Å²	74	128 Å²	128	76%	0.763	75%	0.753	S	S	*	*			trans	-101.6	-136.2	165.9	0	0	0	0	0	111.6
279	P	41	Very low	32.9	Very low	85 Å²	85	130.2 Å²	130.2	55%	0.552	76%	0.755	S	S	*	*			cis	-137.1	-148.9	6.5	43.9	-24.2	0	0	0	113.7
280	S	33.2	Very low	33.4	Very low	108 Å²	108	129.5 Å²	129.5	76%	0.755	76%	0.757	S	S	*	*			trans	84.1	141.6	178.7	78	0	0	0	0	115.6
281	K	36.7	Very low	33.7	Very low	157 Å²	157	125.9 Å²	125.9	68%	0.683	75%	0.747	S	S	*	*			cis	-159.3	158.3	-2.2	-123.3	172.7	165.8	-79.8	0	109.7
282	E	32.9	Very low	33.8	Very low	136 Å²	136	129 Å²	129	64%	0.636	75%	0.751	S	S	*	*			trans	40.5	143.4	154.6	-75.1	115.4	-141.1	0	0	121.2
283	N	37.2	Very low	34	Very low	124 Å²	124	131 Å²	131	66%	0.663	76%	0.762	S	S	*	*			cis	-157.2	171.1	4.6	-116.7	19.9	0	0	0	112.1
284	D	36.4	Very low	33.9	Very low	144 Å²	144	135.1 Å²	135.1	77%	0.77	76%	0.761	S	S	*	*			trans	26.9	133.9	152.1	-43.7	-41.3	0	0	0	119.9
285	G	33.3	Very low	34.2	Very low	77 Å²	77	136.5 Å²	136.5	79%	0.794	76%	0.759	S	S	*	*			cis	135	159	40.1	0	0	0	0	0	106.8
286	S	34.3	Very low	34.5	Very low	108 Å²	108	133.7 Å²	133.7	76%	0.755	76%	0.755	S	S	*	*			cis	-157.8	157.2	0.7	56.9	0	0	0	0	110.7
287	I	30.7	Very low	34.5	Very low	155 Å²	155	132.3 Å²	132.3	80%	0.795	76%	0.758	S	S	*	*			trans	22	127.9	145.6	-34.4	160.8	0	0	0	117.7
288	I	33.7	Very low	34.2	Very low	163 Å²	163	139.4 Å²	139.4	84%	0.836	76%	0.762	S	S	*	*				-169.9	155	91.9	-85.5	169.2	0	0	0	112.4
289	H	32.8	Very low	34.1	Very low	174 Å²	174	139.6 Å²	139.6	81%	0.806	76%	0.764	S	S	*	*			trans	-78.1	160.2	-175.9	-109	-117.8	0	0	0	116.3
290	P	37.1	Very low	33.5	Very low	104 Å²	104	142.2 Å²	142.2	68%	0.675	78%	0.778	S	S	*	*			trans	-94.5	158.9	171.5	37.6	-34.7	0	0	0	113.6
291	N	33.7	Very low	33.7	Very low	136 Å²	136	146.9 Å²	146.9	73%	0.727	79%	0.785	S	S	*	*			trans	-163	152.9	152.9	-117.6	-48	0	0	0	116.2
292	K	32.7	Very low	33.4	Very low	178 Å²	178	145.6 Å²	145.6	77%	0.774	79%	0.79	S	S	*	*			trans	28.2	126.4	152.6	-67.4	155	-172.6	178.1	0	120.3
293	L	32.7	Very low	33.3	Very low	172 Å²	172	147.3 Å²	147.3	90%	0.901	80%	0.803	S	S	*	*				-155.2	152.7	104.3	-108.2	158.6	0	0	0	111.8
294	R	29.1	Very low	33.1	Very low	208 Å²	208	146.5 Å²	146.5	79%	0.785	81%	0.807	S	S	*	*			trans	-94.5	154.5	175.6	-68.6	170.6	172.6	168.2	-4.4	108.7
295	H	38.6	Very low	32.9	Very low	156 Å²	156	144.7 Å²	144.7	72%	0.722	81%	0.812	S	S	*	*				171.7	141.2	106.1	-96.1	-81	0	0	0	114.2
296	T	34.6	Very low	32.8	Very low	130 Å²	130	146.1 Å²	146.1	80%	0.798	81%	0.81	S	S	*	*			trans	1.6	131.3	153.1	51.3	0	0	0	0	120.6
297	G	32.3	Very low	32.7	Very low	82 Å²	82	152.8 Å²	152.8	85%	0.845	82%	0.818	S	S	*	*			trans	170.3	136.6	157.2	0	0	0	0	0	114.5
298	R	30.2	Very low	32.9	Very low	257 Å²	257	155 Å²	155	97%	0.97	82%	0.822	S	S	*	*			trans	-85.6	133.3	168.6	-69	174.9	177.3	156.7	-2.3	109.3
299	G	32.2	Very low	33.2	Very low	77 Å²	77	153 Å²	153	79%	0.794	82%	0.819	S	S	*	*			trans	-171.7	111.8	171.2	0	0	0	0	0	113.1
300	V	29.9	Very low	33.5	Very low	140 Å²	140	150.8 Å²	150.8	85%	0.848	82%	0.818	S	S	*	*			trans	-88.6	115.6	171.8	177.3	0	0	0	0	108.9
301	K	36.4	Very low	33.5	Very low	207 Å²	207	154.1 Å²	154.1	90%	0.9	83%	0.827	S	S	*	*			trans	-136.4	123.1	161.2	-75.4	-168.5	176	-179.1	0	110.3
302	T	30.5	Very low	33.8	Very low	129 Å²	129	151.3 Å²	151.3	79%	0.791	81%	0.812	S	S	*	*			trans	-92.9	109.1	178.6	46.6	0	0	0	0	111.4
303	L	31.2	Very low	34.3	Very low	173 Å²	173	145.1 Å²	145.1	91%	0.906	79%	0.791	S	S	*	*			trans	-152.5	145.7	163.3	-83	173.4	0	0	0	106.9
304	S	33.9	Very low	35.2	Very low	107 Å²	107	142.6 Å²	142.6	75%	0.748	78%	0.778	S	S	*	*			cis	-145.5	170.8	-8.1	60.9	0	0	0	0	109.7
305	A	31.1	Very low	36.1	Very low	106 Å²	106	139.2 Å²	139.2	88%	0.876	77%	0.771	S	S	*	*			trans	-91.1	113	-169.6	0	0	0	0	0	113.8
306	S	32.1	Very low	36.7	Very low	107 Å²	107	136 Å²	136	75%	0.748	76%	0.757	S	S	*	*			trans	-153.5	49.3	166.7	-171.1	0	0	0	0	114.6
307	W	31.7	Very low	37.4	Very low	248 Å²	248	134.8 Å²	134.8	94%	0.939	74%	0.74	S	S	*	*			trans	-124.5	82.6	171.9	-73.7	75.1	0	0	0	110.8	P309	W307-P309 WeakPolarHBondContact O-CD 3.45Å
308	K	35.1	Very low	38.3	Very low	201 Å²	201	139.1 Å²	139.1	87%	0.874	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-67.9	121.5	166	-76.7	179	-179.7	174.3	0	108.3	T310	K308-T310 PolarHBondContact O-N 3.01Å
309	P	39.7	Very low	39.4	Very low	120 Å²	120	136.5 Å²	136.5	78%	0.779	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-65.8	118.5	177.8	-19.5	32.4	0	0	0	110.1	W307 M311	W307-P309 WeakPolarHBondContact O-CD 3.45Å; P309-M311 PolarHBondContact O-N 3.1Å
310	T	39.7	Very low	40.3	Very low	128 Å²	128	140.8 Å²	140.8	79%	0.785	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-54.3	126.1	173.7	-46.9	0	0	0	0	109.2	K308 L312	K308-T310 PolarHBondContact O-N 3.01Å; T310-L312 VanDerWaalsContact C-N 3.26Å; T310-L312 PolarHBondContact O-N 3.28Å
311	M	36.9	Very low	41.7	Very low	174 Å²	174	140.1 Å²	140.1	86%	0.857	72%	0.719	S	S	*	*			trans	-71	82	-177.1	-87.3	-71.7	178.8	0	0	110.9	P309 S313	P309-M311 PolarHBondContact O-N 3.1Å; M311-S313 PolarHBondContact O-N 3.28Å
312	L	39.8	Very low	43.1	Very low	77 Å²	77	135 Å²	135	40%	0.403	70%	0.701	S	S	.	*			trans	-46.8	126.7	173.6	-75	166.6	0	0	0	110.3	T310 E316 K317	T310-L312 VanDerWaalsContact C-N 3.26Å; T310-L312 PolarHBondContact O-N 3.28Å; L312-E316 VanDerWaalsContact CD2-OE1 3.27Å; L312-E316 WeakPolarHBondContact CD2-OE1 3.35Å; L312-K317 VanDerWaalsContact O-CE 3.3Å; L312-K317 WeakPolarHBondContact O-CE 3.45Å; L312-K317 PolarHBondContact O-NZ 2.92Å
313	S	43.8	Very low	44.8	Very low	48 Å²	48	134 Å²	134	34%	0.336	69%	0.69	S	S	.	*			trans	-58.8	156.3	-174	65.8	0	0	0	0	111.5	M311 E315 E316 K317	M311-S313 PolarHBondContact O-N 3.28Å; S313-E315 PolarHBondContact O-N 2.99Å; S313-E316 WeakPolarHBondContact CB-OE2 3.48Å; S313-E316 PolarHBondContact N-OE2 3.19Å; S313-E316 PolarHBondContact O-N 3.44Å; S313-E316 VanDerWaalsContact OG-CG 3.31Å; S313-E316 WeakPolarHBondContact OG-CG 3.18Å; S313-E316 PolarHBondContact OG-N 3.36Å; S313-E316 VanDerWaalsContact OG-N 3.17Å; S313-E316 PolarHBondContact OG-OE2 2.9Å; S313-K317 PolarHBondContact O-N 2.69Å
314	N	49.7	Very low	46.5	Very low	119 Å²	119	133.3 Å²	133.3	64%	0.636	68%	0.676	S	S	*	*	H	α-helix	trans	-63.8	-19.1	173.4	-76.6	-22.3	0	0	0	112.4	K317 Q318	N314-K317 PolarHBondContact OD1-NZ 3.45Å; N314-Q318 PolarHBondContact O-N 3.22Å
315	E	49.8	Very low	48.2	Very low	137 Å²	137	134.8 Å²	134.8	64%	0.64	67%	0.669	S	S	*	*	H	α-helix	trans	-72.6	-45	173.2	-54.8	-157.5	156.1	0	0	112.1	S313 K317 Q318 R319	S313-E315 PolarHBondContact O-N 2.99Å; E315-K317 VanDerWaalsContact C-N 3.3Å; E315-K317 PolarHBondContact O-N 2.8Å; E315-Q318 PolarHBondContact O-N 3.25Å; E315-R319 PolarHBondContact O-N 3.28Å
316	E	50.5	Low	49.8	Very low	90 Å²	90	135.2 Å²	135.2	42%	0.421	65%	0.653	S	S	.	*	H	α-helix	trans	-65.2	-34.2	177	-70.6	163.3	103.6	0	0	112.3	L312 S313 Q318 R319	L312-E316 VanDerWaalsContact CD2-OE1 3.27Å; L312-E316 WeakPolarHBondContact CD2-OE1 3.35Å; S313-E316 WeakPolarHBondContact CB-OE2 3.48Å; S313-E316 PolarHBondContact N-OE2 3.19Å; S313-E316 PolarHBondContact O-N 3.44Å; S313-E316 VanDerWaalsContact OG-CG 3.31Å; S313-E316 WeakPolarHBondContact OG-CG 3.18Å; S313-E316 PolarHBondContact OG-N 3.36Å; S313-E316 VanDerWaalsContact OG-N 3.17Å; S313-E316 PolarHBondContact OG-OE2 2.9Å; E316-Q318 PolarHBondContact O-N 3.09Å; E316-R319 PolarHBondContact O-N 3.5Å; E316-R319 VanDerWaalsContact O-N 3.16Å
317	K	50.2	Low	51.4	Low	104 Å²	104	138 Å²	138	45%	0.452	65%	0.647	S	S	.	*	H	α-helix	trans	-60.4	-32.3	171.8	-69.9	172.4	-169.9	157.6	0	112.1	L312 S313 N314 E315	L312-K317 VanDerWaalsContact O-CE 3.3Å; L312-K317 WeakPolarHBondContact O-CE 3.45Å; L312-K317 PolarHBondContact O-NZ 2.92Å; S313-K317 PolarHBondContact O-N 2.69Å; N314-K317 PolarHBondContact OD1-NZ 3.45Å; E315-K317 VanDerWaalsContact C-N 3.3Å; E315-K317 PolarHBondContact O-N 2.8Å
318	Q	51.2	Low	53	Low	172 Å²	172	133.4 Å²	133.4	80%	0.804	63%	0.629	S	S	*	*	H	α-helix	trans	-82.5	-18.2	175.9	-68.4	-166	40.5	0	0	114.4	N314 E315 E316 R320	N314-Q318 PolarHBondContact O-N 3.22Å; E315-Q318 PolarHBondContact O-N 3.25Å; E316-Q318 PolarHBondContact O-N 3.09Å; Q318-R320 VanDerWaalsContact C-N 3.25Å; Q318-R320 PolarHBondContact O-N 3.13Å
319	R	52.4	Low	54.4	Low	202 Å²	202	126.5 Å²	126.5	76%	0.762	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	-8.1	175.5	-66.9	-175.7	-173.1	-159.9	4.6	113.8	E315 E316	E315-R319 PolarHBondContact O-N 3.28Å; E316-R319 PolarHBondContact O-N 3.5Å; E316-R319 VanDerWaalsContact O-N 3.16Å
320	R	49.9	Very low	55.8	Low	168 Å²	168	122.4 Å²	122.4	63%	0.634	58%	0.576	S	S	*	*	S	Bend	trans	-67.5	135.9	179.9	-66.5	-174.5	174.9	-161.1	-3.5	112	Q318 I322	Q318-R320 VanDerWaalsContact C-N 3.25Å; Q318-R320 PolarHBondContact O-N 3.13Å; R320-I322 PolarHBondContact O-N 3.48Å
321	P	59.7	Low	57.1	Low	125 Å²	125	120.1 Å²	120.1	81%	0.812	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-58.5	130.1	176.4	-25.6	34.7	0	0	0	112.9	N323	P321-N323 PolarHBondContact O-N 2.85Å
322	I	65.7	Low	58.5	Low	101 Å²	101	118 Å²	118	52%	0.518	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-57.1	119.4	179.1	-58.3	176.5	0	0	0	110.1	R320 Q326 R327	R320-I322 PolarHBondContact O-N 3.48Å; I322-Q326 HydrophobicContact CG2-CB 3.5Å; I322-Q326 VanDerWaalsContact CG2-CB 3.5Å; I322-R327 HydrophobicContact CB-CG 4.42Å; I322-R327 HydrophobicContact CG2-CB 4.29Å; I322-R327 HydrophobicContact CG2-CG 3.99Å
323	N	65.9	Low	59.7	Low	106 Å²	106	122.1 Å²	122.1	57%	0.567	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-64.3	149.9	-177.1	-169.6	-14.6	0	0	0	110.8	P321 K325 Q326 R327	P321-N323 PolarHBondContact O-N 2.85Å; N323-K325 PolarHBondContact O-N 2.75Å; N323-Q326 VanDerWaalsContact N-OE1 3.09Å; N323-Q326 PolarHBondContact O-N 3.01Å; N323-R327 PolarHBondContact O-N 2.91Å
324	R	67.6	Low	60.8	Low	160 Å²	160	125.5 Å²	125.5	60%	0.604	57%	0.567	S	S	*	*	H	α-helix	trans	-45.6	-42.2	-179	-71.5	-179.5	173.9	174.5	-2.9	112.6	R327 R328	R324-R327 PolarHBondContact O-N 3.08Å; R324-R328 PolarHBondContact O-N 3.37Å
325	K	69	Low	61.9	Low	138 Å²	138	120.2 Å²	120.2	60%	0.6	54%	0.54	S	S	*	.	H	α-helix	trans	-58.5	-60.9	174.5	178.7	179.1	175.4	-169.4	0	111.9	N323 R327 R328 D329	N323-K325 PolarHBondContact O-N 2.75Å; K325-R327 PolarHBondContact O-N 3.49Å; K325-R328 PolarHBondContact O-N 3.26Å; K325-R328 VanDerWaalsContact O-N 3.11Å; K325-D329 VanDerWaalsContact CE-OD2 3.32Å; K325-D329 WeakPolarHBondContact CE-OD2 3.46Å; K325-D329 WeakPolarHBondContact CG-OD2 3.44Å; K325-D329 WeakPolarHBondContact O-CB 3.46Å; K325-D329 PolarHBondContact O-N 3.44Å
326	Q	65.6	Low	63.1	Low	115 Å²	115	116.5 Å²	116.5	54%	0.537	52%	0.521	S	S	.	.	H	α-helix	trans	-55.9	-36.9	178.9	-67.9	167.1	-46	0	0	112.2	I322 N323 S330	I322-Q326 HydrophobicContact CG2-CB 3.5Å; I322-Q326 VanDerWaalsContact CG2-CB 3.5Å; N323-Q326 VanDerWaalsContact N-OE1 3.09Å; N323-Q326 PolarHBondContact O-N 3.01Å; Q326-S330 VanDerWaalsContact O-CB 3.22Å; Q326-S330 WeakPolarHBondContact O-CB 3.24Å; Q326-S330 PolarHBondContact O-N 3.24Å; Q326-S330 PolarHBondContact O-OG 3.24Å
327	R	65.8	Low	64.4	Low	165 Å²	165	113.6 Å²	113.6	62%	0.623	52%	0.515	S	S	*	.	H	α-helix	trans	-61.2	-52.8	175.1	-114.8	175.4	178	163.6	-0.7	111.7	I322 N323 R324 K325 S330 M331	I322-R327 HydrophobicContact CB-CG 4.42Å; I322-R327 HydrophobicContact CG2-CB 4.29Å; I322-R327 HydrophobicContact CG2-CG 3.99Å; N323-R327 PolarHBondContact O-N 2.91Å; R324-R327 PolarHBondContact O-N 3.08Å; K325-R327 PolarHBondContact O-N 3.49Å; R327-S330 PolarHBondContact O-N 2.87Å; R327-S330 PolarHBondContact O-OG 3.35Å; R327-M331 PolarHBondContact O-N 3.22Å; R327-M331 VanDerWaalsContact O-N 3.14Å
328	R	65.5	Low	66	Low	151 Å²	151	112.1 Å²	112.1	57%	0.57	51%	0.508	S	S	*	.	H	α-helix	trans	-59.3	-49.5	176.5	-178.2	-166.6	67.2	179.8	1.1	111.3	R324 K325 S330 M331 Y332	R324-R328 PolarHBondContact O-N 3.37Å; K325-R328 PolarHBondContact O-N 3.26Å; K325-R328 VanDerWaalsContact O-N 3.11Å; R328-S330 VanDerWaalsContact C-N 3.28Å; R328-S330 PolarHBondContact O-N 3.34Å; R328-M331 WeakPolarHBondContact O-CA 3.33Å; R328-M331 WeakPolarHBondContact O-CB 3.37Å; R328-M331 PolarHBondContact O-N 2.9Å; R328-Y332 PolarHBondContact O-N 3.48Å
329	D	64.7	Low	67.7	Low	57 Å²	57	105.5 Å²	105.5	31%	0.305	48%	0.478	S	S	.	.	H	α-helix	trans	-62.2	-40.1	-176.6	-58.4	-7.6	0	0	0	109.5	K325 M331 Y332 E333	K325-D329 VanDerWaalsContact CE-OD2 3.32Å; K325-D329 WeakPolarHBondContact CE-OD2 3.46Å; K325-D329 WeakPolarHBondContact CG-OD2 3.44Å; K325-D329 WeakPolarHBondContact O-CB 3.46Å; K325-D329 PolarHBondContact O-N 3.44Å; D329-M331 VanDerWaalsContact C-N 3.3Å; D329-M331 PolarHBondContact O-N 3.11Å; D329-Y332 PolarHBondContact O-N 3.08Å; D329-E333 VanDerWaalsContact O-CB 3.28Å; D329-E333 WeakPolarHBondContact O-CB 3.44Å; D329-E333 PolarHBondContact O-N 2.98Å
330	S	68.9	Low	69.5	Low	33 Å²	33	100.3 Å²	100.3	23%	0.231	47%	0.473	C	S	.	.	H	α-helix	trans	-70.9	-13.1	172.9	83.7	0	0	0	0	115.6	Q326 R327 R328 K334	Q326-S330 VanDerWaalsContact O-CB 3.22Å; Q326-S330 WeakPolarHBondContact O-CB 3.24Å; Q326-S330 PolarHBondContact O-N 3.24Å; Q326-S330 PolarHBondContact O-OG 3.24Å; R327-S330 PolarHBondContact O-N 2.87Å; R327-S330 PolarHBondContact O-OG 3.35Å; R328-S330 VanDerWaalsContact C-N 3.28Å; R328-S330 PolarHBondContact O-N 3.34Å; S330-K334 WeakPolarHBondContact O-CD 3.48Å; S330-K334 VanDerWaalsContact O-CG 3.25Å; S330-K334 WeakPolarHBondContact O-CG 3.5Å; S330-K334 PolarHBondContact O-NZ 2.79Å
331	M	66.5	Low	71.5	Confident	81 Å²	81	93.1 Å²	93.1	40%	0.399	45%	0.449	S	S	.	.	H	α-helix	trans	-86.4	-41.8	169.9	-76.2	-180	61.6	0	0	110.3	R327 R328 D329 K334 G335 Y336	R327-M331 PolarHBondContact O-N 3.22Å; R327-M331 VanDerWaalsContact O-N 3.14Å; R328-M331 WeakPolarHBondContact O-CA 3.33Å; R328-M331 WeakPolarHBondContact O-CB 3.37Å; R328-M331 PolarHBondContact O-N 2.9Å; D329-M331 VanDerWaalsContact C-N 3.3Å; D329-M331 PolarHBondContact O-N 3.11Å; M331-K334 CarbonylContact O-C 3.32Å; M331-K334 WeakPolarHBondContact O-CA 3.23Å; M331-K334 WeakPolarHBondContact O-CB 3.28Å; M331-K334 PolarHBondContact O-N 3.44Å; M331-K334 VanDerWaalsContact O-N 3.13Å; M331-G335 PolarHBondContact O-N 3.27Å; M331-Y336 HydrophobicContact CB-CD2 4.47Å; M331-Y336 HydrophobicContact CE-CG 4.45Å; M331-Y336 WeakPolarHBondContact O-CB 3.39Å; M331-Y336 PolarHBondContact O-N 2.94Å
332	Y	66.8	Low	73.1	Confident	130 Å²	130	87.8 Å²	87.8	51%	0.51	41%	0.412	S	S	.	.	H	α-helix	trans	-66.3	-37.9	177.4	-168.7	-105.2	0	0	0	112.6	R328 D329 K334 G335 Y336 K338	R328-Y332 PolarHBondContact O-N 3.48Å; D329-Y332 PolarHBondContact O-N 3.08Å; Y332-K334 VanDerWaalsContact C-N 3.29Å; Y332-K334 PolarHBondContact O-N 3.49Å; Y332-G335 PolarHBondContact O-N 3.03Å; Y332-Y336 WeakPolarHBondContact CA-O 3.44Å; Y332-Y336 WeakPolarHBondContact CD2-O 3.38Å; Y332-K338 HydrophobicContact CD2-CG 4.49Å; Y332-K338 VanDerWaalsContact CE1-CE 3.45Å; Y332-K338 HydrophobicContact CE2-CD 4.36Å; Y332-K338 HydrophobicContact CE2-CG 3.89Å; Y332-K338 VanDerWaalsContact OH-CE 3.31Å; Y332-K338 WeakPolarHBondContact OH-CE 3.5Å
333	E	64.3	Low	74.5	Confident	163 Å²	163	89 Å²	89	76%	0.762	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-34.9	169.9	-177.5	-179	-139.8	0	0	112.3	D329 G335	D329-E333 VanDerWaalsContact O-CB 3.28Å; D329-E333 WeakPolarHBondContact O-CB 3.44Å; D329-E333 PolarHBondContact O-N 2.98Å; E333-G335 PolarHBondContact O-N 2.92Å
334	K	68.1	Low	75.9	Confident	119 Å²	119	87.4 Å²	87.4	52%	0.517	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-1	172.1	-68	-179.7	-167.4	88.3	0	113.5	S330 M331 Y332 Y336 V363	S330-K334 WeakPolarHBondContact O-CD 3.48Å; S330-K334 VanDerWaalsContact O-CG 3.25Å; S330-K334 WeakPolarHBondContact O-CG 3.5Å; S330-K334 PolarHBondContact O-NZ 2.79Å; M331-K334 CarbonylContact O-C 3.32Å; M331-K334 WeakPolarHBondContact O-CA 3.23Å; M331-K334 WeakPolarHBondContact O-CB 3.28Å; M331-K334 PolarHBondContact O-N 3.44Å; M331-K334 VanDerWaalsContact O-N 3.13Å; Y332-K334 VanDerWaalsContact C-N 3.29Å; Y332-K334 PolarHBondContact O-N 3.49Å; K334-Y336 HydrophobicContact CB-CD2 4.17Å; K334-Y336 HydrophobicContact CB-CE2 4.38Å; K334-V363 HydrophobicContact CB-CG1 4.5Å; K334-V363 WeakPolarHBondContact O-CG1 3.31Å; K334-V363 WeakPolarHBondContact O-CG2 3.44Å
335	G	71.2	Confident	77.2	Confident	7 Å²	7	84.8 Å²	84.8	7%	0.072	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.7	-2.7	177	0	0	0	0	0	116.2	M331 Y332 E333 S341	M331-G335 PolarHBondContact O-N 3.27Å; Y332-G335 PolarHBondContact O-N 3.03Å; E333-G335 PolarHBondContact O-N 2.92Å; G335-S341 VanDerWaalsContact CA-OG 3.31Å; G335-S341 WeakPolarHBondContact CA-OG 3.11Å; G335-S341 VanDerWaalsContact O-CB 3.24Å; G335-S341 WeakPolarHBondContact O-CB 3.31Å; G335-S341 PolarHBondContact O-OG 3.07Å; G335-S341 VanDerWaalsContact O-OG 3.09Å
336	Y	76.5	Confident	78.4	Confident	60 Å²	60	83.2 Å²	83.2	24%	0.235	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	142.4	174	-67.7	-80.7	0	0	0	110.8	M331 Y332 K334 V363 D405	M331-Y336 HydrophobicContact CB-CD2 4.47Å; M331-Y336 HydrophobicContact CE-CG 4.45Å; M331-Y336 WeakPolarHBondContact O-CB 3.39Å; M331-Y336 PolarHBondContact O-N 2.94Å; Y332-Y336 WeakPolarHBondContact CA-O 3.44Å; Y332-Y336 WeakPolarHBondContact CD2-O 3.38Å; K334-Y336 HydrophobicContact CB-CD2 4.17Å; K334-Y336 HydrophobicContact CB-CE2 4.38Å; Y336-V363 HydrophobicContact CD2-CG1 4.37Å; Y336-V363 HydrophobicContact CE2-CG1 3.67Å; Y336-D405 WeakPolarHBondContact CA-OD2 3.5Å; Y336-D405 WeakPolarHBondContact CB-OD2 3.47Å; Y336-D405 HydrophobicContact CD1-CB 4.29Å; Y336-D405 WeakPolarHBondContact CD1-OD2 3.46Å
337	G	77.1	Confident	79.7	Confident	29 Å²	29	83.3 Å²	83.3	30%	0.299	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.6	14.8	-175.3	0	0	0	0	0	115.3	D405	G337-D405 PolarHBondContact N-OD2 3.48Å
338	K	83.4	Confident	80.9	Confident	73 Å²	73	79.1 Å²	79.1	32%	0.317	38%	0.378	S	S	.	.			trans	-129.4	131.4	176	-62.6	-179.2	179.8	177.1	0	111.6	Y332 S340 S341 Y342	Y332-K338 HydrophobicContact CD2-CG 4.49Å; Y332-K338 VanDerWaalsContact CE1-CE 3.45Å; Y332-K338 HydrophobicContact CE2-CD 4.36Å; Y332-K338 HydrophobicContact CE2-CG 3.89Å; Y332-K338 VanDerWaalsContact OH-CE 3.31Å; Y332-K338 WeakPolarHBondContact OH-CE 3.5Å; K338-S340 PolarHBondContact O-N 2.93Å; K338-S341 PolarHBondContact O-N 3.2Å; K338-Y342 WeakPolarHBondContact O-CD2 3.39Å; K338-Y342 WeakPolarHBondContact O-CE2 3.43Å
339	L	87.9	Confident	81.8	Confident	33 Å²	33	73.3 Å²	73.3	17%	0.173	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-64.9	-31	176.3	-168.6	63.9	0	0	0	112.2	S341 Y342 I344 L370 I407 E409	L339-S341 PolarHBondContact O-N 2.9Å; L339-Y342 PolarHBondContact O-N 3.27Å; L339-I344 HydrophobicContact CD1-CD1 4.31Å; L339-I344 HydrophobicContact CD2-CD1 4.5Å; L339-L370 HydrophobicContact CD1-CD2 3.76Å; L339-I407 HydrophobicContact CB-CG2 4.47Å; L339-I407 HydrophobicContact CD1-CD1 4.26Å; L339-E409 WeakPolarHBondContact CB-OE1 3.36Å
340	S	89.6	Confident	82.8	Confident	93 Å²	93	75 Å²	75	65%	0.65	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-57.6	-16.9	175.3	64.5	0	0	0	0	114.8	K338 Y342	K338-S340 PolarHBondContact O-N 2.93Å; S340-Y342 VanDerWaalsContact C-N 3.28Å
341	S	91.2	Very high	82.9	Confident	17 Å²	17	75.6 Å²	75.6	12%	0.119	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-87.4	5.7	176.6	-71.1	0	0	0	0	113.6	G335 K338 L339 L362	G335-S341 VanDerWaalsContact CA-OG 3.31Å; G335-S341 WeakPolarHBondContact CA-OG 3.11Å; G335-S341 VanDerWaalsContact O-CB 3.24Å; G335-S341 WeakPolarHBondContact O-CB 3.31Å; G335-S341 PolarHBondContact O-OG 3.07Å; G335-S341 VanDerWaalsContact O-OG 3.09Å; K338-S341 PolarHBondContact O-N 3.2Å; L339-S341 PolarHBondContact O-N 2.9Å; S341-L362 WeakPolarHBondContact O-CB 3.32Å; S341-L362 WeakPolarHBondContact O-CG 3.37Å; S341-L362 PolarHBondContact O-N 2.73Å
342	Y	94.6	Very high	83	Confident	12 Å²	12	77.7 Å²	77.7	5%	0.047	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	120.3	179.2	-58.5	-85.3	0	0	0	110.8	K338 L339 S340 I344 Y360 V368 L370 I407 V416	K338-Y342 WeakPolarHBondContact O-CD2 3.39Å; K338-Y342 WeakPolarHBondContact O-CE2 3.43Å; L339-Y342 PolarHBondContact O-N 3.27Å; S340-Y342 VanDerWaalsContact C-N 3.28Å; Y342-I344 PolarHBondContact O-N 2.93Å; Y342-Y360 WeakPolarHBondContact CA-O 3.39Å; Y342-V368 HydrophobicContact CD1-CG2 3.92Å; Y342-V368 HydrophobicContact CE1-CG2 4.45Å; Y342-L370 HydrophobicContact CG-CD2 4.21Å; Y342-I407 HydrophobicContact CD2-CD1 3.78Å; Y342-I407 HydrophobicContact CE2-CD1 3.64Å; Y342-V416 HydrophobicContact CD1-CG1 4.17Å; Y342-V416 HydrophobicContact CE1-CG1 3.61Å; Y342-V416 HydrophobicContact CE1-CG2 4.44Å; Y342-V416 HydrophobicContact CE2-CG2 4.33Å
343	K	95.1	Very high	83.1	Confident	126 Å²	126	79.9 Å²	79.9	55%	0.548	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	111.5	169.8	-173.2	173.6	179.9	-177.6	0	108.3	Y345 G359 Y360 L362	K343-Y345 HydrophobicContact CB-CE1 4.38Å; K343-Y345 HydrophobicContact CD-CE1 3.71Å; K343-Y345 HydrophobicContact CG-CD1 4.27Å; K343-Y345 HydrophobicContact CG-CE1 3.75Å; K343-G359 CarbonylContact O-C 3.58Å; K343-G359 WeakPolarHBondContact O-CA 3.19Å; K343-Y360 PolarHBondContact N-O 2.91Å; K343-Y360 PolarHBondContact O-N 3.13Å; K343-L362 HydrophobicContact CB-CD2 4.43Å
344	I	94.7	Very high	83.9	Confident	74 Å²	74	72.7 Å²	72.7	38%	0.379	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	142.8	175.5	-58.9	177.5	0	0	0	109.2	L339 Y342 Y357	L339-I344 HydrophobicContact CD1-CD1 4.31Å; L339-I344 HydrophobicContact CD2-CD1 4.5Å; Y342-I344 PolarHBondContact O-N 2.93Å; I344-Y357 HydrophobicContact CG2-CD1 3.86Å; I344-Y357 HydrophobicContact CG2-CG 4.01Å
345	Y	94	Very high	84.8	Confident	104 Å²	104	67.2 Å²	67.2	41%	0.408	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	-133.3	175.8	-61.1	-36.6	0	0	0	109.6	K343 K358 Y360 L367	K343-Y345 HydrophobicContact CB-CE1 4.38Å; K343-Y345 HydrophobicContact CD-CE1 3.71Å; K343-Y345 HydrophobicContact CG-CD1 4.27Å; K343-Y345 HydrophobicContact CG-CE1 3.75Å; Y345-K358 HydrophobicContact CD2-CG 4.42Å; Y345-K358 PolarHBondContact N-O 3.17Å; Y345-Y360 WeakPolarHBondContact OH-CB 3.48Å; Y345-L367 HydrophobicContact CD2-CD2 4.28Å; Y345-L367 HydrophobicContact CE2-CD2 3.89Å
346	E	94.2	Very high	85.7	Confident	106 Å²	106	68.5 Å²	68.5	50%	0.495	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	152.1	-179.6	66.6	-156.4	153.6	0	0	113.9	L348 K358	E346-L348 HydrophobicContact CG-CD2 4.4Å; E346-K358 HydrophobicContact CG-CB 3.93Å; E346-K358 HydrophobicContact CG-CD 3.85Å; E346-K358 PolarHBondContact O-N 2.71Å; E346-K358 WeakPolarHBondContact OE1-CD 3.09Å; E346-K358 WeakPolarHBondContact OE1-CE 3.23Å; E346-K358 IonicContact OE1-NZ 3.79Å; E346-K358 PolarHBondContact OE1-NZ 3.39Å
347	K	94.4	Very high	86.6	Confident	116 Å²	116	68.7 Å²	68.7	50%	0.504	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	120	168.7	-178.8	-170.9	-177.5	-174.7	0	108.3	E350 T355 Y357	K347-E350 VanDerWaalsContact CE-OE2 3.28Å; K347-E350 WeakPolarHBondContact CE-OE2 3.37Å; K347-E350 IonicContact NZ-OE2 2.71Å; K347-E350 PolarHBondContact NZ-OE2 3.24Å; K347-T355 HydrophobicContact CD-CG2 4.32Å; K347-T355 HydrophobicContact CG-CG2 4.04Å; K347-Y357 HydrophobicContact CB-CD1 4.18Å; K347-Y357 HydrophobicContact CB-CE1 4.22Å; K347-Y357 HydrophobicContact CG-CE1 4.47Å
348	L	89.7	Confident	87.5	Confident	77 Å²	77	69.2 Å²	69.2	40%	0.403	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-29.5	177.6	-65.6	171.1	0	0	0	112.1	E346 V356 K358 A369 Y419	E346-L348 HydrophobicContact CG-CD2 4.4Å; L348-V356 HydrophobicContact CB-CB 4.45Å; L348-V356 HydrophobicContact CB-CG1 4.24Å; L348-V356 HydrophobicContact CD1-CG1 4.23Å; L348-V356 PolarHBondContact N-O 2.71Å; L348-K358 HydrophobicContact CD1-CB 3.93Å; L348-K358 HydrophobicContact CD2-CB 4.08Å; L348-K358 HydrophobicContact CD2-CD 4.41Å; L348-K358 HydrophobicContact CG-CB 3.92Å; L348-A369 HydrophobicContact CD1-CB 4.49Å; L348-Y419 HydrophobicContact CD1-CD2 4.35Å; L348-Y419 HydrophobicContact CD1-CE2 3.88Å; L348-Y419 HydrophobicContact CD2-CE2 4.2Å
349	G	85.8	Confident	88.1	Confident	29 Å²	29	65.7 Å²	65.7	30%	0.299	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.3	171.6	178.2	0	0	0	0	0	113.2	T355 V356	G349-T355 WeakPolarHBondContact O-CG2 2.87Å; G349-V356 PolarHBondContact N-O 3.42Å; G349-V356 PolarHBondContact O-N 3.06Å
350	E	84.6	Confident	88.5	Confident	94 Å²	94	67.2 Å²	67.2	44%	0.439	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	131.7	171.5	-178.1	168.3	-166.8	0	0	109.1	K347 T355 R374	K347-E350 VanDerWaalsContact CE-OE2 3.28Å; K347-E350 WeakPolarHBondContact CE-OE2 3.37Å; K347-E350 IonicContact NZ-OE2 2.71Å; K347-E350 PolarHBondContact NZ-OE2 3.24Å; E350-T355 HydrophobicContact CB-CG2 4.28Å; E350-R374 IonicContact OE1-CZ 3.86Å; E350-R374 IonicContact OE1-NH1 2.67Å; E350-R374 PolarHBondContact OE1-NH1 2.96Å; E350-R374 IonicContact OE1-NH2 2.67Å; E350-R374 PolarHBondContact OE1-NH2 2.97Å
351	G	72.3	Confident	88.7	Confident	45 Å²	45	62.9 Å²	62.9	46%	0.464	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	173.2	167.4	0	0	0	0	0	109.9	Y353 A354	G351-Y353 PolarHBondContact O-N 2.94Å; G351-A354 PolarHBondContact N-O 2.85Å; G351-A354 PolarHBondContact O-N 2.9Å; G351-A354 VanDerWaalsContact O-N 3.07Å; G351-A354 VanDerWaalsContact O-O 3.1Å
352	T	67.3	Low	88.8	Confident	125 Å²	125	65.8 Å²	65.8	77%	0.767	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.2	-36.2	-169.8	-40.7	0	0	0	0	115.1
353	Y	69	Low	88.5	Confident	176 Å²	176	67.5 Å²	67.5	69%	0.69	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	-13.6	-174.6	-55.7	-72.5	0	0	0	114.8	G351 I373 R374	G351-Y353 PolarHBondContact O-N 2.94Å; Y353-I373 WeakPolarHBondContact O-CA 3.46Å; Y353-R374 PolarHBondContact O-N 3.47Å; Y353-R374 VanDerWaalsContact O-N 3.1Å
354	A	81.6	Confident	88.2	Confident	12 Å²	12	63.2 Å²	63.2	10%	0.099	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	143.4	-168.6	0	0	0	0	0	114.1	G351 K371 R372 I373	G351-A354 PolarHBondContact N-O 2.85Å; G351-A354 PolarHBondContact O-N 2.9Å; G351-A354 VanDerWaalsContact O-N 3.07Å; G351-A354 VanDerWaalsContact O-O 3.1Å; A354-K371 HydrophobicContact CB-CG 4.07Å; A354-R372 VanDerWaalsContact CA-O 3.28Å; A354-R372 WeakPolarHBondContact CA-O 3.37Å; A354-I373 HydrophobicContact CB-CG1 4.09Å
355	T	87.2	Confident	88	Confident	4 Å²	4	66 Å²	66	3%	0.025	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	131.1	170.2	-44.9	0	0	0	0	109.4	K347 G349 E350 Y357 R372 R374	K347-T355 HydrophobicContact CD-CG2 4.32Å; K347-T355 HydrophobicContact CG-CG2 4.04Å; G349-T355 WeakPolarHBondContact O-CG2 2.87Å; E350-T355 HydrophobicContact CB-CG2 4.28Å; T355-Y357 HydrophobicContact CG2-CD2 4.23Å; T355-Y357 HydrophobicContact CG2-CE1 4.27Å; T355-Y357 HydrophobicContact CG2-CE2 3.52Å; T355-R372 PolarHBondContact N-O 2.96Å; T355-R372 PolarHBondContact O-N 2.88Å; T355-R374 PolarHBondContact OG1-NH2 3.08Å
356	V	90.7	Very high	88	Confident	34 Å²	34	65.9 Å²	65.9	21%	0.206	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	126.1	178.6	-171.1	0	0	0	0	109.1	L348 G349 A369 L370 K371	L348-V356 HydrophobicContact CB-CB 4.45Å; L348-V356 HydrophobicContact CB-CG1 4.24Å; L348-V356 HydrophobicContact CD1-CG1 4.23Å; L348-V356 PolarHBondContact N-O 2.71Å; G349-V356 PolarHBondContact N-O 3.42Å; G349-V356 PolarHBondContact O-N 3.06Å; V356-A369 HydrophobicContact CG1-CB 4.43Å; V356-L370 WeakPolarHBondContact CA-O 3.35Å; V356-K371 HydrophobicContact CG2-CB 4.25Å; V356-K371 HydrophobicContact CG2-CD 4.2Å; V356-K371 HydrophobicContact CG2-CG 4.03Å
357	Y	95.1	Very high	88	Confident	63 Å²	63	64.5 Å²	64.5	25%	0.247	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	149.1	176	-59.7	-93.8	0	0	0	111	I344 K347 T355 A369 L370	I344-Y357 HydrophobicContact CG2-CD1 3.86Å; I344-Y357 HydrophobicContact CG2-CG 4.01Å; K347-Y357 HydrophobicContact CB-CD1 4.18Å; K347-Y357 HydrophobicContact CB-CE1 4.22Å; K347-Y357 HydrophobicContact CG-CE1 4.47Å; T355-Y357 HydrophobicContact CG2-CD2 4.23Å; T355-Y357 HydrophobicContact CG2-CE1 4.27Å; T355-Y357 HydrophobicContact CG2-CE2 3.52Å; Y357-A369 CarbonylContact O-C 3.55Å; Y357-A369 WeakPolarHBondContact O-CA 3.45Å; Y357-L370 PolarHBondContact N-O 2.92Å; Y357-L370 PolarHBondContact O-N 3.01Å
358	K	95	Very high	88	Confident	40 Å²	40	59 Å²	59	17%	0.174	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	148.7	160.7	-165	175.1	-172.3	169.5	0	108.4	Y345 E346 L348 Y419	Y345-K358 HydrophobicContact CD2-CG 4.42Å; Y345-K358 PolarHBondContact N-O 3.17Å; E346-K358 HydrophobicContact CG-CB 3.93Å; E346-K358 HydrophobicContact CG-CD 3.85Å; E346-K358 PolarHBondContact O-N 2.71Å; E346-K358 WeakPolarHBondContact OE1-CD 3.09Å; E346-K358 WeakPolarHBondContact OE1-CE 3.23Å; E346-K358 IonicContact OE1-NZ 3.79Å; E346-K358 PolarHBondContact OE1-NZ 3.39Å; L348-K358 HydrophobicContact CD1-CB 3.93Å; L348-K358 HydrophobicContact CD2-CB 4.08Å; L348-K358 HydrophobicContact CD2-CD 4.41Å; L348-K358 HydrophobicContact CG-CB 3.92Å; K358-Y419 HydrophobicContact CB-CE2 4.45Å; K358-Y419 HydrophobicContact CD-CE2 3.87Å; K358-Y419 HydrophobicContact CG-CD2 3.93Å; K358-Y419 HydrophobicContact CG-CE2 3.7Å
359	G	95.9	Very high	88.2	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	-175.9	170.8	0	0	0	0	0	112.6	K343 L367 V368	K343-G359 CarbonylContact O-C 3.58Å; K343-G359 WeakPolarHBondContact O-CA 3.19Å; G359-L367 WeakPolarHBondContact O-CA 3.27Å; G359-L367 WeakPolarHBondContact O-CD2 3.47Å; G359-V368 PolarHBondContact N-O 3.19Å; G359-V368 PolarHBondContact O-N 2.77Å
360	Y	96	Very high	88.6	Confident	65 Å²	65	54.7 Å²	54.7	26%	0.255	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	121	-179.1	-176.7	-101.3	0	0	0	110.6	Y342 K343 Y345 L362 K365 Q366 L367	Y342-Y360 WeakPolarHBondContact CA-O 3.39Å; K343-Y360 PolarHBondContact N-O 2.91Å; K343-Y360 PolarHBondContact O-N 3.13Å; Y345-Y360 WeakPolarHBondContact OH-CB 3.48Å; Y360-L362 HydrophobicContact CD1-CD2 4.24Å; Y360-L362 PolarHBondContact O-N 3.29Å; Y360-K365 HydrophobicContact CE1-CD 4.26Å; Y360-K365 VanDerWaalsContact CE2-O 3.28Å; Y360-K365 WeakPolarHBondContact CE2-O 3.48Å; Y360-K365 VanDerWaalsContact OH-CA 3.29Å; Y360-K365 WeakPolarHBondContact OH-CA 3.36Å; Y360-K365 WeakPolarHBondContact OH-CB 3.38Å; Y360-K365 PolarHBondContact OH-O 3.46Å; Y360-Q366 WeakPolarHBondContact CA-O 3.2Å; Y360-Q366 WeakPolarHBondContact CD2-O 3.49Å; Y360-L367 HydrophobicContact CD2-CD2 4.3Å
361	S	94.9	Very high	88.8	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.007	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	112.1	176.1	173.6	0	0	0	0	109.9	V363 S364 K365 Q366	S361-V363 PolarHBondContact O-N 3.18Å; S361-S364 WeakPolarHBondContact CB-OG 3.25Å; S361-S364 PolarHBondContact OG-N 3.47Å; S361-S364 PolarHBondContact OG-OG 2.8Å; S361-K365 VanDerWaalsContact O-CA 3.26Å; S361-K365 WeakPolarHBondContact O-CA 3.45Å; S361-K365 PolarHBondContact O-N 2.82Å; S361-Q366 PolarHBondContact N-O 2.89Å
362	L	92.2	Very high	89.6	Confident	79 Å²	79	55.2 Å²	55.2	41%	0.414	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-20.1	176.5	-59.9	178.2	0	0	0	111.8	S341 K343 Y360 K365	S341-L362 WeakPolarHBondContact O-CB 3.32Å; S341-L362 WeakPolarHBondContact O-CG 3.37Å; S341-L362 PolarHBondContact O-N 2.73Å; K343-L362 HydrophobicContact CB-CD2 4.43Å; Y360-L362 HydrophobicContact CD1-CD2 4.24Å; Y360-L362 PolarHBondContact O-N 3.29Å; L362-K365 WeakPolarHBondContact O-CD 3.35Å; L362-K365 VanDerWaalsContact O-CE 3.26Å; L362-K365 WeakPolarHBondContact O-CE 3.41Å; L362-K365 PolarHBondContact O-NZ 3.31Å
363	V	88.9	Confident	90.3	Very high	47 Å²	47	51.1 Å²	51.1	29%	0.285	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-53.9	-177.3	-173.2	0	0	0	0	111.8	K334 Y336 S361	K334-V363 HydrophobicContact CB-CG1 4.5Å; K334-V363 WeakPolarHBondContact O-CG1 3.31Å; K334-V363 WeakPolarHBondContact O-CG2 3.44Å; Y336-V363 HydrophobicContact CD2-CG1 4.37Å; Y336-V363 HydrophobicContact CE2-CG1 3.67Å; S361-V363 PolarHBondContact O-N 3.18Å
364	S	88.2	Confident	90.5	Very high	37 Å²	37	49.4 Å²	49.4	26%	0.259	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-5.2	-178.5	65.5	0	0	0	0	114.1	S361 Q366	S361-S364 WeakPolarHBondContact CB-OG 3.25Å; S361-S364 PolarHBondContact OG-N 3.47Å; S361-S364 PolarHBondContact OG-OG 2.8Å; S364-Q366 WeakPolarHBondContact O-CG 3.49Å; S364-Q366 PolarHBondContact O-N 3.49Å; S364-Q366 PolarHBondContact OG-OE1 2.85Å
365	K	92.2	Very high	90.1	Very high	133 Å²	133	51 Å²	51	58%	0.578	24%	0.238	S	C	*	.			trans	58.2	31.2	-179.6	-56.1	-54.8	-171.8	-165.8	0	113.9	Y360 S361 L362	Y360-K365 HydrophobicContact CE1-CD 4.26Å; Y360-K365 VanDerWaalsContact CE2-O 3.28Å; Y360-K365 WeakPolarHBondContact CE2-O 3.48Å; Y360-K365 VanDerWaalsContact OH-CA 3.29Å; Y360-K365 WeakPolarHBondContact OH-CA 3.36Å; Y360-K365 WeakPolarHBondContact OH-CB 3.38Å; Y360-K365 PolarHBondContact OH-O 3.46Å; S361-K365 VanDerWaalsContact O-CA 3.26Å; S361-K365 WeakPolarHBondContact O-CA 3.45Å; S361-K365 PolarHBondContact O-N 2.82Å; L362-K365 WeakPolarHBondContact O-CD 3.35Å; L362-K365 VanDerWaalsContact O-CE 3.26Å; L362-K365 WeakPolarHBondContact O-CE 3.41Å; L362-K365 PolarHBondContact O-NZ 3.31Å
366	Q	92.3	Very high	89.1	Confident	101 Å²	101	59.3 Å²	59.3	47%	0.472	27%	0.269	S	S	.	.	S	Bend	trans	-121.8	153.2	-175.8	-73.7	166.5	-35	0	0	111.8	Y360 S361 S364	Y360-Q366 WeakPolarHBondContact CA-O 3.2Å; Y360-Q366 WeakPolarHBondContact CD2-O 3.49Å; S361-Q366 PolarHBondContact N-O 2.89Å; S364-Q366 WeakPolarHBondContact O-CG 3.49Å; S364-Q366 PolarHBondContact O-N 3.49Å; S364-Q366 PolarHBondContact OG-OE1 2.85Å
367	L	94.3	Very high	87.6	Confident	76 Å²	76	68.3 Å²	68.3	40%	0.398	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	141.3	166.2	-70.6	173.1	0	0	0	110.4	Y345 G359 Y360 Y419	Y345-L367 HydrophobicContact CD2-CD2 4.28Å; Y345-L367 HydrophobicContact CE2-CD2 3.89Å; G359-L367 WeakPolarHBondContact O-CA 3.27Å; G359-L367 WeakPolarHBondContact O-CD2 3.47Å; Y360-L367 HydrophobicContact CD2-CD2 4.3Å; L367-Y419 HydrophobicContact CB-CG 4.22Å; L367-Y419 PolarHBondContact O-N 3.47Å
368	V	95	Very high	85.7	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	159.3	-179.2	-67.4	0	0	0	0	110.6	Y342 G359 L370 V416 F417	Y342-V368 HydrophobicContact CD1-CG2 3.92Å; Y342-V368 HydrophobicContact CE1-CG2 4.45Å; G359-V368 PolarHBondContact N-O 3.19Å; G359-V368 PolarHBondContact O-N 2.77Å; V368-L370 HydrophobicContact CG2-CD1 3.74Å; V368-L370 HydrophobicContact CG2-CG 4.39Å; V368-V416 HydrophobicContact CB-CG1 3.85Å; V368-V416 HydrophobicContact CG1-CG1 3.93Å; V368-V416 HydrophobicContact CG2-CG1 4.13Å; V368-F417 CarbonylContact C-O 3.54Å; V368-F417 VanDerWaalsContact CA-O 3.26Å; V368-F417 WeakPolarHBondContact CA-O 3.42Å; V368-F417 VanDerWaalsContact CB-O 3.26Å; V368-F417 WeakPolarHBondContact CB-O 3.42Å
369	A	94.5	Very high	83.8	Confident	15 Å²	15	74.9 Å²	74.9	12%	0.124	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	125.3	165.3	0	0	0	0	0	109.3	L348 V356 Y357 V416 F417	L348-A369 HydrophobicContact CD1-CB 4.49Å; V356-A369 HydrophobicContact CG1-CB 4.43Å; Y357-A369 CarbonylContact O-C 3.55Å; Y357-A369 WeakPolarHBondContact O-CA 3.45Å; A369-V416 WeakPolarHBondContact O-CA 3.4Å; A369-F417 HydrophobicContact CB-CB 4.44Å; A369-F417 PolarHBondContact N-O 3.08Å; A369-F417 PolarHBondContact O-N 3.02Å
370	L	93.2	Very high	81.9	Confident	2 Å²	2	76.2 Å²	76.2	1%	0.01	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	102.6	177.9	-61.6	97	0	0	0	109.2	L339 Y342 V356 Y357 V368 R372 T414 L415 V416	L339-L370 HydrophobicContact CD1-CD2 3.76Å; Y342-L370 HydrophobicContact CG-CD2 4.21Å; V356-L370 WeakPolarHBondContact CA-O 3.35Å; Y357-L370 PolarHBondContact N-O 2.92Å; Y357-L370 PolarHBondContact O-N 3.01Å; V368-L370 HydrophobicContact CG2-CD1 3.74Å; V368-L370 HydrophobicContact CG2-CG 4.39Å; L370-R372 PolarHBondContact O-N 3.21Å; L370-T414 HydrophobicContact CB-CG2 3.92Å; L370-T414 HydrophobicContact CD2-CG2 4.16Å; L370-L415 WeakPolarHBondContact CA-O 3.37Å; L370-V416 HydrophobicContact CD2-CG2 4.36Å; L370-V416 HydrophobicContact CG-CG2 4.46Å
371	K	89.2	Confident	80	Confident	46 Å²	46	73.7 Å²	73.7	20%	0.2	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	97.5	175.1	-178.1	161.5	178	172.9	0	109	A354 V356 T414 L415 F417 D481	A354-K371 HydrophobicContact CB-CG 4.07Å; V356-K371 HydrophobicContact CG2-CB 4.25Å; V356-K371 HydrophobicContact CG2-CD 4.2Å; V356-K371 HydrophobicContact CG2-CG 4.03Å; K371-T414 WeakPolarHBondContact O-CA 3.4Å; K371-L415 HydrophobicContact CB-CB 4.44Å; K371-L415 PolarHBondContact N-O 2.93Å; K371-L415 PolarHBondContact O-N 3.5Å; K371-F417 HydrophobicContact CB-CD2 4.42Å; K371-F417 HydrophobicContact CB-CE2 4.14Å; K371-F417 HydrophobicContact CD-CE2 4.46Å; K371-D481 WeakPolarHBondContact CD-OD1 3.49Å; K371-D481 IonicContact NZ-OD1 2.74Å; K371-D481 PolarHBondContact NZ-OD1 3.06Å; K371-D481 IonicContact NZ-OD2 2.72Å; K371-D481 PolarHBondContact NZ-OD2 3.16Å
372	R	88.3	Confident	78.2	Confident	104 Å²	104	76.4 Å²	76.4	39%	0.392	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	107.6	-179.2	-175	174.2	-170.7	-160.7	4	110.2	A354 T355 L370 S412 T414	A354-R372 VanDerWaalsContact CA-O 3.28Å; A354-R372 WeakPolarHBondContact CA-O 3.37Å; T355-R372 PolarHBondContact N-O 2.96Å; T355-R372 PolarHBondContact O-N 2.88Å; L370-R372 PolarHBondContact O-N 3.21Å; R372-S412 PolarHBondContact NE-OG 3.07Å; R372-S412 PolarHBondContact NH2-OG 2.71Å; R372-T414 HydrophobicContact CB-CG2 4.38Å
373	I	82.7	Confident	76.6	Confident	38 Å²	38	77.8 Å²	77.8	20%	0.195	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	133	176	-55.2	169.3	0	0	0	108.5	Y353 A354 M375 S412 L413 L415	Y353-I373 WeakPolarHBondContact O-CA 3.46Å; A354-I373 HydrophobicContact CB-CG1 4.09Å; I373-M375 HydrophobicContact CB-SD 4.42Å; I373-M375 HydrophobicContact CG2-SD 3.87Å; I373-S412 WeakPolarHBondContact O-CA 3.47Å; I373-S412 WeakPolarHBondContact O-CB 3.41Å; I373-L413 HydrophobicContact CB-CB 4.48Å; I373-L413 WeakPolarHBondContact CB-O 3.39Å; I373-L413 HydrophobicContact CD1-CD2 4.39Å; I373-L413 PolarHBondContact N-O 3.09Å; I373-L413 PolarHBondContact O-N 3.28Å; I373-L415 HydrophobicContact CD1-CD1 4.12Å; I373-L415 HydrophobicContact CD1-CG 4.3Å
374	R	74.1	Confident	75.3	Confident	141 Å²	141	79.7 Å²	79.7	53%	0.532	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	120.6	176.1	-63.5	179.3	-178.5	144.4	8.8	109	E350 Y353 T355	E350-R374 IonicContact OE1-CZ 3.86Å; E350-R374 IonicContact OE1-NH1 2.67Å; E350-R374 PolarHBondContact OE1-NH1 2.96Å; E350-R374 IonicContact OE1-NH2 2.67Å; E350-R374 PolarHBondContact OE1-NH2 2.97Å; Y353-R374 PolarHBondContact O-N 3.47Å; Y353-R374 VanDerWaalsContact O-N 3.1Å; T355-R374 PolarHBondContact OG1-NH2 3.08Å
375	M	71.6	Confident	74	Confident	45 Å²	45	79.4 Å²	79.4	22%	0.222	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-91.1	141.5	178.2	-51.9	-45.8	-55.8	0	0	110.9	I373 G380 A381 G411 L413	I373-M375 HydrophobicContact CB-SD 4.42Å; I373-M375 HydrophobicContact CG2-SD 3.87Å; M375-G380 WeakPolarHBondContact CE-O 3.36Å; M375-A381 HydrophobicContact CE-CB 3.99Å; M375-A381 HydrophobicContact CG-CB 4.47Å; M375-A381 HydrophobicContact SD-CB 4.47Å; M375-G411 WeakPolarHBondContact CB-O 3.44Å; M375-G411 PolarHBondContact N-O 3Å; M375-L413 HydrophobicContact SD-CB 4.01Å
376	R	66.5	Low	72.8	Confident	179 Å²	179	75.1 Å²	75.1	68%	0.675	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-72.1	136.1	170.6	-72.4	177.8	170.9	174.4	-4.4	109.4	S378 E379 G380	R376-S378 PolarHBondContact O-N 3.22Å; R376-E379 HydrophobicContact CB-CB 4.31Å; R376-E379 PolarHBondContact O-N 3.38Å; R376-G380 PolarHBondContact O-N 3.4Å
377	K	60.5	Low	71.4	Confident	222 Å²	222	78.4 Å²	78.4	97%	0.965	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-31.4	-173.8	-71.4	-175.1	178	-179.8	0	113.8
378	S	55.1	Low	69.9	Low	118 Å²	118	77.4 Å²	77.4	83%	0.825	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-22.6	-178.3	46.4	0	0	0	0	114.8	R376	R376-S378 PolarHBondContact O-N 3.22Å
379	E	54.7	Low	68.7	Low	124 Å²	124	78.9 Å²	78.9	58%	0.579	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-17	-167.4	-158.5	174.5	176.2	0	0	112.3	R376	R376-E379 HydrophobicContact CB-CB 4.31Å; R376-E379 PolarHBondContact O-N 3.38Å
380	G	55.3	Low	67.3	Low	28 Å²	28	80.5 Å²	80.5	29%	0.289	40%	0.404	S	S	.	.			trans	60	-146.4	-173.2	0	0	0	0	0	111.5	M375 R376	M375-G380 WeakPolarHBondContact CE-O 3.36Å; R376-G380 PolarHBondContact O-N 3.4Å
381	A	56.4	Low	66	Low	12 Å²	12	85.2 Å²	85.2	10%	0.099	43%	0.429	C	S	.	.			trans	-117.4	110.4	159.3	0	0	0	0	0	107	M375 C383 I386 Y408	M375-A381 HydrophobicContact CE-CB 3.99Å; M375-A381 HydrophobicContact CG-CB 4.47Å; M375-A381 HydrophobicContact SD-CB 4.47Å; A381-C383 PolarHBondContact O-N 3.16Å; A381-I386 HydrophobicContact CB-CD1 3.82Å; A381-I386 HydrophobicContact CB-CG1 4.12Å; A381-Y408 HydrophobicContact CB-CD2 4.22Å; A381-Y408 HydrophobicContact CB-CE2 3.62Å
382	P	56.8	Low	65.2	Low	58 Å²	58	84.2 Å²	84.2	38%	0.377	43%	0.426	S	S	.	.			trans	-58.8	130.7	-177.1	21.7	-31.4	0	0	0	109.3	T384 A385 I386	P382-T384 PolarHBondContact O-N 2.91Å; P382-T384 VanDerWaalsContact O-N 3.08Å; P382-A385 HydrophobicContact CG-CB 4.02Å; P382-A385 WeakPolarHBondContact O-CB 3.02Å; P382-A385 PolarHBondContact O-N 3.25Å; P382-I386 PolarHBondContact O-N 3.13Å
383	C	59	Low	64.7	Low	107 Å²	107	83.4 Å²	83.4	72%	0.723	42%	0.423	S	S	*	.	H	α-helix	trans	-63.3	-22.8	-169.8	-58.8	0	0	0	0	112.8	A381 R387	A381-C383 PolarHBondContact O-N 3.16Å; C383-R387 VanDerWaalsContact O-CB 3.27Å; C383-R387 WeakPolarHBondContact O-CB 3.41Å; C383-R387 PolarHBondContact O-N 3.24Å
384	T	60.6	Low	64.5	Low	88 Å²	88	84 Å²	84	54%	0.54	44%	0.438	S	S	.	.	H	α-helix	trans	-57.2	-53	166.8	45.7	0	0	0	0	111.7	P382 I386 R387 E388	P382-T384 PolarHBondContact O-N 2.91Å; P382-T384 VanDerWaalsContact O-N 3.08Å; T384-I386 PolarHBondContact O-N 2.97Å; T384-R387 CarbonylContact O-C 3.58Å; T384-R387 WeakPolarHBondContact O-CA 3.49Å; T384-R387 WeakPolarHBondContact O-CB 3.38Å; T384-R387 PolarHBondContact O-N 3.1Å; T384-E388 WeakPolarHBondContact O-CB 3.44Å; T384-E388 WeakPolarHBondContact O-CG 3.48Å; T384-E388 PolarHBondContact O-N 3.27Å
385	A	61.6	Low	65.1	Low	30 Å²	30	77.7 Å²	77.7	25%	0.248	42%	0.415	C	S	.	.	H	α-helix	trans	-61.8	-40.5	179.2	0	0	0	0	0	112.9	P382 R387 E388 I389	P382-A385 HydrophobicContact CG-CB 4.02Å; P382-A385 WeakPolarHBondContact O-CB 3.02Å; P382-A385 PolarHBondContact O-N 3.25Å; A385-R387 VanDerWaalsContact C-N 3.28Å; A385-R387 PolarHBondContact O-N 3.13Å; A385-E388 PolarHBondContact O-N 3.44Å; A385-I389 WeakPolarHBondContact O-CB 3.49Å; A385-I389 WeakPolarHBondContact O-CD1 3.11Å; A385-I389 WeakPolarHBondContact O-CG1 3.02Å; A385-I389 PolarHBondContact O-N 3.36Å
386	I	67.3	Low	66	Low	43 Å²	43	77.6 Å²	77.6	22%	0.221	42%	0.416	C	S	.	.	H	α-helix	trans	-63.1	-37.6	173.6	-63.2	-179.6	0	0	0	110.8	A381 P382 T384 S390 Y408 L413	A381-I386 HydrophobicContact CB-CD1 3.82Å; A381-I386 HydrophobicContact CB-CG1 4.12Å; P382-I386 PolarHBondContact O-N 3.13Å; T384-I386 PolarHBondContact O-N 2.97Å; I386-S390 VanDerWaalsContact O-CB 3.31Å; I386-S390 WeakPolarHBondContact O-CB 3.43Å; I386-S390 PolarHBondContact O-N 2.83Å; I386-S390 PolarHBondContact O-OG 2.5Å; I386-Y408 HydrophobicContact CD1-CD2 4.19Å; I386-Y408 HydrophobicContact CD1-CG 4.46Å; I386-L413 HydrophobicContact CG1-CD1 4.34Å; I386-L413 HydrophobicContact CG1-CD2 4.42Å
387	R	62.5	Low	67.3	Low	170 Å²	170	69.7 Å²	69.7	64%	0.642	39%	0.386	S	S	*	.	H	α-helix	trans	-70.4	-44.4	178.4	-164.6	177.6	-165.3	162.7	0.2	111.8	C383 T384 A385 S390 L391	C383-R387 VanDerWaalsContact O-CB 3.27Å; C383-R387 WeakPolarHBondContact O-CB 3.41Å; C383-R387 PolarHBondContact O-N 3.24Å; T384-R387 CarbonylContact O-C 3.58Å; T384-R387 WeakPolarHBondContact O-CA 3.49Å; T384-R387 WeakPolarHBondContact O-CB 3.38Å; T384-R387 PolarHBondContact O-N 3.1Å; A385-R387 VanDerWaalsContact C-N 3.28Å; A385-R387 PolarHBondContact O-N 3.13Å; R387-S390 CarbonylContact O-C 3.24Å; R387-S390 WeakPolarHBondContact O-CA 3.32Å; R387-S390 WeakPolarHBondContact O-CB 3.35Å; R387-S390 PolarHBondContact O-N 3.21Å; R387-S390 VanDerWaalsContact O-N 3.13Å; R387-L391 PolarHBondContact O-N 2.87Å; R387-L391 VanDerWaalsContact O-N 3.09Å
388	E	62.9	Low	68.9	Low	55 Å²	55	59.7 Å²	59.7	26%	0.257	35%	0.345	S	S	.	.	H	α-helix	trans	-57.7	-51.6	173	-73.6	160	-136.4	0	0	110.9	T384 A385 S390 L391 R486	T384-E388 WeakPolarHBondContact O-CB 3.44Å; T384-E388 WeakPolarHBondContact O-CG 3.48Å; T384-E388 PolarHBondContact O-N 3.27Å; A385-E388 PolarHBondContact O-N 3.44Å; E388-S390 PolarHBondContact O-N 3.11Å; E388-L391 VanDerWaalsContact O-CB 3.25Å; E388-L391 WeakPolarHBondContact O-CB 3.24Å; E388-L391 PolarHBondContact O-N 2.75Å; E388-R486 WeakPolarHBondContact OE2-CG 3.29Å; E388-R486 IonicContact OE2-NE 3.16Å; E388-R486 PolarHBondContact OE2-NE 3.32Å
389	I	69.3	Low	70.9	Confident	31 Å²	31	54 Å²	54	16%	0.159	31%	0.306	C	S	.	.	H	α-helix	trans	-62.2	-31.6	175.2	-66.4	164.5	0	0	0	111.3	A385 L391 L392 L403 V406 L413 L415	A385-I389 WeakPolarHBondContact O-CB 3.49Å; A385-I389 WeakPolarHBondContact O-CD1 3.11Å; A385-I389 WeakPolarHBondContact O-CG1 3.02Å; A385-I389 PolarHBondContact O-N 3.36Å; I389-L391 VanDerWaalsContact C-N 3.29Å; I389-L391 PolarHBondContact O-N 3.23Å; I389-L392 WeakPolarHBondContact O-CB 3.08Å; I389-L392 PolarHBondContact O-N 3.14Å; I389-L392 VanDerWaalsContact O-N 3.15Å; I389-L403 HydrophobicContact CG2-CD2 3.99Å; I389-L403 WeakPolarHBondContact O-CD2 3.17Å; I389-V406 HydrophobicContact CG2-CG2 4.19Å; I389-L413 HydrophobicContact CD1-CD2 3.81Å; I389-L415 HydrophobicContact CD1-CD1 4.47Å; I389-L415 HydrophobicContact CG2-CD1 3.94Å; I389-L415 HydrophobicContact CG2-CD2 3.63Å; I389-L415 HydrophobicContact CG2-CG 4.45Å
390	S	65.2	Low	72.7	Confident	49 Å²	49	48.2 Å²	48.2	34%	0.343	28%	0.278	S	S	.	.	H	α-helix	trans	-69.3	-22.9	173.5	-61.9	0	0	0	0	113.4	I386 R387 E388 L392 R393	I386-S390 VanDerWaalsContact O-CB 3.31Å; I386-S390 WeakPolarHBondContact O-CB 3.43Å; I386-S390 PolarHBondContact O-N 2.83Å; I386-S390 PolarHBondContact O-OG 2.5Å; R387-S390 CarbonylContact O-C 3.24Å; R387-S390 WeakPolarHBondContact O-CA 3.32Å; R387-S390 WeakPolarHBondContact O-CB 3.35Å; R387-S390 PolarHBondContact O-N 3.21Å; R387-S390 VanDerWaalsContact O-N 3.13Å; E388-S390 PolarHBondContact O-N 3.11Å; S390-L392 VanDerWaalsContact C-N 3.29Å; S390-R393 WeakPolarHBondContact O-CB 3.27Å; S390-R393 PolarHBondContact O-N 2.78Å
391	L	66.7	Low	74.5	Confident	101 Å²	101	47.5 Å²	47.5	53%	0.529	27%	0.268	S	S	.	.	H	α-helix	trans	-66.6	-32.4	169.9	-56.3	178.7	0	0	0	111.3	R387 E388 I389 R393 G394	R387-L391 PolarHBondContact O-N 2.87Å; R387-L391 VanDerWaalsContact O-N 3.09Å; E388-L391 VanDerWaalsContact O-CB 3.25Å; E388-L391 WeakPolarHBondContact O-CB 3.24Å; E388-L391 PolarHBondContact O-N 2.75Å; I389-L391 VanDerWaalsContact C-N 3.29Å; I389-L391 PolarHBondContact O-N 3.23Å; L391-R393 PolarHBondContact O-N 3.3Å; L391-G394 WeakPolarHBondContact O-CA 3.3Å; L391-G394 PolarHBondContact O-N 3.44Å
392	L	72.9	Confident	76.2	Confident	26 Å²	26	50.4 Å²	50.4	14%	0.136	28%	0.279	C	S	.	.	H	α-helix	trans	-64.6	-21.9	175.8	-53.3	177.3	0	0	0	112.6	I389 S390 G394 L395 L403 A485	I389-L392 WeakPolarHBondContact O-CB 3.08Å; I389-L392 PolarHBondContact O-N 3.14Å; I389-L392 VanDerWaalsContact O-N 3.15Å; S390-L392 VanDerWaalsContact C-N 3.29Å; L392-G394 PolarHBondContact O-N 3.17Å; L392-L395 HydrophobicContact CB-CD1 4.5Å; L392-L395 HydrophobicContact CD2-CD1 3.85Å; L392-L395 WeakPolarHBondContact O-CB 3.46Å; L392-L395 PolarHBondContact O-N 3.43Å; L392-L395 VanDerWaalsContact O-N 3.08Å; L392-L403 HydrophobicContact CB-CD2 4.03Å; L392-A485 HydrophobicContact CD2-CB 4.05Å
393	R	77.2	Confident	77.7	Confident	87 Å²	87	48 Å²	48	33%	0.328	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-16.5	169.3	-56.9	-177.6	75.6	152.9	3.2	112.8	S390 L391 L403 H404 D405 V406	S390-R393 WeakPolarHBondContact O-CB 3.27Å; S390-R393 PolarHBondContact O-N 2.78Å; L391-R393 PolarHBondContact O-N 3.3Å; R393-L403 HydrophobicContact CG-CB 4.49Å; R393-L403 HydrophobicContact CG-CD2 3.67Å; R393-L403 HydrophobicContact CG-CG 3.92Å; R393-H404 PolarHBondContact NH2-O 2.77Å; R393-D405 IonicContact CZ-OD1 2.62Å; R393-D405 IonicContact NH1-OD1 2.73Å; R393-D405 PolarHBondContact NH1-OD1 2.84Å; R393-D405 IonicContact NH2-OD1 3.16Å; R393-D405 PolarHBondContact NH2-OD1 2.84Å; R393-V406 HydrophobicContact CG-CG2 4.39Å
394	G	79.4	Confident	79.1	Confident	50 Å²	50	45.2 Å²	45.2	52%	0.515	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-8	172.8	0	0	0	0	0	114.2	L391 L392 N396	L391-G394 WeakPolarHBondContact O-CA 3.3Å; L391-G394 PolarHBondContact O-N 3.44Å; L392-G394 PolarHBondContact O-N 3.17Å; G394-N396 PolarHBondContact O-N 2.84Å
395	L	85.9	Confident	80.4	Confident	9 Å²	9	41.2 Å²	41.2	5%	0.047	21%	0.214	C	C	.	.			trans	-79.1	114.8	172.1	-62.2	176.9	0	0	0	109.4	L392 I400 Y453 K457 I459 F482	L392-L395 HydrophobicContact CB-CD1 4.5Å; L392-L395 HydrophobicContact CD2-CD1 3.85Å; L392-L395 WeakPolarHBondContact O-CB 3.46Å; L392-L395 PolarHBondContact O-N 3.43Å; L392-L395 VanDerWaalsContact O-N 3.08Å; L395-I400 HydrophobicContact CB-CG2 4.26Å; L395-I400 HydrophobicContact CD1-CG2 4.38Å; L395-Y453 HydrophobicContact CB-CE1 4.49Å; L395-Y453 HydrophobicContact CD2-CD1 4.23Å; L395-Y453 HydrophobicContact CD2-CE1 3.79Å; L395-K457 HydrophobicContact CD2-CD 3.78Å; L395-I459 HydrophobicContact CD2-CD1 3.92Å; L395-F482 HydrophobicContact CD1-CE1 4.4Å; L395-F482 HydrophobicContact CD1-CE2 4.35Å; L395-F482 HydrophobicContact CD1-CZ 4.06Å
396	N	90.3	Very high	81.6	Confident	43 Å²	43	40.9 Å²	40.9	23%	0.23	21%	0.209	C	C	.	.			trans	-136.7	89.7	176.8	-162.8	25.3	0	0	0	109.5	G394 K402 Y453 P687 E688	G394-N396 PolarHBondContact O-N 2.84Å; N396-K402 VanDerWaalsContact CG-NZ 3.33Å; N396-K402 PolarHBondContact ND2-NZ 3.29Å; N396-K402 WeakPolarHBondContact OD1-CE 2.95Å; N396-K402 PolarHBondContact OD1-NZ 3.2Å; N396-Y453 PolarHBondContact N-OH 3.35Å; N396-Y453 PolarHBondContact O-OH 3.3Å; N396-P687 WeakPolarHBondContact O-CB 3.43Å; N396-E688 PolarHBondContact ND2-OE1 3.22Å; N396-E688 PolarHBondContact ND2-OE2 2.98Å
397	H	93.9	Very high	82.5	Confident	12 Å²	12	38.9 Å²	38.9	6%	0.056	20%	0.199	C	C	.	.			trans	-142.1	144.4	-177	-176.5	-102.6	0	0	0	109.1	N399 I400 R449 Y453 P687	H397-N399 PolarHBondContact CE1-OD1 3.26Å; H397-N399 PolarHBondContact ND1-N 3.42Å; H397-N399 VanDerWaalsContact ND1-N 3.17Å; H397-N399 PolarHBondContact O-N 2.67Å; H397-I400 HydrophobicContact CB-CB 4.15Å; H397-I400 HydrophobicContact CB-CD1 3.78Å; H397-I400 HydrophobicContact CB-CG1 3.92Å; H397-I400 PolarHBondContact O-N 3.13Å; H397-I400 VanDerWaalsContact O-N 3.14Å; H397-R449 VanDerWaalsContact CE1-C 3.5Å; H397-R449 PolarHBondContact CE1-O 3.19Å; H397-Y453 HydrophobicContact CB-CD1 3.85Å; H397-Y453 HydrophobicContact CB-CD2 4.19Å; H397-Y453 HydrophobicContact CB-CE1 3.99Å; H397-Y453 HydrophobicContact CB-CE2 4.32Å; H397-Y453 HydrophobicContact CB-CG 3.94Å; H397-Y453 AromaticContact CD2-CD2 3.87Å; H397-Y453 AromaticContact CD2-CG 3.98Å; H397-Y453 AromaticContact CG-CG 3.98Å; H397-P687 CarbonylContact C-O 3.57Å; H397-P687 WeakPolarHBondContact CA-O 3.47Å; H397-P687 PolarHBondContact CD2-O 2.76Å
398	A	94.3	Very high	83.5	Confident	12 Å²	12	36.7 Å²	36.7	10%	0.099	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-33	-175.3	0	0	0	0	0	112.5	K478 P687 Q689	A398-K478 WeakPolarHBondContact O-CE 3.41Å; A398-K478 WeakPolarHBondContact O-CG 3.41Å; A398-P687 PolarHBondContact N-O 3.25Å; A398-Q689 WeakPolarHBondContact CB-O 3.32Å
399	N	96.1	Very high	84.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	24.1	180	-52.2	107.1	0	0	0	113.4	H397 Q446 R449 L477 K478 L479	H397-N399 PolarHBondContact CE1-OD1 3.26Å; H397-N399 PolarHBondContact ND1-N 3.42Å; H397-N399 VanDerWaalsContact ND1-N 3.17Å; H397-N399 PolarHBondContact O-N 2.67Å; N399-Q446 VanDerWaalsContact CB-O 3.27Å; N399-Q446 WeakPolarHBondContact CB-O 3.31Å; N399-Q446 WeakPolarHBondContact ND2-CB 3.42Å; N399-Q446 WeakPolarHBondContact ND2-CG 3.25Å; N399-Q446 PolarHBondContact ND2-OE1 3.23Å; N399-R449 PolarHBondContact OD1-NH1 2.9Å; N399-L477 WeakPolarHBondContact CA-O 3.14Å; N399-L477 WeakPolarHBondContact CB-O 3.07Å; N399-L477 PolarHBondContact ND2-O 3.31Å; N399-K478 WeakPolarHBondContact O-CA 3.49Å; N399-L479 WeakPolarHBondContact O-CG 3.32Å; N399-L479 PolarHBondContact O-N 3.29Å
400	I	94.1	Very high	84.7	Confident	2 Å²	2	41 Å²	41	1%	0.01	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-129.8	137	173.3	-62.4	178.9	0	0	0	108.5	L395 H397 K402 Y453 C454 F482	L395-I400 HydrophobicContact CB-CG2 4.26Å; L395-I400 HydrophobicContact CD1-CG2 4.38Å; H397-I400 HydrophobicContact CB-CB 4.15Å; H397-I400 HydrophobicContact CB-CD1 3.78Å; H397-I400 HydrophobicContact CB-CG1 3.92Å; H397-I400 PolarHBondContact O-N 3.13Å; H397-I400 VanDerWaalsContact O-N 3.14Å; I400-K402 PolarHBondContact O-N 2.93Å; I400-Y453 HydrophobicContact CD1-CD1 3.54Å; I400-Y453 HydrophobicContact CD1-CE1 4.17Å; I400-Y453 HydrophobicContact CD1-CG 4.38Å; I400-C454 WeakPolarHBondContact CD1-SG 3.5Å; I400-F482 HydrophobicContact CG2-CE2 3.75Å; I400-F482 HydrophobicContact CG2-CZ 3.84Å
401	V	92.5	Very high	85.1	Confident	13 Å²	13	40.6 Å²	40.6	8%	0.079	23%	0.233	C	C	.	.			trans	-70.1	117.3	175.9	174.5	0	0	0	0	110.3	L403 F417 E418 L470 K478 L479 A480	V401-L403 PolarHBondContact O-N 3.42Å; V401-F417 HydrophobicContact CG1-CB 3.83Å; V401-F417 HydrophobicContact CG1-CD1 3.9Å; V401-F417 HydrophobicContact CG1-CG 4.17Å; V401-E418 HydrophobicContact CG1-CG 3.94Å; V401-L470 HydrophobicContact CG2-CD1 4.1Å; V401-K478 HydrophobicContact CG2-CB 3.61Å; V401-K478 HydrophobicContact CG2-CD 4.26Å; V401-L479 WeakPolarHBondContact CG2-O 3.26Å; V401-L479 PolarHBondContact N-O 3.34Å; V401-A480 HydrophobicContact CB-CB 4.21Å; V401-A480 HydrophobicContact CG2-CB 3.58Å
402	K	91.2	Very high	85.7	Confident	73 Å²	73	36 Å²	36	32%	0.317	21%	0.21	S	C	.	.			trans	-72.4	118.9	-175.5	-168.7	163.5	-170.1	157.8	0	112.4	N396 I400 H404 F417 E418	N396-K402 VanDerWaalsContact CG-NZ 3.33Å; N396-K402 PolarHBondContact ND2-NZ 3.29Å; N396-K402 WeakPolarHBondContact OD1-CE 2.95Å; N396-K402 PolarHBondContact OD1-NZ 3.2Å; I400-K402 PolarHBondContact O-N 2.93Å; K402-H404 PolarHBondContact O-N 3.33Å; K402-F417 CarbonylContact O-C 3.44Å; K402-F417 WeakPolarHBondContact O-CA 3.45Å; K402-E418 HydrophobicContact CB-CG 4.21Å; K402-E418 VanDerWaalsContact CB-OE1 3.31Å; K402-E418 WeakPolarHBondContact CB-OE1 3.36Å; K402-E418 PolarHBondContact N-OE1 2.99Å; K402-E418 PolarHBondContact O-N 3.44Å
403	L	89.5	Confident	86.3	Confident	8 Å²	8	35 Å²	35	4%	0.042	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	99.8	167.2	-178.3	61	0	0	0	109.5	I389 L392 R393 V401 D405 V406 L415 F417	I389-L403 HydrophobicContact CG2-CD2 3.99Å; I389-L403 WeakPolarHBondContact O-CD2 3.17Å; L392-L403 HydrophobicContact CB-CD2 4.03Å; R393-L403 HydrophobicContact CG-CB 4.49Å; R393-L403 HydrophobicContact CG-CD2 3.67Å; R393-L403 HydrophobicContact CG-CG 3.92Å; V401-L403 PolarHBondContact O-N 3.42Å; L403-D405 WeakPolarHBondContact CD1-O 3.41Å; L403-V406 HydrophobicContact CD1-CG2 4.34Å; L403-V406 HydrophobicContact CD2-CG2 3.93Å; L403-V406 HydrophobicContact CG-CG2 4.31Å; L403-L415 HydrophobicContact CD1-CB 3.96Å; L403-F417 HydrophobicContact CB-CD1 4.01Å; L403-F417 HydrophobicContact CB-CE1 3.9Å; L403-F417 HydrophobicContact CD1-CD1 3.95Å; L403-F417 HydrophobicContact CD1-CE1 3.75Å; L403-F417 HydrophobicContact CD1-CE2 4.33Å; L403-F417 HydrophobicContact CD1-CG 4.34Å; L403-F417 HydrophobicContact CD1-CZ 3.95Å; L403-F417 HydrophobicContact CG-CE1 4.32Å
404	H	88.1	Confident	86.8	Confident	48 Å²	48	31 Å²	31	22%	0.222	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	-48.3	177.6	-68.8	-51.2	0	0	0	112	R393 K402 V416 E418	R393-H404 PolarHBondContact NH2-O 2.77Å; K402-H404 PolarHBondContact O-N 3.33Å; H404-V416 WeakPolarHBondContact CA-O 3.42Å; H404-V416 HydrophobicContact CB-CG1 4.48Å; H404-V416 WeakPolarHBondContact CB-O 3.47Å; H404-V416 PolarHBondContact N-O 3.11Å; H404-E418 PolarHBondContact CD2-N 2.78Å; H404-E418 WeakPolarHBondContact NE2-CB 3.33Å
405	D	87.5	Confident	87.2	Confident	4 Å²	4	29.2 Å²	29.2	2%	0.021	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	163.5	-174.3	-149.5	14.1	0	0	0	115.2	Y336 G337 R393 L403 V416	Y336-D405 WeakPolarHBondContact CA-OD2 3.5Å; Y336-D405 WeakPolarHBondContact CB-OD2 3.47Å; Y336-D405 HydrophobicContact CD1-CB 4.29Å; Y336-D405 WeakPolarHBondContact CD1-OD2 3.46Å; G337-D405 PolarHBondContact N-OD2 3.48Å; R393-D405 IonicContact CZ-OD1 2.62Å; R393-D405 IonicContact NH1-OD1 2.73Å; R393-D405 PolarHBondContact NH1-OD1 2.84Å; R393-D405 IonicContact NH2-OD1 3.16Å; R393-D405 PolarHBondContact NH2-OD1 2.84Å; L403-D405 WeakPolarHBondContact CD1-O 3.41Å; D405-V416 HydrophobicContact CB-CB 4.1Å; D405-V416 HydrophobicContact CB-CG2 4.38Å; D405-V416 PolarHBondContact N-O 3.07Å; D405-V416 VanDerWaalsContact N-O 3.08Å; D405-V416 PolarHBondContact O-N 3.4Å
406	V	86.5	Confident	87.5	Confident	22 Å²	22	28.8 Å²	28.8	13%	0.133	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	118.5	179.1	179.8	0	0	0	0	107.5	I389 R393 L403 L413 L415	I389-V406 HydrophobicContact CG2-CG2 4.19Å; R393-V406 HydrophobicContact CG-CG2 4.39Å; L403-V406 HydrophobicContact CD1-CG2 4.34Å; L403-V406 HydrophobicContact CD2-CG2 3.93Å; L403-V406 HydrophobicContact CG-CG2 4.31Å; V406-L413 HydrophobicContact CG1-CD1 3.74Å; V406-L415 HydrophobicContact CG1-CD2 3.98Å; V406-L415 HydrophobicContact CG2-CD2 4.18Å
407	I	87	Confident	87.5	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	128.6	-176.5	-52.3	169.1	0	0	0	107.7	L339 Y342 E409 T414 V416	L339-I407 HydrophobicContact CB-CG2 4.47Å; L339-I407 HydrophobicContact CD1-CD1 4.26Å; Y342-I407 HydrophobicContact CD2-CD1 3.78Å; Y342-I407 HydrophobicContact CE2-CD1 3.64Å; I407-E409 HydrophobicContact CG2-CG 4.23Å; I407-T414 PolarHBondContact N-O 3.46Å; I407-T414 PolarHBondContact O-N 3.11Å; I407-V416 HydrophobicContact CD1-CG2 3.68Å; I407-V416 HydrophobicContact CG1-CG2 4.19Å
408	Y	82.9	Confident	87.5	Confident	124 Å²	124	29.4 Å²	29.4	49%	0.486	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	123.5	175.5	-180	-106	0	0	0	109.9	A381 I386 L413	A381-Y408 HydrophobicContact CB-CD2 4.22Å; A381-Y408 HydrophobicContact CB-CE2 3.62Å; I386-Y408 HydrophobicContact CD1-CD2 4.19Å; I386-Y408 HydrophobicContact CD1-CG 4.46Å; Y408-L413 HydrophobicContact CD2-CD1 4.22Å
409	E	81.6	Confident	87.4	Confident	69 Å²	69	32.3 Å²	32.3	32%	0.322	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	160.3	175.7	-65.8	179.7	160.3	0	0	108.7	L339 I407 G411 S412	L339-E409 WeakPolarHBondContact CB-OE1 3.36Å; I407-E409 HydrophobicContact CG2-CG 4.23Å; E409-G411 PolarHBondContact O-N 3.21Å; E409-S412 PolarHBondContact N-O 2.73Å; E409-S412 PolarHBondContact O-N 3.31Å; E409-S412 VanDerWaalsContact O-O 3.09Å
410	A	76.4	Confident	86.7	Confident	107 Å²	107	32.6 Å²	32.6	88%	0.884	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	107.4	-176.5	0	0	0	0	0	111.5
411	G	72.5	Confident	86.5	Confident	42 Å²	42	33.7 Å²	33.7	43%	0.433	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.4	0.7	-178.6	0	0	0	0	0	116.8	M375 E409	M375-G411 WeakPolarHBondContact CB-O 3.44Å; M375-G411 PolarHBondContact N-O 3Å; E409-G411 PolarHBondContact O-N 3.21Å
412	S	80.1	Confident	86.4	Confident	5 Å²	5	35 Å²	35	4%	0.035	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	134.3	173.4	64.9	0	0	0	0	115	R372 I373 E409	R372-S412 PolarHBondContact NE-OG 3.07Å; R372-S412 PolarHBondContact NH2-OG 2.71Å; I373-S412 WeakPolarHBondContact O-CA 3.47Å; I373-S412 WeakPolarHBondContact O-CB 3.41Å; E409-S412 PolarHBondContact N-O 2.73Å; E409-S412 PolarHBondContact O-N 3.31Å; E409-S412 VanDerWaalsContact O-O 3.09Å
413	L	84.4	Confident	86.6	Confident	5 Å²	5	33.1 Å²	33.1	3%	0.026	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	120	172.8	-179.3	67.1	0	0	0	108.8	I373 M375 I386 I389 V406 Y408 L415	I373-L413 HydrophobicContact CB-CB 4.48Å; I373-L413 WeakPolarHBondContact CB-O 3.39Å; I373-L413 HydrophobicContact CD1-CD2 4.39Å; I373-L413 PolarHBondContact N-O 3.09Å; I373-L413 PolarHBondContact O-N 3.28Å; M375-L413 HydrophobicContact SD-CB 4.01Å; I386-L413 HydrophobicContact CG1-CD1 4.34Å; I386-L413 HydrophobicContact CG1-CD2 4.42Å; I389-L413 HydrophobicContact CD1-CD2 3.81Å; V406-L413 HydrophobicContact CG1-CD1 3.74Å; Y408-L413 HydrophobicContact CD2-CD1 4.22Å; L413-L415 HydrophobicContact CD1-CD2 4.46Å; L413-L415 HydrophobicContact CD2-CD2 4.27Å; L413-L415 HydrophobicContact CG-CD2 4.01Å
414	T	88.6	Confident	86.9	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.012	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	120.2	179.9	-55.7	0	0	0	0	110.7	L370 K371 R372 I407	L370-T414 HydrophobicContact CB-CG2 3.92Å; L370-T414 HydrophobicContact CD2-CG2 4.16Å; K371-T414 WeakPolarHBondContact O-CA 3.4Å; R372-T414 HydrophobicContact CB-CG2 4.38Å; I407-T414 PolarHBondContact N-O 3.46Å; I407-T414 PolarHBondContact O-N 3.11Å
415	L	88.3	Confident	87.2	Confident	13 Å²	13	32 Å²	32	7%	0.068	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	124.9	176.9	-49.6	-171.3	0	0	0	109	L370 K371 I373 I389 L403 V406 L413 F417	L370-L415 WeakPolarHBondContact CA-O 3.37Å; K371-L415 HydrophobicContact CB-CB 4.44Å; K371-L415 PolarHBondContact N-O 2.93Å; K371-L415 PolarHBondContact O-N 3.5Å; I373-L415 HydrophobicContact CD1-CD1 4.12Å; I373-L415 HydrophobicContact CD1-CG 4.3Å; I389-L415 HydrophobicContact CD1-CD1 4.47Å; I389-L415 HydrophobicContact CG2-CD1 3.94Å; I389-L415 HydrophobicContact CG2-CD2 3.63Å; I389-L415 HydrophobicContact CG2-CG 4.45Å; L403-L415 HydrophobicContact CD1-CB 3.96Å; V406-L415 HydrophobicContact CG1-CD2 3.98Å; V406-L415 HydrophobicContact CG2-CD2 4.18Å; L413-L415 HydrophobicContact CD1-CD2 4.46Å; L413-L415 HydrophobicContact CD2-CD2 4.27Å; L413-L415 HydrophobicContact CG-CD2 4.01Å; L415-F417 HydrophobicContact CB-CD2 4.22Å; L415-F417 HydrophobicContact CB-CE2 3.54Å; L415-F417 HydrophobicContact CB-CZ 4.05Å; L415-F417 HydrophobicContact CD1-CE2 4.23Å; L415-F417 HydrophobicContact CD1-CZ 4.15Å
416	V	91.2	Very high	87.5	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	103.9	-177	-175.6	0	0	0	0	109.2	Y342 V368 A369 L370 H404 D405 I407	Y342-V416 HydrophobicContact CD1-CG1 4.17Å; Y342-V416 HydrophobicContact CE1-CG1 3.61Å; Y342-V416 HydrophobicContact CE1-CG2 4.44Å; Y342-V416 HydrophobicContact CE2-CG2 4.33Å; V368-V416 HydrophobicContact CB-CG1 3.85Å; V368-V416 HydrophobicContact CG1-CG1 3.93Å; V368-V416 HydrophobicContact CG2-CG1 4.13Å; A369-V416 WeakPolarHBondContact O-CA 3.4Å; L370-V416 HydrophobicContact CD2-CG2 4.36Å; L370-V416 HydrophobicContact CG-CG2 4.46Å; H404-V416 WeakPolarHBondContact CA-O 3.42Å; H404-V416 HydrophobicContact CB-CG1 4.48Å; H404-V416 WeakPolarHBondContact CB-O 3.47Å; H404-V416 PolarHBondContact N-O 3.11Å; D405-V416 HydrophobicContact CB-CB 4.1Å; D405-V416 HydrophobicContact CB-CG2 4.38Å; D405-V416 PolarHBondContact N-O 3.07Å; D405-V416 VanDerWaalsContact N-O 3.08Å; D405-V416 PolarHBondContact O-N 3.4Å; I407-V416 HydrophobicContact CD1-CG2 3.68Å; I407-V416 HydrophobicContact CG1-CG2 4.19Å
417	F	91.8	Very high	87.9	Confident	28 Å²	28	32.9 Å²	32.9	12%	0.123	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	162.9	177.3	-63.1	-83.5	0	0	0	111.7	V368 A369 K371 V401 K402 L403 L415	V368-F417 CarbonylContact C-O 3.54Å; V368-F417 VanDerWaalsContact CA-O 3.26Å; V368-F417 WeakPolarHBondContact CA-O 3.42Å; V368-F417 VanDerWaalsContact CB-O 3.26Å; V368-F417 WeakPolarHBondContact CB-O 3.42Å; A369-F417 HydrophobicContact CB-CB 4.44Å; A369-F417 PolarHBondContact N-O 3.08Å; A369-F417 PolarHBondContact O-N 3.02Å; K371-F417 HydrophobicContact CB-CD2 4.42Å; K371-F417 HydrophobicContact CB-CE2 4.14Å; K371-F417 HydrophobicContact CD-CE2 4.46Å; V401-F417 HydrophobicContact CG1-CB 3.83Å; V401-F417 HydrophobicContact CG1-CD1 3.9Å; V401-F417 HydrophobicContact CG1-CG 4.17Å; K402-F417 CarbonylContact O-C 3.44Å; K402-F417 WeakPolarHBondContact O-CA 3.45Å; L403-F417 HydrophobicContact CB-CD1 4.01Å; L403-F417 HydrophobicContact CB-CE1 3.9Å; L403-F417 HydrophobicContact CD1-CD1 3.95Å; L403-F417 HydrophobicContact CD1-CE1 3.75Å; L403-F417 HydrophobicContact CD1-CE2 4.33Å; L403-F417 HydrophobicContact CD1-CG 4.34Å; L403-F417 HydrophobicContact CD1-CZ 3.95Å; L403-F417 HydrophobicContact CG-CE1 4.32Å; L415-F417 HydrophobicContact CB-CD2 4.22Å; L415-F417 HydrophobicContact CB-CE2 3.54Å; L415-F417 HydrophobicContact CB-CZ 4.05Å; L415-F417 HydrophobicContact CD1-CE2 4.23Å; L415-F417 HydrophobicContact CD1-CZ 4.15Å
418	E	92.2	Very high	88.3	Confident	40 Å²	40	32.9 Å²	32.9	19%	0.187	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	149.2	161.8	68.3	179.9	132.3	0	0	111	V401 K402 H404 G420 K478	V401-E418 HydrophobicContact CG1-CG 3.94Å; K402-E418 HydrophobicContact CB-CG 4.21Å; K402-E418 VanDerWaalsContact CB-OE1 3.31Å; K402-E418 WeakPolarHBondContact CB-OE1 3.36Å; K402-E418 PolarHBondContact N-OE1 2.99Å; K402-E418 PolarHBondContact O-N 3.44Å; H404-E418 PolarHBondContact CD2-N 2.78Å; H404-E418 WeakPolarHBondContact NE2-CB 3.33Å; E418-G420 PolarHBondContact O-N 3.13Å; E418-K478 IonicContact OE1-NZ 3.77Å; E418-K478 PolarHBondContact OE1-NZ 3.4Å; E418-K478 IonicContact OE2-NZ 2.82Å; E418-K478 PolarHBondContact OE2-NZ 3.14Å
419	Y	92.6	Very high	88.8	Confident	72 Å²	72	34.2 Å²	34.2	28%	0.282	20%	0.199	S	C	.	.			trans	-78.3	105.5	174.6	-175.6	-87.8	0	0	0	110.7	L348 K358 L367 G421	L348-Y419 HydrophobicContact CD1-CD2 4.35Å; L348-Y419 HydrophobicContact CD1-CE2 3.88Å; L348-Y419 HydrophobicContact CD2-CE2 4.2Å; K358-Y419 HydrophobicContact CB-CE2 4.45Å; K358-Y419 HydrophobicContact CD-CE2 3.87Å; K358-Y419 HydrophobicContact CG-CD2 3.93Å; K358-Y419 HydrophobicContact CG-CE2 3.7Å; L367-Y419 HydrophobicContact CB-CG 4.22Å; L367-Y419 PolarHBondContact O-N 3.47Å; Y419-G421 PolarHBondContact O-N 2.98Å
420	G	82.6	Confident	89.3	Confident	6 Å²	6	36.4 Å²	36.4	6%	0.062	21%	0.21	C	C	.	.			trans	-75.2	-17.3	-168.4	0	0	0	0	0	117.4	E418 I471 S472	E418-G420 PolarHBondContact O-N 3.13Å; G420-I471 CarbonylContact O-C 3.59Å; G420-I471 VanDerWaalsContact O-C 3.27Å; G420-S472 VanDerWaalsContact O-CA 3.23Å; G420-S472 WeakPolarHBondContact O-CA 3.47Å; G420-S472 PolarHBondContact O-N 3.5Å
421	G	88.1	Confident	90	Very high	26 Å²	26	33.8 Å²	33.8	27%	0.268	18%	0.178	S	C	.	.			trans	112.4	-127.9	-176.2	0	0	0	0	0	112.9	Y419 I471	Y419-G421 PolarHBondContact O-N 2.98Å; G421-I471 WeakPolarHBondContact CA-O 3.37Å
422	S	92.1	Very high	90.9	Very high	40 Å²	40	38.7 Å²	38.7	28%	0.28	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	158.8	170.4	50.6	0	0	0	0	110.6	L470 I471	S422-L470 CarbonylContact O-C 3.27Å; S422-L470 WeakPolarHBondContact O-CA 3.42Å; S422-I471 PolarHBondContact N-O 3.17Å; S422-I471 PolarHBondContact O-N 3.07Å
423	D	94.3	Very high	91.4	Very high	34 Å²	34	40.9 Å²	40.9	18%	0.182	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	159.1	173.4	69.9	96.7	0	0	0	112.4	K425 S426 Y427 L469 L470	D423-K425 VanDerWaalsContact C-N 3.3Å; D423-K425 PolarHBondContact O-N 3.06Å; D423-K425 WeakPolarHBondContact OD1-CA 3.24Å; D423-K425 VanDerWaalsContact OD1-CB 3.25Å; D423-K425 WeakPolarHBondContact OD1-CB 3.48Å; D423-K425 PolarHBondContact OD1-N 2.82Å; D423-S426 PolarHBondContact O-N 3.09Å; D423-S426 PolarHBondContact OD1-N 3.45Å; D423-S426 PolarHBondContact OD1-OG 2.93Å; D423-S426 WeakPolarHBondContact OD2-CB 3.41Å; D423-S426 PolarHBondContact OD2-OG 3.21Å; D423-Y427 WeakPolarHBondContact O-CB 3.28Å; D423-Y427 PolarHBondContact O-N 2.94Å; D423-L469 CarbonylContact C-O 3.51Å; D423-L469 WeakPolarHBondContact CA-O 3.25Å; D423-L470 HydrophobicContact CB-CD2 4Å
424	L	96.2	Very high	91.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.1	-30.7	-179.2	175.9	67.7	0	0	0	112.8	Y427 M428 L435 F443 P466 L469 I471 I528 M532	L424-Y427 PolarHBondContact O-N 3.24Å; L424-M428 HydrophobicContact CD1-CG 4.19Å; L424-M428 HydrophobicContact CG-CG 4.41Å; L424-M428 HydrophobicContact CG-SD 4.39Å; L424-M428 WeakPolarHBondContact O-CB 3.04Å; L424-M428 VanDerWaalsContact O-CG 3.28Å; L424-M428 WeakPolarHBondContact O-CG 3.49Å; L424-M428 PolarHBondContact O-N 2.95Å; L424-L435 HydrophobicContact CD1-CD1 4.13Å; L424-F443 HydrophobicContact CD1-CD2 3.84Å; L424-F443 HydrophobicContact CD1-CE2 4Å; L424-P466 HydrophobicContact CB-CB 4.08Å; L424-P466 WeakPolarHBondContact CB-O 3.41Å; L424-P466 HydrophobicContact CD2-CB 4.09Å; L424-P466 HydrophobicContact CG-CB 4.1Å; L424-P466 PolarHBondContact N-O 3.09Å; L424-P466 VanDerWaalsContact N-O 3.08Å; L424-L469 HydrophobicContact CB-CB 3.99Å; L424-L469 HydrophobicContact CD2-CB 4.41Å; L424-L469 HydrophobicContact CD2-CD1 3.76Å; L424-L469 PolarHBondContact N-O 3.19Å; L424-I471 HydrophobicContact CB-CD1 4.1Å; L424-I471 HydrophobicContact CD1-CD1 3.79Å; L424-I528 HydrophobicContact CD2-CG2 3.88Å; L424-M532 HydrophobicContact CD1-CG 4.21Å; L424-M532 HydrophobicContact CD1-SD 3.98Å; L424-M532 HydrophobicContact CD2-CG 3.9Å; L424-M532 HydrophobicContact CD2-SD 3.78Å; L424-M532 HydrophobicContact CG-CG 4.47Å
425	K	94	Very high	92	Very high	31 Å²	31	49 Å²	49	14%	0.135	24%	0.236	C	C	.	.	H	α-helix	trans	-69.7	-41.6	177.2	-163.3	60.9	171.9	178.5	0	110.9	D423 R429 P466 Q467 E531	D423-K425 VanDerWaalsContact C-N 3.3Å; D423-K425 PolarHBondContact O-N 3.06Å; D423-K425 WeakPolarHBondContact OD1-CA 3.24Å; D423-K425 VanDerWaalsContact OD1-CB 3.25Å; D423-K425 WeakPolarHBondContact OD1-CB 3.48Å; D423-K425 PolarHBondContact OD1-N 2.82Å; K425-R429 WeakPolarHBondContact O-CG 3.38Å; K425-R429 PolarHBondContact O-N 2.86Å; K425-P466 HydrophobicContact CB-CB 3.98Å; K425-P466 HydrophobicContact CD-CB 4.39Å; K425-Q467 HydrophobicContact CB-CG 4.3Å; K425-E531 WeakPolarHBondContact CD-OE1 3.11Å; K425-E531 WeakPolarHBondContact CE-OE1 2.95Å; K425-E531 IonicContact NZ-OE1 3.99Å; K425-E531 PolarHBondContact NZ-OE1 3.29Å
426	S	93.2	Very high	92.3	Very high	40 Å²	40	49.4 Å²	49.4	28%	0.28	24%	0.24	S	C	.	.	H	α-helix	trans	-65.9	-41.2	172.2	-61.2	0	0	0	0	112	D423 R429 M430	D423-S426 PolarHBondContact O-N 3.09Å; D423-S426 PolarHBondContact OD1-N 3.45Å; D423-S426 PolarHBondContact OD1-OG 2.93Å; D423-S426 WeakPolarHBondContact OD2-CB 3.41Å; D423-S426 PolarHBondContact OD2-OG 3.21Å; S426-R429 WeakPolarHBondContact O-CB 3.31Å; S426-R429 PolarHBondContact O-N 3.16Å; S426-M430 WeakPolarHBondContact O-CG 3.36Å; S426-M430 PolarHBondContact O-N 2.96Å; S426-M430 VanDerWaalsContact O-N 3.09Å
427	Y	95.2	Very high	92.4	Very high	6 Å²	6	51.6 Å²	51.6	2%	0.024	25%	0.25	C	S	.	.	H	α-helix	trans	-63	-42.8	176	-168.9	-87	0	0	0	112	D423 L424 R429 M430 Y431 L435 I439 F443 I471 L751	D423-Y427 WeakPolarHBondContact O-CB 3.28Å; D423-Y427 PolarHBondContact O-N 2.94Å; L424-Y427 PolarHBondContact O-N 3.24Å; Y427-R429 VanDerWaalsContact C-N 3.35Å; Y427-R429 PolarHBondContact O-N 3.47Å; Y427-M430 WeakPolarHBondContact O-CB 3.17Å; Y427-M430 PolarHBondContact O-N 2.85Å; Y427-Y431 HydrophobicContact CD1-CD2 4.18Å; Y427-Y431 HydrophobicContact CD1-CE2 4.26Å; Y427-Y431 AromaticContact CE1-CD2 3.89Å; Y427-Y431 HydrophobicContact CE1-CD2 3.89Å; Y427-Y431 AromaticContact CE1-CE2 3.61Å; Y427-Y431 HydrophobicContact CE1-CE2 3.61Å; Y427-Y431 HydrophobicContact CE2-CE2 4.19Å; Y427-Y431 AromaticContact CZ-CE2 3.57Å; Y427-Y431 WeakPolarHBondContact O-CD2 3.35Å; Y427-Y431 PolarHBondContact O-N 3.48Å; Y427-L435 HydrophobicContact CD1-CD2 3.72Å; Y427-L435 HydrophobicContact CE1-CD2 3.72Å; Y427-I439 HydrophobicContact CE1-CG2 4.37Å; Y427-F443 AromaticContact CD1-CE2 3.94Å; Y427-F443 HydrophobicContact CD1-CE2 3.94Å; Y427-F443 HydrophobicContact CD1-CZ 4.41Å; Y427-F443 AromaticContact CE1-CE2 3.72Å; Y427-F443 HydrophobicContact CE1-CE2 3.72Å; Y427-F443 AromaticContact CE1-CZ 3.91Å; Y427-F443 HydrophobicContact CE1-CZ 3.91Å; Y427-I471 HydrophobicContact CD1-CD1 3.79Å; Y427-I471 HydrophobicContact CD2-CB 4.36Å; Y427-I471 HydrophobicContact CD2-CD1 3.82Å; Y427-I471 HydrophobicContact CD2-CG2 4.02Å; Y427-I471 HydrophobicContact CE1-CD1 4.44Å; Y427-I471 HydrophobicContact CE2-CD1 4.45Å; Y427-I471 HydrophobicContact CE2-CG2 3.94Å; Y427-I471 HydrophobicContact CG-CD1 3.45Å; Y427-I471 VanDerWaalsContact CG-CD1 3.45Å; Y427-L751 HydrophobicContact CE2-CD1 3.9Å; Y427-L751 HydrophobicContact CE2-CD2 4.09Å
428	M	95.3	Very high	92.5	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.1	-45.1	173	-78.7	177.9	64.5	0	0	112.1	L424 M430 Y431 N432 N433 L435 E531 M532	L424-M428 HydrophobicContact CD1-CG 4.19Å; L424-M428 HydrophobicContact CG-CG 4.41Å; L424-M428 HydrophobicContact CG-SD 4.39Å; L424-M428 WeakPolarHBondContact O-CB 3.04Å; L424-M428 VanDerWaalsContact O-CG 3.28Å; L424-M428 WeakPolarHBondContact O-CG 3.49Å; L424-M428 PolarHBondContact O-N 2.95Å; M428-M430 VanDerWaalsContact C-N 3.31Å; M428-M430 PolarHBondContact O-N 3.02Å; M428-Y431 CarbonylContact O-C 3.42Å; M428-Y431 PolarHBondContact O-N 3.05Å; M428-N432 PolarHBondContact O-N 3.33Å; M428-N433 VanDerWaalsContact O-CA 3.27Å; M428-N433 WeakPolarHBondContact O-CA 3.42Å; M428-N433 PolarHBondContact O-N 3.11Å; M428-L435 HydrophobicContact CG-CD1 3.71Å; M428-L435 HydrophobicContact CG-CG 4.04Å; M428-E531 HydrophobicContact CE-CG 3.86Å; M428-E531 WeakPolarHBondContact CE-O 3.42Å; M428-E531 HydrophobicContact SD-CG 4.22Å; M428-M532 HydrophobicContact SD-CG 4.33Å
429	R	94	Very high	92.5	Very high	152 Å²	152	51.3 Å²	51.3	57%	0.574	25%	0.251	S	S	*	.	H	α-helix	trans	-59.5	-38.9	176.8	-71.7	166.8	175.1	154.9	-6.4	112.5	K425 S426 Y427 Y431 N432	K425-R429 WeakPolarHBondContact O-CG 3.38Å; K425-R429 PolarHBondContact O-N 2.86Å; S426-R429 WeakPolarHBondContact O-CB 3.31Å; S426-R429 PolarHBondContact O-N 3.16Å; Y427-R429 VanDerWaalsContact C-N 3.35Å; Y427-R429 PolarHBondContact O-N 3.47Å; R429-Y431 PolarHBondContact O-N 3.25Å; R429-N432 PolarHBondContact O-N 3.42Å
430	M	92.4	Very high	92.7	Very high	115 Å²	115	47.9 Å²	47.9	57%	0.567	24%	0.238	S	C	*	.	H	α-helix	trans	-61.6	-20.9	175.5	-67.6	170	61.5	0	0	113.6	S426 Y427 M428 L751	S426-M430 WeakPolarHBondContact O-CG 3.36Å; S426-M430 PolarHBondContact O-N 2.96Å; S426-M430 VanDerWaalsContact O-N 3.09Å; Y427-M430 WeakPolarHBondContact O-CB 3.17Å; Y427-M430 PolarHBondContact O-N 2.85Å; M428-M430 VanDerWaalsContact C-N 3.31Å; M428-M430 PolarHBondContact O-N 3.02Å; M430-L751 HydrophobicContact CE-CD2 4.15Å
431	Y	91.6	Very high	93.4	Very high	52 Å²	52	51.1 Å²	51.1	20%	0.204	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.4	25.9	175.2	-76.6	-94	0	0	0	112.3	Y427 M428 R429 N433 R434 L435 P436 S747	Y427-Y431 HydrophobicContact CD1-CD2 4.18Å; Y427-Y431 HydrophobicContact CD1-CE2 4.26Å; Y427-Y431 AromaticContact CE1-CD2 3.89Å; Y427-Y431 HydrophobicContact CE1-CD2 3.89Å; Y427-Y431 AromaticContact CE1-CE2 3.61Å; Y427-Y431 HydrophobicContact CE1-CE2 3.61Å; Y427-Y431 HydrophobicContact CE2-CE2 4.19Å; Y427-Y431 AromaticContact CZ-CE2 3.57Å; Y427-Y431 WeakPolarHBondContact O-CD2 3.35Å; Y427-Y431 PolarHBondContact O-N 3.48Å; M428-Y431 CarbonylContact O-C 3.42Å; M428-Y431 PolarHBondContact O-N 3.05Å; R429-Y431 PolarHBondContact O-N 3.25Å; Y431-N433 PolarHBondContact O-N 2.9Å; Y431-N433 VanDerWaalsContact O-N 3.13Å; Y431-R434 PolarHBondContact O-N 2.98Å; Y431-L435 HydrophobicContact CD2-CD2 3.92Å; Y431-L435 HydrophobicContact CG-CD2 3.94Å; Y431-P436 HydrophobicContact CE1-CG 4.49Å; Y431-S747 WeakPolarHBondContact OH-CB 3.47Å; Y431-S747 PolarHBondContact OH-OG 3.33Å
432	N	91.7	Very high	93.7	Very high	146 Å²	146	50.6 Å²	50.6	78%	0.781	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	38.3	-176.8	-63.4	-18.3	0	0	0	112.8	M428 R429 R434	M428-N432 PolarHBondContact O-N 3.33Å; R429-N432 PolarHBondContact O-N 3.42Å; N432-R434 PolarHBondContact O-N 3.44Å; N432-R434 VanDerWaalsContact O-N 3.13Å
433	N	89.6	Confident	94	Very high	51 Å²	51	48.8 Å²	48.8	27%	0.273	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	8.6	-173.8	-53.7	-44.8	0	0	0	115.8	M428 Y431 G535	M428-N433 VanDerWaalsContact O-CA 3.27Å; M428-N433 WeakPolarHBondContact O-CA 3.42Å; M428-N433 PolarHBondContact O-N 3.11Å; Y431-N433 PolarHBondContact O-N 2.9Å; Y431-N433 VanDerWaalsContact O-N 3.13Å; N433-G535 VanDerWaalsContact O-CA 3.23Å; N433-G535 WeakPolarHBondContact O-CA 3.37Å
434	R	91	Very high	94.2	Very high	177 Å²	177	47.2 Å²	47.2	67%	0.668	22%	0.218	S	C	*	.			trans	-113.9	72.8	-176.8	-170.1	176	174.8	149.8	-1.6	111.7	Y431 N432	Y431-R434 PolarHBondContact O-N 2.98Å; N432-R434 PolarHBondContact O-N 3.44Å; N432-R434 VanDerWaalsContact O-N 3.13Å
435	L	94.4	Very high	94.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.219	C	C	.	.			trans	-61.7	142.5	178.4	-66.9	-179.6	0	0	0	112.6	L424 Y427 M428 Y431 V440 M532 R640	L424-L435 HydrophobicContact CD1-CD1 4.13Å; Y427-L435 HydrophobicContact CD1-CD2 3.72Å; Y427-L435 HydrophobicContact CE1-CD2 3.72Å; M428-L435 HydrophobicContact CG-CD1 3.71Å; M428-L435 HydrophobicContact CG-CG 4.04Å; Y431-L435 HydrophobicContact CD2-CD2 3.92Å; Y431-L435 HydrophobicContact CG-CD2 3.94Å; L435-V440 HydrophobicContact CB-CG2 3.72Å; L435-V440 HydrophobicContact CD1-CG2 4.48Å; L435-M532 HydrophobicContact CD1-CB 4.16Å; L435-M532 HydrophobicContact CD1-CG 4.01Å; L435-M532 HydrophobicContact CD1-SD 4.37Å; L435-R640 PolarHBondContact O-NH1 3.16Å; L435-R640 PolarHBondContact O-NH2 3.4Å
436	P	94.5	Very high	94.4	Very high	22 Å²	22	46 Å²	46	14%	0.143	21%	0.212	C	C	.	.			trans	-60.7	136	170	-23.7	34.6	0	0	0	111.9	Y431 N438 I439 V440	Y431-P436 HydrophobicContact CE1-CG 4.49Å; P436-N438 VanDerWaalsContact C-N 3.26Å; P436-N438 WeakPolarHBondContact CB-OD1 3.31Å; P436-N438 PolarHBondContact O-N 3.25Å; P436-I439 HydrophobicContact CB-CG1 4.16Å; P436-I439 HydrophobicContact CG-CG1 4.36Å; P436-I439 WeakPolarHBondContact O-CA 3.43Å; P436-I439 WeakPolarHBondContact O-CB 3.32Å; P436-I439 PolarHBondContact O-N 2.67Å; P436-V440 PolarHBondContact O-N 3.27Å
437	M	94.5	Very high	94.6	Very high	46 Å²	46	44.1 Å²	44.1	23%	0.227	20%	0.199	C	C	.	.	H	α-helix	trans	-65.8	-25.7	-169.8	-65.9	-49.7	-59.8	0	0	114.2	I439 V440 R441 T533 R640 L641	M437-I439 VanDerWaalsContact C-N 3.34Å; M437-V440 HydrophobicContact CE-CB 4.09Å; M437-V440 HydrophobicContact CE-CG1 4.06Å; M437-V440 HydrophobicContact CE-CG2 4.28Å; M437-V440 PolarHBondContact O-N 3.18Å; M437-V440 HydrophobicContact SD-CB 4.49Å; M437-V440 HydrophobicContact SD-CG2 4.09Å; M437-R441 VanDerWaalsContact O-CB 3.29Å; M437-R441 WeakPolarHBondContact O-CB 3.21Å; M437-R441 PolarHBondContact O-N 2.91Å; M437-T533 HydrophobicContact CE-CG2 4.16Å; M437-R640 HydrophobicContact CE-CB 4.49Å; M437-R640 WeakPolarHBondContact CE-O 3.36Å; M437-R640 HydrophobicContact SD-CB 3.94Å; M437-R640 VanDerWaalsContact SD-CZ 3.51Å; M437-R640 PolarHBondContact SD-NH2 3.18Å; M437-R640 VanDerWaalsContact SD-NH2 3.43Å; M437-L641 HydrophobicContact CE-CD2 3.57Å; M437-L641 HydrophobicContact CE-CG 4.03Å
438	N	92.3	Very high	94.8	Very high	49 Å²	49	43.8 Å²	43.8	26%	0.262	20%	0.198	S	C	.	.	H	α-helix	trans	-65.6	-34.4	169.8	59.8	-65.8	0	0	0	112.5	P436 L442 L744	P436-N438 VanDerWaalsContact C-N 3.26Å; P436-N438 WeakPolarHBondContact CB-OD1 3.31Å; P436-N438 PolarHBondContact O-N 3.25Å; N438-L442 VanDerWaalsContact O-CB 3.29Å; N438-L442 WeakPolarHBondContact O-CB 3.49Å; N438-L442 PolarHBondContact O-N 3.05Å; N438-L744 WeakPolarHBondContact ND2-CD1 3.31Å; N438-L744 WeakPolarHBondContact ND2-CD2 3.24Å; N438-L744 VanDerWaalsContact ND2-CG 3.31Å; N438-L744 WeakPolarHBondContact ND2-CG 3.41Å
439	I	93.9	Very high	94.8	Very high	13 Å²	13	44.2 Å²	44.2	7%	0.067	20%	0.199	C	C	.	.	H	α-helix	trans	-73.3	-43.8	173.3	-60.3	-60.5	0	0	0	110	Y427 P436 M437 R441 L442 F443 L744	Y427-I439 HydrophobicContact CE1-CG2 4.37Å; P436-I439 HydrophobicContact CB-CG1 4.16Å; P436-I439 HydrophobicContact CG-CG1 4.36Å; P436-I439 WeakPolarHBondContact O-CA 3.43Å; P436-I439 WeakPolarHBondContact O-CB 3.32Å; P436-I439 PolarHBondContact O-N 2.67Å; M437-I439 VanDerWaalsContact C-N 3.34Å; I439-R441 VanDerWaalsContact C-N 3.33Å; I439-R441 PolarHBondContact O-N 3.09Å; I439-L442 PolarHBondContact O-N 3Å; I439-F443 HydrophobicContact CG2-CD1 4.21Å; I439-F443 HydrophobicContact CG2-CD2 3.7Å; I439-F443 HydrophobicContact CG2-CE1 3.96Å; I439-F443 HydrophobicContact CG2-CE2 3.4Å; I439-F443 HydrophobicContact CG2-CG 4.11Å; I439-F443 HydrophobicContact CG2-CZ 3.54Å; I439-F443 VanDerWaalsContact O-CB 3.3Å; I439-F443 WeakPolarHBondContact O-CB 3.47Å; I439-F443 WeakPolarHBondContact O-CG 3.43Å; I439-F443 PolarHBondContact O-N 2.6Å; I439-L744 HydrophobicContact CD1-CD2 4.02Å
440	V	96.4	Very high	94.9	Very high	0 Å²	0	37 Å²	37	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-54.5	-49.8	173.2	-180	0	0	0	0	110.8	L435 P436 M437 F443 T444 L529 M532	L435-V440 HydrophobicContact CB-CG2 3.72Å; L435-V440 HydrophobicContact CD1-CG2 4.48Å; P436-V440 PolarHBondContact O-N 3.27Å; M437-V440 HydrophobicContact CE-CB 4.09Å; M437-V440 HydrophobicContact CE-CG1 4.06Å; M437-V440 HydrophobicContact CE-CG2 4.28Å; M437-V440 PolarHBondContact O-N 3.18Å; M437-V440 HydrophobicContact SD-CB 4.49Å; M437-V440 HydrophobicContact SD-CG2 4.09Å; V440-F443 PolarHBondContact O-N 2.93Å; V440-T444 WeakPolarHBondContact O-CB 3.27Å; V440-T444 PolarHBondContact O-N 2.66Å; V440-T444 PolarHBondContact O-OG1 3.01Å; V440-L529 HydrophobicContact CG1-CD1 3.88Å; V440-M532 HydrophobicContact CG1-CB 3.89Å; V440-M532 HydrophobicContact CG1-CE 4.23Å; V440-M532 HydrophobicContact CG2-CB 4.12Å
441	R	96.2	Very high	95.1	Very high	73 Å²	73	31.5 Å²	31.5	28%	0.275	15%	0.145	S	C	.	.	H	α-helix	trans	-58.8	-50	176.8	178.9	-179.9	-74.8	152.1	-2.3	112.1	M437 I439 T444 F445 Y671 F672 I675	M437-R441 VanDerWaalsContact O-CB 3.29Å; M437-R441 WeakPolarHBondContact O-CB 3.21Å; M437-R441 PolarHBondContact O-N 2.91Å; I439-R441 VanDerWaalsContact C-N 3.33Å; I439-R441 PolarHBondContact O-N 3.09Å; R441-T444 PolarHBondContact O-N 3.27Å; R441-F445 PolarHBondContact O-N 2.89Å; R441-Y671 HydrophobicContact CB-CE1 4.08Å; R441-Y671 WeakPolarHBondContact CD-O 3.36Å; R441-Y671 HydrophobicContact CG-CD1 4.45Å; R441-Y671 HydrophobicContact CG-CE1 3.92Å; R441-Y671 PolarHBondContact NE-O 3Å; R441-F672 HydrophobicContact CG-CD1 4.16Å; R441-F672 HydrophobicContact CG-CE1 4.49Å; R441-I675 HydrophobicContact CG-CD1 3.58Å; R441-I675 HydrophobicContact CG-CG1 4.09Å
442	L	95.5	Very high	95.3	Very high	16 Å²	16	30.6 Å²	30.6	8%	0.084	14%	0.143	C	C	.	.	H	α-helix	trans	-62.8	-43.3	179.4	174.9	61.4	0	0	0	112.5	N438 I439 F445 Q446 I691 T692 A695	N438-L442 VanDerWaalsContact O-CB 3.29Å; N438-L442 WeakPolarHBondContact O-CB 3.49Å; N438-L442 PolarHBondContact O-N 3.05Å; I439-L442 PolarHBondContact O-N 3Å; L442-F445 PolarHBondContact O-N 2.83Å; L442-Q446 HydrophobicContact CD1-CG 4.39Å; L442-Q446 WeakPolarHBondContact O-CG 3.49Å; L442-Q446 PolarHBondContact O-N 2.72Å; L442-I691 HydrophobicContact CD1-CD1 4.12Å; L442-I691 HydrophobicContact CD1-CG1 4.25Å; L442-T692 HydrophobicContact CD2-CG2 4.22Å; L442-A695 HydrophobicContact CD1-CB 3.88Å
443	F	97.5	Very high	95.4	Very high	2 Å²	2	25.6 Å²	25.6	1%	0.009	11%	0.113	C	C	.	.	H	α-helix	trans	-65.5	-42.9	177.7	-76.2	-2.9	0	0	0	111.5	L424 Y427 I439 V440 F445 Q446 I447 I471 L477 M532	L424-F443 HydrophobicContact CD1-CD2 3.84Å; L424-F443 HydrophobicContact CD1-CE2 4Å; Y427-F443 AromaticContact CD1-CE2 3.94Å; Y427-F443 HydrophobicContact CD1-CE2 3.94Å; Y427-F443 HydrophobicContact CD1-CZ 4.41Å; Y427-F443 AromaticContact CE1-CE2 3.72Å; Y427-F443 HydrophobicContact CE1-CE2 3.72Å; Y427-F443 AromaticContact CE1-CZ 3.91Å; Y427-F443 HydrophobicContact CE1-CZ 3.91Å; I439-F443 HydrophobicContact CG2-CD1 4.21Å; I439-F443 HydrophobicContact CG2-CD2 3.7Å; I439-F443 HydrophobicContact CG2-CE1 3.96Å; I439-F443 HydrophobicContact CG2-CE2 3.4Å; I439-F443 HydrophobicContact CG2-CG 4.11Å; I439-F443 HydrophobicContact CG2-CZ 3.54Å; I439-F443 VanDerWaalsContact O-CB 3.3Å; I439-F443 WeakPolarHBondContact O-CB 3.47Å; I439-F443 WeakPolarHBondContact O-CG 3.43Å; I439-F443 PolarHBondContact O-N 2.6Å; V440-F443 PolarHBondContact O-N 2.93Å; F443-F445 PolarHBondContact O-N 3.3Å; F443-Q446 PolarHBondContact O-N 2.75Å; F443-Q446 VanDerWaalsContact O-N 3.17Å; F443-I447 VanDerWaalsContact O-CG1 3.31Å; F443-I447 WeakPolarHBondContact O-CG1 3.45Å; F443-I447 PolarHBondContact O-N 2.67Å; F443-I471 HydrophobicContact CD2-CD1 4.28Å; F443-I471 HydrophobicContact CE1-CG1 4.49Å; F443-I471 HydrophobicContact CE1-CG2 4.46Å; F443-I471 HydrophobicContact CE2-CD1 3.45Å; F443-I471 VanDerWaalsContact CE2-CD1 3.45Å; F443-I471 HydrophobicContact CE2-CG1 4.15Å; F443-I471 HydrophobicContact CZ-CD1 3.64Å; F443-I471 HydrophobicContact CZ-CG1 3.94Å; F443-I471 HydrophobicContact CZ-CG2 3.96Å; F443-L477 HydrophobicContact CB-CD1 3.63Å; F443-L477 HydrophobicContact CD1-CB 4.06Å; F443-L477 HydrophobicContact CD1-CD1 4.03Å; F443-L477 HydrophobicContact CD2-CD1 4.03Å; F443-L477 HydrophobicContact CE1-CB 4.42Å; F443-L477 HydrophobicContact CG-CD1 3.64Å; F443-M532 HydrophobicContact CB-CE 4.35Å; F443-M532 HydrophobicContact CB-SD 3.89Å; F443-M532 HydrophobicContact CD2-SD 4.11Å
444	T	98.1	Very high	95.6	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-61.3	-43.8	176.7	-49.3	0	0	0	0	111.6	V440 R441 Q446 I447 F448 V525 L529 M532 F672	V440-T444 WeakPolarHBondContact O-CB 3.27Å; V440-T444 PolarHBondContact O-N 2.66Å; V440-T444 PolarHBondContact O-OG1 3.01Å; R441-T444 PolarHBondContact O-N 3.27Å; T444-Q446 PolarHBondContact O-N 3.19Å; T444-I447 PolarHBondContact O-N 3.11Å; T444-F448 HydrophobicContact CG2-CD2 4.07Å; T444-F448 HydrophobicContact CG2-CE2 3.67Å; T444-F448 VanDerWaalsContact O-CD2 3.31Å; T444-F448 WeakPolarHBondContact O-CD2 3.34Å; T444-F448 PolarHBondContact O-N 2.7Å; T444-F448 VanDerWaalsContact O-N 3.09Å; T444-V525 HydrophobicContact CG2-CG1 4.22Å; T444-L529 HydrophobicContact CG2-CB 4.47Å; T444-L529 HydrophobicContact CG2-CD1 4.21Å; T444-L529 HydrophobicContact CG2-CD2 4.37Å; T444-M532 VanDerWaalsContact OG1-CE 3.24Å; T444-M532 WeakPolarHBondContact OG1-CE 3.45Å; T444-F672 HydrophobicContact CG2-CE1 4.39Å; T444-F672 HydrophobicContact CG2-CZ 3.98Å
445	F	97.4	Very high	95.6	Very high	6 Å²	6	16.3 Å²	16.3	3%	0.026	8%	0.076	C	C	.	.	H	α-helix	trans	-61.6	-42	173.8	-171.9	-81.4	0	0	0	112.3	R441 L442 F443 I447 F448 R449 L667 F672 I675 L676 V682 I691	R441-F445 PolarHBondContact O-N 2.89Å; L442-F445 PolarHBondContact O-N 2.83Å; F443-F445 PolarHBondContact O-N 3.3Å; F445-I447 VanDerWaalsContact C-N 3.33Å; F445-I447 PolarHBondContact O-N 3.11Å; F445-F448 PolarHBondContact O-N 2.76Å; F445-R449 WeakPolarHBondContact O-CB 3.46Å; F445-R449 PolarHBondContact O-N 3.38Å; F445-L667 HydrophobicContact CD1-CD2 4.19Å; F445-L667 HydrophobicContact CD2-CD2 3.91Å; F445-L667 HydrophobicContact CE1-CD2 4.09Å; F445-L667 HydrophobicContact CE2-CD2 3.8Å; F445-L667 HydrophobicContact CG-CD2 4.14Å; F445-L667 HydrophobicContact CZ-CD2 3.92Å; F445-F672 HydrophobicContact CB-CD1 4.22Å; F445-F672 HydrophobicContact CB-CE1 3.99Å; F445-F672 HydrophobicContact CB-CZ 4.2Å; F445-F672 HydrophobicContact CD2-CB 3.77Å; F445-F672 HydrophobicContact CD2-CD1 4.02Å; F445-F672 AromaticContact CD2-CD2 3.65Å; F445-F672 HydrophobicContact CD2-CD2 3.65Å; F445-F672 HydrophobicContact CD2-CE1 4.44Å; F445-F672 HydrophobicContact CD2-CE2 4.15Å; F445-F672 AromaticContact CD2-CG 3.57Å; F445-F672 HydrophobicContact CD2-CG 3.57Å; F445-F672 HydrophobicContact CE2-CB 4.07Å; F445-F672 HydrophobicContact CE2-CD2 4.3Å; F445-F672 HydrophobicContact CE2-CG 4.3Å; F445-I675 HydrophobicContact CB-CD1 3.9Å; F445-I675 HydrophobicContact CD2-CD1 3.73Å; F445-I675 HydrophobicContact CE2-CD1 4.48Å; F445-I675 HydrophobicContact CG-CD1 4Å; F445-I675 HydrophobicContact CG-CG2 4.45Å; F445-L676 HydrophobicContact CZ-CD1 4.03Å; F445-L676 HydrophobicContact CZ-CG 4.29Å; F445-V682 HydrophobicContact CE1-CG2 3.74Å; F445-V682 HydrophobicContact CZ-CB 3.89Å; F445-V682 HydrophobicContact CZ-CG2 3.61Å; F445-I691 HydrophobicContact CD1-CD1 3.26Å; F445-I691 HydrophobicContact CE1-CD1 3.51Å; F445-I691 HydrophobicContact CG-CD1 4.41Å
446	Q	97.4	Very high	95.4	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.8	-35.4	176.2	-75.6	-170.4	92.4	0	0	112.8	N399 L442 F443 T444 G450 G475 D476 L477 I691	N399-Q446 VanDerWaalsContact CB-O 3.27Å; N399-Q446 WeakPolarHBondContact CB-O 3.31Å; N399-Q446 WeakPolarHBondContact ND2-CB 3.42Å; N399-Q446 WeakPolarHBondContact ND2-CG 3.25Å; N399-Q446 PolarHBondContact ND2-OE1 3.23Å; L442-Q446 HydrophobicContact CD1-CG 4.39Å; L442-Q446 WeakPolarHBondContact O-CG 3.49Å; L442-Q446 PolarHBondContact O-N 2.72Å; F443-Q446 PolarHBondContact O-N 2.75Å; F443-Q446 VanDerWaalsContact O-N 3.17Å; T444-Q446 PolarHBondContact O-N 3.19Å; Q446-G450 PolarHBondContact O-N 3.09Å; Q446-G450 VanDerWaalsContact O-N 3.08Å; Q446-G475 PolarHBondContact NE2-O 3.36Å; Q446-D476 VanDerWaalsContact OE1-CA 3.3Å; Q446-L477 HydrophobicContact CB-CB 4.12Å; Q446-I691 HydrophobicContact CG-CD1 3.67Å; Q446-I691 HydrophobicContact CG-CG1 3.94Å
447	I	98.1	Very high	95.1	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.5	-54.3	173.4	-66.3	163	0	0	0	110.3	F443 T444 F445 R449 G450 L451 L469 L477 L479 V525 I528 M532	F443-I447 VanDerWaalsContact O-CG1 3.31Å; F443-I447 WeakPolarHBondContact O-CG1 3.45Å; F443-I447 PolarHBondContact O-N 2.67Å; T444-I447 PolarHBondContact O-N 3.11Å; F445-I447 VanDerWaalsContact C-N 3.33Å; F445-I447 PolarHBondContact O-N 3.11Å; I447-R449 VanDerWaalsContact C-N 3.32Å; I447-R449 PolarHBondContact O-N 3.18Å; I447-G450 WeakPolarHBondContact O-CA 3.34Å; I447-G450 PolarHBondContact O-N 2.77Å; I447-L451 HydrophobicContact CG2-CD1 4.03Å; I447-L451 HydrophobicContact CG2-CG 4.5Å; I447-L451 PolarHBondContact O-N 3.12Å; I447-L469 HydrophobicContact CD1-CD1 3.63Å; I447-L469 HydrophobicContact CG1-CD1 4.07Å; I447-L469 HydrophobicContact CG1-CD2 4.42Å; I447-L477 HydrophobicContact CD1-CD1 4.39Å; I447-L477 HydrophobicContact CG1-CD1 4.24Å; I447-L477 HydrophobicContact CG1-CD2 3.58Å; I447-L479 HydrophobicContact CG2-CD2 4.3Å; I447-V525 HydrophobicContact CG2-CB 4.38Å; I447-V525 HydrophobicContact CG2-CG1 3.92Å; I447-V525 HydrophobicContact CG2-CG2 3.57Å; I447-I528 HydrophobicContact CD1-CG2 4.18Å; I447-M532 HydrophobicContact CD1-CE 4.4Å
448	F	98.1	Very high	94.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.2	-40.3	179.8	-74.2	-60	0	0	0	112.8	T444 F445 G450 L451 E452 I522 V525 L648 A663 A666 L667 F672	T444-F448 HydrophobicContact CG2-CD2 4.07Å; T444-F448 HydrophobicContact CG2-CE2 3.67Å; T444-F448 VanDerWaalsContact O-CD2 3.31Å; T444-F448 WeakPolarHBondContact O-CD2 3.34Å; T444-F448 PolarHBondContact O-N 2.7Å; T444-F448 VanDerWaalsContact O-N 3.09Å; F445-F448 PolarHBondContact O-N 2.76Å; F448-G450 VanDerWaalsContact C-N 3.28Å; F448-G450 PolarHBondContact O-N 2.64Å; F448-L451 PolarHBondContact O-N 3.25Å; F448-L451 VanDerWaalsContact O-N 3.09Å; F448-E452 PolarHBondContact O-N 3.45Å; F448-I522 HydrophobicContact CD1-CD1 4.26Å; F448-I522 HydrophobicContact CE1-CD1 3.92Å; F448-V525 HydrophobicContact CD1-CG1 4.48Å; F448-V525 HydrophobicContact CD2-CG1 4.5Å; F448-V525 HydrophobicContact CE1-CB 4.09Å; F448-V525 HydrophobicContact CE1-CG1 3.87Å; F448-V525 HydrophobicContact CE1-CG2 4.16Å; F448-V525 HydrophobicContact CE2-CG1 3.91Å; F448-V525 HydrophobicContact CZ-CB 4.12Å; F448-V525 HydrophobicContact CZ-CG1 3.55Å; F448-L648 HydrophobicContact CE2-CD1 4.49Å; F448-L648 HydrophobicContact CE2-CD2 4.29Å; F448-A663 HydrophobicContact CD1-CB 4.29Å; F448-A666 HydrophobicContact CD1-CB 3.72Å; F448-A666 HydrophobicContact CD2-CB 3.96Å; F448-A666 HydrophobicContact CE1-CB 3.66Å; F448-A666 HydrophobicContact CE2-CB 3.89Å; F448-A666 HydrophobicContact CG-CB 3.88Å; F448-A666 HydrophobicContact CZ-CB 3.74Å; F448-L667 HydrophobicContact CB-CD2 3.91Å; F448-L667 HydrophobicContact CB-CG 3.97Å; F448-F672 AromaticContact CD2-CE2 3.74Å; F448-F672 HydrophobicContact CD2-CE2 3.74Å; F448-F672 AromaticContact CD2-CZ 3.71Å; F448-F672 HydrophobicContact CD2-CZ 3.71Å; F448-F672 HydrophobicContact CE2-CE2 4.14Å; F448-F672 AromaticContact CE2-CZ 3.95Å; F448-F672 HydrophobicContact CE2-CZ 3.95Å
449	R	96.7	Very high	94.3	Very high	8 Å²	8	24.9 Å²	24.9	3%	0.03	13%	0.125	C	C	.	.	H	α-helix	trans	-62.6	-35.5	175.5	-164.6	-174.7	165.8	-127.4	6	112.3	H397 N399 F445 I447 L667 V682 L686 Q689	H397-R449 VanDerWaalsContact CE1-C 3.5Å; H397-R449 PolarHBondContact CE1-O 3.19Å; N399-R449 PolarHBondContact OD1-NH1 2.9Å; F445-R449 WeakPolarHBondContact O-CB 3.46Å; F445-R449 PolarHBondContact O-N 3.38Å; I447-R449 VanDerWaalsContact C-N 3.32Å; I447-R449 PolarHBondContact O-N 3.18Å; R449-L667 HydrophobicContact CB-CD2 4.13Å; R449-V682 HydrophobicContact CG-CG2 4.08Å; R449-L686 PolarHBondContact NH2-O 3.4Å; R449-Q689 PolarHBondContact NH1-O 3Å; R449-Q689 PolarHBondContact NH2-O 2.83Å
450	G	96.3	Very high	93.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-65.2	-42.7	170.3	0	0	0	0	0	112.9	Q446 I447 F448 C454	Q446-G450 PolarHBondContact O-N 3.09Å; Q446-G450 VanDerWaalsContact O-N 3.08Å; I447-G450 WeakPolarHBondContact O-CA 3.34Å; I447-G450 PolarHBondContact O-N 2.77Å; F448-G450 VanDerWaalsContact C-N 3.28Å; F448-G450 PolarHBondContact O-N 2.64Å; G450-C454 PolarHBondContact O-N 3.1Å; G450-C454 PolarHBondContact O-SG 3.46Å
451	L	96	Very high	93.4	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-73	-40.4	-178.1	-68.8	175.1	0	0	0	113.4	I447 F448 Y453 C454 H455 H461 L464 L479 D521 V525 A663	I447-L451 HydrophobicContact CG2-CD1 4.03Å; I447-L451 HydrophobicContact CG2-CG 4.5Å; I447-L451 PolarHBondContact O-N 3.12Å; F448-L451 PolarHBondContact O-N 3.25Å; F448-L451 VanDerWaalsContact O-N 3.09Å; L451-Y453 PolarHBondContact O-N 3.46Å; L451-C454 CarbonylContact O-C 3.49Å; L451-C454 WeakPolarHBondContact O-CA 3.44Å; L451-C454 WeakPolarHBondContact O-CB 3.38Å; L451-C454 PolarHBondContact O-N 3.05Å; L451-H455 WeakPolarHBondContact O-CB 3.48Å; L451-H455 VanDerWaalsContact O-CG 3.32Å; L451-H455 PolarHBondContact O-N 3.32Å; L451-H461 HydrophobicContact CD2-CB 4.19Å; L451-L464 HydrophobicContact CD1-CD1 3.95Å; L451-L464 HydrophobicContact CD2-CD1 4.16Å; L451-L479 HydrophobicContact CD2-CD1 3.71Å; L451-L479 HydrophobicContact CG-CD1 4.01Å; L451-D521 HydrophobicContact CD1-CB 4.12Å; L451-D521 HydrophobicContact CD2-CB 4.01Å; L451-V525 HydrophobicContact CD1-CG2 3.41Å; L451-V525 VanDerWaalsContact CD1-CG2 3.41Å; L451-A663 HydrophobicContact CB-CB 3.98Å
452	E	95.8	Very high	92.9	Very high	34 Å²	34	21.6 Å²	21.6	16%	0.159	11%	0.112	C	C	.	.	H	α-helix	trans	-49.3	-49.6	171.8	164.6	167.8	-84.2	0	0	110.5	F448 C454 H455 A456 A663 T664 L667 H683	F448-E452 PolarHBondContact O-N 3.45Å; E452-C454 VanDerWaalsContact C-N 3.28Å; E452-C454 PolarHBondContact O-N 3.14Å; E452-H455 PolarHBondContact O-N 3.39Å; E452-A456 WeakPolarHBondContact O-CB 3.28Å; E452-A456 PolarHBondContact O-N 2.91Å; E452-A663 HydrophobicContact CB-CB 4.33Å; E452-T664 WeakPolarHBondContact OE1-CA 3.47Å; E452-T664 VanDerWaalsContact OE1-CB 3.26Å; E452-T664 WeakPolarHBondContact OE1-CB 3.49Å; E452-T664 WeakPolarHBondContact OE1-CG2 3.31Å; E452-T664 PolarHBondContact OE1-OG1 2.79Å; E452-L667 HydrophobicContact CB-CD1 4.06Å; E452-H683 IonicContact OE1-CE1 3.95Å; E452-H683 PolarHBondContact OE1-CE1 3.44Å; E452-H683 IonicContact OE1-ND1 2.67Å; E452-H683 PolarHBondContact OE1-ND1 2.98Å; E452-H683 IonicContact OE2-CE1 3.44Å; E452-H683 PolarHBondContact OE2-CE1 3.27Å; E452-H683 IonicContact OE2-ND1 2.65Å; E452-H683 PolarHBondContact OE2-ND1 3.11Å
453	Y	94.4	Very high	92.4	Very high	41 Å²	41	22 Å²	22	16%	0.161	11%	0.114	C	C	.	.	H	α-helix	trans	-65.5	-28.5	179.5	-174.3	-85.7	0	0	0	113.5	L395 N396 H397 I400 L451 K457 P687	L395-Y453 HydrophobicContact CB-CE1 4.49Å; L395-Y453 HydrophobicContact CD2-CD1 4.23Å; L395-Y453 HydrophobicContact CD2-CE1 3.79Å; N396-Y453 PolarHBondContact N-OH 3.35Å; N396-Y453 PolarHBondContact O-OH 3.3Å; H397-Y453 HydrophobicContact CB-CD1 3.85Å; H397-Y453 HydrophobicContact CB-CD2 4.19Å; H397-Y453 HydrophobicContact CB-CE1 3.99Å; H397-Y453 HydrophobicContact CB-CE2 4.32Å; H397-Y453 HydrophobicContact CB-CG 3.94Å; H397-Y453 AromaticContact CD2-CD2 3.87Å; H397-Y453 AromaticContact CD2-CG 3.98Å; H397-Y453 AromaticContact CG-CG 3.98Å; I400-Y453 HydrophobicContact CD1-CD1 3.54Å; I400-Y453 HydrophobicContact CD1-CE1 4.17Å; I400-Y453 HydrophobicContact CD1-CG 4.38Å; L451-Y453 PolarHBondContact O-N 3.46Å; Y453-K457 HydrophobicContact CD1-CD 4.17Å; Y453-K457 HydrophobicContact CE1-CD 3.76Å; Y453-K457 VanDerWaalsContact CE1-CE 3.45Å; Y453-K457 WeakPolarHBondContact O-CG 3.31Å; Y453-K457 WeakPolarHBondContact OH-CE 3.4Å; Y453-P687 HydrophobicContact CD2-CB 4.12Å; Y453-P687 HydrophobicContact CD2-CG 4.3Å; Y453-P687 HydrophobicContact CE2-CB 3.71Å; Y453-P687 HydrophobicContact CE2-CG 3.91Å
454	C	92.1	Very high	92.1	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-78.6	-47.9	175.8	-62.7	0	0	0	0	111.7	I400 G450 L451 E452 K457 Q458 I459	I400-C454 WeakPolarHBondContact CD1-SG 3.5Å; G450-C454 PolarHBondContact O-N 3.1Å; G450-C454 PolarHBondContact O-SG 3.46Å; L451-C454 CarbonylContact O-C 3.49Å; L451-C454 WeakPolarHBondContact O-CA 3.44Å; L451-C454 WeakPolarHBondContact O-CB 3.38Å; L451-C454 PolarHBondContact O-N 3.05Å; E452-C454 VanDerWaalsContact C-N 3.28Å; E452-C454 PolarHBondContact O-N 3.14Å; C454-K457 CarbonylContact O-C 3.59Å; C454-K457 VanDerWaalsContact O-C 3.32Å; C454-K457 WeakPolarHBondContact O-CA 3.45Å; C454-K457 WeakPolarHBondContact O-CB 3.4Å; C454-K457 PolarHBondContact O-N 2.92Å; C454-Q458 PolarHBondContact O-N 3.47Å; C454-I459 CarbonylContact C-O 3.46Å; C454-I459 VanDerWaalsContact C-O 3.23Å; C454-I459 HydrophobicContact CB-CB 4.46Å; C454-I459 HydrophobicContact CB-CG2 4.45Å; C454-I459 WeakPolarHBondContact CB-O 3.48Å; C454-I459 PolarHBondContact O-N 2.85Å
455	H	91.5	Very high	91.9	Very high	32 Å²	32	23.7 Å²	23.7	15%	0.148	12%	0.122	C	C	.	.	H	α-helix	trans	-66.8	-40.6	-178.3	-63.1	172.9	0	0	0	111.2	L451 E452 K457 Q458 G518 D521	L451-H455 WeakPolarHBondContact O-CB 3.48Å; L451-H455 VanDerWaalsContact O-CG 3.32Å; L451-H455 PolarHBondContact O-N 3.32Å; E452-H455 PolarHBondContact O-N 3.39Å; H455-K457 PolarHBondContact O-N 3.26Å; H455-K457 VanDerWaalsContact O-N 3.09Å; H455-Q458 PolarHBondContact O-N 3.42Å; H455-Q458 PolarHBondContact O-NE2 2.83Å; H455-G518 VanDerWaalsContact CE1-CA 3.47Å; H455-G518 WeakPolarHBondContact CE1-CA 3.36Å; H455-G518 PolarHBondContact CE1-O 2.85Å; H455-D521 IonicContact CD2-OD2 2.7Å; H455-D521 IonicContact CE1-OD2 3.15Å; H455-D521 IonicContact NE2-OD2 2.65Å; H455-D521 PolarHBondContact NE2-OD2 3Å
456	A	91.1	Very high	91.7	Very high	84 Å²	84	23.4 Å²	23.4	69%	0.694	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-13.5	169.7	0	0	0	0	0	113.7	E452	E452-A456 WeakPolarHBondContact O-CB 3.28Å; E452-A456 PolarHBondContact O-N 2.91Å
457	K	87.9	Confident	91.4	Very high	101 Å²	101	27.4 Å²	27.4	44%	0.439	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106	10.2	172.8	-72.2	-176	175.2	-59.5	0	113.7	L395 Y453 C454 H455 I459	L395-K457 HydrophobicContact CD2-CD 3.78Å; Y453-K457 HydrophobicContact CD1-CD 4.17Å; Y453-K457 HydrophobicContact CE1-CD 3.76Å; Y453-K457 VanDerWaalsContact CE1-CE 3.45Å; Y453-K457 WeakPolarHBondContact O-CG 3.31Å; Y453-K457 WeakPolarHBondContact OH-CE 3.4Å; C454-K457 CarbonylContact O-C 3.59Å; C454-K457 VanDerWaalsContact O-C 3.32Å; C454-K457 WeakPolarHBondContact O-CA 3.45Å; C454-K457 WeakPolarHBondContact O-CB 3.4Å; C454-K457 PolarHBondContact O-N 2.92Å; H455-K457 PolarHBondContact O-N 3.26Å; H455-K457 VanDerWaalsContact O-N 3.09Å; K457-I459 HydrophobicContact CB-CD1 4.12Å; K457-I459 PolarHBondContact O-N 2.81Å
458	Q	85.2	Confident	91.2	Very high	96 Å²	96	28 Å²	28	45%	0.449	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	36.4	-179	-56.9	-66.7	-66.1	0	0	112.8	C454 H455 Q488	C454-Q458 PolarHBondContact O-N 3.47Å; H455-Q458 PolarHBondContact O-N 3.42Å; H455-Q458 PolarHBondContact O-NE2 2.83Å; Q458-Q488 HydrophobicContact CB-CB 4.12Å; Q458-Q488 PolarHBondContact O-N 2.66Å
459	I	84.2	Confident	91.1	Very high	17 Å²	17	28 Å²	28	9%	0.087	14%	0.143	C	C	.	.	B	Isolated β-bridge	trans	-118.4	124.4	177.6	-69.4	163.8	0	0	0	108.4	L395 C454 K457 F482 A485	L395-I459 HydrophobicContact CD2-CD1 3.92Å; C454-I459 CarbonylContact C-O 3.46Å; C454-I459 VanDerWaalsContact C-O 3.23Å; C454-I459 HydrophobicContact CB-CB 4.46Å; C454-I459 HydrophobicContact CB-CG2 4.45Å; C454-I459 WeakPolarHBondContact CB-O 3.48Å; C454-I459 PolarHBondContact O-N 2.85Å; K457-I459 HydrophobicContact CB-CD1 4.12Å; K457-I459 PolarHBondContact O-N 2.81Å; I459-F482 HydrophobicContact CG2-CD1 4.2Å; I459-F482 HydrophobicContact CG2-CE1 4.18Å; I459-A485 HydrophobicContact CG2-CB 4.01Å
460	L	85.6	Confident	91	Very high	6 Å²	6	29.5 Å²	29.5	3%	0.031	15%	0.151	C	C	.	.			trans	-100.9	144.6	174.1	-56.1	179.6	0	0	0	110	R462	L460-R462 HydrophobicContact CB-CG 3.9Å
461	H	86.8	Confident	91	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.152	C	C	.	.			trans	-80.7	-41.8	-179.2	-165.6	-77.6	0	0	0	112.3	L451 D463 L464 A480 F482 G483 D521	L451-H461 HydrophobicContact CD2-CB 4.19Å; H461-D463 PolarHBondContact CE1-O 3.03Å; H461-D463 PolarHBondContact ND1-O 3.13Å; H461-D463 PolarHBondContact O-N 3.24Å; H461-L464 HydrophobicContact CB-CD2 4.21Å; H461-L464 HydrophobicContact CB-CG 4.02Å; H461-A480 PolarHBondContact CE1-O 3.42Å; H461-A480 VanDerWaalsContact CE1-O 3.23Å; H461-A480 PolarHBondContact NE2-O 2.95Å; H461-A480 VanDerWaalsContact NE2-O 3.09Å; H461-F482 HydrophobicContact CB-CD1 4.45Å; H461-F482 AromaticContact CD2-CD1 3.57Å; H461-F482 AromaticContact CD2-CE1 3.58Å; H461-F482 AromaticContact CD2-CG 3.94Å; H461-F482 AromaticContact CD2-CZ 3.94Å; H461-G483 PolarHBondContact O-N 3.34Å; H461-D521 WeakPolarHBondContact CB-OD1 3.45Å; H461-D521 PolarHBondContact N-OD1 3.35Å; H461-D521 PolarHBondContact N-OD2 2.95Å
462	R	84.2	Confident	90.8	Very high	11 Å²	11	30.7 Å²	30.7	4%	0.042	16%	0.159	C	C	.	.			trans	61.5	-27.8	175	-62.3	179	170.4	142.8	-5	117.4	L460 Y495 V499 V500 D521	L460-R462 HydrophobicContact CB-CG 3.9Å; R462-Y495 VanDerWaalsContact NH2-CZ 3.29Å; R462-Y495 PolarHBondContact NH2-OH 2.95Å; R462-V499 HydrophobicContact CB-CG1 4.07Å; R462-V500 WeakPolarHBondContact O-CA 3.45Å; R462-V500 WeakPolarHBondContact O-CB 3.37Å; R462-V500 VanDerWaalsContact O-CG1 3.31Å; R462-V500 WeakPolarHBondContact O-CG1 3.47Å; R462-V500 WeakPolarHBondContact O-CG2 3.39Å; R462-D521 PolarHBondContact N-OD1 2.73Å
463	D	85.1	Confident	90.4	Very high	23 Å²	23	36.5 Å²	36.5	12%	0.123	18%	0.183	C	C	.	.			trans	-117.7	59.5	174.3	-169.3	34.8	0	0	0	110.3	H461 K465 N468 T501	H461-D463 PolarHBondContact CE1-O 3.03Å; H461-D463 PolarHBondContact ND1-O 3.13Å; H461-D463 PolarHBondContact O-N 3.24Å; D463-K465 IonicContact OD1-NZ 3.97Å; D463-K465 PolarHBondContact OD1-NZ 2.95Å; D463-K465 WeakPolarHBondContact OD2-CE 3.25Å; D463-K465 IonicContact OD2-NZ 2.67Å; D463-K465 PolarHBondContact OD2-NZ 2.78Å; D463-N468 PolarHBondContact O-ND2 3.37Å; D463-N468 PolarHBondContact OD2-ND2 3.27Å; D463-T501 WeakPolarHBondContact OD1-CB 3.49Å; D463-T501 PolarHBondContact OD1-N 3.35Å; D463-T501 PolarHBondContact OD1-OG1 3.01Å
464	L	92.4	Very high	90.1	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.021	19%	0.192	C	C	.	.			trans	-78.9	124.4	171.4	-76.7	175.9	0	0	0	110.2	L451 H461 L469 L479 Y504 D521 V525 I528	L451-L464 HydrophobicContact CD1-CD1 3.95Å; L451-L464 HydrophobicContact CD2-CD1 4.16Å; H461-L464 HydrophobicContact CB-CD2 4.21Å; H461-L464 HydrophobicContact CB-CG 4.02Å; L464-L469 HydrophobicContact CD2-CD2 4.23Å; L464-L479 HydrophobicContact CD2-CD2 4.04Å; L464-Y504 WeakPolarHBondContact O-CB 3.48Å; L464-D521 HydrophobicContact CD1-CB 3.68Å; L464-D521 VanDerWaalsContact CD1-O 3.28Å; L464-D521 WeakPolarHBondContact CD1-O 3.18Å; L464-V525 HydrophobicContact CD1-CG2 4.14Å; L464-I528 HydrophobicContact CB-CD1 4.18Å
465	K	92.7	Very high	90	Very high	35 Å²	35	37.6 Å²	37.6	15%	0.152	20%	0.196	C	C	.	.	S	Bend	trans	-163.8	158.7	175.4	61.1	-164.6	-179.2	-145.6	0	109.2	D463 Q467 N468 T501 Y504	D463-K465 IonicContact OD1-NZ 3.97Å; D463-K465 PolarHBondContact OD1-NZ 2.95Å; D463-K465 WeakPolarHBondContact OD2-CE 3.25Å; D463-K465 IonicContact OD2-NZ 2.67Å; D463-K465 PolarHBondContact OD2-NZ 2.78Å; K465-Q467 HydrophobicContact CG-CB 4.29Å; K465-Q467 VanDerWaalsContact CG-OE1 3.32Å; K465-Q467 PolarHBondContact O-N 2.82Å; K465-Q467 VanDerWaalsContact O-N 3.1Å; K465-N468 VanDerWaalsContact CE-OD1 3.28Å; K465-N468 WeakPolarHBondContact CE-OD1 3.38Å; K465-N468 HydrophobicContact CG-CB 4.04Å; K465-N468 PolarHBondContact O-N 2.81Å; K465-T501 HydrophobicContact CD-CG2 4.04Å; K465-T501 WeakPolarHBondContact CD-OG1 3.25Å; K465-T501 PolarHBondContact NZ-OG1 3.13Å; K465-Y504 HydrophobicContact CB-CD2 3.66Å; K465-Y504 HydrophobicContact CB-CE2 3.55Å; K465-Y504 HydrophobicContact CB-CG 4.36Å
466	P	94.5	Very high	90.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-57	-28.8	-177.6	-28.2	38.2	0	0	0	114.7	L424 K425 N468 L469 Y504 I528	L424-P466 HydrophobicContact CB-CB 4.08Å; L424-P466 WeakPolarHBondContact CB-O 3.41Å; L424-P466 HydrophobicContact CD2-CB 4.09Å; L424-P466 HydrophobicContact CG-CB 4.1Å; L424-P466 PolarHBondContact N-O 3.09Å; L424-P466 VanDerWaalsContact N-O 3.08Å; K425-P466 HydrophobicContact CB-CB 3.98Å; K425-P466 HydrophobicContact CD-CB 4.39Å; P466-N468 VanDerWaalsContact C-N 3.25Å; P466-N468 PolarHBondContact O-N 3.26Å; P466-L469 PolarHBondContact O-N 2.88Å; P466-Y504 VanDerWaalsContact CD-CZ 3.5Å; P466-Y504 VanDerWaalsContact CD-OH 3.28Å; P466-Y504 WeakPolarHBondContact CD-OH 3.48Å; P466-I528 HydrophobicContact CG-CG1 4.29Å
467	Q	91.1	Very high	90.4	Very high	84 Å²	84	32.8 Å²	32.8	39%	0.393	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-67.4	-24.5	175.7	-58	84.2	-10.5	0	0	113.2	K425 K465	K425-Q467 HydrophobicContact CB-CG 4.3Å; K465-Q467 HydrophobicContact CG-CB 4.29Å; K465-Q467 VanDerWaalsContact CG-OE1 3.32Å; K465-Q467 PolarHBondContact O-N 2.82Å; K465-Q467 VanDerWaalsContact O-N 3.1Å
468	N	92.8	Very high	90.8	Very high	13 Å²	13	29.2 Å²	29.2	7%	0.07	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-98.1	9.4	-179.2	-71.1	10.1	0	0	0	112.4	D463 K465 P466 A480	D463-N468 PolarHBondContact O-ND2 3.37Å; D463-N468 PolarHBondContact OD2-ND2 3.27Å; K465-N468 VanDerWaalsContact CE-OD1 3.28Å; K465-N468 WeakPolarHBondContact CE-OD1 3.38Å; K465-N468 HydrophobicContact CG-CB 4.04Å; K465-N468 PolarHBondContact O-N 2.81Å; P466-N468 VanDerWaalsContact C-N 3.25Å; P466-N468 PolarHBondContact O-N 3.26Å; N468-A480 WeakPolarHBondContact CB-O 3.32Å; N468-A480 WeakPolarHBondContact O-CA 3.32Å; N468-A480 WeakPolarHBondContact O-CB 3.36Å; N468-A480 PolarHBondContact O-N 2.97Å
469	L	95.9	Very high	91.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	105.8	176.4	-61.2	-178.7	0	0	0	109	D423 L424 I447 L464 P466 L477 L479 I528	D423-L469 CarbonylContact C-O 3.51Å; D423-L469 WeakPolarHBondContact CA-O 3.25Å; L424-L469 HydrophobicContact CB-CB 3.99Å; L424-L469 HydrophobicContact CD2-CB 4.41Å; L424-L469 HydrophobicContact CD2-CD1 3.76Å; L424-L469 PolarHBondContact N-O 3.19Å; I447-L469 HydrophobicContact CD1-CD1 3.63Å; I447-L469 HydrophobicContact CG1-CD1 4.07Å; I447-L469 HydrophobicContact CG1-CD2 4.42Å; L464-L469 HydrophobicContact CD2-CD2 4.23Å; P466-L469 PolarHBondContact O-N 2.88Å; L469-L477 HydrophobicContact CB-CD1 4.48Å; L469-L477 HydrophobicContact CB-CD2 4.4Å; L469-L477 HydrophobicContact CB-CG 4.47Å; L469-L477 HydrophobicContact CD2-CD2 4.23Å; L469-L479 HydrophobicContact CD2-CD2 3.45Å; L469-L479 VanDerWaalsContact CD2-CD2 3.45Å; L469-I528 HydrophobicContact CD1-CD1 4.04Å; L469-I528 HydrophobicContact CD1-CG2 3.96Å
470	L	95.6	Very high	91.5	Very high	39 Å²	39	24.2 Å²	24.2	20%	0.204	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	134.1	-176.6	-59.5	-173.9	0	0	0	111.5	V401 S422 D423 L477 K478 A480	V401-L470 HydrophobicContact CG2-CD1 4.1Å; S422-L470 CarbonylContact O-C 3.27Å; S422-L470 WeakPolarHBondContact O-CA 3.42Å; D423-L470 HydrophobicContact CB-CD2 4Å; L470-L477 CarbonylContact O-C 3.46Å; L470-L477 WeakPolarHBondContact O-CA 3.32Å; L470-K478 PolarHBondContact N-O 2.99Å; L470-K478 PolarHBondContact O-N 3Å; L470-A480 HydrophobicContact CD1-CB 3.93Å; L470-A480 HydrophobicContact CG-CB 3.79Å
471	I	95.9	Very high	91.2	Very high	5 Å²	5	26.7 Å²	26.7	3%	0.026	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	116.1	-179.4	-63	160	0	0	0	108.7	G420 G421 S422 L424 Y427 F443 L477	G420-I471 CarbonylContact O-C 3.59Å; G420-I471 VanDerWaalsContact O-C 3.27Å; G421-I471 WeakPolarHBondContact CA-O 3.37Å; S422-I471 PolarHBondContact N-O 3.17Å; S422-I471 PolarHBondContact O-N 3.07Å; L424-I471 HydrophobicContact CB-CD1 4.1Å; L424-I471 HydrophobicContact CD1-CD1 3.79Å; Y427-I471 HydrophobicContact CD1-CD1 3.79Å; Y427-I471 HydrophobicContact CD2-CB 4.36Å; Y427-I471 HydrophobicContact CD2-CD1 3.82Å; Y427-I471 HydrophobicContact CD2-CG2 4.02Å; Y427-I471 HydrophobicContact CE1-CD1 4.44Å; Y427-I471 HydrophobicContact CE2-CD1 4.45Å; Y427-I471 HydrophobicContact CE2-CG2 3.94Å; Y427-I471 HydrophobicContact CG-CD1 3.45Å; Y427-I471 VanDerWaalsContact CG-CD1 3.45Å; F443-I471 HydrophobicContact CD2-CD1 4.28Å; F443-I471 HydrophobicContact CE1-CG1 4.49Å; F443-I471 HydrophobicContact CE1-CG2 4.46Å; F443-I471 HydrophobicContact CE2-CD1 3.45Å; F443-I471 VanDerWaalsContact CE2-CD1 3.45Å; F443-I471 HydrophobicContact CE2-CG1 4.15Å; F443-I471 HydrophobicContact CZ-CD1 3.64Å; F443-I471 HydrophobicContact CZ-CG1 3.94Å; F443-I471 HydrophobicContact CZ-CG2 3.96Å; I471-L477 HydrophobicContact CG1-CB 4.43Å; I471-L477 HydrophobicContact CG1-CD1 4.41Å; I471-L477 HydrophobicContact CG1-CG 4.38Å
472	S	92.2	Very high	90.5	Very high	20 Å²	20	28.1 Å²	28.1	14%	0.14	14%	0.141	C	C	.	.			trans	-74.3	162.8	179.8	66.8	0	0	0	0	112.7	G420 T474 G475 D476	G420-S472 VanDerWaalsContact O-CA 3.23Å; G420-S472 WeakPolarHBondContact O-CA 3.47Å; G420-S472 PolarHBondContact O-N 3.5Å; S472-T474 PolarHBondContact O-N 3.45Å; S472-T474 PolarHBondContact OG-N 3.21Å; S472-T474 PolarHBondContact OG-OG1 2.94Å; S472-T474 VanDerWaalsContact OG-OG1 3.05Å; S472-G475 PolarHBondContact O-N 3.01Å; S472-D476 PolarHBondContact N-O 3.47Å; S472-D476 WeakPolarHBondContact OG-CA 3.47Å; S472-D476 WeakPolarHBondContact OG-CB 3.16Å; S472-D476 PolarHBondContact OG-N 3.46Å; S472-D476 PolarHBondContact OG-O 3.43Å
473	K	87.5	Confident	89.2	Confident	155 Å²	155	28.4 Å²	28.4	67%	0.674	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-11.1	172.5	-67.9	-160.6	172.3	-153	0	114.4
474	T	87.4	Confident	87.4	Confident	57 Å²	57	33 Å²	33	35%	0.35	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	1.7	174.6	44.1	0	0	0	0	113.4	S472 D476 T692 M911	S472-T474 PolarHBondContact O-N 3.45Å; S472-T474 PolarHBondContact OG-N 3.21Å; S472-T474 PolarHBondContact OG-OG1 2.94Å; S472-T474 VanDerWaalsContact OG-OG1 3.05Å; T474-D476 VanDerWaalsContact C-N 3.3Å; T474-D476 WeakPolarHBondContact CB-OD2 3.23Å; T474-D476 PolarHBondContact OG1-OD2 2.77Å; T474-T692 VanDerWaalsContact O-CG2 3.29Å; T474-T692 WeakPolarHBondContact O-CG2 3.44Å; T474-M911 HydrophobicContact CG2-CE 3.76Å
475	G	90.5	Very high	85.3	Confident	7 Å²	7	33.4 Å²	33.4	7%	0.072	18%	0.176	C	C	.	.	S	Bend	trans	81.6	4.1	-176.9	0	0	0	0	0	114.4	Q446 S472 T692	Q446-G475 PolarHBondContact NE2-O 3.36Å; S472-G475 PolarHBondContact O-N 3.01Å; G475-T692 PolarHBondContact O-OG1 2.99Å
476	D	94.3	Very high	83.1	Confident	15 Å²	15	36.4 Å²	36.4	8%	0.08	19%	0.186	C	C	.	.			trans	-77	125.9	174.3	-53.8	-66	0	0	0	110.4	Q446 S472 T474 S690 T692	Q446-D476 VanDerWaalsContact OE1-CA 3.3Å; S472-D476 PolarHBondContact N-O 3.47Å; S472-D476 WeakPolarHBondContact OG-CA 3.47Å; S472-D476 WeakPolarHBondContact OG-CB 3.16Å; S472-D476 PolarHBondContact OG-N 3.46Å; S472-D476 PolarHBondContact OG-O 3.43Å; T474-D476 VanDerWaalsContact C-N 3.3Å; T474-D476 WeakPolarHBondContact CB-OD2 3.23Å; T474-D476 PolarHBondContact OG1-OD2 2.77Å; D476-S690 VanDerWaalsContact OD1-CB 3.24Å; D476-S690 WeakPolarHBondContact OD1-CB 3.29Å; D476-S690 PolarHBondContact OD1-OG 3.43Å; D476-T692 WeakPolarHBondContact OD1-CB 3.34Å; D476-T692 PolarHBondContact OD1-OG1 2.97Å
477	L	96.9	Very high	80.8	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	136.6	175.1	-178.4	157.7	0	0	0	110	N399 F443 Q446 I447 L469 L470 I471	N399-L477 WeakPolarHBondContact CA-O 3.14Å; N399-L477 WeakPolarHBondContact CB-O 3.07Å; N399-L477 PolarHBondContact ND2-O 3.31Å; F443-L477 HydrophobicContact CB-CD1 3.63Å; F443-L477 HydrophobicContact CD1-CB 4.06Å; F443-L477 HydrophobicContact CD1-CD1 4.03Å; F443-L477 HydrophobicContact CD2-CD1 4.03Å; F443-L477 HydrophobicContact CE1-CB 4.42Å; F443-L477 HydrophobicContact CG-CD1 3.64Å; Q446-L477 HydrophobicContact CB-CB 4.12Å; I447-L477 HydrophobicContact CD1-CD1 4.39Å; I447-L477 HydrophobicContact CG1-CD1 4.24Å; I447-L477 HydrophobicContact CG1-CD2 3.58Å; L469-L477 HydrophobicContact CB-CD1 4.48Å; L469-L477 HydrophobicContact CB-CD2 4.4Å; L469-L477 HydrophobicContact CB-CG 4.47Å; L469-L477 HydrophobicContact CD2-CD2 4.23Å; L470-L477 CarbonylContact O-C 3.46Å; L470-L477 WeakPolarHBondContact O-CA 3.32Å; I471-L477 HydrophobicContact CG1-CB 4.43Å; I471-L477 HydrophobicContact CG1-CD1 4.41Å; I471-L477 HydrophobicContact CG1-CG 4.38Å
478	K	96.1	Very high	78.6	Confident	27 Å²	27	38.2 Å²	38.2	12%	0.117	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	133.6	-176.8	-55.8	-165	172.5	-155.7	0	112.9	A398 N399 V401 E418 L470 A480	A398-K478 WeakPolarHBondContact O-CE 3.41Å; A398-K478 WeakPolarHBondContact O-CG 3.41Å; N399-K478 WeakPolarHBondContact O-CA 3.49Å; V401-K478 HydrophobicContact CG2-CB 3.61Å; V401-K478 HydrophobicContact CG2-CD 4.26Å; E418-K478 IonicContact OE1-NZ 3.77Å; E418-K478 PolarHBondContact OE1-NZ 3.4Å; E418-K478 IonicContact OE2-NZ 2.82Å; E418-K478 PolarHBondContact OE2-NZ 3.14Å; L470-K478 PolarHBondContact N-O 2.99Å; L470-K478 PolarHBondContact O-N 3Å; K478-A480 PolarHBondContact O-N 3.07Å
479	L	94.9	Very high	76	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	125.8	167.1	-54.4	-174.2	0	0	0	109.8	N399 V401 I447 L451 L464 L469 F482	N399-L479 WeakPolarHBondContact O-CG 3.32Å; N399-L479 PolarHBondContact O-N 3.29Å; V401-L479 WeakPolarHBondContact CG2-O 3.26Å; V401-L479 PolarHBondContact N-O 3.34Å; I447-L479 HydrophobicContact CG2-CD2 4.3Å; L451-L479 HydrophobicContact CD2-CD1 3.71Å; L451-L479 HydrophobicContact CG-CD1 4.01Å; L464-L479 HydrophobicContact CD2-CD2 4.04Å; L469-L479 HydrophobicContact CD2-CD2 3.45Å; L469-L479 VanDerWaalsContact CD2-CD2 3.45Å; L479-F482 HydrophobicContact CB-CZ 4.35Å
480	A	90.4	Very high	72.9	Confident	7 Å²	7	46.1 Å²	46.1	6%	0.058	25%	0.25	C	C	.	.			trans	-130.9	160.1	-177.6	0	0	0	0	0	111	V401 H461 N468 L470 K478 F482	V401-A480 HydrophobicContact CB-CB 4.21Å; V401-A480 HydrophobicContact CG2-CB 3.58Å; H461-A480 PolarHBondContact CE1-O 3.42Å; H461-A480 VanDerWaalsContact CE1-O 3.23Å; H461-A480 PolarHBondContact NE2-O 2.95Å; H461-A480 VanDerWaalsContact NE2-O 3.09Å; N468-A480 WeakPolarHBondContact CB-O 3.32Å; N468-A480 WeakPolarHBondContact O-CA 3.32Å; N468-A480 WeakPolarHBondContact O-CB 3.36Å; N468-A480 PolarHBondContact O-N 2.97Å; L470-A480 HydrophobicContact CD1-CB 3.93Å; L470-A480 HydrophobicContact CG-CB 3.79Å; K478-A480 PolarHBondContact O-N 3.07Å; A480-F482 PolarHBondContact O-N 2.93Å
481	D	78.7	Confident	69.6	Low	59 Å²	59	49.5 Å²	49.5	32%	0.316	27%	0.274	S	S	.	.			trans	53.5	49.5	172.5	-92.8	3	0	0	0	114.8	K371 G483	K371-D481 WeakPolarHBondContact CD-OD1 3.49Å; K371-D481 IonicContact NZ-OD1 2.74Å; K371-D481 PolarHBondContact NZ-OD1 3.06Å; K371-D481 IonicContact NZ-OD2 2.72Å; K371-D481 PolarHBondContact NZ-OD2 3.16Å; D481-G483 PolarHBondContact O-N 3.32Å
482	F	71.6	Confident	66.8	Low	30 Å²	30	51.4 Å²	51.4	13%	0.132	28%	0.284	C	S	.	.			trans	-42.5	103.4	164.5	-71.3	-95.8	0	0	0	111.6	L395 I400 I459 H461 L479 A480 L484 A485	L395-F482 HydrophobicContact CD1-CE1 4.4Å; L395-F482 HydrophobicContact CD1-CE2 4.35Å; L395-F482 HydrophobicContact CD1-CZ 4.06Å; I400-F482 HydrophobicContact CG2-CE2 3.75Å; I400-F482 HydrophobicContact CG2-CZ 3.84Å; I459-F482 HydrophobicContact CG2-CD1 4.2Å; I459-F482 HydrophobicContact CG2-CE1 4.18Å; H461-F482 HydrophobicContact CB-CD1 4.45Å; H461-F482 AromaticContact CD2-CD1 3.57Å; H461-F482 AromaticContact CD2-CE1 3.58Å; H461-F482 AromaticContact CD2-CG 3.94Å; H461-F482 AromaticContact CD2-CZ 3.94Å; L479-F482 HydrophobicContact CB-CZ 4.35Å; A480-F482 PolarHBondContact O-N 2.93Å; F482-L484 VanDerWaalsContact C-N 3.34Å; F482-L484 PolarHBondContact O-N 3.06Å; F482-A485 HydrophobicContact CB-CB 3.66Å; F482-A485 HydrophobicContact CD1-CB 4.01Å; F482-A485 HydrophobicContact CG-CB 4.2Å
483	G	56.6	Low	64	Low	16 Å²	16	59.5 Å²	59.5	17%	0.165	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	78.4	-167.9	0	0	0	0	0	112.3	H461 D481	H461-G483 PolarHBondContact O-N 3.34Å; D481-G483 PolarHBondContact O-N 3.32Å
484	L	48.4	Very low	61.4	Low	119 Å²	119	57.9 Å²	57.9	62%	0.623	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	53	-171.5	-47.8	166.5	0	0	0	112.7	F482 R486	F482-L484 VanDerWaalsContact C-N 3.34Å; F482-L484 PolarHBondContact O-N 3.06Å; L484-R486 VanDerWaalsContact C-N 3.33Å; L484-R486 PolarHBondContact O-N 2.99Å
485	A	47.9	Very low	59.1	Low	14 Å²	14	58.2 Å²	58.2	12%	0.116	31%	0.31	C	S	.	.			trans	-64.2	89.7	170.9	0	0	0	0	0	112.3	L392 I459 F482	L392-A485 HydrophobicContact CD2-CB 4.05Å; I459-A485 HydrophobicContact CG2-CB 4.01Å; F482-A485 HydrophobicContact CB-CB 3.66Å; F482-A485 HydrophobicContact CD1-CB 4.01Å; F482-A485 HydrophobicContact CG-CB 4.2Å
486	R	46.7	Very low	56.9	Low	98 Å²	98	60.6 Å²	60.6	37%	0.37	33%	0.326	S	S	.	.			trans	-92.2	138.3	162.6	-60.9	-173.1	170.8	142.8	-1.5	109.2	E388 L484 I492	E388-R486 WeakPolarHBondContact OE2-CG 3.29Å; E388-R486 IonicContact OE2-NE 3.16Å; E388-R486 PolarHBondContact OE2-NE 3.32Å; L484-R486 VanDerWaalsContact C-N 3.33Å; L484-R486 PolarHBondContact O-N 2.99Å; R486-I492 HydrophobicContact CB-CD1 3.75Å; R486-I492 HydrophobicContact CG-CD1 4.27Å
487	S	44.5	Very low	54.6	Low	26 Å²	26	61 Å²	61	18%	0.182	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-61.3	140.9	172.5	48.9	0	0	0	0	111.3	S489	S487-S489 PolarHBondContact O-N 2.88Å; S487-S489 VanDerWaalsContact O-N 3.13Å
488	Q	46.6	Very low	52.5	Low	96 Å²	96	66.2 Å²	66.2	45%	0.449	35%	0.354	S	S	.	.	S	Bend	trans	-60.5	-22	179.1	-168.4	170.8	-38.1	0	0	113.6	Q458 V490	Q458-Q488 HydrophobicContact CB-CB 4.12Å; Q458-Q488 PolarHBondContact O-N 2.66Å; Q488-V490 PolarHBondContact O-N 2.94Å
489	S	38.3	Very low	50.3	Low	102 Å²	102	67.2 Å²	67.2	71%	0.713	36%	0.362	S	S	*	.	S	Bend	trans	-77.5	28.2	-174.8	67.6	0	0	0	0	115.8	S487	S487-S489 PolarHBondContact O-N 2.88Å; S487-S489 VanDerWaalsContact O-N 3.13Å
490	V	29.9	Very low	48.4	Very low	76 Å²	76	67.8 Å²	67.8	46%	0.461	37%	0.366	S	S	.	.	S	Bend	trans	-140.2	126.4	175.4	-175.7	0	0	0	0	109	Q488 I492	Q488-V490 PolarHBondContact O-N 2.94Å; V490-I492 VanDerWaalsContact C-N 3.28Å; V490-I492 HydrophobicContact CB-CD1 4.31Å; V490-I492 HydrophobicContact CB-CG1 4.25Å; V490-I492 HydrophobicContact CG1-CG1 4.15Å; V490-I492 PolarHBondContact O-N 3.44Å
491	P	26.6	Very low	47.3	Very low	111 Å²	111	69.7 Å²	69.7	72%	0.721	38%	0.377	S	S	*	.			trans	-71.4	83	177.1	29.5	-34.5	0	0	0	110.8
492	I	37.4	Very low	47.7	Very low	44 Å²	44	68.3 Å²	68.3	23%	0.226	37%	0.369	C	S	.	.			trans	-80.6	124	177.8	-65.2	146	0	0	0	108.2	R486 V490 T494	R486-I492 HydrophobicContact CB-CD1 3.75Å; R486-I492 HydrophobicContact CG-CD1 4.27Å; V490-I492 VanDerWaalsContact C-N 3.28Å; V490-I492 HydrophobicContact CB-CD1 4.31Å; V490-I492 HydrophobicContact CB-CG1 4.25Å; V490-I492 HydrophobicContact CG1-CG1 4.15Å; V490-I492 PolarHBondContact O-N 3.44Å; I492-T494 PolarHBondContact O-N 2.8Å
493	R	33.6	Very low	48.8	Very low	190 Å²	190	71.6 Å²	71.6	72%	0.717	38%	0.381	S	S	*	.			trans	-52.6	135.8	178.2	-62	-178.5	-177.7	-178.6	0	110.7	Y495	R493-Y495 PolarHBondContact O-N 3.33Å
494	T	31.3	Very low	50.6	Low	122 Å²	122	71 Å²	71	75%	0.748	37%	0.374	S	S	*	.			trans	-3.3	105.5	177.3	45.8	0	0	0	0	116.2	I492	I492-T494 PolarHBondContact O-N 2.8Å
495	Y	39.9	Very low	52.7	Low	63 Å²	63	66 Å²	66	25%	0.247	35%	0.346	C	S	.	.			trans	-55	136	171.4	-63.9	-84.2	0	0	0	111.9	R462 R493 Y516	R462-Y495 VanDerWaalsContact NH2-CZ 3.29Å; R462-Y495 PolarHBondContact NH2-OH 2.95Å; R493-Y495 PolarHBondContact O-N 3.33Å; Y495-Y516 AromaticContact CD2-CD2 3.27Å; Y495-Y516 HydrophobicContact CD2-CD2 3.27Å; Y495-Y516 AromaticContact CD2-CE2 3.3Å; Y495-Y516 HydrophobicContact CD2-CE2 3.3Å; Y495-Y516 HydrophobicContact CD2-CG 4.04Å; Y495-Y516 AromaticContact CE2-CD2 3.63Å; Y495-Y516 HydrophobicContact CE2-CD2 3.63Å; Y495-Y516 HydrophobicContact CE2-CE2 4.15Å; Y495-Y516 HydrophobicContact CE2-CG 4.13Å; Y495-Y516 HydrophobicContact CG-CD2 4.02Å; Y495-Y516 AromaticContact CG-CE2 3.73Å; Y495-Y516 HydrophobicContact CG-CE2 3.73Å
496	S	44	Very low	54.9	Low	58 Å²	58	65.3 Å²	65.3	41%	0.406	34%	0.341	S	S	.	.			trans	-66.1	141.1	158.4	172.3	0	0	0	0	109.3	E498	S496-E498 PolarHBondContact O-N 3.27Å; S496-E498 VanDerWaalsContact O-N 3.11Å; S496-E498 VanDerWaalsContact OG-CD 3.24Å; S496-E498 PolarHBondContact OG-N 3.31Å; S496-E498 PolarHBondContact OG-OE2 3.27Å
497	S	46.5	Very low	57.2	Low	22 Å²	22	60.7 Å²	60.7	15%	0.154	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-63	-10.3	174.9	64.8	0	0	0	0	114.6	V499 R505	S497-V499 PolarHBondContact O-N 2.83Å; S497-R505 PolarHBondContact O-NE 2.63Å; S497-R505 PolarHBondContact O-NH1 3.44Å
498	E	51.8	Low	59.5	Low	110 Å²	110	59.7 Å²	59.7	51%	0.514	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-80.3	-10.2	-171	-78.5	125.1	-152.4	0	0	116.4	S496 V500 R505 K544	S496-E498 PolarHBondContact O-N 3.27Å; S496-E498 VanDerWaalsContact O-N 3.11Å; S496-E498 VanDerWaalsContact OG-CD 3.24Å; S496-E498 PolarHBondContact OG-N 3.31Å; S496-E498 PolarHBondContact OG-OE2 3.27Å; E498-V500 VanDerWaalsContact C-N 3.25Å; E498-V500 PolarHBondContact O-N 2.88Å; E498-V500 VanDerWaalsContact O-N 3.12Å; E498-R505 PolarHBondContact O-NH2 2.91Å; E498-K544 WeakPolarHBondContact OE1-CE 3.46Å; E498-K544 IonicContact OE1-NZ 2.73Å; E498-K544 PolarHBondContact OE1-NZ 3.44Å
499	V	50.2	Low	61.6	Low	49 Å²	49	55.3 Å²	55.3	30%	0.297	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-61.7	-26.7	-168	-179.6	0	0	0	0	114.3	R462 S497	R462-V499 HydrophobicContact CB-CG1 4.07Å; S497-V499 PolarHBondContact O-N 2.83Å
500	V	54.5	Low	64.2	Low	11 Å²	11	50.6 Å²	50.6	7%	0.067	26%	0.263	C	S	.	.	S	Bend	trans	-92	134.3	177.7	-168	0	0	0	0	110.5	R462 E498 L502 R505 I520	R462-V500 WeakPolarHBondContact O-CA 3.45Å; R462-V500 WeakPolarHBondContact O-CB 3.37Å; R462-V500 VanDerWaalsContact O-CG1 3.31Å; R462-V500 WeakPolarHBondContact O-CG1 3.47Å; R462-V500 WeakPolarHBondContact O-CG2 3.39Å; E498-V500 VanDerWaalsContact C-N 3.25Å; E498-V500 PolarHBondContact O-N 2.88Å; E498-V500 VanDerWaalsContact O-N 3.12Å; V500-L502 PolarHBondContact O-N 3.28Å; V500-R505 HydrophobicContact CB-CB 3.94Å; V500-R505 HydrophobicContact CB-CG 3.8Å; V500-R505 HydrophobicContact CG1-CB 3.94Å; V500-R505 HydrophobicContact CG1-CG 4.26Å; V500-R505 HydrophobicContact CG2-CG 4.06Å; V500-R505 VanDerWaalsContact O-CZ 3.31Å; V500-R505 PolarHBondContact O-NE 2.96Å; V500-R505 VanDerWaalsContact O-NE 3.07Å; V500-R505 PolarHBondContact O-NH2 3.27Å; V500-I520 HydrophobicContact CG2-CG2 4.29Å
501	T	68.7	Low	67.2	Low	47 Å²	47	47.1 Å²	47.1	29%	0.288	24%	0.242	S	C	.	.			trans	-55.8	125.3	169.6	-65.8	0	0	0	0	110.7	D463 K465 W503 Y504 R505	D463-T501 WeakPolarHBondContact OD1-CB 3.49Å; D463-T501 PolarHBondContact OD1-N 3.35Å; D463-T501 PolarHBondContact OD1-OG1 3.01Å; K465-T501 HydrophobicContact CD-CG2 4.04Å; K465-T501 WeakPolarHBondContact CD-OG1 3.25Å; K465-T501 PolarHBondContact NZ-OG1 3.13Å; T501-W503 PolarHBondContact O-N 3.24Å; T501-W503 VanDerWaalsContact O-N 3.11Å; T501-Y504 HydrophobicContact CG2-CD2 4.05Å; T501-Y504 HydrophobicContact CG2-CE2 4.32Å; T501-Y504 PolarHBondContact O-N 3.09Å; T501-R505 PolarHBondContact O-N 3.21Å
502	L	87.3	Confident	70	Confident	30 Å²	30	43.2 Å²	43.2	16%	0.157	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-48	-47.9	-160.5	-178.3	60.3	0	0	0	115	V500 Y504 R505 L510 G541 Q547	V500-L502 PolarHBondContact O-N 3.28Å; L502-Y504 PolarHBondContact O-N 3.06Å; L502-Y504 VanDerWaalsContact O-N 3.14Å; L502-R505 VanDerWaalsContact O-CB 3.3Å; L502-R505 WeakPolarHBondContact O-CB 3.26Å; L502-R505 PolarHBondContact O-N 3.46Å; L502-L510 HydrophobicContact CD1-CD2 4.06Å; L502-G541 WeakPolarHBondContact CD2-O 3.25Å; L502-Q547 HydrophobicContact CD1-CB 3.75Å; L502-Q547 HydrophobicContact CD1-CG 3.85Å; L502-Q547 HydrophobicContact CG-CB 4.07Å; L502-Q547 HydrophobicContact CG-CG 4.13Å; L502-Q547 PolarHBondContact O-NE2 3.19Å
503	W	93.8	Very high	72.3	Confident	99 Å²	99	43.8 Å²	43.8	38%	0.375	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-61.4	-23.5	-176.7	-59.2	-10.3	0	0	0	114.7	T501 F539 P540 G541 Q547	T501-W503 PolarHBondContact O-N 3.24Å; T501-W503 VanDerWaalsContact O-N 3.11Å; W503-F539 VanDerWaalsContact CA-O 3.31Å; W503-F539 WeakPolarHBondContact CA-O 3.2Å; W503-F539 WeakPolarHBondContact CB-O 3.35Å; W503-P540 HydrophobicContact CD2-CB 4.37Å; W503-P540 HydrophobicContact CZ2-CB 4.27Å; W503-P540 VanDerWaalsContact NE1-C 3.28Å; W503-G541 PolarHBondContact NE1-O 2.83Å; W503-Q547 PolarHBondContact O-NE2 3.18Å
504	Y	94.2	Very high	74.4	Confident	5 Å²	5	42.2 Å²	42.2	2%	0.02	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-108.7	9.6	-178.2	-48.7	-82.1	0	0	0	111.7	L464 K465 P466 T501 L502 C527 I528 E531	L464-Y504 WeakPolarHBondContact O-CB 3.48Å; K465-Y504 HydrophobicContact CB-CD2 3.66Å; K465-Y504 HydrophobicContact CB-CE2 3.55Å; K465-Y504 HydrophobicContact CB-CG 4.36Å; P466-Y504 VanDerWaalsContact CD-CZ 3.5Å; P466-Y504 VanDerWaalsContact CD-OH 3.28Å; P466-Y504 WeakPolarHBondContact CD-OH 3.48Å; T501-Y504 HydrophobicContact CG2-CD2 4.05Å; T501-Y504 HydrophobicContact CG2-CE2 4.32Å; T501-Y504 PolarHBondContact O-N 3.09Å; L502-Y504 PolarHBondContact O-N 3.06Å; L502-Y504 VanDerWaalsContact O-N 3.14Å; Y504-C527 HydrophobicContact CD1-CB 3.72Å; Y504-C527 HydrophobicContact CE1-CB 4.31Å; Y504-I528 HydrophobicContact CD1-CG1 4Å; Y504-I528 HydrophobicContact CE1-CG1 3.95Å; Y504-E531 PolarHBondContact OH-OE2 3.28Å
505	R	92.5	Very high	76.6	Confident	13 Å²	13	42 Å²	42	5%	0.049	22%	0.217	C	C	.	.			trans	-84.7	131.1	178.7	-164.1	179.4	-53.8	160.3	-0.1	110.4	S497 E498 V500 T501 L502 V509 L510 W523	S497-R505 PolarHBondContact O-NE 2.63Å; S497-R505 PolarHBondContact O-NH1 3.44Å; E498-R505 PolarHBondContact O-NH2 2.91Å; V500-R505 HydrophobicContact CB-CB 3.94Å; V500-R505 HydrophobicContact CB-CG 3.8Å; V500-R505 HydrophobicContact CG1-CB 3.94Å; V500-R505 HydrophobicContact CG1-CG 4.26Å; V500-R505 HydrophobicContact CG2-CG 4.06Å; V500-R505 VanDerWaalsContact O-CZ 3.31Å; V500-R505 PolarHBondContact O-NE 2.96Å; V500-R505 VanDerWaalsContact O-NE 3.07Å; V500-R505 PolarHBondContact O-NH2 3.27Å; T501-R505 PolarHBondContact O-N 3.21Å; L502-R505 VanDerWaalsContact O-CB 3.3Å; L502-R505 WeakPolarHBondContact O-CB 3.26Å; L502-R505 PolarHBondContact O-N 3.46Å; R505-V509 HydrophobicContact CG-CB 4.49Å; R505-V509 HydrophobicContact CG-CG1 4.32Å; R505-L510 HydrophobicContact CB-CD1 4.38Å; R505-L510 HydrophobicContact CB-CG 4.42Å; R505-L510 HydrophobicContact CG-CD1 4.49Å; R505-L510 HydrophobicContact CG-CD2 4.45Å; R505-L510 HydrophobicContact CG-CG 4.04Å; R505-W523 PolarHBondContact O-NE1 3.13Å
506	P	94.5	Very high	78.3	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.213	C	C	.	.			trans	-74.4	156.3	179	31.6	-36.9	0	0	0	112.5	D508 V509 L510 I520 W523	P506-D508 WeakPolarHBondContact CB-OD1 3.48Å; P506-D508 VanDerWaalsContact CG-OD1 3.23Å; P506-D508 WeakPolarHBondContact CG-OD1 3.47Å; P506-D508 PolarHBondContact O-N 3.32Å; P506-V509 HydrophobicContact CG-CB 4.08Å; P506-V509 HydrophobicContact CG-CG2 3.79Å; P506-V509 PolarHBondContact O-N 3.37Å; P506-L510 PolarHBondContact O-N 3.11Å; P506-I520 HydrophobicContact CG-CB 4.48Å; P506-I520 HydrophobicContact CG-CG1 4.31Å; P506-I520 HydrophobicContact CG-CG2 4.15Å; P506-W523 HydrophobicContact CB-CB 3.84Å; P506-W523 HydrophobicContact CB-CD2 3.88Å; P506-W523 HydrophobicContact CB-CE3 4.45Å; P506-W523 HydrophobicContact CB-CG 3.57Å
507	P	95.2	Very high	80.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-70.1	-29.8	-174.5	27.2	-33.7	0	0	0	113	L510 L511 W523 I548 I551 W563 L655	P507-L510 PolarHBondContact O-N 3.07Å; P507-L511 WeakPolarHBondContact O-CB 3.42Å; P507-L511 WeakPolarHBondContact O-CG 3.28Å; P507-L511 PolarHBondContact O-N 2.9Å; P507-W523 HydrophobicContact CG-CH2 3.97Å; P507-W523 HydrophobicContact CG-CZ2 4.42Å; P507-W523 HydrophobicContact CG-CZ3 4.13Å; P507-I548 HydrophobicContact CB-CD1 3.78Å; P507-I551 HydrophobicContact CB-CD1 4.26Å; P507-I551 HydrophobicContact CB-CG2 4.42Å; P507-I551 HydrophobicContact CG-CG2 4.49Å; P507-W563 HydrophobicContact CB-CH2 4.09Å; P507-W563 HydrophobicContact CB-CZ3 4.21Å; P507-W563 HydrophobicContact CG-CH2 4.31Å; P507-W563 HydrophobicContact CG-CZ3 4.22Å; P507-L655 HydrophobicContact CG-CB 4.37Å; P507-L655 HydrophobicContact CG-CD2 3.71Å; P507-L655 WeakPolarHBondContact CG-O 3.47Å
508	D	93.2	Very high	82.1	Confident	6 Å²	6	39.5 Å²	39.5	3%	0.032	21%	0.206	C	C	.	.	H	α-helix	trans	-59.8	-49.1	174.7	49.5	14.4	0	0	0	111.9	P506 L510 L511 G512 D513 W563 G657 R660	P506-D508 WeakPolarHBondContact CB-OD1 3.48Å; P506-D508 VanDerWaalsContact CG-OD1 3.23Å; P506-D508 WeakPolarHBondContact CG-OD1 3.47Å; P506-D508 PolarHBondContact O-N 3.32Å; D508-L510 PolarHBondContact O-N 3.01Å; D508-L511 CarbonylContact O-C 3.53Å; D508-L511 PolarHBondContact O-N 2.96Å; D508-G512 PolarHBondContact O-N 2.75Å; D508-D513 HydrophobicContact CB-CB 4.06Å; D508-D513 WeakPolarHBondContact O-CB 3.44Å; D508-D513 PolarHBondContact O-N 3.31Å; D508-W563 HydrophobicContact CB-CH2 4.25Å; D508-W563 HydrophobicContact CB-CZ2 4.16Å; D508-G657 WeakPolarHBondContact OD2-CA 3.41Å; D508-G657 PolarHBondContact OD2-N 2.79Å; D508-R660 VanDerWaalsContact CG-NH2 3.3Å; D508-R660 IonicContact OD1-NH1 3.44Å; D508-R660 IonicContact OD1-NH2 2.67Å; D508-R660 PolarHBondContact OD1-NH2 3.03Å; D508-R660 IonicContact OD2-CZ 2.93Å; D508-R660 VanDerWaalsContact OD2-CZ 3.31Å; D508-R660 IonicContact OD2-NH1 3.54Å; D508-R660 PolarHBondContact OD2-NH1 2.67Å; D508-R660 VanDerWaalsContact OD2-NH1 3.08Å; D508-R660 IonicContact OD2-NH2 2.71Å; D508-R660 PolarHBondContact OD2-NH2 3.27Å
509	V	90.8	Very high	84.1	Confident	4 Å²	4	36.5 Å²	36.5	2%	0.024	19%	0.192	C	C	.	.	H	α-helix	trans	-66.3	-35.3	175.8	177.2	0	0	0	0	112	R505 P506 G512 Y516 I520	R505-V509 HydrophobicContact CG-CB 4.49Å; R505-V509 HydrophobicContact CG-CG1 4.32Å; P506-V509 HydrophobicContact CG-CB 4.08Å; P506-V509 HydrophobicContact CG-CG2 3.79Å; P506-V509 PolarHBondContact O-N 3.37Å; V509-G512 PolarHBondContact O-N 2.8Å; V509-Y516 HydrophobicContact CG1-CE1 4.18Å; V509-Y516 HydrophobicContact CG2-CE1 4.45Å; V509-I520 HydrophobicContact CG2-CD1 3.57Å; V509-I520 HydrophobicContact CG2-CG1 3.85Å
510	L	91.9	Very high	86	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-65.6	-38.7	174.7	-78.9	160.2	0	0	0	112.3	L502 R505 P506 P507 D508 G512 K544 Q547 I548 I551 Y575	L502-L510 HydrophobicContact CD1-CD2 4.06Å; R505-L510 HydrophobicContact CB-CD1 4.38Å; R505-L510 HydrophobicContact CB-CG 4.42Å; R505-L510 HydrophobicContact CG-CD1 4.49Å; R505-L510 HydrophobicContact CG-CD2 4.45Å; R505-L510 HydrophobicContact CG-CG 4.04Å; P506-L510 PolarHBondContact O-N 3.11Å; P507-L510 PolarHBondContact O-N 3.07Å; D508-L510 PolarHBondContact O-N 3.01Å; L510-G512 VanDerWaalsContact C-N 3.26Å; L510-G512 PolarHBondContact O-N 3.4Å; L510-K544 HydrophobicContact CD2-CB 4Å; L510-K544 HydrophobicContact CD2-CG 4.25Å; L510-Q547 HydrophobicContact CD1-CB 4.24Å; L510-Q547 HydrophobicContact CD1-CG 3.59Å; L510-I548 HydrophobicContact CB-CD1 3.7Å; L510-I548 HydrophobicContact CB-CG1 3.82Å; L510-I548 HydrophobicContact CD1-CD1 3.99Å; L510-I548 HydrophobicContact CD1-CG1 4.12Å; L510-I548 HydrophobicContact CG-CD1 4.46Å; L510-I548 HydrophobicContact CG-CG1 4.45Å; L510-I551 HydrophobicContact CD1-CD1 4.31Å; L510-Y575 PolarHBondContact O-OH 3.18Å
511	L	92.4	Very high	87.9	Confident	4 Å²	4	34.2 Å²	34.2	2%	0.021	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	5.9	175.3	-63.6	178.5	0	0	0	113.5	P507 D508 I548 F552 W563 L566 N569 K571 F572 Y575	P507-L511 WeakPolarHBondContact O-CB 3.42Å; P507-L511 WeakPolarHBondContact O-CG 3.28Å; P507-L511 PolarHBondContact O-N 2.9Å; D508-L511 CarbonylContact O-C 3.53Å; D508-L511 PolarHBondContact O-N 2.96Å; L511-I548 HydrophobicContact CD1-CD1 4.4Å; L511-I548 HydrophobicContact CD2-CD1 4.21Å; L511-I548 HydrophobicContact CD2-CG1 4.35Å; L511-I548 HydrophobicContact CG-CD1 3.95Å; L511-F552 HydrophobicContact CD1-CE2 4.24Å; L511-F552 HydrophobicContact CD1-CZ 4.17Å; L511-W563 HydrophobicContact CD1-CH2 3.75Å; L511-W563 HydrophobicContact CD1-CZ2 4.03Å; L511-W563 HydrophobicContact CD1-CZ3 4.39Å; L511-L566 HydrophobicContact CD1-CD1 3.44Å; L511-L566 VanDerWaalsContact CD1-CD1 3.44Å; L511-N569 PolarHBondContact O-ND2 2.88Å; L511-K571 HydrophobicContact CD2-CB 4.18Å; L511-F572 HydrophobicContact CD1-CB 4.41Å; L511-F572 HydrophobicContact CD1-CD2 4.19Å; L511-F572 HydrophobicContact CD2-CB 3.94Å; L511-Y575 HydrophobicContact CD2-CD2 3.81Å; L511-Y575 HydrophobicContact CD2-CE2 3.83Å
512	G	86.6	Confident	89.3	Confident	28 Å²	28	32 Å²	32	29%	0.289	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.4	16.1	165.3	0	0	0	0	0	116.7	D508 V509 L510	D508-G512 PolarHBondContact O-N 2.75Å; V509-G512 PolarHBondContact O-N 2.8Å; L510-G512 VanDerWaalsContact C-N 3.26Å; L510-G512 PolarHBondContact O-N 3.4Å
513	D	84.5	Confident	89.7	Confident	56 Å²	56	30.6 Å²	30.6	30%	0.299	16%	0.157	S	C	.	.			trans	-58.3	137.5	168	-170.9	6	0	0	0	110.7	D508 N515	D508-D513 HydrophobicContact CB-CB 4.06Å; D508-D513 WeakPolarHBondContact O-CB 3.44Å; D508-D513 PolarHBondContact O-N 3.31Å; D513-N515 WeakPolarHBondContact OD1-CB 3.33Å; D513-N515 PolarHBondContact OD1-N 2.83Å; D513-N515 PolarHBondContact OD1-ND2 3.17Å
514	K	78.9	Confident	89.9	Confident	158 Å²	158	26 Å²	26	69%	0.687	14%	0.14	S	C	*	.			trans	-104.5	-1.5	-178.2	-61.2	175	-175.1	171.1	0	112.2	Y516	K514-Y516 WeakPolarHBondContact O-CD2 3.28Å; K514-Y516 PolarHBondContact O-N 3.01Å
515	N	77.5	Confident	90	Very high	118 Å²	118	25.8 Å²	25.8	63%	0.631	14%	0.139	S	C	*	.			trans	-79.8	63.7	-177.7	-66.2	-57.1	0	0	0	112.7	D513 S517	D513-N515 WeakPolarHBondContact OD1-CB 3.33Å; D513-N515 PolarHBondContact OD1-N 2.83Å; D513-N515 PolarHBondContact OD1-ND2 3.17Å; N515-S517 PolarHBondContact O-N 2.67Å; N515-S517 PolarHBondContact O-OG 2.9Å
516	Y	74.4	Confident	90.3	Very high	37 Å²	37	25.1 Å²	25.1	15%	0.145	14%	0.137	C	C	.	.			trans	-62.1	97.4	-179.4	-67.3	-83.9	0	0	0	112.1	Y495 V509 K514 I520	Y495-Y516 AromaticContact CD2-CD2 3.27Å; Y495-Y516 HydrophobicContact CD2-CD2 3.27Å; Y495-Y516 AromaticContact CD2-CE2 3.3Å; Y495-Y516 HydrophobicContact CD2-CE2 3.3Å; Y495-Y516 HydrophobicContact CD2-CG 4.04Å; Y495-Y516 AromaticContact CE2-CD2 3.63Å; Y495-Y516 HydrophobicContact CE2-CD2 3.63Å; Y495-Y516 HydrophobicContact CE2-CE2 4.15Å; Y495-Y516 HydrophobicContact CE2-CG 4.13Å; Y495-Y516 HydrophobicContact CG-CD2 4.02Å; Y495-Y516 AromaticContact CG-CE2 3.73Å; Y495-Y516 HydrophobicContact CG-CE2 3.73Å; V509-Y516 HydrophobicContact CG1-CE1 4.18Å; V509-Y516 HydrophobicContact CG2-CE1 4.45Å; K514-Y516 WeakPolarHBondContact O-CD2 3.28Å; K514-Y516 PolarHBondContact O-N 3.01Å; Y516-I520 HydrophobicContact CD1-CD1 3.41Å; Y516-I520 VanDerWaalsContact CD1-CD1 3.41Å; Y516-I520 HydrophobicContact CE1-CD1 4.1Å; Y516-I520 HydrophobicContact CG-CD1 4.14Å
517	S	83.5	Confident	90.5	Very high	35 Å²	35	25.2 Å²	25.2	25%	0.245	14%	0.137	C	C	.	.			trans	-129.9	175	-175.6	59.5	0	0	0	0	111.5	N515 H519 I520	N515-S517 PolarHBondContact O-N 2.67Å; N515-S517 PolarHBondContact O-OG 2.9Å; S517-H519 PolarHBondContact O-N 2.93Å; S517-H519 VanDerWaalsContact O-N 3.09Å; S517-H519 PolarHBondContact OG-ND1 2.62Å; S517-I520 PolarHBondContact O-N 2.63Å; S517-I520 VanDerWaalsContact O-N 3.17Å
518	G	88.1	Confident	90.6	Very high	17 Å²	17	25.2 Å²	25.2	18%	0.175	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-30.7	-178.8	0	0	0	0	0	114.3	H455 I520 D521 I522	H455-G518 VanDerWaalsContact CE1-CA 3.47Å; H455-G518 WeakPolarHBondContact CE1-CA 3.36Å; H455-G518 PolarHBondContact CE1-O 2.85Å; G518-I520 PolarHBondContact O-N 2.99Å; G518-D521 WeakPolarHBondContact O-CB 3.45Å; G518-D521 PolarHBondContact O-N 3.21Å; G518-I522 PolarHBondContact O-N 3.23Å
519	H	92.5	Very high	90.8	Very high	47 Å²	47	24.9 Å²	24.9	22%	0.218	14%	0.135	C	C	.	.	H	α-helix	trans	-60.1	-16.3	-180	-45.2	103.3	0	0	0	114.8	S517 W523 G657 R660	S517-H519 PolarHBondContact O-N 2.93Å; S517-H519 VanDerWaalsContact O-N 3.09Å; S517-H519 PolarHBondContact OG-ND1 2.62Å; H519-W523 PolarHBondContact O-N 2.85Å; H519-G657 VanDerWaalsContact CB-O 3.27Å; H519-G657 WeakPolarHBondContact CB-O 3.35Å; H519-G657 PolarHBondContact CD2-O 2.85Å; H519-G657 VanDerWaalsContact CD2-O 3.24Å; H519-R660 HydrophobicContact CB-CB 4.38Å; H519-R660 WeakPolarHBondContact O-CD 3.4Å; H519-R660 PolarHBondContact O-NH1 2.85Å
520	I	91.9	Very high	91.2	Very high	9 Å²	9	26 Å²	26	5%	0.046	14%	0.139	C	C	.	.	H	α-helix	trans	-70.9	-43.1	172	-65.7	174	0	0	0	110.5	V500 P506 V509 Y516 S517 G518 I522	V500-I520 HydrophobicContact CG2-CG2 4.29Å; P506-I520 HydrophobicContact CG-CB 4.48Å; P506-I520 HydrophobicContact CG-CG1 4.31Å; P506-I520 HydrophobicContact CG-CG2 4.15Å; V509-I520 HydrophobicContact CG2-CD1 3.57Å; V509-I520 HydrophobicContact CG2-CG1 3.85Å; Y516-I520 HydrophobicContact CD1-CD1 3.41Å; Y516-I520 VanDerWaalsContact CD1-CD1 3.41Å; Y516-I520 HydrophobicContact CE1-CD1 4.1Å; Y516-I520 HydrophobicContact CG-CD1 4.14Å; S517-I520 PolarHBondContact O-N 2.63Å; S517-I520 VanDerWaalsContact O-N 3.17Å; G518-I520 PolarHBondContact O-N 2.99Å; I520-I522 VanDerWaalsContact C-N 3.32Å; I520-I522 PolarHBondContact O-N 2.9Å
521	D	94	Very high	91.4	Very high	3 Å²	3	25.9 Å²	25.9	2%	0.016	14%	0.139	C	C	.	.	H	α-helix	trans	-66.7	-37.5	177.6	-68.2	-30.4	0	0	0	110.4	L451 H455 H461 R462 L464 G518 W523 G524 V525	L451-D521 HydrophobicContact CD1-CB 4.12Å; L451-D521 HydrophobicContact CD2-CB 4.01Å; H455-D521 IonicContact CD2-OD2 2.7Å; H455-D521 IonicContact CE1-OD2 3.15Å; H455-D521 IonicContact NE2-OD2 2.65Å; H455-D521 PolarHBondContact NE2-OD2 3Å; H461-D521 WeakPolarHBondContact CB-OD1 3.45Å; H461-D521 PolarHBondContact N-OD1 3.35Å; H461-D521 PolarHBondContact N-OD2 2.95Å; R462-D521 PolarHBondContact N-OD1 2.73Å; L464-D521 HydrophobicContact CD1-CB 3.68Å; L464-D521 VanDerWaalsContact CD1-O 3.28Å; L464-D521 WeakPolarHBondContact CD1-O 3.18Å; G518-D521 WeakPolarHBondContact O-CB 3.45Å; G518-D521 PolarHBondContact O-N 3.21Å; D521-W523 PolarHBondContact O-N 2.76Å; D521-G524 WeakPolarHBondContact O-CA 3.37Å; D521-G524 PolarHBondContact O-N 3.36Å; D521-G524 VanDerWaalsContact O-N 3.07Å; D521-V525 WeakPolarHBondContact O-CG2 3.2Å; D521-V525 PolarHBondContact O-N 3.36Å
522	I	97.3	Very high	91.7	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-59.2	-44.6	180	-56.1	-63.2	0	0	0	112.6	F448 G518 I520 G524 V525 G526 C652 R660 I661 A663	F448-I522 HydrophobicContact CD1-CD1 4.26Å; F448-I522 HydrophobicContact CE1-CD1 3.92Å; G518-I522 PolarHBondContact O-N 3.23Å; I520-I522 VanDerWaalsContact C-N 3.32Å; I520-I522 PolarHBondContact O-N 2.9Å; I522-G524 VanDerWaalsContact C-N 3.26Å; I522-G524 PolarHBondContact O-N 2.86Å; I522-V525 WeakPolarHBondContact O-CA 3.43Å; I522-V525 WeakPolarHBondContact O-CB 3.39Å; I522-V525 PolarHBondContact O-N 2.7Å; I522-G526 PolarHBondContact O-N 3.15Å; I522-C652 HydrophobicContact CG2-CB 4.07Å; I522-R660 HydrophobicContact CG2-CB 4.26Å; I522-I661 WeakPolarHBondContact CG1-O 3.43Å; I522-I661 HydrophobicContact CG2-CG2 4.25Å; I522-I661 WeakPolarHBondContact CG2-O 3.39Å; I522-A663 HydrophobicContact CD1-CB 4.02Å
523	W	97	Very high	92.2	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-58.6	-40.5	174.6	174.6	-84.1	0	0	0	111.7	R505 P506 P507 H519 D521 V525 G526 C527 F539 I551 F555 C652 L653 L655	R505-W523 PolarHBondContact O-NE1 3.13Å; P506-W523 HydrophobicContact CB-CB 3.84Å; P506-W523 HydrophobicContact CB-CD2 3.88Å; P506-W523 HydrophobicContact CB-CE3 4.45Å; P506-W523 HydrophobicContact CB-CG 3.57Å; P507-W523 HydrophobicContact CG-CH2 3.97Å; P507-W523 HydrophobicContact CG-CZ2 4.42Å; P507-W523 HydrophobicContact CG-CZ3 4.13Å; H519-W523 PolarHBondContact O-N 2.85Å; D521-W523 PolarHBondContact O-N 2.76Å; W523-V525 VanDerWaalsContact C-N 3.33Å; W523-V525 PolarHBondContact O-N 2.93Å; W523-G526 PolarHBondContact O-N 3.35Å; W523-C527 PolarHBondContact O-N 3.49Å; W523-C527 PolarHBondContact O-SG 2.99Å; W523-C527 VanDerWaalsContact O-SG 3.35Å; W523-F539 AromaticContact CH2-CE2 3.79Å; W523-F539 HydrophobicContact CH2-CE2 3.79Å; W523-F539 HydrophobicContact CH2-CZ 4.14Å; W523-F539 AromaticContact CZ2-CD2 3.81Å; W523-F539 HydrophobicContact CZ2-CD2 3.81Å; W523-F539 AromaticContact CZ2-CE2 3.28Å; W523-F539 HydrophobicContact CZ2-CE2 3.28Å; W523-F539 HydrophobicContact CZ2-CZ 4.05Å; W523-I551 HydrophobicContact CH2-CD1 4.49Å; W523-I551 HydrophobicContact CH2-CG2 4.25Å; W523-I551 HydrophobicContact CZ2-CD1 3.89Å; W523-I551 HydrophobicContact CZ2-CG1 4.25Å; W523-F555 HydrophobicContact CH2-CE2 4.26Å; W523-C652 WeakPolarHBondContact CA-O 3.39Å; W523-L653 HydrophobicContact CD2-CD2 3.92Å; W523-L653 HydrophobicContact CE3-CD2 3.9Å; W523-L653 HydrophobicContact CG-CD2 4.45Å; W523-L653 HydrophobicContact CH2-CD2 4.45Å; W523-L653 HydrophobicContact CZ2-CD2 4.47Å; W523-L653 HydrophobicContact CZ3-CB 4.35Å; W523-L653 HydrophobicContact CZ3-CD2 4.18Å; W523-L653 VanDerWaalsContact CZ3-O 3.31Å; W523-L653 WeakPolarHBondContact CZ3-O 3.4Å; W523-L655 HydrophobicContact CH2-CD2 4.21Å; W523-L655 HydrophobicContact CZ3-CD2 4.34Å
524	G	96.1	Very high	92.7	Very high	2 Å²	2	23.5 Å²	23.5	2%	0.021	12%	0.121	C	C	.	.	H	α-helix	trans	-58.3	-42	171.8	0	0	0	0	0	112.4	D521 I522 C527 I528	D521-G524 WeakPolarHBondContact O-CA 3.37Å; D521-G524 PolarHBondContact O-N 3.36Å; D521-G524 VanDerWaalsContact O-N 3.07Å; I522-G524 VanDerWaalsContact C-N 3.26Å; I522-G524 PolarHBondContact O-N 2.86Å; G524-C527 PolarHBondContact O-N 3.09Å; G524-I528 WeakPolarHBondContact O-CB 3.45Å; G524-I528 WeakPolarHBondContact O-CD1 3.15Å; G524-I528 WeakPolarHBondContact O-CG1 3.37Å; G524-I528 PolarHBondContact O-N 3.41Å
525	V	98.1	Very high	93.4	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.006	9%	0.09	C	C	.	.	H	α-helix	trans	-63.2	-43	173.8	-169.8	0	0	0	0	111.7	T444 I447 F448 L451 L464 D521 I522 W523 C527 I528 L529	T444-V525 HydrophobicContact CG2-CG1 4.22Å; I447-V525 HydrophobicContact CG2-CB 4.38Å; I447-V525 HydrophobicContact CG2-CG1 3.92Å; I447-V525 HydrophobicContact CG2-CG2 3.57Å; F448-V525 HydrophobicContact CD1-CG1 4.48Å; F448-V525 HydrophobicContact CD2-CG1 4.5Å; F448-V525 HydrophobicContact CE1-CB 4.09Å; F448-V525 HydrophobicContact CE1-CG1 3.87Å; F448-V525 HydrophobicContact CE1-CG2 4.16Å; F448-V525 HydrophobicContact CE2-CG1 3.91Å; F448-V525 HydrophobicContact CZ-CB 4.12Å; F448-V525 HydrophobicContact CZ-CG1 3.55Å; L451-V525 HydrophobicContact CD1-CG2 3.41Å; L451-V525 VanDerWaalsContact CD1-CG2 3.41Å; L464-V525 HydrophobicContact CD1-CG2 4.14Å; D521-V525 WeakPolarHBondContact O-CG2 3.2Å; D521-V525 PolarHBondContact O-N 3.36Å; I522-V525 WeakPolarHBondContact O-CA 3.43Å; I522-V525 WeakPolarHBondContact O-CB 3.39Å; I522-V525 PolarHBondContact O-N 2.7Å; W523-V525 VanDerWaalsContact C-N 3.33Å; W523-V525 PolarHBondContact O-N 2.93Å; V525-C527 PolarHBondContact O-N 3.23Å; V525-I528 CarbonylContact O-C 3.49Å; V525-I528 PolarHBondContact O-N 2.78Å; V525-L529 WeakPolarHBondContact O-CB 3.33Å; V525-L529 PolarHBondContact O-N 3.43Å
526	G	98.1	Very high	94.1	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-58.4	-46.6	176.1	0	0	0	0	0	112.5	I522 W523 I528 L529 Y530 L649	I522-G526 PolarHBondContact O-N 3.15Å; W523-G526 PolarHBondContact O-N 3.35Å; G526-I528 VanDerWaalsContact C-N 3.33Å; G526-I528 PolarHBondContact O-N 3.02Å; G526-L529 PolarHBondContact O-N 3.35Å; G526-Y530 PolarHBondContact O-N 3.28Å; G526-L649 WeakPolarHBondContact O-CD1 3.31Å
527	C	97.8	Very high	95.1	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.007	9%	0.086	C	C	.	.	H	α-helix	trans	-61.9	-38.6	175.1	-66.1	0	0	0	0	112.5	Y504 W523 G524 V525 E531	Y504-C527 HydrophobicContact CD1-CB 3.72Å; Y504-C527 HydrophobicContact CE1-CB 4.31Å; W523-C527 PolarHBondContact O-N 3.49Å; W523-C527 PolarHBondContact O-SG 2.99Å; W523-C527 VanDerWaalsContact O-SG 3.35Å; G524-C527 PolarHBondContact O-N 3.09Å; V525-C527 PolarHBondContact O-N 3.23Å; C527-E531 WeakPolarHBondContact O-CB 3.4Å; C527-E531 PolarHBondContact O-N 3.17Å
528	I	97.9	Very high	95.7	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-73.8	-35.7	178.5	-67.4	165.8	0	0	0	111.9	L424 I447 L464 P466 L469 Y504 G524 V525 G526 E531 M532	L424-I528 HydrophobicContact CD2-CG2 3.88Å; I447-I528 HydrophobicContact CD1-CG2 4.18Å; L464-I528 HydrophobicContact CB-CD1 4.18Å; P466-I528 HydrophobicContact CG-CG1 4.29Å; L469-I528 HydrophobicContact CD1-CD1 4.04Å; L469-I528 HydrophobicContact CD1-CG2 3.96Å; Y504-I528 HydrophobicContact CD1-CG1 4Å; Y504-I528 HydrophobicContact CE1-CG1 3.95Å; G524-I528 WeakPolarHBondContact O-CB 3.45Å; G524-I528 WeakPolarHBondContact O-CD1 3.15Å; G524-I528 WeakPolarHBondContact O-CG1 3.37Å; G524-I528 PolarHBondContact O-N 3.41Å; V525-I528 CarbonylContact O-C 3.49Å; V525-I528 PolarHBondContact O-N 2.78Å; G526-I528 VanDerWaalsContact C-N 3.33Å; G526-I528 PolarHBondContact O-N 3.02Å; I528-E531 PolarHBondContact O-N 3.25Å; I528-M532 HydrophobicContact CG2-CE 4.18Å; I528-M532 HydrophobicContact CG2-CG 4.4Å; I528-M532 WeakPolarHBondContact O-CB 3.46Å; I528-M532 WeakPolarHBondContact O-CG 3.48Å; I528-M532 PolarHBondContact O-N 2.95Å
529	L	98.3	Very high	96.1	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-62.3	-45.2	172.5	170.9	59.4	0	0	0	111	V440 T444 V525 G526 T533 L641 L649	V440-L529 HydrophobicContact CG1-CD1 3.88Å; T444-L529 HydrophobicContact CG2-CB 4.47Å; T444-L529 HydrophobicContact CG2-CD1 4.21Å; T444-L529 HydrophobicContact CG2-CD2 4.37Å; V525-L529 WeakPolarHBondContact O-CB 3.33Å; V525-L529 PolarHBondContact O-N 3.43Å; G526-L529 PolarHBondContact O-N 3.35Å; L529-T533 VanDerWaalsContact O-CB 3.28Å; L529-T533 WeakPolarHBondContact O-CB 3.2Å; L529-T533 PolarHBondContact O-N 2.8Å; L529-T533 PolarHBondContact O-OG1 3.17Å; L529-L641 HydrophobicContact CD1-CD1 4.37Å; L529-L641 HydrophobicContact CD1-CD2 4.1Å; L529-L641 HydrophobicContact CG-CD1 4.33Å; L529-L649 HydrophobicContact CB-CD1 4.32Å; L529-L649 HydrophobicContact CD2-CB 3.96Å; L529-L649 HydrophobicContact CD2-CD1 4.08Å; L529-L649 HydrophobicContact CG-CD1 4.17Å
530	Y	98	Very high	96.2	Very high	26 Å²	26	15.5 Å²	15.5	10%	0.102	8%	0.079	C	C	.	.	H	α-helix	trans	-59.9	-46.1	172.1	-175.4	-90.4	0	0	0	111.9	G526 T533 T534 L538 K554 S637 A638 L649	G526-Y530 PolarHBondContact O-N 3.28Å; Y530-T533 WeakPolarHBondContact O-CB 3.47Å; Y530-T533 PolarHBondContact O-N 3.24Å; Y530-T533 VanDerWaalsContact O-N 3.14Å; Y530-T534 HydrophobicContact CD1-CG2 4.2Å; Y530-T534 HydrophobicContact CD2-CG2 4.23Å; Y530-T534 HydrophobicContact CE1-CG2 3.81Å; Y530-T534 WeakPolarHBondContact CE1-OG1 3.37Å; Y530-T534 HydrophobicContact CE2-CG2 3.82Å; Y530-T534 HydrophobicContact CG-CG2 4.41Å; Y530-T534 PolarHBondContact O-N 3.41Å; Y530-T534 PolarHBondContact O-OG1 3.09Å; Y530-L538 HydrophobicContact CD1-CB 3.51Å; Y530-L538 HydrophobicContact CD1-CD1 3.73Å; Y530-L538 HydrophobicContact CD1-CG 4.09Å; Y530-L538 HydrophobicContact CD2-CD1 3.87Å; Y530-L538 HydrophobicContact CE1-CB 4.08Å; Y530-L538 HydrophobicContact CE1-CD1 3.69Å; Y530-L538 HydrophobicContact CE1-CG 4.45Å; Y530-L538 HydrophobicContact CE2-CD1 3.86Å; Y530-L538 HydrophobicContact CG-CB 3.93Å; Y530-L538 HydrophobicContact CG-CD1 3.81Å; Y530-L538 HydrophobicContact CG-CD2 4.17Å; Y530-L538 HydrophobicContact CG-CG 4.17Å; Y530-K554 PolarHBondContact OH-NZ 2.83Å; Y530-S637 WeakPolarHBondContact CE2-O 3.38Å; Y530-S637 PolarHBondContact OH-O 3.08Å; Y530-A638 HydrophobicContact CD2-CB 3.93Å; Y530-A638 HydrophobicContact CE2-CB 3.93Å; Y530-L649 HydrophobicContact CD2-CD2 4.16Å
531	E	97.3	Very high	96.3	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-65.7	-43.3	-178.6	-178	168.2	160.1	0	0	112.2	K425 M428 Y504 C527 I528 T533 G535 Y536 S537	K425-E531 WeakPolarHBondContact CD-OE1 3.11Å; K425-E531 WeakPolarHBondContact CE-OE1 2.95Å; K425-E531 IonicContact NZ-OE1 3.99Å; K425-E531 PolarHBondContact NZ-OE1 3.29Å; M428-E531 HydrophobicContact CE-CG 3.86Å; M428-E531 WeakPolarHBondContact CE-O 3.42Å; M428-E531 HydrophobicContact SD-CG 4.22Å; Y504-E531 PolarHBondContact OH-OE2 3.28Å; C527-E531 WeakPolarHBondContact O-CB 3.4Å; C527-E531 PolarHBondContact O-N 3.17Å; I528-E531 PolarHBondContact O-N 3.25Å; E531-T533 PolarHBondContact O-N 2.88Å; E531-G535 VanDerWaalsContact O-CA 3.29Å; E531-G535 WeakPolarHBondContact O-CA 3.42Å; E531-G535 PolarHBondContact O-N 3.16Å; E531-Y536 WeakPolarHBondContact CA-O 3.48Å; E531-S537 PolarHBondContact OE1-OG 3.47Å; E531-S537 WeakPolarHBondContact OE2-CA 3.35Å; E531-S537 WeakPolarHBondContact OE2-CB 3.12Å; E531-S537 PolarHBondContact OE2-OG 3.26Å
532	M	97.6	Very high	96.2	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-62.2	-29.5	171.9	-74.1	-168.3	-63.9	0	0	113.2	L424 M428 L435 V440 F443 T444 I447 I528	L424-M532 HydrophobicContact CD1-CG 4.21Å; L424-M532 HydrophobicContact CD1-SD 3.98Å; L424-M532 HydrophobicContact CD2-CG 3.9Å; L424-M532 HydrophobicContact CD2-SD 3.78Å; L424-M532 HydrophobicContact CG-CG 4.47Å; M428-M532 HydrophobicContact SD-CG 4.33Å; L435-M532 HydrophobicContact CD1-CB 4.16Å; L435-M532 HydrophobicContact CD1-CG 4.01Å; L435-M532 HydrophobicContact CD1-SD 4.37Å; V440-M532 HydrophobicContact CG1-CB 3.89Å; V440-M532 HydrophobicContact CG1-CE 4.23Å; V440-M532 HydrophobicContact CG2-CB 4.12Å; F443-M532 HydrophobicContact CB-CE 4.35Å; F443-M532 HydrophobicContact CB-SD 3.89Å; F443-M532 HydrophobicContact CD2-SD 4.11Å; T444-M532 VanDerWaalsContact OG1-CE 3.24Å; T444-M532 WeakPolarHBondContact OG1-CE 3.45Å; I447-M532 HydrophobicContact CD1-CE 4.4Å; I528-M532 HydrophobicContact CG2-CE 4.18Å; I528-M532 HydrophobicContact CG2-CG 4.4Å; I528-M532 WeakPolarHBondContact O-CB 3.46Å; I528-M532 WeakPolarHBondContact O-CG 3.48Å; I528-M532 PolarHBondContact O-N 2.95Å
533	T	96.4	Very high	95.9	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.006	13%	0.126	C	C	.	.	H	α-helix	trans	-79.3	-43.5	-179.5	-63.9	0	0	0	0	112	M437 L529 Y530 E531 A638 R640 L641	M437-T533 HydrophobicContact CE-CG2 4.16Å; L529-T533 VanDerWaalsContact O-CB 3.28Å; L529-T533 WeakPolarHBondContact O-CB 3.2Å; L529-T533 PolarHBondContact O-N 2.8Å; L529-T533 PolarHBondContact O-OG1 3.17Å; Y530-T533 WeakPolarHBondContact O-CB 3.47Å; Y530-T533 PolarHBondContact O-N 3.24Å; Y530-T533 VanDerWaalsContact O-N 3.14Å; E531-T533 PolarHBondContact O-N 2.88Å; T533-A638 HydrophobicContact CG2-CB 4.42Å; T533-R640 HydrophobicContact CG2-CB 3.85Å; T533-R640 WeakPolarHBondContact O-CD 3.31Å; T533-R640 PolarHBondContact O-NH1 3.09Å; T533-L641 HydrophobicContact CG2-CD1 4.08Å; T533-L641 HydrophobicContact CG2-CG 3.78Å
534	T	95	Very high	95.6	Very high	37 Å²	37	25.6 Å²	25.6	23%	0.227	14%	0.139	C	C	.	.	H	α-helix	trans	-101.1	-24.6	-171.5	61.9	0	0	0	0	114.2	Y530 Y536 S637	Y530-T534 HydrophobicContact CD1-CG2 4.2Å; Y530-T534 HydrophobicContact CD2-CG2 4.23Å; Y530-T534 HydrophobicContact CE1-CG2 3.81Å; Y530-T534 WeakPolarHBondContact CE1-OG1 3.37Å; Y530-T534 HydrophobicContact CE2-CG2 3.82Å; Y530-T534 HydrophobicContact CG-CG2 4.41Å; Y530-T534 PolarHBondContact O-N 3.41Å; Y530-T534 PolarHBondContact O-OG1 3.09Å; T534-Y536 VanDerWaalsContact O-CD2 3.25Å; T534-Y536 WeakPolarHBondContact O-CD2 3.17Å; T534-Y536 WeakPolarHBondContact O-CE2 3.35Å; T534-Y536 PolarHBondContact OG1-N 3.06Å; T534-Y536 PolarHBondContact OG1-O 3.36Å; T534-S637 WeakPolarHBondContact CG2-O 3.48Å
535	G	93.9	Very high	95.5	Very high	3 Å²	3	28.2 Å²	28.2	3%	0.031	15%	0.15	C	C	.	.	S	Bend	trans	93.6	-12.2	-170.6	0	0	0	0	0	114.6	N433 E531	N433-G535 VanDerWaalsContact O-CA 3.23Å; N433-G535 WeakPolarHBondContact O-CA 3.37Å; E531-G535 VanDerWaalsContact O-CA 3.29Å; E531-G535 WeakPolarHBondContact O-CA 3.42Å; E531-G535 PolarHBondContact O-N 3.16Å
536	Y	93.3	Very high	95.3	Very high	143 Å²	143	30.4 Å²	30.4	56%	0.561	16%	0.162	S	C	*	.	S	Bend	trans	-125.2	146.3	-170.1	-53.2	-84.3	0	0	0	111.7	E531 T534	E531-Y536 WeakPolarHBondContact CA-O 3.48Å; T534-Y536 VanDerWaalsContact O-CD2 3.25Å; T534-Y536 WeakPolarHBondContact O-CD2 3.17Å; T534-Y536 WeakPolarHBondContact O-CE2 3.35Å; T534-Y536 PolarHBondContact OG1-N 3.06Å; T534-Y536 PolarHBondContact OG1-O 3.36Å
537	S	94.9	Very high	95.1	Very high	20 Å²	20	30.4 Å²	30.4	14%	0.14	16%	0.162	C	C	.	.			trans	-70.8	134.1	-179.5	-56	0	0	0	0	111.1	E531 F539	E531-S537 PolarHBondContact OE1-OG 3.47Å; E531-S537 WeakPolarHBondContact OE2-CA 3.35Å; E531-S537 WeakPolarHBondContact OE2-CB 3.12Å; E531-S537 PolarHBondContact OE2-OG 3.26Å; S537-F539 PolarHBondContact O-N 3.05Å
538	L	96.3	Very high	94.9	Very high	13 Å²	13	30.4 Å²	30.4	7%	0.068	16%	0.162	C	C	.	.	S	Bend	trans	-64.8	-40	-169.8	178.5	55.2	0	0	0	114.2	Y530 K554 L653	Y530-L538 HydrophobicContact CD1-CB 3.51Å; Y530-L538 HydrophobicContact CD1-CD1 3.73Å; Y530-L538 HydrophobicContact CD1-CG 4.09Å; Y530-L538 HydrophobicContact CD2-CD1 3.87Å; Y530-L538 HydrophobicContact CE1-CB 4.08Å; Y530-L538 HydrophobicContact CE1-CD1 3.69Å; Y530-L538 HydrophobicContact CE1-CG 4.45Å; Y530-L538 HydrophobicContact CE2-CD1 3.86Å; Y530-L538 HydrophobicContact CG-CB 3.93Å; Y530-L538 HydrophobicContact CG-CD1 3.81Å; Y530-L538 HydrophobicContact CG-CD2 4.17Å; Y530-L538 HydrophobicContact CG-CG 4.17Å; L538-K554 HydrophobicContact CD1-CD 4Å; L538-L653 HydrophobicContact CD2-CD1 3.48Å; L538-L653 VanDerWaalsContact CD2-CD1 3.48Å; L538-L653 HydrophobicContact CD2-CD2 4.29Å
539	F	96.7	Very high	94.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.171	C	C	.	.			trans	-134.4	81.7	-176.3	-54.2	-62.1	0	0	0	109.3	W503 W523 S537 G541 Q547 I550 I551 K554 F555 L653	W503-F539 VanDerWaalsContact CA-O 3.31Å; W503-F539 WeakPolarHBondContact CA-O 3.2Å; W503-F539 WeakPolarHBondContact CB-O 3.35Å; W523-F539 AromaticContact CH2-CE2 3.79Å; W523-F539 HydrophobicContact CH2-CE2 3.79Å; W523-F539 HydrophobicContact CH2-CZ 4.14Å; W523-F539 AromaticContact CZ2-CD2 3.81Å; W523-F539 HydrophobicContact CZ2-CD2 3.81Å; W523-F539 AromaticContact CZ2-CE2 3.28Å; W523-F539 HydrophobicContact CZ2-CE2 3.28Å; W523-F539 HydrophobicContact CZ2-CZ 4.05Å; S537-F539 PolarHBondContact O-N 3.05Å; F539-G541 VanDerWaalsContact C-N 3.28Å; F539-G541 PolarHBondContact O-N 3.01Å; F539-G541 VanDerWaalsContact O-N 3.09Å; F539-Q547 PolarHBondContact O-NE2 2.93Å; F539-Q547 VanDerWaalsContact O-NE2 3.1Å; F539-Q547 PolarHBondContact O-OE1 3Å; F539-I550 HydrophobicContact CB-CG2 4.42Å; F539-I550 HydrophobicContact CD1-CG2 4.18Å; F539-I551 HydrophobicContact CB-CG1 4.3Å; F539-I551 HydrophobicContact CD1-CG1 3.72Å; F539-I551 HydrophobicContact CD2-CG1 4.05Å; F539-I551 HydrophobicContact CE1-CB 4.4Å; F539-I551 HydrophobicContact CE1-CG1 3.92Å; F539-I551 HydrophobicContact CE2-CG1 4.25Å; F539-I551 HydrophobicContact CG-CG1 3.78Å; F539-I551 HydrophobicContact CZ-CG1 4.18Å; F539-K554 HydrophobicContact CE1-CB 4.31Å; F539-K554 HydrophobicContact CE1-CD 4.23Å; F539-F555 HydrophobicContact CZ-CD2 4.48Å; F539-F555 HydrophobicContact CZ-CE1 4.46Å; F539-F555 AromaticContact CZ-CE2 3.8Å; F539-F555 HydrophobicContact CZ-CE2 3.8Å; F539-F555 AromaticContact CZ-CZ 3.79Å; F539-F555 HydrophobicContact CZ-CZ 3.79Å; F539-L653 HydrophobicContact CE2-CD2 4.47Å
540	P	94.4	Very high	94.6	Very high	65 Å²	65	34.5 Å²	34.5	42%	0.422	18%	0.181	S	C	.	.			trans	-87.3	51	-170.7	36.3	-37.2	0	0	0	113.1	W503	W503-P540 HydrophobicContact CD2-CB 4.37Å; W503-P540 HydrophobicContact CZ2-CB 4.27Å; W503-P540 VanDerWaalsContact NE1-C 3.28Å
541	G	93.4	Very high	94.5	Very high	2 Å²	2	33.3 Å²	33.3	2%	0.021	18%	0.176	C	C	.	.			trans	-68	151.1	-175.5	0	0	0	0	0	114.9	L502 W503 F539 D546	L502-G541 WeakPolarHBondContact CD2-O 3.25Å; W503-G541 PolarHBondContact NE1-O 2.83Å; F539-G541 VanDerWaalsContact C-N 3.28Å; F539-G541 PolarHBondContact O-N 3.01Å; F539-G541 VanDerWaalsContact O-N 3.09Å; G541-D546 WeakPolarHBondContact CA-OD2 3.38Å
542	T	92	Very high	94.4	Very high	121 Å²	121	33.3 Å²	33.3	74%	0.742	18%	0.177	S	C	*	.	S	Bend	trans	-93.7	-29.9	-178.4	58.2	0	0	0	0	113.3	D546	T542-D546 WeakPolarHBondContact CB-OD2 3.39Å; T542-D546 PolarHBondContact N-OD2 3.2Å; T542-D546 PolarHBondContact OG1-OD2 3.08Å
543	S	92.2	Very high	94.2	Very high	41 Å²	41	42.3 Å²	42.3	29%	0.287	21%	0.211	S	C	.	.	S	Bend	trans	-137.5	175.4	177.8	83.9	0	0	0	0	111.7	E545 D546 Q547	S543-E545 VanDerWaalsContact C-N 3.26Å; S543-E545 WeakPolarHBondContact CB-OE2 3.48Å; S543-E545 PolarHBondContact O-N 3.21Å; S543-E545 PolarHBondContact OG-N 3.06Å; S543-E545 PolarHBondContact OG-OE2 3.27Å; S543-D546 PolarHBondContact O-N 3.18Å; S543-D546 WeakPolarHBondContact OG-CB 3.37Å; S543-D546 PolarHBondContact OG-N 3.46Å; S543-D546 VanDerWaalsContact OG-N 3.17Å; S543-Q547 VanDerWaalsContact O-CB 3.24Å; S543-Q547 WeakPolarHBondContact O-CB 3.14Å; S543-Q547 PolarHBondContact O-N 2.83Å
544	K	91	Very high	94	Very high	61 Å²	61	44.7 Å²	44.7	27%	0.265	22%	0.221	S	C	.	.	H	α-helix	trans	-65.1	-36.8	-179.8	-61.7	163.8	-177.1	161.3	0	110.8	E498 L510 I548	E498-K544 WeakPolarHBondContact OE1-CE 3.46Å; E498-K544 IonicContact OE1-NZ 2.73Å; E498-K544 PolarHBondContact OE1-NZ 3.44Å; L510-K544 HydrophobicContact CD2-CB 4Å; L510-K544 HydrophobicContact CD2-CG 4.25Å; K544-I548 PolarHBondContact O-N 3.02Å
545	E	92.7	Very high	94	Very high	57 Å²	57	43.1 Å²	43.1	27%	0.266	21%	0.211	S	C	.	.	H	α-helix	trans	-68.9	-46.7	178.9	-49.7	62.4	-127.9	0	0	110.3	S543 I548 K549 Y575	S543-E545 VanDerWaalsContact C-N 3.26Å; S543-E545 WeakPolarHBondContact CB-OE2 3.48Å; S543-E545 PolarHBondContact O-N 3.21Å; S543-E545 PolarHBondContact OG-N 3.06Å; S543-E545 PolarHBondContact OG-OE2 3.27Å; E545-I548 PolarHBondContact O-N 3.06Å; E545-K549 WeakPolarHBondContact O-CG 3.32Å; E545-K549 PolarHBondContact O-N 3.46Å; E545-Y575 HydrophobicContact CB-CD1 4.23Å; E545-Y575 HydrophobicContact CB-CG 4.32Å; E545-Y575 HydrophobicContact CG-CD1 3.65Å; E545-Y575 HydrophobicContact CG-CE1 4.12Å; E545-Y575 HydrophobicContact CG-CG 4.24Å
546	D	93.5	Very high	93.9	Very high	47 Å²	47	43.7 Å²	43.7	25%	0.251	22%	0.216	S	C	.	.	H	α-helix	trans	-68.4	-42.6	179.4	-177.4	44.6	0	0	0	112	G541 T542 S543 I548 K549 I550	G541-D546 WeakPolarHBondContact CA-OD2 3.38Å; T542-D546 WeakPolarHBondContact CB-OD2 3.39Å; T542-D546 PolarHBondContact N-OD2 3.2Å; T542-D546 PolarHBondContact OG1-OD2 3.08Å; S543-D546 PolarHBondContact O-N 3.18Å; S543-D546 WeakPolarHBondContact OG-CB 3.37Å; S543-D546 PolarHBondContact OG-N 3.46Å; S543-D546 VanDerWaalsContact OG-N 3.17Å; D546-I548 VanDerWaalsContact C-N 3.29Å; D546-I548 PolarHBondContact O-N 2.97Å; D546-K549 PolarHBondContact O-N 3.14Å; D546-K549 VanDerWaalsContact O-N 3.13Å; D546-I550 VanDerWaalsContact O-CG1 3.29Å; D546-I550 WeakPolarHBondContact O-CG1 3.27Å; D546-I550 PolarHBondContact O-N 3.38Å
547	Q	94.5	Very high	93.8	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-55.5	-44	172.6	-173.3	70.1	22.5	0	0	111.5	L502 W503 L510 F539 S543 I551	L502-Q547 HydrophobicContact CD1-CB 3.75Å; L502-Q547 HydrophobicContact CD1-CG 3.85Å; L502-Q547 HydrophobicContact CG-CB 4.07Å; L502-Q547 HydrophobicContact CG-CG 4.13Å; L502-Q547 PolarHBondContact O-NE2 3.19Å; W503-Q547 PolarHBondContact O-NE2 3.18Å; L510-Q547 HydrophobicContact CD1-CB 4.24Å; L510-Q547 HydrophobicContact CD1-CG 3.59Å; F539-Q547 PolarHBondContact O-NE2 2.93Å; F539-Q547 VanDerWaalsContact O-NE2 3.1Å; F539-Q547 PolarHBondContact O-OE1 3Å; S543-Q547 VanDerWaalsContact O-CB 3.24Å; S543-Q547 WeakPolarHBondContact O-CB 3.14Å; S543-Q547 PolarHBondContact O-N 2.83Å; Q547-I551 HydrophobicContact CG-CD1 4.27Å; Q547-I551 WeakPolarHBondContact O-CD1 3.49Å; Q547-I551 VanDerWaalsContact O-CG1 3.27Å; Q547-I551 WeakPolarHBondContact O-CG1 3.28Å; Q547-I551 PolarHBondContact O-N 2.97Å; Q547-I551 VanDerWaalsContact O-N 3.09Å
548	I	94.9	Very high	93.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-66.3	-44.1	174.8	-78.2	-65.4	0	0	0	112	P507 L510 L511 K544 E545 D546 I550 I551 F552 Y575	P507-I548 HydrophobicContact CB-CD1 3.78Å; L510-I548 HydrophobicContact CB-CD1 3.7Å; L510-I548 HydrophobicContact CB-CG1 3.82Å; L510-I548 HydrophobicContact CD1-CD1 3.99Å; L510-I548 HydrophobicContact CD1-CG1 4.12Å; L510-I548 HydrophobicContact CG-CD1 4.46Å; L510-I548 HydrophobicContact CG-CG1 4.45Å; L511-I548 HydrophobicContact CD1-CD1 4.4Å; L511-I548 HydrophobicContact CD2-CD1 4.21Å; L511-I548 HydrophobicContact CD2-CG1 4.35Å; L511-I548 HydrophobicContact CG-CD1 3.95Å; K544-I548 PolarHBondContact O-N 3.02Å; E545-I548 PolarHBondContact O-N 3.06Å; D546-I548 VanDerWaalsContact C-N 3.29Å; D546-I548 PolarHBondContact O-N 2.97Å; I548-I550 VanDerWaalsContact C-N 3.32Å; I548-I550 PolarHBondContact O-N 3.38Å; I548-I551 PolarHBondContact O-N 3.18Å; I548-F552 HydrophobicContact CD1-CE2 4.3Å; I548-F552 HydrophobicContact CG2-CD2 3.64Å; I548-F552 HydrophobicContact CG2-CE2 3.68Å; I548-F552 WeakPolarHBondContact O-CD2 3.43Å; I548-F552 PolarHBondContact O-N 2.9Å; I548-Y575 HydrophobicContact CB-CD2 3.97Å; I548-Y575 HydrophobicContact CG1-CD2 3.81Å; I548-Y575 HydrophobicContact CG1-CE2 3.93Å; I548-Y575 HydrophobicContact CG2-CD2 3.99Å
549	K	93.9	Very high	93.4	Very high	43 Å²	43	36.5 Å²	36.5	19%	0.187	19%	0.187	C	C	.	.	H	α-helix	trans	-59.6	-41.1	176.2	-76.5	169.5	-177.3	169.3	0	112	E545 D546 R553 Y575 L576 N579	E545-K549 WeakPolarHBondContact O-CG 3.32Å; E545-K549 PolarHBondContact O-N 3.46Å; D546-K549 PolarHBondContact O-N 3.14Å; D546-K549 VanDerWaalsContact O-N 3.13Å; K549-R553 WeakPolarHBondContact O-CB 3.34Å; K549-R553 PolarHBondContact O-N 2.78Å; K549-Y575 WeakPolarHBondContact CE-O 3.32Å; K549-Y575 PolarHBondContact NZ-O 3.34Å; K549-L576 HydrophobicContact CG-CD2 4.32Å; K549-N579 PolarHBondContact NZ-OD1 2.92Å
550	I	94.7	Very high	93.1	Very high	44 Å²	44	40.1 Å²	40.1	23%	0.226	20%	0.203	C	C	.	.	H	α-helix	trans	-68	-41.7	178.1	-66.6	163.3	0	0	0	111.1	F539 D546 I548 R553 K554	F539-I550 HydrophobicContact CB-CG2 4.42Å; F539-I550 HydrophobicContact CD1-CG2 4.18Å; D546-I550 VanDerWaalsContact O-CG1 3.29Å; D546-I550 WeakPolarHBondContact O-CG1 3.27Å; D546-I550 PolarHBondContact O-N 3.38Å; I548-I550 VanDerWaalsContact C-N 3.32Å; I548-I550 PolarHBondContact O-N 3.38Å; I550-R553 PolarHBondContact O-N 3.18Å; I550-K554 PolarHBondContact O-N 3.23Å; I550-K554 VanDerWaalsContact O-N 3.07Å
551	I	96.1	Very high	92.9	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.9	-54.1	176.2	-69.6	164	0	0	0	110.6	P507 L510 W523 F539 Q547 I548 R553 K554 F555 L655	P507-I551 HydrophobicContact CB-CD1 4.26Å; P507-I551 HydrophobicContact CB-CG2 4.42Å; P507-I551 HydrophobicContact CG-CG2 4.49Å; L510-I551 HydrophobicContact CD1-CD1 4.31Å; W523-I551 HydrophobicContact CH2-CD1 4.49Å; W523-I551 HydrophobicContact CH2-CG2 4.25Å; W523-I551 HydrophobicContact CZ2-CD1 3.89Å; W523-I551 HydrophobicContact CZ2-CG1 4.25Å; F539-I551 HydrophobicContact CB-CG1 4.3Å; F539-I551 HydrophobicContact CD1-CG1 3.72Å; F539-I551 HydrophobicContact CD2-CG1 4.05Å; F539-I551 HydrophobicContact CE1-CB 4.4Å; F539-I551 HydrophobicContact CE1-CG1 3.92Å; F539-I551 HydrophobicContact CE2-CG1 4.25Å; F539-I551 HydrophobicContact CG-CG1 3.78Å; F539-I551 HydrophobicContact CZ-CG1 4.18Å; Q547-I551 HydrophobicContact CG-CD1 4.27Å; Q547-I551 WeakPolarHBondContact O-CD1 3.49Å; Q547-I551 VanDerWaalsContact O-CG1 3.27Å; Q547-I551 WeakPolarHBondContact O-CG1 3.28Å; Q547-I551 PolarHBondContact O-N 2.97Å; Q547-I551 VanDerWaalsContact O-N 3.09Å; I548-I551 PolarHBondContact O-N 3.18Å; I551-R553 PolarHBondContact O-N 3.22Å; I551-K554 PolarHBondContact O-N 2.77Å; I551-K554 VanDerWaalsContact O-N 3.11Å; I551-F555 PolarHBondContact O-N 2.97Å; I551-L655 HydrophobicContact CG2-CD2 3.73Å
552	F	94.8	Very high	92.9	Very high	1 Å²	1	40 Å²	40	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-72.6	-24.5	-179.3	-66.5	-53.8	0	0	0	113.5	L511 I548 K554 G556 I557 P558 W563 L566 F572 L611 L655	L511-F552 HydrophobicContact CD1-CE2 4.24Å; L511-F552 HydrophobicContact CD1-CZ 4.17Å; I548-F552 HydrophobicContact CD1-CE2 4.3Å; I548-F552 HydrophobicContact CG2-CD2 3.64Å; I548-F552 HydrophobicContact CG2-CE2 3.68Å; I548-F552 WeakPolarHBondContact O-CD2 3.43Å; I548-F552 PolarHBondContact O-N 2.9Å; F552-K554 VanDerWaalsContact C-N 3.3Å; F552-G556 CarbonylContact O-C 3.23Å; F552-G556 WeakPolarHBondContact O-CA 3.25Å; F552-G556 PolarHBondContact O-N 3.32Å; F552-I557 HydrophobicContact CB-CG1 4.38Å; F552-P558 HydrophobicContact CE1-CG 4.49Å; F552-W563 HydrophobicContact CZ-CZ3 4.2Å; F552-L566 HydrophobicContact CE1-CD2 4.3Å; F552-L566 HydrophobicContact CZ-CD1 4.29Å; F552-L566 HydrophobicContact CZ-CD2 4.14Å; F552-F572 HydrophobicContact CD2-CD2 4.45Å; F552-F572 AromaticContact CD2-CE2 3.96Å; F552-F572 HydrophobicContact CD2-CE2 3.96Å; F552-F572 AromaticContact CE2-CD2 3.74Å; F552-F572 HydrophobicContact CE2-CD2 3.74Å; F552-F572 AromaticContact CE2-CE2 3.54Å; F552-F572 HydrophobicContact CE2-CE2 3.54Å; F552-F572 HydrophobicContact CZ-CD2 4.24Å; F552-F572 AromaticContact CZ-CE2 3.95Å; F552-F572 HydrophobicContact CZ-CE2 3.95Å; F552-L611 HydrophobicContact CB-CD1 4.49Å; F552-L655 HydrophobicContact CE1-CD1 4.15Å; F552-L655 HydrophobicContact CE1-CD2 4.5Å
553	R	93.2	Very high	93	Very high	190 Å²	190	35.6 Å²	35.6	72%	0.717	17%	0.173	S	C	*	.	H	α-helix	trans	-66.3	-31.7	168	-179.7	176.8	175.9	-170	-1.5	112.1	K549 I550 I551	K549-R553 WeakPolarHBondContact O-CB 3.34Å; K549-R553 PolarHBondContact O-N 2.78Å; I550-R553 PolarHBondContact O-N 3.18Å; I551-R553 PolarHBondContact O-N 3.22Å
554	K	93.3	Very high	92.9	Very high	51 Å²	51	37.5 Å²	37.5	22%	0.222	19%	0.185	C	C	.	.	H	α-helix	trans	-86.6	-39	179.5	-170	165.6	-177.1	174	0	113.2	Y530 L538 F539 I550 I551 F552 T633 S637	Y530-K554 PolarHBondContact OH-NZ 2.83Å; L538-K554 HydrophobicContact CD1-CD 4Å; F539-K554 HydrophobicContact CE1-CB 4.31Å; F539-K554 HydrophobicContact CE1-CD 4.23Å; I550-K554 PolarHBondContact O-N 3.23Å; I550-K554 VanDerWaalsContact O-N 3.07Å; I551-K554 PolarHBondContact O-N 2.77Å; I551-K554 VanDerWaalsContact O-N 3.11Å; F552-K554 VanDerWaalsContact C-N 3.3Å; K554-T633 HydrophobicContact CG-CG2 4.02Å; K554-T633 WeakPolarHBondContact O-CG2 3.41Å; K554-S637 WeakPolarHBondContact CE-OG 3.38Å; K554-S637 PolarHBondContact NZ-OG 3.36Å
555	F	94.5	Very high	92.9	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.018	20%	0.2	C	C	.	.	H	α-helix	trans	-103	-7.6	-177	-67.4	-15.2	0	0	0	114.5	W523 F539 I551 Y626 I630 L634 L653 L655	W523-F555 HydrophobicContact CH2-CE2 4.26Å; F539-F555 HydrophobicContact CZ-CD2 4.48Å; F539-F555 HydrophobicContact CZ-CE1 4.46Å; F539-F555 AromaticContact CZ-CE2 3.8Å; F539-F555 HydrophobicContact CZ-CE2 3.8Å; F539-F555 AromaticContact CZ-CZ 3.79Å; F539-F555 HydrophobicContact CZ-CZ 3.79Å; I551-F555 PolarHBondContact O-N 2.97Å; F555-Y626 WeakPolarHBondContact O-CE2 3.41Å; F555-Y626 PolarHBondContact O-OH 3.4Å; F555-I630 HydrophobicContact CB-CD1 3.96Å; F555-I630 HydrophobicContact CB-CG1 3.96Å; F555-I630 HydrophobicContact CD1-CG1 4.3Å; F555-I630 HydrophobicContact CD1-CG2 3.96Å; F555-I630 HydrophobicContact CD2-CD1 4.21Å; F555-I630 HydrophobicContact CD2-CG2 4.43Å; F555-I630 HydrophobicContact CE1-CG2 3.9Å; F555-I630 HydrophobicContact CE2-CG2 4.37Å; F555-I630 HydrophobicContact CG-CD1 4.09Å; F555-I630 HydrophobicContact CG-CG1 4.09Å; F555-I630 HydrophobicContact CG-CG2 4.24Å; F555-I630 HydrophobicContact CZ-CG2 4.11Å; F555-L634 HydrophobicContact CE1-CD1 4.45Å; F555-L634 HydrophobicContact CE1-CD2 3.87Å; F555-L634 HydrophobicContact CE1-CG 4.06Å; F555-L634 HydrophobicContact CZ-CD1 4.33Å; F555-L634 HydrophobicContact CZ-CD2 4Å; F555-L634 HydrophobicContact CZ-CG 4.34Å; F555-L653 HydrophobicContact CE2-CB 4.3Å; F555-L653 HydrophobicContact CZ-CB 4.31Å; F555-L653 HydrophobicContact CZ-CD1 4.35Å; F555-L655 HydrophobicContact CD2-CD2 3.95Å; F555-L655 HydrophobicContact CD2-CG 4.45Å
556	G	92.1	Very high	92.9	Very high	14 Å²	14	37.2 Å²	37.2	14%	0.144	19%	0.188	C	C	.	.			trans	73.8	161.4	-168.4	0	0	0	0	0	112.2	F552 Y626	F552-G556 CarbonylContact O-C 3.23Å; F552-G556 WeakPolarHBondContact O-CA 3.25Å; F552-G556 PolarHBondContact O-N 3.32Å; G556-Y626 PolarHBondContact O-OH 2.82Å
557	I	91.6	Very high	92.6	Very high	13 Å²	13	38 Å²	38	7%	0.067	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-71.6	129.4	169.4	-59.3	171.2	0	0	0	107.9	F552 L566 F572 L576 L611 Q614 L615	F552-I557 HydrophobicContact CB-CG1 4.38Å; I557-L566 HydrophobicContact CG2-CD2 4.37Å; I557-F572 HydrophobicContact CD1-CZ 4.2Å; I557-F572 HydrophobicContact CG1-CZ 4.33Å; I557-F572 HydrophobicContact CG2-CE2 4.47Å; I557-F572 HydrophobicContact CG2-CZ 3.8Å; I557-L576 HydrophobicContact CD1-CD1 4.38Å; I557-L611 HydrophobicContact CD1-CD1 4.12Å; I557-L611 HydrophobicContact CD1-CG 4.45Å; I557-L611 HydrophobicContact CG1-CD1 4.13Å; I557-Q614 HydrophobicContact CD1-CB 4.16Å; I557-L615 HydrophobicContact CD1-CD2 3.99Å; I557-L615 HydrophobicContact CD1-CG 4.1Å
558	P	92.5	Very high	92.4	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.013	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-69.9	160.4	179.4	27.5	-34.6	0	0	0	113.2	F552 Y562 W563 L566 R567 Y626 L655	F552-P558 HydrophobicContact CE1-CG 4.49Å; P558-Y562 HydrophobicContact CB-CD1 3.96Å; P558-Y562 HydrophobicContact CB-CG 4.22Å; P558-W563 HydrophobicContact CG-CB 4.14Å; P558-W563 HydrophobicContact CG-CE3 4.34Å; P558-L566 HydrophobicContact CG-CD2 3.35Å; P558-R567 PolarHBondContact O-NH2 3.02Å; P558-Y626 VanDerWaalsContact CA-CZ 3.5Å; P558-Y626 HydrophobicContact CB-CD1 4.27Å; P558-Y626 HydrophobicContact CB-CE1 3.62Å; P558-Y626 HydrophobicContact CB-CE2 4.22Å; P558-L655 HydrophobicContact CB-CD1 4.32Å; P558-L655 HydrophobicContact CG-CD1 4Å
559	P	90.8	Very high	92.2	Very high	10 Å²	10	44 Å²	44	7%	0.065	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-69.3	153.8	165.9	31.9	-35.9	0	0	0	110.5	S561 Y562 W563 D621 Y626	P559-S561 PolarHBondContact O-N 3.35Å; P559-Y562 WeakPolarHBondContact O-CB 3.47Å; P559-Y562 PolarHBondContact O-N 3.48Å; P559-W563 PolarHBondContact O-N 3.27Å; P559-D621 WeakPolarHBondContact CB-O 3.48Å; P559-D621 WeakPolarHBondContact CG-O 3.44Å; P559-Y626 HydrophobicContact CG-CG 4.45Å
560	E	89.3	Confident	92	Very high	76 Å²	76	46.7 Å²	46.7	36%	0.355	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-27.6	-177	-159.7	66.7	-163.6	0	0	112.3	Y562 W563 P564 N565 L566	E560-Y562 VanDerWaalsContact C-N 3.31Å; E560-Y562 PolarHBondContact O-N 2.91Å; E560-W563 CarbonylContact O-C 3.53Å; E560-W563 VanDerWaalsContact O-C 3.24Å; E560-P564 WeakPolarHBondContact O-CA 3.09Å; E560-P564 WeakPolarHBondContact O-CD 3.44Å; E560-P564 WeakPolarHBondContact O-CG 3.29Å; E560-P564 VanDerWaalsContact O-N 3.09Å; E560-N565 VanDerWaalsContact OE1-CA 3.24Å; E560-N565 WeakPolarHBondContact OE1-CA 3.36Å; E560-N565 PolarHBondContact OE1-N 2.93Å; E560-L566 PolarHBondContact OE1-N 3.07Å
561	S	90.9	Very high	91.8	Very high	62 Å²	62	47.8 Å²	47.8	43%	0.434	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-29.7	172	57.3	0	0	0	0	113.7	P559 I623 R659	P559-S561 PolarHBondContact O-N 3.35Å; S561-I623 WeakPolarHBondContact O-CD1 3.48Å; S561-R659 PolarHBondContact O-NH2 2.81Å
562	Y	92.9	Very high	91.6	Very high	4 Å²	4	47.8 Å²	47.8	2%	0.016	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-47.4	176.4	-176.1	-75.5	0	0	0	110.9	P558 P559 E560 I623 Y626 N627 L655 V656 R659	P558-Y562 HydrophobicContact CB-CD1 3.96Å; P558-Y562 HydrophobicContact CB-CG 4.22Å; P559-Y562 WeakPolarHBondContact O-CB 3.47Å; P559-Y562 PolarHBondContact O-N 3.48Å; E560-Y562 VanDerWaalsContact C-N 3.31Å; E560-Y562 PolarHBondContact O-N 2.91Å; Y562-I623 HydrophobicContact CD2-CG2 4.2Å; Y562-Y626 AromaticContact CD2-CD1 3.89Å; Y562-Y626 HydrophobicContact CD2-CD1 3.89Å; Y562-Y626 HydrophobicContact CD2-CE1 4.36Å; Y562-Y626 HydrophobicContact CE2-CD1 4.22Å; Y562-Y626 HydrophobicContact CE2-CE1 4.47Å; Y562-Y626 HydrophobicContact CG-CD1 4.18Å; Y562-Y626 HydrophobicContact CG-CE1 4.38Å; Y562-N627 WeakPolarHBondContact CE2-OD1 3.35Å; Y562-L655 HydrophobicContact CE1-CB 3.98Å; Y562-L655 PolarHBondContact OH-N 2.86Å; Y562-V656 HydrophobicContact CD1-CG2 4.42Å; Y562-V656 HydrophobicContact CE1-CG2 4.11Å; Y562-R659 PolarHBondContact O-NE 3.1Å; Y562-R659 PolarHBondContact O-NH2 2.94Å
563	W	93	Very high	91.3	Very high	28 Å²	28	51.1 Å²	51.1	11%	0.106	27%	0.265	C	S	.	.	S	Bend	trans	-132	89.8	179.8	-168	-19.1	0	0	0	111.2	P507 D508 L511 F552 P558 P559 E560 L566 L655 V656	P507-W563 HydrophobicContact CB-CH2 4.09Å; P507-W563 HydrophobicContact CB-CZ3 4.21Å; P507-W563 HydrophobicContact CG-CH2 4.31Å; P507-W563 HydrophobicContact CG-CZ3 4.22Å; D508-W563 HydrophobicContact CB-CH2 4.25Å; D508-W563 HydrophobicContact CB-CZ2 4.16Å; L511-W563 HydrophobicContact CD1-CH2 3.75Å; L511-W563 HydrophobicContact CD1-CZ2 4.03Å; L511-W563 HydrophobicContact CD1-CZ3 4.39Å; F552-W563 HydrophobicContact CZ-CZ3 4.2Å; P558-W563 HydrophobicContact CG-CB 4.14Å; P558-W563 HydrophobicContact CG-CE3 4.34Å; P559-W563 PolarHBondContact O-N 3.27Å; E560-W563 CarbonylContact O-C 3.53Å; E560-W563 VanDerWaalsContact O-C 3.24Å; W563-L566 HydrophobicContact CB-CB 4.23Å; W563-L566 HydrophobicContact CB-CD2 4.48Å; W563-L566 HydrophobicContact CD2-CB 4.33Å; W563-L566 HydrophobicContact CD2-CD1 4.03Å; W563-L566 HydrophobicContact CD2-CD2 4.27Å; W563-L566 HydrophobicContact CD2-CG 4.45Å; W563-L566 HydrophobicContact CE3-CD1 4.19Å; W563-L566 HydrophobicContact CE3-CD2 4.11Å; W563-L566 HydrophobicContact CG-CB 3.96Å; W563-L566 HydrophobicContact CG-CD2 4.44Å; W563-L566 HydrophobicContact CH2-CD1 4.47Å; W563-L566 HydrophobicContact CZ2-CD1 4.31Å; W563-L566 HydrophobicContact CZ3-CD1 4.39Å; W563-L566 WeakPolarHBondContact O-CB 3.35Å; W563-L566 PolarHBondContact O-N 2.96Å; W563-L655 HydrophobicContact CE3-CB 3.92Å; W563-L655 HydrophobicContact CZ3-CB 3.85Å; W563-V656 HydrophobicContact CB-CG2 3.85Å; W563-V656 HydrophobicContact CD2-CG2 3.58Å; W563-V656 HydrophobicContact CE3-CG2 3.93Å; W563-V656 HydrophobicContact CG-CG2 3.56Å
564	P	91.4	Very high	91.1	Very high	80 Å²	80	47.1 Å²	47.1	52%	0.519	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	143.2	177.6	-23.9	34.3	0	0	0	113.1	E560 L566	E560-P564 WeakPolarHBondContact O-CA 3.09Å; E560-P564 WeakPolarHBondContact O-CD 3.44Å; E560-P564 WeakPolarHBondContact O-CG 3.29Å; E560-P564 VanDerWaalsContact O-N 3.09Å; P564-L566 VanDerWaalsContact C-N 3.25Å; P564-L566 PolarHBondContact O-N 3.04Å
565	N	90.5	Very high	90.8	Very high	111 Å²	111	45 Å²	45	59%	0.594	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	24.4	-174.5	-56.3	-84.2	0	0	0	114.5	E560 T568 N569	E560-N565 VanDerWaalsContact OE1-CA 3.24Å; E560-N565 WeakPolarHBondContact OE1-CA 3.36Å; E560-N565 PolarHBondContact OE1-N 2.93Å; N565-T568 VanDerWaalsContact CA-OG1 3.3Å; N565-T568 WeakPolarHBondContact CA-OG1 3.45Å; N565-T568 WeakPolarHBondContact CB-OG1 3.24Å; N565-T568 PolarHBondContact O-OG1 2.64Å; N565-N569 WeakPolarHBondContact O-CB 3.35Å; N565-N569 PolarHBondContact O-N 2.66Å
566	L	91.9	Very high	90.2	Very high	1 Å²	1	45 Å²	45	1%	0.005	25%	0.246	C	C	.	.	S	Bend	trans	-71.3	-49.8	173.4	179.6	62.7	0	0	0	110.7	L511 F552 I557 P558 E560 W563 P564 T568 N569 F572	L511-L566 HydrophobicContact CD1-CD1 3.44Å; L511-L566 VanDerWaalsContact CD1-CD1 3.44Å; F552-L566 HydrophobicContact CE1-CD2 4.3Å; F552-L566 HydrophobicContact CZ-CD1 4.29Å; F552-L566 HydrophobicContact CZ-CD2 4.14Å; I557-L566 HydrophobicContact CG2-CD2 4.37Å; P558-L566 HydrophobicContact CG-CD2 3.35Å; E560-L566 PolarHBondContact OE1-N 3.07Å; W563-L566 HydrophobicContact CB-CB 4.23Å; W563-L566 HydrophobicContact CB-CD2 4.48Å; W563-L566 HydrophobicContact CD2-CB 4.33Å; W563-L566 HydrophobicContact CD2-CD1 4.03Å; W563-L566 HydrophobicContact CD2-CD2 4.27Å; W563-L566 HydrophobicContact CD2-CG 4.45Å; W563-L566 HydrophobicContact CE3-CD1 4.19Å; W563-L566 HydrophobicContact CE3-CD2 4.11Å; W563-L566 HydrophobicContact CG-CB 3.96Å; W563-L566 HydrophobicContact CG-CD2 4.44Å; W563-L566 HydrophobicContact CH2-CD1 4.47Å; W563-L566 HydrophobicContact CZ2-CD1 4.31Å; W563-L566 HydrophobicContact CZ3-CD1 4.39Å; W563-L566 WeakPolarHBondContact O-CB 3.35Å; W563-L566 PolarHBondContact O-N 2.96Å; P564-L566 VanDerWaalsContact C-N 3.25Å; P564-L566 PolarHBondContact O-N 3.04Å; L566-T568 PolarHBondContact O-N 2.8Å; L566-N569 WeakPolarHBondContact O-CB 3.43Å; L566-N569 PolarHBondContact O-N 3.43Å; L566-N569 VanDerWaalsContact O-N 3.1Å; L566-F572 HydrophobicContact CD1-CB 4.26Å; L566-F572 HydrophobicContact CD1-CD2 3.57Å; L566-F572 HydrophobicContact CD1-CE2 3.96Å; L566-F572 HydrophobicContact CD1-CG 3.88Å; L566-F572 HydrophobicContact CD2-CD2 4.44Å; L566-F572 HydrophobicContact CD2-CE2 3.98Å; L566-F572 HydrophobicContact CD2-CZ 4.22Å; L566-F572 HydrophobicContact CG-CD1 4.35Å; L566-F572 HydrophobicContact CG-CD2 3.94Å; L566-F572 HydrophobicContact CG-CE1 4.31Å; L566-F572 HydrophobicContact CG-CE2 3.9Å; L566-F572 HydrophobicContact CG-CG 4.16Å; L566-F572 HydrophobicContact CG-CZ 4.09Å; L566-F572 WeakPolarHBondContact O-CD1 3.48Å; L566-F572 WeakPolarHBondContact O-CG 3.36Å
567	R	88.8	Confident	89.6	Confident	65 Å²	65	46.4 Å²	46.4	25%	0.245	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-21.1	-176.1	-62.5	-177.8	-171.6	-115.2	-4.9	112.8	P558 F572 L573 Q614 L615	P558-R567 PolarHBondContact O-NH2 3.02Å; R567-F572 HydrophobicContact CG-CE1 4.38Å; R567-L573 WeakPolarHBondContact O-CD2 3.32Å; R567-Q614 PolarHBondContact NH1-O 3.2Å; R567-L615 PolarHBondContact NH1-O 3.14Å
568	T	89.1	Confident	88.4	Confident	91 Å²	91	48.9 Å²	48.9	56%	0.558	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-6.3	174.1	55.8	0	0	0	0	113.9	N565 L566	N565-T568 VanDerWaalsContact CA-OG1 3.3Å; N565-T568 WeakPolarHBondContact CA-OG1 3.45Å; N565-T568 WeakPolarHBondContact CB-OG1 3.24Å; N565-T568 PolarHBondContact O-OG1 2.64Å; L566-T568 PolarHBondContact O-N 2.8Å
569	N	90.4	Very high	86.6	Confident	35 Å²	35	52.2 Å²	52.2	19%	0.187	29%	0.286	C	S	.	.			trans	-68.7	125.5	179.8	-179.2	-48.6	0	0	0	110.6	L511 N565 L566 K571 F572 L573	L511-N569 PolarHBondContact O-ND2 2.88Å; N565-N569 WeakPolarHBondContact O-CB 3.35Å; N565-N569 PolarHBondContact O-N 2.66Å; L566-N569 WeakPolarHBondContact O-CB 3.43Å; L566-N569 PolarHBondContact O-N 3.43Å; L566-N569 VanDerWaalsContact O-N 3.1Å; N569-K571 VanDerWaalsContact C-N 3.31Å; N569-K571 PolarHBondContact O-N 3.25Å; N569-K571 WeakPolarHBondContact OD1-CB 3.43Å; N569-K571 PolarHBondContact OD1-N 2.7Å; N569-F572 HydrophobicContact CB-CB 3.94Å; N569-F572 WeakPolarHBondContact O-CB 3.28Å; N569-F572 PolarHBondContact O-N 2.81Å; N569-F572 VanDerWaalsContact O-N 3.13Å; N569-F572 PolarHBondContact OD1-N 3.37Å; N569-L573 PolarHBondContact O-N 2.91Å; N569-L573 VanDerWaalsContact O-N 3.1Å
570	P	90.8	Very high	84.4	Confident	99 Å²	99	59.1 Å²	59.1	64%	0.643	31%	0.311	S	S	*	.	H	α-helix	trans	-62.1	-35.6	-174.7	23.9	-34	0	0	0	113.1	L573 E574	P570-L573 PolarHBondContact O-N 2.65Å; P570-E574 VanDerWaalsContact O-CB 3.23Å; P570-E574 WeakPolarHBondContact O-CB 3.5Å; P570-E574 PolarHBondContact O-N 2.91Å
571	K	90.2	Very high	82.3	Confident	66 Å²	66	63.8 Å²	63.8	29%	0.287	33%	0.332	S	S	.	.	H	α-helix	trans	-71.9	-34.1	177.6	-68.4	-178.6	172.8	-175.7	0	112.6	L511 N569 E574 Y575	L511-K571 HydrophobicContact CD2-CB 4.18Å; N569-K571 VanDerWaalsContact C-N 3.31Å; N569-K571 PolarHBondContact O-N 3.25Å; N569-K571 WeakPolarHBondContact OD1-CB 3.43Å; N569-K571 PolarHBondContact OD1-N 2.7Å; K571-E574 PolarHBondContact O-N 3.1Å; K571-Y575 HydrophobicContact CB-CE1 4.44Å; K571-Y575 HydrophobicContact CB-CE2 4.17Å; K571-Y575 VanDerWaalsContact O-CB 3.31Å; K571-Y575 WeakPolarHBondContact O-CB 3.43Å; K571-Y575 WeakPolarHBondContact O-CD1 3.5Å; K571-Y575 VanDerWaalsContact O-CD2 3.31Å; K571-Y575 WeakPolarHBondContact O-CD2 3.46Å; K571-Y575 PolarHBondContact O-N 3.08Å
572	F	91.5	Very high	80.2	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-64	-46.3	175	177.8	-102	0	0	0	110.3	L511 F552 I557 L566 R567 N569 L576 L615	L511-F572 HydrophobicContact CD1-CB 4.41Å; L511-F572 HydrophobicContact CD1-CD2 4.19Å; L511-F572 HydrophobicContact CD2-CB 3.94Å; F552-F572 HydrophobicContact CD2-CD2 4.45Å; F552-F572 AromaticContact CD2-CE2 3.96Å; F552-F572 HydrophobicContact CD2-CE2 3.96Å; F552-F572 AromaticContact CE2-CD2 3.74Å; F552-F572 HydrophobicContact CE2-CD2 3.74Å; F552-F572 AromaticContact CE2-CE2 3.54Å; F552-F572 HydrophobicContact CE2-CE2 3.54Å; F552-F572 HydrophobicContact CZ-CD2 4.24Å; F552-F572 AromaticContact CZ-CE2 3.95Å; F552-F572 HydrophobicContact CZ-CE2 3.95Å; I557-F572 HydrophobicContact CD1-CZ 4.2Å; I557-F572 HydrophobicContact CG1-CZ 4.33Å; I557-F572 HydrophobicContact CG2-CE2 4.47Å; I557-F572 HydrophobicContact CG2-CZ 3.8Å; L566-F572 HydrophobicContact CD1-CB 4.26Å; L566-F572 HydrophobicContact CD1-CD2 3.57Å; L566-F572 HydrophobicContact CD1-CE2 3.96Å; L566-F572 HydrophobicContact CD1-CG 3.88Å; L566-F572 HydrophobicContact CD2-CD2 4.44Å; L566-F572 HydrophobicContact CD2-CE2 3.98Å; L566-F572 HydrophobicContact CD2-CZ 4.22Å; L566-F572 HydrophobicContact CG-CD1 4.35Å; L566-F572 HydrophobicContact CG-CD2 3.94Å; L566-F572 HydrophobicContact CG-CE1 4.31Å; L566-F572 HydrophobicContact CG-CE2 3.9Å; L566-F572 HydrophobicContact CG-CG 4.16Å; L566-F572 HydrophobicContact CG-CZ 4.09Å; L566-F572 WeakPolarHBondContact O-CD1 3.48Å; L566-F572 WeakPolarHBondContact O-CG 3.36Å; R567-F572 HydrophobicContact CG-CE1 4.38Å; N569-F572 HydrophobicContact CB-CB 3.94Å; N569-F572 WeakPolarHBondContact O-CB 3.28Å; N569-F572 PolarHBondContact O-N 2.81Å; N569-F572 VanDerWaalsContact O-N 3.13Å; N569-F572 PolarHBondContact OD1-N 3.37Å; F572-L576 HydrophobicContact CD1-CD1 4.26Å; F572-L576 HydrophobicContact CD2-CD1 4.07Å; F572-L576 HydrophobicContact CE1-CD1 3.8Å; F572-L576 HydrophobicContact CE2-CD1 3.59Å; F572-L576 HydrophobicContact CG-CD1 4.38Å; F572-L576 HydrophobicContact CZ-CD1 3.44Å; F572-L576 VanDerWaalsContact CZ-CD1 3.44Å; F572-L576 WeakPolarHBondContact O-CB 3.31Å; F572-L576 WeakPolarHBondContact O-CG 3.4Å; F572-L576 PolarHBondContact O-N 3.31Å; F572-L615 HydrophobicContact CE1-CD2 3.6Å; F572-L615 HydrophobicContact CZ-CD2 3.95Å
573	L	89.1	Confident	77.8	Confident	71 Å²	71	78.9 Å²	78.9	37%	0.372	39%	0.393	S	S	.	.	H	α-helix	trans	-63.4	-44.1	175	-67.9	172.1	0	0	0	112.4	R567 N569 P570 N577	R567-L573 WeakPolarHBondContact O-CD2 3.32Å; N569-L573 PolarHBondContact O-N 2.91Å; N569-L573 VanDerWaalsContact O-N 3.1Å; P570-L573 PolarHBondContact O-N 2.65Å; L573-N577 VanDerWaalsContact O-CB 3.28Å; L573-N577 WeakPolarHBondContact O-CB 3.42Å; L573-N577 PolarHBondContact O-N 3.31Å; L573-N577 PolarHBondContact O-ND2 2.84Å
574	E	88.2	Confident	75	Confident	106 Å²	106	86.6 Å²	86.6	50%	0.495	43%	0.427	S	S	.	.	H	α-helix	trans	-57.6	-59.1	175.8	177.2	-171.5	178.3	0	0	111.8	P570 K571 L576 N577 S578	P570-E574 VanDerWaalsContact O-CB 3.23Å; P570-E574 WeakPolarHBondContact O-CB 3.5Å; P570-E574 PolarHBondContact O-N 2.91Å; K571-E574 PolarHBondContact O-N 3.1Å; E574-L576 VanDerWaalsContact C-N 3.27Å; E574-L576 PolarHBondContact O-N 2.83Å; E574-N577 PolarHBondContact O-N 2.93Å; E574-S578 PolarHBondContact O-N 3.47Å; E574-S578 VanDerWaalsContact O-N 3.13Å; E574-S578 PolarHBondContact O-OG 2.87Å
575	Y	86.8	Confident	72.1	Confident	8 Å²	8	88.5 Å²	88.5	3%	0.031	44%	0.441	C	S	.	.	H	α-helix	trans	-59.1	-39	-174.2	-63.5	-14.9	0	0	0	111.5	L510 L511 E545 I548 K549 K571	L510-Y575 PolarHBondContact O-OH 3.18Å; L511-Y575 HydrophobicContact CD2-CD2 3.81Å; L511-Y575 HydrophobicContact CD2-CE2 3.83Å; E545-Y575 HydrophobicContact CB-CD1 4.23Å; E545-Y575 HydrophobicContact CB-CG 4.32Å; E545-Y575 HydrophobicContact CG-CD1 3.65Å; E545-Y575 HydrophobicContact CG-CE1 4.12Å; E545-Y575 HydrophobicContact CG-CG 4.24Å; I548-Y575 HydrophobicContact CB-CD2 3.97Å; I548-Y575 HydrophobicContact CG1-CD2 3.81Å; I548-Y575 HydrophobicContact CG1-CE2 3.93Å; I548-Y575 HydrophobicContact CG2-CD2 3.99Å; K549-Y575 WeakPolarHBondContact CE-O 3.32Å; K549-Y575 PolarHBondContact NZ-O 3.34Å; K571-Y575 HydrophobicContact CB-CE1 4.44Å; K571-Y575 HydrophobicContact CB-CE2 4.17Å; K571-Y575 VanDerWaalsContact O-CB 3.31Å; K571-Y575 WeakPolarHBondContact O-CB 3.43Å; K571-Y575 WeakPolarHBondContact O-CD1 3.5Å; K571-Y575 VanDerWaalsContact O-CD2 3.31Å; K571-Y575 WeakPolarHBondContact O-CD2 3.46Å; K571-Y575 PolarHBondContact O-N 3.08Å
576	L	83	Confident	69.5	Low	4 Å²	4	91.7 Å²	91.7	2%	0.021	45%	0.452	C	S	.	.	H	α-helix	trans	-78	-37.6	179.7	-64.6	179.6	0	0	0	113.4	K549 I557 F572 E574 S578 L611 L615	K549-L576 HydrophobicContact CG-CD2 4.32Å; I557-L576 HydrophobicContact CD1-CD1 4.38Å; F572-L576 HydrophobicContact CD1-CD1 4.26Å; F572-L576 HydrophobicContact CD2-CD1 4.07Å; F572-L576 HydrophobicContact CE1-CD1 3.8Å; F572-L576 HydrophobicContact CE2-CD1 3.59Å; F572-L576 HydrophobicContact CG-CD1 4.38Å; F572-L576 HydrophobicContact CZ-CD1 3.44Å; F572-L576 VanDerWaalsContact CZ-CD1 3.44Å; F572-L576 WeakPolarHBondContact O-CB 3.31Å; F572-L576 WeakPolarHBondContact O-CG 3.4Å; F572-L576 PolarHBondContact O-N 3.31Å; E574-L576 VanDerWaalsContact C-N 3.27Å; E574-L576 PolarHBondContact O-N 2.83Å; L576-S578 PolarHBondContact O-N 2.91Å; L576-L611 HydrophobicContact CD2-CD2 3.69Å; L576-L611 HydrophobicContact CD2-CG 4.44Å; L576-L615 HydrophobicContact CB-CD1 4.37Å; L576-L615 HydrophobicContact CD1-CD1 4.25Å; L576-L615 HydrophobicContact CD1-CD2 3.8Å; L576-L615 HydrophobicContact CD1-CG 4.32Å
577	N	80	Confident	66.9	Low	42 Å²	42	97.8 Å²	97.8	23%	0.225	50%	0.495	C	S	.	.	H	α-helix	trans	-77.7	-17	-179.1	-77.5	-70.8	0	0	0	114.9	L573 E574 N579 R580	L573-N577 VanDerWaalsContact O-CB 3.28Å; L573-N577 WeakPolarHBondContact O-CB 3.42Å; L573-N577 PolarHBondContact O-N 3.31Å; L573-N577 PolarHBondContact O-ND2 2.84Å; E574-N577 PolarHBondContact O-N 2.93Å; N577-N579 PolarHBondContact O-N 2.88Å; N577-R580 WeakPolarHBondContact O-CG 3.22Å; N577-R580 PolarHBondContact O-N 3.14Å; N577-R580 VanDerWaalsContact O-N 3.08Å; N577-R580 VanDerWaalsContact OD1-CZ 3.28Å; N577-R580 PolarHBondContact OD1-NE 2.84Å; N577-R580 PolarHBondContact OD1-NH2 2.73Å
578	S	65.8	Low	64.5	Low	65 Å²	65	99.9 Å²	99.9	46%	0.455	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-9.4	-173.8	-68.1	0	0	0	0	116.4	E574 L576	E574-S578 PolarHBondContact O-N 3.47Å; E574-S578 VanDerWaalsContact O-N 3.13Å; E574-S578 PolarHBondContact O-OG 2.87Å; L576-S578 PolarHBondContact O-N 2.91Å
579	N	55	Low	61.9	Low	73 Å²	73	105 Å²	105	39%	0.39	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-20.8	175	-71.5	27.7	0	0	0	113.7	K549 N577 H581	K549-N579 PolarHBondContact NZ-OD1 2.92Å; N577-N579 PolarHBondContact O-N 2.88Å; N579-H581 PolarHBondContact O-N 3.06Å; N579-H581 VanDerWaalsContact O-N 3.09Å
580	R	43.9	Very low	59.3	Low	155 Å²	155	107.8 Å²	107.8	59%	0.585	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-16.8	-171.3	-63.7	-172.1	-161.6	-147.7	6.2	115.5	N577	N577-R580 WeakPolarHBondContact O-CG 3.22Å; N577-R580 PolarHBondContact O-N 3.14Å; N577-R580 VanDerWaalsContact O-N 3.08Å; N577-R580 VanDerWaalsContact OD1-CZ 3.28Å; N577-R580 PolarHBondContact OD1-NE 2.84Å; N577-R580 PolarHBondContact OD1-NH2 2.73Å
581	H	45.6	Very low	56.5	Low	173 Å²	173	109.5 Å²	109.5	80%	0.801	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	1.3	-170.9	-78.4	-84.5	0	0	0	115.9	N579	N579-H581 PolarHBondContact O-N 3.06Å; N579-H581 VanDerWaalsContact O-N 3.09Å
582	K	46	Very low	53.9	Low	201 Å²	201	116.6 Å²	116.6	87%	0.874	58%	0.58	S	S	*	*	S	Bend	trans	-104.2	-5	179.9	-75.4	-169.2	174.4	-176.6	0	115.9
583	E	42.3	Very low	51.3	Low	183 Å²	183	121 Å²	121	86%	0.855	61%	0.61	S	S	*	*	S	Bend	trans	-105.4	16.9	-174.9	-62.8	-178.3	155.8	0	0	113.6
584	K	35.6	Very low	48.9	Very low	190 Å²	190	126.3 Å²	126.3	83%	0.826	63%	0.633	S	S	*	*	S	Bend	trans	-127.2	25.3	-168.4	-136.6	177.7	-174.4	-177.1	0	116.2
585	C	30.4	Very low	46.2	Very low	120 Å²	120	126.8 Å²	126.8	81%	0.811	65%	0.648	S	S	*	*	S	Bend	trans	-134.8	154	171.7	-65.7	0	0	0	0	111.1
586	E	36.1	Very low	43.8	Very low	177 Å²	177	130.9 Å²	130.9	83%	0.827	68%	0.679	S	S	*	*			trans	63.9	56.5	175.5	-57.6	-165.4	165.9	0	0	117	T588	E586-T588 PolarHBondContact O-N 2.76Å
587	S	36.1	Very low	41.5	Very low	129 Å²	129	136.1 Å²	136.1	90%	0.902	71%	0.711	S	S	*	*			trans	-71.8	61.1	159.2	60.1	0	0	0	0	112.3
588	T	39.6	Very low	39.2	Very low	110 Å²	110	141 Å²	141	68%	0.675	74%	0.737	S	S	*	*			trans	-127.8	99.9	177.7	32.7	0	0	0	0	111.1	E586 P590	E586-T588 PolarHBondContact O-N 2.76Å; T588-P590 WeakPolarHBondContact O-CD 3.33Å
589	K	33.1	Very low	37.6	Very low	199 Å²	199	144.8 Å²	144.8	87%	0.865	75%	0.751	S	S	*	*			trans	-62.4	142.9	170.1	-62.4	177.5	-178	175.8	0	109.9
590	P	35.5	Very low	36.4	Very low	93 Å²	93	147 Å²	147	60%	0.604	76%	0.763	S	S	*	*			trans	-128.6	135.4	134.1	11.3	9.3	0	0	0	110.9	K156 T588	K156-P590 PolarHBondContact NZ-O 3.27Å; T588-P590 WeakPolarHBondContact O-CD 3.33Å
591	N	32.2	Very low	35.8	Very low	135 Å²	135	147.6 Å²	147.6	72%	0.722	78%	0.777	S	S	*	*			trans	-62.9	157.9	167.8	-66.3	-17.8	0	0	0	110.9	K156	K156-N591 PolarHBondContact NZ-O 2.76Å
592	Y	36.1	Very low	35.3	Very low	214 Å²	214	147.2 Å²	147.2	84%	0.839	78%	0.779	S	S	*	*				-177.6	158	128.9	-104.7	-72	0	0	0	108.3
593	S	37.2	Very low	34.5	Very low	92 Å²	92	143 Å²	143	64%	0.643	77%	0.766	S	S	*	*			trans	-119.7	147.9	-146.9	48.2	0	0	0	0	115.6
594	Q	38.7	Very low	34.2	Very low	183 Å²	183	138.6 Å²	138.6	86%	0.855	76%	0.755	S	S	*	*			trans	69	127.6	152.8	-68.4	170.8	-3.5	0	0	120.4
595	S	30.9	Very low	34.2	Very low	116 Å²	116	137.6 Å²	137.6	81%	0.811	75%	0.751	S	S	*	*			trans	64.4	139.7	152.4	-115.3	0	0	0	0	118.6
596	S	37.3	Very low	34.6	Very low	95 Å²	95	138.8 Å²	138.8	66%	0.664	74%	0.743	S	S	*	*			cis	-155.1	159.6	2	-37.7	0	0	0	0	108
597	T	35	Very low	34.9	Very low	114 Å²	114	134 Å²	134	70%	0.699	73%	0.727	S	S	*	*			cis	-164.6	162.7	-10	9.6	0	0	0	0	109.6
598	N	31.4	Very low	35.3	Very low	145 Å²	145	130.9 Å²	130.9	78%	0.775	71%	0.705	S	S	*	*			trans	46.9	85.6	148.8	-58.5	-3	0	0	0	120.1
599	L	31.7	Very low	35.6	Very low	144 Å²	144	129.3 Å²	129.3	75%	0.754	70%	0.698	S	S	*	*			trans	-173.3	82.7	131.7	-106.2	162.7	0	0	0	109.6
600	N	29.2	Very low	36.4	Very low	118 Å²	118	125.5 Å²	125.5	63%	0.631	68%	0.684	S	S	*	*			trans	-168.8	94.2	172.8	-98.6	-50.5	0	0	0	109.3	Q161	Q161-N600 PolarHBondContact OE1-ND2 2.91Å
601	L	31.3	Very low	37.4	Very low	168 Å²	168	122.3 Å²	122.3	88%	0.88	66%	0.661	S	S	*	*			trans	-152	65.7	174.7	-162.3	73.7	0	0	0	113.6
602	I	34.9	Very low	38.4	Very low	166 Å²	166	118.6 Å²	118.6	85%	0.851	64%	0.642	S	S	*	*			trans	-152.7	50.3	147.3	-91.8	140.7	0	0	0	107.3	S604	I602-S604 PolarHBondContact O-N 2.91Å; I602-S604 VanDerWaalsContact O-N 3.11Å
603	D	30.4	Very low	39.3	Very low	113 Å²	113	115.6 Å²	115.6	60%	0.604	63%	0.633	S	S	*	*			trans	-80.6	89.4	177.1	-179.1	16.7	0	0	0	110.7	K605	D603-K605 WeakPolarHBondContact OD1-CG 3.36Å; D603-K605 IonicContact OD1-NZ 3.08Å; D603-K605 WeakPolarHBondContact OD2-CE 3.27Å; D603-K605 IonicContact OD2-NZ 3.31Å; D603-K605 PolarHBondContact OD2-NZ 2.96Å
604	S	34.7	Very low	40.4	Very low	89 Å²	89	114.9 Å²	114.9	62%	0.622	62%	0.619	S	S	*	*			trans	-106.8	91.7	178	58	0	0	0	0	112.1	I602 K606	I602-S604 PolarHBondContact O-N 2.91Å; I602-S604 VanDerWaalsContact O-N 3.11Å; S604-K606 PolarHBondContact O-N 2.96Å
605	K	37.3	Very low	41.4	Very low	170 Å²	170	107.2 Å²	107.2	74%	0.739	58%	0.584	S	S	*	*			trans	-70.5	54.9	-175.8	-62.4	177.2	173.7	122.7	0	114.6	D603	D603-K605 WeakPolarHBondContact OD1-CG 3.36Å; D603-K605 IonicContact OD1-NZ 3.08Å; D603-K605 WeakPolarHBondContact OD2-CE 3.27Å; D603-K605 IonicContact OD2-NZ 3.31Å; D603-K605 PolarHBondContact OD2-NZ 2.96Å
606	K	37.8	Very low	42.6	Very low	145 Å²	145	109.7 Å²	109.7	63%	0.63	58%	0.577	S	S	*	*			trans	-120.8	1.9	-179.4	-77.6	-175.9	173.5	177.6	0	119.3	S604 S608	S604-K606 PolarHBondContact O-N 2.96Å; K606-S608 PolarHBondContact O-N 3.36Å
607	P	42	Very low	43.4	Very low	76 Å²	76	108.9 Å²	108.9	49%	0.494	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.2	-35.3	-167.7	-23.1	32.9	0	0	0	117.5
608	S	44	Very low	44.4	Very low	64 Å²	64	112 Å²	112	45%	0.448	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.3	-29.4	-161.1	-53.3	0	0	0	0	114.8	K606	K606-S608 PolarHBondContact O-N 3.36Å
609	S	46.3	Very low	45.6	Very low	76 Å²	76	110 Å²	110	53%	0.531	56%	0.561	S	S	.	*	H	α-helix	trans	-77.2	-29.5	-173.6	52.9	0	0	0	0	113.3	K613	S609-K613 PolarHBondContact O-N 2.73Å
610	Q	51.4	Low	47	Very low	120 Å²	120	109.1 Å²	109.1	56%	0.561	56%	0.561	S	S	*	*	H	α-helix	trans	-69.3	-42.4	178.7	-69	-175	-57.3	0	0	112.5	N612 K613 Q614	Q610-N612 VanDerWaalsContact C-N 3.25Å; Q610-N612 PolarHBondContact O-N 2.79Å; Q610-K613 PolarHBondContact O-N 2.78Å; Q610-K613 VanDerWaalsContact O-N 3.08Å; Q610-Q614 PolarHBondContact O-N 3.3Å; Q610-Q614 VanDerWaalsContact O-N 3.11Å
611	L	54.9	Low	48.9	Very low	26 Å²	26	105.2 Å²	105.2	14%	0.136	54%	0.54	C	S	.	.	H	α-helix	trans	-63.7	-34.2	178.5	-163.4	69.3	0	0	0	111.5	F552 I557 L576 Q614 L615	F552-L611 HydrophobicContact CB-CD1 4.49Å; I557-L611 HydrophobicContact CD1-CD1 4.12Å; I557-L611 HydrophobicContact CD1-CG 4.45Å; I557-L611 HydrophobicContact CG1-CD1 4.13Å; L576-L611 HydrophobicContact CD2-CD2 3.69Å; L576-L611 HydrophobicContact CD2-CG 4.44Å; L611-Q614 PolarHBondContact O-N 2.83Å; L611-L615 PolarHBondContact O-N 2.89Å
612	N	53.5	Low	51.5	Low	57 Å²	57	99.8 Å²	99.8	31%	0.305	52%	0.517	S	S	.	.	H	α-helix	trans	-73.6	-22.9	174.9	-73.2	-5.3	0	0	0	113.8	Q610 Y616	Q610-N612 VanDerWaalsContact C-N 3.25Å; Q610-N612 PolarHBondContact O-N 2.79Å; N612-Y616 WeakPolarHBondContact O-CD2 3.4Å
613	K	56.3	Low	54.1	Low	150 Å²	150	94.2 Å²	94.2	65%	0.652	49%	0.488	S	S	*	.	H	α-helix	trans	-73.5	-43.2	168.7	-75.4	-165	170.2	-160.1	0	111.6	S609 Q610 L615 Y616 D617	S609-K613 PolarHBondContact O-N 2.73Å; Q610-K613 PolarHBondContact O-N 2.78Å; Q610-K613 VanDerWaalsContact O-N 3.08Å; K613-L615 PolarHBondContact O-N 3.39Å; K613-Y616 PolarHBondContact O-N 3.46Å; K613-D617 PolarHBondContact O-N 3.41Å
614	Q	59	Low	57.1	Low	78 Å²	78	93.9 Å²	93.9	36%	0.364	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-12.8	178.8	-69.7	176.9	-9.6	0	0	114.8	I557 R567 Q610 L611 Y616	I557-Q614 HydrophobicContact CD1-CB 4.16Å; R567-Q614 PolarHBondContact NH1-O 3.2Å; Q610-Q614 PolarHBondContact O-N 3.3Å; Q610-Q614 VanDerWaalsContact O-N 3.11Å; L611-Q614 PolarHBondContact O-N 2.83Å; Q614-Y616 VanDerWaalsContact C-N 3.35Å
615	L	59.4	Low	59.8	Low	22 Å²	22	93.2 Å²	93.2	12%	0.115	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-30.1	169.5	-80	171.8	0	0	0	113.4	I557 R567 F572 L576 L611 K613	I557-L615 HydrophobicContact CD1-CD2 3.99Å; I557-L615 HydrophobicContact CD1-CG 4.1Å; R567-L615 PolarHBondContact NH1-O 3.14Å; F572-L615 HydrophobicContact CE1-CD2 3.6Å; F572-L615 HydrophobicContact CZ-CD2 3.95Å; L576-L615 HydrophobicContact CB-CD1 4.37Å; L576-L615 HydrophobicContact CD1-CD1 4.25Å; L576-L615 HydrophobicContact CD1-CD2 3.8Å; L576-L615 HydrophobicContact CD1-CG 4.32Å; L611-L615 PolarHBondContact O-N 2.89Å; K613-L615 PolarHBondContact O-N 3.39Å
616	Y	56	Low	62.5	Low	168 Å²	168	85.1 Å²	85.1	66%	0.659	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.2	-16.7	-174	-56.1	-79.7	0	0	0	113.8	N612 K613 Q614 E618	N612-Y616 WeakPolarHBondContact O-CD2 3.4Å; K613-Y616 PolarHBondContact O-N 3.46Å; Q614-Y616 VanDerWaalsContact C-N 3.35Å; Y616-E618 PolarHBondContact O-N 2.92Å; Y616-E618 VanDerWaalsContact O-N 3.14Å
617	D	56	Low	65.2	Low	78 Å²	78	79.3 Å²	79.3	42%	0.417	42%	0.419	S	S	.	.			trans	-65.9	108.6	165.6	-74.2	-36.2	0	0	0	109.8	K613 N619	K613-D617 PolarHBondContact O-N 3.41Å; D617-N619 WeakPolarHBondContact CB-ND2 3.33Å; D617-N619 PolarHBondContact O-N 2.95Å
618	E	55.7	Low	67.6	Low	179 Å²	179	79.6 Å²	79.6	84%	0.836	41%	0.414	S	S	*	.			trans	-73.8	57.7	161.4	-66.4	-163.5	161.4	0	0	110.7	Y616 V620	Y616-E618 PolarHBondContact O-N 2.92Å; Y616-E618 VanDerWaalsContact O-N 3.14Å; E618-V620 VanDerWaalsContact C-N 3.27Å; E618-V620 PolarHBondContact O-N 3.17Å
619	N	56.6	Low	69.9	Low	104 Å²	104	81 Å²	81	56%	0.556	41%	0.412	S	S	*	.			trans	-66.7	95.3	159.9	-78.6	-59.4	0	0	0	107.2	D617 D621	D617-N619 WeakPolarHBondContact CB-ND2 3.33Å; D617-N619 PolarHBondContact O-N 2.95Å; N619-D621 PolarHBondContact O-N 2.67Å
620	V	59.7	Low	72.2	Confident	124 Å²	124	77.5 Å²	77.5	75%	0.752	39%	0.387	S	S	*	.			trans	-73.8	58.7	173.3	-166.9	0	0	0	0	109.2	E618 S622	E618-V620 VanDerWaalsContact C-N 3.27Å; E618-V620 PolarHBondContact O-N 3.17Å; V620-S622 PolarHBondContact O-N 3.45Å
621	D	69.1	Low	74.3	Confident	36 Å²	36	74.1 Å²	74.1	19%	0.193	37%	0.371	C	S	.	.			trans	-51.5	125	163.6	-82.4	-16.7	0	0	0	106.6	P559 N619 T625 K629	P559-D621 WeakPolarHBondContact CB-O 3.48Å; P559-D621 WeakPolarHBondContact CG-O 3.44Å; N619-D621 PolarHBondContact O-N 2.67Å; D621-T625 HydrophobicContact CB-CG2 4.45Å; D621-K629 IonicContact OD2-NZ 2.96Å; D621-K629 PolarHBondContact OD2-NZ 3.42Å
622	S	86.7	Confident	76.1	Confident	55 Å²	55	77.6 Å²	77.6	39%	0.385	39%	0.389	S	S	.	.			trans	-61.8	159.1	170.8	79.6	0	0	0	0	109.7	V620 D624 T625 Y626	V620-S622 PolarHBondContact O-N 3.45Å; S622-D624 PolarHBondContact O-N 2.89Å; S622-D624 VanDerWaalsContact O-N 3.13Å; S622-D624 PolarHBondContact OG-N 2.93Å; S622-T625 PolarHBondContact O-N 3.45Å; S622-T625 VanDerWaalsContact O-N 3.17Å; S622-T625 WeakPolarHBondContact OG-CB 3.49Å; S622-T625 PolarHBondContact OG-N 2.9Å; S622-T625 PolarHBondContact OG-OG1 3Å; S622-Y626 WeakPolarHBondContact O-CB 3.4Å; S622-Y626 PolarHBondContact O-N 2.85Å
623	I	90.3	Very high	78	Confident	49 Å²	49	77.2 Å²	77.2	25%	0.251	39%	0.389	S	S	.	.	H	α-helix	trans	-51.9	-39.1	175.3	-73	172.9	0	0	0	110.3	S561 Y562 N627	S561-I623 WeakPolarHBondContact O-CD1 3.48Å; Y562-I623 HydrophobicContact CD2-CG2 4.2Å; I623-N627 WeakPolarHBondContact O-CB 3.35Å; I623-N627 PolarHBondContact O-N 2.71Å; I623-N627 PolarHBondContact O-ND2 3.2Å
624	D	91.9	Very high	79.8	Confident	106 Å²	106	70.1 Å²	70.1	57%	0.567	36%	0.358	S	S	*	.	H	α-helix	trans	-77.5	-39.6	-178.6	-57.9	-49.9	0	0	0	112.6	S622 Y626 N627 E628	S622-D624 PolarHBondContact O-N 2.89Å; S622-D624 VanDerWaalsContact O-N 3.13Å; S622-D624 PolarHBondContact OG-N 2.93Å; D624-Y626 VanDerWaalsContact C-N 3.28Å; D624-Y626 PolarHBondContact O-N 3.11Å; D624-N627 WeakPolarHBondContact O-CB 3.3Å; D624-N627 PolarHBondContact O-N 3.24Å; D624-N627 VanDerWaalsContact O-N 3.16Å; D624-E628 WeakPolarHBondContact O-CG 3.49Å; D624-E628 PolarHBondContact O-N 2.76Å
625	T	92	Very high	81.4	Confident	75 Å²	75	67.9 Å²	67.9	46%	0.46	35%	0.351	S	S	.	.	H	α-helix	trans	-56.1	-44.8	170.7	-50.3	0	0	0	0	111	D621 S622 K629	D621-T625 HydrophobicContact CB-CG2 4.45Å; S622-T625 PolarHBondContact O-N 3.45Å; S622-T625 VanDerWaalsContact O-N 3.17Å; S622-T625 WeakPolarHBondContact OG-CB 3.49Å; S622-T625 PolarHBondContact OG-N 2.9Å; S622-T625 PolarHBondContact OG-OG1 3Å; T625-K629 WeakPolarHBondContact O-CB 3.38Å; T625-K629 PolarHBondContact O-N 3.3Å; T625-K629 VanDerWaalsContact O-N 3.13Å
626	Y	93.5	Very high	82.9	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-69.5	-37.6	177	-175.6	-101.7	0	0	0	112.4	F555 G556 P558 P559 Y562 S622 D624 K629 I630 L655	F555-Y626 WeakPolarHBondContact O-CE2 3.41Å; F555-Y626 PolarHBondContact O-OH 3.4Å; G556-Y626 PolarHBondContact O-OH 2.82Å; P558-Y626 VanDerWaalsContact CA-CZ 3.5Å; P558-Y626 HydrophobicContact CB-CD1 4.27Å; P558-Y626 HydrophobicContact CB-CE1 3.62Å; P558-Y626 HydrophobicContact CB-CE2 4.22Å; P559-Y626 HydrophobicContact CG-CG 4.45Å; Y562-Y626 AromaticContact CD2-CD1 3.89Å; Y562-Y626 HydrophobicContact CD2-CD1 3.89Å; Y562-Y626 HydrophobicContact CD2-CE1 4.36Å; Y562-Y626 HydrophobicContact CE2-CD1 4.22Å; Y562-Y626 HydrophobicContact CE2-CE1 4.47Å; Y562-Y626 HydrophobicContact CG-CD1 4.18Å; Y562-Y626 HydrophobicContact CG-CE1 4.38Å; S622-Y626 WeakPolarHBondContact O-CB 3.4Å; S622-Y626 PolarHBondContact O-N 2.85Å; D624-Y626 VanDerWaalsContact C-N 3.28Å; D624-Y626 PolarHBondContact O-N 3.11Å; Y626-K629 HydrophobicContact CD2-CD 4.44Å; Y626-K629 WeakPolarHBondContact O-CB 3.39Å; Y626-K629 PolarHBondContact O-N 3.14Å; Y626-I630 HydrophobicContact CD1-CD1 4.1Å; Y626-I630 HydrophobicContact CE1-CD1 3.43Å; Y626-I630 VanDerWaalsContact CE1-CD1 3.43Å; Y626-I630 HydrophobicContact CE1-CG1 4.26Å; Y626-I630 PolarHBondContact O-N 2.86Å; Y626-I630 VanDerWaalsContact O-N 3.13Å; Y626-L655 HydrophobicContact CE1-CD1 4.18Å; Y626-L655 VanDerWaalsContact OH-CD1 3.25Å; Y626-L655 WeakPolarHBondContact OH-CD1 3.47Å
627	N	94.1	Very high	84.6	Confident	22 Å²	22	65.6 Å²	65.6	12%	0.118	36%	0.36	C	S	.	.	H	α-helix	trans	-61.6	-48.4	173.6	-75.2	-31.7	0	0	0	111.9	Y562 I623 D624 K629 I630 K631 F650	Y562-N627 WeakPolarHBondContact CE2-OD1 3.35Å; I623-N627 WeakPolarHBondContact O-CB 3.35Å; I623-N627 PolarHBondContact O-N 2.71Å; I623-N627 PolarHBondContact O-ND2 3.2Å; D624-N627 WeakPolarHBondContact O-CB 3.3Å; D624-N627 PolarHBondContact O-N 3.24Å; D624-N627 VanDerWaalsContact O-N 3.16Å; N627-K629 VanDerWaalsContact C-N 3.31Å; N627-K629 PolarHBondContact O-N 3.17Å; N627-I630 PolarHBondContact O-N 2.86Å; N627-I630 VanDerWaalsContact O-N 3.16Å; N627-K631 WeakPolarHBondContact O-CG 3.32Å; N627-K631 PolarHBondContact O-N 2.94Å; N627-F650 HydrophobicContact CB-CE2 4.08Å; N627-F650 HydrophobicContact CB-CZ 3.72Å
628	E	93.2	Very high	86.4	Confident	83 Å²	83	62 Å²	62	39%	0.388	34%	0.341	S	S	.	.	H	α-helix	trans	-63.7	-36.2	178.9	-67.2	-49.1	130.6	0	0	112.1	D624 I630 K631 N632	D624-E628 WeakPolarHBondContact O-CG 3.49Å; D624-E628 PolarHBondContact O-N 2.76Å; E628-I630 PolarHBondContact O-N 2.79Å; E628-K631 PolarHBondContact O-N 2.69Å; E628-K631 WeakPolarHBondContact OE1-CD 3.31Å; E628-K631 WeakPolarHBondContact OE1-CE 3.42Å; E628-K631 IonicContact OE1-NZ 3.49Å; E628-K631 PolarHBondContact OE1-NZ 3.05Å; E628-K631 WeakPolarHBondContact OE2-CD 3.38Å; E628-K631 IonicContact OE2-NZ 3.77Å; E628-N632 WeakPolarHBondContact O-CB 3.44Å; E628-N632 PolarHBondContact O-N 3.4Å; E628-N632 PolarHBondContact O-ND2 3.06Å
629	K	92.7	Very high	88.2	Confident	93 Å²	93	57.1 Å²	57.1	40%	0.404	33%	0.332	S	S	.	.	H	α-helix	trans	-59.6	-41.5	172.1	-177.2	176.1	-179.5	169.4	0	112.4	D621 T625 Y626 N627 T633	D621-K629 IonicContact OD2-NZ 2.96Å; D621-K629 PolarHBondContact OD2-NZ 3.42Å; T625-K629 WeakPolarHBondContact O-CB 3.38Å; T625-K629 PolarHBondContact O-N 3.3Å; T625-K629 VanDerWaalsContact O-N 3.13Å; Y626-K629 HydrophobicContact CD2-CD 4.44Å; Y626-K629 WeakPolarHBondContact O-CB 3.39Å; Y626-K629 PolarHBondContact O-N 3.14Å; N627-K629 VanDerWaalsContact C-N 3.31Å; N627-K629 PolarHBondContact O-N 3.17Å; K629-T633 WeakPolarHBondContact O-CB 3.28Å; K629-T633 PolarHBondContact O-N 3.12Å; K629-T633 PolarHBondContact O-OG1 2.84Å
630	I	94.5	Very high	90	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.015	32%	0.321	C	S	.	.	H	α-helix	trans	-68.7	-46.9	172.4	-66.4	-179.6	0	0	0	111.1	F555 Y626 N627 E628 N632 T633 L634 F650	F555-I630 HydrophobicContact CB-CD1 3.96Å; F555-I630 HydrophobicContact CB-CG1 3.96Å; F555-I630 HydrophobicContact CD1-CG1 4.3Å; F555-I630 HydrophobicContact CD1-CG2 3.96Å; F555-I630 HydrophobicContact CD2-CD1 4.21Å; F555-I630 HydrophobicContact CD2-CG2 4.43Å; F555-I630 HydrophobicContact CE1-CG2 3.9Å; F555-I630 HydrophobicContact CE2-CG2 4.37Å; F555-I630 HydrophobicContact CG-CD1 4.09Å; F555-I630 HydrophobicContact CG-CG1 4.09Å; F555-I630 HydrophobicContact CG-CG2 4.24Å; F555-I630 HydrophobicContact CZ-CG2 4.11Å; Y626-I630 HydrophobicContact CD1-CD1 4.1Å; Y626-I630 HydrophobicContact CE1-CD1 3.43Å; Y626-I630 VanDerWaalsContact CE1-CD1 3.43Å; Y626-I630 HydrophobicContact CE1-CG1 4.26Å; Y626-I630 PolarHBondContact O-N 2.86Å; Y626-I630 VanDerWaalsContact O-N 3.13Å; N627-I630 PolarHBondContact O-N 2.86Å; N627-I630 VanDerWaalsContact O-N 3.16Å; E628-I630 PolarHBondContact O-N 2.79Å; I630-N632 PolarHBondContact O-N 3.01Å; I630-T633 WeakPolarHBondContact O-CB 3.28Å; I630-T633 PolarHBondContact O-N 3.49Å; I630-L634 HydrophobicContact CG2-CD1 3.88Å; I630-L634 HydrophobicContact CG2-CG 4.34Å; I630-L634 WeakPolarHBondContact O-CG 3.34Å; I630-L634 PolarHBondContact O-N 3.05Å; I630-F650 HydrophobicContact CB-CD2 4.32Å; I630-F650 HydrophobicContact CB-CE2 4.25Å; I630-F650 HydrophobicContact CG2-CD2 3.85Å; I630-F650 HydrophobicContact CG2-CE2 4.18Å
631	K	94.5	Very high	91.7	Very high	49 Å²	49	50.7 Å²	50.7	21%	0.213	29%	0.287	C	S	.	.	H	α-helix	trans	-55.1	-53.8	178.4	-74	176.6	-174.9	172.8	0	111.2	N627 E628 T633 L634 S635 F650	N627-K631 WeakPolarHBondContact O-CG 3.32Å; N627-K631 PolarHBondContact O-N 2.94Å; E628-K631 PolarHBondContact O-N 2.69Å; E628-K631 WeakPolarHBondContact OE1-CD 3.31Å; E628-K631 WeakPolarHBondContact OE1-CE 3.42Å; E628-K631 IonicContact OE1-NZ 3.49Å; E628-K631 PolarHBondContact OE1-NZ 3.05Å; E628-K631 WeakPolarHBondContact OE2-CD 3.38Å; E628-K631 IonicContact OE2-NZ 3.77Å; K631-T633 VanDerWaalsContact C-N 3.29Å; K631-T633 PolarHBondContact O-N 3.02Å; K631-L634 CarbonylContact O-C 3.54Å; K631-L634 WeakPolarHBondContact O-CA 3.09Å; K631-L634 WeakPolarHBondContact O-CB 3.44Å; K631-L634 PolarHBondContact O-N 3.23Å; K631-S635 PolarHBondContact O-N 3.47Å; K631-S635 PolarHBondContact O-OG 2.81Å; K631-S635 VanDerWaalsContact O-OG 3.14Å; K631-F650 HydrophobicContact CD-CD1 4.47Å; K631-F650 HydrophobicContact CG-CB 4.15Å; K631-F650 HydrophobicContact CG-CD1 4.04Å; K631-F650 HydrophobicContact CG-CD2 3.57Å; K631-F650 HydrophobicContact CG-CE1 4.38Å; K631-F650 HydrophobicContact CG-CE2 3.93Å; K631-F650 HydrophobicContact CG-CG 3.63Å; K631-F650 HydrophobicContact CG-CZ 4.33Å
632	N	93.4	Very high	92.9	Very high	98 Å²	98	52.2 Å²	52.2	52%	0.524	30%	0.295	S	S	.	.	H	α-helix	trans	-55.3	-43.7	177.9	-74.4	-45.8	0	0	0	112	E628 I630 L634 S635 C636	E628-N632 WeakPolarHBondContact O-CB 3.44Å; E628-N632 PolarHBondContact O-N 3.4Å; E628-N632 PolarHBondContact O-ND2 3.06Å; I630-N632 PolarHBondContact O-N 3.01Å; N632-L634 VanDerWaalsContact C-N 3.32Å; N632-L634 PolarHBondContact O-N 3.28Å; N632-S635 PolarHBondContact O-N 3.37Å; N632-C636 PolarHBondContact O-N 3.45Å; N632-C636 PolarHBondContact O-SG 3.38Å; N632-C636 VanDerWaalsContact O-SG 3.34Å
633	T	93.6	Very high	93.3	Very high	50 Å²	50	54 Å²	54	31%	0.307	31%	0.307	S	S	.	.	H	α-helix	trans	-62.8	-36.6	176.2	-56.8	0	0	0	0	112.8	K554 K629 I630 K631 S637	K554-T633 HydrophobicContact CG-CG2 4.02Å; K554-T633 WeakPolarHBondContact O-CG2 3.41Å; K629-T633 WeakPolarHBondContact O-CB 3.28Å; K629-T633 PolarHBondContact O-N 3.12Å; K629-T633 PolarHBondContact O-OG1 2.84Å; I630-T633 WeakPolarHBondContact O-CB 3.28Å; I630-T633 PolarHBondContact O-N 3.49Å; K631-T633 VanDerWaalsContact C-N 3.29Å; K631-T633 PolarHBondContact O-N 3.02Å; T633-S637 WeakPolarHBondContact O-CB 3.49Å; T633-S637 PolarHBondContact O-N 3Å; T633-S637 PolarHBondContact O-OG 2.93Å
634	L	94.2	Very high	93.6	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-73.4	-43.2	174.4	-71.1	173.7	0	0	0	111.8	F555 I630 K631 N632 S637 A638 L649 F650 L653	F555-L634 HydrophobicContact CE1-CD1 4.45Å; F555-L634 HydrophobicContact CE1-CD2 3.87Å; F555-L634 HydrophobicContact CE1-CG 4.06Å; F555-L634 HydrophobicContact CZ-CD1 4.33Å; F555-L634 HydrophobicContact CZ-CD2 4Å; F555-L634 HydrophobicContact CZ-CG 4.34Å; I630-L634 HydrophobicContact CG2-CD1 3.88Å; I630-L634 HydrophobicContact CG2-CG 4.34Å; I630-L634 WeakPolarHBondContact O-CG 3.34Å; I630-L634 PolarHBondContact O-N 3.05Å; K631-L634 CarbonylContact O-C 3.54Å; K631-L634 WeakPolarHBondContact O-CA 3.09Å; K631-L634 WeakPolarHBondContact O-CB 3.44Å; K631-L634 PolarHBondContact O-N 3.23Å; N632-L634 VanDerWaalsContact C-N 3.32Å; N632-L634 PolarHBondContact O-N 3.28Å; L634-S637 CarbonylContact O-C 3.58Å; L634-S637 PolarHBondContact O-N 3.33Å; L634-A638 WeakPolarHBondContact O-CA 3.25Å; L634-A638 WeakPolarHBondContact O-CB 3.43Å; L634-A638 PolarHBondContact O-N 3.05Å; L634-L649 HydrophobicContact CD1-CG 4.43Å; L634-L649 HydrophobicContact CD2-CD2 4.2Å; L634-L649 HydrophobicContact CD2-CG 4.43Å; L634-F650 HydrophobicContact CD1-CB 4Å; L634-L653 HydrophobicContact CD1-CD1 4.38Å; L634-L653 HydrophobicContact CD2-CD1 4.08Å
635	S	92.9	Very high	93.8	Very high	31 Å²	31	49.1 Å²	49.1	22%	0.217	28%	0.282	C	S	.	.	H	α-helix	trans	-58.2	-49	177.1	-64.6	0	0	0	0	112.1	K631 N632 S637 A639 Q646	K631-S635 PolarHBondContact O-N 3.47Å; K631-S635 PolarHBondContact O-OG 2.81Å; K631-S635 VanDerWaalsContact O-OG 3.14Å; N632-S635 PolarHBondContact O-N 3.37Å; S635-S637 PolarHBondContact O-N 3.48Å; S635-A639 WeakPolarHBondContact O-CA 3.49Å; S635-A639 PolarHBondContact O-N 3.01Å; S635-A639 VanDerWaalsContact O-N 3.17Å; S635-Q646 PolarHBondContact OG-OE1 3.48Å
636	C	90.5	Very high	94	Very high	107 Å²	107	47.3 Å²	47.3	72%	0.723	27%	0.268	S	S	*	.	H	α-helix	trans	-61.9	-43.8	174.9	-64.9	0	0	0	0	112.1	N632	N632-C636 PolarHBondContact O-N 3.45Å; N632-C636 PolarHBondContact O-SG 3.38Å; N632-C636 VanDerWaalsContact O-SG 3.34Å
637	S	91.8	Very high	94.2	Very high	35 Å²	35	50 Å²	50	25%	0.245	28%	0.28	C	S	.	.	H	α-helix	trans	-87.6	-4.7	-173.9	69.5	0	0	0	0	115.3	Y530 T534 K554 T633 L634 S635	Y530-S637 WeakPolarHBondContact CE2-O 3.38Å; Y530-S637 PolarHBondContact OH-O 3.08Å; T534-S637 WeakPolarHBondContact CG2-O 3.48Å; K554-S637 WeakPolarHBondContact CE-OG 3.38Å; K554-S637 PolarHBondContact NZ-OG 3.36Å; T633-S637 WeakPolarHBondContact O-CB 3.49Å; T633-S637 PolarHBondContact O-N 3Å; T633-S637 PolarHBondContact O-OG 2.93Å; L634-S637 CarbonylContact O-C 3.58Å; L634-S637 PolarHBondContact O-N 3.33Å; S635-S637 PolarHBondContact O-N 3.48Å
638	A	93.1	Very high	94.4	Very high	2 Å²	2	48.9 Å²	48.9	2%	0.017	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.6	28.4	178.5	0	0	0	0	0	113	Y530 T533 L634 R640 L641 L649	Y530-A638 HydrophobicContact CD2-CB 3.93Å; Y530-A638 HydrophobicContact CE2-CB 3.93Å; T533-A638 HydrophobicContact CG2-CB 4.42Å; L634-A638 WeakPolarHBondContact O-CA 3.25Å; L634-A638 WeakPolarHBondContact O-CB 3.43Å; L634-A638 PolarHBondContact O-N 3.05Å; A638-R640 PolarHBondContact O-N 3.2Å; A638-L641 HydrophobicContact CB-CD1 4.24Å; A638-L641 PolarHBondContact O-N 3.41Å; A638-L649 HydrophobicContact CB-CD2 3.84Å
639	A	93.1	Very high	94.6	Very high	77 Å²	77	45 Å²	45	64%	0.636	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-4.8	-171.4	0	0	0	0	0	117.6	S635	S635-A639 WeakPolarHBondContact O-CA 3.49Å; S635-A639 PolarHBondContact O-N 3.01Å; S635-A639 VanDerWaalsContact O-N 3.17Å
640	R	94.9	Very high	94.8	Very high	88 Å²	88	41.6 Å²	41.6	33%	0.332	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-15.5	170	-65.6	-177	63.4	-136.7	-2.2	113.6	L435 M437 T533 A638	L435-R640 PolarHBondContact O-NH1 3.16Å; L435-R640 PolarHBondContact O-NH2 3.4Å; M437-R640 HydrophobicContact CE-CB 4.49Å; M437-R640 WeakPolarHBondContact CE-O 3.36Å; M437-R640 HydrophobicContact SD-CB 3.94Å; M437-R640 VanDerWaalsContact SD-CZ 3.51Å; M437-R640 PolarHBondContact SD-NH2 3.18Å; M437-R640 VanDerWaalsContact SD-NH2 3.43Å; T533-R640 HydrophobicContact CG2-CB 3.85Å; T533-R640 WeakPolarHBondContact O-CD 3.31Å; T533-R640 PolarHBondContact O-NH1 3.09Å; A638-R640 PolarHBondContact O-N 3.2Å
641	L	95	Very high	95	Very high	6 Å²	6	43.5 Å²	43.5	3%	0.031	25%	0.251	C	S	.	.	S	Bend	trans	-80.8	141.1	167.9	-71.9	163.7	0	0	0	109.4	M437 L529 T533 A638 Q646 L649 Y671	M437-L641 HydrophobicContact CE-CD2 3.57Å; M437-L641 HydrophobicContact CE-CG 4.03Å; L529-L641 HydrophobicContact CD1-CD1 4.37Å; L529-L641 HydrophobicContact CD1-CD2 4.1Å; L529-L641 HydrophobicContact CG-CD1 4.33Å; T533-L641 HydrophobicContact CG2-CD1 4.08Å; T533-L641 HydrophobicContact CG2-CG 3.78Å; A638-L641 HydrophobicContact CB-CD1 4.24Å; A638-L641 PolarHBondContact O-N 3.41Å; L641-Q646 HydrophobicContact CB-CG 3.88Å; L641-Q646 PolarHBondContact O-NE2 3.4Å; L641-L649 HydrophobicContact CD1-CB 4.42Å; L641-L649 HydrophobicContact CD1-CD2 3.94Å; L641-Y671 HydrophobicContact CD2-CE2 3.97Å; L641-Y671 WeakPolarHBondContact CD2-OH 3.25Å
642	N	94.8	Very high	95.1	Very high	68 Å²	68	41.2 Å²	41.2	36%	0.364	24%	0.241	S	C	.	.			trans	-74.2	169.9	166.6	71.5	-46.4	0	0	0	110.5	D644 G645 Q646 Y671	N642-D644 VanDerWaalsContact C-N 3.33Å; N642-D644 PolarHBondContact ND2-OD2 3.41Å; N642-D644 PolarHBondContact O-N 3.25Å; N642-G645 WeakPolarHBondContact O-CA 3.46Å; N642-G645 PolarHBondContact O-N 2.68Å; N642-Q646 PolarHBondContact O-N 2.75Å; N642-Y671 WeakPolarHBondContact OD1-CD2 3.29Å; N642-Y671 WeakPolarHBondContact OD1-CE2 3.46Å
643	S	95.2	Very high	95.3	Very high	92 Å²	92	36.6 Å²	36.6	64%	0.643	22%	0.216	S	C	*	.	H	α-helix	trans	-48	-49	-176.3	-173.7	0	0	0	0	113.4	G645 Q646 Q647	S643-G645 PolarHBondContact O-N 2.88Å; S643-Q646 WeakPolarHBondContact O-CB 3.49Å; S643-Q646 PolarHBondContact O-N 2.99Å; S643-Q647 PolarHBondContact O-N 3.27Å
644	D	96.3	Very high	95.4	Very high	53 Å²	53	34.5 Å²	34.5	28%	0.283	20%	0.204	S	C	.	.	H	α-helix	trans	-58.9	-35.6	177	-33.6	-67.8	0	0	0	112.9	N642 L648 H669 V670 Y671	N642-D644 VanDerWaalsContact C-N 3.33Å; N642-D644 PolarHBondContact ND2-OD2 3.41Å; N642-D644 PolarHBondContact O-N 3.25Å; D644-L648 WeakPolarHBondContact O-CB 3.15Å; D644-L648 PolarHBondContact O-N 2.88Å; D644-H669 PolarHBondContact O-CE1 3.28Å; D644-V670 HydrophobicContact CB-CB 4.46Å; D644-Y671 HydrophobicContact CB-CD2 4.27Å; D644-Y671 HydrophobicContact CB-CG 4.47Å
645	G	96.6	Very high	95.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-73.2	-32	178.4	0	0	0	0	0	112.6	N642 S643 L649	N642-G645 WeakPolarHBondContact O-CA 3.46Å; N642-G645 PolarHBondContact O-N 2.68Å; S643-G645 PolarHBondContact O-N 2.88Å; G645-L649 VanDerWaalsContact O-CB 3.25Å; G645-L649 WeakPolarHBondContact O-CB 3.36Å; G645-L649 PolarHBondContact O-N 3.17Å
646	Q	96.8	Very high	95.5	Very high	36 Å²	36	34.1 Å²	34.1	17%	0.168	20%	0.2	C	C	.	.	H	α-helix	trans	-72.1	-41.4	174.1	-61.7	172.7	7.3	0	0	110.8	S635 L641 N642 S643 L649 F650	S635-Q646 PolarHBondContact OG-OE1 3.48Å; L641-Q646 HydrophobicContact CB-CG 3.88Å; L641-Q646 PolarHBondContact O-NE2 3.4Å; N642-Q646 PolarHBondContact O-N 2.75Å; S643-Q646 WeakPolarHBondContact O-CB 3.49Å; S643-Q646 PolarHBondContact O-N 2.99Å; Q646-L649 WeakPolarHBondContact O-CB 3.41Å; Q646-L649 PolarHBondContact O-N 3.23Å; Q646-F650 WeakPolarHBondContact O-CB 3.37Å; Q646-F650 PolarHBondContact O-N 3.03Å
647	Q	96.6	Very high	95.6	Very high	56 Å²	56	29.3 Å²	29.3	26%	0.262	17%	0.169	S	C	.	.	H	α-helix	trans	-61.5	-49.2	173.1	178.7	61.2	22.2	0	0	111.6	S643 L649 F650 E651	S643-Q647 PolarHBondContact O-N 3.27Å; Q647-L649 VanDerWaalsContact C-N 3.28Å; Q647-L649 PolarHBondContact O-N 2.64Å; Q647-F650 WeakPolarHBondContact O-CB 3.28Å; Q647-F650 PolarHBondContact O-N 2.77Å; Q647-F650 VanDerWaalsContact O-N 3.16Å; Q647-E651 PolarHBondContact NE2-OE1 2.84Å; Q647-E651 WeakPolarHBondContact O-CG 3.38Å; Q647-E651 PolarHBondContact O-N 3.21Å
648	L	98	Very high	95.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.1	-39	175.9	-179.9	61.5	0	0	0	112.1	F448 D644 E651 C652 A666 H669 Y671 F672	F448-L648 HydrophobicContact CE2-CD1 4.49Å; F448-L648 HydrophobicContact CE2-CD2 4.29Å; D644-L648 WeakPolarHBondContact O-CB 3.15Å; D644-L648 PolarHBondContact O-N 2.88Å; L648-E651 PolarHBondContact O-N 3.08Å; L648-C652 PolarHBondContact O-N 3.17Å; L648-C652 PolarHBondContact O-SG 2.65Å; L648-A666 HydrophobicContact CD1-CB 4.16Å; L648-H669 HydrophobicContact CD1-CB 4.07Å; L648-Y671 HydrophobicContact CD2-CD1 3.61Å; L648-Y671 HydrophobicContact CD2-CE1 4.38Å; L648-Y671 HydrophobicContact CD2-CG 4.29Å; L648-F672 HydrophobicContact CD2-CE1 4.13Å; L648-F672 HydrophobicContact CD2-CE2 3.93Å; L648-F672 HydrophobicContact CD2-CZ 3.63Å
649	L	98.2	Very high	95.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64	-42.2	176.4	177.1	63.1	0	0	0	111.8	G526 L529 Y530 L634 A638 L641 G645 Q646 Q647 C652 L653	G526-L649 WeakPolarHBondContact O-CD1 3.31Å; L529-L649 HydrophobicContact CB-CD1 4.32Å; L529-L649 HydrophobicContact CD2-CB 3.96Å; L529-L649 HydrophobicContact CD2-CD1 4.08Å; L529-L649 HydrophobicContact CG-CD1 4.17Å; Y530-L649 HydrophobicContact CD2-CD2 4.16Å; L634-L649 HydrophobicContact CD1-CG 4.43Å; L634-L649 HydrophobicContact CD2-CD2 4.2Å; L634-L649 HydrophobicContact CD2-CG 4.43Å; A638-L649 HydrophobicContact CB-CD2 3.84Å; L641-L649 HydrophobicContact CD1-CB 4.42Å; L641-L649 HydrophobicContact CD1-CD2 3.94Å; G645-L649 VanDerWaalsContact O-CB 3.25Å; G645-L649 WeakPolarHBondContact O-CB 3.36Å; G645-L649 PolarHBondContact O-N 3.17Å; Q646-L649 WeakPolarHBondContact O-CB 3.41Å; Q646-L649 PolarHBondContact O-N 3.23Å; Q647-L649 VanDerWaalsContact C-N 3.28Å; Q647-L649 PolarHBondContact O-N 2.64Å; L649-C652 PolarHBondContact O-N 3.18Å; L649-L653 HydrophobicContact CD1-CD1 3.57Å; L649-L653 HydrophobicContact CD1-CG 4.3Å; L649-L653 HydrophobicContact CG-CD1 4.01Å; L649-L653 WeakPolarHBondContact O-CB 3.27Å; L649-L653 VanDerWaalsContact O-CG 3.31Å; L649-L653 WeakPolarHBondContact O-CG 3.23Å; L649-L653 PolarHBondContact O-N 2.67Å
650	F	97.5	Very high	95.7	Very high	22 Å²	22	35.4 Å²	35.4	10%	0.096	18%	0.179	C	C	.	.	H	α-helix	trans	-61.1	-48.7	173.4	163	-98.8	0	0	0	111.7	N627 I630 K631 L634 Q646 Q647 C652 L653 A654	N627-F650 HydrophobicContact CB-CE2 4.08Å; N627-F650 HydrophobicContact CB-CZ 3.72Å; I630-F650 HydrophobicContact CB-CD2 4.32Å; I630-F650 HydrophobicContact CB-CE2 4.25Å; I630-F650 HydrophobicContact CG2-CD2 3.85Å; I630-F650 HydrophobicContact CG2-CE2 4.18Å; K631-F650 HydrophobicContact CD-CD1 4.47Å; K631-F650 HydrophobicContact CG-CB 4.15Å; K631-F650 HydrophobicContact CG-CD1 4.04Å; K631-F650 HydrophobicContact CG-CD2 3.57Å; K631-F650 HydrophobicContact CG-CE1 4.38Å; K631-F650 HydrophobicContact CG-CE2 3.93Å; K631-F650 HydrophobicContact CG-CG 3.63Å; K631-F650 HydrophobicContact CG-CZ 4.33Å; L634-F650 HydrophobicContact CD1-CB 4Å; Q646-F650 WeakPolarHBondContact O-CB 3.37Å; Q646-F650 PolarHBondContact O-N 3.03Å; Q647-F650 WeakPolarHBondContact O-CB 3.28Å; Q647-F650 PolarHBondContact O-N 2.77Å; Q647-F650 VanDerWaalsContact O-N 3.16Å; F650-C652 PolarHBondContact O-N 3.31Å; F650-L653 CarbonylContact O-C 3.56Å; F650-L653 PolarHBondContact O-N 3Å; F650-A654 PolarHBondContact O-N 2.98Å
651	E	97.5	Very high	95.9	Very high	44 Å²	44	32.5 Å²	32.5	21%	0.206	17%	0.17	C	C	.	.	H	α-helix	trans	-61.7	-28.6	178.4	-72.1	173.1	179.3	0	0	113.5	Q647 L648 R660 I661 H669	Q647-E651 PolarHBondContact NE2-OE1 2.84Å; Q647-E651 WeakPolarHBondContact O-CG 3.38Å; Q647-E651 PolarHBondContact O-N 3.21Å; L648-E651 PolarHBondContact O-N 3.08Å; E651-R660 WeakPolarHBondContact O-CA 3.26Å; E651-I661 HydrophobicContact CB-CB 4.07Å; E651-I661 HydrophobicContact CB-CG2 3.92Å; E651-I661 PolarHBondContact O-N 3.17Å; E651-I661 VanDerWaalsContact O-N 3.11Å; E651-I661 VanDerWaalsContact OE2-CD1 3.25Å; E651-I661 WeakPolarHBondContact OE2-CD1 3.42Å; E651-H669 IonicContact OE1-NE2 2.81Å; E651-H669 IonicContact OE2-CD2 2.79Å; E651-H669 PolarHBondContact OE2-CD2 3.49Å; E651-H669 VanDerWaalsContact OE2-CD2 3.28Å; E651-H669 IonicContact OE2-NE2 2.73Å
652	C	97.9	Very high	96	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-77.6	-24.7	173.1	-65	0	0	0	0	113.4	I522 W523 L648 L649 F650	I522-C652 HydrophobicContact CG2-CB 4.07Å; W523-C652 WeakPolarHBondContact CA-O 3.39Å; L648-C652 PolarHBondContact O-N 3.17Å; L648-C652 PolarHBondContact O-SG 2.65Å; L649-C652 PolarHBondContact O-N 3.18Å; F650-C652 PolarHBondContact O-N 3.31Å
653	L	97.7	Very high	96.1	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	17%	0.167	C	C	.	.			trans	-109.8	18	-171.1	-66.5	176.6	0	0	0	113.6	W523 L538 F539 F555 L634 L649 F650 L655	W523-L653 HydrophobicContact CD2-CD2 3.92Å; W523-L653 HydrophobicContact CE3-CD2 3.9Å; W523-L653 HydrophobicContact CG-CD2 4.45Å; W523-L653 HydrophobicContact CH2-CD2 4.45Å; W523-L653 HydrophobicContact CZ2-CD2 4.47Å; W523-L653 HydrophobicContact CZ3-CB 4.35Å; W523-L653 HydrophobicContact CZ3-CD2 4.18Å; W523-L653 VanDerWaalsContact CZ3-O 3.31Å; W523-L653 WeakPolarHBondContact CZ3-O 3.4Å; L538-L653 HydrophobicContact CD2-CD1 3.48Å; L538-L653 VanDerWaalsContact CD2-CD1 3.48Å; L538-L653 HydrophobicContact CD2-CD2 4.29Å; F539-L653 HydrophobicContact CE2-CD2 4.47Å; F555-L653 HydrophobicContact CE2-CB 4.3Å; F555-L653 HydrophobicContact CZ-CB 4.31Å; F555-L653 HydrophobicContact CZ-CD1 4.35Å; L634-L653 HydrophobicContact CD1-CD1 4.38Å; L634-L653 HydrophobicContact CD2-CD1 4.08Å; L649-L653 HydrophobicContact CD1-CD1 3.57Å; L649-L653 HydrophobicContact CD1-CG 4.3Å; L649-L653 HydrophobicContact CG-CD1 4.01Å; L649-L653 WeakPolarHBondContact O-CB 3.27Å; L649-L653 VanDerWaalsContact O-CG 3.31Å; L649-L653 WeakPolarHBondContact O-CG 3.23Å; L649-L653 PolarHBondContact O-N 2.67Å; F650-L653 CarbonylContact O-C 3.56Å; F650-L653 PolarHBondContact O-N 3Å; L653-L655 PolarHBondContact O-N 2.83Å
654	A	96	Very high	96.1	Very high	7 Å²	7	29.5 Å²	29.5	6%	0.058	15%	0.151	C	C	.	.			trans	-55.8	133.6	166	0	0	0	0	0	110.2	F650 V656 R659 R660	F650-A654 PolarHBondContact O-N 2.98Å; A654-V656 PolarHBondContact O-N 2.9Å; A654-R659 HydrophobicContact CB-CB 3.87Å; A654-R659 WeakPolarHBondContact CB-O 3.31Å; A654-R660 HydrophobicContact CB-CG 3.91Å; A654-R660 WeakPolarHBondContact O-CG 3.35Å; A654-R660 PolarHBondContact O-NE 2.95Å; A654-R660 PolarHBondContact O-NH2 3.34Å
655	L	95.3	Very high	96.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.154	C	C	.	.	S	Bend	trans	-66.3	-36	-169.3	-70.8	169.9	0	0	0	112.6	P507 W523 I551 F552 F555 P558 Y562 W563 Y626 L653 R660	P507-L655 HydrophobicContact CG-CB 4.37Å; P507-L655 HydrophobicContact CG-CD2 3.71Å; P507-L655 WeakPolarHBondContact CG-O 3.47Å; W523-L655 HydrophobicContact CH2-CD2 4.21Å; W523-L655 HydrophobicContact CZ3-CD2 4.34Å; I551-L655 HydrophobicContact CG2-CD2 3.73Å; F552-L655 HydrophobicContact CE1-CD1 4.15Å; F552-L655 HydrophobicContact CE1-CD2 4.5Å; F555-L655 HydrophobicContact CD2-CD2 3.95Å; F555-L655 HydrophobicContact CD2-CG 4.45Å; P558-L655 HydrophobicContact CB-CD1 4.32Å; P558-L655 HydrophobicContact CG-CD1 4Å; Y562-L655 HydrophobicContact CE1-CB 3.98Å; Y562-L655 PolarHBondContact OH-N 2.86Å; W563-L655 HydrophobicContact CE3-CB 3.92Å; W563-L655 HydrophobicContact CZ3-CB 3.85Å; Y626-L655 HydrophobicContact CE1-CD1 4.18Å; Y626-L655 VanDerWaalsContact OH-CD1 3.25Å; Y626-L655 WeakPolarHBondContact OH-CD1 3.47Å; L653-L655 PolarHBondContact O-N 2.83Å; L655-R660 PolarHBondContact O-NH2 3.46Å
656	V	93.3	Very high	96.1	Very high	22 Å²	22	30.1 Å²	30.1	13%	0.133	15%	0.154	C	C	.	.	S	Bend	trans	-97.4	132	178.3	-166.9	0	0	0	0	110.1	Y562 W563 A654 N658 R659	Y562-V656 HydrophobicContact CD1-CG2 4.42Å; Y562-V656 HydrophobicContact CE1-CG2 4.11Å; W563-V656 HydrophobicContact CB-CG2 3.85Å; W563-V656 HydrophobicContact CD2-CG2 3.58Å; W563-V656 HydrophobicContact CE3-CG2 3.93Å; W563-V656 HydrophobicContact CG-CG2 3.56Å; A654-V656 PolarHBondContact O-N 2.9Å; V656-N658 VanDerWaalsContact C-N 3.33Å; V656-N658 WeakPolarHBondContact CG1-OD1 3.48Å; V656-N658 PolarHBondContact O-N 3.19Å; V656-R659 PolarHBondContact O-N 2.85Å
657	G	92.1	Very high	96.1	Very high	6 Å²	6	28.9 Å²	28.9	6%	0.062	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-53.4	-40.6	-174.5	0	0	0	0	0	115.5	D508 H519 R659 R660	D508-G657 WeakPolarHBondContact OD2-CA 3.41Å; D508-G657 PolarHBondContact OD2-N 2.79Å; H519-G657 VanDerWaalsContact CB-O 3.27Å; H519-G657 WeakPolarHBondContact CB-O 3.35Å; H519-G657 PolarHBondContact CD2-O 2.85Å; H519-G657 VanDerWaalsContact CD2-O 3.24Å; G657-R659 PolarHBondContact O-N 2.84Å; G657-R660 WeakPolarHBondContact O-CB 3.26Å; G657-R660 PolarHBondContact O-N 2.88Å; G657-R660 VanDerWaalsContact O-N 3.1Å
658	N	91	Very high	96	Very high	132 Å²	132	32.3 Å²	32.3	71%	0.706	16%	0.163	S	C	*	.	G	3₁₀ helix	trans	-69.3	-10.8	179.4	70.3	-18.9	0	0	0	114.6	V656	V656-N658 VanDerWaalsContact C-N 3.33Å; V656-N658 WeakPolarHBondContact CG1-OD1 3.48Å; V656-N658 PolarHBondContact O-N 3.19Å
659	R	93.7	Very high	95.9	Very high	102 Å²	102	33.5 Å²	33.5	39%	0.385	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-95.8	-3.7	172.9	-62.5	-175.4	-175.2	-90	6.8	113	S561 Y562 A654 V656 G657	S561-R659 PolarHBondContact O-NH2 2.81Å; Y562-R659 PolarHBondContact O-NE 3.1Å; Y562-R659 PolarHBondContact O-NH2 2.94Å; A654-R659 HydrophobicContact CB-CB 3.87Å; A654-R659 WeakPolarHBondContact CB-O 3.31Å; V656-R659 PolarHBondContact O-N 2.85Å; G657-R659 PolarHBondContact O-N 2.84Å
660	R	96.2	Very high	95.7	Very high	8 Å²	8	37.5 Å²	37.5	3%	0.03	19%	0.193	C	C	.	.	S	Bend	trans	-84.6	144.5	178.8	-61.7	178.7	-163.1	124.1	18.1	111.2	D508 H519 I522 E651 A654 L655 G657	D508-R660 VanDerWaalsContact CG-NH2 3.3Å; D508-R660 IonicContact OD1-NH1 3.44Å; D508-R660 IonicContact OD1-NH2 2.67Å; D508-R660 PolarHBondContact OD1-NH2 3.03Å; D508-R660 IonicContact OD2-CZ 2.93Å; D508-R660 VanDerWaalsContact OD2-CZ 3.31Å; D508-R660 IonicContact OD2-NH1 3.54Å; D508-R660 PolarHBondContact OD2-NH1 2.67Å; D508-R660 VanDerWaalsContact OD2-NH1 3.08Å; D508-R660 IonicContact OD2-NH2 2.71Å; D508-R660 PolarHBondContact OD2-NH2 3.27Å; H519-R660 HydrophobicContact CB-CB 4.38Å; H519-R660 WeakPolarHBondContact O-CD 3.4Å; H519-R660 PolarHBondContact O-NH1 2.85Å; I522-R660 HydrophobicContact CG2-CB 4.26Å; E651-R660 WeakPolarHBondContact O-CA 3.26Å; A654-R660 HydrophobicContact CB-CG 3.91Å; A654-R660 WeakPolarHBondContact O-CG 3.35Å; A654-R660 PolarHBondContact O-NE 2.95Å; A654-R660 PolarHBondContact O-NH2 3.34Å; L655-R660 PolarHBondContact O-NH2 3.46Å; G657-R660 WeakPolarHBondContact O-CB 3.26Å; G657-R660 PolarHBondContact O-N 2.88Å; G657-R660 VanDerWaalsContact O-N 3.1Å
661	I	97.5	Very high	95.6	Very high	28 Å²	28	36.6 Å²	36.6	14%	0.144	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-61.5	145.2	175.4	-169.6	160.9	0	0	0	112.5	I522 E651 D665 A666	I522-I661 WeakPolarHBondContact CG1-O 3.43Å; I522-I661 HydrophobicContact CG2-CG2 4.25Å; I522-I661 WeakPolarHBondContact CG2-O 3.39Å; E651-I661 HydrophobicContact CB-CB 4.07Å; E651-I661 HydrophobicContact CB-CG2 3.92Å; E651-I661 PolarHBondContact O-N 3.17Å; E651-I661 VanDerWaalsContact O-N 3.11Å; E651-I661 VanDerWaalsContact OE2-CD1 3.25Å; E651-I661 WeakPolarHBondContact OE2-CD1 3.42Å; I661-D665 HydrophobicContact CD1-CB 4.15Å; I661-D665 HydrophobicContact CG1-CB 3.83Å; I661-A666 HydrophobicContact CD1-CB 4.22Å; I661-A666 HydrophobicContact CG1-CB 4.24Å; I661-A666 HydrophobicContact CG2-CB 4.26Å
662	T	97.2	Very high	95.5	Very high	50 Å²	50	35 Å²	35	31%	0.307	18%	0.181	S	C	.	.	P	Polyproline II helix	trans	-77.4	158.5	174.8	86.8	0	0	0	0	111.3	T664 D665 A666	T662-T664 PolarHBondContact O-N 2.94Å; T662-T664 PolarHBondContact OG1-N 3.41Å; T662-D665 WeakPolarHBondContact CG2-OD2 3.28Å; T662-D665 PolarHBondContact O-N 2.82Å; T662-D665 PolarHBondContact OG1-N 2.73Å; T662-D665 PolarHBondContact OG1-OD2 3.41Å; T662-A666 VanDerWaalsContact O-CB 3.29Å; T662-A666 WeakPolarHBondContact O-CB 3.15Å; T662-A666 PolarHBondContact O-N 3.08Å
663	A	96.9	Very high	95	Very high	3 Å²	3	42.5 Å²	42.5	3%	0.025	21%	0.214	C	C	.	.	H	α-helix	trans	-60.5	-32.8	175.2	0	0	0	0	0	112.8	F448 L451 E452 I522 L667	F448-A663 HydrophobicContact CD1-CB 4.29Å; L451-A663 HydrophobicContact CB-CB 3.98Å; E452-A663 HydrophobicContact CB-CB 4.33Å; I522-A663 HydrophobicContact CD1-CB 4.02Å; A663-L667 WeakPolarHBondContact O-CG 3.48Å; A663-L667 PolarHBondContact O-N 2.97Å
664	T	95.5	Very high	94.3	Very high	50 Å²	50	45.7 Å²	45.7	31%	0.307	24%	0.235	S	C	.	.	H	α-helix	trans	-72.8	-36.3	178.2	-68.6	0	0	0	0	112.2	E452 T662 K668	E452-T664 WeakPolarHBondContact OE1-CA 3.47Å; E452-T664 VanDerWaalsContact OE1-CB 3.26Å; E452-T664 WeakPolarHBondContact OE1-CB 3.49Å; E452-T664 WeakPolarHBondContact OE1-CG2 3.31Å; E452-T664 PolarHBondContact OE1-OG1 2.79Å; T662-T664 PolarHBondContact O-N 2.94Å; T662-T664 PolarHBondContact OG1-N 3.41Å; T664-K668 WeakPolarHBondContact O-CE 3.46Å
665	D	96.3	Very high	93.8	Very high	65 Å²	65	45.8 Å²	45.8	35%	0.348	24%	0.235	S	C	.	.	H	α-helix	trans	-81.1	-35.2	178.7	-59.3	-54.3	0	0	0	111.7	I661 T662 L667 K668 H669	I661-D665 HydrophobicContact CD1-CB 4.15Å; I661-D665 HydrophobicContact CG1-CB 3.83Å; T662-D665 WeakPolarHBondContact CG2-OD2 3.28Å; T662-D665 PolarHBondContact O-N 2.82Å; T662-D665 PolarHBondContact OG1-N 2.73Å; T662-D665 PolarHBondContact OG1-OD2 3.41Å; D665-L667 PolarHBondContact O-N 2.76Å; D665-K668 WeakPolarHBondContact O-CA 3.36Å; D665-K668 WeakPolarHBondContact O-CB 3.35Å; D665-K668 PolarHBondContact O-N 2.77Å; D665-K668 IonicContact OD1-NZ 2.71Å; D665-K668 PolarHBondContact OD1-NZ 3.43Å; D665-H669 PolarHBondContact O-N 3.35Å
666	A	97.5	Very high	93.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-56.1	-39	171.8	0	0	0	0	0	111.7	F448 L648 I661 T662 K668 H669 F672	F448-A666 HydrophobicContact CD1-CB 3.72Å; F448-A666 HydrophobicContact CD2-CB 3.96Å; F448-A666 HydrophobicContact CE1-CB 3.66Å; F448-A666 HydrophobicContact CE2-CB 3.89Å; F448-A666 HydrophobicContact CG-CB 3.88Å; F448-A666 HydrophobicContact CZ-CB 3.74Å; L648-A666 HydrophobicContact CD1-CB 4.16Å; I661-A666 HydrophobicContact CD1-CB 4.22Å; I661-A666 HydrophobicContact CG1-CB 4.24Å; I661-A666 HydrophobicContact CG2-CB 4.26Å; T662-A666 VanDerWaalsContact O-CB 3.29Å; T662-A666 WeakPolarHBondContact O-CB 3.15Å; T662-A666 PolarHBondContact O-N 3.08Å; A666-K668 PolarHBondContact O-N 3.24Å; A666-H669 VanDerWaalsContact O-CB 3.23Å; A666-H669 WeakPolarHBondContact O-CB 3.3Å; A666-H669 PolarHBondContact O-N 2.77Å; A666-H669 VanDerWaalsContact O-N 3.09Å; A666-F672 WeakPolarHBondContact O-CD2 3.5Å; A666-F672 WeakPolarHBondContact O-CE2 3.4Å
667	L	95.7	Very high	92.8	Very high	11 Å²	11	46.8 Å²	46.8	6%	0.058	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-19.7	175	-74.7	168.6	0	0	0	114.5	F445 F448 R449 E452 A663 D665 V682	F445-L667 HydrophobicContact CD1-CD2 4.19Å; F445-L667 HydrophobicContact CD2-CD2 3.91Å; F445-L667 HydrophobicContact CE1-CD2 4.09Å; F445-L667 HydrophobicContact CE2-CD2 3.8Å; F445-L667 HydrophobicContact CG-CD2 4.14Å; F445-L667 HydrophobicContact CZ-CD2 3.92Å; F448-L667 HydrophobicContact CB-CD2 3.91Å; F448-L667 HydrophobicContact CB-CG 3.97Å; R449-L667 HydrophobicContact CB-CD2 4.13Å; E452-L667 HydrophobicContact CB-CD1 4.06Å; A663-L667 WeakPolarHBondContact O-CG 3.48Å; A663-L667 PolarHBondContact O-N 2.97Å; D665-L667 PolarHBondContact O-N 2.76Å; L667-V682 HydrophobicContact CB-CG1 4.29Å; L667-V682 HydrophobicContact CD1-CG1 4.36Å
668	K	94.2	Very high	92.2	Very high	127 Å²	127	51.9 Å²	51.9	55%	0.552	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-12.6	176.4	-53	166	-164.2	164.4	0	112.4	T664 D665 A666	T664-K668 WeakPolarHBondContact O-CE 3.46Å; D665-K668 WeakPolarHBondContact O-CA 3.36Å; D665-K668 WeakPolarHBondContact O-CB 3.35Å; D665-K668 PolarHBondContact O-N 2.77Å; D665-K668 IonicContact OD1-NZ 2.71Å; D665-K668 PolarHBondContact OD1-NZ 3.43Å; A666-K668 PolarHBondContact O-N 3.24Å
669	H	96.3	Very high	91.5	Very high	26 Å²	26	49.8 Å²	49.8	12%	0.12	28%	0.282	C	S	.	.	S	Bend	trans	-61.7	143.9	-171.9	-170.5	-86.5	0	0	0	112.6	D644 L648 E651 D665 A666 Y671 F672	D644-H669 PolarHBondContact O-CE1 3.28Å; L648-H669 HydrophobicContact CD1-CB 4.07Å; E651-H669 IonicContact OE1-NE2 2.81Å; E651-H669 IonicContact OE2-CD2 2.79Å; E651-H669 PolarHBondContact OE2-CD2 3.49Å; E651-H669 VanDerWaalsContact OE2-CD2 3.28Å; E651-H669 IonicContact OE2-NE2 2.73Å; D665-H669 PolarHBondContact O-N 3.35Å; A666-H669 VanDerWaalsContact O-CB 3.23Å; A666-H669 WeakPolarHBondContact O-CB 3.3Å; A666-H669 PolarHBondContact O-N 2.77Å; A666-H669 VanDerWaalsContact O-N 3.09Å; H669-Y671 WeakPolarHBondContact ND1-CB 3.35Å; H669-Y671 PolarHBondContact ND1-N 3.32Å; H669-Y671 PolarHBondContact O-N 2.88Å; H669-F672 PolarHBondContact O-N 3.46Å
670	V	94.7	Very high	91	Very high	83 Å²	83	46.3 Å²	46.3	50%	0.503	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-55.8	-32.5	-171.3	-175.6	0	0	0	0	113	D644 F672 K673	D644-V670 HydrophobicContact CB-CB 4.46Å; V670-F672 PolarHBondContact O-N 3.24Å; V670-K673 WeakPolarHBondContact O-CB 3.42Å; V670-K673 PolarHBondContact O-N 3.05Å
671	Y	95.7	Very high	90.4	Very high	4 Å²	4	49.8 Å²	49.8	2%	0.016	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-53	-23.5	174.4	-179	-115.8	0	0	0	114.7	R441 L641 N642 D644 L648 H669	R441-Y671 HydrophobicContact CB-CE1 4.08Å; R441-Y671 WeakPolarHBondContact CD-O 3.36Å; R441-Y671 HydrophobicContact CG-CD1 4.45Å; R441-Y671 HydrophobicContact CG-CE1 3.92Å; R441-Y671 PolarHBondContact NE-O 3Å; L641-Y671 HydrophobicContact CD2-CE2 3.97Å; L641-Y671 WeakPolarHBondContact CD2-OH 3.25Å; N642-Y671 WeakPolarHBondContact OD1-CD2 3.29Å; N642-Y671 WeakPolarHBondContact OD1-CE2 3.46Å; D644-Y671 HydrophobicContact CB-CD2 4.27Å; D644-Y671 HydrophobicContact CB-CG 4.47Å; L648-Y671 HydrophobicContact CD2-CD1 3.61Å; L648-Y671 HydrophobicContact CD2-CE1 4.38Å; L648-Y671 HydrophobicContact CD2-CG 4.29Å; H669-Y671 WeakPolarHBondContact ND1-CB 3.35Å; H669-Y671 PolarHBondContact ND1-N 3.32Å; H669-Y671 PolarHBondContact O-N 2.88Å
672	F	94.7	Very high	89.8	Confident	10 Å²	10	49 Å²	49	4%	0.044	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-99.8	3.4	-179.2	-62.5	-33.6	0	0	0	114.4	R441 T444 F445 F448 L648 A666 H669 V670 C674 I675	R441-F672 HydrophobicContact CG-CD1 4.16Å; R441-F672 HydrophobicContact CG-CE1 4.49Å; T444-F672 HydrophobicContact CG2-CE1 4.39Å; T444-F672 HydrophobicContact CG2-CZ 3.98Å; F445-F672 HydrophobicContact CB-CD1 4.22Å; F445-F672 HydrophobicContact CB-CE1 3.99Å; F445-F672 HydrophobicContact CB-CZ 4.2Å; F445-F672 HydrophobicContact CD2-CB 3.77Å; F445-F672 HydrophobicContact CD2-CD1 4.02Å; F445-F672 AromaticContact CD2-CD2 3.65Å; F445-F672 HydrophobicContact CD2-CD2 3.65Å; F445-F672 HydrophobicContact CD2-CE1 4.44Å; F445-F672 HydrophobicContact CD2-CE2 4.15Å; F445-F672 AromaticContact CD2-CG 3.57Å; F445-F672 HydrophobicContact CD2-CG 3.57Å; F445-F672 HydrophobicContact CE2-CB 4.07Å; F445-F672 HydrophobicContact CE2-CD2 4.3Å; F445-F672 HydrophobicContact CE2-CG 4.3Å; F448-F672 AromaticContact CD2-CE2 3.74Å; F448-F672 HydrophobicContact CD2-CE2 3.74Å; F448-F672 AromaticContact CD2-CZ 3.71Å; F448-F672 HydrophobicContact CD2-CZ 3.71Å; F448-F672 HydrophobicContact CE2-CE2 4.14Å; F448-F672 AromaticContact CE2-CZ 3.95Å; F448-F672 HydrophobicContact CE2-CZ 3.95Å; L648-F672 HydrophobicContact CD2-CE1 4.13Å; L648-F672 HydrophobicContact CD2-CE2 3.93Å; L648-F672 HydrophobicContact CD2-CZ 3.63Å; A666-F672 WeakPolarHBondContact O-CD2 3.5Å; A666-F672 WeakPolarHBondContact O-CE2 3.4Å; H669-F672 PolarHBondContact O-N 3.46Å; V670-F672 PolarHBondContact O-N 3.24Å; F672-C674 PolarHBondContact O-N 3.13Å; F672-I675 HydrophobicContact CB-CD1 3.75Å; F672-I675 HydrophobicContact CD1-CD1 3.5Å; F672-I675 VanDerWaalsContact CD1-CD1 3.5Å; F672-I675 HydrophobicContact CE1-CD1 4.37Å; F672-I675 HydrophobicContact CG-CD1 3.93Å; F672-I675 WeakPolarHBondContact O-CG1 3.16Å; F672-I675 PolarHBondContact O-N 3.2Å
673	K	88.2	Confident	89.2	Confident	158 Å²	158	50.5 Å²	50.5	69%	0.687	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	136.8	171	-169.5	174.4	-178.8	179.5	0	110.3	V670 I675	V670-K673 WeakPolarHBondContact O-CB 3.42Å; V670-K673 PolarHBondContact O-N 3.05Å; K673-I675 VanDerWaalsContact C-N 3.29Å; K673-I675 PolarHBondContact O-N 2.72Å
674	C	81.6	Confident	88.6	Confident	67 Å²	67	54.4 Å²	54.4	45%	0.453	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	15.3	-178	-55.8	0	0	0	0	117.1	F672	F672-C674 PolarHBondContact O-N 3.13Å
675	I	87	Confident	88.2	Confident	10 Å²	10	52.6 Å²	52.6	5%	0.051	30%	0.299	C	S	.	.	S	Bend	trans	-70.5	-44.7	165.6	-66.7	177.4	0	0	0	110.9	R441 F445 F672 K673 A695	R441-I675 HydrophobicContact CG-CD1 3.58Å; R441-I675 HydrophobicContact CG-CG1 4.09Å; F445-I675 HydrophobicContact CB-CD1 3.9Å; F445-I675 HydrophobicContact CD2-CD1 3.73Å; F445-I675 HydrophobicContact CE2-CD1 4.48Å; F445-I675 HydrophobicContact CG-CD1 4Å; F445-I675 HydrophobicContact CG-CG2 4.45Å; F672-I675 HydrophobicContact CB-CD1 3.75Å; F672-I675 HydrophobicContact CD1-CD1 3.5Å; F672-I675 VanDerWaalsContact CD1-CD1 3.5Å; F672-I675 HydrophobicContact CE1-CD1 4.37Å; F672-I675 HydrophobicContact CG-CD1 3.93Å; F672-I675 WeakPolarHBondContact O-CG1 3.16Å; F672-I675 PolarHBondContact O-N 3.2Å; K673-I675 VanDerWaalsContact C-N 3.29Å; K673-I675 PolarHBondContact O-N 2.72Å; I675-A695 HydrophobicContact CG2-CB 4.3Å; I675-A695 WeakPolarHBondContact O-CA 3.3Å
676	L	86.2	Confident	87.8	Confident	20 Å²	20	52 Å²	52	11%	0.105	30%	0.295	C	S	.	.	S	Bend	trans	-97.7	146.8	174.5	-62.5	179.9	0	0	0	109.8	F445 V682 L685 I691 L694	F445-L676 HydrophobicContact CZ-CD1 4.03Å; F445-L676 HydrophobicContact CZ-CG 4.29Å; L676-V682 HydrophobicContact CD1-CB 3.84Å; L676-V682 HydrophobicContact CD1-CG2 4.32Å; L676-L685 HydrophobicContact CD1-CD1 4.18Å; L676-L685 HydrophobicContact CD2-CD1 4.26Å; L676-I691 HydrophobicContact CD2-CB 4.22Å; L676-I691 HydrophobicContact CD2-CG2 4.17Å; L676-L694 HydrophobicContact CD2-CB 4.38Å; L676-L694 HydrophobicContact CD2-CD1 4.25Å
677	P	80.3	Confident	87.4	Confident	23 Å²	23	54.6 Å²	54.6	15%	0.149	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-54.1	144.2	174.4	-26.2	32.7	0	0	0	113.5	G679 I680 Q698	P677-G679 PolarHBondContact O-N 2.74Å; P677-I680 HydrophobicContact CB-CD1 3.83Å; P677-I680 HydrophobicContact CB-CG1 4.23Å; P677-I680 HydrophobicContact CG-CD1 3.91Å; P677-I680 WeakPolarHBondContact O-CB 3.33Å; P677-I680 PolarHBondContact O-N 2.82Å; P677-Q698 HydrophobicContact CG-CG 4.04Å
678	P	79.4	Confident	87.2	Confident	113 Å²	113	59.4 Å²	59.4	73%	0.734	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	134.8	175.2	-29.2	35.6	0	0	0	112.5	I680	P678-I680 VanDerWaalsContact C-N 3.33Å
679	G	77.5	Confident	87	Confident	87 Å²	87	56.3 Å²	56.3	90%	0.897	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	-1.5	-175	0	0	0	0	0	115.5	P677	P677-G679 PolarHBondContact O-N 2.74Å
680	I	81.9	Confident	86.7	Confident	30 Å²	30	57 Å²	57	15%	0.154	33%	0.329	C	S	.	.			trans	-104.7	105.1	173.5	-52.7	-174.1	0	0	0	110	P677 P678 L685	P677-I680 HydrophobicContact CB-CD1 3.83Å; P677-I680 HydrophobicContact CB-CG1 4.23Å; P677-I680 HydrophobicContact CG-CD1 3.91Å; P677-I680 WeakPolarHBondContact O-CB 3.33Å; P677-I680 PolarHBondContact O-N 2.82Å; P678-I680 VanDerWaalsContact C-N 3.33Å; I680-L685 HydrophobicContact CG2-CD2 3.8Å; I680-L685 HydrophobicContact CG2-CG 4.33Å
681	N	83.9	Confident	86.5	Confident	80 Å²	80	53 Å²	53	43%	0.428	31%	0.305	S	S	.	.			trans	-76.3	147.5	168.3	-169.3	-64.7	0	0	0	110.5	H683 D684	N681-H683 VanDerWaalsContact C-N 3.34Å; N681-H683 PolarHBondContact O-N 2.95Å; N681-H683 PolarHBondContact OD1-CD2 3.03Å; N681-H683 PolarHBondContact OD1-N 2.82Å; N681-D684 HydrophobicContact CB-CB 4.25Å; N681-D684 WeakPolarHBondContact O-CB 3.24Å; N681-D684 PolarHBondContact O-N 2.88Å
682	V	84.7	Confident	86.1	Confident	13 Å²	13	53 Å²	53	8%	0.079	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-63.4	-37.5	177.8	68	0	0	0	0	112.7	F445 R449 L667 L676 D684 L685	F445-V682 HydrophobicContact CE1-CG2 3.74Å; F445-V682 HydrophobicContact CZ-CB 3.89Å; F445-V682 HydrophobicContact CZ-CG2 3.61Å; R449-V682 HydrophobicContact CG-CG2 4.08Å; L667-V682 HydrophobicContact CB-CG1 4.29Å; L667-V682 HydrophobicContact CD1-CG1 4.36Å; L676-V682 HydrophobicContact CD1-CB 3.84Å; L676-V682 HydrophobicContact CD1-CG2 4.32Å; V682-D684 PolarHBondContact O-N 3.19Å; V682-L685 WeakPolarHBondContact O-CB 3.29Å; V682-L685 PolarHBondContact O-N 2.91Å; V682-L685 VanDerWaalsContact O-N 3.14Å
683	H	84.5	Confident	85.2	Confident	80 Å²	80	55.3 Å²	55.3	37%	0.37	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-75.6	-13.3	178.7	-38.9	-67.2	0	0	0	112.1	E452 N681 L685	E452-H683 IonicContact OE1-CE1 3.95Å; E452-H683 PolarHBondContact OE1-CE1 3.44Å; E452-H683 IonicContact OE1-ND1 2.67Å; E452-H683 PolarHBondContact OE1-ND1 2.98Å; E452-H683 IonicContact OE2-CE1 3.44Å; E452-H683 PolarHBondContact OE2-CE1 3.27Å; E452-H683 IonicContact OE2-ND1 2.65Å; E452-H683 PolarHBondContact OE2-ND1 3.11Å; N681-H683 VanDerWaalsContact C-N 3.34Å; N681-H683 PolarHBondContact O-N 2.95Å; N681-H683 PolarHBondContact OD1-CD2 3.03Å; N681-H683 PolarHBondContact OD1-N 2.82Å; H683-L685 VanDerWaalsContact C-N 3.3Å
684	D	85.1	Confident	84.9	Confident	85 Å²	85	48.6 Å²	48.6	46%	0.455	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-79.2	-10	169.1	-94.7	-48.3	0	0	0	113.2	N681 V682 R973	N681-D684 HydrophobicContact CB-CB 4.25Å; N681-D684 WeakPolarHBondContact O-CB 3.24Å; N681-D684 PolarHBondContact O-N 2.88Å; V682-D684 PolarHBondContact O-N 3.19Å; D684-R973 VanDerWaalsContact C-NH2 3.34Å; D684-R973 VanDerWaalsContact O-CZ 3.22Å; D684-R973 PolarHBondContact O-NH1 3.21Å; D684-R973 PolarHBondContact O-NH2 2.85Å; D684-R973 IonicContact OD1-NH1 2.66Å
685	L	86.3	Confident	84.7	Confident	13 Å²	13	45.6 Å²	45.6	7%	0.068	27%	0.27	C	S	.	.	S	Bend	trans	-78.6	155.7	172.5	-58.9	177	0	0	0	111.1	L676 I680 V682 H683 I691 L694 R973	L676-L685 HydrophobicContact CD1-CD1 4.18Å; L676-L685 HydrophobicContact CD2-CD1 4.26Å; I680-L685 HydrophobicContact CG2-CD2 3.8Å; I680-L685 HydrophobicContact CG2-CG 4.33Å; V682-L685 WeakPolarHBondContact O-CB 3.29Å; V682-L685 PolarHBondContact O-N 2.91Å; V682-L685 VanDerWaalsContact O-N 3.14Å; H683-L685 VanDerWaalsContact C-N 3.3Å; L685-I691 HydrophobicContact CD1-CG2 3.55Å; L685-L694 HydrophobicContact CD1-CD1 4.38Å; L685-L694 HydrophobicContact CD2-CD1 4.1Å; L685-R973 PolarHBondContact O-NH2 2.76Å
686	L	88.1	Confident	83.9	Confident	53 Å²	53	47.2 Å²	47.2	28%	0.277	28%	0.278	S	S	.	.			trans	-74.6	143.2	167.1	-65.6	172.1	0	0	0	108.9	R449 E688 Q689	R449-L686 PolarHBondContact NH2-O 3.4Å; L686-E688 PolarHBondContact O-N 3.03Å; L686-Q689 HydrophobicContact CB-CG 4.03Å; L686-Q689 WeakPolarHBondContact O-CB 3.42Å; L686-Q689 PolarHBondContact O-N 2.67Å
687	P	90.3	Very high	82.7	Confident	54 Å²	54	48.7 Å²	48.7	35%	0.351	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.5	-38.8	173.1	-34.5	38.8	0	0	0	113.7	N396 H397 A398 Y453 Q689	N396-P687 WeakPolarHBondContact O-CB 3.43Å; H397-P687 CarbonylContact C-O 3.57Å; H397-P687 WeakPolarHBondContact CA-O 3.47Å; H397-P687 PolarHBondContact CD2-O 2.76Å; A398-P687 PolarHBondContact N-O 3.25Å; Y453-P687 HydrophobicContact CD2-CB 4.12Å; Y453-P687 HydrophobicContact CD2-CG 4.3Å; Y453-P687 HydrophobicContact CE2-CB 3.71Å; Y453-P687 HydrophobicContact CE2-CG 3.91Å; P687-Q689 VanDerWaalsContact C-N 3.35Å; P687-Q689 PolarHBondContact O-N 2.54Å
688	E	90	Very high	81.9	Confident	111 Å²	111	48.1 Å²	48.1	52%	0.519	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-4.6	-175	-56.3	-177.1	-128.5	0	0	114.4	N396 L686	N396-E688 PolarHBondContact ND2-OE1 3.22Å; N396-E688 PolarHBondContact ND2-OE2 2.98Å; L686-E688 PolarHBondContact O-N 3.03Å
689	Q	89.7	Confident	80.7	Confident	63 Å²	63	45.2 Å²	45.2	29%	0.294	26%	0.258	S	S	.	.			trans	-81.8	129.1	179.7	-78.7	169.4	-30.3	0	0	112	A398 R449 L686 P687	A398-Q689 WeakPolarHBondContact CB-O 3.32Å; R449-Q689 PolarHBondContact NH1-O 3Å; R449-Q689 PolarHBondContact NH2-O 2.83Å; L686-Q689 HydrophobicContact CB-CG 4.03Å; L686-Q689 WeakPolarHBondContact O-CB 3.42Å; L686-Q689 PolarHBondContact O-N 2.67Å; P687-Q689 VanDerWaalsContact C-N 3.35Å; P687-Q689 PolarHBondContact O-N 2.54Å
690	S	90.4	Very high	79.3	Confident	40 Å²	40	44.2 Å²	44.2	28%	0.28	24%	0.237	S	C	.	.			trans	-62.1	141.6	161.5	163.7	0	0	0	0	110.1	D476 T692	D476-S690 VanDerWaalsContact OD1-CB 3.24Å; D476-S690 WeakPolarHBondContact OD1-CB 3.29Å; D476-S690 PolarHBondContact OD1-OG 3.43Å; S690-T692 PolarHBondContact OG-N 3.41Å
691	I	90.9	Very high	77.5	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.242	C	C	.	.			trans	-101.8	-13.2	171	63.7	172.8	0	0	0	112.9	L442 F445 Q446 L676 L685 L693 L694 A695	L442-I691 HydrophobicContact CD1-CD1 4.12Å; L442-I691 HydrophobicContact CD1-CG1 4.25Å; F445-I691 HydrophobicContact CD1-CD1 3.26Å; F445-I691 HydrophobicContact CE1-CD1 3.51Å; F445-I691 HydrophobicContact CG-CD1 4.41Å; Q446-I691 HydrophobicContact CG-CD1 3.67Å; Q446-I691 HydrophobicContact CG-CG1 3.94Å; L676-I691 HydrophobicContact CD2-CB 4.22Å; L676-I691 HydrophobicContact CD2-CG2 4.17Å; L685-I691 HydrophobicContact CD1-CG2 3.55Å; I691-L693 VanDerWaalsContact C-N 3.29Å; I691-L693 PolarHBondContact O-N 3.02Å; I691-L694 WeakPolarHBondContact O-CB 3.47Å; I691-L694 PolarHBondContact O-N 3.41Å; I691-A695 PolarHBondContact O-N 3.2Å
692	T	87.7	Confident	75.3	Confident	4 Å²	4	45.8 Å²	45.8	3%	0.025	25%	0.245	C	C	.	.	H	α-helix	trans	-59.5	-40.6	-170.5	-56.6	0	0	0	0	111.6	L442 T474 G475 D476 S690 A695 I696	L442-T692 HydrophobicContact CD2-CG2 4.22Å; T474-T692 VanDerWaalsContact O-CG2 3.29Å; T474-T692 WeakPolarHBondContact O-CG2 3.44Å; G475-T692 PolarHBondContact O-OG1 2.99Å; D476-T692 WeakPolarHBondContact OD1-CB 3.34Å; D476-T692 PolarHBondContact OD1-OG1 2.97Å; S690-T692 PolarHBondContact OG-N 3.41Å; T692-A695 PolarHBondContact O-N 2.88Å; T692-I696 HydrophobicContact CG2-CD1 4Å; T692-I696 WeakPolarHBondContact O-CD1 3.39Å; T692-I696 VanDerWaalsContact O-CG1 3.23Å; T692-I696 WeakPolarHBondContact O-CG1 3.31Å; T692-I696 PolarHBondContact O-N 3.41Å
693	L	75.9	Confident	72.7	Confident	58 Å²	58	51.4 Å²	51.4	30%	0.304	27%	0.269	S	S	.	.	H	α-helix	trans	-61.9	-43.5	172.6	-73.3	172.6	0	0	0	113.3	I691 A695 I696 E697 I906 M911	I691-L693 VanDerWaalsContact C-N 3.29Å; I691-L693 PolarHBondContact O-N 3.02Å; L693-A695 VanDerWaalsContact C-N 3.3Å; L693-A695 PolarHBondContact O-N 3.11Å; L693-I696 PolarHBondContact O-N 3.07Å; L693-E697 PolarHBondContact O-N 3.31Å; L693-E697 VanDerWaalsContact O-N 3.13Å; L693-I906 HydrophobicContact CD1-CD1 3.79Å; L693-M911 HydrophobicContact CD1-CE 4.04Å; L693-M911 HydrophobicContact CD1-SD 3.86Å; L693-M911 HydrophobicContact CD2-CE 3.89Å; L693-M911 HydrophobicContact CD2-SD 4.07Å; L693-M911 HydrophobicContact CG-CE 4.14Å; L693-M911 HydrophobicContact CG-SD 4.44Å
694	L	80.7	Confident	70.2	Confident	17 Å²	17	51.2 Å²	51.2	9%	0.089	28%	0.276	C	S	.	.	H	α-helix	trans	-64	-37.2	-180	-58.9	176	0	0	0	111.4	L676 L685 I691 Q698 L962	L676-L694 HydrophobicContact CD2-CB 4.38Å; L676-L694 HydrophobicContact CD2-CD1 4.25Å; L685-L694 HydrophobicContact CD1-CD1 4.38Å; L685-L694 HydrophobicContact CD2-CD1 4.1Å; I691-L694 WeakPolarHBondContact O-CB 3.47Å; I691-L694 PolarHBondContact O-N 3.41Å; L694-Q698 PolarHBondContact O-N 3.26Å; L694-L962 HydrophobicContact CD2-CD1 4.02Å
695	A	78.3	Confident	67.5	Low	4 Å²	4	54.3 Å²	54.3	3%	0.033	29%	0.288	C	S	.	.	H	α-helix	trans	-72.4	-34.2	176.3	0	0	0	0	0	113	L442 I675 I691 T692 L693 Q698 N699	L442-A695 HydrophobicContact CD1-CB 3.88Å; I675-A695 HydrophobicContact CG2-CB 4.3Å; I675-A695 WeakPolarHBondContact O-CA 3.3Å; I691-A695 PolarHBondContact O-N 3.2Å; T692-A695 PolarHBondContact O-N 2.88Å; L693-A695 VanDerWaalsContact C-N 3.3Å; L693-A695 PolarHBondContact O-N 3.11Å; A695-Q698 PolarHBondContact O-N 2.93Å; A695-N699 PolarHBondContact O-N 3.2Å; A695-N699 PolarHBondContact O-ND2 2.83Å
696	I	69.9	Low	64.7	Low	43 Å²	43	59.4 Å²	59.4	22%	0.221	32%	0.322	C	S	.	.	H	α-helix	trans	-65.2	-41.6	174.8	-68.6	158.6	0	0	0	110.7	T692 L693 Q698 S700 L748	T692-I696 HydrophobicContact CG2-CD1 4Å; T692-I696 WeakPolarHBondContact O-CD1 3.39Å; T692-I696 VanDerWaalsContact O-CG1 3.23Å; T692-I696 WeakPolarHBondContact O-CG1 3.31Å; T692-I696 PolarHBondContact O-N 3.41Å; L693-I696 PolarHBondContact O-N 3.07Å; I696-Q698 PolarHBondContact O-N 3.39Å; I696-S700 PolarHBondContact O-N 2.6Å; I696-S700 PolarHBondContact O-OG 2.88Å; I696-L748 HydrophobicContact CD1-CD1 3.5Å; I696-L748 HydrophobicContact CG1-CD1 3.99Å
697	E	62.2	Low	61.9	Low	51 Å²	51	62 Å²	62	24%	0.238	34%	0.344	C	S	.	.	H	α-helix	trans	-61.4	-41	175.2	-71.6	-176.6	-164.3	0	0	112	L693 S700 I701 V958	L693-E697 PolarHBondContact O-N 3.31Å; L693-E697 VanDerWaalsContact O-N 3.13Å; E697-S700 PolarHBondContact O-N 3.43Å; E697-I701 WeakPolarHBondContact O-CD1 3.36Å; E697-I701 VanDerWaalsContact O-CG1 3.3Å; E697-I701 WeakPolarHBondContact O-CG1 3.42Å; E697-I701 PolarHBondContact O-N 3.3Å; E697-V958 WeakPolarHBondContact OE1-CG1 3.49Å
698	Q	61.6	Low	58.9	Low	11 Å²	11	69.8 Å²	69.8	5%	0.051	37%	0.367	C	S	.	.	H	α-helix	trans	-61.1	-51.5	176.5	-78.7	-66.7	-86.6	0	0	113.4	P677 L694 A695 I696 S700 I701 N702	P677-Q698 HydrophobicContact CG-CG 4.04Å; L694-Q698 PolarHBondContact O-N 3.26Å; A695-Q698 PolarHBondContact O-N 2.93Å; I696-Q698 PolarHBondContact O-N 3.39Å; Q698-S700 PolarHBondContact O-N 3.04Å; Q698-I701 PolarHBondContact O-N 3.38Å; Q698-I701 VanDerWaalsContact O-N 3.11Å; Q698-N702 PolarHBondContact O-N 3.22Å; Q698-N702 VanDerWaalsContact O-N 3.17Å
699	N	55.7	Low	56	Low	53 Å²	53	71.1 Å²	71.1	28%	0.283	38%	0.376	S	S	.	.	H	α-helix	trans	-62.3	-27.7	-179.2	-69.5	-66.8	0	0	0	112.4	A695 N741 L744	A695-N699 PolarHBondContact O-N 3.2Å; A695-N699 PolarHBondContact O-ND2 2.83Å; N699-N741 PolarHBondContact O-ND2 3.33Å; N699-N741 PolarHBondContact O-OD1 2.8Å; N699-L744 HydrophobicContact CB-CD1 3.84Å
700	S	47.9	Very low	53.1	Low	65 Å²	65	75.9 Å²	75.9	46%	0.455	40%	0.398	S	S	.	.	H	α-helix	trans	-74.3	-34.7	176.2	-54.2	0	0	0	0	113.1	I696 E697 Q698	I696-S700 PolarHBondContact O-N 2.6Å; I696-S700 PolarHBondContact O-OG 2.88Å; E697-S700 PolarHBondContact O-N 3.43Å; Q698-S700 PolarHBondContact O-N 3.04Å
701	I	43.8	Very low	50	Low	52 Å²	52	79 Å²	79	27%	0.267	42%	0.415	S	S	.	.	H	α-helix	trans	-79.9	-36.8	-176.7	-68.8	164.1	0	0	0	111.9	E697 Q698 F703 S704	E697-I701 WeakPolarHBondContact O-CD1 3.36Å; E697-I701 VanDerWaalsContact O-CG1 3.3Å; E697-I701 WeakPolarHBondContact O-CG1 3.42Å; E697-I701 PolarHBondContact O-N 3.3Å; Q698-I701 PolarHBondContact O-N 3.38Å; Q698-I701 VanDerWaalsContact O-N 3.11Å; I701-F703 PolarHBondContact O-N 2.97Å; I701-F703 VanDerWaalsContact O-N 3.11Å; I701-S704 PolarHBondContact O-N 3.18Å; I701-S704 VanDerWaalsContact O-N 3.1Å; I701-S704 PolarHBondContact O-OG 3.34Å; I701-S704 VanDerWaalsContact O-OG 3.11Å
702	N	36.8	Very low	47.1	Very low	91 Å²	91	85.3 Å²	85.3	49%	0.487	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-7.6	-174.7	-66.2	-13.4	0	0	0	114.2	Q698	Q698-N702 PolarHBondContact O-N 3.22Å; Q698-N702 VanDerWaalsContact O-N 3.17Å
703	F	31.6	Very low	44.2	Very low	131 Å²	131	91.6 Å²	91.6	58%	0.575	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-3.1	173.7	-90	-87.6	0	0	0	114.1	I701 N741	I701-F703 PolarHBondContact O-N 2.97Å; I701-F703 VanDerWaalsContact O-N 3.11Å; F703-N741 WeakPolarHBondContact CD2-ND2 3.45Å
704	S	31.3	Very low	42.1	Very low	76 Å²	76	95.6 Å²	95.6	53%	0.531	52%	0.515	S	S	.	.	S	Bend	trans	-111	28.1	-175.9	68.9	0	0	0	0	113.6	I701	I701-S704 PolarHBondContact O-N 3.18Å; I701-S704 VanDerWaalsContact O-N 3.1Å; I701-S704 PolarHBondContact O-OG 3.34Å; I701-S704 VanDerWaalsContact O-OG 3.11Å
705	Q	28.5	Very low	39.6	Very low	151 Å²	151	100.9 Å²	100.9	71%	0.706	55%	0.547	S	S	*	.			trans	-131.8	111	175.7	-69.7	-63.6	-47.7	0	0	109.3	S707	Q705-S707 PolarHBondContact O-N 3.01Å
706	P	26.8	Very low	37.4	Very low	119 Å²	119	107 Å²	107	77%	0.773	58%	0.584	S	S	*	*			trans	-70.8	122.4	170.5	29.4	-31.8	0	0	0	108.8	R708	P706-R708 PolarHBondContact O-N 2.92Å
707	S	29.7	Very low	35.5	Very low	107 Å²	107	110.8 Å²	110.8	75%	0.748	61%	0.61	S	S	*	*			trans	-65.9	104.1	176.6	49.8	0	0	0	0	110.4	Q705 I709	Q705-S707 PolarHBondContact O-N 3.01Å; S707-I709 PolarHBondContact O-N 3.23Å
708	R	26.5	Very low	34	Very low	218 Å²	218	113.2 Å²	113.2	82%	0.823	63%	0.632	S	S	*	*			trans	-62	103.4	166.9	-88.2	-173.4	171.4	178.1	-3	109.2	P706 H710	P706-R708 PolarHBondContact O-N 2.92Å; R708-H710 PolarHBondContact O-N 3.09Å
709	I	30.2	Very low	32.6	Very low	140 Å²	140	121.5 Å²	121.5	72%	0.718	67%	0.668	S	S	*	*			trans	-69.2	115.2	165.7	-57.9	175	0	0	0	106.7	S707 T711	S707-I709 PolarHBondContact O-N 3.23Å; I709-T711 HydrophobicContact CG2-CG2 4.08Å; I709-T711 PolarHBondContact O-N 3.38Å
710	H	28	Very low	31.4	Very low	163 Å²	163	125.9 Å²	125.9	76%	0.755	69%	0.691	S	S	*	*			trans	-82.7	86	171.5	-86.9	-93.5	0	0	0	109.4	R708 T712	R708-H710 PolarHBondContact O-N 3.09Å; H710-T712 PolarHBondContact O-N 3.26Å
711	T	26.6	Very low	30.7	Very low	104 Å²	104	130.8 Å²	130.8	64%	0.638	71%	0.713	S	S	*	*			trans	-73.8	111.7	164.9	46	0	0	0	0	109.6	I709 N713	I709-T711 HydrophobicContact CG2-CG2 4.08Å; I709-T711 PolarHBondContact O-N 3.38Å; T711-N713 PolarHBondContact O-N 3.44Å
712	T	29.1	Very low	29.9	Very low	133 Å²	133	131.8 Å²	131.8	82%	0.816	74%	0.735	S	S	*	*			trans	-78.8	95.2	172.4	47.1	0	0	0	0	110	H710 T714	H710-T712 PolarHBondContact O-N 3.26Å; T712-T714 PolarHBondContact O-N 3.45Å
713	N	27.6	Very low	29.7	Very low	136 Å²	136	137.8 Å²	137.8	73%	0.727	76%	0.757	S	S	*	*			trans	-75.6	110.8	175.6	-67.2	-3.1	0	0	0	110.6	T711	T711-N713 PolarHBondContact O-N 3.44Å
714	T	31.5	Very low	29.4	Very low	143 Å²	143	140.9 Å²	140.9	88%	0.877	77%	0.771	S	S	*	*			trans	-79.9	132.1	158.9	43.1	0	0	0	0	109.5	T712	T712-T714 PolarHBondContact O-N 3.45Å
715	V	27.5	Very low	29.5	Very low	127 Å²	127	146.7 Å²	146.7	77%	0.77	79%	0.789	S	S	*	*			trans	-105	121.1	-167.5	175.4	0	0	0	0	111.8
716	T	32.5	Very low	29.5	Very low	132 Å²	132	149.1 Å²	149.1	81%	0.81	80%	0.797	S	S	*	*			trans	-144.1	108.8	154.1	46.6	0	0	0	0	111.7
717	T	30.4	Very low	29.6	Very low	124 Å²	124	151.2 Å²	151.2	76%	0.761	80%	0.802	S	S	*	*			trans	-5.2	149.5	139.3	47.2	0	0	0	0	119
718	S	29.4	Very low	29.5	Very low	101 Å²	101	155.2 Å²	155.2	71%	0.706	81%	0.806	S	S	*	*			cis	-175.2	176.3	-5.6	-171.5	0	0	0	0	111.3
719	K	33.8	Very low	29.6	Very low	186 Å²	186	152.4 Å²	152.4	81%	0.809	81%	0.807	S	S	*	*			trans	71.3	93.6	161.9	-71.1	173.2	-179.4	176	0	120.1
720	N	30.9	Very low	29.5	Very low	144 Å²	144	153.7 Å²	153.7	77%	0.77	82%	0.815	S	S	*	*				17.5	124.5	120.2	-53	0.7	0	0	0	118.8
721	N	31.9	Very low	29.4	Very low	169 Å²	169	151.5 Å²	151.5	90%	0.904	82%	0.818	S	S	*	*				-166.6	163.8	89.5	-95.2	-34.9	0	0	0	109.9
722	G	27.8	Very low	29.5	Very low	72 Å²	72	152 Å²	152	74%	0.742	82%	0.821	S	S	*	*			trans	-148.9	-179	-173.1	0	0	0	0	0	114.7
723	K	31.7	Very low	29.3	Very low	218 Å²	218	150.3 Å²	150.3	95%	0.948	82%	0.815	S	S	*	*			trans	-147.7	154.7	164.8	-106.7	166.4	-174.4	175.2	0	110.4
724	K	26.8	Very low	29.3	Very low	196 Å²	196	151.7 Å²	151.7	85%	0.852	81%	0.811	S	S	*	*			trans	-84.1	135.7	-171.3	-57.9	165.2	-177.9	170.2	0	110.5
725	H	32.8	Very low	29	Very low	198 Å²	198	150.5 Å²	150.5	92%	0.917	80%	0.8	S	S	*	*			trans	-134.8	135.8	144	-103	-89.2	0	0	0	110
726	K	28	Very low	29.1	Very low	202 Å²	202	152.2 Å²	152.2	88%	0.878	80%	0.804	S	S	*	*			trans	-83.7	132.9	175	-63.2	174.5	-179.7	175.2	0	108.2
727	N	29.3	Very low	29	Very low	163 Å²	163	154.2 Å²	154.2	87%	0.872	80%	0.802	S	S	*	*			trans	-145.8	149.7	148.4	-131.3	-15.9	0	0	0	111.3
728	K	27.5	Very low	28.9	Very low	190 Å²	190	154.9 Å²	154.9	83%	0.826	80%	0.8	S	S	*	*			trans	-86.3	123.6	-173.1	-61.5	171.9	-178.2	173.2	0	109.8
729	N	29.4	Very low	29	Very low	159 Å²	159	158 Å²	158	85%	0.85	80%	0.798	S	S	*	*			trans	-134.2	127.6	162.2	-88.3	-24.2	0	0	0	109.1	S731	N729-S731 PolarHBondContact O-N 3.13Å
730	N	27.3	Very low	28.9	Very low	167 Å²	167	151.4 Å²	151.4	89%	0.893	78%	0.782	S	S	*	*			trans	-79.1	115.8	-179.1	-73.5	-19.6	0	0	0	110.2
731	S	26.5	Very low	29	Very low	117 Å²	117	146.9 Å²	146.9	82%	0.818	76%	0.758	S	S	*	*			trans	-101	105.1	168.7	45.7	0	0	0	0	110	N729 S733	N729-S731 PolarHBondContact O-N 3.13Å; S731-S733 PolarHBondContact O-N 2.85Å; S731-S733 VanDerWaalsContact O-N 3.12Å
732	T	28.1	Very low	29.1	Very low	114 Å²	114	143.4 Å²	143.4	70%	0.699	74%	0.736	S	S	*	*			trans	-77.2	95.5	174.1	48.5	0	0	0	0	110.2	Y734	T732-Y734 PolarHBondContact O-N 3.46Å
733	S	25	Very low	29.6	Very low	98 Å²	98	145.1 Å²	145.1	69%	0.685	73%	0.725	S	S	*	*			trans	-60.5	122.8	170.2	-176.1	0	0	0	0	110.6	S731 D735	S731-S733 PolarHBondContact O-N 2.85Å; S731-S733 VanDerWaalsContact O-N 3.12Å; S733-D735 PolarHBondContact O-N 2.88Å; S733-D735 VanDerWaalsContact O-N 3.15Å
734	Y	26.6	Very low	29.8	Very low	165 Å²	165	135.9 Å²	135.9	65%	0.647	69%	0.685	S	S	*	*			trans	-83.3	83.3	173.5	-88.2	-90.7	0	0	0	110.8	T732 N736 F858	T732-Y734 PolarHBondContact O-N 3.46Å; Y734-N736 PolarHBondContact O-N 3.03Å; Y734-N736 VanDerWaalsContact O-N 3.16Å; Y734-F858 VanDerWaalsContact OH-CZ 3.24Å; Y734-F858 WeakPolarHBondContact OH-CZ 3.09Å
735	D	26.7	Very low	30.1	Very low	119 Å²	119	129.5 Å²	129.5	64%	0.636	67%	0.666	S	S	*	*			trans	-64.7	111.9	174.4	-80.1	-13.1	0	0	0	111.7	S733 K737	S733-D735 PolarHBondContact O-N 2.88Å; S733-D735 VanDerWaalsContact O-N 3.15Å; D735-K737 VanDerWaalsContact C-N 3.3Å; D735-K737 PolarHBondContact O-N 3.13Å
736	N	28.7	Very low	30.3	Very low	162 Å²	162	124.6 Å²	124.6	87%	0.866	64%	0.642	S	S	*	*			trans	-70.2	77	176.2	-80.9	-74.1	0	0	0	112	Y734	Y734-N736 PolarHBondContact O-N 3.03Å; Y734-N736 VanDerWaalsContact O-N 3.16Å
737	K	30.8	Very low	30.8	Very low	174 Å²	174	115.7 Å²	115.7	76%	0.757	61%	0.605	S	S	*	*			trans	-70.5	133.9	178.2	-77.9	-177.6	176.5	173.7	0	112.8	D735 Y739	D735-K737 VanDerWaalsContact C-N 3.3Å; D735-K737 PolarHBondContact O-N 3.13Å; K737-Y739 PolarHBondContact O-N 3.09Å
738	L	28.2	Very low	31.1	Very low	139 Å²	139	109.9 Å²	109.9	73%	0.728	57%	0.573	S	S	*	*			trans	-65.8	120	-177.7	-65.4	78.8	0	0	0	111.1
739	Y	31.1	Very low	31.5	Very low	167 Å²	167	102 Å²	102	66%	0.655	54%	0.542	S	S	*	.			trans	-135.6	-13.3	175.8	-116.1	-94.2	0	0	0	115.6	K737	K737-Y739 PolarHBondContact O-N 3.09Å
740	G	32.3	Very low	31.7	Very low	46 Å²	46	99.8 Å²	99.8	47%	0.474	53%	0.529	S	S	.	.	H	α-helix	trans	-75.7	-47.8	-174.6	0	0	0	0	0	115	Q743	G740-Q743 PolarHBondContact O-N 2.89Å
741	N	33.3	Very low	32.1	Very low	50 Å²	50	93.5 Å²	93.5	27%	0.267	50%	0.496	S	S	.	.	H	α-helix	trans	-76.8	-27.6	-171	-84.6	-7.4	0	0	0	114.1	N699 F703 Q743 L744 S745	N699-N741 PolarHBondContact O-ND2 3.33Å; N699-N741 PolarHBondContact O-OD1 2.8Å; F703-N741 WeakPolarHBondContact CD2-ND2 3.45Å; N741-Q743 VanDerWaalsContact C-N 3.31Å; N741-Q743 PolarHBondContact O-N 3.22Å; N741-L744 WeakPolarHBondContact O-CB 3.45Å; N741-L744 PolarHBondContact O-N 2.89Å; N741-S745 PolarHBondContact O-N 3.46Å
742	E	32.6	Very low	32.3	Very low	95 Å²	95	91.5 Å²	91.5	44%	0.444	48%	0.482	S	S	.	.	H	α-helix	trans	-61	-39.6	170.2	-82	-142	116.5	0	0	112.1	L744 S745 K746	E742-L744 PolarHBondContact O-N 3.47Å; E742-S745 PolarHBondContact O-N 3.24Å; E742-S745 PolarHBondContact O-OG 3.24Å; E742-S745 VanDerWaalsContact O-OG 3.07Å; E742-K746 HydrophobicContact CB-CD 4.34Å; E742-K746 WeakPolarHBondContact O-CB 3.5Å; E742-K746 VanDerWaalsContact O-CG 3.22Å; E742-K746 WeakPolarHBondContact O-CG 3.37Å; E742-K746 PolarHBondContact O-N 3.38Å; E742-K746 WeakPolarHBondContact OE1-CE 3.49Å; E742-K746 IonicContact OE1-NZ 3.46Å; E742-K746 PolarHBondContact OE1-NZ 2.79Å; E742-K746 IonicContact OE2-NZ 3.13Å; E742-K746 PolarHBondContact OE2-NZ 3.31Å
743	Q	38.3	Very low	32.3	Very low	109 Å²	109	90.8 Å²	90.8	51%	0.509	48%	0.477	S	S	.	.	H	α-helix	trans	-69	-24.4	179.4	-67.6	-166	2.4	0	0	112.6	G740 N741 S747	G740-Q743 PolarHBondContact O-N 2.89Å; N741-Q743 VanDerWaalsContact C-N 3.31Å; N741-Q743 PolarHBondContact O-N 3.22Å; Q743-S747 WeakPolarHBondContact O-CB 3.33Å; Q743-S747 PolarHBondContact O-N 2.99Å; Q743-S747 PolarHBondContact O-OG 2.96Å
744	L	36.6	Very low	32.5	Very low	23 Å²	23	90.9 Å²	90.9	12%	0.12	47%	0.474	C	S	.	.	H	α-helix	trans	-69.5	-51	172.6	-106.8	170.6	0	0	0	111.5	N438 I439 N699 N741 E742 S747 L748	N438-L744 WeakPolarHBondContact ND2-CD1 3.31Å; N438-L744 WeakPolarHBondContact ND2-CD2 3.24Å; N438-L744 VanDerWaalsContact ND2-CG 3.31Å; N438-L744 WeakPolarHBondContact ND2-CG 3.41Å; I439-L744 HydrophobicContact CD1-CD2 4.02Å; N699-L744 HydrophobicContact CB-CD1 3.84Å; N741-L744 WeakPolarHBondContact O-CB 3.45Å; N741-L744 PolarHBondContact O-N 2.89Å; E742-L744 PolarHBondContact O-N 3.47Å; L744-S747 PolarHBondContact O-N 3.05Å; L744-L748 WeakPolarHBondContact O-CD1 3.41Å; L744-L748 WeakPolarHBondContact O-CG 3.21Å; L744-L748 PolarHBondContact O-N 3.03Å; L744-L748 VanDerWaalsContact O-N 3.17Å
745	S	33.9	Very low	32.5	Very low	62 Å²	62	94 Å²	94	43%	0.434	48%	0.484	S	S	.	.	H	α-helix	trans	-66.1	-47	177.3	59.6	0	0	0	0	111.3	N741 E742 S747 L748 T749	N741-S745 PolarHBondContact O-N 3.46Å; E742-S745 PolarHBondContact O-N 3.24Å; E742-S745 PolarHBondContact O-OG 3.24Å; E742-S745 VanDerWaalsContact O-OG 3.07Å; S745-S747 VanDerWaalsContact C-N 3.31Å; S745-S747 PolarHBondContact O-N 3.49Å; S745-L748 PolarHBondContact O-N 2.65Å; S745-L748 VanDerWaalsContact O-N 3.12Å; S745-T749 PolarHBondContact O-N 3.02Å; S745-T749 PolarHBondContact O-OG1 3.26Å; S745-T749 VanDerWaalsContact O-OG1 3.11Å
746	K	36.2	Very low	32.5	Very low	95 Å²	95	93.6 Å²	93.6	41%	0.413	49%	0.49	S	S	.	.	H	α-helix	trans	-62.8	-32.6	177.8	-67.5	173.7	-177.6	176	0	112.7	E742 T749 N750	E742-K746 HydrophobicContact CB-CD 4.34Å; E742-K746 WeakPolarHBondContact O-CB 3.5Å; E742-K746 VanDerWaalsContact O-CG 3.22Å; E742-K746 WeakPolarHBondContact O-CG 3.37Å; E742-K746 PolarHBondContact O-N 3.38Å; E742-K746 WeakPolarHBondContact OE1-CE 3.49Å; E742-K746 IonicContact OE1-NZ 3.46Å; E742-K746 PolarHBondContact OE1-NZ 2.79Å; E742-K746 IonicContact OE2-NZ 3.13Å; E742-K746 PolarHBondContact OE2-NZ 3.31Å; K746-T749 WeakPolarHBondContact CA-OG1 3.23Å; K746-T749 PolarHBondContact O-OG1 3.05Å; K746-N750 WeakPolarHBondContact O-CB 3.1Å; K746-N750 PolarHBondContact O-N 3.22Å; K746-N750 PolarHBondContact O-ND2 3.39Å
747	S	37.9	Very low	32.5	Very low	15 Å²	15	96.6 Å²	96.6	11%	0.105	49%	0.491	C	S	.	.	H	α-helix	trans	-64.1	-49.3	170.1	-72.5	0	0	0	0	112	Y431 Q743 L744 S745 T749 N750 L751	Y431-S747 WeakPolarHBondContact OH-CB 3.47Å; Y431-S747 PolarHBondContact OH-OG 3.33Å; Q743-S747 WeakPolarHBondContact O-CB 3.33Å; Q743-S747 PolarHBondContact O-N 2.99Å; Q743-S747 PolarHBondContact O-OG 2.96Å; L744-S747 PolarHBondContact O-N 3.05Å; S745-S747 VanDerWaalsContact C-N 3.31Å; S745-S747 PolarHBondContact O-N 3.49Å; S747-T749 PolarHBondContact O-N 3.04Å; S747-N750 PolarHBondContact O-N 3.45Å; S747-L751 WeakPolarHBondContact O-CB 3.19Å; S747-L751 WeakPolarHBondContact O-CD1 3.48Å; S747-L751 VanDerWaalsContact O-CG 3.26Å; S747-L751 WeakPolarHBondContact O-CG 3.37Å; S747-L751 PolarHBondContact O-N 3.34Å
748	L	37.2	Very low	32.4	Very low	41 Å²	41	93.9 Å²	93.9	22%	0.215	49%	0.491	C	S	.	.	H	α-helix	trans	-68.2	-34.1	-177.8	-69	165.2	0	0	0	112.4	I696 L744 S745	I696-L748 HydrophobicContact CD1-CD1 3.5Å; I696-L748 HydrophobicContact CG1-CD1 3.99Å; L744-L748 WeakPolarHBondContact O-CD1 3.41Å; L744-L748 WeakPolarHBondContact O-CG 3.21Å; L744-L748 PolarHBondContact O-N 3.03Å; L744-L748 VanDerWaalsContact O-N 3.17Å; S745-L748 PolarHBondContact O-N 2.65Å; S745-L748 VanDerWaalsContact O-N 3.12Å
749	T	35.4	Very low	32.6	Very low	26 Å²	26	92.8 Å²	92.8	16%	0.16	50%	0.496	C	S	.	.	H	α-helix	trans	-76.9	-42	174.5	56.2	0	0	0	0	112.1	S745 K746 S747 L751 S752 T753	S745-T749 PolarHBondContact O-N 3.02Å; S745-T749 PolarHBondContact O-OG1 3.26Å; S745-T749 VanDerWaalsContact O-OG1 3.11Å; K746-T749 WeakPolarHBondContact CA-OG1 3.23Å; K746-T749 PolarHBondContact O-OG1 3.05Å; S747-T749 PolarHBondContact O-N 3.04Å; T749-L751 VanDerWaalsContact C-N 3.29Å; T749-L751 PolarHBondContact O-N 2.78Å; T749-S752 WeakPolarHBondContact O-CA 3.16Å; T749-S752 VanDerWaalsContact O-CB 3.28Å; T749-S752 WeakPolarHBondContact O-CB 3.4Å; T749-S752 PolarHBondContact O-N 3.19Å; T749-S752 PolarHBondContact O-OG 2.81Å; T749-T753 PolarHBondContact O-N 3.47Å; T749-T753 PolarHBondContact O-OG1 3.13Å
750	N	33.9	Very low	32.4	Very low	111 Å²	111	92.3 Å²	92.3	59%	0.594	50%	0.504	S	S	*	.	H	α-helix	trans	-64.4	-32.3	177.4	-71.4	-12.7	0	0	0	112.6	K746 S747 S752 T753	K746-N750 WeakPolarHBondContact O-CB 3.1Å; K746-N750 PolarHBondContact O-N 3.22Å; K746-N750 PolarHBondContact O-ND2 3.39Å; S747-N750 PolarHBondContact O-N 3.45Å; N750-S752 PolarHBondContact O-N 3.2Å; N750-T753 PolarHBondContact O-N 3.39Å
751	L	35	Very low	32.4	Very low	35 Å²	35	98 Å²	98	18%	0.183	52%	0.524	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-18	169.6	-73.2	166.3	0	0	0	113.5	Y427 M430 S747 T749	Y427-L751 HydrophobicContact CE2-CD1 3.9Å; Y427-L751 HydrophobicContact CE2-CD2 4.09Å; M430-L751 HydrophobicContact CE-CD2 4.15Å; S747-L751 WeakPolarHBondContact O-CB 3.19Å; S747-L751 WeakPolarHBondContact O-CD1 3.48Å; S747-L751 VanDerWaalsContact O-CG 3.26Å; S747-L751 WeakPolarHBondContact O-CG 3.37Å; S747-L751 PolarHBondContact O-N 3.34Å; T749-L751 VanDerWaalsContact C-N 3.29Å; T749-L751 PolarHBondContact O-N 2.78Å
752	S	30.7	Very low	32.2	Very low	75 Å²	75	100.5 Å²	100.5	52%	0.524	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-26.1	173.7	83.3	0	0	0	0	113.5	T749 N750 V754	T749-S752 WeakPolarHBondContact O-CA 3.16Å; T749-S752 VanDerWaalsContact O-CB 3.28Å; T749-S752 WeakPolarHBondContact O-CB 3.4Å; T749-S752 PolarHBondContact O-N 3.19Å; T749-S752 PolarHBondContact O-OG 2.81Å; N750-S752 PolarHBondContact O-N 3.2Å; S752-V754 VanDerWaalsContact C-N 3.29Å; S752-V754 PolarHBondContact O-N 3.47Å
753	T	28.5	Very low	32	Very low	99 Å²	99	103.7 Å²	103.7	61%	0.607	57%	0.565	S	S	*	*			trans	-80.3	2.9	-172.3	-35.5	0	0	0	0	114.7	T749 N750 R755	T749-T753 PolarHBondContact O-N 3.47Å; T749-T753 PolarHBondContact O-OG1 3.13Å; N750-T753 PolarHBondContact O-N 3.39Å; T753-R755 PolarHBondContact O-N 3.29Å
754	V	28.9	Very low	31.6	Very low	100 Å²	100	103.7 Å²	103.7	61%	0.606	58%	0.575	S	S	*	*			trans	-68.2	92.5	172.1	-176.1	0	0	0	0	109.5	S752 S756	S752-V754 VanDerWaalsContact C-N 3.29Å; S752-V754 PolarHBondContact O-N 3.47Å; V754-S756 PolarHBondContact O-N 2.89Å
755	R	26.5	Very low	31.1	Very low	232 Å²	232	113.7 Å²	113.7	88%	0.875	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-48.3	134.5	-176.7	-93.6	-178	169.4	171	-2.5	111.9	T753	T753-R755 PolarHBondContact O-N 3.29Å
756	S	27.2	Very low	30.7	Very low	109 Å²	109	118 Å²	118	76%	0.762	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-66.8	127.5	166.9	47.5	0	0	0	0	110.7	V754 P758	V754-S756 PolarHBondContact O-N 2.89Å; S756-P758 WeakPolarHBondContact O-CD 3.29Å
757	Y	27.1	Very low	30.4	Very low	226 Å²	226	118.7 Å²	118.7	89%	0.886	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-56.9	126.5	164.9	-68.7	-87.5	0	0	0	110.3
758	P	30.2	Very low	29.8	Very low	116 Å²	116	123 Å²	123	75%	0.753	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-71.6	138.3	160	31.2	-31.4	0	0	0	108.9	S756	S756-P758 WeakPolarHBondContact O-CD 3.29Å
759	S	31.7	Very low	29.2	Very low	117 Å²	117	128.7 Å²	128.7	82%	0.818	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-72.4	142.9	166.3	48	0	0	0	0	110	D761	S759-D761 PolarHBondContact O-N 2.79Å
760	N	27	Very low	28.8	Very low	157 Å²	157	134.5 Å²	134.5	84%	0.84	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-50.2	131.7	177.5	-59.2	-9.8	0	0	0	112.3
761	D	31.5	Very low	28.4	Very low	165 Å²	165	136.3 Å²	136.3	88%	0.882	75%	0.749	S	S	*	*			trans	-151.3	159.2	136.4	-107.4	-37.1	0	0	0	109.5	S759	S759-D761 PolarHBondContact O-N 2.79Å
762	S	29.4	Very low	28.2	Very low	103 Å²	103	140.3 Å²	140.3	72%	0.72	78%	0.777	S	S	*	*			trans	-101	130.5	-159.4	56.7	0	0	0	0	115
763	N	30	Very low	28	Very low	162 Å²	162	142.8 Å²	142.8	87%	0.866	78%	0.784	S	S	*	*			trans	-163.9	119.5	140.5	-131	-14.2	0	0	0	113.9
764	P	28.9	Very low	28	Very low	108 Å²	108	144.7 Å²	144.7	70%	0.701	80%	0.8	S	S	*	*			trans	-128.6	103.9	166.6	34.8	-18.9	0	0	0	112.7
765	R	25.9	Very low	27.9	Very low	234 Å²	234	148.2 Å²	148.2	88%	0.883	81%	0.807	S	S	*	*			trans	-176.1	152.5	152.4	-104.8	154.3	-166.1	-155.4	1.1	114.3
766	N	26.7	Very low	28.1	Very low	152 Å²	152	144.9 Å²	144.9	81%	0.813	81%	0.807	S	S	*	*			trans	59.8	90.4	152.2	-59.6	8.8	0	0	0	119.9
767	A	28.7	Very low	28	Very low	109 Å²	109	148.2 Å²	148.2	90%	0.901	81%	0.808	S	S	*	*			trans	-145.2	123.4	130.3	0	0	0	0	0	108.3
768	S	24.6	Very low	28.1	Very low	106 Å²	106	145.2 Å²	145.2	74%	0.741	81%	0.806	S	S	*	*			trans	-134.3	120	-170.4	54.7	0	0	0	0	112.3
769	I	26.6	Very low	27.9	Very low	160 Å²	160	144.2 Å²	144.2	82%	0.821	80%	0.798	S	S	*	*			trans	-141.3	97	163	-78.3	103.5	0	0	0	104.6
770	I	27	Very low	27.6	Very low	149 Å²	149	144.7 Å²	144.7	76%	0.764	80%	0.796	S	S	*	*				80.5	112.6	94.9	-68.1	158.5	0	0	0	112.7
771	L	25.6	Very low	27.6	Very low	148 Å²	148	143.8 Å²	143.8	78%	0.775	80%	0.796	S	S	*	*			trans	-87.7	161.5	162.5	-84.3	157.8	0	0	0	109.8
772	P	30.3	Very low	27.3	Very low	120 Å²	120	144.9 Å²	144.9	78%	0.779	79%	0.793	S	S	*	*				-117.4	146.5	129.8	33.7	-30.5	0	0	0	112.3
773	N	26.1	Very low	27.4	Very low	127 Å²	127	148.5 Å²	148.5	68%	0.679	80%	0.799	S	S	*	*			trans	-87.4	147.9	168.7	-66.9	-83.8	0	0	0	109.8
774	C	28.7	Very low	27.2	Very low	139 Å²	139	149.6 Å²	149.6	94%	0.939	80%	0.796	S	S	*	*			trans	-120.2	135.6	145.6	-83.1	0	0	0	0	109.2
775	K	25.9	Very low	27.3	Very low	174 Å²	174	149.4 Å²	149.4	76%	0.757	80%	0.797	S	S	*	*			trans	-115.4	145.7	177.8	-62.8	172.5	-178.2	169.7	0	108.8
776	N	31.6	Very low	27.3	Very low	162 Å²	162	145 Å²	145	87%	0.866	79%	0.791	S	S	*	*			trans	-177.3	121	152.6	-86.5	-22.6	0	0	0	105.2
777	K	25	Very low	27.6	Very low	178 Å²	178	145 Å²	145	77%	0.774	79%	0.791	S	S	*	*			cis	76.8	73	9.3	-152.8	-157	179.4	-165.4	0	117.7
778	L	28.3	Very low	27.5	Very low	163 Å²	163	148.2 Å²	148.2	85%	0.853	79%	0.787	S	S	*	*			trans	-140.9	112.1	141.1	-107.8	70.2	0	0	0	104.4
779	T	26.2	Very low	28	Very low	96 Å²	96	151.3 Å²	151.3	59%	0.589	79%	0.79	S	S	*	*				73.3	118.6	72.3	60.6	0	0	0	0	115.7
780	T	24.8	Very low	28.3	Very low	127 Å²	127	151.3 Å²	151.3	78%	0.779	79%	0.786	S	S	*	*			trans	53.3	137.5	142	60.1	0	0	0	0	119.3
781	T	28.2	Very low	28.2	Very low	137 Å²	137	152.1 Å²	152.1	84%	0.84	79%	0.789	S	S	*	*				-152.8	-175.3	50.5	41.2	0	0	0	0	113.5
782	K	24.5	Very low	28.4	Very low	188 Å²	188	153.3 Å²	153.3	82%	0.817	79%	0.791	S	S	*	*			trans	-79.7	149.3	173.6	-50.5	164.3	-177.8	171.4	0	111
783	H	31.5	Very low	28.2	Very low	180 Å²	180	151.7 Å²	151.7	83%	0.833	79%	0.787	S	S	*	*			trans	180	128.6	132.6	-97	-82.5	0	0	0	105.7
784	K	25.6	Very low	28.3	Very low	184 Å²	184	154.5 Å²	154.5	80%	0.8	79%	0.794	S	S	*	*				75.7	143.1	55.3	-115.2	-163.6	178.8	-159.9	0	114.1
785	S	30.9	Very low	28.1	Very low	105 Å²	105	156.2 Å²	156.2	73%	0.734	79%	0.785	S	S	*	*			trans	63.4	150.2	-174	49.1	0	0	0	0	117.8
786	D	27.4	Very low	28.1	Very low	142 Å²	142	155.6 Å²	155.6	76%	0.759	79%	0.789	S	S	*	*			cis	164.9	175.4	-37.6	-88.7	-34.3	0	0	0	106.7
787	N	32	Very low	27.9	Very low	152 Å²	152	151.4 Å²	151.4	81%	0.813	78%	0.784	S	S	*	*			trans	72.5	110.6	-176.8	-47.7	-27	0	0	0	113.5
788	E	27.8	Very low	28	Very low	175 Å²	175	152.6 Å²	152.6	82%	0.818	79%	0.789	S	S	*	*			cis	70.1	123.5	43.5	-59.5	-149.8	140.1	0	0	116.2
789	H	34.5	Very low	27.9	Very low	171 Å²	171	152 Å²	152	79%	0.792	79%	0.792	S	S	*	*			trans	156.6	129.6	148.6	-84.5	6.7	0	0	0	107.3
790	Q	32.1	Very low	27.8	Very low	160 Å²	160	157 Å²	157	75%	0.748	81%	0.806	S	S	*	*			cis	-138.8	140.7	-0.6	-95	162.5	12	0	0	107.7
791	M	26.3	Very low	28.1	Very low	166 Å²	166	156.2 Å²	156.2	82%	0.818	81%	0.806	S	S	*	*				54.2	132.9	90.3	-76.3	-68.5	174.1	0	0	113.9
792	Q	29.5	Very low	27.9	Very low	174 Å²	174	155.1 Å²	155.1	81%	0.813	80%	0.804	S	S	*	*			cis	-143.2	169.6	24.7	-117.1	158.7	30.2	0	0	113.2
793	A	26.4	Very low	27.9	Very low	85 Å²	85	154.1 Å²	154.1	70%	0.702	81%	0.806	S	S	*	*			trans	-143.9	137.2	176.9	0	0	0	0	0	113.4
794	F	26.9	Very low	27.5	Very low	187 Å²	187	153 Å²	153	82%	0.82	80%	0.801	S	S	*	*			trans	-144.9	126.4	160	-87.8	-85	0	0	0	107.7
795	K	25.4	Very low	27.4	Very low	175 Å²	175	151.1 Å²	151.1	76%	0.761	80%	0.799	S	S	*	*			cis	89.2	131.6	20.7	-155.1	-173.2	-175.7	-179.7	0	113.3
796	L	25.8	Very low	27.1	Very low	161 Å²	161	150.8 Å²	150.8	84%	0.843	80%	0.795	S	S	*	*			trans	68.5	156.1	-170.7	-59.3	102.4	0	0	0	114.2
797	G	26.9	Very low	27	Very low	73 Å²	73	153 Å²	153	75%	0.753	79%	0.794	S	S	*	*			cis	-159.4	171.5	2.2	0	0	0	0	0	114
798	K	26.7	Very low	26.7	Very low	203 Å²	203	149.5 Å²	149.5	88%	0.883	78%	0.776	S	S	*	*			trans	-88.3	148.9	-179.8	-45.8	158.4	-176.3	168.8	0	110.7
799	T	26.6	Very low	26.6	Very low	151 Å²	151	145.9 Å²	145.9	93%	0.926	76%	0.759	S	S	*	*			trans	-168.4	171.4	133.6	18.5	0	0	0	0	112.4
800	K	25.2	Very low	26.2	Very low	200 Å²	200	143.3 Å²	143.3	87%	0.87	74%	0.742	S	S	*	*			trans	-122.9	135.1	179.1	-57.2	172.2	-179.9	175.3	0	111.3
801	S	29.2	Very low	26	Very low	111 Å²	111	140.5 Å²	140.5	78%	0.776	73%	0.732	S	S	*	*			trans	-175.7	124	153.5	44.8	0	0	0	0	106.8
802	S	24	Very low	26.1	Very low	114 Å²	114	138.4 Å²	138.4	80%	0.797	72%	0.724	S	S	*	*			cis	66.2	128.2	47.5	-51	0	0	0	0	112
803	I	25.6	Very low	26	Very low	168 Å²	168	135.4 Å²	135.4	86%	0.862	72%	0.718	S	S	*	*			trans	110.5	80.9	-165.6	-9.8	149.8	0	0	0	115.7
804	Q	23.7	Very low	26.1	Very low	157 Å²	157	136.2 Å²	136.2	73%	0.734	72%	0.718	S	S	*	*			cis	83.4	119.2	35.2	-176.5	167.1	-9.5	0	0	115.5
805	L	23.4	Very low	26.2	Very low	144 Å²	144	133 Å²	133	75%	0.754	72%	0.715	S	S	*	*			trans	69.6	157.5	-179.3	-57.9	158	0	0	0	113.8
806	C	24.4	Very low	26.4	Very low	98 Å²	98	130.5 Å²	130.5	66%	0.662	71%	0.714	S	S	*	*			cis	-149.5	146.7	1.4	-136.4	0	0	0	0	112.7
807	Y	24.6	Very low	26.5	Very low	187 Å²	187	129.1 Å²	129.1	73%	0.733	71%	0.713	S	S	*	*			trans	17.7	119.5	140.4	-78.5	-93.1	0	0	0	122.5
808	N	25.1	Very low	26.8	Very low	79 Å²	79	131.3 Å²	131.3	42%	0.422	71%	0.711	S	S	.	*				81.7	122.3	105	-132.3	42.4	0	0	0	119.8	N844 S845	N808-N844 HydrophobicContact CB-CB 3.33Å; N808-N844 VanDerWaalsContact CG-C 3.43Å; N808-N844 WeakPolarHBondContact ND2-CA 3.48Å; N808-N844 WeakPolarHBondContact ND2-CB 3.31Å; N808-N844 PolarHBondContact ND2-O 3.17Å; N808-N844 WeakPolarHBondContact O-CB 3.3Å; N808-N844 PolarHBondContact O-ND2 3.11Å; N808-S845 WeakPolarHBondContact CA-OG 3.34Å; N808-S845 WeakPolarHBondContact CB-OG 3.47Å; N808-S845 WeakPolarHBondContact OD1-CB 3.23Å; N808-S845 PolarHBondContact OD1-OG 3.02Å
809	E	26.1	Very low	26.9	Very low	99 Å²	99	128.5 Å²	128.5	46%	0.463	71%	0.711	S	S	.	*				-156.7	-162.2	117.6	-167.1	132.8	-125.4	0	0	113.7	N844 S845	E809-N844 HydrophobicContact CB-CB 3.84Å; E809-N844 WeakPolarHBondContact CB-OD1 3.42Å; E809-N844 HydrophobicContact CG-CB 4.14Å; E809-N844 WeakPolarHBondContact CG-OD1 3.33Å; E809-N844 WeakPolarHBondContact OE1-CA 3.42Å; E809-N844 PolarHBondContact OE1-OD1 3.2Å; E809-N844 PolarHBondContact OE2-OD1 3.11Å; E809-S845 WeakPolarHBondContact CA-OG 3.35Å; E809-S845 PolarHBondContact N-OG 3.27Å; E809-S845 WeakPolarHBondContact O-CB 3.39Å; E809-S845 PolarHBondContact O-OG 3.11Å
810	R	27.1	Very low	27.2	Very low	117 Å²	117	127.1 Å²	127.1	44%	0.442	70%	0.703	S	S	.	*			trans	-129.1	162.3	-134.8	-82.5	-178.5	175.4	103.5	-2.7	113.1	I846	R810-I846 HydrophobicContact CB-CB 4.37Å; R810-I846 HydrophobicContact CB-CD1 4.05Å; R810-I846 HydrophobicContact CG-CB 4.09Å; R810-I846 HydrophobicContact CG-CD1 4.02Å; R810-I846 HydrophobicContact CG-CG1 4.29Å
811	N	28.1	Very low	27.6	Very low	101 Å²	101	124 Å²	124	54%	0.54	70%	0.701	S	S	.	*			trans	67.2	160.8	151.2	-81.7	-24	0	0	0	116.9	I846	N811-I846 HydrophobicContact CB-CD1 4.4Å; N811-I846 WeakPolarHBondContact OD1-CD1 3.4Å
812	N	27.6	Very low	27.8	Very low	122 Å²	122	124.2 Å²	124.2	65%	0.652	70%	0.698	S	S	*	*			cis	-153.1	162.9	12.8	-134.1	-8.3	0	0	0	112.4
813	T	28.6	Very low	28.3	Very low	111 Å²	111	124.7 Å²	124.7	68%	0.681	70%	0.696	S	S	*	*			trans	55.4	128.1	154.9	51.8	0	0	0	0	120.2
814	S	27.7	Very low	28.7	Very low	102 Å²	102	122.5 Å²	122.5	71%	0.713	69%	0.69	S	S	*	*				70.2	137	60.5	-48.7	0	0	0	0	113.1
815	T	29	Very low	29.2	Very low	121 Å²	121	120.4 Å²	120.4	74%	0.742	69%	0.689	S	S	*	*			cis	-167.8	144.2	10.9	-6.4	0	0	0	0	115
816	T	28.3	Very low	30	Very low	121 Å²	121	120.9 Å²	120.9	74%	0.742	69%	0.687	S	S	*	*			trans	61.6	162.6	147.3	29.6	0	0	0	0	125.7
817	T	29	Very low	30.7	Very low	133 Å²	133	122.8 Å²	122.8	82%	0.816	69%	0.685	S	S	*	*			trans	83.8	147.6	169.5	76.8	0	0	0	0	116.2
818	T	34	Very low	31.4	Very low	119 Å²	119	120.8 Å²	120.8	73%	0.73	68%	0.683	S	S	*	*			cis	-130.4	153.3	12.4	41.4	0	0	0	0	114.6
819	T	27.8	Very low	32	Very low	143 Å²	143	123.1 Å²	123.1	88%	0.877	69%	0.691	S	S	*	*			trans	-125.4	136.5	159.9	44.2	0	0	0	0	109.3
820	T	33.2	Very low	32.6	Very low	123 Å²	123	125.1 Å²	125.1	76%	0.755	70%	0.7	S	S	*	*			trans	-141.1	110.4	-176.6	43.2	0	0	0	0	113
821	T	33.2	Very low	33.2	Very low	134 Å²	134	126.9 Å²	126.9	82%	0.822	71%	0.713	S	S	*	*			trans	-157.8	95.2	152.8	2.4	0	0	0	0	111.3
822	T	33.9	Very low	33.6	Very low	116 Å²	116	127.6 Å²	127.6	71%	0.712	72%	0.717	S	S	*	*			trans	53.2	122.6	139.3	52.7	0	0	0	0	122.6
823	T	33.2	Very low	34	Very low	124 Å²	124	126.2 Å²	126.2	76%	0.761	72%	0.717	S	S	*	*			trans	92.7	121.7	132.7	45.5	0	0	0	0	123.3
824	T	34.3	Very low	34.4	Very low	121 Å²	121	131.4 Å²	131.4	74%	0.742	73%	0.73	S	S	*	*			trans	85	105.9	143.1	42.3	0	0	0	0	123.3
825	T	35.5	Very low	34.7	Very low	114 Å²	114	132.2 Å²	132.2	70%	0.699	74%	0.736	S	S	*	*			trans	89.7	109.4	130.6	47	0	0	0	0	124.4
826	H	39.1	Very low	35.4	Very low	154 Å²	154	129.9 Å²	129.9	71%	0.713	74%	0.735	S	S	*	*			trans	86	110.2	139.1	-68.1	-60.7	0	0	0	124.9
827	H	39.2	Very low	35.8	Very low	137 Å²	137	130.9 Å²	130.9	63%	0.634	74%	0.736	S	S	*	*			trans	69.4	110.7	135.4	-65.6	-60.2	0	0	0	125.6
828	Q	39.4	Very low	36.3	Very low	146 Å²	146	131.2 Å²	131.2	68%	0.682	73%	0.733	S	S	*	*				68	151.1	119	-70.3	171.5	-45.9	0	0	121.8
829	H	38.9	Very low	36.4	Very low	128 Å²	128	131.8 Å²	131.8	59%	0.593	73%	0.731	S	S	*	*			cis	-149.1	165.1	-1.3	-124.6	-68.9	0	0	0	111.9
830	E	37	Very low	36.8	Very low	140 Å²	140	131.4 Å²	131.4	65%	0.654	72%	0.724	S	S	*	*			trans	-32.4	171.1	166.4	-74.1	132	-147.3	0	0	119.9
831	H	41	Very low	36.9	Very low	155 Å²	155	131.4 Å²	131.4	72%	0.718	72%	0.72	S	S	*	*			cis	-169.7	-173.7	10.6	-118.7	-17.3	0	0	0	109
832	N	36.5	Very low	36.9	Very low	115 Å²	115	130.9 Å²	130.9	62%	0.615	71%	0.712	S	S	*	*			cis	-161.7	-151.1	-10.5	-122.8	-21.4	0	0	0	110
833	S	34.9	Very low	36.7	Very low	93 Å²	93	129.9 Å²	129.9	65%	0.65	70%	0.702	S	S	*	*				-172.7	128.7	-102.7	-62.3	0	0	0	0	113
834	K	38.2	Very low	36.5	Very low	221 Å²	221	126 Å²	126	96%	0.961	68%	0.677	S	S	*	*			trans	172.1	172.8	154.9	-99.2	165.3	-171.4	-175.7	0	116.3
835	S	32.6	Very low	36.2	Very low	119 Å²	119	121.6 Å²	121.6	83%	0.832	65%	0.651	S	S	*	*			trans	-147.3	-179.2	-161.3	56.5	0	0	0	0	114.7
836	G	45.3	Very low	35.7	Very low	71 Å²	71	120 Å²	120	73%	0.732	64%	0.637	S	S	*	*			trans	-168.2	149.8	168.7	0	0	0	0	0	114.2
837	D	35.9	Very low	35.1	Very low	143 Å²	143	118.5 Å²	118.5	77%	0.765	63%	0.634	S	S	*	*			trans	-111.6	160.4	-163.2	-51.1	-83.7	0	0	0	115.3
838	N	39.4	Very low	34.5	Very low	139 Å²	139	118 Å²	118	74%	0.743	64%	0.641	S	S	*	*				174.5	130.7	112.2	-97.4	-75.2	0	0	0	115.8
839	N	36.8	Very low	33.9	Very low	131 Å²	131	116.3 Å²	116.3	70%	0.701	64%	0.636	S	S	*	*			trans	27.4	125.4	139.5	-60	-29.1	0	0	0	121.7
840	N	36.4	Very low	33.2	Very low	136 Å²	136	117.8 Å²	117.8	73%	0.727	64%	0.644	S	S	*	*				-165.9	134	82.1	-117.9	-26.4	0	0	0	116.3
841	N	35.2	Very low	32.6	Very low	123 Å²	123	115.8 Å²	115.8	66%	0.658	65%	0.645	S	S	*	*			trans	51.4	106.9	145.8	-66.2	-9.5	0	0	0	122.7
842	N	32.4	Very low	31.8	Very low	123 Å²	123	112.8 Å²	112.8	66%	0.658	64%	0.641	S	S	*	*				100.9	110.2	121.7	-64	3.7	0	0	0	120.2
843	N	29.5	Very low	31.2	Very low	95 Å²	95	114 Å²	114	51%	0.508	65%	0.648	S	S	.	*				70.2	123.2	124.2	-60.2	30.6	0	0	0	118.8
844	N	28.9	Very low	30.7	Very low	42 Å²	42	116 Å²	116	23%	0.225	65%	0.65	C	S	.	*			cis	-153	166.4	3.1	-81.9	-15.2	0	0	0	109	N808 E809	N808-N844 HydrophobicContact CB-CB 3.33Å; N808-N844 VanDerWaalsContact CG-C 3.43Å; N808-N844 WeakPolarHBondContact ND2-CA 3.48Å; N808-N844 WeakPolarHBondContact ND2-CB 3.31Å; N808-N844 PolarHBondContact ND2-O 3.17Å; N808-N844 WeakPolarHBondContact O-CB 3.3Å; N808-N844 PolarHBondContact O-ND2 3.11Å; E809-N844 HydrophobicContact CB-CB 3.84Å; E809-N844 WeakPolarHBondContact CB-OD1 3.42Å; E809-N844 HydrophobicContact CG-CB 4.14Å; E809-N844 WeakPolarHBondContact CG-OD1 3.33Å; E809-N844 WeakPolarHBondContact OE1-CA 3.42Å; E809-N844 PolarHBondContact OE1-OD1 3.2Å; E809-N844 PolarHBondContact OE2-OD1 3.11Å
845	S	28.1	Very low	30.1	Very low	29 Å²	29	111.7 Å²	111.7	20%	0.203	64%	0.637	C	S	.	*			trans	30.5	156.1	173.4	-21.9	0	0	0	0	124.2	N808 E809	N808-S845 WeakPolarHBondContact CA-OG 3.34Å; N808-S845 WeakPolarHBondContact CB-OG 3.47Å; N808-S845 WeakPolarHBondContact OD1-CB 3.23Å; N808-S845 PolarHBondContact OD1-OG 3.02Å; E809-S845 WeakPolarHBondContact CA-OG 3.35Å; E809-S845 PolarHBondContact N-OG 3.27Å; E809-S845 WeakPolarHBondContact O-CB 3.39Å; E809-S845 PolarHBondContact O-OG 3.11Å
846	I	26.4	Very low	29.8	Very low	80 Å²	80	111.7 Å²	111.7	41%	0.41	63%	0.633	S	S	.	*			cis	79.5	139.7	3.8	-82.1	178.4	0	0	0	118.8	R810 N811	R810-I846 HydrophobicContact CB-CB 4.37Å; R810-I846 HydrophobicContact CB-CD1 4.05Å; R810-I846 HydrophobicContact CG-CB 4.09Å; R810-I846 HydrophobicContact CG-CD1 4.02Å; R810-I846 HydrophobicContact CG-CG1 4.29Å; N811-I846 HydrophobicContact CB-CD1 4.4Å; N811-I846 WeakPolarHBondContact OD1-CD1 3.4Å
847	L	26	Very low	28.9	Very low	122 Å²	122	114.2 Å²	114.2	64%	0.639	64%	0.639	S	S	*	*			cis	-125.2	-153.3	-11.1	-115.6	168.7	0	0	0	106.8
848	T	26.6	Very low	28.4	Very low	127 Å²	127	115.4 Å²	115.4	78%	0.779	64%	0.637	S	S	*	*			cis	-146.2	164.9	10.5	-31	0	0	0	0	111.2
849	D	25.8	Very low	27.9	Very low	111 Å²	111	114.5 Å²	114.5	59%	0.594	64%	0.642	S	S	*	*			trans	-65.2	147.1	-175	-65.4	-74.8	0	0	0	118
850	Q	25.1	Very low	27.3	Very low	159 Å²	159	112.7 Å²	112.7	74%	0.743	64%	0.64	S	S	*	*				31.7	138.1	123.9	-46	-174.8	34.2	0	0	122.3
851	S	23.6	Very low	27	Very low	97 Å²	97	114.3 Å²	114.3	68%	0.678	65%	0.648	S	S	*	*			trans	73.6	140.6	135.8	62.8	0	0	0	0	122
852	S	24.3	Very low	26.6	Very low	93 Å²	93	112.7 Å²	112.7	65%	0.65	65%	0.646	S	S	*	*			trans	66.3	138.5	152.2	43.1	0	0	0	0	119.9
853	D	23.5	Very low	26.4	Very low	141 Å²	141	116.1 Å²	116.1	75%	0.754	66%	0.658	S	S	*	*			trans	63.2	143.6	139.8	-62.1	3	0	0	0	119.1
854	I	25.8	Very low	26.2	Very low	133 Å²	133	121 Å²	121	68%	0.682	67%	0.671	S	S	*	*			cis	179.7	174.9	-18.8	-115.3	165.4	0	0	0	103.7
855	D	24	Very low	26.1	Very low	132 Å²	132	124.5 Å²	124.5	71%	0.706	69%	0.685	S	S	*	*			trans	58.7	98	164.8	-72.3	-7.7	0	0	0	121.1
856	T	27.1	Very low	26	Very low	119 Å²	119	129 Å²	129	73%	0.73	71%	0.705	S	S	*	*				32.9	126.1	117.1	63.8	0	0	0	0	119.9
857	S	26	Very low	26	Very low	123 Å²	123	131.1 Å²	131.1	86%	0.86	72%	0.724	S	S	*	*				-148.2	138.3	127.5	36.4	0	0	0	0	114.6
858	F	26	Very low	25.9	Very low	168 Å²	168	136 Å²	136	74%	0.737	74%	0.735	S	S	*	*			trans	-47.9	143.2	168.2	-82.2	-114.2	0	0	0	114.6	Y734	Y734-F858 VanDerWaalsContact OH-CZ 3.24Å; Y734-F858 WeakPolarHBondContact OH-CZ 3.09Å
859	S	27.5	Very low	26	Very low	121 Å²	121	139 Å²	139	85%	0.846	74%	0.741	S	S	*	*				-148.8	133.4	122.3	-166.8	0	0	0	0	112.2
860	S	26.2	Very low	26	Very low	92 Å²	92	143.1 Å²	143.1	64%	0.643	75%	0.753	S	S	*	*			trans	-78.4	146.1	176.4	48.9	0	0	0	0	112.3
861	N	29	Very low	26	Very low	171 Å²	171	141.6 Å²	141.6	91%	0.914	76%	0.755	S	S	*	*			trans	-145.5	129.1	140.7	-118.2	-28.5	0	0	0	110.3
862	S	26.2	Very low	26.1	Very low	88 Å²	88	142.2 Å²	142.2	62%	0.615	76%	0.758	S	S	*	*			trans	-126.2	134.5	-178	55.6	0	0	0	0	110
863	Q	28.8	Very low	26.1	Very low	195 Å²	195	142.6 Å²	142.6	91%	0.911	76%	0.76	S	S	*	*			trans	-127	139.6	163.2	-76.4	-172.8	-28.1	0	0	109.3
864	Y	25.3	Very low	26.4	Very low	197 Å²	197	144.6 Å²	144.6	77%	0.773	77%	0.765	S	S	*	*			trans	-88.6	155.8	-171.6	-77.9	-106.7	0	0	0	111.3
865	F	26.5	Very low	26.4	Very low	117 Å²	117	145.8 Å²	145.8	51%	0.513	77%	0.768	S	S	.	*			trans	-143.7	135	153.8	-122.3	-87.1	0	0	0	110.3	N172 D173	N172-F865 HydrophobicContact CB-CD1 3.91Å; N172-F865 HydrophobicContact CB-CD2 3.97Å; N172-F865 HydrophobicContact CB-CE1 3.96Å; N172-F865 HydrophobicContact CB-CE2 4.01Å; N172-F865 HydrophobicContact CB-CG 3.92Å; N172-F865 HydrophobicContact CB-CZ 4.01Å; N172-F865 WeakPolarHBondContact ND2-CB 3.3Å; N172-F865 WeakPolarHBondContact ND2-CG 3.45Å; D173-F865 HydrophobicContact CB-CE1 4.14Å; D173-F865 HydrophobicContact CB-CZ 3.73Å; D173-F865 VanDerWaalsContact CG-CZ 3.48Å; D173-F865 WeakPolarHBondContact OD2-CE1 3.35Å
866	I	25.8	Very low	26.5	Very low	123 Å²	123	147.1 Å²	147.1	63%	0.631	77%	0.77	S	S	*	*			trans	-126.4	119.5	-173	-59.2	173.6	0	0	0	109.2
867	P	27.9	Very low	26.4	Very low	124 Å²	124	149.2 Å²	149.2	81%	0.805	77%	0.771	S	S	*	*			trans	-80.4	126.7	162.6	-10.6	28.3	0	0	0	110.2
868	Y	23.8	Very low	26.4	Very low	224 Å²	224	148.9 Å²	148.9	88%	0.878	77%	0.766	S	S	*	*			trans	-68.2	142.5	174.5	-78.8	-111.4	0	0	0	111.8
869	E	27.2	Very low	26.4	Very low	191 Å²	191	150 Å²	150	89%	0.893	77%	0.773	S	S	*	*			trans	-128.9	134.9	150	-151.7	168.4	-141.2	0	0	109.3	V871	E869-V871 PolarHBondContact O-N 3.1Å
870	K	27.2	Very low	26.2	Very low	197 Å²	197	153 Å²	153	86%	0.857	77%	0.774	S	S	*	*			trans	-76.8	114.9	-170.3	-81.7	-173.8	173.6	-176.5	0	111.6	C872	K870-C872 PolarHBondContact O-N 3.41Å
871	V	24.6	Very low	26.2	Very low	128 Å²	128	155.2 Å²	155.2	78%	0.776	78%	0.783	S	S	*	*			trans	-65.1	119.9	152.5	178.8	0	0	0	0	107.5	E869 S873	E869-V871 PolarHBondContact O-N 3.1Å; V871-S873 WeakPolarHBondContact CG1-OG 2.92Å
872	C	26.2	Very low	25.9	Very low	109 Å²	109	151.6 Å²	151.6	74%	0.736	77%	0.771	S	S	*	*			trans	-113.5	78.4	170.5	-172.3	0	0	0	0	108.9	K870 Q874	K870-C872 PolarHBondContact O-N 3.41Å; C872-Q874 PolarHBondContact O-N 3.02Å
873	S	24.4	Very low	26	Very low	101 Å²	101	156.9 Å²	156.9	71%	0.706	78%	0.784	S	S	*	*			trans	-67.5	119.5	169.9	-55.3	0	0	0	0	109.3	V871	V871-S873 WeakPolarHBondContact CG1-OG 2.92Å
874	Q	29.4	Very low	25.8	Very low	183 Å²	183	152.4 Å²	152.4	86%	0.855	77%	0.774	S	S	*	*			trans	-125.1	131.6	156.2	-75.6	-167.6	-35.3	0	0	108.5	C872	C872-Q874 PolarHBondContact O-N 3.02Å
875	Q	24.9	Very low	25.8	Very low	159 Å²	159	148.3 Å²	148.3	74%	0.743	77%	0.774	S	S	*	*			trans	-85.3	175.7	-178	-63.3	155.5	-75.6	0	0	110.3
876	H	27.1	Very low	25.7	Very low	159 Å²	159	149.6 Å²	149.6	74%	0.736	79%	0.791	S	S	*	*			trans	73.1	136.8	163.4	-61.8	-62.7	0	0	0	116.3
877	Q	24.2	Very low	25.7	Very low	164 Å²	164	152.9 Å²	152.9	77%	0.766	80%	0.801	S	S	*	*			cis	-135.2	162.1	-4.6	-76.7	-142.5	28.4	0	0	111.8
878	P	25.7	Very low	25.6	Very low	115 Å²	115	156.5 Å²	156.5	75%	0.747	80%	0.804	S	S	*	*			trans	-90.6	111	169.9	34.3	-28.7	0	0	0	111.6
879	E	27.1	Very low	25.8	Very low	192 Å²	192	151.9 Å²	151.9	90%	0.897	80%	0.801	S	S	*	*			trans	-90.4	123.7	164	-81.3	-166.6	137.6	0	0	111.3
880	Q	23.3	Very low	25.9	Very low	183 Å²	183	149.6 Å²	149.6	86%	0.855	80%	0.801	S	S	*	*			trans	-85	126.2	168.7	-61.3	-178.9	4	0	0	109.3
881	V	26.5	Very low	25.9	Very low	139 Å²	139	149.5 Å²	149.5	84%	0.842	80%	0.801	S	S	*	*			trans	-126.5	98.8	153.9	-175.7	0	0	0	0	107.8
882	S	22.6	Very low	26.1	Very low	95 Å²	95	149.3 Å²	149.3	66%	0.664	79%	0.794	S	S	*	*			trans	-76.9	147.4	165.8	51.8	0	0	0	0	109.4
883	F	26.7	Very low	26.2	Very low	199 Å²	199	150 Å²	150	87%	0.873	79%	0.791	S	S	*	*			trans	-156.5	136.6	137.3	-110.4	-68.4	0	0	0	112.3
884	S	25.2	Very low	26.4	Very low	101 Å²	101	149.3 Å²	149.3	71%	0.706	78%	0.776	S	S	*	*			trans	-1.2	128.5	170	48.9	0	0	0	0	120.9
885	S	25	Very low	26.3	Very low	111 Å²	111	147.8 Å²	147.8	78%	0.776	77%	0.767	S	S	*	*			trans	-52.2	152.9	149.6	54.8	0	0	0	0	114.2
886	V	25.6	Very low	26.4	Very low	144 Å²	144	149.1 Å²	149.1	87%	0.873	78%	0.776	S	S	*	*				-165.6	162	125.3	135.6	0	0	0	0	111.7
887	K	25.3	Very low	26.3	Very low	192 Å²	192	148.7 Å²	148.7	84%	0.835	77%	0.772	S	S	*	*			trans	-87.3	135.5	-166.2	-52.5	157.9	-175.8	169.1	0	113.2
888	K	25.2	Very low	26.6	Very low	201 Å²	201	152.1 Å²	152.1	87%	0.874	78%	0.777	S	S	*	*				172	140.9	124.3	-95.8	163.2	-177.2	176.6	0	112.7
889	P	28	Very low	26.6	Very low	126 Å²	126	153.1 Å²	153.1	82%	0.818	78%	0.784	S	S	*	*			trans	-105.2	137.2	173.2	36.4	-29.3	0	0	0	113.3
890	T	29.2	Very low	26.7	Very low	144 Å²	144	149 Å²	149	88%	0.883	77%	0.772	S	S	*	*			trans	-131.5	136.4	170.4	31.7	0	0	0	0	112.2
891	K	28.2	Very low	26.8	Very low	195 Å²	195	151.7 Å²	151.7	85%	0.848	77%	0.774	S	S	*	*			trans	-90.2	172.7	168.1	-55.3	169.8	-179.9	167.7	0	107.8
892	L	28.2	Very low	26.8	Very low	123 Å²	123	153 Å²	153	64%	0.644	77%	0.768	S	S	*	*			cis	-160.4	162.3	9.3	-163.4	79.3	0	0	0	107.5
893	N	28.6	Very low	27	Very low	124 Å²	124	156 Å²	156	66%	0.663	77%	0.766	S	S	*	*				-175.3	154.5	119.4	-94.5	-24.5	0	0	0	115
894	E	28.6	Very low	27.1	Very low	86 Å²	86	152.5 Å²	152.5	40%	0.402	76%	0.756	S	S	.	*			trans	-98.5	155.6	-164.3	-50.5	-171.7	127.9	0	0	114.8	K897	E894-K897 IonicContact OE1-NZ 3.28Å; E894-K897 PolarHBondContact OE1-NZ 2.86Å; E894-K897 IonicContact OE2-NZ 3.73Å; E894-K897 PolarHBondContact OE2-NZ 3.35Å; E894-K897 VanDerWaalsContact OE2-NZ 3.16Å
895	K	26	Very low	27.4	Very low	152 Å²	152	153 Å²	153	66%	0.661	76%	0.755	S	S	*	*			trans	-153.4	162.8	136.8	-131.1	177.6	-169.3	165.3	0	112.4	L261	L261-K895 HydrophobicContact CD1-CD 3.7Å; L261-K895 HydrophobicContact CD1-CG 4.31Å; L261-K895 HydrophobicContact CG-CD 3.78Å; L261-K895 HydrophobicContact CG-CG 4.18Å
896	M	27.2	Very low	27.7	Very low	187 Å²	187	151.8 Å²	151.8	92%	0.921	74%	0.739	S	S	*	*			trans	64.4	83.5	178.6	-66.8	-158.3	174.5	0	0	118.1
897	K	26.4	Very low	28	Very low	150 Å²	150	148.2 Å²	148.2	65%	0.652	72%	0.72	S	S	*	*			trans	-91.1	136.1	149.4	-72.1	166.4	-177.8	136.9	0	109.4	E894	E894-K897 IonicContact OE1-NZ 3.28Å; E894-K897 PolarHBondContact OE1-NZ 2.86Å; E894-K897 IonicContact OE2-NZ 3.73Å; E894-K897 PolarHBondContact OE2-NZ 3.35Å; E894-K897 VanDerWaalsContact OE2-NZ 3.16Å
898	R	29.8	Very low	28.5	Very low	235 Å²	235	143.4 Å²	143.4	89%	0.887	71%	0.71	S	S	*	*			trans	-138.9	139.4	160.2	-88.8	-174.3	172.3	170	-1.7	108.4	V900	R898-V900 PolarHBondContact O-N 3.06Å
899	P	26.7	Very low	28.8	Very low	136 Å²	136	135.9 Å²	135.9	88%	0.883	69%	0.69	S	S	*	*			trans	-74.3	117.4	-175.1	29.3	-33.8	0	0	0	111
900	V	27.4	Very low	29.2	Very low	106 Å²	106	136 Å²	136	64%	0.642	68%	0.68	S	S	*	*			trans	-120.8	127	166.8	-176.4	0	0	0	0	107.3	R898 K902	R898-V900 PolarHBondContact O-N 3.06Å; V900-K902 HydrophobicContact CB-CG 4.08Å; V900-K902 HydrophobicContact CG1-CG 3.75Å; V900-K902 PolarHBondContact O-N 3.37Å
901	R	26.4	Very low	29.5	Very low	239 Å²	239	130.7 Å²	130.7	90%	0.902	65%	0.645	S	S	*	*			trans	-67.9	76.1	168.4	-76.2	-177.9	171.5	175.3	-4.2	109.5	Y903	R901-Y903 PolarHBondContact O-N 3.37Å
902	K	25.9	Very low	29.9	Very low	168 Å²	168	128.4 Å²	128.4	73%	0.73	64%	0.637	S	S	*	*			trans	-82.6	84	175.1	-74	-173.4	176.7	179.8	0	110.2	V900	V900-K902 HydrophobicContact CB-CG 4.08Å; V900-K902 HydrophobicContact CG1-CG 3.75Å; V900-K902 PolarHBondContact O-N 3.37Å
903	Y	28.6	Very low	30.3	Very low	157 Å²	157	129.3 Å²	129.3	62%	0.616	64%	0.636	S	S	*	*			trans	-68.6	135.9	149.8	-67.7	-85.7	0	0	0	107.5	R901 T905	R901-Y903 PolarHBondContact O-N 3.37Å; Y903-T905 PolarHBondContact O-N 3.03Å
904	L	27.4	Very low	30.7	Very low	125 Å²	125	127.2 Å²	127.2	65%	0.654	62%	0.624	S	S	*	*			trans	-76.6	96.3	-167.1	-83.1	76.3	0	0	0	112	L965	L904-L965 HydrophobicContact CD1-CD2 4.46Å
905	T	31	Very low	31.1	Very low	111 Å²	111	126.1 Å²	126.1	68%	0.681	62%	0.621	S	S	*	*			trans	-66	126.1	141.3	52.5	0	0	0	0	108.2	Y903 S907	Y903-T905 PolarHBondContact O-N 3.03Å; T905-S907 PolarHBondContact O-N 2.99Å
906	I	32.7	Very low	31.7	Very low	87 Å²	87	125.7 Å²	125.7	45%	0.446	62%	0.616	S	S	.	*			trans	-67.1	106.2	172.3	-62.1	174.2	0	0	0	107.6	L693 H910 M911	L693-I906 HydrophobicContact CD1-CD1 3.79Å; I906-H910 HydrophobicContact CG2-CB 3.95Å; I906-M911 HydrophobicContact CG2-CG 4.14Å; I906-M911 HydrophobicContact CG2-SD 3.98Å
907	S	32	Very low	32.1	Very low	69 Å²	69	123.5 Å²	123.5	48%	0.483	60%	0.598	S	S	.	*			trans	-61.5	144.9	178.7	172.7	0	0	0	0	110.7	T905 G909 H910 M911	T905-S907 PolarHBondContact O-N 2.99Å; S907-G909 PolarHBondContact O-N 2.95Å; S907-H910 WeakPolarHBondContact O-CB 3.5Å; S907-H910 PolarHBondContact O-N 3.05Å; S907-M911 PolarHBondContact O-N 2.92Å
908	S	34.5	Very low	32.6	Very low	90 Å²	90	121.4 Å²	121.4	63%	0.629	59%	0.591	S	S	*	*	H	α-helix	trans	-54	-29.8	179.9	54.4	0	0	0	0	113.4	H910 M911 H912	S908-H910 PolarHBondContact O-N 3.41Å; S908-M911 WeakPolarHBondContact O-CB 3.36Å; S908-M911 PolarHBondContact O-N 2.83Å; S908-H912 PolarHBondContact O-N 2.82Å
909	G	32.4	Very low	32.9	Very low	44 Å²	44	114 Å²	114	45%	0.454	57%	0.569	S	S	.	*	H	α-helix	trans	-65.3	-18.1	173.8	0	0	0	0	0	115.2	S907	S907-G909 PolarHBondContact O-N 2.95Å
910	H	36	Very low	33.4	Very low	127 Å²	127	111 Å²	111	59%	0.588	54%	0.544	S	S	*	.	H	α-helix	trans	-87.3	-39.9	169.1	-72.2	77.3	0	0	0	111.4	I906 S907 S908 H912 K913 I914	I906-H910 HydrophobicContact CG2-CB 3.95Å; S907-H910 WeakPolarHBondContact O-CB 3.5Å; S907-H910 PolarHBondContact O-N 3.05Å; S908-H910 PolarHBondContact O-N 3.41Å; H910-H912 VanDerWaalsContact C-N 3.27Å; H910-H912 PolarHBondContact O-N 2.9Å; H910-K913 PolarHBondContact O-N 3.08Å; H910-K913 VanDerWaalsContact O-N 3.13Å; H910-I914 WeakPolarHBondContact O-CG1 3.5Å; H910-I914 PolarHBondContact O-N 2.96Å; H910-I914 VanDerWaalsContact O-N 3.15Å
911	M	34.7	Very low	33.9	Very low	33 Å²	33	110 Å²	110	16%	0.163	54%	0.535	C	S	.	.	H	α-helix	trans	-54.8	-45.2	174	-59.5	-73.6	-95.8	0	0	110.9	T474 L693 I906 S907 S908 K913 I914 L915	T474-M911 HydrophobicContact CG2-CE 3.76Å; L693-M911 HydrophobicContact CD1-CE 4.04Å; L693-M911 HydrophobicContact CD1-SD 3.86Å; L693-M911 HydrophobicContact CD2-CE 3.89Å; L693-M911 HydrophobicContact CD2-SD 4.07Å; L693-M911 HydrophobicContact CG-CE 4.14Å; L693-M911 HydrophobicContact CG-SD 4.44Å; I906-M911 HydrophobicContact CG2-CG 4.14Å; I906-M911 HydrophobicContact CG2-SD 3.98Å; S907-M911 PolarHBondContact O-N 2.92Å; S908-M911 WeakPolarHBondContact O-CB 3.36Å; S908-M911 PolarHBondContact O-N 2.83Å; M911-K913 PolarHBondContact O-N 3.36Å; M911-I914 PolarHBondContact O-N 2.62Å; M911-I914 VanDerWaalsContact O-N 3.14Å; M911-L915 PolarHBondContact O-N 3.22Å
912	H	37.8	Very low	34.3	Very low	147 Å²	147	100.6 Å²	100.6	68%	0.681	51%	0.513	S	S	*	.	H	α-helix	trans	-61.9	-28.8	-179.3	-135.9	-67.6	0	0	0	113.6	S908 H910 Y916	S908-H912 PolarHBondContact O-N 2.82Å; H910-H912 VanDerWaalsContact C-N 3.27Å; H910-H912 PolarHBondContact O-N 2.9Å; H912-Y916 VanDerWaalsContact O-CB 3.23Å; H912-Y916 WeakPolarHBondContact O-CB 3.28Å; H912-Y916 PolarHBondContact O-N 2.78Å
913	K	35.6	Very low	34.7	Very low	142 Å²	142	98.3 Å²	98.3	62%	0.617	51%	0.509	S	S	*	.	H	α-helix	trans	-78.9	-39.7	174	-71.3	-164.9	173.6	-165.5	0	112.2	H910 M911 Y916 Y917	H910-K913 PolarHBondContact O-N 3.08Å; H910-K913 VanDerWaalsContact O-N 3.13Å; M911-K913 PolarHBondContact O-N 3.36Å; K913-Y916 PolarHBondContact O-N 3.31Å; K913-Y917 WeakPolarHBondContact O-CD2 3.48Å; K913-Y917 PolarHBondContact O-N 3.21Å; K913-Y917 VanDerWaalsContact O-N 3.1Å
914	I	37.8	Very low	34.9	Very low	81 Å²	81	97.1 Å²	97.1	42%	0.415	51%	0.513	S	S	.	.	H	α-helix	trans	-64.2	-49	179.7	-65	166.8	0	0	0	110.2	H910 M911 Y916 Y917 Q918	H910-I914 WeakPolarHBondContact O-CG1 3.5Å; H910-I914 PolarHBondContact O-N 2.96Å; H910-I914 VanDerWaalsContact O-N 3.15Å; M911-I914 PolarHBondContact O-N 2.62Å; M911-I914 VanDerWaalsContact O-N 3.14Å; I914-Y916 VanDerWaalsContact C-N 3.34Å; I914-Y916 PolarHBondContact O-N 3.28Å; I914-Y917 PolarHBondContact O-N 2.88Å; I914-Q918 PolarHBondContact O-N 2.85Å
915	L	37.7	Very low	35.2	Very low	63 Å²	63	97.1 Å²	97.1	33%	0.33	52%	0.518	S	S	.	.	H	α-helix	trans	-63	-38.2	177.4	-67	170.4	0	0	0	112.5	M911 Q918 N919	M911-L915 PolarHBondContact O-N 3.22Å; L915-Q918 PolarHBondContact O-N 3.17Å; L915-N919 PolarHBondContact O-N 2.95Å
916	Y	38.3	Very low	35.2	Very low	143 Å²	143	96 Å²	96	56%	0.561	51%	0.514	S	S	*	.	H	α-helix	trans	-60.4	-45.3	175.2	179.7	-98.3	0	0	0	112.3	H912 K913 I914 Q918 N919 I920	H912-Y916 VanDerWaalsContact O-CB 3.23Å; H912-Y916 WeakPolarHBondContact O-CB 3.28Å; H912-Y916 PolarHBondContact O-N 2.78Å; K913-Y916 PolarHBondContact O-N 3.31Å; I914-Y916 VanDerWaalsContact C-N 3.34Å; I914-Y916 PolarHBondContact O-N 3.28Å; Y916-Q918 VanDerWaalsContact C-N 3.35Å; Y916-Q918 PolarHBondContact O-N 3.05Å; Y916-N919 PolarHBondContact O-N 3.49Å; Y916-I920 HydrophobicContact CD1-CD1 3.9Å; Y916-I920 HydrophobicContact CE1-CD1 3.39Å; Y916-I920 HydrophobicContact CE2-CD1 4.43Å; Y916-I920 PolarHBondContact O-N 2.91Å; Y916-I920 VanDerWaalsContact O-N 3.17Å
917	Y	35.4	Very low	35.2	Very low	140 Å²	140	98.4 Å²	98.4	55%	0.549	53%	0.528	S	S	.	.	H	α-helix	trans	-67.9	-31.9	175.4	-74.2	-62	0	0	0	113.1	K913 I914 I921	K913-Y917 WeakPolarHBondContact O-CD2 3.48Å; K913-Y917 PolarHBondContact O-N 3.21Å; K913-Y917 VanDerWaalsContact O-N 3.1Å; I914-Y917 PolarHBondContact O-N 2.88Å; Y917-I921 WeakPolarHBondContact O-CD1 3.12Å; Y917-I921 WeakPolarHBondContact O-CG1 3.26Å; Y917-I921 PolarHBondContact O-N 3.12Å
918	Q	36.8	Very low	35.1	Very low	106 Å²	106	102.7 Å²	102.7	50%	0.495	55%	0.546	S	S	.	.	H	α-helix	trans	-67.5	-41.3	173.9	-72.4	179.2	-74.5	0	0	112.3	I914 L915 Y916 I920 I921 G922	I914-Q918 PolarHBondContact O-N 2.85Å; L915-Q918 PolarHBondContact O-N 3.17Å; Y916-Q918 VanDerWaalsContact C-N 3.35Å; Y916-Q918 PolarHBondContact O-N 3.05Å; Q918-I920 PolarHBondContact O-N 3.49Å; Q918-I921 PolarHBondContact O-N 3.49Å; Q918-G922 PolarHBondContact O-N 2.69Å
919	N	35.6	Very low	34.8	Very low	79 Å²	79	106.2 Å²	106.2	42%	0.422	56%	0.557	S	S	.	*	H	α-helix	trans	-64.2	-38.1	176.1	-73.4	2.3	0	0	0	112.3	L915 Y916 I921 G922 N923	L915-N919 PolarHBondContact O-N 2.95Å; Y916-N919 PolarHBondContact O-N 3.49Å; N919-I921 VanDerWaalsContact C-N 3.29Å; N919-I921 PolarHBondContact O-N 3.37Å; N919-G922 PolarHBondContact O-N 3.39Å; N919-N923 WeakPolarHBondContact O-CB 3.26Å; N919-N923 PolarHBondContact O-N 3.25Å; N919-N923 PolarHBondContact O-OD1 3.34Å
920	I	37.6	Very low	34.8	Very low	73 Å²	73	111.6 Å²	111.6	37%	0.374	58%	0.576	S	S	.	*	H	α-helix	trans	-63.4	-36.3	174.2	-70.7	173.3	0	0	0	111.4	Y916 Q918 N924	Y916-I920 HydrophobicContact CD1-CD1 3.9Å; Y916-I920 HydrophobicContact CE1-CD1 3.39Å; Y916-I920 HydrophobicContact CE2-CD1 4.43Å; Y916-I920 PolarHBondContact O-N 2.91Å; Y916-I920 VanDerWaalsContact O-N 3.17Å; Q918-I920 PolarHBondContact O-N 3.49Å; I920-N924 PolarHBondContact O-ND2 3.46Å
921	I	37.4	Very low	34.6	Very low	85 Å²	85	111.9 Å²	111.9	44%	0.436	58%	0.581	S	S	.	*	H	α-helix	trans	-74.4	-36.3	178.1	-66.4	165.6	0	0	0	111.3	Y917 Q918 N919 V925 T951	Y917-I921 WeakPolarHBondContact O-CD1 3.12Å; Y917-I921 WeakPolarHBondContact O-CG1 3.26Å; Y917-I921 PolarHBondContact O-N 3.12Å; Q918-I921 PolarHBondContact O-N 3.49Å; N919-I921 VanDerWaalsContact C-N 3.29Å; N919-I921 PolarHBondContact O-N 3.37Å; I921-V925 WeakPolarHBondContact O-CG2 3.24Å; I921-T951 HydrophobicContact CD1-CG2 3.99Å; I921-T951 HydrophobicContact CG2-CG2 4.49Å
922	G	34.3	Very low	34.6	Very low	43 Å²	43	117 Å²	117	44%	0.443	61%	0.61	S	S	.	*	H	α-helix	trans	-64.7	-46.5	175.7	0	0	0	0	0	113.2	Q918 N919 N924 V925	Q918-G922 PolarHBondContact O-N 2.69Å; N919-G922 PolarHBondContact O-N 3.39Å; G922-N924 PolarHBondContact O-N 3.25Å; G922-N924 VanDerWaalsContact O-N 3.16Å; G922-V925 PolarHBondContact O-N 3.36Å
923	N	34.2	Very low	34.2	Very low	120 Å²	120	116.7 Å²	116.7	64%	0.642	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-0	-175.4	-68.8	23.7	0	0	0	114.6	N919	N919-N923 WeakPolarHBondContact O-CB 3.26Å; N919-N923 PolarHBondContact O-N 3.25Å; N919-N923 PolarHBondContact O-OD1 3.34Å
924	N	32.9	Very low	34	Very low	131 Å²	131	116.7 Å²	116.7	70%	0.701	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.5	17.9	176.5	-78.4	-81.2	0	0	0	112.8	I920 G922	I920-N924 PolarHBondContact O-ND2 3.46Å; G922-N924 PolarHBondContact O-N 3.25Å; G922-N924 VanDerWaalsContact O-N 3.16Å
925	V	34.3	Very low	33.6	Very low	126 Å²	126	119.4 Å²	119.4	76%	0.764	64%	0.635	S	S	*	*	S	Bend	trans	-123.9	6.5	-179.8	-176.3	0	0	0	0	111.4	I921 G922	I921-V925 WeakPolarHBondContact O-CG2 3.24Å; G922-V925 PolarHBondContact O-N 3.36Å
926	S	31.5	Very low	33.2	Very low	86 Å²	86	124 Å²	124	60%	0.601	65%	0.654	S	S	*	*	S	Bend	trans	-125.2	20.5	-171.3	60.8	0	0	0	0	115.1
927	D	31.3	Very low	32.7	Very low	138 Å²	138	123 Å²	123	74%	0.738	66%	0.659	S	S	*	*			trans	-139.8	89.8	175.5	-80.3	-59	0	0	0	110
928	N	30.1	Very low	32.3	Very low	160 Å²	160	123.2 Å²	123.2	86%	0.856	67%	0.669	S	S	*	*			trans	167.9	96.5	158.3	-93.2	-27.9	0	0	0	109.4
929	N	29.6	Very low	31.9	Very low	163 Å²	163	124.3 Å²	124.3	87%	0.872	68%	0.684	S	S	*	*			trans	-179.3	94.5	155.1	-99	-20.2	0	0	0	109.3
930	N	31.2	Very low	31.5	Very low	157 Å²	157	127.7 Å²	127.7	84%	0.84	70%	0.702	S	S	*	*			trans	-165.3	157.9	159.4	-101.7	-18.1	0	0	0	108.7
931	N	33.2	Very low	31.1	Very low	133 Å²	133	132.3 Å²	132.3	71%	0.711	73%	0.725	S	S	*	*			trans	74.1	91.3	175.5	-62.1	40	0	0	0	117.4
932	D	34.2	Very low	30.7	Very low	141 Å²	141	136.6 Å²	136.6	75%	0.754	74%	0.741	S	S	*	*				77.6	133.4	117.2	-51.3	-35.7	0	0	0	122.9
933	N	29.6	Very low	30.4	Very low	141 Å²	141	141.3 Å²	141.3	75%	0.754	76%	0.756	S	S	*	*			trans	-61.9	139.9	170.2	-41.4	-76.6	0	0	0	110.3
934	N	30.3	Very low	30.1	Very low	142 Å²	142	144.7 Å²	144.7	76%	0.759	77%	0.765	S	S	*	*				-179.2	161.5	88.7	-88.9	-41	0	0	0	112.7
935	N	29.6	Very low	29.8	Very low	138 Å²	138	143.1 Å²	143.1	74%	0.738	76%	0.764	S	S	*	*			trans	59.7	114.5	151.5	-67.1	-5.8	0	0	0	121.7
936	H	29.8	Very low	29.5	Very low	158 Å²	158	144 Å²	144	73%	0.731	76%	0.763	S	S	*	*			trans	68	123.3	131.1	-83	-60.3	0	0	0	123
937	N	27.9	Very low	29.6	Very low	123 Å²	123	144 Å²	144	66%	0.658	76%	0.764	S	S	*	*			trans	84.2	107.1	134	-60.6	-8.4	0	0	0	121.1
938	N	26.4	Very low	29.6	Very low	144 Å²	144	143.3 Å²	143.3	77%	0.77	76%	0.758	S	S	*	*			trans	79.7	153.3	132.1	-69.9	-5.9	0	0	0	122.2
939	T	28	Very low	29.7	Very low	130 Å²	130	140 Å²	140	80%	0.798	74%	0.744	S	S	*	*			trans	70.5	120.6	164.9	45.3	0	0	0	0	119.8
940	D	28.7	Very low	30	Very low	149 Å²	149	136.3 Å²	136.3	80%	0.797	73%	0.731	S	S	*	*			trans	-47.3	133.5	175.1	-59.1	-93.9	0	0	0	117
941	I	29.3	Very low	30.1	Very low	170 Å²	170	131.3 Å²	131.3	87%	0.872	71%	0.706	S	S	*	*			trans	-133.1	140.3	141.9	-82.9	102.8	0	0	0	109.9
942	K	29.1	Very low	30.4	Very low	176 Å²	176	129.8 Å²	129.8	77%	0.765	70%	0.698	S	S	*	*			trans	-87.8	144.9	-168.1	-66.7	167.8	-179.6	167.2	0	113.9
943	N	26.4	Very low	30.9	Very low	141 Å²	141	128.3 Å²	128.3	75%	0.754	69%	0.69	S	S	*	*			trans	56	118	144.9	-64.3	-22.7	0	0	0	120.4
944	K	27.9	Very low	31.6	Very low	192 Å²	192	125.9 Å²	125.9	84%	0.835	68%	0.677	S	S	*	*			trans	-141.4	54.5	153.1	-140.7	170.3	-169.4	174.5	0	113.3	I946	K944-I946 PolarHBondContact O-N 3.33Å
945	S	27.8	Very low	32.1	Very low	98 Å²	98	121.9 Å²	121.9	69%	0.685	66%	0.657	S	S	*	*			trans	-72.4	44.3	-177.8	45.4	0	0	0	0	114.8
946	I	27.7	Very low	33.1	Very low	143 Å²	143	117 Å²	117	73%	0.733	64%	0.637	S	S	*	*			trans	-116	73.8	-168.9	-47.4	179.1	0	0	0	111.2	K944	K944-I946 PolarHBondContact O-N 3.33Å
947	S	32.7	Very low	34	Very low	88 Å²	88	113.7 Å²	113.7	62%	0.615	62%	0.624	S	S	*	*	S	Bend	trans	-155.6	-51.5	169.8	56.9	0	0	0	0	113.4	T949	S947-T949 PolarHBondContact O-N 2.84Å
948	I	31.9	Very low	34.9	Very low	123 Å²	123	110.1 Å²	110.1	63%	0.631	61%	0.606	S	S	*	*	H	α-helix	trans	-73	-29.9	-169	-60	172	0	0	0	113.5	S950 T951 N952	I948-S950 PolarHBondContact O-N 3.15Å; I948-T951 PolarHBondContact O-OG1 3.06Å; I948-N952 PolarHBondContact O-ND2 3.33Å
949	T	32	Very low	36	Very low	90 Å²	90	108 Å²	108	55%	0.552	59%	0.59	S	S	*	*	H	α-helix	trans	-72.1	-28.4	-172.3	-31.7	0	0	0	0	113.5	S947 N953	S947-T949 PolarHBondContact O-N 2.84Å; T949-N953 WeakPolarHBondContact O-CB 3.47Å; T949-N953 PolarHBondContact O-N 3.44Å; T949-N953 PolarHBondContact O-ND2 2.84Å
950	S	35.6	Very low	37.4	Very low	86 Å²	86	111.1 Å²	111.1	60%	0.601	59%	0.587	S	S	*	*	H	α-helix	trans	-77.3	-42.2	-171.7	-164	0	0	0	0	112.9	I948 N953 L954	I948-S950 PolarHBondContact O-N 3.15Å; S950-N953 PolarHBondContact O-N 3.12Å; S950-L954 PolarHBondContact O-N 3.16Å
951	T	34	Very low	38.7	Very low	52 Å²	52	110.2 Å²	110.2	32%	0.319	58%	0.576	S	S	.	*	H	α-helix	trans	-63.6	-42	176.7	48	0	0	0	0	111.8	I921 I948 L954 T955	I921-T951 HydrophobicContact CD1-CG2 3.99Å; I921-T951 HydrophobicContact CG2-CG2 4.49Å; I948-T951 PolarHBondContact O-OG1 3.06Å; T951-L954 PolarHBondContact O-N 2.95Å; T951-T955 WeakPolarHBondContact O-CB 3.26Å; T951-T955 PolarHBondContact O-N 3.36Å; T951-T955 PolarHBondContact O-OG1 2.99Å
952	N	39.1	Very low	39.7	Very low	101 Å²	101	104.4 Å²	104.4	54%	0.54	55%	0.547	S	S	.	.	H	α-helix	trans	-62.5	-44.5	175.1	-75.1	-31.5	0	0	0	111.9	I948 T955 A956	I948-N952 PolarHBondContact O-ND2 3.33Å; N952-T955 PolarHBondContact O-N 2.77Å; N952-A956 WeakPolarHBondContact O-CB 3.49Å; N952-A956 PolarHBondContact O-N 3.45Å
953	N	45.6	Very low	40.9	Very low	109 Å²	109	103.6 Å²	103.6	58%	0.583	54%	0.54	S	S	*	.	H	α-helix	trans	-63.6	-41.8	176.1	-81.6	-30.6	0	0	0	113	T949 S950 A956 L957	T949-N953 WeakPolarHBondContact O-CB 3.47Å; T949-N953 PolarHBondContact O-N 3.44Å; T949-N953 PolarHBondContact O-ND2 2.84Å; S950-N953 PolarHBondContact O-N 3.12Å; N953-A956 PolarHBondContact O-N 2.91Å; N953-L957 WeakPolarHBondContact O-CB 3.43Å; N953-L957 PolarHBondContact O-N 3.5Å
954	L	43.6	Very low	42.4	Very low	91 Å²	91	99 Å²	99	48%	0.476	52%	0.519	S	S	.	.	H	α-helix	trans	-64.9	-43	176.2	-171.4	66.5	0	0	0	111.5	S950 T951 L957 V958	S950-L954 PolarHBondContact O-N 3.16Å; T951-L954 PolarHBondContact O-N 2.95Å; L954-L957 WeakPolarHBondContact O-CB 3.34Å; L954-L957 PolarHBondContact O-N 2.97Å; L954-V958 WeakPolarHBondContact O-CG2 3.44Å; L954-V958 PolarHBondContact O-N 3.27Å
955	T	42.1	Very low	43.4	Very low	57 Å²	57	93.2 Å²	93.2	35%	0.35	50%	0.497	S	S	.	.	H	α-helix	trans	-62.2	-43.4	177	-56.3	0	0	0	0	111.4	T951 N952 L957 V958 K959	T951-T955 WeakPolarHBondContact O-CB 3.26Å; T951-T955 PolarHBondContact O-N 3.36Å; T951-T955 PolarHBondContact O-OG1 2.99Å; N952-T955 PolarHBondContact O-N 2.77Å; T955-L957 VanDerWaalsContact C-N 3.34Å; T955-L957 PolarHBondContact O-N 3.47Å; T955-V958 PolarHBondContact O-N 3.25Å; T955-K959 HydrophobicContact CG2-CD 4.25Å; T955-K959 WeakPolarHBondContact O-CB 3.29Å; T955-K959 WeakPolarHBondContact O-CG 3.1Å; T955-K959 PolarHBondContact O-N 3.32Å
956	A	49.3	Very low	44.5	Very low	37 Å²	37	91.6 Å²	91.6	31%	0.306	48%	0.478	S	S	.	.	H	α-helix	trans	-63.1	-38.1	174.5	0	0	0	0	0	112.4	N952 N953 R960	N952-A956 WeakPolarHBondContact O-CB 3.49Å; N952-A956 PolarHBondContact O-N 3.45Å; N953-A956 PolarHBondContact O-N 2.91Å; A956-R960 WeakPolarHBondContact O-CB 3.5Å; A956-R960 VanDerWaalsContact O-CG 3.29Å; A956-R960 WeakPolarHBondContact O-CG 3.36Å; A956-R960 PolarHBondContact O-N 2.63Å
957	L	48.8	Very low	46.1	Very low	87 Å²	87	87 Å²	87	46%	0.455	46%	0.457	S	S	.	.	H	α-helix	trans	-66.2	-40.5	176.3	-172.4	71.2	0	0	0	112.3	N953 L954 T955 K961	N953-L957 WeakPolarHBondContact O-CB 3.43Å; N953-L957 PolarHBondContact O-N 3.5Å; L954-L957 WeakPolarHBondContact O-CB 3.34Å; L954-L957 PolarHBondContact O-N 2.97Å; T955-L957 VanDerWaalsContact C-N 3.34Å; T955-L957 PolarHBondContact O-N 3.47Å; L957-K961 WeakPolarHBondContact O-CG 3.45Å; L957-K961 PolarHBondContact O-N 2.86Å; L957-K961 VanDerWaalsContact O-N 3.08Å
958	V	47.3	Very low	47.3	Very low	48 Å²	48	88.4 Å²	88.4	29%	0.291	45%	0.452	S	S	.	.	H	α-helix	trans	-67.3	-49	175.9	174.4	0	0	0	0	110.5	E697 L954 T955 R960 K961 L962	E697-V958 WeakPolarHBondContact OE1-CG1 3.49Å; L954-V958 WeakPolarHBondContact O-CG2 3.44Å; L954-V958 PolarHBondContact O-N 3.27Å; T955-V958 PolarHBondContact O-N 3.25Å; V958-R960 PolarHBondContact O-N 3.26Å; V958-K961 PolarHBondContact O-N 3.31Å; V958-L962 HydrophobicContact CG1-CD1 3.93Å; V958-L962 HydrophobicContact CG1-CG 4.29Å; V958-L962 PolarHBondContact O-N 3.37Å
959	K	49.2	Very low	48.1	Very low	101 Å²	101	83.1 Å²	83.1	44%	0.439	43%	0.427	S	S	.	.	H	α-helix	trans	-55.4	-46.7	175.5	-73.7	178.5	177.9	179.9	0	112.1	T955 K961 L962 Y963	T955-K959 HydrophobicContact CG2-CD 4.25Å; T955-K959 WeakPolarHBondContact O-CB 3.29Å; T955-K959 WeakPolarHBondContact O-CG 3.1Å; T955-K959 PolarHBondContact O-N 3.32Å; K959-K961 VanDerWaalsContact C-N 3.34Å; K959-K961 PolarHBondContact O-N 3.33Å; K959-L962 PolarHBondContact O-N 3Å; K959-Y963 WeakPolarHBondContact O-CB 3.44Å; K959-Y963 PolarHBondContact O-N 3.07Å
960	R	57.2	Low	49.3	Very low	194 Å²	194	85 Å²	85	73%	0.732	43%	0.427	S	S	*	.	H	α-helix	trans	-60.1	-39.2	174.9	-76.8	173.9	174.7	166.8	-0.9	112.8	A956 V958 S964	A956-R960 WeakPolarHBondContact O-CB 3.5Å; A956-R960 VanDerWaalsContact O-CG 3.29Å; A956-R960 WeakPolarHBondContact O-CG 3.36Å; A956-R960 PolarHBondContact O-N 2.63Å; V958-R960 PolarHBondContact O-N 3.26Å; R960-S964 WeakPolarHBondContact O-CB 3.45Å; R960-S964 PolarHBondContact O-N 3.44Å
961	K	57.2	Low	50.5	Low	131 Å²	131	85.2 Å²	85.2	57%	0.57	42%	0.419	S	S	*	.	H	α-helix	trans	-70	-42.8	176.5	-79.2	178.1	177.6	175.6	0	112.7	L957 V958 K959 S964 L965	L957-K961 WeakPolarHBondContact O-CG 3.45Å; L957-K961 PolarHBondContact O-N 2.86Å; L957-K961 VanDerWaalsContact O-N 3.08Å; V958-K961 PolarHBondContact O-N 3.31Å; K959-K961 VanDerWaalsContact C-N 3.34Å; K959-K961 PolarHBondContact O-N 3.33Å; K961-S964 PolarHBondContact O-N 2.92Å; K961-L965 WeakPolarHBondContact O-CG 3.37Å; K961-L965 PolarHBondContact O-N 3.11Å
962	L	49.9	Very low	51.2	Low	48 Å²	48	84.4 Å²	84.4	25%	0.251	42%	0.415	S	S	.	.	H	α-helix	trans	-62	-47.5	175.9	-72.4	173.4	0	0	0	110.8	L694 V958 K959 S964 L965 Q966	L694-L962 HydrophobicContact CD2-CD1 4.02Å; V958-L962 HydrophobicContact CG1-CD1 3.93Å; V958-L962 HydrophobicContact CG1-CG 4.29Å; V958-L962 PolarHBondContact O-N 3.37Å; K959-L962 PolarHBondContact O-N 3Å; L962-S964 PolarHBondContact O-N 2.86Å; L962-L965 WeakPolarHBondContact O-CB 3.47Å; L962-L965 PolarHBondContact O-N 2.82Å; L962-Q966 WeakPolarHBondContact O-CG 3.47Å; L962-Q966 PolarHBondContact O-N 3.18Å
963	Y	53.5	Low	51.7	Low	159 Å²	159	82.8 Å²	82.8	62%	0.624	40%	0.402	S	S	*	.	H	α-helix	trans	-59.9	-44.1	176.8	-161.7	-99.4	0	0	0	111.9	K959 L965 Q966 T967	K959-Y963 WeakPolarHBondContact O-CB 3.44Å; K959-Y963 PolarHBondContact O-N 3.07Å; Y963-L965 VanDerWaalsContact C-N 3.27Å; Y963-L965 PolarHBondContact O-N 3.35Å; Y963-Q966 PolarHBondContact O-N 3.13Å; Y963-Q966 VanDerWaalsContact O-N 3.11Å; Y963-T967 HydrophobicContact CD1-CG2 4.12Å; Y963-T967 HydrophobicContact CE1-CG2 3.96Å; Y963-T967 PolarHBondContact O-N 3.27Å
964	S	57.6	Low	52.1	Low	45 Å²	45	81.5 Å²	81.5	32%	0.315	40%	0.395	S	S	.	.	H	α-helix	trans	-66.2	-24.1	175.5	-166.6	0	0	0	0	114.1	R960 K961 L962 T967 K968	R960-S964 WeakPolarHBondContact O-CB 3.45Å; R960-S964 PolarHBondContact O-N 3.44Å; K961-S964 PolarHBondContact O-N 2.92Å; L962-S964 PolarHBondContact O-N 2.86Å; S964-T967 PolarHBondContact O-OG1 2.99Å; S964-K968 VanDerWaalsContact O-CD 3.3Å; S964-K968 WeakPolarHBondContact O-CD 3.36Å; S964-K968 VanDerWaalsContact O-CG 3.31Å; S964-K968 WeakPolarHBondContact O-CG 3.29Å; S964-K968 PolarHBondContact OG-NZ 3.28Å
965	L	49.6	Very low	52.3	Low	69 Å²	69	84.7 Å²	84.7	36%	0.361	40%	0.401	S	S	.	.	H	α-helix	trans	-79	-35.8	171	-72	167.7	0	0	0	111.3	L904 K961 L962 Y963 A969	L904-L965 HydrophobicContact CD1-CD2 4.46Å; K961-L965 WeakPolarHBondContact O-CG 3.37Å; K961-L965 PolarHBondContact O-N 3.11Å; L962-L965 WeakPolarHBondContact O-CB 3.47Å; L962-L965 PolarHBondContact O-N 2.82Å; Y963-L965 VanDerWaalsContact C-N 3.27Å; Y963-L965 PolarHBondContact O-N 3.35Å; L965-A969 VanDerWaalsContact O-CB 3.32Å; L965-A969 WeakPolarHBondContact O-CB 3.4Å; L965-A969 PolarHBondContact O-N 2.96Å
966	Q	49.9	Very low	52.4	Low	64 Å²	64	87.7 Å²	87.7	30%	0.299	41%	0.414	S	S	.	.	H	α-helix	trans	-68	-43.7	175.4	-72.7	174.9	-54.5	0	0	112.5	L962 Y963 K968 A969 K970	L962-Q966 WeakPolarHBondContact O-CG 3.47Å; L962-Q966 PolarHBondContact O-N 3.18Å; Y963-Q966 PolarHBondContact O-N 3.13Å; Y963-Q966 VanDerWaalsContact O-N 3.11Å; Q966-K968 PolarHBondContact O-N 3.15Å; Q966-A969 PolarHBondContact O-N 3.43Å; Q966-K970 WeakPolarHBondContact O-CB 3.24Å; Q966-K970 PolarHBondContact O-N 2.95Å
967	T	61.4	Low	52.2	Low	47 Å²	47	94.6 Å²	94.6	29%	0.288	43%	0.432	S	S	.	.	H	α-helix	trans	-61	-47.1	175.5	63.7	0	0	0	0	110.7	Y963 S964 A969 K970 E971	Y963-T967 HydrophobicContact CD1-CG2 4.12Å; Y963-T967 HydrophobicContact CE1-CG2 3.96Å; Y963-T967 PolarHBondContact O-N 3.27Å; S964-T967 PolarHBondContact O-OG1 2.99Å; T967-A969 VanDerWaalsContact C-N 3.3Å; T967-A969 PolarHBondContact O-N 3.04Å; T967-K970 CarbonylContact O-C 3.51Å; T967-K970 PolarHBondContact O-N 3.37Å; T967-K970 VanDerWaalsContact O-N 3.08Å; T967-E971 WeakPolarHBondContact O-CB 3.17Å; T967-E971 VanDerWaalsContact O-CG 3.28Å; T967-E971 WeakPolarHBondContact O-CG 3.43Å; T967-E971 PolarHBondContact O-N 3.41Å
968	K	58.8	Low	52.1	Low	117 Å²	117	92.6 Å²	92.6	51%	0.509	43%	0.425	S	S	.	.	H	α-helix	trans	-63.1	-32	176.1	-71.2	171.1	-175.7	137.6	0	113.3	S964 Q966 S972	S964-K968 VanDerWaalsContact O-CD 3.3Å; S964-K968 WeakPolarHBondContact O-CD 3.36Å; S964-K968 VanDerWaalsContact O-CG 3.31Å; S964-K968 WeakPolarHBondContact O-CG 3.29Å; S964-K968 PolarHBondContact OG-NZ 3.28Å; Q966-K968 PolarHBondContact O-N 3.15Å; K968-S972 WeakPolarHBondContact O-CB 3.14Å; K968-S972 PolarHBondContact O-N 2.97Å; K968-S972 PolarHBondContact O-OG 3.14Å
969	A	48.5	Very low	51.8	Low	13 Å²	13	94.8 Å²	94.8	11%	0.107	44%	0.435	C	S	.	.	H	α-helix	trans	-70	-42.4	171.7	0	0	0	0	0	111.8	L965 Q966 T967 S972 R973	L965-A969 VanDerWaalsContact O-CB 3.32Å; L965-A969 WeakPolarHBondContact O-CB 3.4Å; L965-A969 PolarHBondContact O-N 2.96Å; Q966-A969 PolarHBondContact O-N 3.43Å; T967-A969 VanDerWaalsContact C-N 3.3Å; T967-A969 PolarHBondContact O-N 3.04Å; A969-S972 PolarHBondContact O-N 3.14Å; A969-S972 PolarHBondContact O-OG 3.16Å; A969-R973 WeakPolarHBondContact O-CB 3.28Å; A969-R973 WeakPolarHBondContact O-CG 3.36Å; A969-R973 PolarHBondContact O-N 3.24Å
970	K	56.9	Low	51.4	Low	128 Å²	128	92.9 Å²	92.9	56%	0.557	44%	0.435	S	S	*	.	H	α-helix	trans	-65.8	-45.1	176	-169.9	170.9	-178.1	173.1	0	111.7	Q966 T967 S972 R973 N974	Q966-K970 WeakPolarHBondContact O-CB 3.24Å; Q966-K970 PolarHBondContact O-N 2.95Å; T967-K970 CarbonylContact O-C 3.51Å; T967-K970 PolarHBondContact O-N 3.37Å; T967-K970 VanDerWaalsContact O-N 3.08Å; K970-S972 PolarHBondContact O-N 3.2Å; K970-R973 PolarHBondContact O-N 2.73Å; K970-N974 WeakPolarHBondContact O-CB 3.42Å; K970-N974 VanDerWaalsContact O-CG 3.27Å; K970-N974 PolarHBondContact O-N 2.71Å; K970-N974 PolarHBondContact O-OD1 3.1Å
971	E	60.4	Low	50.6	Low	92 Å²	92	87.1 Å²	87.1	43%	0.43	42%	0.421	S	S	.	.	H	α-helix	trans	-56.9	-47	172	-72.6	161.4	-137.8	0	0	111.8	T967 N974 R975	T967-E971 WeakPolarHBondContact O-CB 3.17Å; T967-E971 VanDerWaalsContact O-CG 3.28Å; T967-E971 WeakPolarHBondContact O-CG 3.43Å; T967-E971 PolarHBondContact O-N 3.41Å; E971-N974 PolarHBondContact O-N 2.67Å; E971-R975 WeakPolarHBondContact O-CB 3.22Å; E971-R975 VanDerWaalsContact O-CG 3.32Å; E971-R975 WeakPolarHBondContact O-CG 3.39Å; E971-R975 PolarHBondContact O-N 3.43Å
972	S	48.8	Very low	49.6	Very low	34 Å²	34	84.2 Å²	84.2	24%	0.238	41%	0.411	C	S	.	.	H	α-helix	trans	-73.4	-30.1	-179.9	51.5	0	0	0	0	113.4	K968 A969 K970 L976	K968-S972 WeakPolarHBondContact O-CB 3.14Å; K968-S972 PolarHBondContact O-N 2.97Å; K968-S972 PolarHBondContact O-OG 3.14Å; A969-S972 PolarHBondContact O-N 3.14Å; A969-S972 PolarHBondContact O-OG 3.16Å; K970-S972 PolarHBondContact O-N 3.2Å; S972-L976 WeakPolarHBondContact O-CB 3.18Å; S972-L976 VanDerWaalsContact O-CG 3.25Å; S972-L976 WeakPolarHBondContact O-CG 3.11Å; S972-L976 PolarHBondContact O-N 3.41Å
973	R	50	Low	49	Very low	67 Å²	67	88.7 Å²	88.7	25%	0.253	43%	0.431	S	S	.	.	H	α-helix	trans	-64.8	-45	165.7	-75.8	-178.6	-172.4	134.4	2	111.9	D684 L685 A969 K970 L976 R977	D684-R973 VanDerWaalsContact C-NH2 3.34Å; D684-R973 VanDerWaalsContact O-CZ 3.22Å; D684-R973 PolarHBondContact O-NH1 3.21Å; D684-R973 PolarHBondContact O-NH2 2.85Å; D684-R973 IonicContact OD1-NH1 2.66Å; L685-R973 PolarHBondContact O-NH2 2.76Å; A969-R973 WeakPolarHBondContact O-CB 3.28Å; A969-R973 WeakPolarHBondContact O-CG 3.36Å; A969-R973 PolarHBondContact O-N 3.24Å; K970-R973 PolarHBondContact O-N 2.73Å; R973-L976 PolarHBondContact O-N 2.98Å; R973-R977 PolarHBondContact O-N 3.47Å
974	N	53.7	Low	48	Very low	83 Å²	83	88.2 Å²	88.2	44%	0.444	43%	0.432	S	S	.	.	H	α-helix	trans	-65.4	-39.8	179.5	-74.9	7.2	0	0	0	111.3	K970 E971 R977 S978	K970-N974 WeakPolarHBondContact O-CB 3.42Å; K970-N974 VanDerWaalsContact O-CG 3.27Å; K970-N974 PolarHBondContact O-N 2.71Å; K970-N974 PolarHBondContact O-OD1 3.1Å; E971-N974 PolarHBondContact O-N 2.67Å; N974-R977 PolarHBondContact O-N 2.94Å; N974-S978 PolarHBondContact O-N 3.5Å
975	R	47.3	Very low	46.7	Very low	158 Å²	158	92.3 Å²	92.3	60%	0.596	45%	0.445	S	S	*	.	H	α-helix	trans	-66.8	-32.8	171.6	-71.2	177.6	-172.9	-161.5	2.4	113	E971 S978 L979	E971-R975 WeakPolarHBondContact O-CB 3.22Å; E971-R975 VanDerWaalsContact O-CG 3.32Å; E971-R975 WeakPolarHBondContact O-CG 3.39Å; E971-R975 PolarHBondContact O-N 3.43Å; R975-S978 PolarHBondContact O-OG 3.33Å; R975-L979 WeakPolarHBondContact O-CB 3.45Å; R975-L979 WeakPolarHBondContact O-CD1 3.48Å; R975-L979 WeakPolarHBondContact O-CG 3.45Å; R975-L979 PolarHBondContact O-N 3.17Å
976	L	45.9	Very low	45.7	Very low	120 Å²	120	95.9 Å²	95.9	63%	0.628	46%	0.463	S	S	*	.	H	α-helix	trans	-72	-35.7	172.7	-77.1	167.6	0	0	0	112	S972 R973 S980	S972-L976 WeakPolarHBondContact O-CB 3.18Å; S972-L976 VanDerWaalsContact O-CG 3.25Å; S972-L976 WeakPolarHBondContact O-CG 3.11Å; S972-L976 PolarHBondContact O-N 3.41Å; R973-L976 PolarHBondContact O-N 2.98Å; L976-S980 WeakPolarHBondContact O-CB 3.48Å; L976-S980 PolarHBondContact O-N 3.36Å; L976-S980 PolarHBondContact O-OG 3.33Å
977	R	44.4	Very low	44.7	Very low	181 Å²	181	99.9 Å²	99.9	68%	0.683	49%	0.485	S	S	*	.	H	α-helix	trans	-65.4	-48.8	171	-77.1	-178.7	172.5	177.2	-3.3	111.2	R973 N974 S980 T981	R973-R977 PolarHBondContact O-N 3.47Å; N974-R977 PolarHBondContact O-N 2.94Å; R977-S980 WeakPolarHBondContact CA-OG 3.23Å; R977-S980 CarbonylContact O-C 3.49Å; R977-S980 WeakPolarHBondContact O-CA 3.4Å; R977-S980 PolarHBondContact O-N 3.43Å; R977-S980 PolarHBondContact O-OG 3.42Å; R977-T981 PolarHBondContact O-N 3.29Å; R977-T981 PolarHBondContact O-OG1 3.18Å
978	S	47.4	Very low	43.1	Very low	45 Å²	45	101.4 Å²	101.4	32%	0.315	50%	0.497	S	S	.	.	H	α-helix	trans	-62.1	-48	177.3	77.4	0	0	0	0	111	N974 R975 S980 T981 D982	N974-S978 PolarHBondContact O-N 3.5Å; R975-S978 PolarHBondContact O-OG 3.33Å; S978-S980 PolarHBondContact O-N 3.48Å; S978-S980 VanDerWaalsContact O-N 3.11Å; S978-T981 WeakPolarHBondContact CA-OG1 3.11Å; S978-T981 PolarHBondContact O-N 3.47Å; S978-T981 PolarHBondContact O-OG1 3.24Å; S978-D982 VanDerWaalsContact O-CB 3.26Å; S978-D982 WeakPolarHBondContact O-CB 3.5Å; S978-D982 PolarHBondContact O-N 3.19Å
979	L	40.8	Very low	41.5	Very low	94 Å²	94	103.4 Å²	103.4	49%	0.492	51%	0.512	S	S	.	.	H	α-helix	trans	-57.4	-30.6	173.5	-74.3	167.5	0	0	0	113	R975 Q983	R975-L979 WeakPolarHBondContact O-CB 3.45Å; R975-L979 WeakPolarHBondContact O-CD1 3.48Å; R975-L979 WeakPolarHBondContact O-CG 3.45Å; R975-L979 PolarHBondContact O-N 3.17Å; L979-Q983 VanDerWaalsContact O-CB 3.24Å; L979-Q983 WeakPolarHBondContact O-CB 3.48Å; L979-Q983 VanDerWaalsContact O-CG 3.25Å; L979-Q983 WeakPolarHBondContact O-CG 3.33Å; L979-Q983 PolarHBondContact O-N 3.2Å; L979-Q983 VanDerWaalsContact O-N 3.11Å
980	S	39.3	Very low	40.5	Very low	62 Å²	62	107.5 Å²	107.5	43%	0.434	54%	0.54	S	S	.	.	H	α-helix	trans	-75.6	-38.6	172.5	70.4	0	0	0	0	113.5	L976 R977 S978 F984	L976-S980 WeakPolarHBondContact O-CB 3.48Å; L976-S980 PolarHBondContact O-N 3.36Å; L976-S980 PolarHBondContact O-OG 3.33Å; R977-S980 WeakPolarHBondContact CA-OG 3.23Å; R977-S980 CarbonylContact O-C 3.49Å; R977-S980 WeakPolarHBondContact O-CA 3.4Å; R977-S980 PolarHBondContact O-N 3.43Å; R977-S980 PolarHBondContact O-OG 3.42Å; S978-S980 PolarHBondContact O-N 3.48Å; S978-S980 VanDerWaalsContact O-N 3.11Å; S980-F984 VanDerWaalsContact O-CD2 3.28Å; S980-F984 WeakPolarHBondContact O-CD2 3.5Å; S980-F984 PolarHBondContact O-N 3.4Å
981	T	41.4	Very low	39.1	Very low	73 Å²	73	106.8 Å²	106.8	45%	0.448	55%	0.551	S	S	.	*	H	α-helix	trans	-71.6	-36.5	175.1	52.1	0	0	0	0	111.9	R977 S978 F984 K985	R977-T981 PolarHBondContact O-N 3.29Å; R977-T981 PolarHBondContact O-OG1 3.18Å; S978-T981 WeakPolarHBondContact CA-OG1 3.11Å; S978-T981 PolarHBondContact O-N 3.47Å; S978-T981 PolarHBondContact O-OG1 3.24Å; T981-F984 CarbonylContact O-C 3.59Å; T981-F984 PolarHBondContact O-N 3.4Å; T981-K985 WeakPolarHBondContact O-CG 3.43Å; T981-K985 PolarHBondContact O-N 3.04Å
982	D	36.8	Very low	37.6	Very low	69 Å²	69	108.3 Å²	108.3	37%	0.369	57%	0.569	S	S	.	*	H	α-helix	trans	-80.5	-28.4	-174.7	-55.2	-27.7	0	0	0	111.3	S978 F984 K985	S978-D982 VanDerWaalsContact O-CB 3.26Å; S978-D982 WeakPolarHBondContact O-CB 3.5Å; S978-D982 PolarHBondContact O-N 3.19Å; D982-F984 VanDerWaalsContact C-N 3.32Å; D982-K985 IonicContact OD1-NZ 2.64Å
983	Q	36.2	Very low	36.5	Very low	143 Å²	143	112.3 Å²	112.3	67%	0.668	60%	0.597	S	S	*	*	H	α-helix	trans	-77.9	-12.4	166	-69.2	-173.9	-9.2	0	0	113.8	L979	L979-Q983 VanDerWaalsContact O-CB 3.24Å; L979-Q983 WeakPolarHBondContact O-CB 3.48Å; L979-Q983 VanDerWaalsContact O-CG 3.25Å; L979-Q983 WeakPolarHBondContact O-CG 3.33Å; L979-Q983 PolarHBondContact O-N 3.2Å; L979-Q983 VanDerWaalsContact O-N 3.11Å
984	F	33	Very low	35.5	Very low	148 Å²	148	113.8 Å²	113.8	65%	0.649	62%	0.618	S	S	*	*	H	α-helix	trans	-93.7	-25	168.1	-90.9	-102.7	0	0	0	113.3	S980 T981 D982 I986 I987 S988	S980-F984 VanDerWaalsContact O-CD2 3.28Å; S980-F984 WeakPolarHBondContact O-CD2 3.5Å; S980-F984 PolarHBondContact O-N 3.4Å; T981-F984 CarbonylContact O-C 3.59Å; T981-F984 PolarHBondContact O-N 3.4Å; D982-F984 VanDerWaalsContact C-N 3.32Å; F984-I986 PolarHBondContact O-N 3.3Å; F984-I987 PolarHBondContact O-N 2.78Å; F984-I987 VanDerWaalsContact O-N 3.14Å; F984-S988 WeakPolarHBondContact O-CB 3.47Å; F984-S988 PolarHBondContact O-N 3.16Å; F984-S988 PolarHBondContact O-OG 3.38Å
985	K	30.3	Very low	34.2	Very low	132 Å²	132	118.4 Å²	118.4	57%	0.574	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-19.1	175.1	-85	175.9	175.9	175.7	0	114.6	T981 D982	T981-K985 WeakPolarHBondContact O-CG 3.43Å; T981-K985 PolarHBondContact O-N 3.04Å; D982-K985 IonicContact OD1-NZ 2.64Å
986	I	29.4	Very low	33.3	Very low	144 Å²	144	115 Å²	115	74%	0.738	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-1.4	178	-63.1	177	0	0	0	112.2	F984	F984-I986 PolarHBondContact O-N 3.3Å
987	I	29	Very low	32.5	Very low	148 Å²	148	117.1 Å²	117.1	76%	0.759	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.7	0.8	172.7	-64.1	178.7	0	0	0	111.6	F984	F984-I987 PolarHBondContact O-N 2.78Å; F984-I987 VanDerWaalsContact O-N 3.14Å
988	S	27.5	Very low	31.6	Very low	78 Å²	78	117.4 Å²	117.4	55%	0.545	66%	0.66	S	S	.	*			trans	-115	44	-173.2	-49.8	0	0	0	0	113.3	F984	F984-S988 WeakPolarHBondContact O-CB 3.47Å; F984-S988 PolarHBondContact O-N 3.16Å; F984-S988 PolarHBondContact O-OG 3.38Å
989	L	24.7	Very low	30.5	Very low	159 Å²	159	123.2 Å²	123.2	83%	0.832	68%	0.682	S	S	*	*			trans	-110.8	45.4	179.9	-74.5	173.1	0	0	0	112.9
990	S	27	Very low	29.9	Very low	99 Å²	99	125.2 Å²	125.2	69%	0.692	69%	0.692	S	S	*	*	S	Bend	trans	-178	127	168.8	52.7	0	0	0	0	106.9
991	S	27.4	Very low	29.2	Very low	113 Å²	113	129.7 Å²	129.7	79%	0.79	71%	0.706	S	S	*	*			cis	-144.6	168.8	4.5	-69.9	0	0	0	0	109.3
992	P	28.5	Very low	28.4	Very low	124 Å²	124	132.5 Å²	132.5	81%	0.805	72%	0.718	S	S	*	*			trans	-88	171.5	-159.1	35.6	-37	0	0	0	115.6
993	S	25.9	Very low	27.9	Very low	118 Å²	118	136.1 Å²	136.1	83%	0.825	74%	0.736	S	S	*	*			trans	-80.6	137.8	169	52.6	0	0	0	0	113.1
994	S	30	Very low	27.5	Very low	98 Å²	98	135.7 Å²	135.7	69%	0.685	74%	0.738	S	S	*	*			trans	-168	102.9	157.1	51.7	0	0	0	0	112.4
995	D	25.6	Very low	27.2	Very low	181 Å²	181	132.1 Å²	132.1	97%	0.968	74%	0.736	S	S	*	*			trans	-99.2	79.4	157	-96.8	-42.3	0	0	0	107.8
996	S	28.5	Very low	27.1	Very low	85 Å²	85	133.4 Å²	133.4	59%	0.594	75%	0.749	S	S	*	*			trans	-167.9	130.5	175.2	57.1	0	0	0	0	109.6
997	L	28.9	Very low	27.1	Very low	165 Å²	165	129.9 Å²	129.9	86%	0.864	75%	0.748	S	S	*	*			trans	69.8	122.5	177.4	-50.4	-177.6	0	0	0	112.7
998	K	25.5	Very low	27.2	Very low	187 Å²	187	132.1 Å²	132.1	81%	0.813	75%	0.752	S	S	*	*			cis	47.5	91.1	22.5	-82.8	-163.5	175.9	-165.6	0	110.8
999	E	25.8	Very low	27.4	Very low	168 Å²	168	131 Å²	131	79%	0.785	75%	0.753	S	S	*	*				-163.3	178.5	66.7	-92.6	168	166.2	0	0	112.7
1000	I	26.7	Very low	27.7	Very low	135 Å²	135	130.3 Å²	130.3	69%	0.692	75%	0.751	S	S	*	*			trans	67.9	100	162.6	-69	153.2	0	0	0	113.2
1001	E	25	Very low	28	Very low	156 Å²	156	131.6 Å²	131.6	73%	0.729	75%	0.75	S	S	*	*				64.9	143.7	77.5	-66.8	-173.1	141.9	0	0	112.7
1002	L	25.3	Very low	28.2	Very low	132 Å²	132	131.8 Å²	131.8	69%	0.691	74%	0.742	S	S	*	*			cis	-160.9	-163.4	-9.6	-111.4	166.5	0	0	0	105.2
1003	I	26.6	Very low	28.3	Very low	146 Å²	146	134 Å²	134	75%	0.749	74%	0.741	S	S	*	*			trans	69.8	128.7	156.6	-46.1	-168.2	0	0	0	116.4
1004	N	27	Very low	28.4	Very low	133 Å²	133	132.6 Å²	132.6	71%	0.711	73%	0.731	S	S	*	*			cis	-158.2	130.4	-25.4	-104.7	-11.8	0	0	0	104.8
1005	A	27.2	Very low	28.5	Very low	73 Å²	73	134.4 Å²	134.4	60%	0.603	73%	0.733	S	S	*	*				86.1	162.2	74.6	0	0	0	0	0	113.2
1006	N	28.2	Very low	28.7	Very low	160 Å²	160	133 Å²	133	86%	0.856	72%	0.721	S	S	*	*			trans	68.2	127.7	177.9	-46.2	-21.4	0	0	0	114.5
1007	G	29.7	Very low	28.6	Very low	69 Å²	69	135.4 Å²	135.4	71%	0.711	73%	0.727	S	S	*	*			cis	178.8	-172.1	-3	0	0	0	0	0	106
1008	F	30.2	Very low	28.6	Very low	195 Å²	195	134.1 Å²	134.1	86%	0.855	72%	0.72	S	S	*	*			cis	-141.7	159.7	-11.7	-92.4	-103.8	0	0	0	103.9
1009	G	30.9	Very low	28.9	Very low	55 Å²	55	129.8 Å²	129.8	57%	0.567	71%	0.714	S	S	*	*			cis	-179.3	-171.4	-0.2	0	0	0	0	0	107.7
1010	D	32.5	Very low	29	Very low	145 Å²	145	126.4 Å²	126.4	78%	0.775	71%	0.708	S	S	*	*			trans	63.5	127.9	145.6	-44	-6.5	0	0	0	117.8
1011	D	32.2	Very low	29.2	Very low	126 Å²	126	126.6 Å²	126.6	67%	0.674	71%	0.711	S	S	*	*			cis	-164.4	164.5	1.4	-144.4	-1.4	0	0	0	113.8
1012	N	33	Very low	29.4	Very low	116 Å²	116	125 Å²	125	62%	0.62	71%	0.712	S	S	*	*			trans	64	120.1	164.1	-62.8	-61.1	0	0	0	117.9
1013	H	29.6	Very low	29.3	Very low	170 Å²	170	128.1 Å²	128.1	79%	0.787	72%	0.72	S	S	*	*				64.4	136.1	72.4	-71.5	-78.6	0	0	0	112.1
1014	S	29.1	Very low	29.3	Very low	90 Å²	90	126.7 Å²	126.7	63%	0.629	72%	0.718	S	S	*	*			cis	-156.7	151.6	25.7	55.6	0	0	0	0	112.9
1015	D	30.6	Very low	29.4	Very low	136 Å²	136	127 Å²	127	73%	0.727	72%	0.72	S	S	*	*			trans	62.9	151.1	134.7	-57.1	-5.6	0	0	0	120.5
1016	E	29.5	Very low	29.4	Very low	151 Å²	151	131 Å²	131	71%	0.706	73%	0.73	S	S	*	*			cis	-150.5	132.1	-8.3	-118.9	-172	144.7	0	0	107.6
1017	L	27.6	Very low	29.2	Very low	136 Å²	136	132.1 Å²	132.1	71%	0.712	73%	0.73	S	S	*	*				68.7	152.1	101.4	-77.5	-175.4	0	0	0	118.8
1018	N	29.2	Very low	29	Very low	137 Å²	137	132.1 Å²	132.1	73%	0.733	73%	0.73	S	S	*	*			trans	75.3	134.8	163.9	-58.6	-38	0	0	0	118.5
1019	S	30.8	Very low	28.9	Very low	97 Å²	97	127.5 Å²	127.5	68%	0.678	73%	0.728	S	S	*	*			cis	-159.1	129.3	-10.6	51.1	0	0	0	0	113.7
1020	S	27.7	Very low	28.8	Very low	96 Å²	96	132.6 Å²	132.6	67%	0.671	74%	0.741	S	S	*	*				40.2	120.3	124.2	-37.2	0	0	0	0	120.8
1021	N	31.3	Very low	28.5	Very low	140 Å²	140	134.3 Å²	134.3	75%	0.749	74%	0.742	S	S	*	*				172.3	105.9	104.6	-84.2	-21.5	0	0	0	110
1022	T	29.6	Very low	28.3	Very low	121 Å²	121	134 Å²	134	74%	0.742	74%	0.74	S	S	*	*				58.2	111.8	98.5	56.2	0	0	0	0	115.1
1023	F	23.5	Very low	28.4	Very low	199 Å²	199	138.4 Å²	138.4	87%	0.873	75%	0.754	S	S	*	*				74.4	150	66.2	-124.3	-88.9	0	0	0	114.9
1024	V	26.6	Very low	28.4	Very low	115 Å²	115	136.3 Å²	136.3	70%	0.697	75%	0.747	S	S	*	*			trans	81.5	151.1	174.2	-162.4	0	0	0	0	116
1025	N	28.6	Very low	28.4	Very low	139 Å²	139	138.6 Å²	138.6	74%	0.743	75%	0.752	S	S	*	*			trans	77.5	136.1	176.1	-61.2	-36.7	0	0	0	117.8
1026	L	27.2	Very low	28.7	Very low	158 Å²	158	139.3 Å²	139.3	83%	0.827	76%	0.756	S	S	*	*			cis	-154.5	173.9	-17	-126.9	167.8	0	0	0	110.7
1027	H	23.8	Very low	28.9	Very low	183 Å²	183	135.4 Å²	135.4	85%	0.847	76%	0.756	S	S	*	*			trans	-94.5	126.5	-168.2	-177.4	-87.7	0	0	0	113.3
1028	G	26.4	Very low	29.3	Very low	70 Å²	70	138.4 Å²	138.4	72%	0.722	76%	0.763	S	S	*	*			trans	91.2	124.2	153.3	0	0	0	0	0	118.5
1029	A	27.6	Very low	29.3	Very low	97 Å²	97	140.5 Å²	140.5	80%	0.802	77%	0.766	S	S	*	*			trans	-157.9	115.7	146.8	0	0	0	0	0	112.4
1030	L	28.6	Very low	29.4	Very low	162 Å²	162	138.8 Å²	138.8	85%	0.848	77%	0.765	S	S	*	*			trans	36.5	101.9	141.6	-63.2	164.6	0	0	0	121.4
1031	K	26.5	Very low	29.6	Very low	181 Å²	181	141.3 Å²	141.3	79%	0.787	77%	0.766	S	S	*	*				36.3	141.5	106.9	-88.3	-175.6	175.7	178	0	121.7
1032	N	28.7	Very low	29.6	Very low	120 Å²	120	140 Å²	140	64%	0.642	76%	0.758	S	S	*	*			trans	88.4	100.4	143.6	-63.7	-3.2	0	0	0	121.3
1033	K	34.6	Very low	29.7	Very low	209 Å²	209	141.2 Å²	141.2	91%	0.909	76%	0.758	S	S	*	*			trans	174	105.5	135.3	-96.9	168.5	-176.3	-178.4	0	106.1
1034	I	28	Very low	30.1	Very low	126 Å²	126	138 Å²	138	65%	0.646	75%	0.75	S	S	*	*			cis	72.9	123	25.2	-60	-178.8	0	0	0	113.9
1035	N	30.5	Very low	30	Very low	138 Å²	138	140.3 Å²	140.3	74%	0.738	75%	0.753	S	S	*	*			trans	66.9	138.6	175.6	-68.3	11.9	0	0	0	116.6
1036	D	36.2	Very low	30.1	Very low	151 Å²	151	141.7 Å²	141.7	81%	0.807	76%	0.76	S	S	*	*			cis	-132.2	166.1	-3.7	-77.3	-57.9	0	0	0	108.2
1037	G	34.1	Very low	29.9	Very low	69 Å²	69	145.1 Å²	145.1	71%	0.711	76%	0.762	S	S	*	*			cis	133.7	143.9	28.2	0	0	0	0	0	106.3
1038	K	35	Very low	30.1	Very low	198 Å²	198	144.5 Å²	144.5	86%	0.861	76%	0.764	S	S	*	*			cis	-147.4	143.9	18.6	-72	173	177	173.4	0	111.9
1039	F	29.5	Very low	29.9	Very low	181 Å²	181	151.1 Å²	151.1	79%	0.794	77%	0.769	S	S	*	*				31.6	141.6	129.7	-75.5	-105.5	0	0	0	122.2
1040	G	33.1	Very low	29.9	Very low	62 Å²	62	153.8 Å²	153.8	64%	0.639	77%	0.768	S	S	*	*			cis	174.7	170.3	-6.4	0	0	0	0	0	115.9
1041	Q	31.4	Very low	29.7	Very low	149 Å²	149	153.4 Å²	153.4	70%	0.696	77%	0.767	S	S	*	*			trans	63.6	144.4	138	-70.3	-173.9	4.9	0	0	120.1
1042	N	32.3	Very low	29.8	Very low	111 Å²	111	150.7 Å²	150.7	59%	0.594	77%	0.765	S	S	*	*			cis	-150.6	156.5	18.1	-112	-26.5	0	0	0	113.6
1043	M	31.3	Very low	29.7	Very low	148 Å²	148	151.7 Å²	151.7	73%	0.729	77%	0.771	S	S	*	*			trans	42.5	143.1	141.4	-53.8	-56.1	-178.3	0	0	121.7
1044	N	31.1	Very low	29.4	Very low	131 Å²	131	149.2 Å²	149.2	70%	0.701	77%	0.765	S	S	*	*			cis	-152.5	168.6	-3.8	-133.3	-18.6	0	0	0	114.3
1045	Q	25.9	Very low	29.3	Very low	164 Å²	164	149.7 Å²	149.7	77%	0.766	77%	0.769	S	S	*	*			trans	-78.5	152	-174.8	-57.1	160.6	-9.5	0	0	113.4
1046	N	29.7	Very low	29.1	Very low	167 Å²	167	151.2 Å²	151.2	89%	0.893	77%	0.77	S	S	*	*				-165.1	145.8	112.3	-105.3	-26.3	0	0	0	112.9
1047	R	23.1	Very low	28.7	Very low	231 Å²	231	148.1 Å²	148.1	87%	0.872	76%	0.76	S	S	*	*			trans	-148.4	121.9	-174.3	-176.2	-166.9	-163.3	-164.8	6.9	108
1048	L	27.8	Very low	28.3	Very low	170 Å²	170	152.8 Å²	152.8	89%	0.89	77%	0.767	S	S	*	*			trans	-152.8	140.7	169.3	-110.3	167.7	0	0	0	111.3
1049	Y	22.8	Very low	27.9	Very low	208 Å²	208	150.8 Å²	150.8	82%	0.816	77%	0.765	S	S	*	*			trans	-104.9	134.1	171.5	-103.7	-105.2	0	0	0	107.7
1050	I	28.7	Very low	28	Very low	153 Å²	153	150.1 Å²	150.1	79%	0.785	77%	0.77	S	S	*	*			trans	-147.7	130.8	150	-58.4	-173.7	0	0	0	108.1	V1052	I1050-V1052 HydrophobicContact CG2-CG2 4.05Å
1051	D	23.3	Very low	27.8	Very low	154 Å²	154	154 Å²	154	82%	0.824	78%	0.776	S	S	*	*			trans	-90.7	124.2	164.2	-93.8	-53.9	0	0	0	110.1
1052	V	29.7	Very low	27.9	Very low	124 Å²	124	152.2 Å²	152.2	75%	0.752	78%	0.777	S	S	*	*			trans	-144.4	135	156.8	-176.3	0	0	0	0	109.7	I1050	I1050-V1052 HydrophobicContact CG2-CG2 4.05Å
1053	N	25	Very low	27.8	Very low	142 Å²	142	156.1 Å²	156.1	76%	0.759	79%	0.788	S	S	*	*			trans	-106.4	124	178	170	22.6	0	0	0	110.1
1054	I	29.9	Very low	27.7	Very low	156 Å²	156	153.8 Å²	153.8	80%	0.8	79%	0.786	S	S	*	*			trans	-160.2	161.2	168.6	-106	147.4	0	0	0	111.4
1055	N	25.6	Very low	27.5	Very low	137 Å²	137	156 Å²	156	73%	0.733	80%	0.797	S	S	*	*			trans	-103.4	158.2	-164.8	-96.6	-82.9	0	0	0	115.8
1056	K	26.7	Very low	27.6	Very low	170 Å²	170	156.7 Å²	156.7	74%	0.739	80%	0.8	S	S	*	*			trans	71.4	114.7	151.2	-77	175.5	179.7	173.7	0	121.4
1057	S	25.8	Very low	27.6	Very low	86 Å²	86	156.2 Å²	156.2	60%	0.601	80%	0.796	S	S	*	*			trans	55.8	117.5	133.2	63.5	0	0	0	0	122.3
1058	L	26.9	Very low	27.8	Very low	167 Å²	167	152.4 Å²	152.4	87%	0.874	79%	0.791	S	S	*	*				-153.6	177.2	107	-134.8	74.4	0	0	0	111
1059	L	27.1	Very low	27.9	Very low	156 Å²	156	151 Å²	151	82%	0.817	78%	0.784	S	S	*	*			trans	-96.3	155.5	172.9	-64.2	84.1	0	0	0	110.2
1060	D	30.8	Very low	28.3	Very low	166 Å²	166	145.5 Å²	145.5	89%	0.888	78%	0.776	S	S	*	*				-159.2	168.7	122.5	-127.7	-32.5	0	0	0	113.6
1061	L	29.2	Very low	28.5	Very low	145 Å²	145	144.6 Å²	144.6	76%	0.759	78%	0.781	S	S	*	*			trans	-149.7	146	-166.9	-145.8	166	0	0	0	111.8
1062	P	33.6	Very low	28.7	Very low	111 Å²	111	142.1 Å²	142.1	72%	0.721	78%	0.775	S	S	*	*			trans	-129.3	125.8	152.5	31.3	-16.3	0	0	0	115.3
1063	K	30.7	Very low	28.8	Very low	192 Å²	192	145.9 Å²	145.9	84%	0.835	78%	0.777	S	S	*	*				21.6	149.5	120	-59.5	172.7	-175.1	171.5	0	119.2
1064	S	27.7	Very low	28.9	Very low	99 Å²	99	147.9 Å²	147.9	69%	0.692	78%	0.779	S	S	*	*			cis	174.9	136.9	-21.5	50.8	0	0	0	0	109.2
1065	I	28.6	Very low	29	Very low	179 Å²	179	145.6 Å²	145.6	92%	0.918	78%	0.777	S	S	*	*			trans	-138.5	141	163.8	-62	-175.6	0	0	0	109.5
1066	Q	27.9	Very low	29.4	Very low	178 Å²	178	144.9 Å²	144.9	83%	0.832	78%	0.78	S	S	*	*			trans	-113.4	-164.5	-172.4	-66.7	-174	-21.4	0	0	113.5
1067	I	28.9	Very low	29.4	Very low	157 Å²	157	143.8 Å²	143.8	81%	0.805	78%	0.782	S	S	*	*			trans	89.6	133.6	172.5	-56.8	171.8	0	0	0	113.9
1068	I	28	Very low	29.6	Very low	150 Å²	150	149.3 Å²	149.3	77%	0.769	80%	0.795	S	S	*	*			cis	-172.3	156.4	-28.1	-129.2	165.9	0	0	0	106.2
1069	N	29.3	Very low	29.5	Very low	141 Å²	141	150.5 Å²	150.5	75%	0.754	79%	0.793	S	S	*	*			cis	-149.6	-174.5	-7.5	-159.3	-8.6	0	0	0	109.3
1070	S	30.1	Very low	29.4	Very low	93 Å²	93	150 Å²	150	65%	0.65	79%	0.79	S	S	*	*			trans	-93.6	-155.9	165.1	-54	0	0	0	0	110.6
1071	P	33.7	Very low	29.2	Very low	134 Å²	134	148.9 Å²	148.9	87%	0.87	78%	0.783	S	S	*	*			cis	-66.7	172.2	16.2	44	-16.2	0	0	0	131.6
1072	S	28.2	Very low	29	Very low	101 Å²	101	151 Å²	151	71%	0.706	79%	0.786	S	S	*	*			trans	-143.4	160.8	150.4	72.2	0	0	0	0	111.6
1073	Y	30.2	Very low	28.6	Very low	203 Å²	203	150.5 Å²	150.5	80%	0.796	79%	0.785	S	S	*	*			trans	-146.6	106.6	162.9	-103.4	-80	0	0	0	115.4
1074	K	28	Very low	28.4	Very low	184 Å²	184	147.8 Å²	147.8	80%	0.8	78%	0.779	S	S	*	*			trans	35.3	146.2	133.8	-58.3	180	-179.7	173.7	0	123.7
1075	S	31.3	Very low	28.2	Very low	109 Å²	109	153.1 Å²	153.1	76%	0.762	79%	0.786	S	S	*	*			trans	-95.7	177.5	166.9	60.8	0	0	0	0	112.8
1076	P	33.8	Very low	28	Very low	122 Å²	122	149 Å²	149	79%	0.792	77%	0.772	S	S	*	*				-153	-179.2	102.2	40.4	-22.1	0	0	0	117.8
1077	N	27.9	Very low	27.8	Very low	146 Å²	146	146.6 Å²	146.6	78%	0.781	77%	0.771	S	S	*	*			trans	-67.3	158.6	-177.4	-49.4	-78.4	0	0	0	116.8
1078	K	30.2	Very low	27.7	Very low	203 Å²	203	146.5 Å²	146.5	88%	0.883	77%	0.77	S	S	*	*				-171.2	159.8	107.1	-101.7	166.4	-173.3	176.3	0	116.1
1079	K	24.9	Very low	27.5	Very low	191 Å²	191	143.6 Å²	143.6	83%	0.83	76%	0.763	S	S	*	*			trans	-50.7	168.1	174	-53.6	163.3	-179.8	-178.7	0	113.1
1080	I	25.2	Very low	27.4	Very low	147 Å²	147	143.6 Å²	143.6	75%	0.754	76%	0.763	S	S	*	*				-178.2	145.3	78.2	-87.1	-169.7	0	0	0	111.2
1081	I	26.4	Very low	27.2	Very low	141 Å²	141	146.3 Å²	146.3	72%	0.723	77%	0.77	S	S	*	*			trans	52.7	127.8	160.1	-72.2	164.8	0	0	0	118.7
1082	K	24.1	Very low	27	Very low	191 Å²	191	145.4 Å²	145.4	83%	0.83	77%	0.767	S	S	*	*			cis	86.8	149.3	45.9	-88.4	-169.9	174.5	-175	0	114.7
1083	S	24.8	Very low	26.8	Very low	99 Å²	99	148.4 Å²	148.4	69%	0.692	77%	0.772	S	S	*	*			trans	62.7	148.5	174.1	45	0	0	0	0	117.2
1084	N	26.6	Very low	26.6	Very low	136 Å²	136	144.2 Å²	144.2	73%	0.727	76%	0.763	S	S	*	*			cis	-151.2	158.9	-11.1	-108.2	-7.5	0	0	0	111.5
1085	Y	23.7	Very low	26.5	Very low	211 Å²	211	145.2 Å²	145.2	83%	0.827	76%	0.762	S	S	*	*				-3	148.2	126.1	-66.9	-83	0	0	0	117.4
1086	S	24.2	Very low	26.4	Very low	91 Å²	91	146.9 Å²	146.9	64%	0.636	76%	0.762	S	S	*	*			cis	-176.8	162.5	8	42.4	0	0	0	0	114
1087	T	23.4	Very low	26.2	Very low	129 Å²	129	146.4 Å²	146.4	79%	0.791	75%	0.752	S	S	*	*			trans	62.6	174.5	150.6	32.5	0	0	0	0	120.9
1088	I	26.9	Very low	26.6	Very low	155 Å²	155	146.2 Å²	146.2	80%	0.795	75%	0.747	S	S	*	*			trans	72.4	104.6	-178.6	-47.5	170.4	0	0	0	112.7
1089	S	24.9	Very low	26.7	Very low	88 Å²	88	143.9 Å²	143.9	62%	0.615	74%	0.738	S	S	*	*			cis	95.1	119.8	20.9	91.7	0	0	0	0	116.8
1090	N	26.2	Very low	27	Very low	141 Å²	141	142.2 Å²	142.2	75%	0.754	73%	0.731	S	S	*	*			trans	82.5	135.2	150.5	-60.8	-13	0	0	0	121.6
1091	N	26.2	Very low	27.3	Very low	151 Å²	151	142.3 Å²	142.3	81%	0.807	73%	0.728	S	S	*	*			trans	69	94	139.3	-60.6	-4.3	0	0	0	123.2
1092	S	29.7	Very low	27.3	Very low	114 Å²	114	139.3 Å²	139.3	80%	0.797	72%	0.719	S	S	*	*			trans	-171.9	118.1	130.4	52.3	0	0	0	0	107.7
1093	M	24.7	Very low	27.5	Very low	165 Å²	165	138.2 Å²	138.2	81%	0.813	72%	0.718	S	S	*	*			cis	78.1	128.9	39.3	-153.9	-163	-152.9	0	0	113.7
1094	N	26	Very low	27.5	Very low	115 Å²	115	140 Å²	140	62%	0.615	72%	0.718	S	S	*	*			trans	71.7	148.9	170.4	-64.1	-34.8	0	0	0	116.4
1095	R	26.5	Very low	27.3	Very low	204 Å²	204	141 Å²	141	77%	0.77	72%	0.723	S	S	*	*			cis	-164.9	179.4	-1.5	-116.3	169.6	-159.3	-170.8	4.9	110
1096	L	28.1	Very low	27.4	Very low	145 Å²	145	136.3 Å²	136.3	76%	0.759	72%	0.721	S	S	*	*			trans	74.5	143.3	159.5	-60.9	125.6	0	0	0	118.9
1097	N	30.6	Very low	27.4	Very low	112 Å²	112	137 Å²	137	60%	0.599	73%	0.726	S	S	*	*			cis	-165.9	149.7	-30.2	-120.7	8.3	0	0	0	113.4
1098	H	34.5	Very low	27.5	Very low	142 Å²	142	135.3 Å²	135.3	66%	0.657	73%	0.725	S	S	*	*			trans	53	158.3	153.9	-57.4	-35.6	0	0	0	120.9
1099	H	34	Very low	27.4	Very low	153 Å²	153	137.7 Å²	137.7	71%	0.708	73%	0.73	S	S	*	*			cis	-125.8	150.4	-7	-92.1	-68.1	0	0	0	108.1
1100	K	30	Very low	27.5	Very low	157 Å²	157	141 Å²	141	68%	0.683	74%	0.739	S	S	*	*				53.4	146.2	72.6	-78.1	-179.4	163.6	-154.7	0	114.3
1101	H	31.6	Very low	27.4	Very low	148 Å²	148	144.3 Å²	144.3	69%	0.685	74%	0.741	S	S	*	*			cis	-115.4	-123.6	7.9	-129.9	-61.3	0	0	0	114.6
1102	S	27.5	Very low	27.6	Very low	78 Å²	78	144.3 Å²	144.3	55%	0.545	74%	0.739	S	S	.	*			trans	-175	176	-158.9	52.7	0	0	0	0	114.5
1103	Q	27.6	Very low	27.4	Very low	169 Å²	169	144.9 Å²	144.9	79%	0.79	73%	0.733	S	S	*	*			trans	76.3	164	160.4	-62.1	179.7	1.1	0	0	117.2
1104	L	24.3	Very low	27.6	Very low	136 Å²	136	147.4 Å²	147.4	71%	0.712	73%	0.734	S	S	*	*			cis	-153.9	-178.3	-24.3	-111.7	169.2	0	0	0	111.2
1105	L	23.6	Very low	27.9	Very low	156 Å²	156	147.1 Å²	147.1	82%	0.817	74%	0.738	S	S	*	*			trans	-34.9	155.7	171.7	-64.3	161.7	0	0	0	118
1106	S	24.7	Very low	27.9	Very low	114 Å²	114	143.4 Å²	143.4	80%	0.797	73%	0.734	S	S	*	*				129.2	146.5	123.3	-148.5	0	0	0	0	116.7
1107	S	24.4	Very low	27.8	Very low	106 Å²	106	141.1 Å²	141.1	74%	0.741	73%	0.73	S	S	*	*			trans	-60.2	147.9	177.8	51	0	0	0	0	115.8
1108	A	26.2	Very low	27.9	Very low	93 Å²	93	145 Å²	145	77%	0.769	74%	0.742	S	S	*	*			trans	-156.4	141.9	134.7	0	0	0	0	0	112
1109	F	24	Very low	27.5	Very low	205 Å²	205	144.6 Å²	144.6	90%	0.899	75%	0.745	S	S	*	*			trans	-78.9	133.6	158.3	-85.1	-117	0	0	0	108.8
1110	I	27.7	Very low	27.4	Very low	156 Å²	156	145 Å²	145	80%	0.8	75%	0.751	S	S	*	*			trans	-133.1	145.2	147.8	-66.7	-171.1	0	0	0	108.8	I1112	I1110-I1112 HydrophobicContact CG2-CD1 4.25Å; I1110-I1112 HydrophobicContact CG2-CG1 4.21Å
1111	R	23.9	Very low	27.1	Very low	212 Å²	212	146.5 Å²	146.5	80%	0.8	76%	0.758	S	S	*	*			trans	-142.5	99.7	-161.5	-179.8	-157.6	-152.1	177	8.6	110.3
1112	I	30.1	Very low	26.9	Very low	150 Å²	150	143 Å²	143	77%	0.769	76%	0.761	S	S	*	*			trans	-137	101.6	178.1	-52	177.7	0	0	0	106.5	I1110	I1110-I1112 HydrophobicContact CG2-CD1 4.25Å; I1110-I1112 HydrophobicContact CG2-CG1 4.21Å
1113	N	25.3	Very low	27	Very low	126 Å²	126	146.4 Å²	146.4	67%	0.674	77%	0.772	S	S	*	*				68.4	102.6	69.8	-76.5	-13.2	0	0	0	115.5
1114	R	30	Very low	27	Very low	218 Å²	218	146.1 Å²	146.1	82%	0.823	77%	0.771	S	S	*	*				42.6	146.6	129.2	-86.8	-172.4	-179.7	-169.1	0.3	120.7
1115	P	32.4	Very low	27.2	Very low	109 Å²	109	146.9 Å²	146.9	71%	0.708	77%	0.771	S	S	*	*				-138.2	164.6	54.3	41.7	-22.8	0	0	0	115.3
1116	N	26.7	Very low	27.4	Very low	127 Å²	127	145.9 Å²	145.9	68%	0.679	77%	0.766	S	S	*	*				51.8	145.9	97.9	-48.9	-11.4	0	0	0	115.2
1117	S	25.9	Very low	27.6	Very low	97 Å²	97	150.4 Å²	150.4	68%	0.678	77%	0.767	S	S	*	*			cis	-164.2	-154.7	-1.3	34.4	0	0	0	0	110.7
1118	F	30.9	Very low	27.7	Very low	192 Å²	192	149.4 Å²	149.4	84%	0.842	76%	0.759	S	S	*	*			trans	73.2	112.5	-176.1	-58.1	-81.4	0	0	0	115.1
1119	N	26.8	Very low	27.9	Very low	135 Å²	135	153.6 Å²	153.6	72%	0.722	76%	0.761	S	S	*	*			cis	82	100.9	4.8	-162.1	24.4	0	0	0	118.7
1120	L	31.3	Very low	28.1	Very low	161 Å²	161	151.1 Å²	151.1	84%	0.843	75%	0.752	S	S	*	*			trans	-173	122.4	149.9	-92.5	144.3	0	0	0	105.1
1121	K	25.3	Very low	28.3	Very low	188 Å²	188	148.3 Å²	148.3	82%	0.817	75%	0.746	S	S	*	*			cis	89.9	127.4	44.2	-88.7	-165.9	172.2	-173.2	0	114.7
1122	G	27	Very low	28.6	Very low	74 Å²	74	144.4 Å²	144.4	76%	0.763	74%	0.741	S	S	*	*			trans	92.7	151.7	169	0	0	0	0	0	115.4
1123	I	29.2	Very low	28.6	Very low	150 Å²	150	143 Å²	143	77%	0.769	74%	0.735	S	S	*	*			cis	-149.1	120.9	-10.7	-86.2	169.7	0	0	0	103.8
1124	Q	27	Very low	28.8	Very low	163 Å²	163	142.1 Å²	142.1	76%	0.762	74%	0.738	S	S	*	*				84.5	152.1	76.6	-147.2	-171.8	19.8	0	0	114.7
1125	Q	29.8	Very low	28.6	Very low	153 Å²	153	137.9 Å²	137.9	72%	0.715	73%	0.731	S	S	*	*			trans	81.9	112.5	174	-52	-171.4	11.5	0	0	115.2
1126	N	26.7	Very low	28.5	Very low	135 Å²	135	139.4 Å²	139.4	72%	0.722	74%	0.738	S	S	*	*				86.8	137.5	72.4	-64.6	-7.5	0	0	0	111
1127	Y	29.6	Very low	28.6	Very low	209 Å²	209	140.4 Å²	140.4	82%	0.82	74%	0.738	S	S	*	*			cis	-119.3	154.6	21	-69	-107.7	0	0	0	111.1
1128	C	26.5	Very low	28.7	Very low	84 Å²	84	139.2 Å²	139.2	57%	0.568	73%	0.73	S	S	*	*				61	131.8	59.6	-138.4	0	0	0	0	112.7
1129	F	29.2	Very low	28.6	Very low	182 Å²	182	136.9 Å²	136.9	80%	0.798	73%	0.727	S	S	*	*			cis	-103.9	154	16	-77.2	-113	0	0	0	112.1
1130	Q	28.8	Very low	28.8	Very low	153 Å²	153	134.9 Å²	134.9	72%	0.715	72%	0.723	S	S	*	*				62	136.9	56.8	-67.3	-171.9	-8.2	0	0	113.3
1131	S	32.6	Very low	28.8	Very low	96 Å²	96	135.8 Å²	135.8	67%	0.671	72%	0.723	S	S	*	*			cis	-145.8	143.3	19.6	66.7	0	0	0	0	114.9
1132	N	30.1	Very low	29	Very low	131 Å²	131	137.3 Å²	137.3	70%	0.701	72%	0.723	S	S	*	*				56.7	154.3	128.4	-63.3	-16.8	0	0	0	123.6
1133	N	28.7	Very low	29	Very low	121 Å²	121	142.9 Å²	142.9	65%	0.647	73%	0.727	S	S	*	*			cis	-177.8	-176.8	-38.4	-116.2	-44.3	0	0	0	108.5
1134	S	30.5	Very low	29	Very low	106 Å²	106	141 Å²	141	74%	0.741	73%	0.727	S	S	*	*			trans	62.9	100.2	177.9	66.4	0	0	0	0	114.6
1135	L	25.4	Very low	28.9	Very low	130 Å²	130	144 Å²	144	68%	0.681	73%	0.732	S	S	*	*			cis	73.7	70.8	12.3	-141.7	-178	0	0	0	114.4
1136	V	30.6	Very low	28.7	Very low	140 Å²	140	142.7 Å²	142.7	85%	0.848	73%	0.73	S	S	*	*			trans	-124.4	102.6	160.9	177.3	0	0	0	0	110.1
1137	H	28.9	Very low	28.8	Very low	148 Å²	148	141.5 Å²	141.5	69%	0.685	73%	0.731	S	S	*	*			trans	-45	167.3	155.8	-89.8	-99.5	0	0	0	114
1138	S	27.6	Very low	28.8	Very low	73 Å²	73	137.4 Å²	137.4	51%	0.51	73%	0.733	S	S	.	*			cis	175.2	171.2	-23.6	57.5	0	0	0	0	107.6
1139	N	30.1	Very low	28.9	Very low	142 Å²	142	136.3 Å²	136.3	76%	0.759	74%	0.736	S	S	*	*			trans	70.2	112.8	169.9	-52.5	-29.6	0	0	0	114.7
1140	S	30.1	Very low	28.9	Very low	93 Å²	93	133.6 Å²	133.6	65%	0.65	74%	0.74	S	S	*	*			cis	93.2	109.8	46.5	74.1	0	0	0	0	113.9
1141	H	31.4	Very low	29	Very low	181 Å²	181	130.8 Å²	130.8	84%	0.838	74%	0.737	S	S	*	*			trans	-167.3	104.2	136.4	-102.7	-68	0	0	0	113.5
1142	R	28.7	Very low	28.9	Very low	219 Å²	219	132.6 Å²	132.6	83%	0.826	74%	0.739	S	S	*	*			trans	44.8	129.7	136.8	-96.5	-177.9	170.8	-173.2	-1.7	123.1
1143	K	26.8	Very low	28.8	Very low	191 Å²	191	133 Å²	133	83%	0.83	74%	0.741	S	S	*	*			trans	84.9	78.3	146.7	-64.5	-175.6	175.9	-174.7	0	120.1
1144	S	30.1	Very low	28.9	Very low	112 Å²	112	133.9 Å²	133.9	78%	0.783	75%	0.745	S	S	*	*			trans	-144.5	125.3	137.9	47.1	0	0	0	0	106.8
1145	W	25.1	Very low	28.9	Very low	225 Å²	225	134.4 Å²	134.4	85%	0.852	74%	0.744	S	S	*	*				64.2	118	74.5	-86.2	69.3	0	0	0	114.9
1146	N	26.1	Very low	29.5	Very low	126 Å²	126	134.2 Å²	134.2	67%	0.674	75%	0.751	S	S	*	*			trans	60.3	118.3	150.8	-71.4	1.8	0	0	0	122.7
1147	S	26.8	Very low	29.5	Very low	109 Å²	109	135.7 Å²	135.7	76%	0.762	75%	0.747	S	S	*	*				95.2	160.5	119.4	78.6	0	0	0	0	120.6
1148	S	30.4	Very low	29.7	Very low	123 Å²	123	134.6 Å²	134.6	86%	0.86	75%	0.745	S	S	*	*			trans	67.1	139.6	-178.3	74.8	0	0	0	0	116.8
1149	G	28.5	Very low	29.8	Very low	61 Å²	61	138.6 Å²	138.6	63%	0.629	76%	0.756	S	S	*	*			cis	161.7	155.2	-12.6	0	0	0	0	0	114.5
1150	S	29.3	Very low	30.1	Very low	126 Å²	126	140 Å²	140	88%	0.881	76%	0.758	S	S	*	*			trans	63.9	160	176.4	84	0	0	0	0	114.3
1151	S	30.1	Very low	30.5	Very low	93 Å²	93	140 Å²	140	65%	0.65	76%	0.758	S	S	*	*			cis	-155.7	148.4	0.2	53.6	0	0	0	0	106.3
1152	N	30.5	Very low	30.5	Very low	134 Å²	134	137.4 Å²	137.4	72%	0.717	76%	0.755	S	S	*	*			cis	-162.7	158.7	14.2	-106.9	-11.6	0	0	0	109.1
1153	L	28.9	Very low	30.5	Very low	141 Å²	141	136.8 Å²	136.8	74%	0.738	76%	0.758	S	S	*	*			trans	51.6	131.6	144.6	-56.2	168.3	0	0	0	119
1154	D	30.2	Very low	30.6	Very low	138 Å²	138	140 Å²	140	74%	0.738	77%	0.772	S	S	*	*			cis	-146.4	152.5	10.2	-88.5	-51.6	0	0	0	112.6
1155	T	30.5	Very low	30.7	Very low	117 Å²	117	141.5 Å²	141.5	72%	0.718	77%	0.772	S	S	*	*			trans	-133.4	113.3	163.8	51.9	0	0	0	0	110.1	F1157	T1155-F1157 PolarHBondContact O-N 2.85Å
1156	P	38.1	Very low	31	Very low	127 Å²	127	137.1 Å²	137.1	83%	0.825	77%	0.768	S	S	*	*			trans	-70.4	118.1	166.7	28.7	-31.3	0	0	0	109.1
1157	F	30.4	Very low	31.2	Very low	171 Å²	171	137.7 Å²	137.7	75%	0.75	77%	0.773	S	S	*	*			trans	-61.6	154.3	168.2	-95.5	-103.4	0	0	0	111.3	T1155 E1159	T1155-F1157 PolarHBondContact O-N 2.85Å; F1157-E1159 HydrophobicContact CB-CG 4.07Å; F1157-E1159 HydrophobicContact CD1-CG 3.62Å; F1157-E1159 HydrophobicContact CE1-CG 4.39Å; F1157-E1159 HydrophobicContact CG-CG 4.19Å
1158	D	33.3	Very low	31.5	Very low	124 Å²	124	139.4 Å²	139.4	66%	0.663	77%	0.774	S	S	*	*			trans	-127.7	85	155.4	-167.4	-3.9	0	0	0	107.7	Q1160 S1161	D1158-Q1160 PolarHBondContact O-N 3.32Å; D1158-S1161 PolarHBondContact O-OG 3.35Å
1159	E	29.6	Very low	31.5	Very low	158 Å²	158	140.4 Å²	140.4	74%	0.738	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-64.1	-5.6	-166.4	-75.7	-166.9	118.4	0	0	115	F1157 S1161	F1157-E1159 HydrophobicContact CB-CG 4.07Å; F1157-E1159 HydrophobicContact CD1-CG 3.62Å; F1157-E1159 HydrophobicContact CE1-CG 4.39Å; F1157-E1159 HydrophobicContact CG-CG 4.19Å; E1159-S1161 VanDerWaalsContact C-N 3.27Å; E1159-S1161 PolarHBondContact O-N 3.32Å
1160	Q	36.1	Very low	31.7	Very low	172 Å²	172	145.7 Å²	145.7	80%	0.804	78%	0.777	S	S	*	*	G	3₁₀ helix	trans	-82.3	5.7	-170	-56.8	-164.5	4.2	0	0	115.2	D1158	D1158-Q1160 PolarHBondContact O-N 3.32Å
1161	S	38.8	Very low	31.9	Very low	91 Å²	91	147.1 Å²	147.1	64%	0.636	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-115.7	4.6	-167.3	57.1	0	0	0	0	116.5	D1158 E1159	D1158-S1161 PolarHBondContact O-OG 3.35Å; E1159-S1161 VanDerWaalsContact C-N 3.27Å; E1159-S1161 PolarHBondContact O-N 3.32Å
1162	V	32.4	Very low	32.1	Very low	127 Å²	127	151.2 Å²	151.2	77%	0.77	78%	0.779	S	S	*	*	S	Bend	trans	-123.1	13.7	179.2	-168.3	0	0	0	0	112.3
1163	F	27.3	Very low	32.2	Very low	206 Å²	206	152.7 Å²	152.7	90%	0.904	78%	0.784	S	S	*	*			trans	-127.4	32.1	176	-109.9	-82.4	0	0	0	112.9
1164	K	30.7	Very low	32.5	Very low	260 Å²	260	153.7 Å²	153.7	100%	1.13	79%	0.789	S	S	*	*			trans	-141.2	0	167.8	-93.9	-170.1	173.3	-175.6	0	109.1

Retrieved 1,164 of 1,164 residues in 157.1 ms (Link to these results)

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