WNK_CAEEL Loading...

Isoform b of Serine/threonine-protein kinase WNK AlphaSync

Canonical isoform description: Serine/threonine-protein kinase component of the WNK3-SPAK/OSR1 kinase cascade, which plays an important role in the regulation of electrolyte homeostasis and regulatory volume increase in response to hyperosmotic stress¹. Wnk-1 mediates regulatory volume increase in response to hyperosmotic stress by acting as a molecular crowding sensor, which senses cell shrinkage and mediates formation of a membraneless compartment by undergoing liquid-liquid phase separation². The membraneless compartment concentrates wnk-1 with its substrates (By similarity). Phosphorylates gck-3³. Plays a role in osmotic stress responses during which it increases gpdh-1 translation, likely by phosphorylating gck-3⁴. Essential for larval development and the tubular formation of the excretory canals⁵.

AlphaFold DB , UniProt , Accession X5M5N0-3 (canonical: X5M5N0), Species CAEEL (Caenorhabditis elegans), Gene wnk-1, Length 1,677 aa.

						>WNK_CAEEL|X5M5N0-3|wnk-1
MPDSITNGGRPPAPPSSVSSTTASTTGNFGTRRRLVNRIKKVDELHPAQENPTMGSHWLSEQERSRLEAVQQDWRRTRPMKWTSKKRPDDPTTSSPSTVSISNALENSTPSLNNVSSITNSSSPFSLSSAATSTASAIIPFTSNVATNHPHLNHHVSRIPQAIVTGGTNGSLPPLLISPTSAAAATPLISGKAGPMSPSTGSPINVAATVLQNAVSSPQHSIFDRSRLNKIPPNTSLASSSSPSDAANNDKPIQQRHSILSNVRTLTQAMVNDGPRTLTGDDMDKMVSEEERARKEQEKREEEEKAARRIDVEDDFDAQEKPIDKSKNGRFLKFDEELGRGSFKTVFRGLDTETGVAVAWCELQESKLNKTERQRFREEAEMLKDLQHPNIVRFYDYWESADLCGKRKYIVLVTELMTSGTLKMYLKRFKRINIKVLKSWCRQILKGLSFLHTRNPPVIHRDLKCDNIFITGTTGSVKIGDLGLATLKNKSFAKSVIGTPEFMAPEMYEEMYDESVDVYAFGMCLLEMVTGEYPYSECMNPATIYRKVISGVKPECFSRIPAQYPEIREIIDRCIRVRREERSTVKQLLVDDFFTPEDLIGIRVEIKNRDADLNDLNVEIQMQLRVYDEKKRKQYRFKENEGLQFAFDIENDSPDEVVQQMIEQQHIPDEDTRMITKLIKDKVDAFRRDRDHRLLEIKRAKEEEERIREEAEIKEELRLRAEAKEKEKERLEKERLEKKAAAAAAANPNPTPIPPTPATPHSSAQQQPIPPPLSTQTSAEIQQSAQQPSVPVTMIANIPAMSPTSAQPQPVLSPTSAAVPVPTTMIHVPKPSEIPVQNVATTAAPVAANNVPPSPAPFKTEDIQTPTLAQNTVPRTISTDASGLVINTPASIASPSPAPSATDVASTTAPVTPAPTPTTTTDGGAAAASTTTENKEEKRKSNKRKVVMEILGCDESRNFALVSCRLDTSHKSVTFQFAPGTDKPCTIATKLLAEDCLLKVHVHIVEAQLGEVIQLINSDGKKGVGTKLATVLDPNSTEPPTITAVMPKDSSAATASNTKPKIEIEKTPPTRDASQEPNNVQVTNVRKVSQESNAESVQSIPRPGGIIVMSPTNQTDSAPPPTGAAAKPSRFQVTKSADPIATPISSSISTATVIPIVAATPTNITSEPVIVQPITAQVITHLATPSPVSHSLSSNSSPSATTHSNMSSIQSTTSVPGRRFTVQPVSQAESGISSSISTPHPEPTPAITSCPPPVPSVPPVVSNGTLNLEVAPKQTPSATNQNVDTQHSSSTASTATLVSETPATVHVTPISVPAPVQEPLVIDHHSDVLTQLDSELRKVSGVSHSASPSTVVESLTSMTPQTIPLACQTVPASIGQAPAVIAAAHAASLIPNASVPQSPSRLDAETGLAGLHEKLEALKMEQDRREDMGDDAIGTTTTDGKDEIPIDTLKGLAEALGKVIHADGRETTPMPPDHPDLTDASTGQMDLESEDPEVIQMIVRHRMEQHKLLEKQRVEIERLRSKIRVPRATSVNPEMIGDDEADTTLTALQSALGNASLSLPASPPPNTETTKVNTTVIPSDVLATRMTMSQSSTKSSNVSVSSRHRDNQSAPPRHHHHQPHPPHHPHLQNHYHPPQNHTSATAPCPSAMVQLQAVSNNNVNPLHQPPHPVSSQIPPQA
					

Structure Viewer

Loading PAE data...

(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	37.2	Very low	38.2	Very low	164 Å²	164	132 Å²	132	81%	0.808	78%	0.784	S	S	*	*				0	112.2	0	-65.3	-53.8	-170.5	0	0	109.5	A1677	M1-A1677 CarbonylContact C-O 3.54Å; M1-A1677 VanDerWaalsContact N-CA 3.31Å; M1-A1677 VanDerWaalsContact N-CB 3.34Å; M1-A1677 PolarHBondContact N-O 3.34Å; M1-A1677 PolarHBondContact O-N 3.32Å; M1-A1677 VanDerWaalsContact O-N 3.09Å
2	P	36.4	Very low	38.6	Very low	99 Å²	99	131.5 Å²	131.5	64%	0.643	79%	0.786	S	S	*	*			trans	-89.2	-178.9	-177.4	40.1	-38.6	0	0	0	112.6
3	D	36.4	Very low	39	Very low	145 Å²	145	126.8 Å²	126.8	78%	0.775	77%	0.77	S	S	*	*			trans	69.7	158.6	152.2	-62.3	-41.1	0	0	0	120.3
4	S	37.9	Very low	39.9	Very low	117 Å²	117	126.5 Å²	126.5	82%	0.818	77%	0.772	S	S	*	*			trans	77.8	141.5	179.8	-38.9	0	0	0	0	114.4
5	I	37.3	Very low	40.2	Very low	161 Å²	161	126.9 Å²	126.9	83%	0.826	78%	0.778	S	S	*	*			cis	-125.3	140.9	9.6	-67.3	172.6	0	0	0	110.6
6	T	39	Very low	40.1	Very low	122 Å²	122	126.5 Å²	126.5	75%	0.748	78%	0.782	S	S	*	*			trans	-91.1	144.5	170.9	47.6	0	0	0	0	111.8
7	N	38.4	Very low	40.2	Very low	167 Å²	167	126.4 Å²	126.4	89%	0.893	79%	0.787	S	S	*	*			trans	-175.9	144	145.2	-104.6	-43.1	0	0	0	114
8	G	35.4	Very low	40.1	Very low	80 Å²	80	127.4 Å²	127.4	83%	0.825	79%	0.792	S	S	*	*			trans	77.7	128.3	168.6	0	0	0	0	0	115.8
9	G	35.4	Very low	40	Very low	76 Å²	76	126.4 Å²	126.4	78%	0.784	79%	0.79	S	S	*	*			cis	-161.2	152.8	-6	0	0	0	0	0	111.1
10	R	38.9	Very low	39.9	Very low	215 Å²	215	125.5 Å²	125.5	81%	0.811	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-98.8	127.6	-170.5	177	178.5	-178.4	-122.2	2.8	111.9
11	P	47.6	Very low	39.7	Very low	106 Å²	106	126.3 Å²	126.3	69%	0.688	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-70.1	148.2	169.2	29.4	-33.5	0	0	0	111.5
12	P	43.8	Very low	39.7	Very low	126 Å²	126	124.7 Å²	124.7	82%	0.818	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-81.4	160.7	-165.1	32.7	-37.1	0	0	0	114.6
13	A	43.1	Very low	39.6	Very low	70 Å²	70	124.2 Å²	124.2	58%	0.579	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-101.1	148.9	165.8	0	0	0	0	0	110.2
14	P	51.8	Low	39.4	Very low	123 Å²	123	122.4 Å²	122.4	80%	0.799	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-70.1	152.8	179.5	29.1	-34.9	0	0	0	112.6
15	P	44.8	Very low	39.3	Very low	132 Å²	132	123.9 Å²	123.9	86%	0.857	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-87.8	161.8	-168.1	35.3	-37.2	0	0	0	114.5
16	S	38.3	Very low	39.2	Very low	121 Å²	121	123 Å²	123	85%	0.846	80%	0.802	S	S	*	*			trans	-113.9	149.9	163.4	54.6	0	0	0	0	110.6
17	S	41.8	Very low	39.1	Very low	124 Å²	124	120.6 Å²	120.6	87%	0.867	80%	0.802	S	S	*	*			trans	-134.5	153.9	-178.1	53.9	0	0	0	0	111.9
18	V	38.3	Very low	39	Very low	145 Å²	145	118.7 Å²	118.7	88%	0.879	79%	0.792	S	S	*	*			trans	-127.2	145.2	-159.2	-74.5	0	0	0	0	114.5
19	S	37.8	Very low	38.9	Very low	108 Å²	108	124.6 Å²	124.6	76%	0.755	80%	0.795	S	S	*	*			trans	-175.7	110.3	151.7	51.7	0	0	0	0	108.8
20	S	37.6	Very low	38.9	Very low	109 Å²	109	124.4 Å²	124.4	76%	0.762	79%	0.793	S	S	*	*				82	114.5	56.4	73.6	0	0	0	0	115.1
21	T	36.6	Very low	38.8	Very low	142 Å²	142	121.4 Å²	121.4	87%	0.871	80%	0.799	S	S	*	*			trans	-172.6	152.9	131.7	-73.9	0	0	0	0	110.6
22	T	36.5	Very low	38.1	Very low	131 Å²	131	124 Å²	124	80%	0.804	80%	0.795	S	S	*	*			trans	-93.7	151.3	-161.2	50.6	0	0	0	0	117
23	A	35.9	Very low	37.5	Very low	88 Å²	88	125.7 Å²	125.7	73%	0.727	79%	0.785	S	S	*	*				160.6	106.9	127.5	0	0	0	0	0	110.7
24	S	32.1	Very low	37	Very low	108 Å²	108	133.7 Å²	133.7	76%	0.755	80%	0.8	S	S	*	*				71.2	102.2	62	76.8	0	0	0	0	116.5
25	T	35.6	Very low	36	Very low	148 Å²	148	136 Å²	136	91%	0.908	81%	0.805	S	S	*	*			trans	-165.5	157.7	143.5	-76.8	0	0	0	0	109.5
26	T	35	Very low	35.4	Very low	141 Å²	141	135.3 Å²	135.3	87%	0.865	80%	0.798	S	S	*	*			trans	-120.8	155.8	-156.6	50.6	0	0	0	0	115.9
27	G	36	Very low	34.9	Very low	73 Å²	73	136.6 Å²	136.6	75%	0.753	80%	0.796	S	S	*	*			trans	147.4	90.6	166.4	0	0	0	0	0	112.4
28	N	35.8	Very low	34.4	Very low	127 Å²	127	142.2 Å²	142.2	68%	0.679	80%	0.798	S	S	*	*			cis	77	100.6	44.8	-164.7	86.1	0	0	0	114.7
29	F	35.1	Very low	34.2	Very low	203 Å²	203	142.7 Å²	142.7	89%	0.89	79%	0.794	S	S	*	*			trans	170.3	124.9	131	-97.1	-65.5	0	0	0	114.6
30	G	34.7	Very low	34	Very low	72 Å²	72	147 Å²	147	74%	0.742	80%	0.799	S	S	*	*			trans	72.2	154	157.3	0	0	0	0	0	119
31	T	37.6	Very low	33.6	Very low	152 Å²	152	149.3 Å²	149.3	93%	0.933	80%	0.795	S	S	*	*			cis	-151.2	172.8	-11.3	-62.7	0	0	0	0	109.2
32	R	32	Very low	33.4	Very low	161 Å²	161	149.4 Å²	149.4	61%	0.608	80%	0.795	S	S	*	*			trans	-90.4	157.4	-159	-75.9	177.8	166.9	-176.7	-2.9	118.5	A146	R32-A146 PolarHBondContact NH1-O 3.26Å
33	R	32.3	Very low	33.2	Very low	162 Å²	162	148 Å²	148	61%	0.611	78%	0.783	S	S	*	*			trans	83	120.8	141.4	-85.1	173.3	-174.5	169.6	4.4	121.7	V145	R33-V145 PolarHBondContact NH2-O 2.74Å
34	R	31.9	Very low	33	Very low	237 Å²	237	152.1 Å²	152.1	89%	0.894	79%	0.787	S	S	*	*			trans	53.4	115.5	142.8	-70.1	-176	173	176.5	-3.2	120.3
35	L	29.9	Very low	32.9	Very low	172 Å²	172	154.7 Å²	154.7	90%	0.901	79%	0.792	S	S	*	*				-150	158.1	119.2	-152.9	66.1	0	0	0	111.2
36	V	32.3	Very low	32.8	Very low	118 Å²	118	156.8 Å²	156.8	72%	0.715	79%	0.791	S	S	*	*			trans	-96.6	166.6	170.4	-178.3	0	0	0	0	108.5
37	N	29.1	Very low	32.6	Very low	147 Å²	147	155.4 Å²	155.4	79%	0.786	78%	0.784	S	S	*	*			trans	72.4	86.5	178.6	-61.9	-19.8	0	0	0	117.2
38	R	31.5	Very low	32.2	Very low	242 Å²	242	156 Å²	156	91%	0.913	78%	0.781	S	S	*	*				-175.6	115.3	127.3	-105.4	172.1	-174.3	176.1	2.8	112.8
39	I	33.6	Very low	31.8	Very low	155 Å²	155	159.1 Å²	159.1	80%	0.795	79%	0.792	S	S	*	*			trans	-131	106.9	141.9	-60.1	-177.8	0	0	0	106.8
40	K	32.6	Very low	31.6	Very low	199 Å²	199	158.6 Å²	158.6	87%	0.865	79%	0.793	S	S	*	*			trans	-130.9	140.2	160.7	-86.5	-167.1	173.5	-173.3	0	105.9
41	K	29.8	Very low	31.3	Very low	158 Å²	158	161.9 Å²	161.9	69%	0.687	79%	0.793	S	S	*	*			trans	60.5	104.1	-160.4	-74.4	-173.7	166.2	-91.1	0	113.8	D43	K41-D43 HydrophobicContact CB-CB 4.24Å; K41-D43 HydrophobicContact CD-CB 4.46Å; K41-D43 HydrophobicContact CG-CB 4.04Å; K41-D43 IonicContact NZ-OD2 2.82Å; K41-D43 PolarHBondContact NZ-OD2 2.88Å
42	V	32.2	Very low	30.9	Very low	144 Å²	144	160.2 Å²	160.2	87%	0.873	79%	0.785	S	S	*	*				-109.4	107.3	126	175.6	0	0	0	0	104
43	D	33	Very low	30.9	Very low	102 Å²	102	158.9 Å²	158.9	55%	0.545	80%	0.795	S	S	.	*			trans	-156.4	118	-170.3	-172	25.8	0	0	0	104.7	K41	K41-D43 HydrophobicContact CB-CB 4.24Å; K41-D43 HydrophobicContact CD-CB 4.46Å; K41-D43 HydrophobicContact CG-CB 4.04Å; K41-D43 IonicContact NZ-OD2 2.82Å; K41-D43 PolarHBondContact NZ-OD2 2.88Å
44	E	30.5	Very low	30.7	Very low	174 Å²	174	158.5 Å²	158.5	81%	0.813	80%	0.802	S	S	*	*	S	Bend	trans	56	112.1	-163.9	-59.7	-174.8	107.6	0	0	116.7
45	L	30.1	Very low	30.7	Very low	162 Å²	162	150.3 Å²	150.3	85%	0.848	79%	0.791	S	S	*	*				166.5	90.1	125.7	-90.5	169.4	0	0	0	111.6
46	H	34.8	Very low	31.2	Very low	192 Å²	192	147.5 Å²	147.5	89%	0.889	79%	0.785	S	S	*	*			trans	-152.6	101.1	153.4	-127.1	-89.6	0	0	0	109
47	P	30.8	Very low	31.9	Very low	111 Å²	111	147.4 Å²	147.4	72%	0.721	78%	0.777	S	S	*	*			trans	-84	-179.1	176.5	35.3	-35.2	0	0	0	111.8
48	A	27.7	Very low	33	Very low	85 Å²	85	146.5 Å²	146.5	70%	0.702	76%	0.763	S	S	*	*			trans	79.3	91	172.4	0	0	0	0	0	117.9
49	Q	26.4	Very low	34.3	Very low	193 Å²	193	136.2 Å²	136.2	90%	0.902	73%	0.726	S	S	*	*				55.2	81.7	115.9	-166.7	179	-6.2	0	0	118.2
50	E	30.7	Very low	36.1	Very low	193 Å²	193	131.5 Å²	131.5	90%	0.902	71%	0.707	S	S	*	*			trans	-118.8	152	158.9	-68.5	-161.5	143.8	0	0	111.9
51	N	29.3	Very low	37.7	Very low	140 Å²	140	130 Å²	130	75%	0.749	70%	0.703	S	S	*	*			trans	-82.5	150.5	-166.9	-75.2	-55	0	0	0	114	T53	N51-T53 VanDerWaalsContact C-N 3.34Å; N51-T53 PolarHBondContact O-N 2.81Å
52	P	28.6	Very low	39.5	Very low	118 Å²	118	128.9 Å²	128.9	77%	0.766	70%	0.7	S	S	*	*			trans	-77	77.1	175.7	33.1	-36.2	0	0	0	112.4	M54	P52-M54 PolarHBondContact O-N 3.23Å; P52-M54 VanDerWaalsContact O-N 3.12Å
53	T	31.1	Very low	41.2	Very low	132 Å²	132	122.7 Å²	122.7	81%	0.81	66%	0.661	S	S	*	*			trans	-70.4	102.2	166.3	47.2	0	0	0	0	110.1	N51	N51-T53 VanDerWaalsContact C-N 3.34Å; N51-T53 PolarHBondContact O-N 2.81Å
54	M	29.5	Very low	43.1	Very low	155 Å²	155	123.9 Å²	123.9	76%	0.764	66%	0.658	S	S	*	*			trans	-61.5	138.7	-179	-65.1	176.5	-75.4	0	0	112.2	P52 K630	P52-M54 PolarHBondContact O-N 3.23Å; P52-M54 VanDerWaalsContact O-N 3.12Å; M54-K630 PolarHBondContact SD-NZ 2.86Å
55	G	31.7	Very low	45.2	Very low	64 Å²	64	118.8 Å²	118.8	66%	0.66	64%	0.642	S	S	*	*			trans	170.1	-20.5	168.7	0	0	0	0	0	118.6	W58	G55-W58 PolarHBondContact O-NE1 2.78Å
56	S	40	Very low	47.3	Very low	113 Å²	113	114.1 Å²	114.1	79%	0.79	61%	0.613	S	S	*	*	S	Bend	trans	-115.4	-12.5	-159.7	52.6	0	0	0	0	117.8
57	H	47.5	Very low	49.1	Very low	117 Å²	117	105.4 Å²	105.4	54%	0.542	57%	0.573	S	S	.	*			trans	-111.2	80.4	-170.4	-155.7	-86.1	0	0	0	113.3	L59	H57-L59 PolarHBondContact CE1-O 3.26Å; H57-L59 PolarHBondContact ND1-O 2.89Å
58	W	50.9	Low	51.3	Low	127 Å²	127	104.1 Å²	104.1	48%	0.481	56%	0.557	S	S	.	*			trans	-87.1	-5.1	-176.1	-72.9	87.6	0	0	0	115.5	G55 D598	G55-W58 PolarHBondContact O-NE1 2.78Å; W58-D598 HydrophobicContact CH2-CB 3.99Å; W58-D598 HydrophobicContact CZ3-CB 4.2Å; W58-D598 VanDerWaalsContact CZ3-OD2 3.3Å; W58-D598 WeakPolarHBondContact CZ3-OD2 3.23Å
59	L	59.8	Low	53.6	Low	26 Å²	26	101.5 Å²	101.5	14%	0.136	54%	0.535	C	S	.	.	S	Bend	trans	-101.6	133.3	177.6	-65.3	164.1	0	0	0	108.9	H57 E63 L67 V436	H57-L59 PolarHBondContact CE1-O 3.26Å; H57-L59 PolarHBondContact ND1-O 2.89Å; L59-E63 HydrophobicContact CB-CB 4.29Å; L59-E63 HydrophobicContact CD2-CB 3.96Å; L59-L67 HydrophobicContact CD1-CD1 3.52Å; L59-L67 HydrophobicContact CD2-CD1 3.76Å; L59-L67 HydrophobicContact CG-CD1 4.3Å; L59-V436 HydrophobicContact CD2-CG2 4.33Å
60	S	70.2	Confident	55.7	Low	57 Å²	57	92.5 Å²	92.5	40%	0.399	49%	0.494	S	S	.	.			trans	-63.5	158.3	161.8	62.8	0	0	0	0	110.4	Q62 E63 R64	S60-Q62 PolarHBondContact O-N 3.33Å; S60-E63 VanDerWaalsContact CB-OE2 3.3Å; S60-E63 WeakPolarHBondContact CB-OE2 3.19Å; S60-E63 PolarHBondContact N-OE2 3.49Å; S60-E63 PolarHBondContact O-N 3.07Å; S60-E63 VanDerWaalsContact OG-CG 3.29Å; S60-E63 WeakPolarHBondContact OG-CG 3.35Å; S60-E63 PolarHBondContact OG-N 3.02Å; S60-E63 PolarHBondContact OG-OE2 3.11Å; S60-R64 PolarHBondContact O-N 3.01Å
61	E	67	Low	57.7	Low	168 Å²	168	85.1 Å²	85.1	79%	0.785	46%	0.459	S	S	*	.	H	α-helix	trans	-56.6	-34.2	175.3	-62.5	-172.2	137.5	0	0	112	E63 R64 S65	E61-E63 PolarHBondContact O-N 3Å; E61-R64 PolarHBondContact O-N 3.13Å; E61-S65 WeakPolarHBondContact O-CB 3.18Å; E61-S65 PolarHBondContact O-N 3.4Å
62	Q	68.4	Low	59.7	Low	133 Å²	133	83.2 Å²	83.2	62%	0.621	45%	0.446	S	S	*	.	H	α-helix	trans	-66.1	-34.9	174.8	-171.6	64.5	-0.6	0	0	112.7	S60 R66	S60-Q62 PolarHBondContact O-N 3.33Å; Q62-R66 WeakPolarHBondContact O-CB 3.31Å; Q62-R66 VanDerWaalsContact O-CG 3.25Å; Q62-R66 WeakPolarHBondContact O-CG 3.12Å; Q62-R66 PolarHBondContact O-N 2.99Å
63	E	66.6	Low	61.5	Low	14 Å²	14	80.4 Å²	80.4	7%	0.065	42%	0.424	C	S	.	.	H	α-helix	trans	-78.4	-33.6	176	-71.2	160.2	138.3	0	0	112.4	L59 S60 E61 R66 L67 N433 V436	L59-E63 HydrophobicContact CB-CB 4.29Å; L59-E63 HydrophobicContact CD2-CB 3.96Å; S60-E63 VanDerWaalsContact CB-OE2 3.3Å; S60-E63 WeakPolarHBondContact CB-OE2 3.19Å; S60-E63 PolarHBondContact N-OE2 3.49Å; S60-E63 PolarHBondContact O-N 3.07Å; S60-E63 VanDerWaalsContact OG-CG 3.29Å; S60-E63 WeakPolarHBondContact OG-CG 3.35Å; S60-E63 PolarHBondContact OG-N 3.02Å; S60-E63 PolarHBondContact OG-OE2 3.11Å; E61-E63 PolarHBondContact O-N 3Å; E63-R66 WeakPolarHBondContact O-CB 3.46Å; E63-R66 PolarHBondContact O-N 3.39Å; E63-L67 WeakPolarHBondContact O-CG 3.48Å; E63-L67 PolarHBondContact O-N 2.95Å; E63-N433 WeakPolarHBondContact OE1-CB 3.23Å; E63-N433 VanDerWaalsContact OE1-CG 3.3Å; E63-N433 PolarHBondContact OE1-ND2 3.44Å; E63-V436 WeakPolarHBondContact OE1-CG2 3.34Å
64	R	72.6	Confident	62.8	Low	128 Å²	128	76.5 Å²	76.5	48%	0.483	40%	0.395	S	S	.	.	H	α-helix	trans	-64.5	-48.3	169.7	-178	177.2	175.2	161.1	0.6	111.1	S60 E61 R66 L67 E68	S60-R64 PolarHBondContact O-N 3.01Å; E61-R64 PolarHBondContact O-N 3.13Å; R64-R66 VanDerWaalsContact C-N 3.29Å; R64-R66 PolarHBondContact O-N 3.39Å; R64-L67 PolarHBondContact O-N 3.01Å; R64-E68 WeakPolarHBondContact CG-OE1 3.43Å; R64-E68 IonicContact CZ-OE1 3.76Å; R64-E68 IonicContact NE-OE1 3.8Å; R64-E68 PolarHBondContact NE-OE1 3.43Å; R64-E68 IonicContact NH2-OE1 2.68Å; R64-E68 WeakPolarHBondContact O-CG 3.21Å; R64-E68 PolarHBondContact O-N 3.27Å
65	S	76.1	Confident	64.3	Low	66 Å²	66	75.1 Å²	75.1	46%	0.462	38%	0.381	S	S	.	.	H	α-helix	trans	-57.1	-41.3	172.9	176.7	0	0	0	0	111.8	E61 E68 A69	E61-S65 WeakPolarHBondContact O-CB 3.18Å; E61-S65 PolarHBondContact O-N 3.4Å; S65-E68 PolarHBondContact O-N 2.9Å; S65-A69 VanDerWaalsContact O-CB 3.31Å; S65-A69 WeakPolarHBondContact O-CB 3.42Å; S65-A69 PolarHBondContact O-N 3.43Å
66	R	74.4	Confident	65.6	Low	65 Å²	65	81.1 Å²	81.1	25%	0.245	38%	0.384	C	S	.	.	H	α-helix	trans	-58.2	-48.5	170.3	-84.5	176.6	145.5	-150.8	-5.6	112.6	Q62 E63 R64 A69 V70 F429 R431	Q62-R66 WeakPolarHBondContact O-CB 3.31Å; Q62-R66 VanDerWaalsContact O-CG 3.25Å; Q62-R66 WeakPolarHBondContact O-CG 3.12Å; Q62-R66 PolarHBondContact O-N 2.99Å; E63-R66 WeakPolarHBondContact O-CB 3.46Å; E63-R66 PolarHBondContact O-N 3.39Å; R64-R66 VanDerWaalsContact C-N 3.29Å; R64-R66 PolarHBondContact O-N 3.39Å; R66-A69 WeakPolarHBondContact O-CB 3.48Å; R66-A69 PolarHBondContact O-N 2.91Å; R66-V70 WeakPolarHBondContact O-CG2 3.15Å; R66-V70 PolarHBondContact O-N 3.39Å; R66-F429 HydrophobicContact CB-CD2 4.3Å; R66-F429 HydrophobicContact CB-CE1 4.22Å; R66-F429 HydrophobicContact CB-CE2 3.49Å; R66-F429 VanDerWaalsContact CB-CE2 3.49Å; R66-F429 HydrophobicContact CB-CZ 3.45Å; R66-F429 VanDerWaalsContact CB-CZ 3.45Å; R66-F429 HydrophobicContact CG-CD1 4.3Å; R66-F429 HydrophobicContact CG-CD2 4.47Å; R66-F429 HydrophobicContact CG-CE1 3.75Å; R66-F429 HydrophobicContact CG-CE2 3.9Å; R66-F429 HydrophobicContact CG-CZ 3.51Å; R66-F429 VanDerWaalsContact O-CE2 3.24Å; R66-F429 WeakPolarHBondContact O-CE2 3.47Å; R66-F429 VanDerWaalsContact O-CZ 3.23Å; R66-F429 WeakPolarHBondContact O-CZ 3.17Å; R66-R431 PolarHBondContact NH1-O 2.87Å; R66-R431 PolarHBondContact NH2-O 2.95Å
67	L	71.5	Confident	66.1	Low	9 Å²	9	80.3 Å²	80.3	5%	0.047	37%	0.374	C	S	.	.	H	α-helix	trans	-66	-40.9	178.6	-75.9	166.1	0	0	0	112.4	L59 E63 R64 A69 V70 Q71 Y425 I470	L59-L67 HydrophobicContact CD1-CD1 3.52Å; L59-L67 HydrophobicContact CD2-CD1 3.76Å; L59-L67 HydrophobicContact CG-CD1 4.3Å; E63-L67 WeakPolarHBondContact O-CG 3.48Å; E63-L67 PolarHBondContact O-N 2.95Å; R64-L67 PolarHBondContact O-N 3.01Å; L67-A69 VanDerWaalsContact C-N 3.29Å; L67-A69 PolarHBondContact O-N 3.37Å; L67-V70 WeakPolarHBondContact O-CB 3.19Å; L67-V70 PolarHBondContact O-N 3.44Å; L67-Q71 PolarHBondContact O-N 3.07Å; L67-Y425 HydrophobicContact CD2-CD2 3.96Å; L67-Y425 HydrophobicContact CD2-CE2 3.7Å; L67-Y425 HydrophobicContact CG-CE2 4.23Å; L67-I470 HydrophobicContact CD2-CG2 3.86Å
68	E	77.2	Confident	66	Low	84 Å²	84	76.5 Å²	76.5	39%	0.393	36%	0.355	S	S	.	.	H	α-helix	trans	-63	-36.8	173.2	-72	178.5	-161.5	0	0	111	R64 S65 Q71 Q72	R64-E68 WeakPolarHBondContact CG-OE1 3.43Å; R64-E68 IonicContact CZ-OE1 3.76Å; R64-E68 IonicContact NE-OE1 3.8Å; R64-E68 PolarHBondContact NE-OE1 3.43Å; R64-E68 IonicContact NH2-OE1 2.68Å; R64-E68 WeakPolarHBondContact O-CG 3.21Å; R64-E68 PolarHBondContact O-N 3.27Å; S65-E68 PolarHBondContact O-N 2.9Å; E68-Q71 PolarHBondContact O-N 2.71Å; E68-Q72 WeakPolarHBondContact O-CB 3.23Å; E68-Q72 WeakPolarHBondContact O-CG 3.36Å; E68-Q72 PolarHBondContact O-N 2.95Å
69	A	76.4	Confident	65.3	Low	29 Å²	29	76.6 Å²	76.6	24%	0.24	37%	0.372	C	S	.	.	H	α-helix	trans	-65.8	-36.8	172.7	0	0	0	0	0	112.9	S65 R66 L67 D73 R428	S65-A69 VanDerWaalsContact O-CB 3.31Å; S65-A69 WeakPolarHBondContact O-CB 3.42Å; S65-A69 PolarHBondContact O-N 3.43Å; R66-A69 WeakPolarHBondContact O-CB 3.48Å; R66-A69 PolarHBondContact O-N 2.91Å; L67-A69 VanDerWaalsContact C-N 3.29Å; L67-A69 PolarHBondContact O-N 3.37Å; A69-D73 WeakPolarHBondContact O-CB 3.4Å; A69-D73 PolarHBondContact O-N 2.82Å; A69-R428 PolarHBondContact O-NH2 2.88Å; A69-R428 VanDerWaalsContact O-NH2 3.08Å
70	V	70.8	Confident	64.3	Low	5 Å²	5	80.2 Å²	80.2	3%	0.03	39%	0.389	C	S	.	.	H	α-helix	trans	-61.5	-46.4	169.6	176.2	0	0	0	0	110	R66 L67 D73 W74 M424 Y425 R428 F429	R66-V70 WeakPolarHBondContact O-CG2 3.15Å; R66-V70 PolarHBondContact O-N 3.39Å; L67-V70 WeakPolarHBondContact O-CB 3.19Å; L67-V70 PolarHBondContact O-N 3.44Å; V70-D73 PolarHBondContact O-N 3.17Å; V70-W74 VanDerWaalsContact O-CB 3.26Å; V70-W74 WeakPolarHBondContact O-CB 3.35Å; V70-W74 PolarHBondContact O-N 2.75Å; V70-M424 HydrophobicContact CG1-CE 3.45Å; V70-M424 VanDerWaalsContact CG1-CE 3.45Å; V70-Y425 HydrophobicContact CG2-CD2 4.07Å; V70-R428 VanDerWaalsContact CG2-CD 3.43Å; V70-F429 HydrophobicContact CG2-CD2 4.19Å; V70-F429 HydrophobicContact CG2-CE2 3.48Å; V70-F429 VanDerWaalsContact CG2-CE2 3.48Å; V70-F429 HydrophobicContact CG2-CZ 4.2Å
71	Q	72.2	Confident	62.4	Low	38 Å²	38	86.2 Å²	86.2	18%	0.178	41%	0.408	C	S	.	.	H	α-helix	trans	-66.3	-39.5	-178.4	-162	-172.6	68.5	0	0	112.3	L67 E68 R75	L67-Q71 PolarHBondContact O-N 3.07Å; E68-Q71 PolarHBondContact O-N 2.71Å; Q71-R75 VanDerWaalsContact CD-NH2 3.33Å; Q71-R75 VanDerWaalsContact O-CG 3.26Å; Q71-R75 WeakPolarHBondContact O-CG 3.49Å; Q71-R75 PolarHBondContact O-N 2.81Å; Q71-R75 VanDerWaalsContact OE1-CZ 3.22Å
72	Q	71.2	Confident	60.7	Low	99 Å²	99	86.1 Å²	86.1	46%	0.463	40%	0.401	S	S	.	.	H	α-helix	trans	-64	-43.1	173.5	-75.1	-173.4	32.9	0	0	111.9	E68 R75 R76	E68-Q72 WeakPolarHBondContact O-CB 3.23Å; E68-Q72 WeakPolarHBondContact O-CG 3.36Å; E68-Q72 PolarHBondContact O-N 2.95Å; Q72-R75 WeakPolarHBondContact O-CB 2.96Å; Q72-R75 PolarHBondContact O-N 3.37Å; Q72-R76 VanDerWaalsContact O-CG 3.26Å; Q72-R76 WeakPolarHBondContact O-CG 3.24Å; Q72-R76 PolarHBondContact O-N 3.48Å
73	D	67.2	Low	59	Low	60 Å²	60	85.7 Å²	85.7	32%	0.321	41%	0.407	S	S	.	.	H	α-helix	trans	-75.3	-33.8	-178.7	-166.9	46.1	0	0	0	112.5	A69 V70 R75 R76 T77 R428	A69-D73 WeakPolarHBondContact O-CB 3.4Å; A69-D73 PolarHBondContact O-N 2.82Å; V70-D73 PolarHBondContact O-N 3.17Å; D73-R75 VanDerWaalsContact C-N 3.29Å; D73-R75 PolarHBondContact O-N 3.38Å; D73-R76 CarbonylContact O-C 3.53Å; D73-R76 PolarHBondContact O-N 3.45Å; D73-R76 VanDerWaalsContact O-N 3.09Å; D73-T77 WeakPolarHBondContact O-CB 3.36Å; D73-T77 WeakPolarHBondContact O-CG2 3.38Å; D73-T77 PolarHBondContact O-N 2.84Å; D73-T77 PolarHBondContact O-OG1 3.46Å; D73-R428 IonicContact OD2-CZ 2.71Å; D73-R428 IonicContact OD2-NH1 3.71Å; D73-R428 PolarHBondContact OD2-NH1 2.71Å
74	W	56.9	Low	57.3	Low	50 Å²	50	89.3 Å²	89.3	19%	0.189	43%	0.434	C	S	.	.	H	α-helix	trans	-62.1	-36.7	169.1	-175.1	82.1	0	0	0	111.7	V70 R78 T418 M424	V70-W74 VanDerWaalsContact O-CB 3.26Å; V70-W74 WeakPolarHBondContact O-CB 3.35Å; V70-W74 PolarHBondContact O-N 2.75Å; W74-R78 VanDerWaalsContact CH2-NE 3.32Å; W74-R78 WeakPolarHBondContact O-CG 3.07Å; W74-R78 PolarHBondContact O-N 2.91Å; W74-T418 HydrophobicContact CH2-CG2 4.1Å; W74-T418 HydrophobicContact CZ3-CG2 4.39Å; W74-T418 VanDerWaalsContact CZ3-O 3.25Å; W74-T418 WeakPolarHBondContact CZ3-O 3.3Å; W74-M424 HydrophobicContact CB-CE 3.96Å; W74-M424 HydrophobicContact CG-CE 4.04Å
75	R	61.2	Low	55.5	Low	126 Å²	126	92.8 Å²	92.8	48%	0.475	45%	0.453	S	S	.	.	H	α-helix	trans	-66.6	-34.8	169.5	-72.7	169.3	178.1	135.2	2.3	113	Q71 Q72 D73	Q71-R75 VanDerWaalsContact CD-NH2 3.33Å; Q71-R75 VanDerWaalsContact O-CG 3.26Å; Q71-R75 WeakPolarHBondContact O-CG 3.49Å; Q71-R75 PolarHBondContact O-N 2.81Å; Q71-R75 VanDerWaalsContact OE1-CZ 3.22Å; Q72-R75 WeakPolarHBondContact O-CB 2.96Å; Q72-R75 PolarHBondContact O-N 3.37Å; D73-R75 VanDerWaalsContact C-N 3.29Å; D73-R75 PolarHBondContact O-N 3.38Å
76	R	58.8	Low	53.3	Low	190 Å²	190	99.1 Å²	99.1	72%	0.717	47%	0.472	S	S	*	.	H	α-helix	trans	-82.5	-28.8	-179.3	-70.4	166.4	-175.1	-107.1	7.3	114.6	Q72 D73	Q72-R76 VanDerWaalsContact O-CG 3.26Å; Q72-R76 WeakPolarHBondContact O-CG 3.24Å; Q72-R76 PolarHBondContact O-N 3.48Å; D73-R76 CarbonylContact O-C 3.53Å; D73-R76 PolarHBondContact O-N 3.45Å; D73-R76 VanDerWaalsContact O-N 3.09Å
77	T	51.9	Low	51.3	Low	95 Å²	95	106.7 Å²	106.7	58%	0.583	50%	0.5	S	S	*	.	H	α-helix	trans	-92.5	-12.2	-178.6	52.8	0	0	0	0	112.9	D73	D73-T77 WeakPolarHBondContact O-CB 3.36Å; D73-T77 WeakPolarHBondContact O-CG2 3.38Å; D73-T77 PolarHBondContact O-N 2.84Å; D73-T77 PolarHBondContact O-OG1 3.46Å
78	R	45.8	Very low	49.5	Very low	38 Å²	38	111.8 Å²	111.8	14%	0.143	53%	0.534	C	S	.	.	S	Bend	trans	-57.1	137.9	155.9	-84.6	173.8	174	-87	-21.5	109.7	W74 M80 E336	W74-R78 VanDerWaalsContact CH2-NE 3.32Å; W74-R78 WeakPolarHBondContact O-CG 3.07Å; W74-R78 PolarHBondContact O-N 2.91Å; R78-M80 PolarHBondContact O-N 3.48Å; R78-E336 IonicContact CZ-OE1 3.98Å; R78-E336 IonicContact NH1-OE1 3.23Å; R78-E336 PolarHBondContact NH1-OE1 2.82Å
79	P	34.9	Very low	47.3	Very low	128 Å²	128	115.5 Å²	115.5	83%	0.831	56%	0.557	S	S	*	*			trans	-75	66.1	171.4	33.2	-35.7	0	0	0	110.9	K81	P79-K81 PolarHBondContact O-N 3.19Å
80	M	38.5	Very low	45.2	Very low	102 Å²	102	121.2 Å²	121.2	50%	0.502	58%	0.583	S	S	.	*			trans	-62.1	123.2	165.8	-80.6	-177.2	149.2	0	0	108.8	R78 W82	R78-M80 PolarHBondContact O-N 3.48Å; M80-W82 HydrophobicContact CE-CE3 4.33Å; M80-W82 HydrophobicContact CE-CZ3 3.99Å; M80-W82 PolarHBondContact O-N 3.5Å; M80-W82 HydrophobicContact SD-CE3 3.74Å; M80-W82 HydrophobicContact SD-CZ3 3.97Å
81	K	31.9	Very low	43.4	Very low	183 Å²	183	126.2 Å²	126.2	80%	0.796	62%	0.616	S	S	*	*			trans	-72.1	50.3	171.2	-69.8	179.9	179.2	169.1	0	111.6	P79 T83	P79-K81 PolarHBondContact O-N 3.19Å; K81-T83 PolarHBondContact O-N 3.08Å
82	W	31	Very low	41.4	Very low	167 Å²	167	130.8 Å²	130.8	63%	0.633	65%	0.646	S	S	*	*			trans	-88.9	91	-179.2	-134	-47.9	0	0	0	110.8	M80 S84	M80-W82 HydrophobicContact CE-CE3 4.33Å; M80-W82 HydrophobicContact CE-CZ3 3.99Å; M80-W82 PolarHBondContact O-N 3.5Å; M80-W82 HydrophobicContact SD-CE3 3.74Å; M80-W82 HydrophobicContact SD-CZ3 3.97Å; W82-S84 VanDerWaalsContact CD1-OG 3.3Å; W82-S84 PolarHBondContact O-N 3.03Å
83	T	31.4	Very low	39.4	Very low	124 Å²	124	132.8 Å²	132.8	76%	0.761	67%	0.665	S	S	*	*			trans	-75.1	64	173	48.6	0	0	0	0	111.1	K81 K85	K81-T83 PolarHBondContact O-N 3.08Å; T83-K85 PolarHBondContact O-N 3.28Å
84	S	31.4	Very low	37.6	Very low	89 Å²	89	135.6 Å²	135.6	62%	0.622	69%	0.69	S	S	*	*			trans	-69.1	73.4	177.1	-63.2	0	0	0	0	111.7	W82 K86	W82-S84 VanDerWaalsContact CD1-OG 3.3Å; W82-S84 PolarHBondContact O-N 3.03Å; S84-K86 PolarHBondContact O-N 3.07Å
85	K	34	Very low	36.5	Very low	202 Å²	202	138.4 Å²	138.4	88%	0.878	72%	0.717	S	S	*	*			trans	-69.6	91.1	173.9	-168.3	169	-172.8	170.1	0	109	T83 R87	T83-K85 PolarHBondContact O-N 3.28Å; K85-R87 PolarHBondContact O-N 2.73Å
86	K	31.4	Very low	35.6	Very low	198 Å²	198	138 Å²	138	86%	0.861	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-46.1	129.4	172.6	-75.1	-171.3	173.3	-170.5	0	109.7	S84	S84-K86 PolarHBondContact O-N 3.07Å
87	R	32.4	Very low	34.4	Very low	224 Å²	224	134.7 Å²	134.7	85%	0.845	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-69.9	144.5	156.2	-64.9	-171.2	-175.9	-155.7	3.4	107.6	K85	K85-R87 PolarHBondContact O-N 2.73Å
88	P	33.3	Very low	33.4	Very low	116 Å²	116	136 Å²	136	75%	0.753	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-67.7	152	166.8	31.2	-34	0	0	0	109.8
89	D	30.9	Very low	32.7	Very low	162 Å²	162	140.5 Å²	140.5	87%	0.866	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-71	133.2	173.1	-51.7	-86.3	0	0	0	110.2
90	D	32.8	Very low	32.5	Very low	150 Å²	150	139 Å²	139	80%	0.802	77%	0.769	S	S	*	*			trans	-126.5	106	176.5	-166.3	-0.8	0	0	0	109.9
91	P	32	Very low	32.1	Very low	109 Å²	109	141.6 Å²	141.6	71%	0.708	78%	0.783	S	S	*	*			trans	-99.4	107.5	-173	35.1	-30.3	0	0	0	112.5
92	T	31.2	Very low	32.1	Very low	134 Å²	134	137.4 Å²	137.4	82%	0.822	78%	0.777	S	S	*	*			trans	-160.2	133.9	142.7	4.4	0	0	0	0	112.7
93	T	29.3	Very low	32.1	Very low	141 Å²	141	136.8 Å²	136.8	87%	0.865	79%	0.786	S	S	*	*			trans	-117.7	118.4	165.9	-39.9	0	0	0	0	108.4
94	S	29.3	Very low	32.2	Very low	119 Å²	119	135.3 Å²	135.3	83%	0.832	79%	0.787	S	S	*	*			trans	-146.3	145	160.4	62.5	0	0	0	0	109.4
95	S	32.5	Very low	32.2	Very low	109 Å²	109	138.2 Å²	138.2	76%	0.762	79%	0.794	S	S	*	*			trans	-148.1	-173.9	-163.2	65.9	0	0	0	0	109.9
96	P	43.7	Very low	32.1	Very low	117 Å²	117	135.9 Å²	135.9	76%	0.76	79%	0.786	S	S	*	*				-121.8	-177.8	-104.6	35.8	-17.8	0	0	0	113.3
97	S	32.6	Very low	32.1	Very low	122 Å²	122	132.7 Å²	132.7	85%	0.853	78%	0.779	S	S	*	*			trans	-146.2	160.1	162.5	60.1	0	0	0	0	111.5
98	T	30.4	Very low	32.2	Very low	122 Å²	122	127.2 Å²	127.2	75%	0.748	78%	0.775	S	S	*	*			trans	-139.8	126.4	-163.5	-54.3	0	0	0	0	112.7
99	V	31.8	Very low	32.1	Very low	132 Å²	132	128.1 Å²	128.1	80%	0.8	78%	0.779	S	S	*	*			trans	-150.3	106.1	160.7	-155.8	0	0	0	0	104.8
100	S	30	Very low	32.5	Very low	96 Å²	96	126 Å²	126	67%	0.671	77%	0.774	S	S	*	*				61.7	119.5	71	-61.7	0	0	0	0	114.7
101	I	31.5	Very low	32.5	Very low	157 Å²	157	124.2 Å²	124.2	81%	0.805	77%	0.773	S	S	*	*			trans	167.5	111.8	133.9	-85.2	156.1	0	0	0	112.2
102	S	31.9	Very low	32.6	Very low	95 Å²	95	127.2 Å²	127.2	66%	0.664	78%	0.782	S	S	*	*			trans	37.8	121.8	136.6	-44.6	0	0	0	0	125.6
103	N	30.7	Very low	32.8	Very low	155 Å²	155	127.3 Å²	127.3	83%	0.829	78%	0.777	S	S	*	*				78.9	150.6	121.7	-66.3	0.9	0	0	0	124.4
104	A	32.4	Very low	33.2	Very low	93 Å²	93	127.1 Å²	127.1	77%	0.769	77%	0.771	S	S	*	*			trans	74.7	146.6	161.4	0	0	0	0	0	116.8
105	L	32.4	Very low	33.4	Very low	150 Å²	150	127 Å²	127	79%	0.785	77%	0.765	S	S	*	*			cis	-149.9	175.9	-2.9	-154.5	57	0	0	0	111.5
106	E	31.2	Very low	33.6	Very low	152 Å²	152	126.8 Å²	126.8	71%	0.71	76%	0.764	S	S	*	*			trans	-38.8	175.5	167.1	-52.8	173.3	-176.7	0	0	118.5
107	N	30.9	Very low	33.3	Very low	131 Å²	131	125.8 Å²	125.8	70%	0.701	76%	0.759	S	S	*	*			cis	-163.6	178.7	7.7	-134.9	-38.8	0	0	0	112.7
108	S	34.6	Very low	33.5	Very low	109 Å²	109	127.1 Å²	127.1	76%	0.762	76%	0.755	S	S	*	*			trans	101.9	133.8	152.7	-46.4	0	0	0	0	122.4
109	T	32.3	Very low	33.7	Very low	136 Å²	136	126.8 Å²	126.8	83%	0.834	75%	0.753	S	S	*	*			trans	-113.2	-162.4	167.8	58.4	0	0	0	0	108.6
110	P	38.1	Very low	33.9	Very low	117 Å²	117	127.2 Å²	127.2	76%	0.76	75%	0.751	S	S	*	*			cis	-124.5	168.3	9.3	33.8	-10.8	0	0	0	114.9
111	S	33.6	Very low	34.3	Very low	112 Å²	112	127.6 Å²	127.6	78%	0.783	75%	0.754	S	S	*	*				79.9	125.2	52.6	-156.8	0	0	0	0	117
112	L	34.2	Very low	34.6	Very low	173 Å²	173	126.1 Å²	126.1	91%	0.906	76%	0.757	S	S	*	*			trans	-167	177.2	156.8	-107	169.6	0	0	0	111.6
113	N	36.1	Very low	34.9	Very low	135 Å²	135	126.9 Å²	126.9	72%	0.722	76%	0.763	S	S	*	*				-145.4	179.4	-129.7	-135.5	-5.3	0	0	0	117.5
114	N	36.1	Very low	35.4	Very low	137 Å²	137	124.4 Å²	124.4	73%	0.733	76%	0.755	S	S	*	*			trans	78.6	151.2	157	-69.8	1.5	0	0	0	119.6
115	V	35	Very low	35.5	Very low	117 Å²	117	129.4 Å²	129.4	71%	0.709	76%	0.76	S	S	*	*			cis	-164.6	144.2	-4.3	119.1	0	0	0	0	114.1
116	S	36.7	Very low	35.6	Very low	105 Å²	105	126.6 Å²	126.6	73%	0.734	75%	0.753	S	S	*	*			trans	35.9	160	140.8	-47	0	0	0	0	124.9
117	S	36.8	Very low	35.5	Very low	95 Å²	95	127.3 Å²	127.3	66%	0.664	76%	0.76	S	S	*	*			cis	178.7	-178.7	-15.4	55.7	0	0	0	0	113.4
118	I	36.1	Very low	35.6	Very low	151 Å²	151	126.4 Å²	126.4	77%	0.774	76%	0.764	S	S	*	*			trans	82.1	155.8	158.9	-64.2	163.9	0	0	0	117.8
119	T	34.8	Very low	35.4	Very low	114 Å²	114	126.2 Å²	126.2	70%	0.699	76%	0.763	S	S	*	*				-163.2	171.8	-82.4	41.4	0	0	0	0	112.6
120	N	35.8	Very low	35.3	Very low	142 Å²	142	124.6 Å²	124.6	76%	0.759	76%	0.764	S	S	*	*			trans	93.1	97.6	153.2	-72.1	0.7	0	0	0	123.9
121	S	38.3	Very low	34.9	Very low	104 Å²	104	123.2 Å²	123.2	73%	0.727	76%	0.762	S	S	*	*				75	140.7	113.1	72.2	0	0	0	0	125.5
122	S	39	Very low	34.8	Very low	126 Å²	126	123.1 Å²	123.1	88%	0.881	76%	0.757	S	S	*	*			trans	104.1	155.3	151.9	78.2	0	0	0	0	119.2
123	S	37.4	Very low	34.6	Very low	111 Å²	111	118.7 Å²	118.7	78%	0.776	74%	0.74	S	S	*	*			trans	-168.3	-178.8	-152.2	58.5	0	0	0	0	110.7
124	P	40.8	Very low	34.3	Very low	103 Å²	103	118.4 Å²	118.4	67%	0.669	74%	0.744	S	S	*	*			cis	-124.4	-177.5	-38.8	38.2	-23.5	0	0	0	111.9
125	F	34.3	Very low	34.1	Very low	197 Å²	197	117 Å²	117	86%	0.864	75%	0.751	S	S	*	*			trans	176.6	147.9	130.6	-105.9	-71.9	0	0	0	114.5
126	S	35.2	Very low	33.8	Very low	91 Å²	91	117 Å²	117	64%	0.636	76%	0.756	S	S	*	*			trans	49.3	104.8	154.2	-63.3	0	0	0	0	124
127	L	29.4	Very low	33.4	Very low	167 Å²	167	116.1 Å²	116.1	87%	0.874	76%	0.755	S	S	*	*				48.7	105.8	117.3	-63.4	164.6	0	0	0	121.2
128	S	32.5	Very low	33	Very low	112 Å²	112	118.8 Å²	118.8	78%	0.783	76%	0.76	S	S	*	*				-176.4	144.8	112.8	62	0	0	0	0	114.5
129	S	31.5	Very low	32.8	Very low	106 Å²	106	118.9 Å²	118.9	74%	0.741	76%	0.761	S	S	*	*			trans	50	116.2	151.2	63.5	0	0	0	0	122.6
130	A	30.3	Very low	33	Very low	102 Å²	102	117.6 Å²	117.6	84%	0.843	76%	0.755	S	S	*	*			trans	74.2	157.3	137.8	0	0	0	0	0	121.8
131	A	30.1	Very low	32.8	Very low	87 Å²	87	119.6 Å²	119.6	72%	0.719	76%	0.757	S	S	*	*			trans	73.9	98.8	159.1	0	0	0	0	0	120.8
132	T	30.6	Very low	32.4	Very low	111 Å²	111	119.8 Å²	119.8	68%	0.681	75%	0.754	S	S	*	*			trans	72.3	135.1	135.1	-7.2	0	0	0	0	122.6	L237	T132-L237 HydrophobicContact CG2-CD2 4.44Å
133	S	30.6	Very low	32.2	Very low	80 Å²	80	119.6 Å²	119.6	56%	0.559	75%	0.752	S	S	*	*			trans	78.6	121.8	139.8	-135.3	0	0	0	0	122
134	T	29.6	Very low	31.9	Very low	129 Å²	129	121.4 Å²	121.4	79%	0.791	75%	0.753	S	S	*	*			trans	39.4	107.7	134.8	58.1	0	0	0	0	120.6
135	A	31	Very low	31.5	Very low	106 Å²	106	121.3 Å²	121.3	88%	0.876	75%	0.751	S	S	*	*			trans	-155.9	152.7	132.4	0	0	0	0	0	111.9
136	S	29.5	Very low	31.4	Very low	119 Å²	119	114.7 Å²	114.7	83%	0.832	73%	0.732	S	S	*	*			trans	-94.2	-174.8	179.6	-49.1	0	0	0	0	112.6
137	A	28	Very low	31.3	Very low	85 Å²	85	115.4 Å²	115.4	70%	0.702	73%	0.733	S	S	*	*			trans	74.7	109.6	172.7	0	0	0	0	0	115.4
138	I	28.9	Very low	31.4	Very low	151 Å²	151	114.8 Å²	114.8	77%	0.774	73%	0.73	S	S	*	*			cis	87.9	150.1	42.5	-57.1	161.1	0	0	0	112.4
139	I	31.8	Very low	31.3	Very low	154 Å²	154	117.8 Å²	117.8	79%	0.79	73%	0.732	S	S	*	*			trans	69	159	168.8	41.3	175.5	0	0	0	119
140	P	38.9	Very low	31.5	Very low	87 Å²	87	118.6 Å²	118.6	57%	0.565	74%	0.735	S	S	*	*			cis	-138.3	179.4	-7.5	26.6	-2.5	0	0	0	117.6
141	F	31.2	Very low	31.5	Very low	184 Å²	184	121.8 Å²	121.8	81%	0.807	73%	0.731	S	S	*	*			trans	65	138.6	152.5	-58.8	-45.6	0	0	0	120
142	T	30.5	Very low	31.5	Very low	108 Å²	108	125.7 Å²	125.7	66%	0.663	74%	0.739	S	S	*	*			cis	153.1	142.6	-28.5	39.1	0	0	0	0	107
143	S	34.5	Very low	31.4	Very low	121 Å²	121	126.5 Å²	126.5	85%	0.846	74%	0.74	S	S	*	*			trans	-135.1	109	155.9	61.3	0	0	0	0	110
144	N	30.7	Very low	31.5	Very low	149 Å²	149	130.6 Å²	130.6	80%	0.797	75%	0.75	S	S	*	*			trans	-76.4	138.5	-176.8	-82.8	-29.9	0	0	0	112.8
145	V	33.1	Very low	31.6	Very low	102 Å²	102	132.3 Å²	132.3	62%	0.618	75%	0.748	S	S	*	*			trans	-141.3	124.5	139.6	-170.4	0	0	0	0	110.1	R33	R33-V145 PolarHBondContact NH2-O 2.74Å
146	A	30.9	Very low	31.5	Very low	58 Å²	58	132.8 Å²	132.8	48%	0.479	74%	0.74	S	S	.	*			trans	-70.5	-168	176.9	0	0	0	0	0	111.6	R32	R32-A146 PolarHBondContact NH1-O 3.26Å
147	T	33.4	Very low	31.5	Very low	105 Å²	105	131.5 Å²	131.5	64%	0.644	73%	0.731	S	S	*	*			cis	-151.2	152.5	21.6	44.6	0	0	0	0	111.9
148	N	30.8	Very low	31.8	Very low	154 Å²	154	138.7 Å²	138.7	82%	0.824	74%	0.74	S	S	*	*			trans	56.6	137.2	141.3	-54.3	0.9	0	0	0	122.9
149	H	32	Very low	32	Very low	176 Å²	176	137.5 Å²	137.5	82%	0.815	73%	0.734	S	S	*	*			trans	-77.1	169.2	158.8	-79.1	-96.3	0	0	0	111.4
150	P	34.6	Very low	32.1	Very low	123 Å²	123	135.8 Å²	135.8	80%	0.799	73%	0.733	S	S	*	*				-139.1	166.1	92.8	38.6	-26	0	0	0	115.2
151	H	30.4	Very low	31.8	Very low	168 Å²	168	140 Å²	140	78%	0.778	75%	0.745	S	S	*	*			trans	-74.6	152.1	159.3	-92.9	-111.5	0	0	0	110.7
152	L	30.8	Very low	31.9	Very low	169 Å²	169	134.9 Å²	134.9	89%	0.885	74%	0.736	S	S	*	*			trans	-164.7	163.1	144.2	-112.4	157.8	0	0	0	112.3
153	N	27.7	Very low	31.8	Very low	129 Å²	129	137 Å²	137	69%	0.69	74%	0.742	S	S	*	*			trans	-101.5	168.6	-169.8	-75.8	-24.4	0	0	0	113.6
154	H	33.5	Very low	31.8	Very low	166 Å²	166	137.4 Å²	137.4	77%	0.769	74%	0.739	S	S	*	*			trans	77.4	132.1	144.4	-82.7	-59	0	0	0	121.9
155	H	30.7	Very low	31.9	Very low	165 Å²	165	136.6 Å²	136.6	76%	0.764	74%	0.74	S	S	*	*				112	145.5	124.3	-115	-86.3	0	0	0	122.1
156	V	28.9	Very low	32	Very low	115 Å²	115	135.5 Å²	135.5	70%	0.697	75%	0.749	S	S	*	*			trans	77.2	88.7	162.4	-167.6	0	0	0	0	120.8
157	S	29.9	Very low	32.1	Very low	92 Å²	92	136.3 Å²	136.3	64%	0.643	76%	0.763	S	S	*	*				36.4	131.8	114.5	-42.8	0	0	0	0	124.6
158	R	33.3	Very low	32.2	Very low	236 Å²	236	137.3 Å²	137.3	89%	0.891	77%	0.769	S	S	*	*				-177	126.6	113.9	-93.5	168.1	-168.6	-151.1	3.3	108.9
159	I	34.2	Very low	32.3	Very low	126 Å²	126	137.8 Å²	137.8	65%	0.646	77%	0.772	S	S	*	*				70.4	120.5	54.1	-62.7	-179.8	0	0	0	110.7	Q161	I159-Q161 HydrophobicContact CG2-CG 4.08Å
160	P	34.2	Very low	32.4	Very low	118 Å²	118	133.1 Å²	133.1	77%	0.766	77%	0.771	S	S	*	*				-106.8	149.7	54	1.4	21.4	0	0	0	115
161	Q	32.5	Very low	32.3	Very low	176 Å²	176	132.5 Å²	132.5	82%	0.822	77%	0.77	S	S	*	*				80.8	142	60.6	-68.6	-177.9	-4.8	0	0	114.1	I159	I159-Q161 HydrophobicContact CG2-CG 4.08Å
162	A	32.1	Very low	32.3	Very low	76 Å²	76	132.3 Å²	132.3	63%	0.628	77%	0.774	S	S	*	*			cis	-151.9	156.6	19.3	0	0	0	0	0	116
163	I	29.9	Very low	32.5	Very low	154 Å²	154	129.8 Å²	129.8	79%	0.79	77%	0.767	S	S	*	*			trans	60.1	117.6	143.7	-62.6	160.9	0	0	0	118.3
164	V	33	Very low	33.4	Very low	129 Å²	129	129.2 Å²	129.2	78%	0.782	77%	0.77	S	S	*	*			cis	81.7	134.5	24.3	-170.6	0	0	0	0	113.9
165	T	34.4	Very low	33.3	Very low	132 Å²	132	129.4 Å²	129.4	81%	0.81	78%	0.776	S	S	*	*			cis	-113.1	-168.4	11.9	56.2	0	0	0	0	112.9
166	G	33.6	Very low	33.3	Very low	78 Å²	78	128.7 Å²	128.7	80%	0.804	78%	0.777	S	S	*	*			cis	126.2	113.1	-17.4	0	0	0	0	0	117.6
167	G	33.9	Very low	33.3	Very low	76 Å²	76	130.8 Å²	130.8	78%	0.784	78%	0.783	S	S	*	*			trans	121.3	147.3	166.5	0	0	0	0	0	116.5
168	T	35.4	Very low	33.4	Very low	126 Å²	126	131.7 Å²	131.7	77%	0.773	79%	0.79	S	S	*	*			cis	-158.2	138.4	-6.3	49.2	0	0	0	0	113.9
169	N	32.5	Very low	34.3	Very low	164 Å²	164	126 Å²	126	88%	0.877	78%	0.783	S	S	*	*			trans	57.7	143.6	138.9	-56.4	-4.7	0	0	0	125.5
170	G	34.5	Very low	34	Very low	77 Å²	77	127.1 Å²	127.1	79%	0.794	80%	0.796	S	S	*	*			trans	106.3	109.8	161.5	0	0	0	0	0	115.3
171	S	32.2	Very low	34	Very low	110 Å²	110	126.7 Å²	126.7	77%	0.769	80%	0.795	S	S	*	*			cis	87.7	100.6	16.5	-167.8	0	0	0	0	117.8
172	L	30.7	Very low	33.9	Very low	165 Å²	165	123 Å²	123	86%	0.864	80%	0.795	S	S	*	*				171.8	159.2	122.7	-87.9	173.8	0	0	0	111.5
173	P	35.6	Very low	33.9	Very low	115 Å²	115	124.1 Å²	124.1	75%	0.747	81%	0.805	S	S	*	*			trans	-125.6	-142.4	-160.5	47.8	-30.4	0	0	0	114.2
174	P	46	Very low	34.1	Very low	117 Å²	117	121.8 Å²	121.8	76%	0.76	81%	0.808	S	S	*	*			trans	-115.6	170.9	-133.2	38.7	-19.5	0	0	0	116.4
175	L	31.7	Very low	34.1	Very low	170 Å²	170	120 Å²	120	89%	0.89	81%	0.807	S	S	*	*			trans	-145.6	165	168.4	-93.4	-179.9	0	0	0	114.3
176	L	30	Very low	34.1	Very low	150 Å²	150	119.9 Å²	119.9	79%	0.785	81%	0.806	S	S	*	*			trans	-92.6	174.2	-171.7	-55.5	116.4	0	0	0	113.5
177	I	30.7	Very low	34.5	Very low	159 Å²	159	120.6 Å²	120.6	82%	0.815	80%	0.797	S	S	*	*				171.3	122.5	118.2	-85.4	155.4	0	0	0	112.9
178	S	30.7	Very low	34.2	Very low	112 Å²	112	124.3 Å²	124.3	78%	0.783	80%	0.798	S	S	*	*			trans	35	158.9	142.5	-49.4	0	0	0	0	125.6
179	P	51.6	Low	34	Very low	115 Å²	115	125 Å²	125	75%	0.747	80%	0.795	S	S	*	*			trans	-108.7	167.1	-174.9	41.7	-34.5	0	0	0	116.1
180	T	29.6	Very low	33.8	Very low	151 Å²	151	122.5 Å²	122.5	93%	0.926	79%	0.791	S	S	*	*			trans	-159.4	178.5	158.1	-2.9	0	0	0	0	112.7
181	S	32.5	Very low	33.7	Very low	108 Å²	108	122.6 Å²	122.6	76%	0.755	79%	0.792	S	S	*	*			trans	-132.7	169.5	-164.5	60.5	0	0	0	0	115.1
182	A	31.9	Very low	33.6	Very low	98 Å²	98	127.4 Å²	127.4	81%	0.81	80%	0.799	S	S	*	*			trans	72.9	157.9	162.5	0	0	0	0	0	117.3
183	A	32.2	Very low	33.6	Very low	101 Å²	101	124.4 Å²	124.4	84%	0.835	80%	0.798	S	S	*	*			cis	-167.4	157.7	-26.7	0	0	0	0	0	110.3
184	A	34.1	Very low	33.3	Very low	104 Å²	104	122.1 Å²	122.1	86%	0.86	80%	0.795	S	S	*	*			trans	-157.9	156.9	166.3	0	0	0	0	0	110.6
185	A	32.7	Very low	33.1	Very low	92 Å²	92	122.4 Å²	122.4	76%	0.76	80%	0.797	S	S	*	*			trans	-156.9	175.3	-164.3	0	0	0	0	0	111.9
186	T	33.6	Very low	32.9	Very low	130 Å²	130	122.6 Å²	122.6	80%	0.798	80%	0.796	S	S	*	*			cis	-147.2	-66.8	16.6	-34.2	0	0	0	0	117.8
187	P	42.7	Very low	32.9	Very low	93 Å²	93	120.4 Å²	120.4	60%	0.604	79%	0.793	S	S	*	*				-136.1	167.8	-127.3	42.7	-28.3	0	0	0	120.1
188	L	28	Very low	33.3	Very low	154 Å²	154	118.2 Å²	118.2	81%	0.806	79%	0.789	S	S	*	*			trans	69	148.1	152.6	-69.3	152	0	0	0	116.4
189	I	30.7	Very low	33.2	Very low	140 Å²	140	118 Å²	118	72%	0.718	79%	0.787	S	S	*	*			cis	-143.4	128.9	16	-115.6	139.8	0	0	0	108.6
190	S	28.9	Very low	32.2	Very low	111 Å²	111	118.9 Å²	118.9	78%	0.776	79%	0.791	S	S	*	*				64.9	113.4	96.4	146.5	0	0	0	0	116.9
191	G	32.4	Very low	32.1	Very low	79 Å²	79	115 Å²	115	81%	0.814	78%	0.78	S	S	*	*			trans	-164.6	96.6	174.6	0	0	0	0	0	114.7
192	K	30.1	Very low	32	Very low	211 Å²	211	115.4 Å²	115.4	92%	0.917	78%	0.783	S	S	*	*			trans	-46.7	165.8	166	-66	168.8	179.3	176.6	0	113.3
193	A	30.1	Very low	32.1	Very low	102 Å²	102	115.9 Å²	115.9	84%	0.843	78%	0.779	S	S	*	*			cis	-176.6	176	-14	0	0	0	0	0	105.4
194	G	29.2	Very low	31.7	Very low	68 Å²	68	118.2 Å²	118.2	70%	0.701	78%	0.775	S	S	*	*			cis	-167.9	178.4	0.7	0	0	0	0	0	109.8
195	P	41.7	Very low	31.5	Very low	123 Å²	123	120.4 Å²	120.4	80%	0.799	77%	0.773	S	S	*	*			trans	-102.5	-158.4	-164.1	41.4	-37.4	0	0	0	114.5
196	M	27.7	Very low	31.2	Very low	174 Å²	174	123.1 Å²	123.1	86%	0.857	78%	0.78	S	S	*	*			trans	97.1	140.5	178	-57.7	168.8	68	0	0	114.2
197	S	29	Very low	30.7	Very low	104 Å²	104	121.2 Å²	121.2	73%	0.727	78%	0.777	S	S	*	*			cis	-159.1	170.8	-10.6	-104.1	0	0	0	0	111
198	P	40.3	Very low	29.9	Very low	112 Å²	112	121 Å²	121	73%	0.727	78%	0.783	S	S	*	*			trans	-105.2	178.7	-162.6	40.7	-37.3	0	0	0	116.8
199	S	28.9	Very low	29.8	Very low	108 Å²	108	119.6 Å²	119.6	76%	0.755	78%	0.781	S	S	*	*			trans	78.3	163.4	172.2	88.6	0	0	0	0	115.5
200	T	29.4	Very low	29.5	Very low	133 Å²	133	118.1 Å²	118.1	82%	0.816	78%	0.778	S	S	*	*			cis	-149.7	150.8	11.8	-18.6	0	0	0	0	111.8
201	G	28.1	Very low	29.3	Very low	69 Å²	69	120.1 Å²	120.1	71%	0.711	78%	0.779	S	S	*	*			trans	77.5	171.3	157.5	0	0	0	0	0	118
202	S	29.7	Very low	29	Very low	117 Å²	117	124.2 Å²	124.2	82%	0.818	78%	0.777	S	S	*	*			cis	-148	-160.1	-19	-63.6	0	0	0	0	108.3
203	P	34.3	Very low	28.8	Very low	109 Å²	109	119.5 Å²	119.5	71%	0.708	76%	0.762	S	S	*	*				-133.4	-155.9	-125.9	33.6	-6.2	0	0	0	114.8
204	I	25.3	Very low	28.6	Very low	149 Å²	149	119.8 Å²	119.8	76%	0.764	76%	0.764	S	S	*	*			trans	83.9	144.7	155.7	-66.5	162.4	0	0	0	118.1
205	N	29.8	Very low	28.4	Very low	151 Å²	151	122.8 Å²	122.8	81%	0.807	77%	0.769	S	S	*	*			trans	-64.2	139.2	178.2	-46.1	-84.6	0	0	0	113.3
206	V	25.7	Very low	27.7	Very low	149 Å²	149	122.1 Å²	122.1	90%	0.903	77%	0.767	S	S	*	*			trans	-132.9	148.2	142.5	-174.9	0	0	0	0	108.2
207	A	23.8	Very low	27.8	Very low	90 Å²	90	119.8 Å²	119.8	74%	0.744	77%	0.768	S	S	*	*			trans	-116.5	161.1	-174.8	0	0	0	0	0	113.1
208	A	24.8	Very low	28.1	Very low	87 Å²	87	120.1 Å²	120.1	72%	0.719	77%	0.767	S	S	*	*			trans	83.1	155.7	158.9	0	0	0	0	0	119.4
209	T	25.9	Very low	27.5	Very low	125 Å²	125	122 Å²	122	77%	0.767	77%	0.766	S	S	*	*			trans	80	124.5	149.5	-58.2	0	0	0	0	117
210	V	23.9	Very low	27.4	Very low	110 Å²	110	124.3 Å²	124.3	67%	0.667	77%	0.765	S	S	*	*			cis	-167.3	168.9	-9.4	71.3	0	0	0	0	112.2
211	L	25.4	Very low	27.4	Very low	152 Å²	152	123.2 Å²	123.2	80%	0.796	76%	0.763	S	S	*	*			trans	76	163	160	-71.6	172.1	0	0	0	120.6
212	Q	26.5	Very low	27.5	Very low	166 Å²	166	127.2 Å²	127.2	78%	0.776	77%	0.766	S	S	*	*			trans	79.1	99.1	164.8	-51.7	-162.4	16.4	0	0	120.8
213	N	25.2	Very low	27.6	Very low	112 Å²	112	129.3 Å²	129.3	60%	0.599	76%	0.761	S	S	*	*				47.1	98.6	123.7	-54.4	-20.8	0	0	0	120.2	M539	N213-M539 HydrophobicContact CB-CE 3.85Å; N213-M539 WeakPolarHBondContact ND2-CE 3.41Å
214	A	26	Very low	27.3	Very low	107 Å²	107	130.7 Å²	130.7	88%	0.884	76%	0.762	S	S	*	*			trans	-158.7	141.9	140	0	0	0	0	0	115
215	V	26.2	Very low	27.7	Very low	131 Å²	131	130.8 Å²	130.8	79%	0.794	75%	0.753	S	S	*	*			trans	-48.9	147.5	167.1	168.9	0	0	0	0	114.7
216	S	26.8	Very low	27.7	Very low	110 Å²	110	128 Å²	128	77%	0.769	75%	0.745	S	S	*	*			trans	65.5	111.9	164.2	-67.7	0	0	0	0	119.2
217	S	28.7	Very low	27.8	Very low	125 Å²	125	131.9 Å²	131.9	87%	0.874	74%	0.744	S	S	*	*			trans	-153.1	157.5	155.3	-85.5	0	0	0	0	112
218	P	36.1	Very low	28	Very low	110 Å²	110	135.2 Å²	135.2	71%	0.714	75%	0.749	S	S	*	*			trans	-126.4	-158.3	-151.1	34.4	-13.3	0	0	0	113.2
219	Q	28.1	Very low	28.2	Very low	151 Å²	151	138.1 Å²	138.1	71%	0.706	75%	0.752	S	S	*	*			trans	120.5	128.1	152.2	-63.1	-93.6	-55.9	0	0	116.3
220	H	26.4	Very low	28.4	Very low	157 Å²	157	142.1 Å²	142.1	73%	0.727	76%	0.759	S	S	*	*			trans	37.9	111	153.4	-67.1	-98.7	0	0	0	120.3
221	S	29.9	Very low	29	Very low	110 Å²	110	144 Å²	144	77%	0.769	76%	0.763	S	S	*	*			trans	-106.3	123.7	149.1	-168.9	0	0	0	0	109	F223	S221-F223 PolarHBondContact O-N 2.72Å; S221-F223 VanDerWaalsContact O-N 3.08Å
222	I	30.1	Very low	29.5	Very low	153 Å²	153	141.9 Å²	141.9	79%	0.785	76%	0.759	S	S	*	*			trans	-84.9	81.7	-172.5	-60.4	168.3	0	0	0	108.9
223	F	31.4	Very low	29.9	Very low	162 Å²	162	139 Å²	139	71%	0.711	75%	0.754	S	S	*	*			trans	-143.2	54.2	174.7	-98.8	-73.9	0	0	0	111.9	S221 R225	S221-F223 PolarHBondContact O-N 2.72Å; S221-F223 VanDerWaalsContact O-N 3.08Å; F223-R225 PolarHBondContact O-N 2.83Å
224	D	27.6	Very low	30.1	Very low	137 Å²	137	140.9 Å²	140.9	73%	0.733	77%	0.765	S	S	*	*			trans	-70.7	108.4	162.9	-168.6	-21.6	0	0	0	108.9	S226	D224-S226 VanDerWaalsContact CG-OG 3.28Å; D224-S226 WeakPolarHBondContact OD1-CB 3.26Å; D224-S226 PolarHBondContact OD1-N 2.83Å; D224-S226 PolarHBondContact OD1-OG 3.17Å
225	R	33.7	Very low	30.3	Very low	151 Å²	151	141.6 Å²	141.6	57%	0.57	76%	0.758	S	S	*	*			trans	-99.5	25.9	-178.8	-124.3	-176.1	-179.5	-177.9	3.8	112.9	F223 R227 D402	F223-R225 PolarHBondContact O-N 2.83Å; R225-R227 PolarHBondContact O-N 3.15Å; R225-D402 IonicContact CZ-OD2 3.75Å; R225-D402 IonicContact NH1-OD2 2.82Å; R225-D402 PolarHBondContact NH1-OD2 3.36Å
226	S	29.7	Very low	30.6	Very low	93 Å²	93	140.2 Å²	140.2	65%	0.65	75%	0.754	S	S	*	*			trans	-68.7	39.8	172.9	57.9	0	0	0	0	115	D224	D224-S226 VanDerWaalsContact CG-OG 3.28Å; D224-S226 WeakPolarHBondContact OD1-CB 3.26Å; D224-S226 PolarHBondContact OD1-N 2.83Å; D224-S226 PolarHBondContact OD1-OG 3.17Å
227	R	27.4	Very low	30.7	Very low	230 Å²	230	141.4 Å²	141.4	87%	0.868	75%	0.751	S	S	*	*			trans	-137	63.8	174	-74.5	-164.9	176.5	-156.1	1.8	112.7	R225	R225-R227 PolarHBondContact O-N 3.15Å
228	L	29.3	Very low	30.9	Very low	161 Å²	161	139.1 Å²	139.1	84%	0.843	74%	0.74	S	S	*	*	S	Bend	trans	-171.3	96.9	140.9	-127.1	68.2	0	0	0	110.8
229	N	28.6	Very low	30.6	Very low	147 Å²	147	138.7 Å²	138.7	79%	0.786	74%	0.739	S	S	*	*			trans	158.4	91.3	144.2	-85.7	-6.1	0	0	0	111.6
230	K	30.3	Very low	30.8	Very low	210 Å²	210	137 Å²	137	91%	0.913	74%	0.744	S	S	*	*			trans	-145.3	91.4	147.5	-143.8	173.7	-171	179.4	0	109.4
231	I	35.6	Very low	31	Very low	148 Å²	148	134.7 Å²	134.7	76%	0.759	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-90	119	174.7	-63.6	171.7	0	0	0	107.5
232	P	37.1	Very low	30.9	Very low	108 Å²	108	134.7 Å²	134.7	70%	0.701	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-78.1	145.7	161.5	32.9	-31.8	0	0	0	110
233	P	33.1	Very low	31.2	Very low	105 Å²	105	132.9 Å²	132.9	68%	0.682	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-87.3	145.9	-171.1	33.4	-35.6	0	0	0	114.5
234	N	30.4	Very low	31.1	Very low	153 Å²	153	129.3 Å²	129.3	82%	0.818	74%	0.739	S	S	*	*			trans	64.4	158.2	163.1	-54.6	-23.1	0	0	0	115.9
235	T	30.7	Very low	31.4	Very low	122 Å²	122	129.8 Å²	129.8	75%	0.748	74%	0.742	S	S	*	*			cis	-152.9	158.6	12.3	-27.8	0	0	0	0	110.5
236	S	31.8	Very low	31.3	Very low	102 Å²	102	127 Å²	127	71%	0.713	75%	0.751	S	S	*	*			trans	61.5	131.8	163.2	52.9	0	0	0	0	118.3
237	L	29.8	Very low	31.6	Very low	135 Å²	135	126.6 Å²	126.6	71%	0.707	75%	0.753	S	S	*	*			cis	67.3	129.8	38.6	-70.4	142.9	0	0	0	113.9	T132	T132-L237 HydrophobicContact CG2-CD2 4.44Å
238	A	31.8	Very low	31.9	Very low	77 Å²	77	122.7 Å²	122.7	64%	0.636	75%	0.749	S	S	*	*			cis	-157.6	156.6	-0.4	0	0	0	0	0	114.8
239	S	30.6	Very low	32.2	Very low	100 Å²	100	121.5 Å²	121.5	70%	0.699	74%	0.744	S	S	*	*			trans	45	138.9	137.1	64.4	0	0	0	0	124.9
240	S	30.7	Very low	32.5	Very low	116 Å²	116	120 Å²	120	81%	0.811	74%	0.736	S	S	*	*			trans	76.4	162.2	146.2	85.4	0	0	0	0	117.4
241	S	31.2	Very low	32.8	Very low	109 Å²	109	118 Å²	118	76%	0.762	73%	0.727	S	S	*	*			cis	-149.1	171	4.4	63.2	0	0	0	0	112.9
242	S	28.7	Very low	32.7	Very low	109 Å²	109	116.1 Å²	116.1	76%	0.762	73%	0.725	S	S	*	*			trans	-132.4	159.5	148.9	58.9	0	0	0	0	106.8
243	P	35.5	Very low	32.4	Very low	115 Å²	115	118.5 Å²	118.5	75%	0.747	73%	0.73	S	S	*	*			cis	-115.2	-146.6	7	43.6	-31.2	0	0	0	112.6
244	S	30.2	Very low	32.3	Very low	87 Å²	87	122.4 Å²	122.4	61%	0.608	74%	0.739	S	S	*	*			trans	-50.1	154.3	172.5	62.8	0	0	0	0	113.5
245	D	33.4	Very low	32.4	Very low	147 Å²	147	123.1 Å²	123.1	79%	0.786	74%	0.737	S	S	*	*			cis	-155.5	165.7	42.8	-101.2	-63.6	0	0	0	115.7
246	A	32.3	Very low	32.4	Very low	93 Å²	93	128.7 Å²	128.7	77%	0.769	75%	0.745	S	S	*	*			trans	54.8	124.7	151.4	0	0	0	0	0	123.6
247	A	34.1	Very low	32.4	Very low	84 Å²	84	132.8 Å²	132.8	69%	0.694	75%	0.752	S	S	*	*			trans	87.8	87.7	138	0	0	0	0	0	122.5
248	N	34.6	Very low	32.4	Very low	148 Å²	148	129 Å²	129	79%	0.791	74%	0.737	S	S	*	*				90.5	127	124.8	-66.2	-9.1	0	0	0	123.2
249	N	34.8	Very low	32.7	Very low	137 Å²	137	132.8 Å²	132.8	73%	0.733	75%	0.745	S	S	*	*			trans	64.3	145.4	154.3	-57.7	-4.9	0	0	0	118
250	D	34.8	Very low	32.9	Very low	115 Å²	115	136.1 Å²	136.1	62%	0.615	75%	0.754	S	S	*	*			cis	-174	157	-18.5	-106.9	2.9	0	0	0	107.1
251	K	37.2	Very low	33.1	Very low	168 Å²	168	133.1 Å²	133.1	73%	0.73	73%	0.733	S	S	*	*			cis	-151.7	172.4	-12.5	-117.7	168.2	-176.4	76.1	0	107.3
252	P	34.3	Very low	33.5	Very low	108 Å²	108	133.6 Å²	133.6	70%	0.701	73%	0.727	S	S	*	*			trans	-109.3	165.1	-140.9	41.1	-40.8	0	0	0	119
253	I	30.1	Very low	33.9	Very low	158 Å²	158	134.1 Å²	134.1	81%	0.81	73%	0.725	S	S	*	*			trans	10.8	112.7	140	-50.6	169.9	0	0	0	116.9
254	Q	31.1	Very low	33.9	Very low	187 Å²	187	138.4 Å²	138.4	87%	0.874	73%	0.727	S	S	*	*			trans	-171.8	104.6	142.6	-110.3	166.7	55.9	0	0	112.7
255	Q	32.6	Very low	34.2	Very low	168 Å²	168	139 Å²	139	79%	0.785	73%	0.727	S	S	*	*			trans	173.3	87.4	141.9	-99.7	-179.6	-4.6	0	0	111.8
256	R	30.7	Very low	34.2	Very low	240 Å²	240	139.1 Å²	139.1	91%	0.906	73%	0.727	S	S	*	*	S	Bend	trans	-86	154	139.4	-79.8	177.6	164.9	150.1	-4.2	106.7
257	H	31.5	Very low	34.4	Very low	187 Å²	187	140.7 Å²	140.7	87%	0.866	73%	0.727	S	S	*	*	S	Bend	trans	73.8	85.9	-167.8	-54.9	-101.6	0	0	0	115.6
258	S	31.3	Very low	34.4	Very low	56 Å²	56	144.7 Å²	144.7	39%	0.392	73%	0.731	S	S	.	*			trans	-160.4	-1	157.4	-158	0	0	0	0	116.8	S261	S258-S261 PolarHBondContact O-OG 2.79Å
259	I	37.3	Very low	34.4	Very low	156 Å²	156	141.6 Å²	141.6	80%	0.8	73%	0.726	S	S	*	*	S	Bend	trans	-99.1	-14.3	-172.6	-59.8	180	0	0	0	113.1
260	L	35	Very low	34.5	Very low	171 Å²	171	143.7 Å²	143.7	90%	0.895	73%	0.734	S	S	*	*	S	Bend	trans	-92.7	4.1	171	-75.5	172.2	0	0	0	114.1
261	S	35.3	Very low	34.7	Very low	53 Å²	53	144.3 Å²	144.3	37%	0.371	74%	0.741	S	S	.	*	S	Bend	trans	-91.4	-29.4	177.5	38.5	0	0	0	0	113.7	S258 R264 T265	S258-S261 PolarHBondContact O-OG 2.79Å; S261-R264 PolarHBondContact O-N 3.37Å; S261-T265 PolarHBondContact O-OG1 2.84Å; S261-T265 VanDerWaalsContact O-OG1 3.12Å
262	N	37.9	Very low	34.7	Very low	118 Å²	118	143.7 Å²	143.7	63%	0.631	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-18.1	-166.7	-64.4	16	0	0	0	114.2
263	V	37.4	Very low	35	Very low	120 Å²	120	146.8 Å²	146.8	73%	0.727	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-18.3	174.9	-175.1	0	0	0	0	111.8	T267	V263-T267 PolarHBondContact O-OG1 3.17Å
264	R	36.3	Very low	35.4	Very low	205 Å²	205	141.9 Å²	141.9	77%	0.774	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-17.1	178	-145.2	177.8	-164	110.4	2.8	113.4	S261	S261-R264 PolarHBondContact O-N 3.37Å
265	T	36.5	Very low	35.8	Very low	99 Å²	99	139.6 Å²	139.6	61%	0.607	75%	0.746	S	S	*	*	S	Bend	trans	-87	-22.7	-176.6	-49.3	0	0	0	0	113.1	S261	S261-T265 PolarHBondContact O-OG1 2.84Å; S261-T265 VanDerWaalsContact O-OG1 3.12Å
266	L	34	Very low	36.4	Very low	151 Å²	151	142.9 Å²	142.9	79%	0.791	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-80.3	-21.7	178.4	-143.9	73.8	0	0	0	113.1	Q268	L266-Q268 VanDerWaalsContact C-N 3.33Å
267	T	35.3	Very low	36.8	Very low	126 Å²	126	138.1 Å²	138.1	77%	0.773	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-86.2	0.2	-178.9	-19.2	0	0	0	0	114	V263	V263-T267 PolarHBondContact O-OG1 3.17Å
268	Q	34.5	Very low	37.4	Very low	167 Å²	167	134.9 Å²	134.9	78%	0.78	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-121.7	8.7	-172.5	-155	167.6	8.8	0	0	113.3	L266	L266-Q268 VanDerWaalsContact C-N 3.33Å
269	A	34.9	Very low	38.3	Very low	83 Å²	83	136.5 Å²	136.5	69%	0.686	75%	0.745	S	S	*	*	S	Bend	trans	-115.8	12.1	-172.9	0	0	0	0	0	114.7
270	M	36.5	Very low	39.1	Very low	182 Å²	182	131.6 Å²	131.6	90%	0.897	73%	0.734	S	S	*	*			trans	-121.9	28.4	179.2	-75.9	-176.1	155.9	0	0	113.2
271	V	39.3	Very low	40	Very low	128 Å²	128	129.8 Å²	129.8	78%	0.776	73%	0.725	S	S	*	*			trans	-109.3	77.3	168.1	-175.5	0	0	0	0	108.2
272	N	37.3	Very low	40.8	Very low	154 Å²	154	130.4 Å²	130.4	82%	0.824	72%	0.724	S	S	*	*			trans	162.7	87.9	157.4	-86.3	-17.7	0	0	0	109.9
273	D	40.2	Very low	41.5	Very low	174 Å²	174	128.9 Å²	128.9	93%	0.93	71%	0.714	S	S	*	*				-164.1	157.6	128.1	-121.3	-38.2	0	0	0	111.8
274	G	39.2	Very low	42.5	Very low	54 Å²	54	129 Å²	129	56%	0.557	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-78.3	156	-168.6	0	0	0	0	0	115.6	R276	G274-R276 PolarHBondContact O-N 2.92Å
275	P	39.5	Very low	43.4	Very low	139 Å²	139	126.6 Å²	126.6	90%	0.903	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-69.6	123.2	-177.1	28.8	-34.6	0	0	0	111.9
276	R	44.2	Very low	44.4	Very low	237 Å²	237	127.1 Å²	127.1	89%	0.894	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-99.3	125.1	161.2	-73	-169.7	172.6	-152.2	-2.1	109.4	G274 L278	G274-R276 PolarHBondContact O-N 2.92Å; R276-L278 PolarHBondContact O-N 3.28Å
277	T	39.3	Very low	45.6	Very low	141 Å²	141	124 Å²	124	87%	0.865	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-66.4	116.4	175.9	47.8	0	0	0	0	110.2
278	L	43.5	Very low	47	Very low	119 Å²	119	121.1 Å²	121.1	62%	0.623	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-76.8	150	171	-71.5	171.1	0	0	0	110.9	R276 D282 M283	R276-L278 PolarHBondContact O-N 3.28Å; L278-D282 HydrophobicContact CB-CB 4.47Å; L278-M283 HydrophobicContact CD1-CE 4.04Å
279	T	51.4	Low	48.5	Very low	89 Å²	89	120 Å²	120	55%	0.546	67%	0.669	S	S	.	*	P	Polyproline II helix	trans	-84.8	159.1	-179.5	15.1	0	0	0	0	111.4	D281 D282	T279-D281 VanDerWaalsContact C-N 3.26Å; T279-D281 PolarHBondContact O-N 3.06Å; T279-D282 WeakPolarHBondContact CB-OD2 3.5Å; T279-D282 PolarHBondContact N-OD2 3.11Å; T279-D282 WeakPolarHBondContact O-CB 3.43Å; T279-D282 PolarHBondContact O-N 2.87Å; T279-D282 VanDerWaalsContact O-N 3.11Å; T279-D282 PolarHBondContact OG1-OD2 3.2Å
280	G	52.9	Low	50.1	Low	54 Å²	54	120.6 Å²	120.6	56%	0.557	66%	0.658	S	S	*	*	H	α-helix	trans	-56.7	-39.1	-175.3	0	0	0	0	0	113.4	D282 M283	G280-D282 PolarHBondContact O-N 3.06Å; G280-M283 WeakPolarHBondContact O-CB 3.36Å; G280-M283 PolarHBondContact O-N 3.45Å; G280-M283 VanDerWaalsContact O-N 3.12Å
281	D	54.7	Low	51.8	Low	133 Å²	133	116.7 Å²	116.7	71%	0.711	64%	0.637	S	S	*	*	H	α-helix	trans	-65.8	-20.9	-178.7	-48.9	-63	0	0	0	113.7	T279	T279-D281 VanDerWaalsContact C-N 3.26Å; T279-D281 PolarHBondContact O-N 3.06Å
282	D	52.8	Low	53.4	Low	65 Å²	65	119.1 Å²	119.1	35%	0.348	63%	0.633	S	S	.	*	H	α-helix	trans	-77.5	-29.8	176.2	-59.9	-66.2	0	0	0	111.9	L278 T279 G280 M286	L278-D282 HydrophobicContact CB-CB 4.47Å; T279-D282 WeakPolarHBondContact CB-OD2 3.5Å; T279-D282 PolarHBondContact N-OD2 3.11Å; T279-D282 WeakPolarHBondContact O-CB 3.43Å; T279-D282 PolarHBondContact O-N 2.87Å; T279-D282 VanDerWaalsContact O-N 3.11Å; T279-D282 PolarHBondContact OG1-OD2 3.2Å; G280-D282 PolarHBondContact O-N 3.06Å; D282-M286 PolarHBondContact O-N 3.11Å; D282-M286 VanDerWaalsContact O-N 3.09Å
283	M	51.6	Low	55.2	Low	86 Å²	86	114.5 Å²	114.5	42%	0.424	62%	0.616	S	S	.	*	H	α-helix	trans	-69.8	-44.3	178.4	-67.6	-73.3	95.5	0	0	111.7	L278 G280 K285 M286 V287	L278-M283 HydrophobicContact CD1-CE 4.04Å; G280-M283 WeakPolarHBondContact O-CB 3.36Å; G280-M283 PolarHBondContact O-N 3.45Å; G280-M283 VanDerWaalsContact O-N 3.12Å; M283-K285 PolarHBondContact O-N 3.12Å; M283-M286 HydrophobicContact CE-CE 4.38Å; M283-M286 HydrophobicContact CE-SD 3.77Å; M283-M286 PolarHBondContact O-N 2.93Å; M283-M286 VanDerWaalsContact O-N 3.16Å; M283-V287 WeakPolarHBondContact O-CG2 3.31Å; M283-V287 PolarHBondContact O-N 3.25Å
284	D	57.9	Low	57	Low	123 Å²	123	114 Å²	114	66%	0.658	60%	0.601	S	S	*	*	H	α-helix	trans	-62.6	-33	177.8	-79.5	-19.9	0	0	0	112.1	S288	D284-S288 WeakPolarHBondContact O-CB 3.38Å; D284-S288 PolarHBondContact O-N 3Å
285	K	56.7	Low	58.7	Low	154 Å²	154	117.1 Å²	117.1	67%	0.67	60%	0.599	S	S	*	*	H	α-helix	trans	-66.8	-49	170.8	-89.9	-173.3	172.7	-178.8	0	112.7	M283 V287 S288 E289	M283-K285 PolarHBondContact O-N 3.12Å; K285-V287 VanDerWaalsContact C-N 3.29Å; K285-V287 PolarHBondContact O-N 2.87Å; K285-S288 PolarHBondContact O-N 3.5Å; K285-S288 VanDerWaalsContact O-N 3.13Å; K285-E289 PolarHBondContact O-N 3.23Å
286	M	56.1	Low	60.4	Low	110 Å²	110	117.5 Å²	117.5	54%	0.542	59%	0.589	S	S	.	*	H	α-helix	trans	-57.5	-42.9	176.5	-93	-178.5	57.1	0	0	111.8	D282 M283 S288 E289 E290	D282-M286 PolarHBondContact O-N 3.11Å; D282-M286 VanDerWaalsContact O-N 3.09Å; M283-M286 HydrophobicContact CE-CE 4.38Å; M283-M286 HydrophobicContact CE-SD 3.77Å; M283-M286 PolarHBondContact O-N 2.93Å; M283-M286 VanDerWaalsContact O-N 3.16Å; M286-S288 PolarHBondContact O-N 3.03Å; M286-E289 PolarHBondContact O-N 3.19Å; M286-E290 WeakPolarHBondContact O-CB 3.47Å; M286-E290 PolarHBondContact O-N 3.26Å
287	V	60.5	Low	61.7	Low	85 Å²	85	111.9 Å²	111.9	52%	0.515	57%	0.573	S	S	.	*	H	α-helix	trans	-63.9	-40.1	176.3	172.9	0	0	0	0	111.3	M283 K285 E290 E291	M283-V287 WeakPolarHBondContact O-CG2 3.31Å; M283-V287 PolarHBondContact O-N 3.25Å; K285-V287 VanDerWaalsContact C-N 3.29Å; K285-V287 PolarHBondContact O-N 2.87Å; V287-E290 PolarHBondContact O-N 2.81Å; V287-E291 WeakPolarHBondContact O-CB 3.31Å; V287-E291 PolarHBondContact O-N 3.13Å
288	S	65.1	Low	63.5	Low	66 Å²	66	111.6 Å²	111.6	46%	0.462	56%	0.562	S	S	.	*	H	α-helix	trans	-68.2	-35.2	178.1	-161.1	0	0	0	0	113.7	D284 K285 M286 R292	D284-S288 WeakPolarHBondContact O-CB 3.38Å; D284-S288 PolarHBondContact O-N 3Å; K285-S288 PolarHBondContact O-N 3.5Å; K285-S288 VanDerWaalsContact O-N 3.13Å; M286-S288 PolarHBondContact O-N 3.03Å; S288-R292 PolarHBondContact O-N 2.79Å
289	E	65.7	Low	65.3	Low	144 Å²	144	111.5 Å²	111.5	67%	0.673	56%	0.556	S	S	*	*	H	α-helix	trans	-75.4	-38.8	173.3	-71	-167.7	134.3	0	0	112.2	K285 M286 R292 A293	K285-E289 PolarHBondContact O-N 3.23Å; M286-E289 PolarHBondContact O-N 3.19Å; E289-R292 WeakPolarHBondContact O-CB 3.5Å; E289-R292 PolarHBondContact O-N 2.89Å; E289-A293 PolarHBondContact O-N 2.95Å
290	E	68.2	Low	66.6	Low	95 Å²	95	116.3 Å²	116.3	44%	0.444	57%	0.565	S	S	.	*	H	α-helix	trans	-65.2	-40.7	175.5	-160	-167.1	141.1	0	0	111.7	M286 V287 R292 A293 R294	M286-E290 WeakPolarHBondContact O-CB 3.47Å; M286-E290 PolarHBondContact O-N 3.26Å; V287-E290 PolarHBondContact O-N 2.81Å; E290-R292 VanDerWaalsContact C-N 3.32Å; E290-R292 PolarHBondContact O-N 3.42Å; E290-A293 PolarHBondContact O-N 3.03Å; E290-R294 WeakPolarHBondContact O-CB 3.41Å; E290-R294 VanDerWaalsContact O-CG 3.31Å; E290-R294 WeakPolarHBondContact O-CG 3.25Å; E290-R294 PolarHBondContact O-N 3.15Å; E290-R294 IonicContact OE1-CZ 3.06Å; E290-R294 IonicContact OE1-NE 2.84Å; E290-R294 PolarHBondContact OE1-NE 2.93Å; E290-R294 IonicContact OE1-NH2 3.85Å; E290-R294 PolarHBondContact OE1-NH2 2.82Å
291	E	71.3	Confident	67.8	Low	100 Å²	100	118.9 Å²	118.9	47%	0.467	56%	0.562	S	S	.	*	H	α-helix	trans	-69.1	-30.8	176.2	-157.7	-174	126.3	0	0	112.3	V287 K295	V287-E291 WeakPolarHBondContact O-CB 3.31Å; V287-E291 PolarHBondContact O-N 3.13Å; E291-K295 WeakPolarHBondContact O-CB 3.43Å; E291-K295 PolarHBondContact O-N 3.19Å; E291-K295 IonicContact OE1-NZ 3.99Å; E291-K295 PolarHBondContact OE1-NZ 3.24Å
292	R	74	Confident	68.8	Low	179 Å²	179	118.6 Å²	118.6	68%	0.675	56%	0.556	S	S	*	*	H	α-helix	trans	-62.2	-50.1	167.7	-103.8	-172.6	174.1	81.8	0.2	111.5	S288 E289 E290 R294 K295 E296	S288-R292 PolarHBondContact O-N 2.79Å; E289-R292 WeakPolarHBondContact O-CB 3.5Å; E289-R292 PolarHBondContact O-N 2.89Å; E290-R292 VanDerWaalsContact C-N 3.32Å; E290-R292 PolarHBondContact O-N 3.42Å; R292-R294 VanDerWaalsContact C-N 3.32Å; R292-R294 PolarHBondContact O-N 2.84Å; R292-K295 PolarHBondContact O-N 2.79Å; R292-E296 PolarHBondContact O-N 2.89Å
293	A	74.4	Confident	69.9	Low	58 Å²	58	120.6 Å²	120.6	48%	0.479	56%	0.564	S	S	.	*	H	α-helix	trans	-60.4	-41.4	179.2	0	0	0	0	0	111.8	E289 E290 E296 Q297	E289-A293 PolarHBondContact O-N 2.95Å; E290-A293 PolarHBondContact O-N 3.03Å; A293-E296 PolarHBondContact O-N 2.9Å; A293-Q297 WeakPolarHBondContact O-CB 3.29Å; A293-Q297 PolarHBondContact O-N 3.09Å
294	R	77.6	Confident	71.1	Confident	164 Å²	164	121.2 Å²	121.2	62%	0.619	57%	0.566	S	S	*	*	H	α-helix	trans	-61.3	-46.5	174.3	-73	172.5	179.4	-131.6	7.8	112.1	E290 R292 E296 Q297 E298	E290-R294 WeakPolarHBondContact O-CB 3.41Å; E290-R294 VanDerWaalsContact O-CG 3.31Å; E290-R294 WeakPolarHBondContact O-CG 3.25Å; E290-R294 PolarHBondContact O-N 3.15Å; E290-R294 IonicContact OE1-CZ 3.06Å; E290-R294 IonicContact OE1-NE 2.84Å; E290-R294 PolarHBondContact OE1-NE 2.93Å; E290-R294 IonicContact OE1-NH2 3.85Å; E290-R294 PolarHBondContact OE1-NH2 2.82Å; R292-R294 VanDerWaalsContact C-N 3.32Å; R292-R294 PolarHBondContact O-N 2.84Å; R294-E296 PolarHBondContact O-N 3.41Å; R294-Q297 PolarHBondContact O-N 2.96Å; R294-E298 WeakPolarHBondContact O-CB 3.42Å; R294-E298 PolarHBondContact O-N 2.78Å
295	K	75.2	Confident	72	Confident	118 Å²	118	121.3 Å²	121.3	51%	0.513	56%	0.56	S	S	.	*	H	α-helix	trans	-65.7	-35.5	177.4	-82	168	171.8	159	0	113.2	E291 R292 K299	E291-K295 WeakPolarHBondContact O-CB 3.43Å; E291-K295 PolarHBondContact O-N 3.19Å; E291-K295 IonicContact OE1-NZ 3.99Å; E291-K295 PolarHBondContact OE1-NZ 3.24Å; R292-K295 PolarHBondContact O-N 2.79Å; K295-K299 WeakPolarHBondContact O-CB 3.44Å; K295-K299 PolarHBondContact O-N 3.28Å
296	E	74.7	Confident	72.9	Confident	147 Å²	147	115.9 Å²	115.9	69%	0.687	54%	0.544	S	S	*	.	H	α-helix	trans	-74.4	-34.4	176.2	-169.7	153.3	-152.1	0	0	112.2	R292 A293 R294 R300	R292-E296 PolarHBondContact O-N 2.89Å; A293-E296 PolarHBondContact O-N 2.9Å; R294-E296 PolarHBondContact O-N 3.41Å; E296-R300 WeakPolarHBondContact O-CB 3.44Å; E296-R300 PolarHBondContact O-N 3.36Å; E296-R300 VanDerWaalsContact O-N 3.08Å
297	Q	73.1	Confident	73.7	Confident	119 Å²	119	113.2 Å²	113.2	56%	0.556	54%	0.54	S	S	*	.	H	α-helix	trans	-67.2	-44.1	169.5	-177.7	172.6	-27.7	0	0	112	A293 R294 K299 R300 E301	A293-Q297 WeakPolarHBondContact O-CB 3.29Å; A293-Q297 PolarHBondContact O-N 3.09Å; R294-Q297 PolarHBondContact O-N 2.96Å; Q297-K299 PolarHBondContact O-N 3.45Å; Q297-R300 CarbonylContact O-C 3.6Å; Q297-R300 WeakPolarHBondContact O-CB 3.49Å; Q297-R300 PolarHBondContact O-N 3.49Å; Q297-R300 VanDerWaalsContact O-N 3.08Å; Q297-E301 HydrophobicContact CG-CG 4.49Å; Q297-E301 PolarHBondContact NE2-OE1 2.9Å; Q297-E301 PolarHBondContact O-N 2.87Å
298	E	77.1	Confident	74.2	Confident	136 Å²	136	117 Å²	117	64%	0.636	54%	0.544	S	S	*	.	H	α-helix	trans	-59.9	-44.6	177	-177.9	172.4	-146.7	0	0	111.5	R294 R300 E301 E302	R294-E298 WeakPolarHBondContact O-CB 3.42Å; R294-E298 PolarHBondContact O-N 2.78Å; E298-R300 VanDerWaalsContact C-N 3.3Å; E298-R300 PolarHBondContact O-N 2.98Å; E298-E301 PolarHBondContact O-N 2.82Å; E298-E302 PolarHBondContact O-N 3Å
299	K	80.4	Confident	74.4	Confident	116 Å²	116	120 Å²	120	50%	0.504	55%	0.546	S	S	.	.	H	α-helix	trans	-58.8	-40.3	172.2	179.6	177.2	177.3	-66.3	0	112.2	K295 Q297 E302 E303	K295-K299 WeakPolarHBondContact O-CB 3.44Å; K295-K299 PolarHBondContact O-N 3.28Å; Q297-K299 PolarHBondContact O-N 3.45Å; K299-E302 PolarHBondContact O-N 3.3Å; K299-E303 WeakPolarHBondContact CE-OE1 3.18Å; K299-E303 IonicContact NZ-OE1 3.15Å; K299-E303 PolarHBondContact NZ-OE1 2.67Å; K299-E303 IonicContact NZ-OE2 2.61Å; K299-E303 WeakPolarHBondContact O-CB 3.1Å; K299-E303 WeakPolarHBondContact O-CG 3.34Å; K299-E303 PolarHBondContact O-N 2.98Å
300	R	79.1	Confident	74.1	Confident	191 Å²	191	118.5 Å²	118.5	72%	0.721	54%	0.541	S	S	*	.	H	α-helix	trans	-71.1	-38.7	179.8	-159.4	177.1	-161.3	163.8	6	112.2	E296 Q297 E298 E303 E304	E296-R300 WeakPolarHBondContact O-CB 3.44Å; E296-R300 PolarHBondContact O-N 3.36Å; E296-R300 VanDerWaalsContact O-N 3.08Å; Q297-R300 CarbonylContact O-C 3.6Å; Q297-R300 WeakPolarHBondContact O-CB 3.49Å; Q297-R300 PolarHBondContact O-N 3.49Å; Q297-R300 VanDerWaalsContact O-N 3.08Å; E298-R300 VanDerWaalsContact C-N 3.3Å; E298-R300 PolarHBondContact O-N 2.98Å; R300-E303 PolarHBondContact O-N 3.21Å; R300-E304 WeakPolarHBondContact O-CB 3.41Å; R300-E304 PolarHBondContact O-N 2.81Å
301	E	77.5	Confident	73.5	Confident	108 Å²	108	120 Å²	120	51%	0.505	55%	0.552	S	S	.	*	H	α-helix	trans	-66.3	-36.6	171.3	-74.8	-175.7	-153.1	0	0	111.5	Q297 E298 K305	Q297-E301 HydrophobicContact CG-CG 4.49Å; Q297-E301 PolarHBondContact NE2-OE1 2.9Å; Q297-E301 PolarHBondContact O-N 2.87Å; E298-E301 PolarHBondContact O-N 2.82Å; E301-K305 WeakPolarHBondContact O-CB 3.18Å; E301-K305 PolarHBondContact O-N 2.8Å
302	E	76	Confident	72.8	Confident	126 Å²	126	119.3 Å²	119.3	59%	0.589	56%	0.555	S	S	*	*	H	α-helix	trans	-69.8	-40.3	173.8	-175.5	156.8	-125	0	0	112.6	E298 K299 K305 A306	E298-E302 PolarHBondContact O-N 3Å; K299-E302 PolarHBondContact O-N 3.3Å; E302-K305 CarbonylContact O-C 3.56Å; E302-K305 PolarHBondContact O-N 2.85Å; E302-A306 WeakPolarHBondContact O-CB 3.49Å; E302-A306 PolarHBondContact O-N 3.23Å
303	E	75.7	Confident	71.7	Confident	107 Å²	107	117.1 Å²	117.1	50%	0.5	55%	0.552	S	S	.	*	H	α-helix	trans	-62.3	-43	172.8	-78.5	174.2	179.3	0	0	111.9	K299 R300 A306 A307	K299-E303 WeakPolarHBondContact CE-OE1 3.18Å; K299-E303 IonicContact NZ-OE1 3.15Å; K299-E303 PolarHBondContact NZ-OE1 2.67Å; K299-E303 IonicContact NZ-OE2 2.61Å; K299-E303 WeakPolarHBondContact O-CB 3.1Å; K299-E303 WeakPolarHBondContact O-CG 3.34Å; K299-E303 PolarHBondContact O-N 2.98Å; R300-E303 PolarHBondContact O-N 3.21Å; E303-A306 PolarHBondContact O-N 2.97Å; E303-A307 PolarHBondContact O-N 3.29Å
304	E	76	Confident	70.5	Confident	99 Å²	99	120.2 Å²	120.2	46%	0.463	56%	0.561	S	S	.	*	H	α-helix	trans	-66.6	-37.9	174.8	-161.8	-170.8	153.1	0	0	111.8	R300 A306 A307 R308	R300-E304 WeakPolarHBondContact O-CB 3.41Å; R300-E304 PolarHBondContact O-N 2.81Å; E304-A306 VanDerWaalsContact C-N 3.28Å; E304-A306 PolarHBondContact O-N 2.9Å; E304-A307 PolarHBondContact O-N 3.46Å; E304-R308 VanDerWaalsContact O-CB 3.32Å; E304-R308 WeakPolarHBondContact O-CB 3.46Å; E304-R308 VanDerWaalsContact O-CG 3.24Å; E304-R308 WeakPolarHBondContact O-CG 3.46Å; E304-R308 PolarHBondContact O-N 3.32Å; E304-R308 IonicContact OE1-CZ 2.65Å; E304-R308 IonicContact OE1-NE 2.71Å; E304-R308 PolarHBondContact OE1-NE 2.65Å; E304-R308 IonicContact OE1-NH2 2.62Å; E304-R308 PolarHBondContact OE1-NH2 2.76Å
305	K	77.2	Confident	69.2	Low	126 Å²	126	116.9 Å²	116.9	55%	0.548	56%	0.555	S	S	.	*	H	α-helix	trans	-73.3	-18.1	176.4	-170.8	-179.5	-164.1	171	0	112.8	E301 E302 R309	E301-K305 WeakPolarHBondContact O-CB 3.18Å; E301-K305 PolarHBondContact O-N 2.8Å; E302-K305 CarbonylContact O-C 3.56Å; E302-K305 PolarHBondContact O-N 2.85Å; K305-R309 VanDerWaalsContact O-CD 3.3Å; K305-R309 WeakPolarHBondContact O-CD 3.25Å; K305-R309 VanDerWaalsContact O-CG 3.23Å; K305-R309 WeakPolarHBondContact O-CG 3.48Å
306	A	75.6	Confident	67.8	Low	39 Å²	39	116.4 Å²	116.4	32%	0.322	55%	0.553	S	S	.	*	H	α-helix	trans	-81.8	-44.7	166.9	0	0	0	0	0	111.2	E302 E303 E304 R308 R309 I310	E302-A306 WeakPolarHBondContact O-CB 3.49Å; E302-A306 PolarHBondContact O-N 3.23Å; E303-A306 PolarHBondContact O-N 2.97Å; E304-A306 VanDerWaalsContact C-N 3.28Å; E304-A306 PolarHBondContact O-N 2.9Å; A306-R308 PolarHBondContact O-N 2.9Å; A306-R309 WeakPolarHBondContact O-CB 3.29Å; A306-R309 PolarHBondContact O-N 3.26Å; A306-I310 PolarHBondContact O-N 2.89Å; A306-I310 VanDerWaalsContact O-N 3.1Å
307	A	74	Confident	66.6	Low	55 Å²	55	115.5 Å²	115.5	46%	0.455	55%	0.553	S	S	.	*	H	α-helix	trans	-57.3	-48.6	172.8	0	0	0	0	0	111.4	E303 E304 R309 I310 D311	E303-A307 PolarHBondContact O-N 3.29Å; E304-A307 PolarHBondContact O-N 3.46Å; A307-R309 PolarHBondContact O-N 2.87Å; A307-R309 VanDerWaalsContact O-N 3.12Å; A307-I310 PolarHBondContact O-N 2.77Å; A307-I310 VanDerWaalsContact O-N 3.09Å; A307-D311 WeakPolarHBondContact O-CB 3.25Å; A307-D311 PolarHBondContact O-N 3.07Å
308	R	70.7	Confident	65.5	Low	163 Å²	163	111.1 Å²	111.1	62%	0.615	54%	0.537	S	S	*	.	H	α-helix	trans	-65.6	-6.1	173.3	-68.1	172.7	179.7	-140.4	13.1	114.7	E304 A306 V312	E304-R308 VanDerWaalsContact O-CB 3.32Å; E304-R308 WeakPolarHBondContact O-CB 3.46Å; E304-R308 VanDerWaalsContact O-CG 3.24Å; E304-R308 WeakPolarHBondContact O-CG 3.46Å; E304-R308 PolarHBondContact O-N 3.32Å; E304-R308 IonicContact OE1-CZ 2.65Å; E304-R308 IonicContact OE1-NE 2.71Å; E304-R308 PolarHBondContact OE1-NE 2.65Å; E304-R308 IonicContact OE1-NH2 2.62Å; E304-R308 PolarHBondContact OE1-NH2 2.76Å; A306-R308 PolarHBondContact O-N 2.9Å; R308-V312 VanDerWaalsContact O-CG2 3.26Å; R308-V312 WeakPolarHBondContact O-CG2 3.21Å
309	R	68.1	Low	64.3	Low	130 Å²	130	110.6 Å²	110.6	49%	0.491	54%	0.535	S	S	.	.	H	α-helix	trans	-90.3	-43.6	167.2	-77.9	163.5	178.9	159.1	-1.8	110.7	K305 A306 A307 D311 V312 E313	K305-R309 VanDerWaalsContact O-CD 3.3Å; K305-R309 WeakPolarHBondContact O-CD 3.25Å; K305-R309 VanDerWaalsContact O-CG 3.23Å; K305-R309 WeakPolarHBondContact O-CG 3.48Å; A306-R309 WeakPolarHBondContact O-CB 3.29Å; A306-R309 PolarHBondContact O-N 3.26Å; A307-R309 PolarHBondContact O-N 2.87Å; A307-R309 VanDerWaalsContact O-N 3.12Å; R309-D311 VanDerWaalsContact C-N 3.34Å; R309-D311 PolarHBondContact O-N 3.34Å; R309-V312 CarbonylContact O-C 3.6Å; R309-V312 PolarHBondContact O-N 3.46Å; R309-V312 VanDerWaalsContact O-N 3.07Å; R309-E313 WeakPolarHBondContact O-CG 3.42Å; R309-E313 PolarHBondContact O-N 3.23Å
310	I	61.1	Low	63.5	Low	113 Å²	113	110.8 Å²	110.8	58%	0.579	54%	0.537	S	S	*	.	H	α-helix	trans	-61.4	-44.3	176.5	-62	166.1	0	0	0	110.2	A306 A307 V312 E313 D314	A306-I310 PolarHBondContact O-N 2.89Å; A306-I310 VanDerWaalsContact O-N 3.1Å; A307-I310 PolarHBondContact O-N 2.77Å; A307-I310 VanDerWaalsContact O-N 3.09Å; I310-V312 PolarHBondContact O-N 3.12Å; I310-V312 VanDerWaalsContact O-N 3.13Å; I310-E313 PolarHBondContact O-N 3.45Å; I310-D314 PolarHBondContact O-N 2.86Å
311	D	55.3	Low	63.5	Low	126 Å²	126	107.9 Å²	107.9	67%	0.674	53%	0.53	S	S	*	.	H	α-helix	trans	-63.3	-16.4	176.1	-141.5	33.5	0	0	0	113.2	A307 R309	A307-D311 WeakPolarHBondContact O-CB 3.25Å; A307-D311 PolarHBondContact O-N 3.07Å; R309-D311 VanDerWaalsContact C-N 3.34Å; R309-D311 PolarHBondContact O-N 3.34Å
312	V	55.2	Low	64	Low	85 Å²	85	106 Å²	106	52%	0.515	53%	0.527	S	S	.	.	H	α-helix	trans	-99.9	-19.8	175.1	169.2	0	0	0	0	112	R308 R309 I310	R308-V312 VanDerWaalsContact O-CG2 3.26Å; R308-V312 WeakPolarHBondContact O-CG2 3.21Å; R309-V312 CarbonylContact O-C 3.6Å; R309-V312 PolarHBondContact O-N 3.46Å; R309-V312 VanDerWaalsContact O-N 3.07Å; I310-V312 PolarHBondContact O-N 3.12Å; I310-V312 VanDerWaalsContact O-N 3.13Å
313	E	52.4	Low	64.7	Low	134 Å²	134	104.2 Å²	104.2	63%	0.626	52%	0.521	S	S	*	.	H	α-helix	trans	-80	-32.6	172.2	-73.4	171.4	174.3	0	0	110.9	R309 I310 D315 F316	R309-E313 WeakPolarHBondContact O-CG 3.42Å; R309-E313 PolarHBondContact O-N 3.23Å; I310-E313 PolarHBondContact O-N 3.45Å; E313-D315 VanDerWaalsContact C-N 3.29Å; E313-D315 PolarHBondContact O-N 2.87Å; E313-F316 PolarHBondContact O-N 3.21Å
314	D	49	Very low	65.5	Low	123 Å²	123	101.3 Å²	101.3	66%	0.658	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-23.8	168.1	-113.9	16.1	0	0	0	112.8	I310 F316 D317	I310-D314 PolarHBondContact O-N 2.86Å; D314-F316 VanDerWaalsContact C-N 3.27Å; D314-F316 PolarHBondContact O-N 3.38Å; D314-D317 PolarHBondContact O-N 3.01Å
315	D	50.5	Low	66.3	Low	93 Å²	93	103.4 Å²	103.4	50%	0.497	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-6.7	176.8	-153.8	37.5	0	0	0	112.9	E313 A318	E313-D315 VanDerWaalsContact C-N 3.29Å; E313-D315 PolarHBondContact O-N 2.87Å; D315-A318 WeakPolarHBondContact O-CB 3.32Å; D315-A318 PolarHBondContact O-N 3.09Å; D315-A318 VanDerWaalsContact OD1-CB 3.27Å; D315-A318 WeakPolarHBondContact OD1-CB 3.23Å
316	F	44.8	Very low	67.1	Low	109 Å²	109	97.5 Å²	97.5	48%	0.478	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-44.8	166.3	-96.6	-96.8	0	0	0	111.4	E313 D314 A318 Q319	E313-F316 PolarHBondContact O-N 3.21Å; D314-F316 VanDerWaalsContact C-N 3.27Å; D314-F316 PolarHBondContact O-N 3.38Å; F316-A318 PolarHBondContact O-N 2.88Å; F316-A318 VanDerWaalsContact O-N 3.15Å; F316-Q319 PolarHBondContact O-N 2.87Å
317	D	50.3	Low	67.8	Low	127 Å²	127	103.1 Å²	103.1	68%	0.679	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-12.9	172.8	-84.3	15.3	0	0	0	112	D314 K321	D314-D317 PolarHBondContact O-N 3.01Å; D317-K321 WeakPolarHBondContact O-CE 3.35Å
318	A	48.9	Very low	68.6	Low	27 Å²	27	105.4 Å²	105.4	22%	0.223	51%	0.513	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-22.5	169.6	0	0	0	0	0	114.5	D315 F316 K321	D315-A318 WeakPolarHBondContact O-CB 3.32Å; D315-A318 PolarHBondContact O-N 3.09Å; D315-A318 VanDerWaalsContact OD1-CB 3.27Å; D315-A318 WeakPolarHBondContact OD1-CB 3.23Å; F316-A318 PolarHBondContact O-N 2.88Å; F316-A318 VanDerWaalsContact O-N 3.15Å; A318-K321 HydrophobicContact CB-CD 4.34Å
319	Q	52.7	Low	69.7	Low	126 Å²	126	99 Å²	99	59%	0.589	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-16.3	-176.9	-63.8	-177.1	25.5	0	0	113.9	F316	F316-Q319 PolarHBondContact O-N 2.87Å
320	E	63.8	Low	71	Confident	119 Å²	119	95.6 Å²	95.6	56%	0.556	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	16.2	172	-158.3	156.3	-128.6	0	0	112.8	F334 R348	E320-F334 HydrophobicContact CG-CD1 4.19Å; E320-F334 HydrophobicContact CG-CE1 3.88Å; E320-F334 VanDerWaalsContact O-CE1 3.29Å; E320-F334 WeakPolarHBondContact O-CE1 3.5Å; E320-R348 IonicContact OE1-NH2 3.15Å; E320-R348 PolarHBondContact OE1-NH2 3.24Å; E320-R348 VanDerWaalsContact OE1-NH2 3.11Å
321	K	78.8	Confident	72.7	Confident	131 Å²	131	90.4 Å²	90.4	57%	0.57	46%	0.458	S	S	*	.			trans	-75.6	126.6	174.3	-70.6	170.8	-175.2	153.5	0	110.4	D317 A318	D317-K321 WeakPolarHBondContact O-CE 3.35Å; A318-K321 HydrophobicContact CB-CD 4.34Å
322	P	88.2	Confident	74.6	Confident	69 Å²	69	86.1 Å²	86.1	45%	0.448	44%	0.435	S	S	.	.			trans	-71.4	134.1	-177.9	29.1	-35.3	0	0	0	111.6	L332 K333 F334	P322-L332 HydrophobicContact CB-CB 4.03Å; P322-L332 HydrophobicContact CB-CD1 4.3Å; P322-L332 HydrophobicContact CB-CD2 4.36Å; P322-L332 HydrophobicContact CB-CG 4.46Å; P322-L332 HydrophobicContact CG-CD1 4.31Å; P322-K333 CarbonylContact C-O 3.55Å; P322-K333 VanDerWaalsContact CA-O 3.22Å; P322-K333 WeakPolarHBondContact CA-O 3.49Å; P322-F334 HydrophobicContact CB-CE1 4.39Å
323	I	91.3	Very high	76.6	Confident	88 Å²	88	82.9 Å²	82.9	45%	0.451	41%	0.414	S	S	.	.			trans	-95.3	-20.9	-174	54.8	160.1	0	0	0	114.3	K333 D335	I323-K333 HydrophobicContact CD1-CD 3.79Å; I323-K333 HydrophobicContact CD1-CG 4.12Å; I323-K333 HydrophobicContact CG1-CB 4.25Å; I323-K333 HydrophobicContact CG1-CD 3.95Å; I323-K333 HydrophobicContact CG1-CG 3.99Å; I323-K333 WeakPolarHBondContact CG1-O 3.4Å; I323-K333 PolarHBondContact N-O 2.72Å; I323-D335 HydrophobicContact CD1-CB 3.94Å; I323-D335 HydrophobicContact CG2-CB 4.17Å
324	D	91.2	Very high	78.5	Confident	46 Å²	46	77.3 Å²	77.3	25%	0.246	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	164	175.5	-162.1	2.1	0	0	0	109.4	K333 W360 Y409	D324-K333 HydrophobicContact CB-CB 3.84Å; D324-K333 HydrophobicContact CB-CD 3.72Å; D324-K333 HydrophobicContact CB-CG 4.42Å; D324-K333 PolarHBondContact O-N 2.91Å; D324-W360 HydrophobicContact CB-CH2 4.14Å; D324-W360 HydrophobicContact CB-CZ2 3.96Å; D324-W360 WeakPolarHBondContact OD2-CZ2 3.34Å; D324-Y409 PolarHBondContact OD2-OH 2.66Å
325	K	93	Very high	80.6	Confident	142 Å²	142	77.6 Å²	77.6	62%	0.617	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.5	145.2	178.2	64.2	-177.5	179.6	179.4	0	112.3	F331 L332	K325-F331 WeakPolarHBondContact CA-O 3.44Å; K325-L332 HydrophobicContact CB-CD2 3.87Å
326	S	93.5	Very high	82.5	Confident	3 Å²	3	75.6 Å²	75.6	2%	0.021	38%	0.376	C	S	.	.			trans	-54.1	157.7	169.4	55.4	0	0	0	0	112.9	N328 G329 R330 F331	S326-N328 VanDerWaalsContact C-N 3.27Å; S326-N328 WeakPolarHBondContact CB-OD1 3.35Å; S326-N328 PolarHBondContact O-N 2.99Å; S326-N328 PolarHBondContact OG-OD1 2.9Å; S326-G329 WeakPolarHBondContact O-CA 3.29Å; S326-G329 PolarHBondContact O-N 2.55Å; S326-G329 PolarHBondContact OG-N 3.13Å; S326-R330 PolarHBondContact OG-N 3.3Å; S326-F331 WeakPolarHBondContact CB-O 3.41Å; S326-F331 PolarHBondContact N-O 3.31Å; S326-F331 PolarHBondContact OG-N 3.08Å; S326-F331 PolarHBondContact OG-O 2.9Å
327	K	90.2	Very high	84.8	Confident	157 Å²	157	74.7 Å²	74.7	68%	0.683	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-29.7	-174.6	-63.2	-179.2	-177.8	175.9	0	114	W398 E399	K327-W398 HydrophobicContact CD-CB 4.25Å; K327-W398 HydrophobicContact CD-CG 4.35Å; K327-W398 HydrophobicContact CG-CG 4.41Å; K327-E399 WeakPolarHBondContact CE-O 3.45Å; K327-E399 PolarHBondContact NZ-O 3.32Å
328	N	91.7	Very high	86.7	Confident	103 Å²	103	70.7 Å²	70.7	55%	0.551	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-4.1	173.4	57.3	3.6	0	0	0	113	S326 R330	S326-N328 VanDerWaalsContact C-N 3.27Å; S326-N328 WeakPolarHBondContact CB-OD1 3.35Å; S326-N328 PolarHBondContact O-N 2.99Å; S326-N328 PolarHBondContact OG-OD1 2.9Å; N328-R330 PolarHBondContact O-N 3.16Å; N328-R330 WeakPolarHBondContact OD1-CB 3.36Å; N328-R330 PolarHBondContact OD1-N 2.96Å
329	G	92.7	Very high	88.4	Confident	28 Å²	28	70.9 Å²	70.9	29%	0.289	36%	0.357	S	S	.	.	S	Bend	trans	78.9	-6.6	-177.3	0	0	0	0	0	115.5	S326	S326-G329 WeakPolarHBondContact O-CA 3.29Å; S326-G329 PolarHBondContact O-N 2.55Å; S326-G329 PolarHBondContact OG-N 3.13Å
330	R	96.5	Very high	89.9	Confident	59 Å²	59	73.1 Å²	73.1	22%	0.223	36%	0.36	C	S	.	.			trans	-61.1	-49.1	-175.5	176.8	-179.9	176.5	158.7	-8.7	113.1	S326 N328 D351 T352 E353	S326-R330 PolarHBondContact OG-N 3.3Å; N328-R330 PolarHBondContact O-N 3.16Å; N328-R330 WeakPolarHBondContact OD1-CB 3.36Å; N328-R330 PolarHBondContact OD1-N 2.96Å; R330-D351 WeakPolarHBondContact CG-OD1 3.41Å; R330-D351 IonicContact CZ-OD1 3.89Å; R330-D351 IonicContact CZ-OD2 2.68Å; R330-D351 IonicContact NE-OD1 3.57Å; R330-D351 PolarHBondContact NE-OD1 2.79Å; R330-D351 IonicContact NE-OD2 3.48Å; R330-D351 PolarHBondContact NE-OD2 3.31Å; R330-D351 IonicContact NH2-OD1 3.74Å; R330-D351 IonicContact NH2-OD2 2.71Å; R330-D351 PolarHBondContact NH2-OD2 2.88Å; R330-T352 WeakPolarHBondContact O-CG2 3.26Å; R330-T352 PolarHBondContact O-N 2.81Å; R330-T352 PolarHBondContact O-OG1 2.88Å; R330-E353 VanDerWaalsContact CD-CD 3.41Å; R330-E353 WeakPolarHBondContact CD-OE1 3.44Å; R330-E353 WeakPolarHBondContact CD-OE2 2.99Å; R330-E353 HydrophobicContact CG-CB 4.43Å; R330-E353 HydrophobicContact CG-CG 3.96Å; R330-E353 IonicContact CZ-OE2 3.77Å; R330-E353 IonicContact NE-OE1 2.82Å; R330-E353 IonicContact NE-OE2 3.11Å; R330-E353 PolarHBondContact NE-OE2 3.33Å; R330-E353 IonicContact NH1-OE2 2.65Å; R330-E353 PolarHBondContact NH1-OE2 3.13Å; R330-E353 IonicContact NH2-OE2 3.82Å
331	F	97	Very high	90.2	Very high	4 Å²	4	69.8 Å²	69.8	2%	0.018	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	133	178	-49.7	-70.6	0	0	0	110.9	K325 S326 L350 D351 V358 W360 Y395 D396 W398 V413	K325-F331 WeakPolarHBondContact CA-O 3.44Å; S326-F331 WeakPolarHBondContact CB-O 3.41Å; S326-F331 PolarHBondContact N-O 3.31Å; S326-F331 PolarHBondContact OG-N 3.08Å; S326-F331 PolarHBondContact OG-O 2.9Å; F331-L350 WeakPolarHBondContact CA-O 3.32Å; F331-D351 HydrophobicContact CD1-CB 3.85Å; F331-D351 HydrophobicContact CE1-CB 3.79Å; F331-V358 HydrophobicContact CD1-CG2 4.24Å; F331-W360 HydrophobicContact CB-CE3 4.41Å; F331-W360 HydrophobicContact CB-CZ3 4.25Å; F331-Y395 HydrophobicContact CE1-CG 4.47Å; F331-Y395 HydrophobicContact CZ-CG 4.43Å; F331-D396 HydrophobicContact CE2-CB 3.83Å; F331-W398 HydrophobicContact CB-CH2 4.37Å; F331-W398 HydrophobicContact CD2-CH2 4.14Å; F331-W398 AromaticContact CD2-CZ3 3.99Å; F331-W398 HydrophobicContact CD2-CZ3 3.99Å; F331-V413 HydrophobicContact CB-CG2 4.34Å; F331-V413 HydrophobicContact CD1-CG1 3.75Å; F331-V413 HydrophobicContact CD2-CB 4.43Å; F331-V413 HydrophobicContact CD2-CG1 4.37Å; F331-V413 HydrophobicContact CD2-CG2 4.01Å; F331-V413 HydrophobicContact CE1-CG1 3.96Å; F331-V413 HydrophobicContact CG-CB 4.47Å; F331-V413 HydrophobicContact CG-CG1 3.97Å; F331-V413 HydrophobicContact CG-CG2 4.09Å; F331-V413 HydrophobicContact CZ-CG1 4.37Å
332	L	95.8	Very high	89.6	Confident	36 Å²	36	68.6 Å²	68.6	19%	0.188	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	150.1	171.3	-58.8	176.9	0	0	0	110.4	P322 K325 F334 G349 L350 T352	P322-L332 HydrophobicContact CB-CB 4.03Å; P322-L332 HydrophobicContact CB-CD1 4.3Å; P322-L332 HydrophobicContact CB-CD2 4.36Å; P322-L332 HydrophobicContact CB-CG 4.46Å; P322-L332 HydrophobicContact CG-CD1 4.31Å; K325-L332 HydrophobicContact CB-CD2 3.87Å; L332-F334 HydrophobicContact CB-CE2 4.35Å; L332-F334 HydrophobicContact CB-CZ 4.45Å; L332-G349 CarbonylContact O-C 3.58Å; L332-G349 WeakPolarHBondContact O-CA 3.3Å; L332-L350 PolarHBondContact N-O 2.84Å; L332-L350 PolarHBondContact O-N 2.86Å; L332-T352 HydrophobicContact CD1-CG2 3.63Å; L332-T352 HydrophobicContact CG-CG2 3.74Å
333	K	95.7	Very high	88.7	Confident	17 Å²	17	69.2 Å²	69.2	7%	0.074	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	140.4	173.6	-172.9	-167.6	-177.6	179.5	0	110.6	P322 I323 D324 F347 W360 E362	P322-K333 CarbonylContact C-O 3.55Å; P322-K333 VanDerWaalsContact CA-O 3.22Å; P322-K333 WeakPolarHBondContact CA-O 3.49Å; I323-K333 HydrophobicContact CD1-CD 3.79Å; I323-K333 HydrophobicContact CD1-CG 4.12Å; I323-K333 HydrophobicContact CG1-CB 4.25Å; I323-K333 HydrophobicContact CG1-CD 3.95Å; I323-K333 HydrophobicContact CG1-CG 3.99Å; I323-K333 WeakPolarHBondContact CG1-O 3.4Å; I323-K333 PolarHBondContact N-O 2.72Å; D324-K333 HydrophobicContact CB-CB 3.84Å; D324-K333 HydrophobicContact CB-CD 3.72Å; D324-K333 HydrophobicContact CB-CG 4.42Å; D324-K333 PolarHBondContact O-N 2.91Å; K333-F347 HydrophobicContact CD-CG 4.49Å; K333-F347 HydrophobicContact CG-CB 4.09Å; K333-F347 HydrophobicContact CG-CG 4.43Å; K333-W360 HydrophobicContact CB-CD2 3.75Å; K333-W360 HydrophobicContact CB-CE3 3.85Å; K333-W360 HydrophobicContact CB-CG 4.29Å; K333-W360 HydrophobicContact CB-CH2 3.99Å; K333-W360 HydrophobicContact CB-CZ2 3.93Å; K333-W360 HydrophobicContact CB-CZ3 3.96Å; K333-W360 HydrophobicContact CD-CD2 4.33Å; K333-W360 HydrophobicContact CD-CG 4.44Å; K333-W360 HydrophobicContact CD-CZ2 4.07Å; K333-W360 HydrophobicContact CG-CD2 3.94Å; K333-W360 HydrophobicContact CG-CG 4Å; K333-W360 HydrophobicContact CG-CZ2 4.37Å; K333-E362 WeakPolarHBondContact CE-OE1 3.45Å; K333-E362 IonicContact NZ-OE1 3.41Å; K333-E362 PolarHBondContact NZ-OE1 2.93Å; K333-E362 IonicContact NZ-OE2 2.92Å; K333-E362 PolarHBondContact NZ-OE2 2.96Å
334	F	93.7	Very high	88.1	Confident	17 Å²	17	66.4 Å²	66.4	8%	0.075	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	158.4	171.5	-54.8	-94.3	0	0	0	110.5	E320 P322 L332 E336 R348 L350	E320-F334 HydrophobicContact CG-CD1 4.19Å; E320-F334 HydrophobicContact CG-CE1 3.88Å; E320-F334 VanDerWaalsContact O-CE1 3.29Å; E320-F334 WeakPolarHBondContact O-CE1 3.5Å; P322-F334 HydrophobicContact CB-CE1 4.39Å; L332-F334 HydrophobicContact CB-CE2 4.35Å; L332-F334 HydrophobicContact CB-CZ 4.45Å; F334-E336 PolarHBondContact O-N 2.8Å; F334-R348 HydrophobicContact CD2-CG 4.36Å; F334-R348 PolarHBondContact N-O 3.22Å; F334-L350 HydrophobicContact CE2-CB 3.61Å; F334-L350 HydrophobicContact CZ-CB 3.97Å; F334-L350 HydrophobicContact CZ-CD2 4.46Å
335	D	91.4	Very high	88	Confident	128 Å²	128	64.9 Å²	64.9	68%	0.684	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	34.6	179.7	-156.9	35.1	0	0	0	113.4	I323	I323-D335 HydrophobicContact CD1-CB 3.94Å; I323-D335 HydrophobicContact CG2-CB 4.17Å
336	E	91.7	Very high	87.9	Confident	52 Å²	52	59.2 Å²	59.2	24%	0.243	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	91.3	175.7	-167.8	-178.5	175.6	0	0	109.2	R78 F334 L338 F347 R348	R78-E336 IonicContact CZ-OE1 3.98Å; R78-E336 IonicContact NH1-OE1 3.23Å; R78-E336 PolarHBondContact NH1-OE1 2.82Å; F334-E336 PolarHBondContact O-N 2.8Å; E336-L338 HydrophobicContact CB-CD2 4.5Å; E336-L338 HydrophobicContact CG-CD2 3.98Å; E336-L338 WeakPolarHBondContact O-CD2 3.23Å; E336-L338 PolarHBondContact O-N 3.01Å; E336-F347 CarbonylContact O-C 3.57Å; E336-F347 WeakPolarHBondContact O-CA 3.31Å; E336-R348 HydrophobicContact CB-CB 4.04Å; E336-R348 PolarHBondContact O-N 3.14Å; E336-R348 WeakPolarHBondContact OE2-CD 3.35Å; E336-R348 IonicContact OE2-CZ 2.99Å; E336-R348 IonicContact OE2-NE 3.33Å; E336-R348 IonicContact OE2-NH1 3.1Å; E336-R348 PolarHBondContact OE2-NH1 3.26Å
337	E	92.7	Very high	88	Confident	90 Å²	90	60.1 Å²	60.1	42%	0.421	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	120.4	172.1	-167.9	-177.7	113.9	0	0	109.6	R340 T345 V346 F347	E337-R340 VanDerWaalsContact OE1-CB 3.29Å; E337-R340 WeakPolarHBondContact OE1-CB 3.4Å; E337-R340 IonicContact OE2-NH1 2.79Å; E337-T345 HydrophobicContact CG-CG2 3.71Å; E337-T345 WeakPolarHBondContact OE2-CG2 3.45Å; E337-V346 CarbonylContact C-O 3.54Å; E337-V346 WeakPolarHBondContact CA-O 3.38Å; E337-F347 HydrophobicContact CB-CE1 4.38Å
338	L	89.3	Confident	88.2	Confident	43 Å²	43	56.5 Å²	56.5	23%	0.225	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-19.3	-178.6	-47.2	-176	0	0	0	112.9	E336 V346 R348 L416	E336-L338 HydrophobicContact CB-CD2 4.5Å; E336-L338 HydrophobicContact CG-CD2 3.98Å; E336-L338 WeakPolarHBondContact O-CD2 3.23Å; E336-L338 PolarHBondContact O-N 3.01Å; L338-V346 HydrophobicContact CB-CB 4.35Å; L338-V346 HydrophobicContact CB-CG1 4.2Å; L338-V346 HydrophobicContact CD1-CG1 4.13Å; L338-V346 HydrophobicContact CG-CG1 4.47Å; L338-V346 PolarHBondContact N-O 2.93Å; L338-R348 HydrophobicContact CD1-CB 4.34Å; L338-R348 HydrophobicContact CD2-CB 4Å; L338-R348 HydrophobicContact CG-CB 4.47Å; L338-L416 HydrophobicContact CD1-CD1 3.47Å; L338-L416 VanDerWaalsContact CD1-CD1 3.47Å
339	G	84.8	Confident	88.4	Confident	31 Å²	31	51.6 Å²	51.6	32%	0.32	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	164.7	157.2	-179.7	0	0	0	0	0	112	V346	G339-V346 PolarHBondContact O-N 3.18Å
340	R	84.6	Confident	88.6	Confident	173 Å²	173	52.8 Å²	52.8	65%	0.653	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.2	132.1	-171.8	179.5	170.7	170.5	177.6	-3.8	111.6	E337 T345	E337-R340 VanDerWaalsContact OE1-CB 3.29Å; E337-R340 WeakPolarHBondContact OE1-CB 3.4Å; E337-R340 IonicContact OE2-NH1 2.79Å; R340-T345 HydrophobicContact CB-CG2 4.4Å; R340-T345 HydrophobicContact CG-CG2 4.45Å
341	G	71.2	Confident	88.6	Confident	49 Å²	49	50 Å²	50	51%	0.505	26%	0.264	S	S	.	.			trans	-114.6	-166.2	175.5	0	0	0	0	0	112.3	F343 K344	G341-F343 VanDerWaalsContact C-N 3.34Å; G341-F343 PolarHBondContact O-N 2.97Å; G341-K344 PolarHBondContact N-O 3.01Å
342	S	65.2	Low	88.5	Confident	105 Å²	105	53.4 Å²	53.4	73%	0.734	29%	0.285	S	S	*	.	S	Bend	trans	-69.5	-24.9	-177.5	43.6	0	0	0	0	114.9
343	F	68.8	Low	88.5	Confident	82 Å²	82	57.8 Å²	57.8	36%	0.36	30%	0.304	S	S	.	.	S	Bend	trans	-131.4	-9.2	-178	-55.6	-85.4	0	0	0	114	G341 L363 Q364 K367	G341-F343 VanDerWaalsContact C-N 3.34Å; G341-F343 PolarHBondContact O-N 2.97Å; F343-L363 WeakPolarHBondContact O-CA 3.43Å; F343-Q364 PolarHBondContact O-N 3.32Å; F343-Q364 VanDerWaalsContact O-N 3.11Å; F343-K367 HydrophobicContact CD1-CD 4.21Å; F343-K367 HydrophobicContact CE1-CD 3.72Å
344	K	80.1	Confident	88.4	Confident	30 Å²	30	60.7 Å²	60.7	13%	0.13	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	133.5	-168.1	172.2	173.5	165.2	176.2	0	110.4	G341 V346 C361 E362 L363 D481 L484	G341-K344 PolarHBondContact N-O 3.01Å; K344-V346 HydrophobicContact CD-CG2 4.21Å; K344-V346 HydrophobicContact CG-CG2 4.03Å; K344-C361 VanDerWaalsContact CE-SG 3.6Å; K344-E362 WeakPolarHBondContact CA-O 3.3Å; K344-L363 HydrophobicContact CB-CD2 3.53Å; K344-L363 HydrophobicContact CD-CD2 4.15Å; K344-L363 HydrophobicContact CG-CD2 3.78Å; K344-D481 IonicContact NZ-OD1 3.74Å; K344-D481 PolarHBondContact NZ-OD1 3.07Å; K344-D481 IonicContact NZ-OD2 3.96Å; K344-D481 PolarHBondContact NZ-OD2 2.94Å; K344-L484 HydrophobicContact CD-CD1 3.85Å
345	T	87.8	Confident	88.4	Confident	14 Å²	14	62.6 Å²	62.6	9%	0.086	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	139.6	161.7	-53.9	0	0	0	0	108.6	E337 R340 F347 C361 E362	E337-T345 HydrophobicContact CG-CG2 3.71Å; E337-T345 WeakPolarHBondContact OE2-CG2 3.45Å; R340-T345 HydrophobicContact CB-CG2 4.4Å; R340-T345 HydrophobicContact CG-CG2 4.45Å; T345-F347 HydrophobicContact CG2-CD2 4.1Å; T345-F347 HydrophobicContact CG2-CE1 4.47Å; T345-F347 HydrophobicContact CG2-CE2 3.4Å; T345-F347 VanDerWaalsContact CG2-CE2 3.4Å; T345-F347 HydrophobicContact CG2-CZ 3.63Å; T345-C361 CarbonylContact O-C 3.55Å; T345-C361 WeakPolarHBondContact O-CA 3.38Å; T345-E362 PolarHBondContact N-O 3.47Å; T345-E362 PolarHBondContact O-N 2.96Å
346	V	91.5	Very high	88.5	Confident	23 Å²	23	60 Å²	60	14%	0.139	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	130.1	178.8	-170	0	0	0	0	109.1	E337 L338 G339 K344 A359 W360	E337-V346 CarbonylContact C-O 3.54Å; E337-V346 WeakPolarHBondContact CA-O 3.38Å; L338-V346 HydrophobicContact CB-CB 4.35Å; L338-V346 HydrophobicContact CB-CG1 4.2Å; L338-V346 HydrophobicContact CD1-CG1 4.13Å; L338-V346 HydrophobicContact CG-CG1 4.47Å; L338-V346 PolarHBondContact N-O 2.93Å; G339-V346 PolarHBondContact O-N 3.18Å; K344-V346 HydrophobicContact CD-CG2 4.21Å; K344-V346 HydrophobicContact CG-CG2 4.03Å; V346-A359 HydrophobicContact CG1-CB 4.01Å; V346-W360 CarbonylContact C-O 3.16Å; V346-W360 WeakPolarHBondContact CA-O 3.38Å
347	F	94.8	Very high	88.6	Confident	22 Å²	22	59.3 Å²	59.3	10%	0.096	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	158.7	176	-64	-93	0	0	0	110.3	K333 E336 E337 T345 W360 E362	K333-F347 HydrophobicContact CD-CG 4.49Å; K333-F347 HydrophobicContact CG-CB 4.09Å; K333-F347 HydrophobicContact CG-CG 4.43Å; E336-F347 CarbonylContact O-C 3.57Å; E336-F347 WeakPolarHBondContact O-CA 3.31Å; E337-F347 HydrophobicContact CB-CE1 4.38Å; T345-F347 HydrophobicContact CG2-CD2 4.1Å; T345-F347 HydrophobicContact CG2-CE1 4.47Å; T345-F347 HydrophobicContact CG2-CE2 3.4Å; T345-F347 VanDerWaalsContact CG2-CE2 3.4Å; T345-F347 HydrophobicContact CG2-CZ 3.63Å; F347-W360 HydrophobicContact CB-CB 4.32Å; F347-W360 PolarHBondContact N-O 3.28Å; F347-W360 PolarHBondContact O-N 2.91Å; F347-E362 HydrophobicContact CD2-CG 4.32Å; F347-E362 HydrophobicContact CE2-CG 4.32Å; F347-E362 WeakPolarHBondContact CE2-OE2 3.44Å
348	R	95.6	Very high	88.8	Confident	80 Å²	80	55 Å²	55	30%	0.302	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	139.4	164.4	-174.1	171	164.8	-158.2	-15.9	109.5	E320 F334 E336 L338	E320-R348 IonicContact OE1-NH2 3.15Å; E320-R348 PolarHBondContact OE1-NH2 3.24Å; E320-R348 VanDerWaalsContact OE1-NH2 3.11Å; F334-R348 HydrophobicContact CD2-CG 4.36Å; F334-R348 PolarHBondContact N-O 3.22Å; E336-R348 HydrophobicContact CB-CB 4.04Å; E336-R348 PolarHBondContact O-N 3.14Å; E336-R348 WeakPolarHBondContact OE2-CD 3.35Å; E336-R348 IonicContact OE2-CZ 2.99Å; E336-R348 IonicContact OE2-NE 3.33Å; E336-R348 IonicContact OE2-NH1 3.1Å; E336-R348 PolarHBondContact OE2-NH1 3.26Å; L338-R348 HydrophobicContact CD1-CB 4.34Å; L338-R348 HydrophobicContact CD2-CB 4Å; L338-R348 HydrophobicContact CG-CB 4.47Å
349	G	96	Very high	89.1	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	177.3	165.2	0	0	0	0	0	112.2	L332 A357 V358	L332-G349 CarbonylContact O-C 3.58Å; L332-G349 WeakPolarHBondContact O-CA 3.3Å; G349-A357 WeakPolarHBondContact O-CA 3.43Å; G349-V358 VanDerWaalsContact C-CG2 3.49Å; G349-V358 PolarHBondContact N-O 3.28Å; G349-V358 PolarHBondContact O-N 2.9Å
350	L	96.4	Very high	89.6	Confident	54 Å²	54	51.9 Å²	51.9	28%	0.283	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	133.1	174	179.2	70.4	0	0	0	108.4	F331 L332 F334 G355	F331-L350 WeakPolarHBondContact CA-O 3.32Å; L332-L350 PolarHBondContact N-O 2.84Å; L332-L350 PolarHBondContact O-N 2.86Å; F334-L350 HydrophobicContact CE2-CB 3.61Å; F334-L350 HydrophobicContact CZ-CB 3.97Å; F334-L350 HydrophobicContact CZ-CD2 4.46Å; L350-G355 WeakPolarHBondContact CD1-O 3.45Å
351	D	96.9	Very high	89.9	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	110	165.9	177.3	10.1	0	0	0	109.1	R330 F331 E353 T354 G355 V356 V358	R330-D351 WeakPolarHBondContact CG-OD1 3.41Å; R330-D351 IonicContact CZ-OD1 3.89Å; R330-D351 IonicContact CZ-OD2 2.68Å; R330-D351 IonicContact NE-OD1 3.57Å; R330-D351 PolarHBondContact NE-OD1 2.79Å; R330-D351 IonicContact NE-OD2 3.48Å; R330-D351 PolarHBondContact NE-OD2 3.31Å; R330-D351 IonicContact NH2-OD1 3.74Å; R330-D351 IonicContact NH2-OD2 2.71Å; R330-D351 PolarHBondContact NH2-OD2 2.88Å; F331-D351 HydrophobicContact CD1-CB 3.85Å; F331-D351 HydrophobicContact CE1-CB 3.79Å; D351-E353 VanDerWaalsContact C-N 3.27Å; D351-E353 PolarHBondContact O-N 3.3Å; D351-E353 PolarHBondContact OD1-N 2.93Å; D351-T354 WeakPolarHBondContact CB-OG1 3.17Å; D351-T354 PolarHBondContact O-N 2.95Å; D351-T354 VanDerWaalsContact OD2-CG2 3.27Å; D351-T354 WeakPolarHBondContact OD2-CG2 3.36Å; D351-T354 PolarHBondContact OD2-OG1 3.48Å; D351-G355 WeakPolarHBondContact O-CA 3.42Å; D351-G355 PolarHBondContact O-N 2.67Å; D351-V356 PolarHBondContact N-O 3.44Å; D351-V358 HydrophobicContact CB-CG1 4Å
352	T	95	Very high	90.8	Very high	75 Å²	75	42.9 Å²	42.9	46%	0.46	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-17.6	-175.7	63.6	0	0	0	0	113.4	R330 L332	R330-T352 WeakPolarHBondContact O-CG2 3.26Å; R330-T352 PolarHBondContact O-N 2.81Å; R330-T352 PolarHBondContact O-OG1 2.88Å; L332-T352 HydrophobicContact CD1-CG2 3.63Å; L332-T352 HydrophobicContact CG-CG2 3.74Å
353	E	95.1	Very high	91.5	Very high	128 Å²	128	38.2 Å²	38.2	60%	0.598	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77	-29.8	175.1	-74	173.8	-159.9	0	0	112.1	R330 D351	R330-E353 VanDerWaalsContact CD-CD 3.41Å; R330-E353 WeakPolarHBondContact CD-OE1 3.44Å; R330-E353 WeakPolarHBondContact CD-OE2 2.99Å; R330-E353 HydrophobicContact CG-CB 4.43Å; R330-E353 HydrophobicContact CG-CG 3.96Å; R330-E353 IonicContact CZ-OE2 3.77Å; R330-E353 IonicContact NE-OE1 2.82Å; R330-E353 IonicContact NE-OE2 3.11Å; R330-E353 PolarHBondContact NE-OE2 3.33Å; R330-E353 IonicContact NH1-OE2 2.65Å; R330-E353 PolarHBondContact NH1-OE2 3.13Å; R330-E353 IonicContact NH2-OE2 3.82Å; D351-E353 VanDerWaalsContact C-N 3.27Å; D351-E353 PolarHBondContact O-N 3.3Å; D351-E353 PolarHBondContact OD1-N 2.93Å
354	T	94.2	Very high	91.7	Very high	79 Å²	79	37.8 Å²	37.8	49%	0.485	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-15.2	-174.5	62.3	0	0	0	0	114.1	D351 V356	D351-T354 WeakPolarHBondContact CB-OG1 3.17Å; D351-T354 PolarHBondContact O-N 2.95Å; D351-T354 VanDerWaalsContact OD2-CG2 3.27Å; D351-T354 WeakPolarHBondContact OD2-CG2 3.36Å; D351-T354 PolarHBondContact OD2-OG1 3.48Å; T354-V356 PolarHBondContact O-N 3.48Å; T354-V356 WeakPolarHBondContact OG1-CB 3.34Å; T354-V356 PolarHBondContact OG1-N 2.93Å
355	G	92.9	Very high	91.1	Very high	57 Å²	57	37 Å²	37	59%	0.588	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.3	8.2	-171.2	0	0	0	0	0	114	L350 D351	L350-G355 WeakPolarHBondContact CD1-O 3.45Å; D351-G355 WeakPolarHBondContact O-CA 3.42Å; D351-G355 PolarHBondContact O-N 2.67Å
356	V	93.8	Very high	89.8	Confident	72 Å²	72	40.5 Å²	40.5	44%	0.436	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	133.7	-174.6	-179.7	0	0	0	0	110.8	D351 T354	D351-V356 PolarHBondContact N-O 3.44Å; T354-V356 PolarHBondContact O-N 3.48Å; T354-V356 WeakPolarHBondContact OG1-CB 3.34Å; T354-V356 PolarHBondContact OG1-N 2.93Å
357	A	94.9	Very high	88.3	Confident	38 Å²	38	44.5 Å²	44.5	31%	0.314	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	134.5	174	0	0	0	0	0	111.1	G349 L416	G349-A357 WeakPolarHBondContact O-CA 3.43Å; A357-L416 HydrophobicContact CB-CD2 3.68Å; A357-L416 VanDerWaalsContact O-CB 3.28Å; A357-L416 WeakPolarHBondContact O-CB 3.46Å
358	V	96	Very high	86.7	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	162.5	-176.7	-64.5	0	0	0	0	111.2	F331 G349 D351 Y395 V413 T414	F331-V358 HydrophobicContact CD1-CG2 4.24Å; G349-V358 VanDerWaalsContact C-CG2 3.49Å; G349-V358 PolarHBondContact N-O 3.28Å; G349-V358 PolarHBondContact O-N 2.9Å; D351-V358 HydrophobicContact CB-CG1 4Å; V358-Y395 HydrophobicContact CG1-CD2 4Å; V358-Y395 HydrophobicContact CG1-CE2 3.72Å; V358-V413 HydrophobicContact CB-CG1 3.76Å; V358-V413 HydrophobicContact CG1-CG1 4.21Å; V358-V413 HydrophobicContact CG2-CG1 3.65Å; V358-T414 WeakPolarHBondContact CB-O 3.41Å
359	A	95.7	Very high	85.3	Confident	8 Å²	8	46.1 Å²	46.1	7%	0.066	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	118.7	169.8	0	0	0	0	0	109.3	V346 V413 T414 L416	V346-A359 HydrophobicContact CG1-CB 4.01Å; A359-V413 WeakPolarHBondContact O-CA 3.4Å; A359-T414 PolarHBondContact N-O 3.13Å; A359-T414 PolarHBondContact O-N 3.01Å; A359-L416 HydrophobicContact CB-CD1 4.12Å
360	W	94.8	Very high	84.2	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	107.8	177.2	177	-68.4	0	0	0	108.5	D324 F331 K333 V346 F347 E362 W398 V411	D324-W360 HydrophobicContact CB-CH2 4.14Å; D324-W360 HydrophobicContact CB-CZ2 3.96Å; D324-W360 WeakPolarHBondContact OD2-CZ2 3.34Å; F331-W360 HydrophobicContact CB-CE3 4.41Å; F331-W360 HydrophobicContact CB-CZ3 4.25Å; K333-W360 HydrophobicContact CB-CD2 3.75Å; K333-W360 HydrophobicContact CB-CE3 3.85Å; K333-W360 HydrophobicContact CB-CG 4.29Å; K333-W360 HydrophobicContact CB-CH2 3.99Å; K333-W360 HydrophobicContact CB-CZ2 3.93Å; K333-W360 HydrophobicContact CB-CZ3 3.96Å; K333-W360 HydrophobicContact CD-CD2 4.33Å; K333-W360 HydrophobicContact CD-CG 4.44Å; K333-W360 HydrophobicContact CD-CZ2 4.07Å; K333-W360 HydrophobicContact CG-CD2 3.94Å; K333-W360 HydrophobicContact CG-CG 4Å; K333-W360 HydrophobicContact CG-CZ2 4.37Å; V346-W360 CarbonylContact C-O 3.16Å; V346-W360 WeakPolarHBondContact CA-O 3.38Å; F347-W360 HydrophobicContact CB-CB 4.32Å; F347-W360 PolarHBondContact N-O 3.28Å; F347-W360 PolarHBondContact O-N 2.91Å; W360-E362 PolarHBondContact NE1-OE1 3.41Å; W360-W398 HydrophobicContact CE3-CH2 4.34Å; W360-W398 HydrophobicContact CE3-CZ2 4.34Å; W360-W398 HydrophobicContact CH2-CH2 4.29Å; W360-W398 AromaticContact CH2-CZ2 3.58Å; W360-W398 HydrophobicContact CH2-CZ2 3.58Å; W360-W398 HydrophobicContact CZ2-CZ2 4.01Å; W360-W398 AromaticContact CZ3-CH2 3.98Å; W360-W398 HydrophobicContact CZ3-CH2 3.98Å; W360-W398 AromaticContact CZ3-CZ2 3.74Å; W360-W398 HydrophobicContact CZ3-CZ2 3.74Å; W360-V411 HydrophobicContact CD2-CG1 3.76Å; W360-V411 HydrophobicContact CE3-CG1 4.35Å; W360-V411 HydrophobicContact CG-CG1 4.09Å; W360-V411 HydrophobicContact CZ2-CG1 4.02Å; W360-V411 HydrophobicContact CZ2-CG2 4.06Å
361	C	92.1	Very high	82.9	Confident	6 Å²	6	56 Å²	56	4%	0.041	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	121.8	-175.1	-61	0	0	0	0	110.9	K344 T345 V411 L412	K344-C361 VanDerWaalsContact CE-SG 3.6Å; T345-C361 CarbonylContact O-C 3.55Å; T345-C361 WeakPolarHBondContact O-CA 3.38Å; C361-V411 CarbonylContact O-C 3.45Å; C361-V411 VanDerWaalsContact O-CA 3.3Å; C361-V411 WeakPolarHBondContact O-CA 3.38Å; C361-L412 HydrophobicContact CB-CB 4.31Å; C361-L412 WeakPolarHBondContact CB-O 3.44Å; C361-L412 PolarHBondContact N-O 3.28Å; C361-L412 PolarHBondContact O-N 3.41Å
362	E	88.9	Confident	81.4	Confident	28 Å²	28	58.7 Å²	58.7	13%	0.131	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	121.5	178.7	-59.7	-173.1	151.7	0	0	110.9	K333 K344 T345 F347 W360 Y409 I410 V411	K333-E362 WeakPolarHBondContact CE-OE1 3.45Å; K333-E362 IonicContact NZ-OE1 3.41Å; K333-E362 PolarHBondContact NZ-OE1 2.93Å; K333-E362 IonicContact NZ-OE2 2.92Å; K333-E362 PolarHBondContact NZ-OE2 2.96Å; K344-E362 WeakPolarHBondContact CA-O 3.3Å; T345-E362 PolarHBondContact N-O 3.47Å; T345-E362 PolarHBondContact O-N 2.96Å; F347-E362 HydrophobicContact CD2-CG 4.32Å; F347-E362 HydrophobicContact CE2-CG 4.32Å; F347-E362 WeakPolarHBondContact CE2-OE2 3.44Å; W360-E362 PolarHBondContact NE1-OE1 3.41Å; E362-Y409 HydrophobicContact CB-CD2 4.23Å; E362-Y409 HydrophobicContact CG-CD2 4.16Å; E362-Y409 HydrophobicContact CG-CE2 4.23Å; E362-Y409 WeakPolarHBondContact OE1-CE2 3.24Å; E362-I410 CarbonylContact C-O 3.57Å; E362-I410 WeakPolarHBondContact CA-O 3.47Å; E362-V411 HydrophobicContact CG-CG2 4.49Å
363	L	79.7	Confident	80.3	Confident	6 Å²	6	57.3 Å²	57.3	3%	0.031	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	130.5	177.7	-50.6	-173	0	0	0	110.9	F343 K344 E365 F376 Y409 I410 L412 L484 L487	F343-L363 WeakPolarHBondContact O-CA 3.43Å; K344-L363 HydrophobicContact CB-CD2 3.53Å; K344-L363 HydrophobicContact CD-CD2 4.15Å; K344-L363 HydrophobicContact CG-CD2 3.78Å; L363-E365 PolarHBondContact O-N 2.75Å; L363-F376 HydrophobicContact CD1-CE2 4.15Å; L363-F376 HydrophobicContact CD1-CZ 4.4Å; L363-Y409 CarbonylContact O-C 3.54Å; L363-Y409 VanDerWaalsContact O-CA 3.23Å; L363-Y409 WeakPolarHBondContact O-CA 3.46Å; L363-Y409 VanDerWaalsContact O-CB 3.29Å; L363-Y409 WeakPolarHBondContact O-CB 3.4Å; L363-I410 HydrophobicContact CB-CB 4.36Å; L363-I410 PolarHBondContact N-O 3.15Å; L363-I410 PolarHBondContact O-N 3.12Å; L363-L412 HydrophobicContact CD1-CD1 3.49Å; L363-L412 VanDerWaalsContact CD1-CD1 3.49Å; L363-L412 HydrophobicContact CD2-CD1 4.37Å; L363-L412 HydrophobicContact CG-CD1 3.53Å; L363-L484 HydrophobicContact CD1-CD2 3.7Å; L363-L484 HydrophobicContact CD2-CD2 3.79Å; L363-L484 HydrophobicContact CG-CD2 4.44Å; L363-L487 HydrophobicContact CD1-CD1 3.67Å
364	Q	73.8	Confident	79.3	Confident	73 Å²	73	55.5 Å²	55.5	34%	0.341	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	110.8	-178.5	-62.1	-173.2	25.3	0	0	111.4	F343 S366	F343-Q364 PolarHBondContact O-N 3.32Å; F343-Q364 VanDerWaalsContact O-N 3.11Å; Q364-S366 VanDerWaalsContact C-N 3.26Å; Q364-S366 PolarHBondContact O-N 3.42Å
365	E	67.1	Low	78.1	Confident	14 Å²	14	58.4 Å²	58.4	7%	0.065	31%	0.309	C	S	.	.			trans	-73.6	-13.9	-172.5	-158.9	-167	-102.3	0	0	114	L363 K367 L368 R373 K408	L363-E365 PolarHBondContact O-N 2.75Å; E365-K367 PolarHBondContact O-N 2.73Å; E365-L368 PolarHBondContact O-N 2.73Å; E365-R373 IonicContact OE1-CZ 3.9Å; E365-R373 VanDerWaalsContact OE1-CZ 3.32Å; E365-R373 IonicContact OE1-NH1 3.4Å; E365-R373 PolarHBondContact OE1-NH1 2.95Å; E365-R373 IonicContact OE1-NH2 2.61Å; E365-R373 IonicContact OE2-CZ 3.76Å; E365-R373 IonicContact OE2-NH1 2.74Å; E365-R373 PolarHBondContact OE2-NH1 2.81Å; E365-R373 IonicContact OE2-NH2 3.88Å; E365-R373 PolarHBondContact OE2-NH2 3.42Å; E365-K408 HydrophobicContact CB-CB 4.11Å; E365-K408 VanDerWaalsContact CB-O 3.25Å; E365-K408 WeakPolarHBondContact CB-O 3.32Å; E365-K408 VanDerWaalsContact CD-CB 3.47Å; E365-K408 HydrophobicContact CG-CB 4.45Å; E365-K408 PolarHBondContact N-O 2.68Å; E365-K408 WeakPolarHBondContact OE2-CB 3.28Å; E365-K408 WeakPolarHBondContact OE2-CD 3.35Å
366	S	60	Low	77.2	Confident	87 Å²	87	56 Å²	56	61%	0.608	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	23.5	-171.1	67	0	0	0	0	115.7	Q364	Q364-S366 VanDerWaalsContact C-N 3.26Å; Q364-S366 PolarHBondContact O-N 3.42Å
367	K	59.9	Low	76.4	Confident	107 Å²	107	57.6 Å²	57.6	47%	0.465	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.5	1.9	174.4	-70.8	-177.8	170.7	-173.4	0	113.1	F343 E365 F492	F343-K367 HydrophobicContact CD1-CD 4.21Å; F343-K367 HydrophobicContact CE1-CD 3.72Å; E365-K367 PolarHBondContact O-N 2.73Å; K367-F492 HydrophobicContact CD-CE2 3.99Å
368	L	62.9	Low	75.5	Confident	29 Å²	29	60.7 Å²	60.7	15%	0.152	29%	0.289	C	S	.	.			trans	-109.5	128.2	-173.1	-64.1	175	0	0	0	112.7	E365 E372 I410 L487	E365-L368 PolarHBondContact O-N 2.73Å; L368-E372 HydrophobicContact CD2-CB 4.31Å; L368-I410 HydrophobicContact CD1-CD1 4.48Å; L368-L487 HydrophobicContact CD1-CD2 3.82Å; L368-L487 HydrophobicContact CD2-CD2 3.84Å
369	N	66.3	Low	74.6	Confident	107 Å²	107	62.8 Å²	62.8	57%	0.572	30%	0.299	S	S	*	.			trans	-77.8	164.8	176.7	-163.4	-0.9	0	0	0	111.7	T371 E372 R373	N369-T371 VanDerWaalsContact C-N 3.3Å; N369-T371 PolarHBondContact O-N 3.35Å; N369-E372 HydrophobicContact CB-CG 4.34Å; N369-E372 WeakPolarHBondContact CB-OE2 3.41Å; N369-E372 PolarHBondContact N-OE2 2.92Å; N369-E372 PolarHBondContact O-N 3.31Å; N369-E372 VanDerWaalsContact O-N 3.14Å; N369-R373 PolarHBondContact O-N 3.46Å
370	K	73	Confident	73.8	Confident	172 Å²	172	62.5 Å²	62.5	75%	0.748	30%	0.296	S	S	*	.	H	α-helix	trans	-55.3	-42.2	-178.6	-171.7	179.4	178.8	-176.3	0	112.5	Q374	K370-Q374 PolarHBondContact O-N 3.09Å; K370-Q374 VanDerWaalsContact O-N 3.13Å
371	T	69.1	Low	73.2	Confident	90 Å²	90	66.7 Å²	66.7	55%	0.552	32%	0.316	S	S	*	.	H	α-helix	trans	-69.1	-37.2	178.8	-44.4	0	0	0	0	112.6	N369 Q374 R375	N369-T371 VanDerWaalsContact C-N 3.3Å; N369-T371 PolarHBondContact O-N 3.35Å; T371-Q374 PolarHBondContact O-N 3.1Å; T371-R375 PolarHBondContact O-N 2.76Å; T371-R375 VanDerWaalsContact O-N 3.07Å
372	E	65	Low	72.5	Confident	57 Å²	57	70.3 Å²	70.3	27%	0.266	33%	0.333	S	S	.	.	H	α-helix	trans	-70.2	-40.5	179	-62.1	172.7	132.4	0	0	110.9	L368 N369 Q374 R375 F376	L368-E372 HydrophobicContact CD2-CB 4.31Å; N369-E372 HydrophobicContact CB-CG 4.34Å; N369-E372 WeakPolarHBondContact CB-OE2 3.41Å; N369-E372 PolarHBondContact N-OE2 2.92Å; N369-E372 PolarHBondContact O-N 3.31Å; N369-E372 VanDerWaalsContact O-N 3.14Å; E372-Q374 VanDerWaalsContact C-N 3.31Å; E372-Q374 PolarHBondContact O-N 2.67Å; E372-R375 PolarHBondContact O-N 3.01Å; E372-F376 WeakPolarHBondContact O-CB 3.39Å; E372-F376 PolarHBondContact O-N 3.17Å
373	R	71.5	Confident	72.3	Confident	46 Å²	46	69.8 Å²	69.8	17%	0.174	33%	0.331	C	S	.	.	H	α-helix	trans	-59.6	-39.8	171.4	-174.2	-158.7	-55.5	-104.9	-15.1	112.3	E365 N369 R377 E399	E365-R373 IonicContact OE1-CZ 3.9Å; E365-R373 VanDerWaalsContact OE1-CZ 3.32Å; E365-R373 IonicContact OE1-NH1 3.4Å; E365-R373 PolarHBondContact OE1-NH1 2.95Å; E365-R373 IonicContact OE1-NH2 2.61Å; E365-R373 IonicContact OE2-CZ 3.76Å; E365-R373 IonicContact OE2-NH1 2.74Å; E365-R373 PolarHBondContact OE2-NH1 2.81Å; E365-R373 IonicContact OE2-NH2 3.88Å; E365-R373 PolarHBondContact OE2-NH2 3.42Å; N369-R373 PolarHBondContact O-N 3.46Å; R373-R377 WeakPolarHBondContact O-CB 3.45Å; R373-R377 PolarHBondContact O-N 2.97Å; R373-E399 WeakPolarHBondContact CD-OE1 3.5Å; R373-E399 IonicContact CZ-OE2 3.31Å; R373-E399 IonicContact NH1-OE2 3.84Å; R373-E399 PolarHBondContact NH1-OE2 2.89Å
374	Q	74.6	Confident	72.6	Confident	89 Å²	89	71.5 Å²	71.5	42%	0.416	34%	0.338	S	S	.	.	H	α-helix	trans	-67.4	-47	178.5	-178.5	58	33.9	0	0	111.7	K370 T371 E372 F376 R377 E378	K370-Q374 PolarHBondContact O-N 3.09Å; K370-Q374 VanDerWaalsContact O-N 3.13Å; T371-Q374 PolarHBondContact O-N 3.1Å; E372-Q374 VanDerWaalsContact C-N 3.31Å; E372-Q374 PolarHBondContact O-N 2.67Å; Q374-F376 PolarHBondContact O-N 2.71Å; Q374-R377 WeakPolarHBondContact O-CB 3.34Å; Q374-R377 PolarHBondContact O-N 2.73Å; Q374-R377 VanDerWaalsContact O-N 3.15Å; Q374-E378 WeakPolarHBondContact CG-OE1 3.5Å; Q374-E378 PolarHBondContact NE2-OE1 3.21Å; Q374-E378 PolarHBondContact O-N 2.87Å; Q374-E378 VanDerWaalsContact O-N 3.11Å
375	R	68.5	Low	73	Confident	141 Å²	141	74.2 Å²	74.2	53%	0.532	36%	0.355	S	S	.	.	H	α-helix	trans	-59.1	-47.7	173.8	-71.3	-177.9	177.7	-161.3	-2.8	111.7	T371 E372 R377 E378 E379	T371-R375 PolarHBondContact O-N 2.76Å; T371-R375 VanDerWaalsContact O-N 3.07Å; E372-R375 PolarHBondContact O-N 3.01Å; R375-R377 PolarHBondContact O-N 2.69Å; R375-E378 PolarHBondContact O-N 3.06Å; R375-E378 VanDerWaalsContact O-N 3.14Å; R375-E379 WeakPolarHBondContact O-CB 3.32Å; R375-E379 VanDerWaalsContact O-CD 3.23Å; R375-E379 WeakPolarHBondContact O-CG 3.47Å; R375-E379 PolarHBondContact O-N 2.8Å
376	F	73.1	Confident	74	Confident	5 Å²	5	74 Å²	74	2%	0.022	35%	0.354	C	S	.	.	H	α-helix	trans	-55.4	-38.9	175.9	176.1	-83.9	0	0	0	112.2	L363 E372 Q374 E379 A380 Y397 I410 L412 G483 L487	L363-F376 HydrophobicContact CD1-CE2 4.15Å; L363-F376 HydrophobicContact CD1-CZ 4.4Å; E372-F376 WeakPolarHBondContact O-CB 3.39Å; E372-F376 PolarHBondContact O-N 3.17Å; Q374-F376 PolarHBondContact O-N 2.71Å; F376-E379 WeakPolarHBondContact CA-OE2 2.79Å; F376-E379 PolarHBondContact N-OE2 2.92Å; F376-A380 HydrophobicContact CD1-CB 4.33Å; F376-A380 HydrophobicContact CE1-CB 3.75Å; F376-A380 HydrophobicContact CZ-CB 3.98Å; F376-A380 WeakPolarHBondContact O-CB 3.27Å; F376-A380 PolarHBondContact O-N 3.09Å; F376-Y397 HydrophobicContact CE1-CD2 4.28Å; F376-I410 HydrophobicContact CD1-CD1 3.68Å; F376-I410 HydrophobicContact CD1-CG2 4.44Å; F376-I410 HydrophobicContact CE1-CD1 3.78Å; F376-I410 HydrophobicContact CE1-CG2 3.54Å; F376-I410 HydrophobicContact CG-CD1 4.26Å; F376-I410 HydrophobicContact CZ-CD1 4.35Å; F376-I410 HydrophobicContact CZ-CG2 3.88Å; F376-L412 HydrophobicContact CE2-CD2 4.29Å; F376-L412 HydrophobicContact CZ-CD1 4.18Å; F376-L412 HydrophobicContact CZ-CD2 3.82Å; F376-L412 HydrophobicContact CZ-CG 4.12Å; F376-G483 WeakPolarHBondContact CE2-O 3.21Å; F376-L487 HydrophobicContact CB-CD2 3.98Å; F376-L487 HydrophobicContact CD2-CD1 3.8Å; F376-L487 HydrophobicContact CD2-CD2 3.6Å; F376-L487 HydrophobicContact CD2-CG 3.7Å; F376-L487 HydrophobicContact CE2-CD1 3.94Å; F376-L487 HydrophobicContact CE2-CG 4.27Å; F376-L487 HydrophobicContact CG-CD2 4.08Å
377	R	77.4	Confident	75.5	Confident	107 Å²	107	75.2 Å²	75.2	40%	0.404	35%	0.35	S	S	.	.	H	α-helix	trans	-65.3	-46.3	178.1	-173.6	-175.9	-69.9	-153.9	-1.1	111.9	R373 Q374 R375 E379 A380 E381 Y397 E399	R373-R377 WeakPolarHBondContact O-CB 3.45Å; R373-R377 PolarHBondContact O-N 2.97Å; Q374-R377 WeakPolarHBondContact O-CB 3.34Å; Q374-R377 PolarHBondContact O-N 2.73Å; Q374-R377 VanDerWaalsContact O-N 3.15Å; R375-R377 PolarHBondContact O-N 2.69Å; R377-E379 VanDerWaalsContact C-N 3.34Å; R377-A380 PolarHBondContact O-N 3.25Å; R377-E381 PolarHBondContact O-N 2.74Å; R377-Y397 HydrophobicContact CG-CE2 4.15Å; R377-Y397 VanDerWaalsContact CG-OH 3.25Å; R377-Y397 WeakPolarHBondContact CG-OH 3.46Å; R377-Y397 PolarHBondContact O-OH 3.41Å; R377-E399 IonicContact CZ-OE1 3.9Å; R377-E399 IonicContact NE-OE1 2.77Å; R377-E399 IonicContact NH2-OE1 3.98Å; R377-E399 PolarHBondContact NH2-OE1 3.17Å
378	E	76.8	Confident	77.1	Confident	102 Å²	102	72.2 Å²	72.2	48%	0.477	34%	0.338	S	S	.	.	H	α-helix	trans	-60.9	-44.5	176.3	-69.1	156.3	-169.6	0	0	111	Q374 R375 E381 M382	Q374-E378 WeakPolarHBondContact CG-OE1 3.5Å; Q374-E378 PolarHBondContact NE2-OE1 3.21Å; Q374-E378 PolarHBondContact O-N 2.87Å; Q374-E378 VanDerWaalsContact O-N 3.11Å; R375-E378 PolarHBondContact O-N 3.06Å; R375-E378 VanDerWaalsContact O-N 3.14Å; E378-E381 PolarHBondContact O-N 3.36Å; E378-M382 WeakPolarHBondContact O-CG 3.41Å; E378-M382 PolarHBondContact O-N 3.28Å; E378-M382 VanDerWaalsContact O-N 3.15Å
379	E	75.9	Confident	78.6	Confident	44 Å²	44	75.2 Å²	75.2	21%	0.206	36%	0.359	C	S	.	.	H	α-helix	trans	-66.7	-45.7	178.5	-65.5	156.6	160.6	0	0	111.9	R375 F376 R377 E381 M382 L383 T486	R375-E379 WeakPolarHBondContact O-CB 3.32Å; R375-E379 VanDerWaalsContact O-CD 3.23Å; R375-E379 WeakPolarHBondContact O-CG 3.47Å; R375-E379 PolarHBondContact O-N 2.8Å; F376-E379 WeakPolarHBondContact CA-OE2 2.79Å; F376-E379 PolarHBondContact N-OE2 2.92Å; R377-E379 VanDerWaalsContact C-N 3.34Å; E379-E381 VanDerWaalsContact C-N 3.27Å; E379-E381 PolarHBondContact O-N 2.64Å; E379-M382 HydrophobicContact CG-CE 4.25Å; E379-M382 PolarHBondContact O-N 2.93Å; E379-L383 WeakPolarHBondContact O-CG 3.1Å; E379-L383 PolarHBondContact O-N 3.12Å; E379-T486 HydrophobicContact CB-CG2 4.42Å; E379-T486 HydrophobicContact CG-CG2 3.95Å; E379-T486 VanDerWaalsContact OE1-CB 3.25Å; E379-T486 WeakPolarHBondContact OE1-CB 3.42Å; E379-T486 WeakPolarHBondContact OE1-CG2 3.09Å; E379-T486 WeakPolarHBondContact OE2-CB 3.43Å; E379-T486 WeakPolarHBondContact OE2-CG2 3.39Å; E379-T486 PolarHBondContact OE2-OG1 3.19Å
380	A	79.6	Confident	80.1	Confident	2 Å²	2	70.7 Å²	70.7	2%	0.017	34%	0.335	C	S	.	.	H	α-helix	trans	-69.4	-22.5	179.3	0	0	0	0	0	113.3	F376 R377 F394 Y397	F376-A380 HydrophobicContact CD1-CB 4.33Å; F376-A380 HydrophobicContact CE1-CB 3.75Å; F376-A380 HydrophobicContact CZ-CB 3.98Å; F376-A380 WeakPolarHBondContact O-CB 3.27Å; F376-A380 PolarHBondContact O-N 3.09Å; R377-A380 PolarHBondContact O-N 3.25Å; A380-F394 HydrophobicContact CB-CZ 4.44Å; A380-F394 WeakPolarHBondContact O-CE1 3.47Å; A380-Y397 VanDerWaalsContact C-CE1 3.41Å; A380-Y397 HydrophobicContact CB-CD1 3.42Å; A380-Y397 VanDerWaalsContact CB-CD1 3.42Å; A380-Y397 HydrophobicContact CB-CD2 4.02Å; A380-Y397 HydrophobicContact CB-CE1 3.65Å; A380-Y397 HydrophobicContact CB-CE2 4.25Å; A380-Y397 HydrophobicContact CB-CG 3.65Å; A380-Y397 WeakPolarHBondContact O-CD1 3.37Å; A380-Y397 WeakPolarHBondContact O-CE1 3.46Å
381	E	82.2	Confident	81.1	Confident	89 Å²	89	62.7 Å²	62.7	42%	0.416	30%	0.3	S	S	.	.	H	α-helix	trans	-71.7	-49.4	167.7	-151.6	66.6	-139.4	0	0	110.6	R377 E378 E379 L383 K384 Y397	R377-E381 PolarHBondContact O-N 2.74Å; E378-E381 PolarHBondContact O-N 3.36Å; E379-E381 VanDerWaalsContact C-N 3.27Å; E379-E381 PolarHBondContact O-N 2.64Å; E381-L383 PolarHBondContact O-N 3.11Å; E381-L383 VanDerWaalsContact O-N 3.14Å; E381-K384 WeakPolarHBondContact O-CB 3.36Å; E381-K384 PolarHBondContact O-N 3.06Å; E381-K384 WeakPolarHBondContact OE1-CD 3.37Å; E381-K384 WeakPolarHBondContact OE1-CE 3.42Å; E381-K384 IonicContact OE1-NZ 3.86Å; E381-K384 PolarHBondContact OE1-NZ 3.11Å; E381-K384 IonicContact OE2-NZ 2.81Å; E381-K384 PolarHBondContact OE2-NZ 3.25Å; E381-Y397 HydrophobicContact CB-CE1 4.36Å; E381-Y397 WeakPolarHBondContact OE2-CE1 3.36Å; E381-Y397 VanDerWaalsContact OE2-CZ 3.31Å; E381-Y397 PolarHBondContact OE2-OH 2.99Å
382	M	78.1	Confident	82.3	Confident	82 Å²	82	59.1 Å²	59.1	40%	0.404	28%	0.279	S	S	.	.	H	α-helix	trans	-56.2	-31.4	175.2	-69.7	-168.8	-66.2	0	0	113.3	E378 E379 K384 P456	E378-M382 WeakPolarHBondContact O-CG 3.41Å; E378-M382 PolarHBondContact O-N 3.28Å; E378-M382 VanDerWaalsContact O-N 3.15Å; E379-M382 HydrophobicContact CG-CE 4.25Å; E379-M382 PolarHBondContact O-N 2.93Å; M382-K384 VanDerWaalsContact C-N 3.3Å; M382-K384 PolarHBondContact O-N 3.15Å; M382-P456 HydrophobicContact SD-CG 4Å
383	L	83.1	Confident	83.6	Confident	17 Å²	17	60.5 Å²	60.5	9%	0.089	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-67.3	-24.8	178.5	-70.3	177.5	0	0	0	113.8	E379 E381 D385 L386 F394 L482 G483	E379-L383 WeakPolarHBondContact O-CG 3.1Å; E379-L383 PolarHBondContact O-N 3.12Å; E381-L383 PolarHBondContact O-N 3.11Å; E381-L383 VanDerWaalsContact O-N 3.14Å; L383-D385 VanDerWaalsContact C-N 3.3Å; L383-D385 PolarHBondContact O-N 2.86Å; L383-L386 HydrophobicContact CD2-CD1 3.5Å; L383-L386 HydrophobicContact CD2-CG 4.45Å; L383-L386 WeakPolarHBondContact O-CB 3.28Å; L383-L386 PolarHBondContact O-N 2.98Å; L383-F394 HydrophobicContact CB-CB 4.38Å; L383-F394 HydrophobicContact CB-CD1 3.86Å; L383-F394 HydrophobicContact CB-CD2 4.24Å; L383-F394 HydrophobicContact CB-CE1 4.11Å; L383-F394 HydrophobicContact CB-CE2 4.48Å; L383-F394 HydrophobicContact CB-CG 3.92Å; L383-F394 HydrophobicContact CB-CZ 4.41Å; L383-F394 HydrophobicContact CD1-CE2 4.32Å; L383-F394 WeakPolarHBondContact O-CB 3.49Å; L383-L482 HydrophobicContact CD2-CB 3.89Å; L383-L482 HydrophobicContact CD2-CD1 4.28Å; L383-G483 VanDerWaalsContact CD1-CA 3.45Å
384	K	86.4	Confident	84.6	Confident	42 Å²	42	59 Å²	59	18%	0.183	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-64.8	-33.2	179.9	-63	178.7	-168.6	176.6	0	112.8	E381 M382 L386 F394 D396 Y397	E381-K384 WeakPolarHBondContact O-CB 3.36Å; E381-K384 PolarHBondContact O-N 3.06Å; E381-K384 WeakPolarHBondContact OE1-CD 3.37Å; E381-K384 WeakPolarHBondContact OE1-CE 3.42Å; E381-K384 IonicContact OE1-NZ 3.86Å; E381-K384 PolarHBondContact OE1-NZ 3.11Å; E381-K384 IonicContact OE2-NZ 2.81Å; E381-K384 PolarHBondContact OE2-NZ 3.25Å; M382-K384 VanDerWaalsContact C-N 3.3Å; M382-K384 PolarHBondContact O-N 3.15Å; K384-L386 VanDerWaalsContact C-N 3.29Å; K384-L386 PolarHBondContact O-N 2.82Å; K384-F394 HydrophobicContact CB-CD1 4.49Å; K384-F394 HydrophobicContact CG-CD1 3.82Å; K384-F394 HydrophobicContact CG-CE1 4.04Å; K384-D396 WeakPolarHBondContact CE-OD1 3.27Å; K384-D396 IonicContact NZ-OD1 3.7Å; K384-D396 PolarHBondContact NZ-OD1 3.33Å; K384-Y397 VanDerWaalsContact CE-CD1 3.43Å; K384-Y397 VanDerWaalsContact CE-CE1 3.42Å
385	D	83.8	Confident	85.4	Confident	129 Å²	129	57.4 Å²	57.4	69%	0.69	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-81.2	-6.8	-179.5	-67.8	-32.8	0	0	0	113.3	L383 Q387	L383-D385 VanDerWaalsContact C-N 3.3Å; L383-D385 PolarHBondContact O-N 2.86Å; D385-Q387 PolarHBondContact O-N 3.25Å
386	L	87.2	Confident	86.5	Confident	10 Å²	10	52.3 Å²	52.3	5%	0.052	25%	0.25	C	C	.	.			trans	-77	93.4	-179.9	-60.9	-169.4	0	0	0	112.2	L383 K384 F450 L451 R454 L482	L383-L386 HydrophobicContact CD2-CD1 3.5Å; L383-L386 HydrophobicContact CD2-CG 4.45Å; L383-L386 WeakPolarHBondContact O-CB 3.28Å; L383-L386 PolarHBondContact O-N 2.98Å; K384-L386 VanDerWaalsContact C-N 3.29Å; K384-L386 PolarHBondContact O-N 2.82Å; L386-F450 HydrophobicContact CB-CE1 4.13Å; L386-F450 HydrophobicContact CD2-CE1 3.96Å; L386-F450 HydrophobicContact CD2-CZ 4.29Å; L386-L451 HydrophobicContact CD1-CD2 3.76Å; L386-R454 HydrophobicContact CD2-CG 3.77Å; L386-L482 HydrophobicContact CD1-CD1 4.05Å
387	Q	91.9	Very high	87.3	Confident	112 Å²	112	53.4 Å²	53.4	52%	0.523	25%	0.254	S	S	.	.			trans	-117.1	105.4	178.6	-54.7	-172.2	43	0	0	110.8	D385 R393	D385-Q387 PolarHBondContact O-N 3.25Å; Q387-R393 VanDerWaalsContact CD-NH2 3.34Å
388	H	94	Very high	87.9	Confident	45 Å²	45	49.1 Å²	49.1	21%	0.208	24%	0.238	C	C	.	.			trans	-150.9	139.9	178.2	180	-98.7	0	0	0	110.3	N390 I391 F450	H388-N390 PolarHBondContact ND1-N 3.31Å; H388-N390 PolarHBondContact O-N 2.93Å; H388-N390 VanDerWaalsContact O-N 3.12Å; H388-I391 HydrophobicContact CB-CB 4.25Å; H388-I391 HydrophobicContact CB-CG1 3.85Å; H388-I391 PolarHBondContact O-N 3.03Å; H388-F450 HydrophobicContact CB-CB 4.35Å; H388-F450 HydrophobicContact CB-CD1 3.59Å; H388-F450 HydrophobicContact CB-CD2 3.88Å; H388-F450 HydrophobicContact CB-CE1 3.74Å; H388-F450 HydrophobicContact CB-CE2 4.02Å; H388-F450 HydrophobicContact CB-CG 3.66Å; H388-F450 HydrophobicContact CB-CZ 3.95Å; H388-F450 AromaticContact CD2-CD2 3.84Å; H388-F450 AromaticContact CD2-CG 3.8Å; H388-F450 AromaticContact CG-CG 3.7Å
389	P	94	Very high	88.4	Confident	92 Å²	92	46.2 Å²	46.2	60%	0.597	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-29.7	-175.1	20.6	-34.8	0	0	0	114.5	K478	P389-K478 VanDerWaalsContact O-CE 3.28Å; P389-K478 WeakPolarHBondContact O-CE 3.38Å; P389-K478 VanDerWaalsContact O-CG 3.28Å; P389-K478 WeakPolarHBondContact O-CG 3.49Å
390	N	96.4	Very high	88.8	Confident	12 Å²	12	45.5 Å²	45.5	6%	0.064	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	18.7	178.4	-53.5	115.7	0	0	0	114.1	H388 Q443 V477 K478 I479	H388-N390 PolarHBondContact ND1-N 3.31Å; H388-N390 PolarHBondContact O-N 2.93Å; H388-N390 VanDerWaalsContact O-N 3.12Å; N390-Q443 VanDerWaalsContact CB-O 3.28Å; N390-Q443 WeakPolarHBondContact CB-O 3.25Å; N390-Q443 WeakPolarHBondContact ND2-CB 3.22Å; N390-Q443 WeakPolarHBondContact ND2-CG 3.48Å; N390-Q443 PolarHBondContact ND2-OE1 3.47Å; N390-Q443 VanDerWaalsContact ND2-OE1 3.1Å; N390-V477 WeakPolarHBondContact CA-O 3.4Å; N390-V477 WeakPolarHBondContact CB-O 3.36Å; N390-V477 PolarHBondContact ND2-O 3.19Å; N390-K478 WeakPolarHBondContact O-CA 3.26Å; N390-I479 PolarHBondContact O-N 3.33Å
391	I	94.8	Very high	88.8	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.015	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-115.2	144.7	167.5	-58	-61.1	0	0	0	108.2	H388 R393 F450 L451 K478 I479 L482	H388-I391 HydrophobicContact CB-CB 4.25Å; H388-I391 HydrophobicContact CB-CG1 3.85Å; H388-I391 PolarHBondContact O-N 3.03Å; I391-R393 PolarHBondContact O-N 3.13Å; I391-F450 HydrophobicContact CG1-CD1 4.06Å; I391-F450 HydrophobicContact CG1-CE1 4.47Å; I391-L451 HydrophobicContact CD1-CD1 3.79Å; I391-L451 HydrophobicContact CD1-CD2 4.11Å; I391-L451 HydrophobicContact CD1-CG 3.9Å; I391-K478 PolarHBondContact O-NZ 3.28Å; I391-I479 WeakPolarHBondContact CA-O 3.37Å; I391-I479 HydrophobicContact CD1-CB 3.99Å; I391-I479 HydrophobicContact CD1-CD1 4.28Å; I391-I479 HydrophobicContact CD1-CG1 4.44Å; I391-L482 HydrophobicContact CG2-CD1 3.84Å
392	V	94.1	Very high	88.5	Confident	16 Å²	16	45.2 Å²	45.2	10%	0.097	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-71.8	119.9	169.9	176.4	0	0	0	0	107.7	F394 E415 M417 F469 K478 I479	V392-F394 PolarHBondContact O-N 3.22Å; V392-E415 HydrophobicContact CG1-CB 3.95Å; V392-M417 HydrophobicContact CG1-CG 4.25Å; V392-M417 HydrophobicContact CG2-CG 3.88Å; V392-M417 HydrophobicContact CG2-SD 4.22Å; V392-F469 HydrophobicContact CG2-CD2 3.77Å; V392-F469 HydrophobicContact CG2-CE2 4.4Å; V392-F469 HydrophobicContact CG2-CG 4.42Å; V392-K478 HydrophobicContact CG2-CB 3.74Å; V392-I479 PolarHBondContact N-O 3.34Å
393	R	93	Very high	87.9	Confident	85 Å²	85	50.7 Å²	50.7	32%	0.321	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-63.7	129.7	-174.4	178.2	172.6	-175.4	113.2	20.8	111.2	Q387 I391 Y395 T414 E415	Q387-R393 VanDerWaalsContact CD-NH2 3.34Å; I391-R393 PolarHBondContact O-N 3.13Å; R393-Y395 VanDerWaalsContact CD-CE1 3.44Å; R393-Y395 HydrophobicContact CG-CD1 4.26Å; R393-Y395 HydrophobicContact CG-CE1 4Å; R393-T414 CarbonylContact O-C 3.57Å; R393-T414 VanDerWaalsContact O-CA 3.27Å; R393-T414 WeakPolarHBondContact O-CA 3.49Å; R393-T414 WeakPolarHBondContact O-CB 3.4Å; R393-E415 HydrophobicContact CB-CB 4.11Å; R393-E415 PolarHBondContact N-OE2 3.32Å; R393-E415 PolarHBondContact O-N 2.86Å
394	F	91.5	Very high	87	Confident	16 Å²	16	52.9 Å²	52.9	7%	0.07	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	138.6	164.8	-157.1	-102.8	0	0	0	109.2	A380 L383 K384 V392 Y397 L412 T414	A380-F394 HydrophobicContact CB-CZ 4.44Å; A380-F394 WeakPolarHBondContact O-CE1 3.47Å; L383-F394 HydrophobicContact CB-CB 4.38Å; L383-F394 HydrophobicContact CB-CD1 3.86Å; L383-F394 HydrophobicContact CB-CD2 4.24Å; L383-F394 HydrophobicContact CB-CE1 4.11Å; L383-F394 HydrophobicContact CB-CE2 4.48Å; L383-F394 HydrophobicContact CB-CG 3.92Å; L383-F394 HydrophobicContact CB-CZ 4.41Å; L383-F394 HydrophobicContact CD1-CE2 4.32Å; L383-F394 WeakPolarHBondContact O-CB 3.49Å; K384-F394 HydrophobicContact CB-CD1 4.49Å; K384-F394 HydrophobicContact CG-CD1 3.82Å; K384-F394 HydrophobicContact CG-CE1 4.04Å; V392-F394 PolarHBondContact O-N 3.22Å; F394-Y397 HydrophobicContact CE1-CD1 4.19Å; F394-L412 HydrophobicContact CE2-CB 3.96Å; F394-L412 HydrophobicContact CE2-CD2 3.75Å; F394-L412 HydrophobicContact CE2-CG 4.32Å; F394-L412 HydrophobicContact CZ-CB 4.13Å; F394-L412 HydrophobicContact CZ-CD2 3.97Å; F394-L412 HydrophobicContact CZ-CG 4.28Å; F394-T414 HydrophobicContact CD2-CG2 3.81Å; F394-T414 HydrophobicContact CE2-CG2 4.28Å
395	Y	92.5	Very high	86.2	Confident	55 Å²	55	53.4 Å²	53.4	22%	0.216	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-55.3	178.6	-67.9	-68.7	0	0	0	112	F331 V358 R393 V413 E415	F331-Y395 HydrophobicContact CE1-CG 4.47Å; F331-Y395 HydrophobicContact CZ-CG 4.43Å; V358-Y395 HydrophobicContact CG1-CD2 4Å; V358-Y395 HydrophobicContact CG1-CE2 3.72Å; R393-Y395 VanDerWaalsContact CD-CE1 3.44Å; R393-Y395 HydrophobicContact CG-CD1 4.26Å; R393-Y395 HydrophobicContact CG-CE1 4Å; Y395-V413 HydrophobicContact CD2-CG1 4.17Å; Y395-V413 PolarHBondContact N-O 2.94Å; Y395-E415 HydrophobicContact CE2-CB 4.33Å
396	D	91.6	Very high	85.5	Confident	33 Å²	33	55.9 Å²	55.9	18%	0.176	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	170.2	-177.8	-160.3	14.1	0	0	0	111.8	F331 K384 W398 V413	F331-D396 HydrophobicContact CE2-CB 3.83Å; K384-D396 WeakPolarHBondContact CE-OD1 3.27Å; K384-D396 IonicContact NZ-OD1 3.7Å; K384-D396 PolarHBondContact NZ-OD1 3.33Å; D396-W398 HydrophobicContact CB-CZ3 4.36Å; D396-V413 PolarHBondContact O-N 2.99Å
397	Y	89.5	Confident	84.7	Confident	28 Å²	28	60.2 Å²	60.2	11%	0.11	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	157.7	169.2	77.5	-83.2	0	0	0	111.7	F376 R377 A380 E381 K384 F394 V411	F376-Y397 HydrophobicContact CE1-CD2 4.28Å; R377-Y397 HydrophobicContact CG-CE2 4.15Å; R377-Y397 VanDerWaalsContact CG-OH 3.25Å; R377-Y397 WeakPolarHBondContact CG-OH 3.46Å; R377-Y397 PolarHBondContact O-OH 3.41Å; A380-Y397 VanDerWaalsContact C-CE1 3.41Å; A380-Y397 HydrophobicContact CB-CD1 3.42Å; A380-Y397 VanDerWaalsContact CB-CD1 3.42Å; A380-Y397 HydrophobicContact CB-CD2 4.02Å; A380-Y397 HydrophobicContact CB-CE1 3.65Å; A380-Y397 HydrophobicContact CB-CE2 4.25Å; A380-Y397 HydrophobicContact CB-CG 3.65Å; A380-Y397 WeakPolarHBondContact O-CD1 3.37Å; A380-Y397 WeakPolarHBondContact O-CE1 3.46Å; E381-Y397 HydrophobicContact CB-CE1 4.36Å; E381-Y397 WeakPolarHBondContact OE2-CE1 3.36Å; E381-Y397 VanDerWaalsContact OE2-CZ 3.31Å; E381-Y397 PolarHBondContact OE2-OH 2.99Å; K384-Y397 VanDerWaalsContact CE-CD1 3.43Å; K384-Y397 VanDerWaalsContact CE-CE1 3.42Å; F394-Y397 HydrophobicContact CE1-CD1 4.19Å; Y397-V411 CarbonylContact C-O 3.58Å; Y397-V411 WeakPolarHBondContact CA-O 3.13Å; Y397-V411 VanDerWaalsContact CB-O 3.3Å; Y397-V411 WeakPolarHBondContact CB-O 3.3Å
398	W	89.6	Confident	84.1	Confident	17 Å²	17	59.9 Å²	59.9	6%	0.064	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	149.7	167.6	57.6	89.2	0	0	0	113	K327 F331 W360 D396 V411 V413	K327-W398 HydrophobicContact CD-CB 4.25Å; K327-W398 HydrophobicContact CD-CG 4.35Å; K327-W398 HydrophobicContact CG-CG 4.41Å; F331-W398 HydrophobicContact CB-CH2 4.37Å; F331-W398 HydrophobicContact CD2-CH2 4.14Å; F331-W398 AromaticContact CD2-CZ3 3.99Å; F331-W398 HydrophobicContact CD2-CZ3 3.99Å; W360-W398 HydrophobicContact CE3-CH2 4.34Å; W360-W398 HydrophobicContact CE3-CZ2 4.34Å; W360-W398 HydrophobicContact CH2-CH2 4.29Å; W360-W398 AromaticContact CH2-CZ2 3.58Å; W360-W398 HydrophobicContact CH2-CZ2 3.58Å; W360-W398 HydrophobicContact CZ2-CZ2 4.01Å; W360-W398 AromaticContact CZ3-CH2 3.98Å; W360-W398 HydrophobicContact CZ3-CH2 3.98Å; W360-W398 AromaticContact CZ3-CZ2 3.74Å; W360-W398 HydrophobicContact CZ3-CZ2 3.74Å; D396-W398 HydrophobicContact CB-CZ3 4.36Å; W398-V411 HydrophobicContact CD2-CB 4.13Å; W398-V411 HydrophobicContact CG-CB 4.49Å; W398-V411 HydrophobicContact CH2-CB 4.38Å; W398-V411 HydrophobicContact CH2-CG1 3.79Å; W398-V411 HydrophobicContact CZ2-CB 3.75Å; W398-V411 HydrophobicContact CZ2-CG1 3.45Å; W398-V411 VanDerWaalsContact CZ2-CG1 3.45Å; W398-V411 HydrophobicContact CZ2-CG2 4.16Å; W398-V411 HydrophobicContact CZ3-CG1 4.49Å; W398-V411 PolarHBondContact N-O 2.91Å; W398-V411 PolarHBondContact O-N 3.22Å; W398-V413 HydrophobicContact CH2-CG2 3.45Å; W398-V413 VanDerWaalsContact CH2-CG2 3.45Å; W398-V413 HydrophobicContact CZ3-CG2 3.64Å
399	E	86.4	Confident	83.6	Confident	42 Å²	42	59.1 Å²	59.1	20%	0.196	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	132.5	162.4	-73.9	172.7	-126.1	0	0	110.1	K327 R373 R377 I410	K327-E399 WeakPolarHBondContact CE-O 3.45Å; K327-E399 PolarHBondContact NZ-O 3.32Å; R373-E399 WeakPolarHBondContact CD-OE1 3.5Å; R373-E399 IonicContact CZ-OE2 3.31Å; R373-E399 IonicContact NH1-OE2 3.84Å; R373-E399 PolarHBondContact NH1-OE2 2.89Å; R377-E399 IonicContact CZ-OE1 3.9Å; R377-E399 IonicContact NE-OE1 2.77Å; R377-E399 IonicContact NH2-OE1 3.98Å; R377-E399 PolarHBondContact NH2-OE1 3.17Å; E399-I410 HydrophobicContact CG-CG1 4.29Å
400	S	85.5	Confident	83.1	Confident	29 Å²	29	54.8 Å²	54.8	20%	0.203	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	173.4	175.8	-162.7	0	0	0	0	110.8	K408 Y409	S400-K408 WeakPolarHBondContact O-CA 3.45Å; S400-Y409 PolarHBondContact N-O 3.45Å; S400-Y409 PolarHBondContact O-N 2.76Å; S400-Y409 VanDerWaalsContact O-O 3.07Å; S400-Y409 PolarHBondContact OG-OH 3.47Å
401	A	79.7	Confident	82.8	Confident	43 Å²	43	54.2 Å²	54.2	36%	0.355	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	149	173.5	0	0	0	0	0	111.2	R407 K408 Y409	A401-R407 CarbonylContact C-O 3.53Å; A401-R407 VanDerWaalsContact CA-O 3.22Å; A401-R407 WeakPolarHBondContact CA-O 3.35Å; A401-R407 WeakPolarHBondContact CB-O 3.48Å; A401-K408 HydrophobicContact CB-CG 4.32Å; A401-Y409 VanDerWaalsContact C-CE1 3.5Å
402	D	74.6	Confident	82.6	Confident	42 Å²	42	54.5 Å²	54.5	23%	0.225	28%	0.277	C	S	.	.			trans	-49.5	152.3	171.8	-82.7	28.3	0	0	0	110.6	R225 C404 G405 R407	R225-D402 IonicContact CZ-OD2 3.75Å; R225-D402 IonicContact NH1-OD2 2.82Å; R225-D402 PolarHBondContact NH1-OD2 3.36Å; D402-C404 PolarHBondContact O-N 3.08Å; D402-G405 PolarHBondContact O-N 3.29Å; D402-R407 HydrophobicContact CB-CB 4.39Å; D402-R407 PolarHBondContact N-O 3.04Å
403	L	66.2	Low	82.6	Confident	197 Å²	197	53.7 Å²	53.7	100%	1.031	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-9.9	171.7	-64.5	171.3	0	0	0	115.4
404	C	65.3	Low	82.6	Confident	63 Å²	63	50.9 Å²	50.9	43%	0.426	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-0.4	178.7	-168.5	0	0	0	0	112.9	D402 K406	D402-C404 PolarHBondContact O-N 3.08Å; C404-K406 PolarHBondContact O-N 3.44Å
405	G	68.2	Low	82.7	Confident	52 Å²	52	52.1 Å²	52.1	54%	0.536	27%	0.271	S	S	.	.	S	Bend	trans	69.5	-22.2	-176.3	0	0	0	0	0	115.9	D402 R407	D402-G405 PolarHBondContact O-N 3.29Å; G405-R407 VanDerWaalsContact C-N 3.28Å; G405-R407 PolarHBondContact O-N 2.93Å
406	K	69	Low	82.8	Confident	181 Å²	181	51.1 Å²	51.1	79%	0.787	27%	0.269	S	S	*	.	S	Bend	trans	-67.5	-15.5	-170.8	-65.8	-177.2	-175.1	-172.8	0	116	C404	C404-K406 PolarHBondContact O-N 3.44Å
407	R	72	Confident	82.8	Confident	101 Å²	101	50.6 Å²	50.6	38%	0.381	27%	0.265	S	S	.	.			trans	-134.1	128	178.1	-164	-174.7	-152.5	147.7	4.7	109.2	A401 D402 G405	A401-R407 CarbonylContact C-O 3.53Å; A401-R407 VanDerWaalsContact CA-O 3.22Å; A401-R407 WeakPolarHBondContact CA-O 3.35Å; A401-R407 WeakPolarHBondContact CB-O 3.48Å; D402-R407 HydrophobicContact CB-CB 4.39Å; D402-R407 PolarHBondContact N-O 3.04Å; G405-R407 VanDerWaalsContact C-N 3.28Å; G405-R407 PolarHBondContact O-N 2.93Å
408	K	78	Confident	82.8	Confident	106 Å²	106	52 Å²	52	46%	0.461	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	149.1	169.3	-67.4	-179.8	177.2	-175	0	110	E365 S400 A401	E365-K408 HydrophobicContact CB-CB 4.11Å; E365-K408 VanDerWaalsContact CB-O 3.25Å; E365-K408 WeakPolarHBondContact CB-O 3.32Å; E365-K408 VanDerWaalsContact CD-CB 3.47Å; E365-K408 HydrophobicContact CG-CB 4.45Å; E365-K408 PolarHBondContact N-O 2.68Å; E365-K408 WeakPolarHBondContact OE2-CB 3.28Å; E365-K408 WeakPolarHBondContact OE2-CD 3.35Å; S400-K408 WeakPolarHBondContact O-CA 3.45Å; A401-K408 HydrophobicContact CB-CG 4.32Å
409	Y	83.3	Confident	82.8	Confident	28 Å²	28	51.4 Å²	51.4	11%	0.11	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	157.2	175.4	60.4	-84.6	0	0	0	109.7	D324 E362 L363 S400 A401 V411	D324-Y409 PolarHBondContact OD2-OH 2.66Å; E362-Y409 HydrophobicContact CB-CD2 4.23Å; E362-Y409 HydrophobicContact CG-CD2 4.16Å; E362-Y409 HydrophobicContact CG-CE2 4.23Å; E362-Y409 WeakPolarHBondContact OE1-CE2 3.24Å; L363-Y409 CarbonylContact O-C 3.54Å; L363-Y409 VanDerWaalsContact O-CA 3.23Å; L363-Y409 WeakPolarHBondContact O-CA 3.46Å; L363-Y409 VanDerWaalsContact O-CB 3.29Å; L363-Y409 WeakPolarHBondContact O-CB 3.4Å; S400-Y409 PolarHBondContact N-O 3.45Å; S400-Y409 PolarHBondContact O-N 2.76Å; S400-Y409 VanDerWaalsContact O-O 3.07Å; S400-Y409 PolarHBondContact OG-OH 3.47Å; A401-Y409 VanDerWaalsContact C-CE1 3.5Å; Y409-V411 HydrophobicContact CD2-CG2 3.82Å; Y409-V411 HydrophobicContact CE2-CG2 3.53Å
410	I	84	Confident	83	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.6	175.6	-52	-177.6	0	0	0	108.1	E362 L363 L368 F376 E399 L412	E362-I410 CarbonylContact C-O 3.57Å; E362-I410 WeakPolarHBondContact CA-O 3.47Å; L363-I410 HydrophobicContact CB-CB 4.36Å; L363-I410 PolarHBondContact N-O 3.15Å; L363-I410 PolarHBondContact O-N 3.12Å; L368-I410 HydrophobicContact CD1-CD1 4.48Å; F376-I410 HydrophobicContact CD1-CD1 3.68Å; F376-I410 HydrophobicContact CD1-CG2 4.44Å; F376-I410 HydrophobicContact CE1-CD1 3.78Å; F376-I410 HydrophobicContact CE1-CG2 3.54Å; F376-I410 HydrophobicContact CG-CD1 4.26Å; F376-I410 HydrophobicContact CZ-CD1 4.35Å; F376-I410 HydrophobicContact CZ-CG2 3.88Å; E399-I410 HydrophobicContact CG-CG1 4.29Å; I410-L412 HydrophobicContact CG2-CD1 4.1Å
411	V	90.1	Very high	83.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	136.7	170	-173.6	0	0	0	0	109.1	W360 C361 E362 Y397 W398 Y409 V413	W360-V411 HydrophobicContact CD2-CG1 3.76Å; W360-V411 HydrophobicContact CE3-CG1 4.35Å; W360-V411 HydrophobicContact CG-CG1 4.09Å; W360-V411 HydrophobicContact CZ2-CG1 4.02Å; W360-V411 HydrophobicContact CZ2-CG2 4.06Å; C361-V411 CarbonylContact O-C 3.45Å; C361-V411 VanDerWaalsContact O-CA 3.3Å; C361-V411 WeakPolarHBondContact O-CA 3.38Å; E362-V411 HydrophobicContact CG-CG2 4.49Å; Y397-V411 CarbonylContact C-O 3.58Å; Y397-V411 WeakPolarHBondContact CA-O 3.13Å; Y397-V411 VanDerWaalsContact CB-O 3.3Å; Y397-V411 WeakPolarHBondContact CB-O 3.3Å; W398-V411 HydrophobicContact CD2-CB 4.13Å; W398-V411 HydrophobicContact CG-CB 4.49Å; W398-V411 HydrophobicContact CH2-CB 4.38Å; W398-V411 HydrophobicContact CH2-CG1 3.79Å; W398-V411 HydrophobicContact CZ2-CB 3.75Å; W398-V411 HydrophobicContact CZ2-CG1 3.45Å; W398-V411 VanDerWaalsContact CZ2-CG1 3.45Å; W398-V411 HydrophobicContact CZ2-CG2 4.16Å; W398-V411 HydrophobicContact CZ3-CG1 4.49Å; W398-V411 PolarHBondContact N-O 2.91Å; W398-V411 PolarHBondContact O-N 3.22Å; Y409-V411 HydrophobicContact CD2-CG2 3.82Å; Y409-V411 HydrophobicContact CE2-CG2 3.53Å; V411-V413 HydrophobicContact CG1-CG2 4.3Å
412	L	89.9	Confident	84	Confident	9 Å²	9	47 Å²	47	5%	0.047	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	136.5	169.1	-52.8	80.3	0	0	0	107.7	C361 L363 F376 F394 I410	C361-L412 HydrophobicContact CB-CB 4.31Å; C361-L412 WeakPolarHBondContact CB-O 3.44Å; C361-L412 PolarHBondContact N-O 3.28Å; C361-L412 PolarHBondContact O-N 3.41Å; L363-L412 HydrophobicContact CD1-CD1 3.49Å; L363-L412 VanDerWaalsContact CD1-CD1 3.49Å; L363-L412 HydrophobicContact CD2-CD1 4.37Å; L363-L412 HydrophobicContact CG-CD1 3.53Å; F376-L412 HydrophobicContact CE2-CD2 4.29Å; F376-L412 HydrophobicContact CZ-CD1 4.18Å; F376-L412 HydrophobicContact CZ-CD2 3.82Å; F376-L412 HydrophobicContact CZ-CG 4.12Å; F394-L412 HydrophobicContact CE2-CB 3.96Å; F394-L412 HydrophobicContact CE2-CD2 3.75Å; F394-L412 HydrophobicContact CE2-CG 4.32Å; F394-L412 HydrophobicContact CZ-CB 4.13Å; F394-L412 HydrophobicContact CZ-CD2 3.97Å; F394-L412 HydrophobicContact CZ-CG 4.28Å; I410-L412 HydrophobicContact CG2-CD1 4.1Å
413	V	93.7	Very high	84.9	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	126.1	180	-173	0	0	0	0	110	F331 V358 A359 Y395 D396 W398 V411	F331-V413 HydrophobicContact CB-CG2 4.34Å; F331-V413 HydrophobicContact CD1-CG1 3.75Å; F331-V413 HydrophobicContact CD2-CB 4.43Å; F331-V413 HydrophobicContact CD2-CG1 4.37Å; F331-V413 HydrophobicContact CD2-CG2 4.01Å; F331-V413 HydrophobicContact CE1-CG1 3.96Å; F331-V413 HydrophobicContact CG-CB 4.47Å; F331-V413 HydrophobicContact CG-CG1 3.97Å; F331-V413 HydrophobicContact CG-CG2 4.09Å; F331-V413 HydrophobicContact CZ-CG1 4.37Å; V358-V413 HydrophobicContact CB-CG1 3.76Å; V358-V413 HydrophobicContact CG1-CG1 4.21Å; V358-V413 HydrophobicContact CG2-CG1 3.65Å; A359-V413 WeakPolarHBondContact O-CA 3.4Å; Y395-V413 HydrophobicContact CD2-CG1 4.17Å; Y395-V413 PolarHBondContact N-O 2.94Å; D396-V413 PolarHBondContact O-N 2.99Å; W398-V413 HydrophobicContact CH2-CG2 3.45Å; W398-V413 VanDerWaalsContact CH2-CG2 3.45Å; W398-V413 HydrophobicContact CZ3-CG2 3.64Å; V411-V413 HydrophobicContact CG1-CG2 4.3Å
414	T	93.9	Very high	86.1	Confident	25 Å²	25	42.2 Å²	42.2	15%	0.153	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	167.7	-178.6	71.6	0	0	0	0	112.7	V358 A359 R393 F394 L416	V358-T414 WeakPolarHBondContact CB-O 3.41Å; A359-T414 PolarHBondContact N-O 3.13Å; A359-T414 PolarHBondContact O-N 3.01Å; R393-T414 CarbonylContact O-C 3.57Å; R393-T414 VanDerWaalsContact O-CA 3.27Å; R393-T414 WeakPolarHBondContact O-CA 3.49Å; R393-T414 WeakPolarHBondContact O-CB 3.4Å; F394-T414 HydrophobicContact CD2-CG2 3.81Å; F394-T414 HydrophobicContact CE2-CG2 4.28Å; T414-L416 PolarHBondContact O-N 2.78Å
415	E	94.1	Very high	87.3	Confident	43 Å²	43	39.3 Å²	39.3	20%	0.201	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.6	132.8	168.6	178.7	-179.5	-170.6	0	0	111.8	V392 R393 Y395 M417 K478	V392-E415 HydrophobicContact CG1-CB 3.95Å; R393-E415 HydrophobicContact CB-CB 4.11Å; R393-E415 PolarHBondContact N-OE2 3.32Å; R393-E415 PolarHBondContact O-N 2.86Å; Y395-E415 HydrophobicContact CE2-CB 4.33Å; E415-M417 HydrophobicContact CG-SD 4.02Å; E415-M417 PolarHBondContact O-N 2.95Å; E415-K478 WeakPolarHBondContact OE1-CE 3.28Å; E415-K478 IonicContact OE1-NZ 3.9Å; E415-K478 PolarHBondContact OE1-NZ 3.15Å; E415-K478 IonicContact OE2-NZ 3.11Å; E415-K478 PolarHBondContact OE2-NZ 3.11Å
416	L	93.8	Very high	88.4	Confident	34 Å²	34	37.4 Å²	37.4	18%	0.178	18%	0.175	C	C	.	.			trans	-85.1	101	-177.6	-179.8	57.4	0	0	0	111.4	L338 A357 A359 T414 T418	L338-L416 HydrophobicContact CD1-CD1 3.47Å; L338-L416 VanDerWaalsContact CD1-CD1 3.47Å; A357-L416 HydrophobicContact CB-CD2 3.68Å; A357-L416 VanDerWaalsContact O-CB 3.28Å; A357-L416 WeakPolarHBondContact O-CB 3.46Å; A359-L416 HydrophobicContact CB-CD1 4.12Å; T414-L416 PolarHBondContact O-N 2.78Å; L416-T418 HydrophobicContact CD2-CG2 4.19Å; L416-T418 HydrophobicContact CG-CG2 3.88Å; L416-T418 PolarHBondContact O-N 3.35Å
417	M	93	Very high	89.4	Confident	21 Å²	21	37.7 Å²	37.7	10%	0.103	18%	0.176	C	C	.	.			trans	-79.3	100.3	178.6	-61.2	-52.7	-60.1	0	0	111.8	V392 E415 F469 K478	V392-M417 HydrophobicContact CG1-CG 4.25Å; V392-M417 HydrophobicContact CG2-CG 3.88Å; V392-M417 HydrophobicContact CG2-SD 4.22Å; E415-M417 HydrophobicContact CG-SD 4.02Å; E415-M417 PolarHBondContact O-N 2.95Å; M417-F469 HydrophobicContact CB-CB 3.76Å; M417-F469 HydrophobicContact CB-CD1 3.43Å; M417-F469 VanDerWaalsContact CB-CD1 3.43Å; M417-F469 HydrophobicContact CB-CE1 4.2Å; M417-F469 HydrophobicContact CB-CG 3.72Å; M417-F469 HydrophobicContact CE-CB 3.65Å; M417-F469 HydrophobicContact CG-CB 3.61Å; M417-F469 HydrophobicContact CG-CD1 3.89Å; M417-F469 HydrophobicContact CG-CD2 4.25Å; M417-F469 HydrophobicContact CG-CG 3.65Å; M417-F469 HydrophobicContact SD-CB 4.35Å; M417-K478 HydrophobicContact CE-CB 4.23Å; M417-K478 HydrophobicContact CE-CD 3.76Å; M417-K478 HydrophobicContact SD-CD 3.81Å
418	T	89	Confident	89.9	Confident	57 Å²	57	37.3 Å²	37.3	35%	0.35	18%	0.175	S	C	.	.			trans	-93.1	-4.7	-171.9	57.2	0	0	0	0	116	W74 L416	W74-T418 HydrophobicContact CH2-CG2 4.1Å; W74-T418 HydrophobicContact CZ3-CG2 4.39Å; W74-T418 VanDerWaalsContact CZ3-O 3.25Å; W74-T418 WeakPolarHBondContact CZ3-O 3.3Å; L416-T418 HydrophobicContact CD2-CG2 4.19Å; L416-T418 HydrophobicContact CG-CG2 3.88Å; L416-T418 PolarHBondContact O-N 3.35Å
419	S	88.3	Confident	90	Very high	6 Å²	6	33.5 Å²	33.5	4%	0.042	16%	0.158	C	C	.	.	S	Bend	trans	-108.8	14.5	-177.3	-43.5	0	0	0	0	113.4	I470 G472	S419-I470 WeakPolarHBondContact CB-O 3.17Å; S419-G472 VanDerWaalsContact OG-CA 3.31Å; S419-G472 WeakPolarHBondContact OG-CA 2.98Å; S419-G472 PolarHBondContact OG-N 2.94Å
420	G	90.5	Very high	89.5	Confident	5 Å²	5	40.7 Å²	40.7	5%	0.052	19%	0.19	C	C	.	.			trans	78.2	-161.4	175.7	0	0	0	0	0	114.8	F469 I470	G420-F469 WeakPolarHBondContact O-CA 3.24Å; G420-I470 PolarHBondContact O-N 3.41Å
421	T	93.5	Very high	89.2	Confident	17 Å²	17	50.6 Å²	50.6	10%	0.104	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-118.2	161.1	-171	66	0	0	0	0	110.8	K423 M424 Y425 C465 D466 I468 F469	T421-K423 PolarHBondContact O-N 3.12Å; T421-M424 WeakPolarHBondContact O-CB 3.33Å; T421-M424 PolarHBondContact O-N 2.99Å; T421-M424 PolarHBondContact OG1-N 3.48Å; T421-Y425 PolarHBondContact O-N 2.71Å; T421-C465 WeakPolarHBondContact CB-O 3.2Å; T421-D466 WeakPolarHBondContact CG2-O 3.36Å; T421-I468 CarbonylContact C-O 3.53Å; T421-I468 VanDerWaalsContact CA-O 3.31Å; T421-I468 WeakPolarHBondContact CA-O 3.42Å; T421-F469 HydrophobicContact CG2-CD1 3.75Å; T421-F469 HydrophobicContact CG2-CE1 3.73Å; T421-F469 HydrophobicContact CG2-CG 4.48Å; T421-F469 HydrophobicContact CG2-CZ 4.43Å
422	L	93.8	Very high	89	Confident	0 Å²	0	52 Å²	52	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-55.1	-39.9	175.1	-72.6	-179.7	0	0	0	112	M424 Y425 L426 W440 I444 C465 I468 I470 V477 M528	L422-M424 VanDerWaalsContact C-N 3.34Å; L422-M424 PolarHBondContact O-N 2.92Å; L422-Y425 WeakPolarHBondContact O-CB 3.24Å; L422-Y425 PolarHBondContact O-N 2.93Å; L422-L426 WeakPolarHBondContact O-CB 3.36Å; L422-L426 WeakPolarHBondContact O-CG 3.35Å; L422-L426 PolarHBondContact O-N 2.67Å; L422-W440 HydrophobicContact CD2-CD2 3.94Å; L422-W440 HydrophobicContact CD2-CE3 3.29Å; L422-W440 HydrophobicContact CD2-CH2 4.12Å; L422-W440 HydrophobicContact CD2-CZ3 3.39Å; L422-I444 HydrophobicContact CD1-CD1 4.1Å; L422-C465 HydrophobicContact CB-CB 3.81Å; L422-C465 WeakPolarHBondContact CB-O 3.49Å; L422-C465 PolarHBondContact N-O 2.68Å; L422-C465 VanDerWaalsContact N-O 3.13Å; L422-I468 HydrophobicContact CD1-CB 3.78Å; L422-I468 HydrophobicContact CD1-CD1 4.05Å; L422-I468 HydrophobicContact CD1-CG2 3.49Å; L422-I468 VanDerWaalsContact CD1-CG2 3.49Å; L422-I468 HydrophobicContact CG-CB 4.13Å; L422-I468 HydrophobicContact CG-CG2 3.88Å; L422-I468 PolarHBondContact N-O 2.9Å; L422-I470 HydrophobicContact CD2-CD1 4.11Å; L422-I470 HydrophobicContact CD2-CG1 4.06Å; L422-V477 HydrophobicContact CD2-CG1 4.06Å; L422-M528 HydrophobicContact CD1-CE 4.49Å; L422-M528 HydrophobicContact CD1-SD 3.78Å; L422-M528 HydrophobicContact CD2-SD 4.34Å
423	K	92.5	Very high	88.7	Confident	81 Å²	81	54.6 Å²	54.6	35%	0.352	25%	0.248	S	C	.	.	H	α-helix	trans	-60.4	-41.5	175.3	-172.4	-169.2	-168.5	-173.8	0	112	T421 K427 C465 D466	T421-K423 PolarHBondContact O-N 3.12Å; K423-K427 WeakPolarHBondContact O-CB 3.36Å; K423-K427 PolarHBondContact O-N 3.26Å; K423-C465 HydrophobicContact CB-CB 4.03Å; K423-C465 WeakPolarHBondContact CB-O 3.46Å; K423-C465 PolarHBondContact N-O 2.86Å; K423-D466 HydrophobicContact CD-CB 3.88Å; K423-D466 VanDerWaalsContact CD-OD1 3.23Å; K423-D466 WeakPolarHBondContact CD-OD1 3.4Å; K423-D466 WeakPolarHBondContact CD-OD2 3.26Å; K423-D466 IonicContact NZ-OD1 2.84Å; K423-D466 IonicContact NZ-OD2 2.64Å; K423-D466 PolarHBondContact NZ-OD2 3.37Å
424	M	91.9	Very high	88.3	Confident	57 Å²	57	56.3 Å²	56.3	28%	0.281	26%	0.257	S	S	.	.	H	α-helix	trans	-69.5	-37.2	176.8	-162	-179	87.2	0	0	112	V70 W74 T421 L422 R428	V70-M424 HydrophobicContact CG1-CE 3.45Å; V70-M424 VanDerWaalsContact CG1-CE 3.45Å; W74-M424 HydrophobicContact CB-CE 3.96Å; W74-M424 HydrophobicContact CG-CE 4.04Å; T421-M424 WeakPolarHBondContact O-CB 3.33Å; T421-M424 PolarHBondContact O-N 2.99Å; T421-M424 PolarHBondContact OG1-N 3.48Å; L422-M424 VanDerWaalsContact C-N 3.34Å; L422-M424 PolarHBondContact O-N 2.92Å; M424-R428 PolarHBondContact O-N 3.27Å
425	Y	91.8	Very high	87.8	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.008	27%	0.268	C	S	.	.	H	α-helix	trans	-64	-47.9	173.1	-175.1	-82.7	0	0	0	111.5	L67 V70 T421 L422 K427 R428 F429 I432 W440 I470	L67-Y425 HydrophobicContact CD2-CD2 3.96Å; L67-Y425 HydrophobicContact CD2-CE2 3.7Å; L67-Y425 HydrophobicContact CG-CE2 4.23Å; V70-Y425 HydrophobicContact CG2-CD2 4.07Å; T421-Y425 PolarHBondContact O-N 2.71Å; L422-Y425 WeakPolarHBondContact O-CB 3.24Å; L422-Y425 PolarHBondContact O-N 2.93Å; Y425-K427 PolarHBondContact O-N 3.06Å; Y425-R428 PolarHBondContact O-N 2.75Å; Y425-R428 VanDerWaalsContact O-N 3.14Å; Y425-F429 HydrophobicContact CD1-CB 4.34Å; Y425-F429 HydrophobicContact CD1-CD2 4.16Å; Y425-F429 AromaticContact CD2-CD2 3.86Å; Y425-F429 HydrophobicContact CD2-CD2 3.86Å; Y425-F429 HydrophobicContact CD2-CE2 4.24Å; Y425-F429 HydrophobicContact CE1-CB 4.03Å; Y425-F429 AromaticContact CE1-CD2 3.86Å; Y425-F429 HydrophobicContact CE1-CD2 3.86Å; Y425-F429 HydrophobicContact CE1-CG 4.44Å; Y425-F429 AromaticContact CE2-CD2 3.53Å; Y425-F429 HydrophobicContact CE2-CD2 3.53Å; Y425-F429 AromaticContact CE2-CE2 3.85Å; Y425-F429 HydrophobicContact CE2-CE2 3.85Å; Y425-F429 HydrophobicContact CG-CD2 4.16Å; Y425-F429 AromaticContact CZ-CD2 3.54Å; Y425-F429 PolarHBondContact O-N 3.29Å; Y425-I432 HydrophobicContact CD1-CG1 4.45Å; Y425-I432 HydrophobicContact CE1-CG1 4.1Å; Y425-W440 AromaticContact CD1-CH2 3.88Å; Y425-W440 HydrophobicContact CD1-CH2 3.88Å; Y425-W440 AromaticContact CD1-CZ3 3.97Å; Y425-W440 HydrophobicContact CD1-CZ3 3.97Å; Y425-W440 AromaticContact CD2-CH2 3.94Å; Y425-W440 HydrophobicContact CD2-CH2 3.94Å; Y425-W440 AromaticContact CE1-CH2 3.8Å; Y425-W440 HydrophobicContact CE1-CH2 3.8Å; Y425-W440 HydrophobicContact CE1-CZ3 4.03Å; Y425-W440 AromaticContact CE2-CH2 3.87Å; Y425-W440 HydrophobicContact CE2-CH2 3.87Å; Y425-W440 AromaticContact CG-CH2 3.95Å; Y425-W440 HydrophobicContact CG-CH2 3.95Å; Y425-W440 HydrophobicContact CG-CZ3 4.36Å; Y425-W440 AromaticContact CZ-CH2 3.8Å; Y425-I470 HydrophobicContact CD2-CD1 3.79Å; Y425-I470 HydrophobicContact CG-CD1 3.86Å
426	L	91.3	Very high	87.5	Confident	12 Å²	12	57.7 Å²	57.7	6%	0.063	26%	0.261	C	S	.	.	H	α-helix	trans	-60.7	-44	177.8	-78.3	167.2	0	0	0	112.7	L422 R428 F429 I432 E527 M528	L422-L426 WeakPolarHBondContact O-CB 3.36Å; L422-L426 WeakPolarHBondContact O-CG 3.35Å; L422-L426 PolarHBondContact O-N 2.67Å; L426-R428 PolarHBondContact O-N 3.47Å; L426-F429 CarbonylContact O-C 3.6Å; L426-F429 VanDerWaalsContact O-C 3.28Å; L426-F429 PolarHBondContact O-N 2.77Å; L426-I432 HydrophobicContact CD2-CD1 3.71Å; L426-I432 HydrophobicContact CD2-CG1 3.89Å; L426-I432 HydrophobicContact CG-CD1 4.29Å; L426-E527 HydrophobicContact CD1-CG 4.04Å; L426-M528 HydrophobicContact CD1-CG 4.08Å
427	K	89.1	Confident	87.4	Confident	187 Å²	187	56.5 Å²	56.5	81%	0.813	26%	0.255	S	S	*	.	H	α-helix	trans	-55.7	-33	175.3	-174.7	-177.5	176.8	-171.5	0	112.6	K423 Y425	K423-K427 WeakPolarHBondContact O-CB 3.36Å; K423-K427 PolarHBondContact O-N 3.26Å; Y425-K427 PolarHBondContact O-N 3.06Å
428	R	83.4	Confident	87.3	Confident	93 Å²	93	56.2 Å²	56.2	35%	0.351	25%	0.253	S	S	.	.	H	α-helix	trans	-85.6	-44	176.1	-170.7	-171.8	-164.2	79.8	0.6	112.4	A69 V70 D73 M424 Y425 L426	A69-R428 PolarHBondContact O-NH2 2.88Å; A69-R428 VanDerWaalsContact O-NH2 3.08Å; V70-R428 VanDerWaalsContact CG2-CD 3.43Å; D73-R428 IonicContact OD2-CZ 2.71Å; D73-R428 IonicContact OD2-NH1 3.71Å; D73-R428 PolarHBondContact OD2-NH1 2.71Å; M424-R428 PolarHBondContact O-N 3.27Å; Y425-R428 PolarHBondContact O-N 2.75Å; Y425-R428 VanDerWaalsContact O-N 3.14Å; L426-R428 PolarHBondContact O-N 3.47Å
429	F	79.7	Confident	87.3	Confident	26 Å²	26	54.5 Å²	54.5	11%	0.114	24%	0.243	C	C	.	.			trans	-120	89.5	-172.1	-58.8	-48.5	0	0	0	110.5	R66 V70 Y425 L426 R431	R66-F429 HydrophobicContact CB-CD2 4.3Å; R66-F429 HydrophobicContact CB-CE1 4.22Å; R66-F429 HydrophobicContact CB-CE2 3.49Å; R66-F429 VanDerWaalsContact CB-CE2 3.49Å; R66-F429 HydrophobicContact CB-CZ 3.45Å; R66-F429 VanDerWaalsContact CB-CZ 3.45Å; R66-F429 HydrophobicContact CG-CD1 4.3Å; R66-F429 HydrophobicContact CG-CD2 4.47Å; R66-F429 HydrophobicContact CG-CE1 3.75Å; R66-F429 HydrophobicContact CG-CE2 3.9Å; R66-F429 HydrophobicContact CG-CZ 3.51Å; R66-F429 VanDerWaalsContact O-CE2 3.24Å; R66-F429 WeakPolarHBondContact O-CE2 3.47Å; R66-F429 VanDerWaalsContact O-CZ 3.23Å; R66-F429 WeakPolarHBondContact O-CZ 3.17Å; V70-F429 HydrophobicContact CG2-CD2 4.19Å; V70-F429 HydrophobicContact CG2-CE2 3.48Å; V70-F429 VanDerWaalsContact CG2-CE2 3.48Å; V70-F429 HydrophobicContact CG2-CZ 4.2Å; Y425-F429 HydrophobicContact CD1-CB 4.34Å; Y425-F429 HydrophobicContact CD1-CD2 4.16Å; Y425-F429 AromaticContact CD2-CD2 3.86Å; Y425-F429 HydrophobicContact CD2-CD2 3.86Å; Y425-F429 HydrophobicContact CD2-CE2 4.24Å; Y425-F429 HydrophobicContact CE1-CB 4.03Å; Y425-F429 AromaticContact CE1-CD2 3.86Å; Y425-F429 HydrophobicContact CE1-CD2 3.86Å; Y425-F429 HydrophobicContact CE1-CG 4.44Å; Y425-F429 AromaticContact CE2-CD2 3.53Å; Y425-F429 HydrophobicContact CE2-CD2 3.53Å; Y425-F429 AromaticContact CE2-CE2 3.85Å; Y425-F429 HydrophobicContact CE2-CE2 3.85Å; Y425-F429 HydrophobicContact CG-CD2 4.16Å; Y425-F429 AromaticContact CZ-CD2 3.54Å; Y425-F429 PolarHBondContact O-N 3.29Å; L426-F429 CarbonylContact O-C 3.6Å; L426-F429 VanDerWaalsContact O-C 3.28Å; L426-F429 PolarHBondContact O-N 2.77Å; F429-R431 PolarHBondContact O-N 3.31Å
430	K	72.9	Confident	87.6	Confident	179 Å²	179	54.3 Å²	54.3	78%	0.778	24%	0.242	S	C	*	.	S	Bend	trans	-54.7	-3.4	178.5	-56.1	-176.8	179.4	-177.7	0	116.1
431	R	77.1	Confident	87.9	Confident	209 Å²	209	54.1 Å²	54.1	79%	0.789	24%	0.24	S	C	*	.			trans	-146.6	121.5	176.9	-66.2	-171.1	178.9	-179	-0.4	110.4	R66 F429	R66-R431 PolarHBondContact NH1-O 2.87Å; R66-R431 PolarHBondContact NH2-O 2.95Å; F429-R431 PolarHBondContact O-N 3.31Å
432	I	85.4	Confident	87.9	Confident	28 Å²	28	55 Å²	55	14%	0.144	24%	0.241	C	C	.	.			trans	-88.5	147.1	168.7	-49.8	-175	0	0	0	108.5	Y425 L426 V436 L437 W440 M528	Y425-I432 HydrophobicContact CD1-CG1 4.45Å; Y425-I432 HydrophobicContact CE1-CG1 4.1Å; L426-I432 HydrophobicContact CD2-CD1 3.71Å; L426-I432 HydrophobicContact CD2-CG1 3.89Å; L426-I432 HydrophobicContact CG-CD1 4.29Å; I432-V436 HydrophobicContact CG2-CB 4.03Å; I432-V436 HydrophobicContact CG2-CG1 3.9Å; I432-L437 HydrophobicContact CG2-CB 4.23Å; I432-W440 HydrophobicContact CD1-CE3 4.25Å; I432-W440 HydrophobicContact CD1-CZ3 3.93Å; I432-W440 HydrophobicContact CG2-CE3 4.46Å; I432-W440 HydrophobicContact CG2-CZ3 4.29Å; I432-M528 HydrophobicContact CD1-CB 3.91Å; I432-M528 HydrophobicContact CD1-CG 3.85Å; I432-M528 HydrophobicContact CD1-SD 4.25Å
433	N	83.6	Confident	88	Confident	64 Å²	64	56.1 Å²	56.1	34%	0.342	25%	0.246	S	C	.	.			trans	-72.4	140.1	169.6	-179.8	-2.5	0	0	0	110.2	E63 K435 V436 L437	E63-N433 WeakPolarHBondContact OE1-CB 3.23Å; E63-N433 VanDerWaalsContact OE1-CG 3.3Å; E63-N433 PolarHBondContact OE1-ND2 3.44Å; N433-K435 VanDerWaalsContact C-N 3.26Å; N433-K435 PolarHBondContact O-N 3.44Å; N433-K435 PolarHBondContact OD1-N 2.88Å; N433-V436 HydrophobicContact CB-CB 4.38Å; N433-V436 HydrophobicContact CB-CG2 4.27Å; N433-V436 PolarHBondContact O-N 3.44Å; N433-V436 VanDerWaalsContact O-N 3.08Å; N433-L437 PolarHBondContact O-N 3.39Å
434	I	86.2	Confident	88.2	Confident	37 Å²	37	52.3 Å²	52.3	19%	0.19	23%	0.23	C	C	.	.	H	α-helix	trans	-54.1	-38.3	178.2	-172.4	57.6	0	0	0	113.1	L437 K438 Y564 I567 F593	I434-L437 HydrophobicContact CD1-CD2 4.12Å; I434-L437 PolarHBondContact O-N 2.79Å; I434-K438 HydrophobicContact CD1-CG 4.47Å; I434-K438 WeakPolarHBondContact O-CB 3.29Å; I434-K438 WeakPolarHBondContact O-CG 3.49Å; I434-K438 PolarHBondContact O-N 2.85Å; I434-Y564 HydrophobicContact CD1-CD1 4.48Å; I434-Y564 HydrophobicContact CD1-CE1 4.35Å; I434-Y564 HydrophobicContact CG1-CE1 4.14Å; I434-I567 HydrophobicContact CD1-CD1 3.81Å; I434-F593 HydrophobicContact CD1-CE2 3.82Å; I434-F593 HydrophobicContact CD1-CZ 3.67Å
435	K	83.5	Confident	88.5	Confident	88 Å²	88	49.6 Å²	49.6	38%	0.383	22%	0.217	S	C	.	.	H	α-helix	trans	-65.2	-42.7	176.3	-75.6	-157.9	162.5	-156.5	0	112.8	N433 S439 E597 D598	N433-K435 VanDerWaalsContact C-N 3.26Å; N433-K435 PolarHBondContact O-N 3.44Å; N433-K435 PolarHBondContact OD1-N 2.88Å; K435-S439 WeakPolarHBondContact O-CB 3.25Å; K435-S439 PolarHBondContact O-N 3.21Å; K435-E597 VanDerWaalsContact CE-OE2 3.25Å; K435-E597 WeakPolarHBondContact CE-OE2 3.33Å; K435-E597 IonicContact NZ-OE2 3.99Å; K435-D598 IonicContact NZ-OD1 3.8Å; K435-D598 PolarHBondContact NZ-OD1 3.3Å; K435-D598 IonicContact NZ-OD2 2.75Å; K435-D598 PolarHBondContact NZ-OD2 3.12Å
436	V	87.7	Confident	88.7	Confident	8 Å²	8	54.6 Å²	54.6	5%	0.048	24%	0.238	C	C	.	.	H	α-helix	trans	-66.9	-43	175.7	174.5	0	0	0	0	110.7	L59 E63 I432 N433 S439 W440	L59-V436 HydrophobicContact CD2-CG2 4.33Å; E63-V436 WeakPolarHBondContact OE1-CG2 3.34Å; I432-V436 HydrophobicContact CG2-CB 4.03Å; I432-V436 HydrophobicContact CG2-CG1 3.9Å; N433-V436 HydrophobicContact CB-CB 4.38Å; N433-V436 HydrophobicContact CB-CG2 4.27Å; N433-V436 PolarHBondContact O-N 3.44Å; N433-V436 VanDerWaalsContact O-N 3.08Å; V436-S439 PolarHBondContact O-N 3.46Å; V436-W440 HydrophobicContact CG1-CD2 3.61Å; V436-W440 VanDerWaalsContact CG1-CE2 3.42Å; V436-W440 HydrophobicContact CG1-CE3 3.9Å; V436-W440 HydrophobicContact CG1-CG 4.24Å; V436-W440 HydrophobicContact CG1-CH2 3.92Å; V436-W440 HydrophobicContact CG1-CZ2 3.6Å; V436-W440 HydrophobicContact CG1-CZ3 4.05Å; V436-W440 PolarHBondContact O-N 3.4Å
437	L	91.5	Very high	88.9	Confident	9 Å²	9	54 Å²	54	5%	0.047	24%	0.235	C	C	.	.	H	α-helix	trans	-56.6	-53.7	175.9	-178.4	70.8	0	0	0	111.4	I432 N433 I434 S439 W440 C441 L525 M528 V529 I567	I432-L437 HydrophobicContact CG2-CB 4.23Å; N433-L437 PolarHBondContact O-N 3.39Å; I434-L437 HydrophobicContact CD1-CD2 4.12Å; I434-L437 PolarHBondContact O-N 2.79Å; L437-S439 VanDerWaalsContact C-N 3.28Å; L437-S439 PolarHBondContact O-N 3.01Å; L437-W440 PolarHBondContact O-N 3.32Å; L437-C441 WeakPolarHBondContact O-CB 3.37Å; L437-C441 PolarHBondContact O-N 2.89Å; L437-C441 PolarHBondContact O-SG 2.91Å; L437-L525 HydrophobicContact CD1-CD1 4.13Å; L437-L525 HydrophobicContact CD2-CD1 4.29Å; L437-L525 HydrophobicContact CG-CD1 4.35Å; L437-M528 HydrophobicContact CD1-CB 3.57Å; L437-M528 HydrophobicContact CD1-CE 4.16Å; L437-M528 HydrophobicContact CD1-CG 4.36Å; L437-M528 HydrophobicContact CD1-SD 3.97Å; L437-V529 HydrophobicContact CD1-CG2 4.4Å; L437-V529 HydrophobicContact CD2-CG2 3.61Å; L437-I567 HydrophobicContact CD2-CD1 4.08Å
438	K	90.2	Very high	89.3	Confident	15 Å²	15	45.1 Å²	45.1	7%	0.065	20%	0.196	C	C	.	.	H	α-helix	trans	-55	-44.1	175.8	-76.3	-177.5	171	-165.7	0	111.8	I434 R442 F593 E597	I434-K438 HydrophobicContact CD1-CG 4.47Å; I434-K438 WeakPolarHBondContact O-CB 3.29Å; I434-K438 WeakPolarHBondContact O-CG 3.49Å; I434-K438 PolarHBondContact O-N 2.85Å; K438-R442 VanDerWaalsContact O-CB 3.26Å; K438-R442 WeakPolarHBondContact O-CB 3.16Å; K438-R442 PolarHBondContact O-N 2.89Å; K438-F593 HydrophobicContact CD-CE2 4.27Å; K438-F593 HydrophobicContact CD-CZ 4.3Å; K438-F593 WeakPolarHBondContact CD-O 3.28Å; K438-F593 WeakPolarHBondContact CE-O 3.25Å; K438-F593 HydrophobicContact CG-CD1 4.25Å; K438-F593 HydrophobicContact CG-CE1 3.72Å; K438-F593 HydrophobicContact CG-CE2 4.09Å; K438-F593 HydrophobicContact CG-CZ 3.62Å; K438-F593 WeakPolarHBondContact CG-O 3.43Å; K438-E597 IonicContact NZ-OE1 2.76Å; K438-E597 PolarHBondContact NZ-OE1 2.85Å
439	S	89.8	Confident	89.9	Confident	21 Å²	21	42 Å²	42	15%	0.147	19%	0.189	C	C	.	.	H	α-helix	trans	-65.2	-45.5	179.7	-166.5	0	0	0	0	113	K435 V436 L437 Q443	K435-S439 WeakPolarHBondContact O-CB 3.25Å; K435-S439 PolarHBondContact O-N 3.21Å; V436-S439 PolarHBondContact O-N 3.46Å; L437-S439 VanDerWaalsContact C-N 3.28Å; L437-S439 PolarHBondContact O-N 3.01Å; S439-Q443 WeakPolarHBondContact O-CB 3.45Å; S439-Q443 WeakPolarHBondContact O-CG 3.2Å; S439-Q443 PolarHBondContact O-N 3.12Å; S439-Q443 VanDerWaalsContact O-N 3.09Å; S439-Q443 PolarHBondContact O-NE2 2.92Å; S439-Q443 VanDerWaalsContact O-NE2 3.11Å; S439-Q443 PolarHBondContact OG-NE2 3.37Å; S439-Q443 VanDerWaalsContact OG-NE2 3.15Å
440	W	94.4	Very high	90.6	Very high	3 Å²	3	42.1 Å²	42.1	1%	0.011	19%	0.19	C	C	.	.	H	α-helix	trans	-67.4	-42.4	178.4	-71.1	-9.1	0	0	0	112.2	L422 Y425 I432 V436 L437 Q443 I444 I470 G475 V477 M528	L422-W440 HydrophobicContact CD2-CD2 3.94Å; L422-W440 HydrophobicContact CD2-CE3 3.29Å; L422-W440 HydrophobicContact CD2-CH2 4.12Å; L422-W440 HydrophobicContact CD2-CZ3 3.39Å; Y425-W440 AromaticContact CD1-CH2 3.88Å; Y425-W440 HydrophobicContact CD1-CH2 3.88Å; Y425-W440 AromaticContact CD1-CZ3 3.97Å; Y425-W440 HydrophobicContact CD1-CZ3 3.97Å; Y425-W440 AromaticContact CD2-CH2 3.94Å; Y425-W440 HydrophobicContact CD2-CH2 3.94Å; Y425-W440 AromaticContact CE1-CH2 3.8Å; Y425-W440 HydrophobicContact CE1-CH2 3.8Å; Y425-W440 HydrophobicContact CE1-CZ3 4.03Å; Y425-W440 AromaticContact CE2-CH2 3.87Å; Y425-W440 HydrophobicContact CE2-CH2 3.87Å; Y425-W440 AromaticContact CG-CH2 3.95Å; Y425-W440 HydrophobicContact CG-CH2 3.95Å; Y425-W440 HydrophobicContact CG-CZ3 4.36Å; Y425-W440 AromaticContact CZ-CH2 3.8Å; I432-W440 HydrophobicContact CD1-CE3 4.25Å; I432-W440 HydrophobicContact CD1-CZ3 3.93Å; I432-W440 HydrophobicContact CG2-CE3 4.46Å; I432-W440 HydrophobicContact CG2-CZ3 4.29Å; V436-W440 HydrophobicContact CG1-CD2 3.61Å; V436-W440 VanDerWaalsContact CG1-CE2 3.42Å; V436-W440 HydrophobicContact CG1-CE3 3.9Å; V436-W440 HydrophobicContact CG1-CG 4.24Å; V436-W440 HydrophobicContact CG1-CH2 3.92Å; V436-W440 HydrophobicContact CG1-CZ2 3.6Å; V436-W440 HydrophobicContact CG1-CZ3 4.05Å; V436-W440 PolarHBondContact O-N 3.4Å; L437-W440 PolarHBondContact O-N 3.32Å; W440-Q443 WeakPolarHBondContact O-CB 3.3Å; W440-Q443 PolarHBondContact O-N 3.3Å; W440-Q443 VanDerWaalsContact O-N 3.16Å; W440-I444 WeakPolarHBondContact O-CD1 3.37Å; W440-I444 VanDerWaalsContact O-CG1 3.3Å; W440-I444 WeakPolarHBondContact O-CG1 3.4Å; W440-I444 PolarHBondContact O-N 3.26Å; W440-I470 HydrophobicContact CH2-CD1 3.81Å; W440-I470 HydrophobicContact CZ2-CD1 4.15Å; W440-I470 HydrophobicContact CZ2-CG2 4.33Å; W440-I470 HydrophobicContact CZ3-CD1 4.46Å; W440-G475 PolarHBondContact NE1-O 3.33Å; W440-V477 HydrophobicContact CB-CG1 4.24Å; W440-V477 HydrophobicContact CB-CG2 4.09Å; W440-V477 HydrophobicContact CD2-CG1 3.94Å; W440-V477 HydrophobicContact CG-CG1 3.7Å; W440-V477 HydrophobicContact CG-CG2 4.27Å; W440-M528 HydrophobicContact CE3-SD 4.39Å
441	C	96	Very high	91.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-63.5	-46.3	177.9	-64.4	0	0	0	0	112	L437 Q443 I444 L445 F521 M528 F594	L437-C441 WeakPolarHBondContact O-CB 3.37Å; L437-C441 PolarHBondContact O-N 2.89Å; L437-C441 PolarHBondContact O-SG 2.91Å; C441-Q443 PolarHBondContact O-N 3.33Å; C441-I444 PolarHBondContact O-N 3.05Å; C441-L445 WeakPolarHBondContact O-CG 3.45Å; C441-L445 PolarHBondContact O-N 3.07Å; C441-F521 HydrophobicContact CB-CE2 4.03Å; C441-F521 HydrophobicContact CB-CZ 4.05Å; C441-M528 WeakPolarHBondContact SG-CE 3.46Å; C441-F594 HydrophobicContact CB-CD1 3.86Å; C441-F594 HydrophobicContact CB-CE1 3.24Å; C441-F594 HydrophobicContact CB-CZ 4.05Å
442	R	93.9	Very high	92.3	Very high	35 Å²	35	25 Å²	25	13%	0.132	12%	0.121	C	C	.	.	H	α-helix	trans	-56.9	-36.6	172.5	172.8	171.9	53.4	-120.6	2.2	112.5	K438 K446 F594	K438-R442 VanDerWaalsContact O-CB 3.26Å; K438-R442 WeakPolarHBondContact O-CB 3.16Å; K438-R442 PolarHBondContact O-N 2.89Å; R442-K446 WeakPolarHBondContact O-CG 3.25Å; R442-K446 PolarHBondContact O-N 2.97Å; R442-F594 WeakPolarHBondContact CD-O 3.17Å; R442-F594 PolarHBondContact NH1-O 3.33Å
443	Q	95.3	Very high	92.5	Very high	25 Å²	25	26.5 Å²	26.5	12%	0.117	13%	0.132	C	C	.	.	H	α-helix	trans	-71.4	-40.8	176.6	-78	174.6	68.9	0	0	112.8	N390 S439 W440 C441 K446 G447 V477	N390-Q443 VanDerWaalsContact CB-O 3.28Å; N390-Q443 WeakPolarHBondContact CB-O 3.25Å; N390-Q443 WeakPolarHBondContact ND2-CB 3.22Å; N390-Q443 WeakPolarHBondContact ND2-CG 3.48Å; N390-Q443 PolarHBondContact ND2-OE1 3.47Å; N390-Q443 VanDerWaalsContact ND2-OE1 3.1Å; S439-Q443 WeakPolarHBondContact O-CB 3.45Å; S439-Q443 WeakPolarHBondContact O-CG 3.2Å; S439-Q443 PolarHBondContact O-N 3.12Å; S439-Q443 VanDerWaalsContact O-N 3.09Å; S439-Q443 PolarHBondContact O-NE2 2.92Å; S439-Q443 VanDerWaalsContact O-NE2 3.11Å; S439-Q443 PolarHBondContact OG-NE2 3.37Å; S439-Q443 VanDerWaalsContact OG-NE2 3.15Å; W440-Q443 WeakPolarHBondContact O-CB 3.3Å; W440-Q443 PolarHBondContact O-N 3.3Å; W440-Q443 VanDerWaalsContact O-N 3.16Å; C441-Q443 PolarHBondContact O-N 3.33Å; Q443-K446 PolarHBondContact O-N 3Å; Q443-G447 PolarHBondContact O-N 2.73Å; Q443-V477 HydrophobicContact CB-CG2 3.52Å; Q443-V477 HydrophobicContact CG-CG2 4.47Å
444	I	97.5	Very high	92.7	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-62.6	-47.5	173.5	-63.6	155.4	0	0	0	109.9	L422 W440 C441 K446 G447 L448 L463 I468 V477 I479 F521 M528	L422-I444 HydrophobicContact CD1-CD1 4.1Å; W440-I444 WeakPolarHBondContact O-CD1 3.37Å; W440-I444 VanDerWaalsContact O-CG1 3.3Å; W440-I444 WeakPolarHBondContact O-CG1 3.4Å; W440-I444 PolarHBondContact O-N 3.26Å; C441-I444 PolarHBondContact O-N 3.05Å; I444-K446 VanDerWaalsContact C-N 3.32Å; I444-K446 PolarHBondContact O-N 3.03Å; I444-G447 CarbonylContact O-C 3.45Å; I444-G447 WeakPolarHBondContact O-CA 3.46Å; I444-G447 PolarHBondContact O-N 2.71Å; I444-L448 HydrophobicContact CG2-CD1 4.39Å; I444-L448 HydrophobicContact CG2-CG 4.47Å; I444-L448 PolarHBondContact O-N 2.74Å; I444-L463 HydrophobicContact CG2-CD2 4.45Å; I444-I468 HydrophobicContact CD1-CD1 3.93Å; I444-I468 HydrophobicContact CD1-CG2 4.28Å; I444-I468 HydrophobicContact CG1-CD1 4.2Å; I444-I468 HydrophobicContact CG1-CG2 4.1Å; I444-I468 HydrophobicContact CG2-CD1 4.44Å; I444-V477 HydrophobicContact CG1-CG2 4.1Å; I444-I479 HydrophobicContact CG2-CD1 4.04Å; I444-F521 HydrophobicContact CB-CD2 4.34Å; I444-F521 HydrophobicContact CB-CE2 4.38Å; I444-F521 HydrophobicContact CG2-CD2 3.81Å; I444-F521 HydrophobicContact CG2-CE2 4.33Å; I444-M528 HydrophobicContact CD1-CE 4.25Å
445	L	97.5	Very high	92.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.8	-37.8	177.3	-70.4	169.4	0	0	0	112.6	C441 L448 S449 F521 V585 L588 L589 F594	C441-L445 WeakPolarHBondContact O-CG 3.45Å; C441-L445 PolarHBondContact O-N 3.07Å; L445-L448 PolarHBondContact O-N 2.56Å; L445-S449 VanDerWaalsContact O-CB 3.24Å; L445-S449 WeakPolarHBondContact O-CB 3.39Å; L445-S449 PolarHBondContact O-N 3.45Å; L445-F521 HydrophobicContact CD1-CE1 4.19Å; L445-F521 HydrophobicContact CD1-CE2 4.24Å; L445-F521 HydrophobicContact CD1-CZ 3.7Å; L445-F521 HydrophobicContact CD2-CD1 3.97Å; L445-F521 HydrophobicContact CD2-CD2 4.16Å; L445-F521 HydrophobicContact CD2-CE1 3.81Å; L445-F521 HydrophobicContact CD2-CE2 3.99Å; L445-F521 HydrophobicContact CD2-CG 4.15Å; L445-F521 HydrophobicContact CD2-CZ 3.82Å; L445-F521 HydrophobicContact CG-CD2 4.3Å; L445-F521 HydrophobicContact CG-CE1 4.16Å; L445-F521 HydrophobicContact CG-CE2 3.73Å; L445-F521 HydrophobicContact CG-CZ 3.65Å; L445-V585 HydrophobicContact CB-CG1 4.34Å; L445-V585 HydrophobicContact CD2-CG1 4.06Å; L445-V585 VanDerWaalsContact O-CG1 3.24Å; L445-V585 WeakPolarHBondContact O-CG1 3.41Å; L445-L588 HydrophobicContact CD1-CB 3.87Å; L445-L588 HydrophobicContact CD2-CB 3.83Å; L445-L588 HydrophobicContact CD2-CD1 3.86Å; L445-L589 HydrophobicContact CB-CD2 3.57Å; L445-L589 HydrophobicContact CB-CG 3.91Å; L445-F594 HydrophobicContact CD1-CD2 3.94Å; L445-F594 HydrophobicContact CD1-CE2 3.98Å; L445-F594 HydrophobicContact CD1-CG 4.23Å; L445-F594 HydrophobicContact CD1-CZ 4.34Å
446	K	96.4	Very high	92.3	Very high	106 Å²	106	33 Å²	33	46%	0.461	17%	0.169	S	C	.	.	H	α-helix	trans	-63.7	-41.8	170.8	-77.7	-177.4	177.2	-167.7	0	112.2	R442 Q443 I444 S449 F450 L589	R442-K446 WeakPolarHBondContact O-CG 3.25Å; R442-K446 PolarHBondContact O-N 2.97Å; Q443-K446 PolarHBondContact O-N 3Å; I444-K446 VanDerWaalsContact C-N 3.32Å; I444-K446 PolarHBondContact O-N 3.03Å; K446-S449 PolarHBondContact O-N 2.77Å; K446-F450 PolarHBondContact O-N 3.13Å; K446-L589 HydrophobicContact CG-CD2 3.97Å
447	G	96.3	Very high	92.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-58.5	-50.1	173.7	0	0	0	0	0	112.5	Q443 I444 F450 L451	Q443-G447 PolarHBondContact O-N 2.73Å; I444-G447 CarbonylContact O-C 3.45Å; I444-G447 WeakPolarHBondContact O-CA 3.46Å; I444-G447 PolarHBondContact O-N 2.71Å; G447-F450 WeakPolarHBondContact O-CB 3.44Å; G447-F450 PolarHBondContact O-N 3.46Å; G447-L451 WeakPolarHBondContact O-CG 3.46Å; G447-L451 PolarHBondContact O-N 2.92Å; G447-L451 VanDerWaalsContact O-N 3.17Å
448	L	96.5	Very high	91.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.5	-47.1	176	-66.3	-179.2	0	0	0	111.9	I444 L445 F450 L451 H452 L463 I479 D517 F521 V585	I444-L448 HydrophobicContact CG2-CD1 4.39Å; I444-L448 HydrophobicContact CG2-CG 4.47Å; I444-L448 PolarHBondContact O-N 2.74Å; L445-L448 PolarHBondContact O-N 2.56Å; L448-F450 VanDerWaalsContact C-N 3.25Å; L448-F450 PolarHBondContact O-N 3.42Å; L448-L451 PolarHBondContact O-N 3.16Å; L448-H452 WeakPolarHBondContact O-CB 3.35Å; L448-H452 PolarHBondContact O-N 3.25Å; L448-H452 PolarHBondContact O-ND1 2.88Å; L448-L463 HydrophobicContact CD1-CD2 3.89Å; L448-L463 HydrophobicContact CD2-CD2 4.15Å; L448-L463 HydrophobicContact CG-CD2 4.47Å; L448-I479 HydrophobicContact CD2-CD1 4.03Å; L448-I479 HydrophobicContact CG-CD1 4.12Å; L448-D517 HydrophobicContact CD1-CB 4.21Å; L448-D517 HydrophobicContact CD2-CB 3.94Å; L448-F521 HydrophobicContact CD1-CB 4.25Å; L448-V585 HydrophobicContact CB-CG1 4.17Å; L448-V585 HydrophobicContact CB-CG2 4.19Å; L448-V585 HydrophobicContact CD1-CG2 4.48Å
449	S	95.8	Very high	91.7	Very high	28 Å²	28	36.8 Å²	36.8	20%	0.196	19%	0.194	C	C	.	.	H	α-helix	trans	-58	-37	177.6	-171	0	0	0	0	112.5	L445 K446 T453	L445-S449 VanDerWaalsContact O-CB 3.24Å; L445-S449 WeakPolarHBondContact O-CB 3.39Å; L445-S449 PolarHBondContact O-N 3.45Å; K446-S449 PolarHBondContact O-N 2.77Å; S449-T453 WeakPolarHBondContact O-CB 3.42Å; S449-T453 WeakPolarHBondContact O-CG2 3.28Å; S449-T453 PolarHBondContact O-N 2.78Å; S449-T453 VanDerWaalsContact O-N 3.15Å; S449-T453 PolarHBondContact O-OG1 3Å
450	F	95.2	Very high	91.6	Very high	29 Å²	29	35.8 Å²	35.8	13%	0.127	19%	0.187	C	C	.	.	H	α-helix	trans	-63.5	-45.6	172.4	171.1	-96.3	0	0	0	112.2	L386 H388 I391 K446 G447 L448 T453 R454	L386-F450 HydrophobicContact CB-CE1 4.13Å; L386-F450 HydrophobicContact CD2-CE1 3.96Å; L386-F450 HydrophobicContact CD2-CZ 4.29Å; H388-F450 HydrophobicContact CB-CB 4.35Å; H388-F450 HydrophobicContact CB-CD1 3.59Å; H388-F450 HydrophobicContact CB-CD2 3.88Å; H388-F450 HydrophobicContact CB-CE1 3.74Å; H388-F450 HydrophobicContact CB-CE2 4.02Å; H388-F450 HydrophobicContact CB-CG 3.66Å; H388-F450 HydrophobicContact CB-CZ 3.95Å; H388-F450 AromaticContact CD2-CD2 3.84Å; H388-F450 AromaticContact CD2-CG 3.8Å; H388-F450 AromaticContact CG-CG 3.7Å; I391-F450 HydrophobicContact CG1-CD1 4.06Å; I391-F450 HydrophobicContact CG1-CE1 4.47Å; K446-F450 PolarHBondContact O-N 3.13Å; G447-F450 WeakPolarHBondContact O-CB 3.44Å; G447-F450 PolarHBondContact O-N 3.46Å; L448-F450 VanDerWaalsContact C-N 3.25Å; L448-F450 PolarHBondContact O-N 3.42Å; F450-T453 PolarHBondContact O-N 3.15Å; F450-T453 PolarHBondContact O-OG1 3.17Å; F450-T453 VanDerWaalsContact O-OG1 3.12Å; F450-R454 PolarHBondContact O-NE 3.45Å; F450-R454 PolarHBondContact O-NH2 2.84Å
451	L	92.6	Very high	91.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-67	-46.2	179.5	-62.8	170.6	0	0	0	112.2	L386 I391 G447 L448 T453 R454 V458 L482	L386-L451 HydrophobicContact CD1-CD2 3.76Å; I391-L451 HydrophobicContact CD1-CD1 3.79Å; I391-L451 HydrophobicContact CD1-CD2 4.11Å; I391-L451 HydrophobicContact CD1-CG 3.9Å; G447-L451 WeakPolarHBondContact O-CG 3.46Å; G447-L451 PolarHBondContact O-N 2.92Å; G447-L451 VanDerWaalsContact O-N 3.17Å; L448-L451 PolarHBondContact O-N 3.16Å; L451-T453 PolarHBondContact O-N 2.83Å; L451-R454 WeakPolarHBondContact O-CB 3.42Å; L451-R454 WeakPolarHBondContact O-CG 3.49Å; L451-R454 PolarHBondContact O-N 3.25Å; L451-R454 VanDerWaalsContact O-N 3.15Å; L451-V458 CarbonylContact C-O 3.52Å; L451-V458 HydrophobicContact CB-CB 4.14Å; L451-V458 HydrophobicContact CB-CG1 4.45Å; L451-V458 VanDerWaalsContact CB-O 3.31Å; L451-V458 WeakPolarHBondContact CB-O 3.43Å; L451-V458 HydrophobicContact CD2-CB 4.3Å; L451-V458 HydrophobicContact CD2-CG1 4.04Å; L451-V458 PolarHBondContact O-N 3.11Å; L451-L482 HydrophobicContact CD1-CD2 3.81Å; L451-L482 HydrophobicContact CD2-CD1 3.94Å; L451-L482 HydrophobicContact CD2-CD2 4.23Å
452	H	92.2	Very high	90.6	Very high	27 Å²	27	39.2 Å²	39.2	13%	0.125	20%	0.201	C	C	.	.	H	α-helix	trans	-68.4	-12	178	-60.5	163	0	0	0	113.7	L448 V458 E514 D517	L448-H452 WeakPolarHBondContact O-CB 3.35Å; L448-H452 PolarHBondContact O-N 3.25Å; L448-H452 PolarHBondContact O-ND1 2.88Å; H452-V458 PolarHBondContact CD2-O 3.05Å; H452-E514 HydrophobicContact CB-CG 3.89Å; H452-D517 IonicContact CD2-OD2 3.34Å; H452-D517 IonicContact CE1-OD2 2.8Å; H452-D517 IonicContact NE2-OD2 3.63Å; H452-D517 PolarHBondContact NE2-OD2 3.4Å
453	T	90.8	Very high	90.5	Very high	60 Å²	60	37.6 Å²	37.6	37%	0.368	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	17.6	173.8	57.5	0	0	0	0	113.4	S449 F450 L451	S449-T453 WeakPolarHBondContact O-CB 3.42Å; S449-T453 WeakPolarHBondContact O-CG2 3.28Å; S449-T453 PolarHBondContact O-N 2.78Å; S449-T453 VanDerWaalsContact O-N 3.15Å; S449-T453 PolarHBondContact O-OG1 3Å; F450-T453 PolarHBondContact O-N 3.15Å; F450-T453 PolarHBondContact O-OG1 3.17Å; F450-T453 VanDerWaalsContact O-OG1 3.12Å; L451-T453 PolarHBondContact O-N 2.83Å
454	R	87.9	Confident	90.4	Very high	85 Å²	85	37.6 Å²	37.6	32%	0.321	20%	0.195	S	C	.	.	S	Bend	trans	-77.4	166.7	166.1	-61.8	-50.8	86.4	-159.6	-6.3	110.5	L386 F450 L451 P456 P457 V458	L386-R454 HydrophobicContact CD2-CG 3.77Å; F450-R454 PolarHBondContact O-NE 3.45Å; F450-R454 PolarHBondContact O-NH2 2.84Å; L451-R454 WeakPolarHBondContact O-CB 3.42Å; L451-R454 WeakPolarHBondContact O-CG 3.49Å; L451-R454 PolarHBondContact O-N 3.25Å; L451-R454 VanDerWaalsContact O-N 3.15Å; R454-P456 CarbonylContact C-O 3.6Å; R454-P456 WeakPolarHBondContact CB-O 3.48Å; R454-P456 CarbonylContact O-C 3.58Å; R454-P457 WeakPolarHBondContact O-CA 3.17Å; R454-P457 VanDerWaalsContact O-N 3.13Å; R454-V458 HydrophobicContact CB-CG2 4.02Å; R454-V458 HydrophobicContact CG-CG2 4.01Å
455	N	78.4	Confident	90.3	Very high	162 Å²	162	37.5 Å²	37.5	87%	0.866	19%	0.194	S	C	*	.	S	Bend	trans	-126.6	103.4	174.1	-67.1	95.6	0	0	0	108.7
456	P	83.1	Confident	90	Very high	79 Å²	79	40.4 Å²	40.4	51%	0.513	21%	0.21	S	C	.	.	S	Bend	cis	-67.2	160	-3.5	31.1	-36.8	0	0	0	113.1	M382 R454	M382-P456 HydrophobicContact SD-CG 4Å; R454-P456 CarbonylContact C-O 3.6Å; R454-P456 WeakPolarHBondContact CB-O 3.48Å; R454-P456 CarbonylContact O-C 3.58Å
457	P	86	Confident	89.8	Confident	62 Å²	62	36 Å²	36	40%	0.403	19%	0.191	S	C	.	.			trans	-59	141.6	174	-25.2	35.4	0	0	0	112.4	R454 E514	R454-P457 WeakPolarHBondContact O-CA 3.17Å; R454-P457 VanDerWaalsContact O-N 3.13Å; P457-E514 WeakPolarHBondContact CB-OE1 3.48Å
458	V	84.7	Confident	89.8	Confident	25 Å²	25	36 Å²	36	15%	0.152	19%	0.191	C	C	.	.			trans	-104.8	111.2	179.3	177.2	0	0	0	0	109.5	L451 H452 R454 L482	L451-V458 CarbonylContact C-O 3.52Å; L451-V458 HydrophobicContact CB-CB 4.14Å; L451-V458 HydrophobicContact CB-CG1 4.45Å; L451-V458 VanDerWaalsContact CB-O 3.31Å; L451-V458 WeakPolarHBondContact CB-O 3.43Å; L451-V458 HydrophobicContact CD2-CB 4.3Å; L451-V458 HydrophobicContact CD2-CG1 4.04Å; L451-V458 PolarHBondContact O-N 3.11Å; H452-V458 PolarHBondContact CD2-O 3.05Å; R454-V458 HydrophobicContact CB-CG2 4.02Å; R454-V458 HydrophobicContact CG-CG2 4.01Å; V458-L482 HydrophobicContact CG1-CD2 4.44Å
459	I	86.4	Confident	89.8	Confident	24 Å²	24	37.8 Å²	37.8	12%	0.123	20%	0.199	C	C	.	.			trans	-95.1	128.5	176	-51.1	164.2	0	0	0	109.3	R461 Y512 E514 V516	I459-R461 HydrophobicContact CB-CG 4.34Å; I459-R461 HydrophobicContact CG2-CG 3.86Å; I459-R461 PolarHBondContact O-NE 3.15Å; I459-Y512 HydrophobicContact CD1-CD2 4.17Å; I459-Y512 HydrophobicContact CD1-CE2 4.41Å; I459-Y512 HydrophobicContact CG2-CD2 4.47Å; I459-E514 HydrophobicContact CG1-CG 4.38Å; I459-V516 HydrophobicContact CG2-CG2 3.51Å
460	H	87.6	Confident	89.7	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	19%	0.19	C	C	.	.			trans	-78.1	-39.7	-172.3	-176.6	-65.6	0	0	0	113.5	D462 L463 I479 G480 L482 A485 D517	H460-D462 VanDerWaalsContact CE1-C 3.42Å; H460-D462 PolarHBondContact CE1-O 2.99Å; H460-D462 VanDerWaalsContact ND1-C 3.31Å; H460-D462 PolarHBondContact ND1-N 2.96Å; H460-D462 PolarHBondContact O-N 3.48Å; H460-L463 PolarHBondContact ND1-N 3.32Å; H460-L463 VanDerWaalsContact ND1-N 3.1Å; H460-I479 WeakPolarHBondContact CD2-CG2 3.2Å; H460-I479 WeakPolarHBondContact NE2-CG2 3.29Å; H460-G480 PolarHBondContact NE2-O 3.13Å; H460-L482 HydrophobicContact CB-CD2 4.22Å; H460-L482 WeakPolarHBondContact CD2-CD2 3.39Å; H460-A485 VanDerWaalsContact O-CB 3.23Å; H460-A485 WeakPolarHBondContact O-CB 3.28Å; H460-D517 WeakPolarHBondContact CB-OD1 3.37Å; H460-D517 PolarHBondContact N-OD1 3.14Å; H460-D517 PolarHBondContact N-OD2 3.42Å
461	R	83.7	Confident	89.5	Confident	55 Å²	55	36.2 Å²	36.2	21%	0.208	19%	0.191	C	C	.	.	S	Bend	trans	66.8	-31.7	171.9	-50	162.7	-130.7	-169.7	-2.9	117.1	I459 A485 N489 M507 Y512 D517	I459-R461 HydrophobicContact CB-CG 4.34Å; I459-R461 HydrophobicContact CG2-CG 3.86Å; I459-R461 PolarHBondContact O-NE 3.15Å; R461-A485 HydrophobicContact CB-CB 4.47Å; R461-A485 WeakPolarHBondContact CD-O 3.11Å; R461-A485 PolarHBondContact NH1-O 3.17Å; R461-N489 PolarHBondContact NH1-ND2 3.02Å; R461-N489 PolarHBondContact NH1-OD1 2.97Å; R461-M507 HydrophobicContact CB-CE 3.97Å; R461-M507 HydrophobicContact CG-CE 4.43Å; R461-Y512 WeakPolarHBondContact CD-OH 3.48Å; R461-Y512 HydrophobicContact CG-CD2 4.47Å; R461-Y512 HydrophobicContact CG-CE2 3.86Å; R461-Y512 PolarHBondContact NH1-OH 2.92Å; R461-D517 PolarHBondContact N-OD1 3.44Å
462	D	84.8	Confident	88.6	Confident	19 Å²	19	37.4 Å²	37.4	10%	0.102	20%	0.203	C	C	.	.			trans	-113.2	36.1	177.2	-164.8	50.2	0	0	0	112.5	H460 K464 N467 K488	H460-D462 VanDerWaalsContact CE1-C 3.42Å; H460-D462 PolarHBondContact CE1-O 2.99Å; H460-D462 VanDerWaalsContact ND1-C 3.31Å; H460-D462 PolarHBondContact ND1-N 2.96Å; H460-D462 PolarHBondContact O-N 3.48Å; D462-K464 PolarHBondContact O-N 3.01Å; D462-K464 IonicContact OD1-NZ 2.73Å; D462-K464 PolarHBondContact OD1-NZ 3.45Å; D462-K464 WeakPolarHBondContact OD2-CE 3.37Å; D462-K464 IonicContact OD2-NZ 2.77Å; D462-K464 PolarHBondContact OD2-NZ 2.88Å; D462-N467 PolarHBondContact O-ND2 3.39Å; D462-N467 PolarHBondContact OD2-ND2 3.03Å; D462-K488 IonicContact OD1-NZ 3.71Å; D462-K488 PolarHBondContact OD1-NZ 3.35Å; D462-K488 IonicContact OD2-NZ 2.71Å; D462-K488 PolarHBondContact OD2-NZ 3.43Å
463	L	92.5	Very high	87.5	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.01	23%	0.234	C	C	.	.			trans	-71	127.2	-178.8	-172.8	74.8	0	0	0	109.5	I444 L448 H460 I468 I479 A520 F521	I444-L463 HydrophobicContact CG2-CD2 4.45Å; L448-L463 HydrophobicContact CD1-CD2 3.89Å; L448-L463 HydrophobicContact CD2-CD2 4.15Å; L448-L463 HydrophobicContact CG-CD2 4.47Å; H460-L463 PolarHBondContact ND1-N 3.32Å; H460-L463 VanDerWaalsContact ND1-N 3.1Å; L463-I468 HydrophobicContact CD1-CD1 4Å; L463-I468 HydrophobicContact CD1-CG1 4.01Å; L463-I468 HydrophobicContact CG-CD1 4.39Å; L463-I479 HydrophobicContact CD1-CD1 4.31Å; L463-I479 HydrophobicContact CD1-CG1 4.48Å; L463-I479 HydrophobicContact CD1-CG2 3.7Å; L463-A520 HydrophobicContact CB-CB 3.83Å; L463-A520 HydrophobicContact CD2-CB 4.32Å; L463-A520 HydrophobicContact CG-CB 4.49Å; L463-F521 HydrophobicContact CD2-CB 4.09Å
464	K	92.8	Very high	86.4	Confident	24 Å²	24	43.5 Å²	43.5	10%	0.104	24%	0.242	C	C	.	.	S	Bend	trans	-165.7	163.4	179.4	59.8	-160	176.2	-155.2	0	110.2	D462 D466 N467 I468 T499 F502 C524	D462-K464 PolarHBondContact O-N 3.01Å; D462-K464 IonicContact OD1-NZ 2.73Å; D462-K464 PolarHBondContact OD1-NZ 3.45Å; D462-K464 WeakPolarHBondContact OD2-CE 3.37Å; D462-K464 IonicContact OD2-NZ 2.77Å; D462-K464 PolarHBondContact OD2-NZ 2.88Å; K464-D466 HydrophobicContact CD-CB 4.46Å; K464-D466 HydrophobicContact CG-CB 4.03Å; K464-D466 PolarHBondContact O-N 2.99Å; K464-N467 WeakPolarHBondContact CE-OD1 3.21Å; K464-N467 HydrophobicContact CG-CB 4.27Å; K464-N467 PolarHBondContact O-N 2.98Å; K464-I468 WeakPolarHBondContact O-CG1 3.4Å; K464-I468 PolarHBondContact O-N 3.03Å; K464-T499 HydrophobicContact CD-CG2 4.49Å; K464-T499 PolarHBondContact NZ-OG1 3.5Å; K464-F502 HydrophobicContact CB-CD1 3.83Å; K464-F502 HydrophobicContact CB-CE1 3.97Å; K464-F502 HydrophobicContact CB-CG 4.18Å; K464-F502 HydrophobicContact CB-CZ 4.44Å; K464-C524 VanDerWaalsContact C-SG 3.52Å; K464-C524 WeakPolarHBondContact CA-SG 3.41Å
465	C	94.5	Very high	86	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-12.8	-179.9	-64.6	0	0	0	0	114.4	T421 L422 K423 C524 E527	T421-C465 WeakPolarHBondContact CB-O 3.2Å; L422-C465 HydrophobicContact CB-CB 3.81Å; L422-C465 WeakPolarHBondContact CB-O 3.49Å; L422-C465 PolarHBondContact N-O 2.68Å; L422-C465 VanDerWaalsContact N-O 3.13Å; K423-C465 HydrophobicContact CB-CB 4.03Å; K423-C465 WeakPolarHBondContact CB-O 3.46Å; K423-C465 PolarHBondContact N-O 2.86Å; C465-C524 PolarHBondContact N-SG 3.41Å; C465-C524 VanDerWaalsContact SG-SG 3.68Å; C465-E527 WeakPolarHBondContact CB-OE2 3.34Å; C465-E527 PolarHBondContact SG-OE2 3.47Å
466	D	91.4	Very high	86.7	Confident	60 Å²	60	33.2 Å²	33.2	32%	0.321	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-28.7	171.8	-128.8	-3.3	0	0	0	113.3	T421 K423 K464	T421-D466 WeakPolarHBondContact CG2-O 3.36Å; K423-D466 HydrophobicContact CD-CB 3.88Å; K423-D466 VanDerWaalsContact CD-OD1 3.23Å; K423-D466 WeakPolarHBondContact CD-OD1 3.4Å; K423-D466 WeakPolarHBondContact CD-OD2 3.26Å; K423-D466 IonicContact NZ-OD1 2.84Å; K423-D466 IonicContact NZ-OD2 2.64Å; K423-D466 PolarHBondContact NZ-OD2 3.37Å; K464-D466 HydrophobicContact CD-CB 4.46Å; K464-D466 HydrophobicContact CG-CB 4.03Å; K464-D466 PolarHBondContact O-N 2.99Å
467	N	93.4	Very high	87.3	Confident	14 Å²	14	29.5 Å²	29.5	8%	0.075	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	1.4	-178	-66.1	2.1	0	0	0	112.1	D462 K464 F469 G480	D462-N467 PolarHBondContact O-ND2 3.39Å; D462-N467 PolarHBondContact OD2-ND2 3.03Å; K464-N467 WeakPolarHBondContact CE-OD1 3.21Å; K464-N467 HydrophobicContact CG-CB 4.27Å; K464-N467 PolarHBondContact O-N 2.98Å; N467-F469 WeakPolarHBondContact O-CD2 3.24Å; N467-G480 PolarHBondContact O-N 3.21Å
468	I	95.9	Very high	87.9	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	111.4	174.9	-56.8	161.7	0	0	0	107.9	T421 L422 I444 L463 K464 V477	T421-I468 CarbonylContact C-O 3.53Å; T421-I468 VanDerWaalsContact CA-O 3.31Å; T421-I468 WeakPolarHBondContact CA-O 3.42Å; L422-I468 HydrophobicContact CD1-CB 3.78Å; L422-I468 HydrophobicContact CD1-CD1 4.05Å; L422-I468 HydrophobicContact CD1-CG2 3.49Å; L422-I468 VanDerWaalsContact CD1-CG2 3.49Å; L422-I468 HydrophobicContact CG-CB 4.13Å; L422-I468 HydrophobicContact CG-CG2 3.88Å; L422-I468 PolarHBondContact N-O 2.9Å; I444-I468 HydrophobicContact CD1-CD1 3.93Å; I444-I468 HydrophobicContact CD1-CG2 4.28Å; I444-I468 HydrophobicContact CG1-CD1 4.2Å; I444-I468 HydrophobicContact CG1-CG2 4.1Å; I444-I468 HydrophobicContact CG2-CD1 4.44Å; L463-I468 HydrophobicContact CD1-CD1 4Å; L463-I468 HydrophobicContact CD1-CG1 4.01Å; L463-I468 HydrophobicContact CG-CD1 4.39Å; K464-I468 WeakPolarHBondContact O-CG1 3.4Å; K464-I468 PolarHBondContact O-N 3.03Å; I468-V477 HydrophobicContact CG2-CB 4.01Å; I468-V477 HydrophobicContact CG2-CG1 4.44Å
469	F	95.6	Very high	88.4	Confident	38 Å²	38	26.5 Å²	26.5	17%	0.167	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	149.1	-174.2	-63.1	-91.3	0	0	0	111.6	V392 M417 G420 T421 N467 V477 K478	V392-F469 HydrophobicContact CG2-CD2 3.77Å; V392-F469 HydrophobicContact CG2-CE2 4.4Å; V392-F469 HydrophobicContact CG2-CG 4.42Å; M417-F469 HydrophobicContact CB-CB 3.76Å; M417-F469 HydrophobicContact CB-CD1 3.43Å; M417-F469 VanDerWaalsContact CB-CD1 3.43Å; M417-F469 HydrophobicContact CB-CE1 4.2Å; M417-F469 HydrophobicContact CB-CG 3.72Å; M417-F469 HydrophobicContact CE-CB 3.65Å; M417-F469 HydrophobicContact CG-CB 3.61Å; M417-F469 HydrophobicContact CG-CD1 3.89Å; M417-F469 HydrophobicContact CG-CD2 4.25Å; M417-F469 HydrophobicContact CG-CG 3.65Å; M417-F469 HydrophobicContact SD-CB 4.35Å; G420-F469 WeakPolarHBondContact O-CA 3.24Å; T421-F469 HydrophobicContact CG2-CD1 3.75Å; T421-F469 HydrophobicContact CG2-CE1 3.73Å; T421-F469 HydrophobicContact CG2-CG 4.48Å; T421-F469 HydrophobicContact CG2-CZ 4.43Å; N467-F469 WeakPolarHBondContact O-CD2 3.24Å; F469-V477 CarbonylContact O-C 3.58Å; F469-V477 VanDerWaalsContact O-CA 3.25Å; F469-V477 WeakPolarHBondContact O-CA 3.48Å; F469-K478 PolarHBondContact N-O 3.2Å; F469-K478 PolarHBondContact O-N 3.37Å
470	I	94	Very high	88.7	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.005	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	140	176.6	-54	172.7	0	0	0	109.5	L67 S419 G420 L422 Y425 W440 V477	L67-I470 HydrophobicContact CD2-CG2 3.86Å; S419-I470 WeakPolarHBondContact CB-O 3.17Å; G420-I470 PolarHBondContact O-N 3.41Å; L422-I470 HydrophobicContact CD2-CD1 4.11Å; L422-I470 HydrophobicContact CD2-CG1 4.06Å; Y425-I470 HydrophobicContact CD2-CD1 3.79Å; Y425-I470 HydrophobicContact CG-CD1 3.86Å; W440-I470 HydrophobicContact CH2-CD1 3.81Å; W440-I470 HydrophobicContact CZ2-CD1 4.15Å; W440-I470 HydrophobicContact CZ2-CG2 4.33Å; W440-I470 HydrophobicContact CZ3-CD1 4.46Å; I470-V477 HydrophobicContact CG1-CG1 4.25Å
471	T	90.4	Very high	88.5	Confident	22 Å²	22	27.8 Å²	27.8	14%	0.135	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	95	175.3	-44.6	0	0	0	0	109.7	T473 T474 G475 S476	T471-T473 PolarHBondContact O-N 3.41Å; T471-T473 VanDerWaalsContact O-N 3.07Å; T471-T474 WeakPolarHBondContact CB-OG1 3.48Å; T471-T474 WeakPolarHBondContact CG2-OG1 3.47Å; T471-T474 PolarHBondContact O-N 2.95Å; T471-T474 PolarHBondContact O-OG1 3.02Å; T471-G475 PolarHBondContact O-N 3.23Å; T471-S476 WeakPolarHBondContact CB-OG 3.43Å; T471-S476 PolarHBondContact N-O 3.16Å; T471-S476 PolarHBondContact OG1-O 3.09Å; T471-S476 PolarHBondContact OG1-OG 3.29Å; T471-S476 VanDerWaalsContact OG1-OG 3.08Å
472	G	74.7	Confident	88	Confident	26 Å²	26	26.1 Å²	26.1	27%	0.268	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.3	-172.5	0	0	0	0	0	115.8	S419 T474	S419-G472 VanDerWaalsContact OG-CA 3.31Å; S419-G472 WeakPolarHBondContact OG-CA 2.98Å; S419-G472 PolarHBondContact OG-N 2.94Å; G472-T474 VanDerWaalsContact C-N 3.34Å
473	T	68.5	Low	86.7	Confident	126 Å²	126	25.7 Å²	25.7	77%	0.773	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-17.9	176.3	52.7	0	0	0	0	114.3	T471	T471-T473 PolarHBondContact O-N 3.41Å; T471-T473 VanDerWaalsContact O-N 3.07Å
474	T	67.6	Low	85	Confident	88 Å²	88	27.2 Å²	27.2	54%	0.54	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-134.6	-10.7	-173.3	51.2	0	0	0	0	114	T471 G472 S476	T471-T474 WeakPolarHBondContact CB-OG1 3.48Å; T471-T474 WeakPolarHBondContact CG2-OG1 3.47Å; T471-T474 PolarHBondContact O-N 2.95Å; T471-T474 PolarHBondContact O-OG1 3.02Å; G472-T474 VanDerWaalsContact C-N 3.34Å; T474-S476 PolarHBondContact O-N 3.41Å; T474-S476 PolarHBondContact OG1-N 3.11Å; T474-S476 PolarHBondContact OG1-OG 3.06Å
475	G	80.9	Confident	83.1	Confident	7 Å²	7	26.3 Å²	26.3	7%	0.072	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.5	10	-169.8	0	0	0	0	0	113.9	W440 T471	W440-G475 PolarHBondContact NE1-O 3.33Å; T471-G475 PolarHBondContact O-N 3.23Å
476	S	92.4	Very high	80.9	Confident	24 Å²	24	27.2 Å²	27.2	17%	0.168	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	164.8	177.8	62.9	0	0	0	0	112.3	T471 T474	T471-S476 WeakPolarHBondContact CB-OG 3.43Å; T471-S476 PolarHBondContact N-O 3.16Å; T471-S476 PolarHBondContact OG1-O 3.09Å; T471-S476 PolarHBondContact OG1-OG 3.29Å; T471-S476 VanDerWaalsContact OG1-OG 3.08Å; T474-S476 PolarHBondContact O-N 3.41Å; T474-S476 PolarHBondContact OG1-N 3.11Å; T474-S476 PolarHBondContact OG1-OG 3.06Å
477	V	96.3	Very high	78.7	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.012	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	146.9	173.7	-70.1	0	0	0	0	112.2	N390 L422 W440 Q443 I444 I468 F469 I470	N390-V477 WeakPolarHBondContact CA-O 3.4Å; N390-V477 WeakPolarHBondContact CB-O 3.36Å; N390-V477 PolarHBondContact ND2-O 3.19Å; L422-V477 HydrophobicContact CD2-CG1 4.06Å; W440-V477 HydrophobicContact CB-CG1 4.24Å; W440-V477 HydrophobicContact CB-CG2 4.09Å; W440-V477 HydrophobicContact CD2-CG1 3.94Å; W440-V477 HydrophobicContact CG-CG1 3.7Å; W440-V477 HydrophobicContact CG-CG2 4.27Å; Q443-V477 HydrophobicContact CB-CG2 3.52Å; Q443-V477 HydrophobicContact CG-CG2 4.47Å; I444-V477 HydrophobicContact CG1-CG2 4.1Å; I468-V477 HydrophobicContact CG2-CB 4.01Å; I468-V477 HydrophobicContact CG2-CG1 4.44Å; F469-V477 CarbonylContact O-C 3.58Å; F469-V477 VanDerWaalsContact O-CA 3.25Å; F469-V477 WeakPolarHBondContact O-CA 3.48Å; I470-V477 HydrophobicContact CG1-CG1 4.25Å
478	K	97	Very high	76.6	Confident	22 Å²	22	27.7 Å²	27.7	10%	0.096	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	129.4	-178.1	-79.5	166.4	164	-88	0	111.1	P389 N390 I391 V392 E415 M417 F469	P389-K478 VanDerWaalsContact O-CE 3.28Å; P389-K478 WeakPolarHBondContact O-CE 3.38Å; P389-K478 VanDerWaalsContact O-CG 3.28Å; P389-K478 WeakPolarHBondContact O-CG 3.49Å; N390-K478 WeakPolarHBondContact O-CA 3.26Å; I391-K478 PolarHBondContact O-NZ 3.28Å; V392-K478 HydrophobicContact CG2-CB 3.74Å; E415-K478 WeakPolarHBondContact OE1-CE 3.28Å; E415-K478 IonicContact OE1-NZ 3.9Å; E415-K478 PolarHBondContact OE1-NZ 3.15Å; E415-K478 IonicContact OE2-NZ 3.11Å; E415-K478 PolarHBondContact OE2-NZ 3.11Å; M417-K478 HydrophobicContact CE-CB 4.23Å; M417-K478 HydrophobicContact CE-CD 3.76Å; M417-K478 HydrophobicContact SD-CD 3.81Å; F469-K478 PolarHBondContact N-O 3.2Å; F469-K478 PolarHBondContact O-N 3.37Å
479	I	96	Very high	74.2	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	131.1	175.2	-48.9	175.2	0	0	0	109.2	N390 I391 V392 I444 L448 H460 L463	N390-I479 PolarHBondContact O-N 3.33Å; I391-I479 WeakPolarHBondContact CA-O 3.37Å; I391-I479 HydrophobicContact CD1-CB 3.99Å; I391-I479 HydrophobicContact CD1-CD1 4.28Å; I391-I479 HydrophobicContact CD1-CG1 4.44Å; V392-I479 PolarHBondContact N-O 3.34Å; I444-I479 HydrophobicContact CG2-CD1 4.04Å; L448-I479 HydrophobicContact CD2-CD1 4.03Å; L448-I479 HydrophobicContact CG-CD1 4.12Å; H460-I479 WeakPolarHBondContact CD2-CG2 3.2Å; H460-I479 WeakPolarHBondContact NE2-CG2 3.29Å; L463-I479 HydrophobicContact CD1-CD1 4.31Å; L463-I479 HydrophobicContact CD1-CG1 4.48Å; L463-I479 HydrophobicContact CD1-CG2 3.7Å
480	G	91.8	Very high	71.7	Confident	2 Å²	2	34.6 Å²	34.6	2%	0.021	20%	0.198	C	C	.	.			trans	-131.8	-173.3	-177.5	0	0	0	0	0	114.4	H460 N467 L482	H460-G480 PolarHBondContact NE2-O 3.13Å; N467-G480 PolarHBondContact O-N 3.21Å; G480-L482 PolarHBondContact O-N 3.4Å
481	D	83.7	Confident	68.8	Low	51 Å²	51	35.7 Å²	35.7	27%	0.273	21%	0.206	S	C	.	.			trans	62.6	14	-179.4	-85.4	35.8	0	0	0	117.4	K344 G483 L484	K344-D481 IonicContact NZ-OD1 3.74Å; K344-D481 PolarHBondContact NZ-OD1 3.07Å; K344-D481 IonicContact NZ-OD2 3.96Å; K344-D481 PolarHBondContact NZ-OD2 2.94Å; D481-G483 PolarHBondContact O-N 3.25Å; D481-G483 VanDerWaalsContact O-N 3.1Å; D481-L484 PolarHBondContact O-N 3.23Å
482	L	74.4	Confident	66	Low	20 Å²	20	39.1 Å²	39.1	11%	0.105	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-42.5	-44	171.8	-70.6	168.5	0	0	0	114.3	L383 L386 I391 L451 V458 H460 G480 L484 A485	L383-L482 HydrophobicContact CD2-CB 3.89Å; L383-L482 HydrophobicContact CD2-CD1 4.28Å; L386-L482 HydrophobicContact CD1-CD1 4.05Å; I391-L482 HydrophobicContact CG2-CD1 3.84Å; L451-L482 HydrophobicContact CD1-CD2 3.81Å; L451-L482 HydrophobicContact CD2-CD1 3.94Å; L451-L482 HydrophobicContact CD2-CD2 4.23Å; V458-L482 HydrophobicContact CG1-CD2 4.44Å; H460-L482 HydrophobicContact CB-CD2 4.22Å; H460-L482 WeakPolarHBondContact CD2-CD2 3.39Å; G480-L482 PolarHBondContact O-N 3.4Å; L482-L484 PolarHBondContact O-N 3.32Å; L482-A485 VanDerWaalsContact O-CB 3.24Å; L482-A485 WeakPolarHBondContact O-CB 3.43Å; L482-A485 PolarHBondContact O-N 2.99Å
483	G	57.2	Low	64	Low	9 Å²	9	43 Å²	43	9%	0.093	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-67.2	0.6	-178.6	0	0	0	0	0	116.3	F376 L383 D481	F376-G483 WeakPolarHBondContact CE2-O 3.21Å; L383-G483 VanDerWaalsContact CD1-CA 3.45Å; D481-G483 PolarHBondContact O-N 3.25Å; D481-G483 VanDerWaalsContact O-N 3.1Å
484	L	57.2	Low	62.5	Low	34 Å²	34	46.7 Å²	46.7	18%	0.178	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-103.4	-11.2	170.1	-63.1	-177.4	0	0	0	113.4	K344 L363 D481 L482 T486 L487 K488	K344-L484 HydrophobicContact CD-CD1 3.85Å; L363-L484 HydrophobicContact CD1-CD2 3.7Å; L363-L484 HydrophobicContact CD2-CD2 3.79Å; L363-L484 HydrophobicContact CG-CD2 4.44Å; D481-L484 PolarHBondContact O-N 3.23Å; L482-L484 PolarHBondContact O-N 3.32Å; L484-T486 PolarHBondContact O-N 2.61Å; L484-T486 VanDerWaalsContact O-N 3.14Å; L484-L487 HydrophobicContact CD2-CD1 4.26Å; L484-K488 WeakPolarHBondContact O-CG 3.26Å; L484-K488 PolarHBondContact O-N 3.02Å
485	A	53	Low	60.9	Low	5 Å²	5	45.6 Å²	45.6	4%	0.041	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-26.8	-173.3	0	0	0	0	0	113.2	H460 R461 L482 N489	H460-A485 VanDerWaalsContact O-CB 3.23Å; H460-A485 WeakPolarHBondContact O-CB 3.28Å; R461-A485 HydrophobicContact CB-CB 4.47Å; R461-A485 WeakPolarHBondContact CD-O 3.11Å; R461-A485 PolarHBondContact NH1-O 3.17Å; L482-A485 VanDerWaalsContact O-CB 3.24Å; L482-A485 WeakPolarHBondContact O-CB 3.43Å; L482-A485 PolarHBondContact O-N 2.99Å; A485-N489 PolarHBondContact O-OD1 3.43Å; A485-N489 VanDerWaalsContact O-OD1 3.13Å
486	T	47.9	Very low	58.6	Low	20 Å²	20	50 Å²	50	12%	0.123	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-38	-171	59.1	0	0	0	0	113	E379 L484 K488 N489	E379-T486 HydrophobicContact CB-CG2 4.42Å; E379-T486 HydrophobicContact CG-CG2 3.95Å; E379-T486 VanDerWaalsContact OE1-CB 3.25Å; E379-T486 WeakPolarHBondContact OE1-CB 3.42Å; E379-T486 WeakPolarHBondContact OE1-CG2 3.09Å; E379-T486 WeakPolarHBondContact OE2-CB 3.43Å; E379-T486 WeakPolarHBondContact OE2-CG2 3.39Å; E379-T486 PolarHBondContact OE2-OG1 3.19Å; L484-T486 PolarHBondContact O-N 2.61Å; L484-T486 VanDerWaalsContact O-N 3.14Å; T486-K488 PolarHBondContact O-N 3.24Å; T486-N489 VanDerWaalsContact O-CB 3.3Å; T486-N489 WeakPolarHBondContact O-CB 3.4Å; T486-N489 PolarHBondContact O-N 3.07Å
487	L	45.2	Very low	56.4	Low	28 Å²	28	51.7 Å²	51.7	15%	0.147	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-58.1	-27.6	169.8	-62	179.8	0	0	0	112.2	L363 L368 F376 L484 N489	L363-L487 HydrophobicContact CD1-CD1 3.67Å; L368-L487 HydrophobicContact CD1-CD2 3.82Å; L368-L487 HydrophobicContact CD2-CD2 3.84Å; F376-L487 HydrophobicContact CB-CD2 3.98Å; F376-L487 HydrophobicContact CD2-CD1 3.8Å; F376-L487 HydrophobicContact CD2-CD2 3.6Å; F376-L487 HydrophobicContact CD2-CG 3.7Å; F376-L487 HydrophobicContact CE2-CD1 3.94Å; F376-L487 HydrophobicContact CE2-CG 4.27Å; F376-L487 HydrophobicContact CG-CD2 4.08Å; L484-L487 HydrophobicContact CD2-CD1 4.26Å; L487-N489 PolarHBondContact O-N 3.47Å
488	K	48.6	Very low	54.1	Low	55 Å²	55	52.7 Å²	52.7	24%	0.239	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-67.2	-18.5	174.5	-73.9	-173	-170.5	-159	0	114.4	D462 L484 T486 K490 I497	D462-K488 IonicContact OD1-NZ 3.71Å; D462-K488 PolarHBondContact OD1-NZ 3.35Å; D462-K488 IonicContact OD2-NZ 2.71Å; D462-K488 PolarHBondContact OD2-NZ 3.43Å; L484-K488 WeakPolarHBondContact O-CG 3.26Å; L484-K488 PolarHBondContact O-N 3.02Å; T486-K488 PolarHBondContact O-N 3.24Å; K488-K490 VanDerWaalsContact C-N 3.32Å; K488-K490 PolarHBondContact O-N 3.09Å; K488-I497 HydrophobicContact CB-CG2 4.23Å
489	N	46.8	Very low	51.9	Low	68 Å²	68	53 Å²	53	36%	0.364	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-63.2	-29.7	-165.6	-79.1	21.2	0	0	0	114.7	R461 A485 T486 L487 Y512	R461-N489 PolarHBondContact NH1-ND2 3.02Å; R461-N489 PolarHBondContact NH1-OD1 2.97Å; A485-N489 PolarHBondContact O-OD1 3.43Å; A485-N489 VanDerWaalsContact O-OD1 3.13Å; T486-N489 VanDerWaalsContact O-CB 3.3Å; T486-N489 WeakPolarHBondContact O-CB 3.4Å; T486-N489 PolarHBondContact O-N 3.07Å; L487-N489 PolarHBondContact O-N 3.47Å; N489-Y512 VanDerWaalsContact CG-OH 3.3Å; N489-Y512 PolarHBondContact ND2-OH 2.84Å; N489-Y512 PolarHBondContact OD1-OH 3.48Å
490	K	42.3	Very low	50	Low	116 Å²	116	53.3 Å²	53.3	50%	0.504	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.9	-16.3	-175.2	-70.2	-173.1	178.5	-79	0	117.2	K488 F492 E510	K488-K490 VanDerWaalsContact C-N 3.32Å; K488-K490 PolarHBondContact O-N 3.09Å; K490-F492 PolarHBondContact O-N 3.03Å; K490-E510 IonicContact NZ-OE1 2.67Å; K490-E510 PolarHBondContact NZ-OE1 3.46Å; K490-E510 IonicContact NZ-OE2 2.69Å; K490-E510 PolarHBondContact NZ-OE2 2.79Å
491	S	33.7	Very low	48.4	Very low	23 Å²	23	54.6 Å²	54.6	16%	0.161	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	108.4	-175.8	74.9	0	0	0	0	113	I497	S491-I497 WeakPolarHBondContact O-CD1 3.5Å
492	F	31.4	Very low	47.2	Very low	95 Å²	95	52.7 Å²	52.7	42%	0.417	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	92	63.6	176.3	-71.9	-100.7	0	0	0	118.7	K367 K490 K494 S495 I497	K367-F492 HydrophobicContact CD-CE2 3.99Å; K490-F492 PolarHBondContact O-N 3.03Å; F492-K494 PolarHBondContact O-N 3.4Å; F492-S495 WeakPolarHBondContact CB-OG 3.42Å; F492-S495 WeakPolarHBondContact CD1-OG 3.41Å; F492-S495 PolarHBondContact O-N 3.2Å; F492-I497 HydrophobicContact CB-CD1 4.47Å; F492-I497 WeakPolarHBondContact O-CD1 3.22Å
493	A	31.9	Very low	46.7	Very low	107 Å²	107	52.7 Å²	52.7	88%	0.884	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	41.7	160.7	0	0	0	0	0	114.5
494	K	37.1	Very low	46.6	Very low	203 Å²	203	52.2 Å²	52.2	88%	0.883	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-157.6	-4	179.1	-117.8	168.9	-173.5	170.4	0	114.9	F492	F492-K494 PolarHBondContact O-N 3.4Å
495	S	33.2	Very low	46.7	Very low	65 Å²	65	51.4 Å²	51.4	46%	0.455	29%	0.285	S	S	.	.	S	Bend	trans	-146.1	95.5	177.6	60.8	0	0	0	0	111.6	F492 I497	F492-S495 WeakPolarHBondContact CB-OG 3.42Å; F492-S495 WeakPolarHBondContact CD1-OG 3.41Å; F492-S495 PolarHBondContact O-N 3.2Å; S495-I497 PolarHBondContact O-N 3.18Å; S495-I497 VanDerWaalsContact O-N 3.11Å
496	V	32.6	Very low	47.3	Very low	101 Å²	101	52 Å²	52	61%	0.612	29%	0.287	S	S	*	.			trans	18.1	77.9	167.2	-165.8	0	0	0	0	114	P500 P541	V496-P500 HydrophobicContact CG1-CG 4.36Å; V496-P541 HydrophobicContact CG1-CB 4.41Å; V496-P541 HydrophobicContact CG1-CG 3.96Å; V496-P541 HydrophobicContact CG2-CG 4.01Å
497	I	47.6	Very low	47.6	Very low	58 Å²	58	52.7 Å²	52.7	30%	0.297	29%	0.289	S	S	.	.			trans	-79.9	137.3	169.7	-61.1	178.5	0	0	0	108	K488 S491 F492 S495 M503	K488-I497 HydrophobicContact CB-CG2 4.23Å; S491-I497 WeakPolarHBondContact O-CD1 3.5Å; F492-I497 HydrophobicContact CB-CD1 4.47Å; F492-I497 WeakPolarHBondContact O-CD1 3.22Å; S495-I497 PolarHBondContact O-N 3.18Å; S495-I497 VanDerWaalsContact O-N 3.11Å; I497-M503 VanDerWaalsContact O-SD 3.39Å
498	G	48.5	Very low	47.8	Very low	24 Å²	24	55.8 Å²	55.8	25%	0.247	30%	0.299	C	S	.	.	S	Bend	trans	79.6	178.8	-176.8	0	0	0	0	0	113.1
499	T	49.1	Very low	48	Very low	27 Å²	27	59.2 Å²	59.2	17%	0.166	32%	0.316	C	S	.	.			trans	-107.2	97.6	175.6	-62.9	0	0	0	0	105.7	K464 E501 F502 M503 Y533	K464-T499 HydrophobicContact CD-CG2 4.49Å; K464-T499 PolarHBondContact NZ-OG1 3.5Å; T499-E501 WeakPolarHBondContact CG2-OE2 3.49Å; T499-E501 PolarHBondContact O-N 3.09Å; T499-F502 HydrophobicContact CG2-CD2 3.8Å; T499-F502 HydrophobicContact CG2-CE2 4.39Å; T499-F502 PolarHBondContact O-N 3.06Å; T499-M503 PolarHBondContact O-N 3.26Å; T499-Y533 WeakPolarHBondContact CG2-OH 3.35Å
500	P	56.3	Low	48.3	Very low	8 Å²	8	62.9 Å²	62.9	5%	0.052	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-17.3	-159.2	25.5	-35	0	0	0	113.9	V496 F502 P541 I544	V496-P500 HydrophobicContact CG1-CG 4.36Å; P500-F502 VanDerWaalsContact C-N 3.25Å; P500-F502 PolarHBondContact O-N 2.95Å; P500-P541 HydrophobicContact CB-CB 4.23Å; P500-P541 HydrophobicContact CG-CB 3.83Å; P500-P541 HydrophobicContact CG-CG 3.97Å; P500-I544 HydrophobicContact CG-CD1 4.25Å; P500-I544 WeakPolarHBondContact O-CG2 3.37Å
501	E	58.9	Low	48.8	Very low	29 Å²	29	64.4 Å²	64.4	14%	0.136	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-17.6	174.9	-51	80.7	-168.1	0	0	113.2	T499 Y533 Y535 I544	T499-E501 WeakPolarHBondContact CG2-OE2 3.49Å; T499-E501 PolarHBondContact O-N 3.09Å; E501-Y533 HydrophobicContact CB-CE1 4.04Å; E501-Y533 HydrophobicContact CG-CD1 4.4Å; E501-Y533 HydrophobicContact CG-CE1 3.61Å; E501-Y533 PolarHBondContact OE2-OH 3Å; E501-Y535 HydrophobicContact CB-CD2 4.44Å; E501-I544 HydrophobicContact CG-CD1 3.66Å; E501-I544 HydrophobicContact CG-CG1 4.42Å; E501-I544 HydrophobicContact CG-CG2 4.45Å; E501-I544 WeakPolarHBondContact OE1-CD1 3.48Å
502	F	59	Low	50.4	Low	11 Å²	11	65.6 Å²	65.6	5%	0.048	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-4.7	-178.7	-69.7	-105.1	0	0	0	112.9	K464 T499 P500 M523 E527 Y533 P534	K464-F502 HydrophobicContact CB-CD1 3.83Å; K464-F502 HydrophobicContact CB-CE1 3.97Å; K464-F502 HydrophobicContact CB-CG 4.18Å; K464-F502 HydrophobicContact CB-CZ 4.44Å; T499-F502 HydrophobicContact CG2-CD2 3.8Å; T499-F502 HydrophobicContact CG2-CE2 4.39Å; T499-F502 PolarHBondContact O-N 3.06Å; P500-F502 VanDerWaalsContact C-N 3.25Å; P500-F502 PolarHBondContact O-N 2.95Å; F502-M523 HydrophobicContact CD1-CB 3.66Å; F502-M523 HydrophobicContact CE1-CB 3.87Å; F502-M523 HydrophobicContact CG-CB 4.3Å; F502-E527 WeakPolarHBondContact CZ-OE2 3.48Å; F502-Y533 HydrophobicContact CE2-CD2 4.28Å; F502-Y533 AromaticContact CE2-CE2 3.6Å; F502-Y533 HydrophobicContact CE2-CE2 3.6Å; F502-Y533 AromaticContact CE2-CZ 3.78Å; F502-Y533 HydrophobicContact CZ-CE2 4.22Å; F502-P534 HydrophobicContact CE2-CG 4.45Å; F502-P534 HydrophobicContact CZ-CG 4.15Å
503	M	63.3	Low	52.8	Low	20 Å²	20	63 Å²	63	10%	0.099	33%	0.333	C	S	.	.			trans	-82.3	128.8	-179.2	-68.6	171.5	70.9	0	0	110.6	I497 T499 M507 Y508 Y519	I497-M503 VanDerWaalsContact O-SD 3.39Å; T499-M503 PolarHBondContact O-N 3.26Å; M503-M507 HydrophobicContact CB-CB 4.31Å; M503-M507 HydrophobicContact CB-CG 4.36Å; M503-M507 HydrophobicContact CE-CB 4.21Å; M503-M507 HydrophobicContact CE-CG 3.58Å; M503-M507 HydrophobicContact CG-CG 4.29Å; M503-Y508 HydrophobicContact CB-CE2 4.1Å; M503-Y508 HydrophobicContact CE-CD1 4.47Å; M503-Y508 HydrophobicContact CE-CE1 3.91Å; M503-Y508 HydrophobicContact CE-CE2 4.06Å; M503-Y519 VanDerWaalsContact O-CE1 3.28Å; M503-Y519 WeakPolarHBondContact O-CE1 3.42Å
504	A	54.9	Low	55.5	Low	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.306	C	S	.	.			trans	-65.7	152.4	170	0	0	0	0	0	110.8	E506 M507 V516 Y519	A504-E506 VanDerWaalsContact C-N 3.25Å; A504-E506 WeakPolarHBondContact CB-OE1 3.47Å; A504-E506 WeakPolarHBondContact CB-OE2 3.5Å; A504-E506 PolarHBondContact O-N 3.41Å; A504-M507 WeakPolarHBondContact O-CB 3.42Å; A504-M507 PolarHBondContact O-N 3.39Å; A504-V516 HydrophobicContact CB-CB 4.42Å; A504-V516 HydrophobicContact CB-CG1 4.21Å; A504-Y519 HydrophobicContact CB-CD1 3.87Å; A504-Y519 HydrophobicContact CB-CD2 4.23Å; A504-Y519 HydrophobicContact CB-CE1 4.49Å; A504-Y519 HydrophobicContact CB-CG 3.72Å
505	P	60.1	Low	58	Low	16 Å²	16	52.2 Å²	52.2	10%	0.104	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-57.3	-35.2	-177.4	19.4	-30	0	0	0	113.7	M507 Y508 V548 I549 V577	P505-M507 VanDerWaalsContact C-N 3.34Å; P505-M507 PolarHBondContact O-N 3.17Å; P505-Y508 WeakPolarHBondContact O-CD2 3.47Å; P505-V548 HydrophobicContact CB-CG1 4.01Å; P505-V548 HydrophobicContact CG-CG1 4.22Å; P505-I549 HydrophobicContact CB-CG1 3.92Å; P505-V577 HydrophobicContact CG-CG1 4.14Å; P505-V577 WeakPolarHBondContact CG-O 3.25Å
506	E	65	Low	60.7	Low	19 Å²	19	49.2 Å²	49.2	9%	0.089	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-78.9	-8.8	178	74.9	-70.5	171.4	0	0	114.3	A504 Y508 E509 V516 R582	A504-E506 VanDerWaalsContact C-N 3.25Å; A504-E506 WeakPolarHBondContact CB-OE1 3.47Å; A504-E506 WeakPolarHBondContact CB-OE2 3.5Å; A504-E506 PolarHBondContact O-N 3.41Å; E506-Y508 PolarHBondContact O-N 3.45Å; E506-Y508 VanDerWaalsContact O-N 3.08Å; E506-E509 PolarHBondContact O-N 2.79Å; E506-E509 VanDerWaalsContact O-O 3.1Å; E506-V516 HydrophobicContact CG-CG1 4.43Å; E506-V516 WeakPolarHBondContact OE1-CG1 3.49Å; E506-R582 IonicContact OE1-CZ 2.63Å; E506-R582 IonicContact OE1-NH1 3.94Å; E506-R582 PolarHBondContact OE1-NH1 3.26Å; E506-R582 IonicContact OE1-NH2 2.68Å; E506-R582 PolarHBondContact OE1-NH2 3.23Å; E506-R582 IonicContact OE2-CZ 2.66Å; E506-R582 IonicContact OE2-NH1 3.59Å; E506-R582 IonicContact OE2-NH2 3.36Å; E506-R582 PolarHBondContact OE2-NH2 3.01Å
507	M	53.1	Low	63.6	Low	34 Å²	34	44.4 Å²	44.4	17%	0.167	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-64.7	-11.6	172.5	-172.6	65.6	78.2	0	0	112.5	R461 M503 A504 P505 Y512 V516	R461-M507 HydrophobicContact CB-CE 3.97Å; R461-M507 HydrophobicContact CG-CE 4.43Å; M503-M507 HydrophobicContact CB-CB 4.31Å; M503-M507 HydrophobicContact CB-CG 4.36Å; M503-M507 HydrophobicContact CE-CB 4.21Å; M503-M507 HydrophobicContact CE-CG 3.58Å; M503-M507 HydrophobicContact CG-CG 4.29Å; A504-M507 WeakPolarHBondContact O-CB 3.42Å; A504-M507 PolarHBondContact O-N 3.39Å; P505-M507 VanDerWaalsContact C-N 3.34Å; P505-M507 PolarHBondContact O-N 3.17Å; M507-Y512 HydrophobicContact SD-CD1 4.09Å; M507-Y512 HydrophobicContact SD-CE1 4.32Å; M507-Y512 HydrophobicContact SD-CG 4.38Å; M507-V516 HydrophobicContact CE-CB 3.56Å; M507-V516 HydrophobicContact CE-CG1 3.76Å; M507-V516 HydrophobicContact CE-CG2 3.64Å
508	Y	50.1	Low	65.9	Low	92 Å²	92	41.9 Å²	41.9	36%	0.361	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-90.6	-6.8	174.1	-62.8	-89.3	0	0	0	113	M503 P505 E506 Y545	M503-Y508 HydrophobicContact CB-CE2 4.1Å; M503-Y508 HydrophobicContact CE-CD1 4.47Å; M503-Y508 HydrophobicContact CE-CE1 3.91Å; M503-Y508 HydrophobicContact CE-CE2 4.06Å; P505-Y508 WeakPolarHBondContact O-CD2 3.47Å; E506-Y508 PolarHBondContact O-N 3.45Å; E506-Y508 VanDerWaalsContact O-N 3.08Å; Y508-Y545 HydrophobicContact CD1-CD2 4.02Å; Y508-Y545 AromaticContact CD1-CE2 3.73Å; Y508-Y545 HydrophobicContact CD1-CE2 3.73Å; Y508-Y545 AromaticContact CD2-CD2 3.85Å; Y508-Y545 HydrophobicContact CD2-CD2 3.85Å; Y508-Y545 AromaticContact CD2-CE2 3.66Å; Y508-Y545 HydrophobicContact CD2-CE2 3.66Å; Y508-Y545 AromaticContact CE1-CD2 3.84Å; Y508-Y545 HydrophobicContact CE1-CD2 3.84Å; Y508-Y545 HydrophobicContact CE1-CE2 4.04Å; Y508-Y545 AromaticContact CE2-CD2 3.65Å; Y508-Y545 HydrophobicContact CE2-CD2 3.65Å; Y508-Y545 AromaticContact CE2-CE2 3.97Å; Y508-Y545 HydrophobicContact CE2-CE2 3.97Å; Y508-Y545 HydrophobicContact CG-CD2 4.03Å; Y508-Y545 AromaticContact CG-CE2 3.52Å; Y508-Y545 HydrophobicContact CG-CE2 3.52Å; Y508-Y545 AromaticContact CZ-CD2 3.64Å
509	E	53.5	Low	68.1	Low	128 Å²	128	41 Å²	41	60%	0.598	20%	0.196	S	C	*	.	S	Bend	trans	-100.7	144.7	168.8	-57.9	-178.8	-170.8	0	0	108.2	E506 M511	E506-E509 PolarHBondContact O-N 2.79Å; E506-E509 VanDerWaalsContact O-O 3.1Å; E509-M511 PolarHBondContact O-N 3.2Å
510	E	51.7	Low	70.3	Confident	144 Å²	144	39.9 Å²	39.9	67%	0.673	19%	0.19	S	C	*	.	S	Bend	trans	-74.4	8.2	-175.7	-63	-157.9	161	0	0	114.3	K490	K490-E510 IonicContact NZ-OE1 2.67Å; K490-E510 PolarHBondContact NZ-OE1 3.46Å; K490-E510 IonicContact NZ-OE2 2.69Å; K490-E510 PolarHBondContact NZ-OE2 2.79Å
511	M	54	Low	72.3	Confident	149 Å²	149	39.5 Å²	39.5	73%	0.734	19%	0.187	S	C	*	.			trans	-123	85.5	-177.5	-62.6	-170.5	-60.6	0	0	111.1	E509	E509-M511 PolarHBondContact O-N 3.2Å
512	Y	66.2	Low	74.1	Confident	48 Å²	48	38.1 Å²	38.1	19%	0.188	18%	0.181	C	C	.	.			trans	-116.1	157.7	175.4	53.5	-99	0	0	0	112.1	I459 R461 N489 M507 V516	I459-Y512 HydrophobicContact CD1-CD2 4.17Å; I459-Y512 HydrophobicContact CD1-CE2 4.41Å; I459-Y512 HydrophobicContact CG2-CD2 4.47Å; R461-Y512 WeakPolarHBondContact CD-OH 3.48Å; R461-Y512 HydrophobicContact CG-CD2 4.47Å; R461-Y512 HydrophobicContact CG-CE2 3.86Å; R461-Y512 PolarHBondContact NH1-OH 2.92Å; N489-Y512 VanDerWaalsContact CG-OH 3.3Å; N489-Y512 PolarHBondContact ND2-OH 2.84Å; N489-Y512 PolarHBondContact OD1-OH 3.48Å; M507-Y512 HydrophobicContact SD-CD1 4.09Å; M507-Y512 HydrophobicContact SD-CE1 4.32Å; M507-Y512 HydrophobicContact SD-CG 4.38Å; Y512-V516 HydrophobicContact CG-CG1 4.47Å
513	D	81.7	Confident	75.9	Confident	39 Å²	39	37.6 Å²	37.6	21%	0.209	18%	0.178	C	C	.	.			trans	-126.8	-166.1	-178.4	55.9	52.2	0	0	0	111	S515 V516 R579	D513-S515 PolarHBondContact O-N 3.16Å; D513-S515 VanDerWaalsContact O-N 3.16Å; D513-S515 WeakPolarHBondContact OD1-CB 3.37Å; D513-S515 PolarHBondContact OD1-N 2.69Å; D513-S515 PolarHBondContact OD1-OG 3.15Å; D513-V516 WeakPolarHBondContact O-CG2 3.39Å; D513-R579 WeakPolarHBondContact OD2-CD 3.33Å; D513-R579 IonicContact OD2-CZ 2.67Å; D513-R579 IonicContact OD2-NE 3.55Å; D513-R579 IonicContact OD2-NH1 3.4Å; D513-R579 PolarHBondContact OD2-NH1 3.4Å
514	E	88.5	Confident	77.5	Confident	68 Å²	68	36.6 Å²	36.6	32%	0.318	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-19.1	-178.7	-59.7	82.9	-176.4	0	0	114.3	H452 P457 I459 V516 D517	H452-E514 HydrophobicContact CB-CG 3.89Å; P457-E514 WeakPolarHBondContact CB-OE1 3.48Å; I459-E514 HydrophobicContact CG1-CG 4.38Å; E514-V516 PolarHBondContact O-N 3.37Å; E514-D517 PolarHBondContact O-N 2.94Å; E514-D517 VanDerWaalsContact O-N 3.16Å
515	S	91.2	Very high	79.5	Confident	16 Å²	16	36.6 Å²	36.6	11%	0.112	17%	0.174	C	C	.	.	H	α-helix	trans	-70.2	-14.2	-176.1	72.8	0	0	0	0	114.3	D513 D517 V518 Y519 R579 R582	D513-S515 PolarHBondContact O-N 3.16Å; D513-S515 VanDerWaalsContact O-N 3.16Å; D513-S515 WeakPolarHBondContact OD1-CB 3.37Å; D513-S515 PolarHBondContact OD1-N 2.69Å; D513-S515 PolarHBondContact OD1-OG 3.15Å; S515-D517 VanDerWaalsContact C-N 3.32Å; S515-V518 WeakPolarHBondContact O-CB 3.36Å; S515-V518 PolarHBondContact O-N 2.72Å; S515-Y519 PolarHBondContact O-N 3.37Å; S515-Y519 VanDerWaalsContact O-N 3.09Å; S515-R579 VanDerWaalsContact OG-CB 3.29Å; S515-R579 WeakPolarHBondContact OG-CB 3.23Å; S515-R582 PolarHBondContact O-NH1 3.2Å; S515-R582 VanDerWaalsContact O-NH1 3.08Å; S515-R582 PolarHBondContact OG-NH1 2.83Å
516	V	90	Very high	81.2	Confident	3 Å²	3	35.9 Å²	35.9	2%	0.018	17%	0.169	C	C	.	.	H	α-helix	trans	-66.9	-36.4	170.9	-59.3	0	0	0	0	111.6	I459 A504 E506 M507 Y512 D513 E514 V518 Y519 A520	I459-V516 HydrophobicContact CG2-CG2 3.51Å; A504-V516 HydrophobicContact CB-CB 4.42Å; A504-V516 HydrophobicContact CB-CG1 4.21Å; E506-V516 HydrophobicContact CG-CG1 4.43Å; E506-V516 WeakPolarHBondContact OE1-CG1 3.49Å; M507-V516 HydrophobicContact CE-CB 3.56Å; M507-V516 HydrophobicContact CE-CG1 3.76Å; M507-V516 HydrophobicContact CE-CG2 3.64Å; Y512-V516 HydrophobicContact CG-CG1 4.47Å; D513-V516 WeakPolarHBondContact O-CG2 3.39Å; E514-V516 PolarHBondContact O-N 3.37Å; V516-V518 VanDerWaalsContact C-N 3.31Å; V516-Y519 PolarHBondContact O-N 3.32Å; V516-A520 WeakPolarHBondContact O-CB 3.31Å; V516-A520 PolarHBondContact O-N 3Å
517	D	93.3	Very high	82.6	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-73.9	-27.9	178.5	-65.3	-25	0	0	0	110.8	L448 H452 H460 R461 E514 S515 F521	L448-D517 HydrophobicContact CD1-CB 4.21Å; L448-D517 HydrophobicContact CD2-CB 3.94Å; H452-D517 IonicContact CD2-OD2 3.34Å; H452-D517 IonicContact CE1-OD2 2.8Å; H452-D517 IonicContact NE2-OD2 3.63Å; H452-D517 PolarHBondContact NE2-OD2 3.4Å; H460-D517 WeakPolarHBondContact CB-OD1 3.37Å; H460-D517 PolarHBondContact N-OD1 3.14Å; H460-D517 PolarHBondContact N-OD2 3.42Å; R461-D517 PolarHBondContact N-OD1 3.44Å; E514-D517 PolarHBondContact O-N 2.94Å; E514-D517 VanDerWaalsContact O-N 3.16Å; S515-D517 VanDerWaalsContact C-N 3.32Å; D517-F521 VanDerWaalsContact O-CB 3.24Å; D517-F521 WeakPolarHBondContact O-CB 3.37Å; D517-F521 PolarHBondContact O-N 3.39Å
518	V	95.8	Very high	84.5	Confident	5 Å²	5	34.2 Å²	34.2	3%	0.03	16%	0.161	C	C	.	.	H	α-helix	trans	-65.5	-48.3	169.9	170.3	0	0	0	0	111	S515 V516 A520 F521 G522 C574 R582 S583 V585 L588	S515-V518 WeakPolarHBondContact O-CB 3.36Å; S515-V518 PolarHBondContact O-N 2.72Å; V516-V518 VanDerWaalsContact C-N 3.31Å; V518-A520 VanDerWaalsContact C-N 3.34Å; V518-A520 PolarHBondContact O-N 3.01Å; V518-F521 WeakPolarHBondContact O-CB 3.15Å; V518-F521 PolarHBondContact O-N 3.08Å; V518-G522 PolarHBondContact O-N 2.63Å; V518-C574 HydrophobicContact CG1-CB 4.2Å; V518-R582 HydrophobicContact CG1-CB 4.28Å; V518-S583 WeakPolarHBondContact CG1-O 3.43Å; V518-V585 HydrophobicContact CG2-CG2 3.73Å; V518-L588 HydrophobicContact CG1-CD1 4.25Å
519	Y	95.3	Very high	86.6	Confident	4 Å²	4	31.2 Å²	31.2	2%	0.016	15%	0.152	C	C	.	.	H	α-helix	trans	-59.2	-47.3	177.1	-178.8	-84.9	0	0	0	111	M503 A504 S515 V516 F521 G522 M523 V548 C574 I575	M503-Y519 VanDerWaalsContact O-CE1 3.28Å; M503-Y519 WeakPolarHBondContact O-CE1 3.42Å; A504-Y519 HydrophobicContact CB-CD1 3.87Å; A504-Y519 HydrophobicContact CB-CD2 4.23Å; A504-Y519 HydrophobicContact CB-CE1 4.49Å; A504-Y519 HydrophobicContact CB-CG 3.72Å; S515-Y519 PolarHBondContact O-N 3.37Å; S515-Y519 VanDerWaalsContact O-N 3.09Å; V516-Y519 PolarHBondContact O-N 3.32Å; Y519-F521 PolarHBondContact O-N 2.84Å; Y519-G522 PolarHBondContact O-N 3.04Å; Y519-G522 VanDerWaalsContact O-N 3.14Å; Y519-M523 HydrophobicContact CD1-CG 4.42Å; Y519-M523 HydrophobicContact CE1-CE 3.84Å; Y519-M523 HydrophobicContact CE1-CG 4.09Å; Y519-M523 HydrophobicContact CE2-CE 4.27Å; Y519-M523 PolarHBondContact O-N 2.81Å; Y519-M523 VanDerWaalsContact O-N 3.07Å; Y519-M523 VanDerWaalsContact OH-CE 3.25Å; Y519-M523 WeakPolarHBondContact OH-CE 3.45Å; Y519-V548 WeakPolarHBondContact OH-CG1 3.5Å; Y519-C574 WeakPolarHBondContact CA-O 3.17Å; Y519-I575 HydrophobicContact CD2-CB 4.21Å; Y519-I575 HydrophobicContact CE2-CB 4.01Å
520	A	94.9	Very high	88.5	Confident	4 Å²	4	26.4 Å²	26.4	3%	0.033	13%	0.131	C	C	.	.	H	α-helix	trans	-64	-36.6	176.9	0	0	0	0	0	112.9	L463 V516 V518 M523 C524	L463-A520 HydrophobicContact CB-CB 3.83Å; L463-A520 HydrophobicContact CD2-CB 4.32Å; L463-A520 HydrophobicContact CG-CB 4.49Å; V516-A520 WeakPolarHBondContact O-CB 3.31Å; V516-A520 PolarHBondContact O-N 3Å; V518-A520 VanDerWaalsContact C-N 3.34Å; V518-A520 PolarHBondContact O-N 3.01Å; A520-M523 PolarHBondContact O-N 3.39Å; A520-C524 PolarHBondContact O-N 3.09Å
521	F	97.5	Very high	90.3	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-61.8	-41.9	170.9	167	-97.1	0	0	0	111.9	C441 I444 L445 L448 L463 D517 V518 Y519 M523 C524 L525 L588 F594	C441-F521 HydrophobicContact CB-CE2 4.03Å; C441-F521 HydrophobicContact CB-CZ 4.05Å; I444-F521 HydrophobicContact CB-CD2 4.34Å; I444-F521 HydrophobicContact CB-CE2 4.38Å; I444-F521 HydrophobicContact CG2-CD2 3.81Å; I444-F521 HydrophobicContact CG2-CE2 4.33Å; L445-F521 HydrophobicContact CD1-CE1 4.19Å; L445-F521 HydrophobicContact CD1-CE2 4.24Å; L445-F521 HydrophobicContact CD1-CZ 3.7Å; L445-F521 HydrophobicContact CD2-CD1 3.97Å; L445-F521 HydrophobicContact CD2-CD2 4.16Å; L445-F521 HydrophobicContact CD2-CE1 3.81Å; L445-F521 HydrophobicContact CD2-CE2 3.99Å; L445-F521 HydrophobicContact CD2-CG 4.15Å; L445-F521 HydrophobicContact CD2-CZ 3.82Å; L445-F521 HydrophobicContact CG-CD2 4.3Å; L445-F521 HydrophobicContact CG-CE1 4.16Å; L445-F521 HydrophobicContact CG-CE2 3.73Å; L445-F521 HydrophobicContact CG-CZ 3.65Å; L448-F521 HydrophobicContact CD1-CB 4.25Å; L463-F521 HydrophobicContact CD2-CB 4.09Å; D517-F521 VanDerWaalsContact O-CB 3.24Å; D517-F521 WeakPolarHBondContact O-CB 3.37Å; D517-F521 PolarHBondContact O-N 3.39Å; V518-F521 WeakPolarHBondContact O-CB 3.15Å; V518-F521 PolarHBondContact O-N 3.08Å; Y519-F521 PolarHBondContact O-N 2.84Å; F521-M523 VanDerWaalsContact C-N 3.31Å; F521-M523 PolarHBondContact O-N 3.4Å; F521-C524 WeakPolarHBondContact O-CB 3.49Å; F521-C524 PolarHBondContact O-N 3.37Å; F521-L525 HydrophobicContact CE1-CD2 4.46Å; F521-L525 WeakPolarHBondContact O-CB 3.39Å; F521-L525 PolarHBondContact O-N 3.25Å; F521-L588 HydrophobicContact CD1-CD1 4.17Å; F521-L588 HydrophobicContact CE1-CD1 4.19Å; F521-F594 HydrophobicContact CE1-CZ 4.44Å; F521-F594 AromaticContact CZ-CZ 3.97Å; F521-F594 HydrophobicContact CZ-CZ 3.97Å
522	G	97	Very high	92.1	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-58	-41.9	173.4	0	0	0	0	0	112.7	V518 Y519 L525 L526	V518-G522 PolarHBondContact O-N 2.63Å; Y519-G522 PolarHBondContact O-N 3.04Å; Y519-G522 VanDerWaalsContact O-N 3.14Å; G522-L525 PolarHBondContact O-N 2.87Å; G522-L526 WeakPolarHBondContact O-CB 3.31Å; G522-L526 PolarHBondContact O-N 3.14Å
523	M	96	Very high	93.2	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-69.2	-37.1	175	-66.7	-58.7	-177.9	0	0	113	F502 Y519 A520 F521 L526 E527 P534 Y535 P554 I575	F502-M523 HydrophobicContact CD1-CB 3.66Å; F502-M523 HydrophobicContact CE1-CB 3.87Å; F502-M523 HydrophobicContact CG-CB 4.3Å; Y519-M523 HydrophobicContact CD1-CG 4.42Å; Y519-M523 HydrophobicContact CE1-CE 3.84Å; Y519-M523 HydrophobicContact CE1-CG 4.09Å; Y519-M523 HydrophobicContact CE2-CE 4.27Å; Y519-M523 PolarHBondContact O-N 2.81Å; Y519-M523 VanDerWaalsContact O-N 3.07Å; Y519-M523 VanDerWaalsContact OH-CE 3.25Å; Y519-M523 WeakPolarHBondContact OH-CE 3.45Å; A520-M523 PolarHBondContact O-N 3.39Å; F521-M523 VanDerWaalsContact C-N 3.31Å; F521-M523 PolarHBondContact O-N 3.4Å; M523-L526 PolarHBondContact O-N 3.47Å; M523-L526 HydrophobicContact SD-CD2 4.21Å; M523-E527 PolarHBondContact O-N 3.14Å; M523-P534 HydrophobicContact CB-CG 4.31Å; M523-P534 HydrophobicContact SD-CB 3.97Å; M523-P534 HydrophobicContact SD-CG 4.26Å; M523-Y535 HydrophobicContact CE-CE2 3.82Å; M523-P554 HydrophobicContact SD-CG 4.5Å; M523-I575 HydrophobicContact CE-CB 4.16Å; M523-I575 HydrophobicContact CE-CD1 4.28Å; M523-I575 HydrophobicContact CE-CG2 3.92Å; M523-I575 HydrophobicContact CG-CG2 4.35Å; M523-I575 HydrophobicContact SD-CG2 4.15Å
524	C	97	Very high	93.8	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61.1	-44.4	170.3	-78	0	0	0	0	112.6	K464 C465 A520 F521 L526 E527 M528	K464-C524 VanDerWaalsContact C-SG 3.52Å; K464-C524 WeakPolarHBondContact CA-SG 3.41Å; C465-C524 PolarHBondContact N-SG 3.41Å; C465-C524 VanDerWaalsContact SG-SG 3.68Å; A520-C524 PolarHBondContact O-N 3.09Å; F521-C524 WeakPolarHBondContact O-CB 3.49Å; F521-C524 PolarHBondContact O-N 3.37Å; C524-L526 VanDerWaalsContact C-N 3.34Å; C524-E527 PolarHBondContact O-N 2.94Å; C524-M528 WeakPolarHBondContact O-CB 3.37Å; C524-M528 WeakPolarHBondContact O-CG 3.24Å; C524-M528 PolarHBondContact O-N 3.41Å
525	L	96.8	Very high	94	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.1	-42	177	176.3	56.2	0	0	0	110.9	L437 F521 G522 M528 V529 I567 I570 I571 F594	L437-L525 HydrophobicContact CD1-CD1 4.13Å; L437-L525 HydrophobicContact CD2-CD1 4.29Å; L437-L525 HydrophobicContact CG-CD1 4.35Å; F521-L525 HydrophobicContact CE1-CD2 4.46Å; F521-L525 WeakPolarHBondContact O-CB 3.39Å; F521-L525 PolarHBondContact O-N 3.25Å; G522-L525 PolarHBondContact O-N 2.87Å; L525-M528 PolarHBondContact O-N 3.46Å; L525-V529 HydrophobicContact CD1-CG2 3.81Å; L525-V529 HydrophobicContact CG-CG2 4.43Å; L525-V529 WeakPolarHBondContact O-CB 3.44Å; L525-V529 WeakPolarHBondContact O-CG2 3.48Å; L525-V529 PolarHBondContact O-N 3.24Å; L525-I567 HydrophobicContact CD1-CG2 4.39Å; L525-I567 HydrophobicContact CG-CG2 4.47Å; L525-I570 HydrophobicContact CD2-CG2 3.72Å; L525-I571 HydrophobicContact CB-CG1 4.21Å; L525-I571 HydrophobicContact CD2-CD1 4.42Å; L525-I571 HydrophobicContact CD2-CG1 3.67Å; L525-I571 HydrophobicContact CG-CD1 3.99Å; L525-I571 HydrophobicContact CG-CG1 3.69Å; L525-F594 HydrophobicContact CD2-CZ 4.3Å
526	L	95.8	Very high	94	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-61.5	-46.6	174.8	-179.4	62.8	0	0	0	112.8	G522 M523 C524 M528 V529 T530 P534 P554 F557 I560 I571	G522-L526 WeakPolarHBondContact O-CB 3.31Å; G522-L526 PolarHBondContact O-N 3.14Å; M523-L526 PolarHBondContact O-N 3.47Å; M523-L526 HydrophobicContact SD-CD2 4.21Å; C524-L526 VanDerWaalsContact C-N 3.34Å; L526-M528 VanDerWaalsContact C-N 3.33Å; L526-M528 PolarHBondContact O-N 2.88Å; L526-V529 PolarHBondContact O-N 2.97Å; L526-T530 HydrophobicContact CD1-CG2 3.78Å; L526-T530 WeakPolarHBondContact O-CB 3.43Å; L526-T530 WeakPolarHBondContact O-CG2 3.49Å; L526-T530 PolarHBondContact O-N 3.21Å; L526-T530 PolarHBondContact O-OG1 3.35Å; L526-P534 HydrophobicContact CD2-CG 4.44Å; L526-P554 HydrophobicContact CD2-CG 3.46Å; L526-P554 VanDerWaalsContact CD2-CG 3.46Å; L526-F557 HydrophobicContact CD1-CB 4.49Å; L526-I560 HydrophobicContact CD1-CD1 3.96Å; L526-I560 HydrophobicContact CD1-CG1 3.9Å; L526-I571 HydrophobicContact CB-CD1 4.13Å; L526-I571 HydrophobicContact CB-CG2 4.32Å; L526-I571 HydrophobicContact CD1-CD1 4.2Å
527	E	95.2	Very high	94.1	Very high	14 Å²	14	19.3 Å²	19.3	7%	0.065	11%	0.11	C	C	.	.	H	α-helix	trans	-61.6	-41.4	176.1	-165.5	-172.7	179.8	0	0	111.1	L426 C465 F502 M523 C524 V529 G531 P534	L426-E527 HydrophobicContact CD1-CG 4.04Å; C465-E527 WeakPolarHBondContact CB-OE2 3.34Å; C465-E527 PolarHBondContact SG-OE2 3.47Å; F502-E527 WeakPolarHBondContact CZ-OE2 3.48Å; M523-E527 PolarHBondContact O-N 3.14Å; C524-E527 PolarHBondContact O-N 2.94Å; E527-V529 PolarHBondContact O-N 3.07Å; E527-G531 WeakPolarHBondContact O-CA 3.43Å; E527-G531 PolarHBondContact O-N 2.98Å; E527-P534 HydrophobicContact CB-CG 4.4Å
528	M	94.1	Very high	93.9	Very high	4 Å²	4	20.1 Å²	20.1	2%	0.02	12%	0.116	C	C	.	.	H	α-helix	trans	-66.7	-33.7	178.2	-80.4	-168.5	-69.3	0	0	114.4	L422 L426 I432 L437 W440 C441 I444 C524 L525 L526	L422-M528 HydrophobicContact CD1-CE 4.49Å; L422-M528 HydrophobicContact CD1-SD 3.78Å; L422-M528 HydrophobicContact CD2-SD 4.34Å; L426-M528 HydrophobicContact CD1-CG 4.08Å; I432-M528 HydrophobicContact CD1-CB 3.91Å; I432-M528 HydrophobicContact CD1-CG 3.85Å; I432-M528 HydrophobicContact CD1-SD 4.25Å; L437-M528 HydrophobicContact CD1-CB 3.57Å; L437-M528 HydrophobicContact CD1-CE 4.16Å; L437-M528 HydrophobicContact CD1-CG 4.36Å; L437-M528 HydrophobicContact CD1-SD 3.97Å; W440-M528 HydrophobicContact CE3-SD 4.39Å; C441-M528 WeakPolarHBondContact SG-CE 3.46Å; I444-M528 HydrophobicContact CD1-CE 4.25Å; C524-M528 WeakPolarHBondContact O-CB 3.37Å; C524-M528 WeakPolarHBondContact O-CG 3.24Å; C524-M528 PolarHBondContact O-N 3.41Å; L525-M528 PolarHBondContact O-N 3.46Å; L526-M528 VanDerWaalsContact C-N 3.33Å; L526-M528 PolarHBondContact O-N 2.88Å
529	V	93.7	Very high	93.3	Very high	29 Å²	29	26.8 Å²	26.8	18%	0.176	15%	0.148	C	C	.	.	H	α-helix	trans	-82.5	-40.3	-177.4	168.9	0	0	0	0	111.9	L437 L525 L526 E527 I560 I567	L437-V529 HydrophobicContact CD1-CG2 4.4Å; L437-V529 HydrophobicContact CD2-CG2 3.61Å; L525-V529 HydrophobicContact CD1-CG2 3.81Å; L525-V529 HydrophobicContact CG-CG2 4.43Å; L525-V529 WeakPolarHBondContact O-CB 3.44Å; L525-V529 WeakPolarHBondContact O-CG2 3.48Å; L525-V529 PolarHBondContact O-N 3.24Å; L526-V529 PolarHBondContact O-N 2.97Å; E527-V529 PolarHBondContact O-N 3.07Å; V529-I560 HydrophobicContact CG1-CG2 4.11Å; V529-I567 HydrophobicContact CB-CG2 4.49Å; V529-I567 HydrophobicContact CG1-CG2 4.22Å; V529-I567 HydrophobicContact CG2-CD1 4.37Å; V529-I567 HydrophobicContact CG2-CG2 3.63Å
530	T	92	Very high	92.6	Very high	27 Å²	27	29.8 Å²	29.8	17%	0.166	17%	0.165	C	C	.	.	H	α-helix	trans	-88.7	-27.2	-176.9	59.7	0	0	0	0	112.9	L526 E532 C556 I560	L526-T530 HydrophobicContact CD1-CG2 3.78Å; L526-T530 WeakPolarHBondContact O-CB 3.43Å; L526-T530 WeakPolarHBondContact O-CG2 3.49Å; L526-T530 PolarHBondContact O-N 3.21Å; L526-T530 PolarHBondContact O-OG1 3.35Å; T530-E532 PolarHBondContact O-N 2.71Å; T530-E532 PolarHBondContact OG1-N 2.9Å; T530-E532 VanDerWaalsContact OG1-N 3.13Å; T530-E532 PolarHBondContact OG1-O 2.94Å; T530-C556 HydrophobicContact CG2-CB 4.14Å; T530-C556 WeakPolarHBondContact CG2-O 3.42Å; T530-I560 HydrophobicContact CG2-CG1 4.46Å
531	G	90.8	Very high	91.8	Very high	36 Å²	36	32.1 Å²	32.1	37%	0.371	18%	0.179	S	C	.	.	S	Bend	trans	70.4	9.2	-166.4	0	0	0	0	0	113.4	E527	E527-G531 WeakPolarHBondContact O-CA 3.43Å; E527-G531 PolarHBondContact O-N 2.98Å
532	E	91	Very high	90.7	Very high	67 Å²	67	34.4 Å²	34.4	31%	0.313	20%	0.198	S	C	.	.	S	Bend	trans	-117	139.1	-177.6	-63.3	-170.4	129.9	0	0	110.9	T530 C556 R559	T530-E532 PolarHBondContact O-N 2.71Å; T530-E532 PolarHBondContact OG1-N 2.9Å; T530-E532 VanDerWaalsContact OG1-N 3.13Å; T530-E532 PolarHBondContact OG1-O 2.94Å; E532-C556 HydrophobicContact CB-CB 4.22Å; E532-R559 IonicContact OE1-CZ 2.71Å; E532-R559 IonicContact OE1-NH1 3.64Å; E532-R559 PolarHBondContact OE1-NH1 3.01Å; E532-R559 VanDerWaalsContact OE2-CD 3.31Å; E532-R559 WeakPolarHBondContact OE2-CD 3.3Å; E532-R559 IonicContact OE2-CZ 3.94Å; E532-R559 IonicContact OE2-NE 2.92Å; E532-R559 IonicContact OE2-NH1 2.71Å; E532-R559 PolarHBondContact OE2-NH1 2.94Å
533	Y	90.4	Very high	90.3	Very high	79 Å²	79	36.1 Å²	36.1	31%	0.31	21%	0.209	S	C	.	.			trans	-68.6	129.1	179.6	-168.5	-102.4	0	0	0	110.4	T499 E501 F502 S536	T499-Y533 WeakPolarHBondContact CG2-OH 3.35Å; E501-Y533 HydrophobicContact CB-CE1 4.04Å; E501-Y533 HydrophobicContact CG-CD1 4.4Å; E501-Y533 HydrophobicContact CG-CE1 3.61Å; E501-Y533 PolarHBondContact OE2-OH 3Å; F502-Y533 HydrophobicContact CE2-CD2 4.28Å; F502-Y533 AromaticContact CE2-CE2 3.6Å; F502-Y533 HydrophobicContact CE2-CE2 3.6Å; F502-Y533 AromaticContact CE2-CZ 3.78Å; F502-Y533 HydrophobicContact CZ-CE2 4.22Å; Y533-S536 WeakPolarHBondContact O-CB 3.46Å; Y533-S536 PolarHBondContact O-N 2.9Å; Y533-S536 PolarHBondContact O-OG 3.47Å
534	P	93	Very high	89.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	143.3	178.1	-27.8	35.8	0	0	0	112.5	F502 M523 L526 E527 S536	F502-P534 HydrophobicContact CE2-CG 4.45Å; F502-P534 HydrophobicContact CZ-CG 4.15Å; M523-P534 HydrophobicContact CB-CG 4.31Å; M523-P534 HydrophobicContact SD-CB 3.97Å; M523-P534 HydrophobicContact SD-CG 4.26Å; L526-P534 HydrophobicContact CD2-CG 4.44Å; E527-P534 HydrophobicContact CB-CG 4.4Å; P534-S536 PolarHBondContact O-N 3.12Å
535	Y	93.5	Very high	89	Confident	6 Å²	6	40.8 Å²	40.8	2%	0.024	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	21.2	-177.8	-66	-70.8	0	0	0	115.9	E501 M523 E537 C538 I544 K547 V548 V552 P554	E501-Y535 HydrophobicContact CB-CD2 4.44Å; M523-Y535 HydrophobicContact CE-CE2 3.82Å; Y535-E537 VanDerWaalsContact CA-OE2 3.27Å; Y535-E537 WeakPolarHBondContact CA-OE2 3.42Å; Y535-E537 PolarHBondContact O-N 2.86Å; Y535-C538 VanDerWaalsContact O-CB 3.25Å; Y535-C538 WeakPolarHBondContact O-CB 3.43Å; Y535-C538 PolarHBondContact O-N 3.1Å; Y535-I544 HydrophobicContact CD2-CG2 3.98Å; Y535-I544 HydrophobicContact CG-CG2 4.09Å; Y535-K547 HydrophobicContact CD1-CB 4.46Å; Y535-K547 HydrophobicContact CD1-CD 3.84Å; Y535-K547 HydrophobicContact CE1-CB 3.84Å; Y535-K547 HydrophobicContact CE1-CD 3.73Å; Y535-K547 HydrophobicContact CE1-CG 4.48Å; Y535-V548 HydrophobicContact CD2-CG2 4.49Å; Y535-V548 HydrophobicContact CE2-CG2 3.63Å; Y535-V552 VanDerWaalsContact CE1-O 3.28Å; Y535-V552 WeakPolarHBondContact CE1-O 3.06Å; Y535-V552 PolarHBondContact OH-O 2.89Å; Y535-P554 HydrophobicContact CD1-CB 3.7Å; Y535-P554 HydrophobicContact CD2-CB 4.04Å; Y535-P554 HydrophobicContact CE1-CB 3.83Å; Y535-P554 HydrophobicContact CE1-CG 4.5Å; Y535-P554 HydrophobicContact CE2-CB 4.17Å; Y535-P554 HydrophobicContact CE2-CG 4.31Å; Y535-P554 HydrophobicContact CG-CB 3.81Å
536	S	91.4	Very high	88.4	Confident	76 Å²	76	47.5 Å²	47.5	53%	0.531	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-11.2	179	49.7	0	0	0	0	115	Y533 P534 C538	Y533-S536 WeakPolarHBondContact O-CB 3.46Å; Y533-S536 PolarHBondContact O-N 2.9Å; Y533-S536 PolarHBondContact O-OG 3.47Å; P534-S536 PolarHBondContact O-N 3.12Å; S536-C538 VanDerWaalsContact C-N 3.25Å; S536-C538 PolarHBondContact O-N 2.93Å
537	E	91.3	Very high	88.2	Confident	54 Å²	54	49.7 Å²	49.7	25%	0.252	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-10	167	76.7	-74	176.3	0	0	114.2	Y535 K547 E555	Y535-E537 VanDerWaalsContact CA-OE2 3.27Å; Y535-E537 WeakPolarHBondContact CA-OE2 3.42Å; Y535-E537 PolarHBondContact O-N 2.86Å; E537-K547 IonicContact OE1-NZ 3.22Å; E537-K547 PolarHBondContact OE1-NZ 2.6Å; E537-E555 HydrophobicContact CB-CB 4.44Å; E537-E555 HydrophobicContact CG-CB 4.07Å; E537-E555 PolarHBondContact OE1-N 2.83Å; E537-E555 PolarHBondContact OE2-N 2.88Å
538	C	88.8	Confident	87.8	Confident	18 Å²	18	49.4 Å²	49.4	12%	0.122	26%	0.261	C	S	.	.			trans	-97	124.1	-177.4	-60.4	0	0	0	0	112.1	Y535 S536 N540 T543 I544	Y535-C538 VanDerWaalsContact O-CB 3.25Å; Y535-C538 WeakPolarHBondContact O-CB 3.43Å; Y535-C538 PolarHBondContact O-N 3.1Å; S536-C538 VanDerWaalsContact C-N 3.25Å; S536-C538 PolarHBondContact O-N 2.93Å; C538-N540 VanDerWaalsContact C-N 3.35Å; C538-N540 PolarHBondContact O-N 3.34Å; C538-T543 HydrophobicContact CB-CG2 4.19Å; C538-I544 HydrophobicContact CB-CD1 4.22Å; C538-I544 HydrophobicContact CB-CG1 3.49Å; C538-I544 VanDerWaalsContact CB-CG1 3.49Å
539	M	84.4	Confident	87.4	Confident	144 Å²	144	53 Å²	53	71%	0.709	28%	0.28	S	S	*	.	S	Bend	trans	-77.8	-10.6	-177.3	-59.3	-170.5	76.5	0	0	115.4	N213	N213-M539 HydrophobicContact CB-CE 3.85Å; N213-M539 WeakPolarHBondContact ND2-CE 3.41Å
540	N	79.2	Confident	87.1	Confident	68 Å²	68	54.1 Å²	54.1	36%	0.364	29%	0.289	S	S	.	.	S	Bend	trans	-157.6	155.1	-178.1	65.9	73.3	0	0	0	113.4	C538 A542 T543 I544	C538-N540 VanDerWaalsContact C-N 3.35Å; C538-N540 PolarHBondContact O-N 3.34Å; N540-A542 VanDerWaalsContact C-N 3.29Å; N540-A542 PolarHBondContact O-N 3.11Å; N540-A542 WeakPolarHBondContact OD1-CB 3.45Å; N540-A542 PolarHBondContact OD1-N 2.98Å; N540-A542 VanDerWaalsContact OD1-N 3.16Å; N540-T543 PolarHBondContact ND2-OG1 3.49Å; N540-T543 PolarHBondContact O-N 3.31Å; N540-T543 VanDerWaalsContact O-N 3.13Å; N540-T543 PolarHBondContact OD1-N 3.08Å; N540-T543 PolarHBondContact OD1-OG1 2.83Å; N540-I544 PolarHBondContact O-N 2.8Å
541	P	78.3	Confident	86.9	Confident	52 Å²	52	54.5 Å²	54.5	34%	0.338	30%	0.298	S	S	.	.	H	α-helix	trans	-52.1	-37.2	178.1	-32.1	38	0	0	0	115.5	V496 P500 T543 I544 Y545	V496-P541 HydrophobicContact CG1-CB 4.41Å; V496-P541 HydrophobicContact CG1-CG 3.96Å; V496-P541 HydrophobicContact CG2-CG 4.01Å; P500-P541 HydrophobicContact CB-CB 4.23Å; P500-P541 HydrophobicContact CG-CB 3.83Å; P500-P541 HydrophobicContact CG-CG 3.97Å; P541-T543 VanDerWaalsContact C-N 3.32Å; P541-T543 PolarHBondContact O-N 2.74Å; P541-I544 WeakPolarHBondContact O-CB 3.28Å; P541-I544 PolarHBondContact O-N 2.97Å; P541-Y545 WeakPolarHBondContact O-CB 3.39Å; P541-Y545 PolarHBondContact O-N 3.3Å
542	A	75.9	Confident	87	Confident	49 Å²	49	54.3 Å²	54.3	41%	0.405	29%	0.289	S	S	.	.	H	α-helix	trans	-69.7	-30.4	-177.4	0	0	0	0	0	112.4	N540 R546	N540-A542 VanDerWaalsContact C-N 3.29Å; N540-A542 PolarHBondContact O-N 3.11Å; N540-A542 WeakPolarHBondContact OD1-CB 3.45Å; N540-A542 PolarHBondContact OD1-N 2.98Å; N540-A542 VanDerWaalsContact OD1-N 3.16Å; A542-R546 VanDerWaalsContact C-NH1 3.29Å; A542-R546 WeakPolarHBondContact O-CG 3.28Å; A542-R546 PolarHBondContact O-N 2.87Å; A542-R546 VanDerWaalsContact O-N 3.14Å; A542-R546 PolarHBondContact O-NH1 3.04Å
543	T	87.6	Confident	87.2	Confident	36 Å²	36	54.6 Å²	54.6	22%	0.221	29%	0.29	C	S	.	.	H	α-helix	trans	-71.5	-37.9	172.8	-60.8	0	0	0	0	111.7	C538 N540 P541 R546 K547	C538-T543 HydrophobicContact CB-CG2 4.19Å; N540-T543 PolarHBondContact ND2-OG1 3.49Å; N540-T543 PolarHBondContact O-N 3.31Å; N540-T543 VanDerWaalsContact O-N 3.13Å; N540-T543 PolarHBondContact OD1-N 3.08Å; N540-T543 PolarHBondContact OD1-OG1 2.83Å; P541-T543 VanDerWaalsContact C-N 3.32Å; P541-T543 PolarHBondContact O-N 2.74Å; T543-R546 PolarHBondContact O-N 3.49Å; T543-R546 PolarHBondContact OG1-NH2 3.25Å; T543-K547 PolarHBondContact O-N 3.05Å; T543-K547 VanDerWaalsContact O-N 3.08Å
544	I	85	Confident	87.4	Confident	1 Å²	1	51 Å²	51	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-62.3	-52.2	174.4	-61.6	155	0	0	0	109.6	P500 E501 Y535 C538 N540 P541 R546 K547 V548	P500-I544 HydrophobicContact CG-CD1 4.25Å; P500-I544 WeakPolarHBondContact O-CG2 3.37Å; E501-I544 HydrophobicContact CG-CD1 3.66Å; E501-I544 HydrophobicContact CG-CG1 4.42Å; E501-I544 HydrophobicContact CG-CG2 4.45Å; E501-I544 WeakPolarHBondContact OE1-CD1 3.48Å; Y535-I544 HydrophobicContact CD2-CG2 3.98Å; Y535-I544 HydrophobicContact CG-CG2 4.09Å; C538-I544 HydrophobicContact CB-CD1 4.22Å; C538-I544 HydrophobicContact CB-CG1 3.49Å; C538-I544 VanDerWaalsContact CB-CG1 3.49Å; N540-I544 PolarHBondContact O-N 2.8Å; P541-I544 WeakPolarHBondContact O-CB 3.28Å; P541-I544 PolarHBondContact O-N 2.97Å; I544-R546 VanDerWaalsContact C-N 3.35Å; I544-R546 PolarHBondContact O-N 3.46Å; I544-K547 WeakPolarHBondContact O-CA 3.3Å; I544-K547 WeakPolarHBondContact O-CB 3.4Å; I544-K547 PolarHBondContact O-N 2.88Å; I544-V548 HydrophobicContact CG2-CG2 4.15Å; I544-V548 WeakPolarHBondContact O-CG2 3.46Å; I544-V548 PolarHBondContact O-N 2.89Å
545	Y	80.2	Confident	87.4	Confident	96 Å²	96	54.7 Å²	54.7	38%	0.376	29%	0.293	S	S	.	.	H	α-helix	trans	-50.9	-48.4	175.7	178.1	-104.9	0	0	0	113	Y508 P541 K547 V548 I549	Y508-Y545 HydrophobicContact CD1-CD2 4.02Å; Y508-Y545 AromaticContact CD1-CE2 3.73Å; Y508-Y545 HydrophobicContact CD1-CE2 3.73Å; Y508-Y545 AromaticContact CD2-CD2 3.85Å; Y508-Y545 HydrophobicContact CD2-CD2 3.85Å; Y508-Y545 AromaticContact CD2-CE2 3.66Å; Y508-Y545 HydrophobicContact CD2-CE2 3.66Å; Y508-Y545 AromaticContact CE1-CD2 3.84Å; Y508-Y545 HydrophobicContact CE1-CD2 3.84Å; Y508-Y545 HydrophobicContact CE1-CE2 4.04Å; Y508-Y545 AromaticContact CE2-CD2 3.65Å; Y508-Y545 HydrophobicContact CE2-CD2 3.65Å; Y508-Y545 AromaticContact CE2-CE2 3.97Å; Y508-Y545 HydrophobicContact CE2-CE2 3.97Å; Y508-Y545 HydrophobicContact CG-CD2 4.03Å; Y508-Y545 AromaticContact CG-CE2 3.52Å; Y508-Y545 HydrophobicContact CG-CE2 3.52Å; Y508-Y545 AromaticContact CZ-CD2 3.64Å; P541-Y545 WeakPolarHBondContact O-CB 3.39Å; P541-Y545 PolarHBondContact O-N 3.3Å; Y545-K547 PolarHBondContact O-N 2.86Å; Y545-V548 PolarHBondContact O-N 3.26Å; Y545-I549 HydrophobicContact CD1-CD1 4.37Å; Y545-I549 HydrophobicContact CD2-CD1 3.99Å; Y545-I549 HydrophobicContact CE1-CD1 3.82Å; Y545-I549 HydrophobicContact CE2-CD1 3.39Å; Y545-I549 HydrophobicContact CE2-CG1 4.43Å; Y545-I549 HydrophobicContact CG-CD1 4.45Å; Y545-I549 PolarHBondContact O-N 3.19Å; Y545-I549 VanDerWaalsContact O-N 3.09Å; Y545-I549 WeakPolarHBondContact OH-CD1 3.12Å
546	R	85.7	Confident	87.4	Confident	141 Å²	141	54.5 Å²	54.5	53%	0.532	29%	0.293	S	S	.	.	H	α-helix	trans	-62.2	-39.5	176.1	-73.4	-169.5	-52	-76.4	-2.5	112.7	A542 T543 I544 S550	A542-R546 VanDerWaalsContact C-NH1 3.29Å; A542-R546 WeakPolarHBondContact O-CG 3.28Å; A542-R546 PolarHBondContact O-N 2.87Å; A542-R546 VanDerWaalsContact O-N 3.14Å; A542-R546 PolarHBondContact O-NH1 3.04Å; T543-R546 PolarHBondContact O-N 3.49Å; T543-R546 PolarHBondContact OG1-NH2 3.25Å; I544-R546 VanDerWaalsContact C-N 3.35Å; I544-R546 PolarHBondContact O-N 3.46Å; R546-S550 WeakPolarHBondContact O-CB 3.38Å; R546-S550 PolarHBondContact O-N 2.8Å; R546-S550 PolarHBondContact O-OG 2.93Å
547	K	90.4	Very high	87.6	Confident	47 Å²	47	51.9 Å²	51.9	20%	0.204	27%	0.272	C	S	.	.	H	α-helix	trans	-65.1	-49.6	175.7	-79.7	-163.7	178.2	-162.7	0	112	Y535 E537 T543 I544 Y545 I549 S550 G551 V552	Y535-K547 HydrophobicContact CD1-CB 4.46Å; Y535-K547 HydrophobicContact CD1-CD 3.84Å; Y535-K547 HydrophobicContact CE1-CB 3.84Å; Y535-K547 HydrophobicContact CE1-CD 3.73Å; Y535-K547 HydrophobicContact CE1-CG 4.48Å; E537-K547 IonicContact OE1-NZ 3.22Å; E537-K547 PolarHBondContact OE1-NZ 2.6Å; T543-K547 PolarHBondContact O-N 3.05Å; T543-K547 VanDerWaalsContact O-N 3.08Å; I544-K547 WeakPolarHBondContact O-CA 3.3Å; I544-K547 WeakPolarHBondContact O-CB 3.4Å; I544-K547 PolarHBondContact O-N 2.88Å; Y545-K547 PolarHBondContact O-N 2.86Å; K547-I549 PolarHBondContact O-N 2.78Å; K547-S550 CarbonylContact O-C 3.56Å; K547-S550 PolarHBondContact O-N 3.33Å; K547-S550 PolarHBondContact O-OG 3.48Å; K547-G551 PolarHBondContact O-N 2.83Å; K547-G551 VanDerWaalsContact O-N 3.17Å; K547-V552 HydrophobicContact CB-CB 3.95Å; K547-V552 HydrophobicContact CB-CG1 4.29Å; K547-V552 HydrophobicContact CD-CB 4.43Å; K547-V552 HydrophobicContact CD-CG1 3.85Å; K547-V552 HydrophobicContact CG-CB 4.05Å; K547-V552 HydrophobicContact CG-CG1 3.93Å; K547-V552 PolarHBondContact O-N 3.08Å
548	V	87.3	Confident	87.7	Confident	7 Å²	7	53.8 Å²	53.8	4%	0.042	29%	0.291	C	S	.	.	H	α-helix	trans	-59	-47.7	-177.3	171.7	0	0	0	0	111.1	P505 Y519 Y535 I544 Y545 S550 G551	P505-V548 HydrophobicContact CB-CG1 4.01Å; P505-V548 HydrophobicContact CG-CG1 4.22Å; Y519-V548 WeakPolarHBondContact OH-CG1 3.5Å; Y535-V548 HydrophobicContact CD2-CG2 4.49Å; Y535-V548 HydrophobicContact CE2-CG2 3.63Å; I544-V548 HydrophobicContact CG2-CG2 4.15Å; I544-V548 WeakPolarHBondContact O-CG2 3.46Å; I544-V548 PolarHBondContact O-N 2.89Å; Y545-V548 PolarHBondContact O-N 3.26Å; V548-S550 PolarHBondContact O-N 2.74Å; V548-G551 PolarHBondContact O-N 3Å
549	I	85.2	Confident	87.8	Confident	80 Å²	80	57.8 Å²	57.8	41%	0.41	30%	0.304	S	S	.	.	H	α-helix	trans	-68	-32.7	178.3	-71.6	178.4	0	0	0	112.7	P505 Y545 K547 G551	P505-I549 HydrophobicContact CB-CG1 3.92Å; Y545-I549 HydrophobicContact CD1-CD1 4.37Å; Y545-I549 HydrophobicContact CD2-CD1 3.99Å; Y545-I549 HydrophobicContact CE1-CD1 3.82Å; Y545-I549 HydrophobicContact CE2-CD1 3.39Å; Y545-I549 HydrophobicContact CE2-CG1 4.43Å; Y545-I549 HydrophobicContact CG-CD1 4.45Å; Y545-I549 PolarHBondContact O-N 3.19Å; Y545-I549 VanDerWaalsContact O-N 3.09Å; Y545-I549 WeakPolarHBondContact OH-CD1 3.12Å; K547-I549 PolarHBondContact O-N 2.78Å; I549-G551 PolarHBondContact O-N 2.87Å
550	S	88	Confident	88.2	Confident	53 Å²	53	51.7 Å²	51.7	37%	0.371	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	8.6	175.2	55.6	0	0	0	0	114.2	R546 K547 V548 V552	R546-S550 WeakPolarHBondContact O-CB 3.38Å; R546-S550 PolarHBondContact O-N 2.8Å; R546-S550 PolarHBondContact O-OG 2.93Å; K547-S550 CarbonylContact O-C 3.56Å; K547-S550 PolarHBondContact O-N 3.33Å; K547-S550 PolarHBondContact O-OG 3.48Å; V548-S550 PolarHBondContact O-N 2.74Å; S550-V552 PolarHBondContact O-N 3.43Å; S550-V552 WeakPolarHBondContact OG-CG2 3.19Å
551	G	88.5	Confident	88.6	Confident	35 Å²	35	50.5 Å²	50.5	36%	0.361	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	11.6	-179.8	0	0	0	0	0	115.1	K547 V548 I549 K553	K547-G551 PolarHBondContact O-N 2.83Å; K547-G551 VanDerWaalsContact O-N 3.17Å; V548-G551 PolarHBondContact O-N 3Å; I549-G551 PolarHBondContact O-N 2.87Å; G551-K553 PolarHBondContact O-N 3.39Å; G551-K553 VanDerWaalsContact O-N 3.11Å
552	V	92.7	Very high	88.9	Confident	31 Å²	31	52.5 Å²	52.5	19%	0.188	29%	0.291	C	S	.	.			trans	-77.6	101.2	-179.7	-179.5	0	0	0	0	108.5	Y535 K547 S550 I1381	Y535-V552 VanDerWaalsContact CE1-O 3.28Å; Y535-V552 WeakPolarHBondContact CE1-O 3.06Å; Y535-V552 PolarHBondContact OH-O 2.89Å; K547-V552 HydrophobicContact CB-CB 3.95Å; K547-V552 HydrophobicContact CB-CG1 4.29Å; K547-V552 HydrophobicContact CD-CB 4.43Å; K547-V552 HydrophobicContact CD-CG1 3.85Å; K547-V552 HydrophobicContact CG-CB 4.05Å; K547-V552 HydrophobicContact CG-CG1 3.93Å; K547-V552 PolarHBondContact O-N 3.08Å; S550-V552 PolarHBondContact O-N 3.43Å; S550-V552 WeakPolarHBondContact OG-CG2 3.19Å; V552-I1381 HydrophobicContact CB-CD1 4.29Å; V552-I1381 HydrophobicContact CG1-CD1 3.81Å; V552-I1381 HydrophobicContact CG2-CD1 3.48Å; V552-I1381 VanDerWaalsContact CG2-CD1 3.48Å; V552-I1381 HydrophobicContact CG2-CG1 3.91Å
553	K	94.8	Very high	89.2	Confident	73 Å²	73	56.2 Å²	56.2	32%	0.317	30%	0.3	S	S	.	.			trans	-58.4	153.2	175.1	-66.6	-171.7	169.9	85.9	0	111.9	G551 F557 D572 I575	G551-K553 PolarHBondContact O-N 3.39Å; G551-K553 VanDerWaalsContact O-N 3.11Å; K553-F557 HydrophobicContact CB-CB 4.29Å; K553-F557 HydrophobicContact CB-CD1 4.32Å; K553-F557 HydrophobicContact CB-CG 4.32Å; K553-F557 HydrophobicContact CD-CD1 3.55Å; K553-F557 HydrophobicContact CD-CD2 4.09Å; K553-F557 HydrophobicContact CD-CE1 3.46Å; K553-F557 VanDerWaalsContact CD-CE1 3.46Å; K553-F557 HydrophobicContact CD-CE2 4.02Å; K553-F557 HydrophobicContact CD-CG 3.87Å; K553-F557 HydrophobicContact CD-CZ 3.72Å; K553-D572 WeakPolarHBondContact CE-OD1 3.4Å; K553-D572 IonicContact NZ-OD1 2.64Å; K553-D572 PolarHBondContact NZ-OD1 3.24Å; K553-I575 HydrophobicContact CD-CD1 4.04Å; K553-I575 HydrophobicContact CG-CD1 4.07Å
554	P	94.1	Very high	89	Confident	4 Å²	4	58 Å²	58	3%	0.026	30%	0.303	C	S	.	.			trans	-65.8	152.5	178.3	28.3	-36.7	0	0	0	112.2	M523 L526 Y535 C556 F557	M523-P554 HydrophobicContact SD-CG 4.5Å; L526-P554 HydrophobicContact CD2-CG 3.46Å; L526-P554 VanDerWaalsContact CD2-CG 3.46Å; Y535-P554 HydrophobicContact CD1-CB 3.7Å; Y535-P554 HydrophobicContact CD2-CB 4.04Å; Y535-P554 HydrophobicContact CE1-CB 3.83Å; Y535-P554 HydrophobicContact CE1-CG 4.5Å; Y535-P554 HydrophobicContact CE2-CB 4.17Å; Y535-P554 HydrophobicContact CE2-CG 4.31Å; Y535-P554 HydrophobicContact CG-CB 3.81Å; P554-C556 PolarHBondContact O-N 2.96Å; P554-C556 VanDerWaalsContact O-N 3.17Å; P554-F557 HydrophobicContact CG-CB 4.36Å; P554-F557 VanDerWaalsContact O-CB 3.3Å; P554-F557 WeakPolarHBondContact O-CB 3.25Å; P554-F557 PolarHBondContact O-N 3.25Å
555	E	93.7	Very high	89	Confident	78 Å²	78	62 Å²	62	36%	0.364	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-56.7	-38.1	-175.3	-165.9	-170.6	135.8	0	0	112.2	E537 F557 S558 R559	E537-E555 HydrophobicContact CB-CB 4.44Å; E537-E555 HydrophobicContact CG-CB 4.07Å; E537-E555 PolarHBondContact OE1-N 2.83Å; E537-E555 PolarHBondContact OE2-N 2.88Å; E555-F557 PolarHBondContact O-N 2.89Å; E555-S558 PolarHBondContact O-N 2.64Å; E555-S558 VanDerWaalsContact O-N 3.12Å; E555-S558 PolarHBondContact O-OG 3.31Å; E555-R559 IonicContact OE1-CZ 3.73Å; E555-R559 IonicContact OE1-NE 3.96Å; E555-R559 IonicContact OE1-NH2 3.51Å; E555-R559 PolarHBondContact OE1-NH2 3.08Å
556	C	93.3	Very high	89.2	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.014	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-67.2	-15.3	-180	59.7	0	0	0	0	114.5	T530 E532 P554 S558 R559	T530-C556 HydrophobicContact CG2-CB 4.14Å; T530-C556 WeakPolarHBondContact CG2-O 3.42Å; E532-C556 HydrophobicContact CB-CB 4.22Å; P554-C556 PolarHBondContact O-N 2.96Å; P554-C556 VanDerWaalsContact O-N 3.17Å; C556-S558 PolarHBondContact O-N 2.74Å; C556-R559 WeakPolarHBondContact O-CA 3.2Å; C556-R559 WeakPolarHBondContact O-CB 2.96Å; C556-R559 PolarHBondContact O-N 2.86Å
557	F	94.8	Very high	89.5	Confident	21 Å²	21	52.9 Å²	52.9	9%	0.092	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-61.5	-30.2	170.5	-178.2	-95.6	0	0	0	112.1	L526 K553 P554 E555 R559 I560 R568 I571 D572 I575	L526-F557 HydrophobicContact CD1-CB 4.49Å; K553-F557 HydrophobicContact CB-CB 4.29Å; K553-F557 HydrophobicContact CB-CD1 4.32Å; K553-F557 HydrophobicContact CB-CG 4.32Å; K553-F557 HydrophobicContact CD-CD1 3.55Å; K553-F557 HydrophobicContact CD-CD2 4.09Å; K553-F557 HydrophobicContact CD-CE1 3.46Å; K553-F557 VanDerWaalsContact CD-CE1 3.46Å; K553-F557 HydrophobicContact CD-CE2 4.02Å; K553-F557 HydrophobicContact CD-CG 3.87Å; K553-F557 HydrophobicContact CD-CZ 3.72Å; P554-F557 HydrophobicContact CG-CB 4.36Å; P554-F557 VanDerWaalsContact O-CB 3.3Å; P554-F557 WeakPolarHBondContact O-CB 3.25Å; P554-F557 PolarHBondContact O-N 3.25Å; E555-F557 PolarHBondContact O-N 2.89Å; F557-R559 PolarHBondContact O-N 3.11Å; F557-I560 HydrophobicContact CD2-CD1 3.7Å; F557-I560 HydrophobicContact CE2-CD1 3.98Å; F557-I560 HydrophobicContact CG-CD1 4.25Å; F557-I560 WeakPolarHBondContact O-CD1 3.29Å; F557-R568 HydrophobicContact CE1-CG 4.37Å; F557-R568 HydrophobicContact CE2-CG 4.27Å; F557-R568 HydrophobicContact CZ-CG 3.87Å; F557-I571 HydrophobicContact CD2-CG2 3.83Å; F557-I571 HydrophobicContact CE2-CB 4.19Å; F557-I571 HydrophobicContact CE2-CG2 3.79Å; F557-D572 HydrophobicContact CE2-CB 4.44Å; F557-D572 HydrophobicContact CZ-CB 4.13Å; F557-I575 HydrophobicContact CD2-CD1 4.1Å; F557-I575 HydrophobicContact CE2-CD1 4.36Å
558	S	93.3	Very high	89.7	Confident	93 Å²	93	57.4 Å²	57.4	65%	0.65	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-73	-12.2	174.1	70.1	0	0	0	0	113.8	E555 C556	E555-S558 PolarHBondContact O-N 2.64Å; E555-S558 VanDerWaalsContact O-N 3.12Å; E555-S558 PolarHBondContact O-OG 3.31Å; C556-S558 PolarHBondContact O-N 2.74Å
559	R	91.8	Very high	89.9	Confident	103 Å²	103	59.8 Å²	59.8	39%	0.389	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-104.7	5.9	-174.4	-52.2	179.9	-175.8	-174.6	0.7	113.6	E532 E555 C556 F557	E532-R559 IonicContact OE1-CZ 2.71Å; E532-R559 IonicContact OE1-NH1 3.64Å; E532-R559 PolarHBondContact OE1-NH1 3.01Å; E532-R559 VanDerWaalsContact OE2-CD 3.31Å; E532-R559 WeakPolarHBondContact OE2-CD 3.3Å; E532-R559 IonicContact OE2-CZ 3.94Å; E532-R559 IonicContact OE2-NE 2.92Å; E532-R559 IonicContact OE2-NH1 2.71Å; E532-R559 PolarHBondContact OE2-NH1 2.94Å; E555-R559 IonicContact OE1-CZ 3.73Å; E555-R559 IonicContact OE1-NE 3.96Å; E555-R559 IonicContact OE1-NH2 3.51Å; E555-R559 PolarHBondContact OE1-NH2 3.08Å; C556-R559 WeakPolarHBondContact O-CA 3.2Å; C556-R559 WeakPolarHBondContact O-CB 2.96Å; C556-R559 PolarHBondContact O-N 2.86Å; F557-R559 PolarHBondContact O-N 3.11Å
560	I	91.9	Very high	90.4	Very high	15 Å²	15	56 Å²	56	8%	0.077	30%	0.303	C	S	.	.	S	Bend	trans	-57.7	126.9	170.5	-64.6	164.9	0	0	0	107.9	L526 V529 T530 F557 A562 I567 R568 I571	L526-I560 HydrophobicContact CD1-CD1 3.96Å; L526-I560 HydrophobicContact CD1-CG1 3.9Å; V529-I560 HydrophobicContact CG1-CG2 4.11Å; T530-I560 HydrophobicContact CG2-CG1 4.46Å; F557-I560 HydrophobicContact CD2-CD1 3.7Å; F557-I560 HydrophobicContact CE2-CD1 3.98Å; F557-I560 HydrophobicContact CG-CD1 4.25Å; F557-I560 WeakPolarHBondContact O-CD1 3.29Å; I560-A562 PolarHBondContact O-N 3.14Å; I560-I567 HydrophobicContact CG2-CG2 4.41Å; I560-R568 HydrophobicContact CB-CB 4.49Å; I560-R568 HydrophobicContact CD1-CB 4.04Å; I560-R568 HydrophobicContact CD1-CG 4.01Å; I560-R568 HydrophobicContact CG2-CB 4.01Å; I560-I571 HydrophobicContact CD1-CD1 3.67Å; I560-I571 HydrophobicContact CG1-CD1 4.32Å
561	P	87.8	Confident	90.7	Very high	43 Å²	43	53.5 Å²	53.5	28%	0.279	29%	0.285	S	S	.	.			trans	-60.5	128.3	-173.3	-24.2	33.8	0	0	0	112.3	Q563 Y564	P561-Q563 VanDerWaalsContact CB-CD 3.47Å; P561-Q563 PolarHBondContact O-N 3.11Å; P561-Y564 HydrophobicContact CB-CD2 4.32Å; P561-Y564 PolarHBondContact O-N 3.22Å
562	A	85.7	Confident	91	Very high	95 Å²	95	53.7 Å²	53.7	79%	0.785	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-20	-170.8	0	0	0	0	0	114.5	I560 Y564	I560-A562 PolarHBondContact O-N 3.14Å; A562-Y564 PolarHBondContact O-N 2.91Å
563	Q	80.9	Confident	91.1	Very high	126 Å²	126	54.1 Å²	54.1	59%	0.589	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-2.9	174.2	73.5	-84.1	18.4	0	0	114.7	P561 P565	P561-Q563 VanDerWaalsContact CB-CD 3.47Å; P561-Q563 PolarHBondContact O-N 3.11Å; Q563-P565 VanDerWaalsContact C-CD 3.5Å
564	Y	83	Confident	91.2	Very high	75 Å²	75	50.6 Å²	50.6	29%	0.294	26%	0.261	S	S	.	.			trans	-128.5	62.4	176.4	-55.3	-56.8	0	0	0	112	I434 P561 A562 E566 I567	I434-Y564 HydrophobicContact CD1-CD1 4.48Å; I434-Y564 HydrophobicContact CD1-CE1 4.35Å; I434-Y564 HydrophobicContact CG1-CE1 4.14Å; P561-Y564 HydrophobicContact CB-CD2 4.32Å; P561-Y564 PolarHBondContact O-N 3.22Å; A562-Y564 PolarHBondContact O-N 2.91Å; Y564-E566 VanDerWaalsContact CA-OE2 3.25Å; Y564-E566 WeakPolarHBondContact CA-OE2 3.38Å; Y564-E566 PolarHBondContact O-N 3.15Å; Y564-I567 HydrophobicContact CD2-CD1 4.21Å; Y564-I567 HydrophobicContact CG-CD1 3.9Å; Y564-I567 WeakPolarHBondContact O-CB 3.35Å; Y564-I567 PolarHBondContact O-N 2.62Å
565	P	85.2	Confident	91.3	Very high	85 Å²	85	51 Å²	51	55%	0.552	26%	0.263	S	S	*	.	H	α-helix	trans	-60.5	-31	-178.9	27.3	-35.3	0	0	0	112.7	Q563 I567 R568 E569	Q563-P565 VanDerWaalsContact C-CD 3.5Å; P565-I567 VanDerWaalsContact C-N 3.29Å; P565-I567 PolarHBondContact O-N 3.4Å; P565-R568 WeakPolarHBondContact O-CB 3.35Å; P565-R568 PolarHBondContact O-N 3Å; P565-R568 VanDerWaalsContact O-N 3.11Å; P565-E569 PolarHBondContact O-N 2.96Å
566	E	85.7	Confident	91.2	Very high	44 Å²	44	49.8 Å²	49.8	21%	0.206	26%	0.255	C	S	.	.	H	α-helix	trans	-65.9	-31.9	179.6	77.1	-80.7	-149.9	0	0	112.3	Y564 R568 E569 I570 F593 R603	Y564-E566 VanDerWaalsContact CA-OE2 3.25Å; Y564-E566 WeakPolarHBondContact CA-OE2 3.38Å; Y564-E566 PolarHBondContact O-N 3.15Å; E566-R568 VanDerWaalsContact C-N 3.35Å; E566-E569 PolarHBondContact O-N 3.49Å; E566-I570 WeakPolarHBondContact O-CB 3.34Å; E566-I570 WeakPolarHBondContact O-CD1 3.21Å; E566-I570 VanDerWaalsContact O-CG1 3.23Å; E566-I570 WeakPolarHBondContact O-CG1 3.47Å; E566-I570 PolarHBondContact O-N 3.25Å; E566-F593 HydrophobicContact CG-CB 4.21Å; E566-F593 HydrophobicContact CG-CD2 3.34Å; E566-F593 HydrophobicContact CG-CE2 4.02Å; E566-F593 HydrophobicContact CG-CG 4.05Å; E566-F593 WeakPolarHBondContact OE1-CD2 3.28Å; E566-R603 IonicContact OE1-NH2 3.31Å
567	I	92.1	Very high	91	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-65.7	-41.4	173.4	-63.5	-178.5	0	0	0	110.5	I434 L437 L525 V529 I560 Y564 P565 E569 I570 I571 F593	I434-I567 HydrophobicContact CD1-CD1 3.81Å; L437-I567 HydrophobicContact CD2-CD1 4.08Å; L525-I567 HydrophobicContact CD1-CG2 4.39Å; L525-I567 HydrophobicContact CG-CG2 4.47Å; V529-I567 HydrophobicContact CB-CG2 4.49Å; V529-I567 HydrophobicContact CG1-CG2 4.22Å; V529-I567 HydrophobicContact CG2-CD1 4.37Å; V529-I567 HydrophobicContact CG2-CG2 3.63Å; I560-I567 HydrophobicContact CG2-CG2 4.41Å; Y564-I567 HydrophobicContact CD2-CD1 4.21Å; Y564-I567 HydrophobicContact CG-CD1 3.9Å; Y564-I567 WeakPolarHBondContact O-CB 3.35Å; Y564-I567 PolarHBondContact O-N 2.62Å; P565-I567 VanDerWaalsContact C-N 3.29Å; P565-I567 PolarHBondContact O-N 3.4Å; I567-E569 VanDerWaalsContact C-N 3.33Å; I567-I570 PolarHBondContact O-N 2.98Å; I567-I571 HydrophobicContact CG2-CD1 3.79Å; I567-I571 HydrophobicContact CG2-CG1 4.43Å; I567-I571 VanDerWaalsContact O-CG1 3.28Å; I567-I571 WeakPolarHBondContact O-CG1 3.29Å; I567-I571 PolarHBondContact O-N 3.13Å; I567-F593 HydrophobicContact CD1-CE2 3.76Å; I567-F593 HydrophobicContact CD1-CZ 3.52Å; I567-F593 HydrophobicContact CG1-CD2 4.22Å; I567-F593 HydrophobicContact CG1-CE1 4.09Å; I567-F593 HydrophobicContact CG1-CE2 3.4Å; I567-F593 VanDerWaalsContact CG1-CE2 3.4Å; I567-F593 HydrophobicContact CG1-CZ 3.35Å
568	R	92.8	Very high	90.5	Very high	142 Å²	142	57.6 Å²	57.6	54%	0.536	29%	0.29	S	S	.	.	H	α-helix	trans	-64.8	-40	178.1	-178.3	177.2	172.5	-155.9	-5.2	111.3	F557 I560 P565 E566 D572	F557-R568 HydrophobicContact CE1-CG 4.37Å; F557-R568 HydrophobicContact CE2-CG 4.27Å; F557-R568 HydrophobicContact CZ-CG 3.87Å; I560-R568 HydrophobicContact CB-CB 4.49Å; I560-R568 HydrophobicContact CD1-CB 4.04Å; I560-R568 HydrophobicContact CD1-CG 4.01Å; I560-R568 HydrophobicContact CG2-CB 4.01Å; P565-R568 WeakPolarHBondContact O-CB 3.35Å; P565-R568 PolarHBondContact O-N 3Å; P565-R568 VanDerWaalsContact O-N 3.11Å; E566-R568 VanDerWaalsContact C-N 3.35Å; R568-D572 WeakPolarHBondContact O-CB 3.48Å; R568-D572 PolarHBondContact O-N 3.21Å
569	E	92.6	Very high	90.3	Very high	57 Å²	57	57.7 Å²	57.7	27%	0.266	28%	0.276	S	S	.	.	H	α-helix	trans	-63.7	-48.4	174.6	-155.2	-160.9	116	0	0	111.5	P565 E566 I567 I571 D572 R573 R609	P565-E569 PolarHBondContact O-N 2.96Å; E566-E569 PolarHBondContact O-N 3.49Å; I567-E569 VanDerWaalsContact C-N 3.33Å; E569-I571 PolarHBondContact O-N 3.33Å; E569-D572 WeakPolarHBondContact O-CB 3.39Å; E569-D572 PolarHBondContact O-N 3.5Å; E569-R573 WeakPolarHBondContact O-CG 3.48Å; E569-R573 PolarHBondContact O-N 3.23Å; E569-R573 IonicContact OE1-CZ 2.73Å; E569-R573 IonicContact OE1-NH1 3.68Å; E569-R573 PolarHBondContact OE1-NH1 3.45Å; E569-R609 VanDerWaalsContact CD-NH2 3.34Å; E569-R609 IonicContact OE1-NH2 2.67Å; E569-R609 PolarHBondContact OE1-NH2 2.94Å; E569-R609 IonicContact OE2-CZ 3.15Å; E569-R609 IonicContact OE2-NE 2.76Å; E569-R609 IonicContact OE2-NH2 3.41Å; E569-R609 PolarHBondContact OE2-NH2 2.94Å
570	I	94.5	Very high	90.1	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-59	-45.7	177.2	-70.1	161.4	0	0	0	111.4	L525 E566 I567 R573 C574 L588 F593 F594	L525-I570 HydrophobicContact CD2-CG2 3.72Å; E566-I570 WeakPolarHBondContact O-CB 3.34Å; E566-I570 WeakPolarHBondContact O-CD1 3.21Å; E566-I570 VanDerWaalsContact O-CG1 3.23Å; E566-I570 WeakPolarHBondContact O-CG1 3.47Å; E566-I570 PolarHBondContact O-N 3.25Å; I567-I570 PolarHBondContact O-N 2.98Å; I570-R573 PolarHBondContact O-N 3.38Å; I570-C574 PolarHBondContact O-N 3.19Å; I570-C574 VanDerWaalsContact O-N 3.15Å; I570-C574 PolarHBondContact O-SG 3.17Å; I570-L588 HydrophobicContact CG2-CD2 4.16Å; I570-F593 HydrophobicContact CD1-CB 3.47Å; I570-F593 VanDerWaalsContact CD1-CB 3.47Å; I570-F593 HydrophobicContact CD1-CD1 3.69Å; I570-F593 HydrophobicContact CD1-CG 3.69Å; I570-F594 HydrophobicContact CD1-CE2 3.97Å; I570-F594 HydrophobicContact CD1-CZ 4.31Å; I570-F594 HydrophobicContact CG2-CE2 3.84Å; I570-F594 HydrophobicContact CG2-CZ 4.01Å
571	I	96.4	Very high	90	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.7	-46.2	176.4	-66.7	164.7	0	0	0	110	L525 L526 F557 I560 I567 E569 R573 C574 I575	L525-I571 HydrophobicContact CB-CG1 4.21Å; L525-I571 HydrophobicContact CD2-CD1 4.42Å; L525-I571 HydrophobicContact CD2-CG1 3.67Å; L525-I571 HydrophobicContact CG-CD1 3.99Å; L525-I571 HydrophobicContact CG-CG1 3.69Å; L526-I571 HydrophobicContact CB-CD1 4.13Å; L526-I571 HydrophobicContact CB-CG2 4.32Å; L526-I571 HydrophobicContact CD1-CD1 4.2Å; F557-I571 HydrophobicContact CD2-CG2 3.83Å; F557-I571 HydrophobicContact CE2-CB 4.19Å; F557-I571 HydrophobicContact CE2-CG2 3.79Å; I560-I571 HydrophobicContact CD1-CD1 3.67Å; I560-I571 HydrophobicContact CG1-CD1 4.32Å; I567-I571 HydrophobicContact CG2-CD1 3.79Å; I567-I571 HydrophobicContact CG2-CG1 4.43Å; I567-I571 VanDerWaalsContact O-CG1 3.28Å; I567-I571 WeakPolarHBondContact O-CG1 3.29Å; I567-I571 PolarHBondContact O-N 3.13Å; E569-I571 PolarHBondContact O-N 3.33Å; I571-R573 PolarHBondContact O-N 3.09Å; I571-C574 WeakPolarHBondContact O-CB 3.42Å; I571-C574 PolarHBondContact O-N 3.46Å; I571-I575 HydrophobicContact CG2-CD1 3.97Å; I571-I575 HydrophobicContact CG2-CG1 4.37Å; I571-I575 HydrophobicContact CG2-CG2 4.3Å; I571-I575 WeakPolarHBondContact O-CG1 3.37Å; I571-I575 PolarHBondContact O-N 2.64Å
572	D	94.7	Very high	90.3	Very high	39 Å²	39	59.9 Å²	59.9	21%	0.209	29%	0.286	C	S	.	.	H	α-helix	trans	-53.1	-54	178	-174	90.2	0	0	0	111.4	K553 F557 R568 E569 C574 I575 R576	K553-D572 WeakPolarHBondContact CE-OD1 3.4Å; K553-D572 IonicContact NZ-OD1 2.64Å; K553-D572 PolarHBondContact NZ-OD1 3.24Å; F557-D572 HydrophobicContact CE2-CB 4.44Å; F557-D572 HydrophobicContact CZ-CB 4.13Å; R568-D572 WeakPolarHBondContact O-CB 3.48Å; R568-D572 PolarHBondContact O-N 3.21Å; E569-D572 WeakPolarHBondContact O-CB 3.39Å; E569-D572 PolarHBondContact O-N 3.5Å; D572-C574 PolarHBondContact O-N 3.17Å; D572-C574 VanDerWaalsContact O-N 3.14Å; D572-I575 PolarHBondContact O-N 3.02Å; D572-I575 VanDerWaalsContact O-N 3.13Å; D572-R576 VanDerWaalsContact O-CG 3.24Å; D572-R576 WeakPolarHBondContact O-CG 2.94Å; D572-R576 PolarHBondContact O-N 3.25Å; D572-R576 IonicContact OD2-NE 2.69Å; D572-R576 PolarHBondContact OD2-NE 3.2Å; D572-R576 IonicContact OD2-NH2 2.75Å
573	R	94.5	Very high	90.6	Very high	39 Å²	39	56.1 Å²	56.1	15%	0.147	25%	0.253	C	S	.	.	H	α-helix	trans	-66	-13.6	-179.5	-57.6	-179.1	-27.6	-125.5	-2.9	113.5	E569 I570 I571 R582 S583 D591	E569-R573 WeakPolarHBondContact O-CG 3.48Å; E569-R573 PolarHBondContact O-N 3.23Å; E569-R573 IonicContact OE1-CZ 2.73Å; E569-R573 IonicContact OE1-NH1 3.68Å; E569-R573 PolarHBondContact OE1-NH1 3.45Å; I570-R573 PolarHBondContact O-N 3.38Å; I571-R573 PolarHBondContact O-N 3.09Å; R573-R582 CarbonylContact O-C 3.58Å; R573-R582 VanDerWaalsContact O-CA 3.26Å; R573-R582 WeakPolarHBondContact O-CA 3.46Å; R573-S583 WeakPolarHBondContact CB-OG 3.41Å; R573-S583 PolarHBondContact NE-OG 2.98Å; R573-S583 PolarHBondContact O-N 3.11Å; R573-D591 IonicContact CZ-OD2 3.54Å; R573-D591 IonicContact NH1-OD2 3.8Å; R573-D591 PolarHBondContact NH1-OD2 3.17Å; R573-D591 IonicContact NH2-OD2 2.74Å; R573-D591 PolarHBondContact NH2-OD2 3Å
574	C	96.6	Very high	91.2	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-89.3	-38.9	171.2	-65.5	0	0	0	0	112.5	V518 Y519 I570 I571 D572 R582	V518-C574 HydrophobicContact CG1-CB 4.2Å; Y519-C574 WeakPolarHBondContact CA-O 3.17Å; I570-C574 PolarHBondContact O-N 3.19Å; I570-C574 VanDerWaalsContact O-N 3.15Å; I570-C574 PolarHBondContact O-SG 3.17Å; I571-C574 WeakPolarHBondContact O-CB 3.42Å; I571-C574 PolarHBondContact O-N 3.46Å; D572-C574 PolarHBondContact O-N 3.17Å; D572-C574 VanDerWaalsContact O-N 3.14Å; C574-R582 WeakPolarHBondContact O-CD 3.21Å
575	I	95	Very high	91.8	Very high	11 Å²	11	50.4 Å²	50.4	6%	0.056	24%	0.235	C	C	.	.	S	Bend	trans	-97.7	19.3	-171	74	175.6	0	0	0	114.6	Y519 M523 K553 F557 I571 D572	Y519-I575 HydrophobicContact CD2-CB 4.21Å; Y519-I575 HydrophobicContact CE2-CB 4.01Å; M523-I575 HydrophobicContact CE-CB 4.16Å; M523-I575 HydrophobicContact CE-CD1 4.28Å; M523-I575 HydrophobicContact CE-CG2 3.92Å; M523-I575 HydrophobicContact CG-CG2 4.35Å; M523-I575 HydrophobicContact SD-CG2 4.15Å; K553-I575 HydrophobicContact CD-CD1 4.04Å; K553-I575 HydrophobicContact CG-CD1 4.07Å; F557-I575 HydrophobicContact CD2-CD1 4.1Å; F557-I575 HydrophobicContact CE2-CD1 4.36Å; I571-I575 HydrophobicContact CG2-CD1 3.97Å; I571-I575 HydrophobicContact CG2-CG1 4.37Å; I571-I575 HydrophobicContact CG2-CG2 4.3Å; I571-I575 WeakPolarHBondContact O-CG1 3.37Å; I571-I575 PolarHBondContact O-N 2.64Å; D572-I575 PolarHBondContact O-N 3.02Å; D572-I575 VanDerWaalsContact O-N 3.13Å
576	R	93.4	Very high	92.1	Very high	53 Å²	53	53.4 Å²	53.4	20%	0.2	24%	0.239	C	C	.	.			trans	-63.7	146.7	176.1	-62.5	-172.9	171.2	177	-14.5	111.6	D572 E581 R582	D572-R576 VanDerWaalsContact O-CG 3.24Å; D572-R576 WeakPolarHBondContact O-CG 2.94Å; D572-R576 PolarHBondContact O-N 3.25Å; D572-R576 IonicContact OD2-NE 2.69Å; D572-R576 PolarHBondContact OD2-NE 3.2Å; D572-R576 IonicContact OD2-NH2 2.75Å; R576-E581 HydrophobicContact CB-CB 4.34Å; R576-E581 VanDerWaalsContact CD-O 3.3Å; R576-E581 WeakPolarHBondContact CD-O 3.13Å; R576-E581 PolarHBondContact NH1-O 3.45Å; R576-R582 HydrophobicContact CB-CG 4.14Å; R576-R582 PolarHBondContact O-NE 2.81Å; R576-R582 PolarHBondContact O-NH2 2.8Å
577	V	88.1	Confident	92.4	Very high	55 Å²	55	55.8 Å²	55.8	33%	0.333	25%	0.25	S	S	.	.	S	Bend	trans	-63.4	-58.1	-176.6	-175.2	0	0	0	0	110.5	P505 R579 R582	P505-V577 HydrophobicContact CG-CG1 4.14Å; P505-V577 WeakPolarHBondContact CG-O 3.25Å; V577-R579 PolarHBondContact O-N 2.88Å; V577-R582 PolarHBondContact O-NH2 2.72Å
578	R	85.4	Confident	92.5	Very high	133 Å²	133	55.8 Å²	55.8	50%	0.502	25%	0.25	S	S	.	.	S	Bend	trans	-67.1	129.2	174.6	-59.3	-171.4	-175.6	109.5	0.6	109.4	E580 E581	R578-E580 VanDerWaalsContact C-N 3.29Å; R578-E580 PolarHBondContact O-N 3.06Å; R578-E581 HydrophobicContact CB-CB 4.3Å; R578-E581 HydrophobicContact CB-CG 3.91Å; R578-E581 IonicContact CZ-OE1 3.14Å; R578-E581 IonicContact NH1-OE1 3.01Å; R578-E581 PolarHBondContact NH1-OE1 3.19Å; R578-E581 IonicContact NH1-OE2 2.73Å; R578-E581 PolarHBondContact O-N 3.04Å
579	R	87.9	Confident	92.4	Very high	95 Å²	95	51.5 Å²	51.5	36%	0.358	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-65.3	-34.1	178.5	56.8	170.6	-174.7	179.8	-8.6	112.3	D513 S515 V577 E581 R582	D513-R579 WeakPolarHBondContact OD2-CD 3.33Å; D513-R579 IonicContact OD2-CZ 2.67Å; D513-R579 IonicContact OD2-NE 3.55Å; D513-R579 IonicContact OD2-NH1 3.4Å; D513-R579 PolarHBondContact OD2-NH1 3.4Å; S515-R579 VanDerWaalsContact OG-CB 3.29Å; S515-R579 WeakPolarHBondContact OG-CB 3.23Å; V577-R579 PolarHBondContact O-N 2.88Å; R579-E581 PolarHBondContact O-N 3.37Å; R579-R582 WeakPolarHBondContact O-CB 3.34Å; R579-R582 PolarHBondContact O-N 2.69Å; R579-R582 VanDerWaalsContact O-N 3.13Å
580	E	88.3	Confident	92	Very high	132 Å²	132	52.9 Å²	52.9	62%	0.617	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-67.5	-22.9	-178.6	-58.3	77.2	-168.7	0	0	112.2	R578	R578-E580 VanDerWaalsContact C-N 3.29Å; R578-E580 PolarHBondContact O-N 3.06Å
581	E	89.4	Confident	91.5	Very high	59 Å²	59	54.2 Å²	54.2	28%	0.276	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-86.8	-6.6	177.9	-64.6	178	163.8	0	0	112.9	R576 R578 R579 R699	R576-E581 HydrophobicContact CB-CB 4.34Å; R576-E581 VanDerWaalsContact CD-O 3.3Å; R576-E581 WeakPolarHBondContact CD-O 3.13Å; R576-E581 PolarHBondContact NH1-O 3.45Å; R578-E581 HydrophobicContact CB-CB 4.3Å; R578-E581 HydrophobicContact CB-CG 3.91Å; R578-E581 IonicContact CZ-OE1 3.14Å; R578-E581 IonicContact NH1-OE1 3.01Å; R578-E581 PolarHBondContact NH1-OE1 3.19Å; R578-E581 IonicContact NH1-OE2 2.73Å; R578-E581 PolarHBondContact O-N 3.04Å; R579-E581 PolarHBondContact O-N 3.37Å; E581-R699 IonicContact OE1-NH1 3.6Å; E581-R699 IonicContact OE1-NH2 3.19Å
582	R	94	Very high	90.6	Very high	16 Å²	16	56 Å²	56	6%	0.06	27%	0.266	C	S	.	.	S	Bend	trans	-83	149.7	-175.3	-59.9	178.2	-165.1	147.4	14.1	112.7	E506 S515 V518 R573 C574 R576 V577 R579 T584	E506-R582 IonicContact OE1-CZ 2.63Å; E506-R582 IonicContact OE1-NH1 3.94Å; E506-R582 PolarHBondContact OE1-NH1 3.26Å; E506-R582 IonicContact OE1-NH2 2.68Å; E506-R582 PolarHBondContact OE1-NH2 3.23Å; E506-R582 IonicContact OE2-CZ 2.66Å; E506-R582 IonicContact OE2-NH1 3.59Å; E506-R582 IonicContact OE2-NH2 3.36Å; E506-R582 PolarHBondContact OE2-NH2 3.01Å; S515-R582 PolarHBondContact O-NH1 3.2Å; S515-R582 VanDerWaalsContact O-NH1 3.08Å; S515-R582 PolarHBondContact OG-NH1 2.83Å; V518-R582 HydrophobicContact CG1-CB 4.28Å; R573-R582 CarbonylContact O-C 3.58Å; R573-R582 VanDerWaalsContact O-CA 3.26Å; R573-R582 WeakPolarHBondContact O-CA 3.46Å; C574-R582 WeakPolarHBondContact O-CD 3.21Å; R576-R582 HydrophobicContact CB-CG 4.14Å; R576-R582 PolarHBondContact O-NE 2.81Å; R576-R582 PolarHBondContact O-NH2 2.8Å; V577-R582 PolarHBondContact O-NH2 2.72Å; R579-R582 WeakPolarHBondContact O-CB 3.34Å; R579-R582 PolarHBondContact O-N 2.69Å; R579-R582 VanDerWaalsContact O-N 3.13Å; R582-T584 PolarHBondContact O-N 3.49Å
583	S	92.1	Very high	90	Very high	15 Å²	15	54.4 Å²	54.4	11%	0.105	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-70.3	123.4	173.4	-65.5	0	0	0	0	112	V518 R573	V518-S583 WeakPolarHBondContact CG1-O 3.43Å; R573-S583 WeakPolarHBondContact CB-OG 3.41Å; R573-S583 PolarHBondContact NE-OG 2.98Å; R573-S583 PolarHBondContact O-N 3.11Å
584	T	93.9	Very high	89.4	Confident	72 Å²	72	52.7 Å²	52.7	44%	0.442	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-63.3	154.4	172.8	64	0	0	0	0	111.8	R582 K586 Q587 L588	R582-T584 PolarHBondContact O-N 3.49Å; T584-K586 PolarHBondContact O-N 3.02Å; T584-K586 VanDerWaalsContact O-N 3.13Å; T584-Q587 PolarHBondContact O-N 3.03Å; T584-Q587 VanDerWaalsContact OG1-CD 3.3Å; T584-Q587 WeakPolarHBondContact OG1-CG 3.1Å; T584-Q587 PolarHBondContact OG1-N 3.1Å; T584-Q587 PolarHBondContact OG1-OE1 3.1Å; T584-L588 WeakPolarHBondContact O-CG 3.34Å; T584-L588 PolarHBondContact O-N 2.73Å
585	V	95	Very high	88.2	Confident	9 Å²	9	54.4 Å²	54.4	6%	0.055	26%	0.262	C	S	.	.	H	α-helix	trans	-56.4	-31.1	175.7	-177.9	0	0	0	0	112.2	L445 L448 V518 L589	L445-V585 HydrophobicContact CB-CG1 4.34Å; L445-V585 HydrophobicContact CD2-CG1 4.06Å; L445-V585 VanDerWaalsContact O-CG1 3.24Å; L445-V585 WeakPolarHBondContact O-CG1 3.41Å; L448-V585 HydrophobicContact CB-CG1 4.17Å; L448-V585 HydrophobicContact CB-CG2 4.19Å; L448-V585 HydrophobicContact CD1-CG2 4.48Å; V518-V585 HydrophobicContact CG2-CG2 3.73Å; V585-L589 HydrophobicContact CG1-CD1 4.24Å; V585-L589 WeakPolarHBondContact O-CB 3.14Å; V585-L589 WeakPolarHBondContact O-CG 3.34Å; V585-L589 PolarHBondContact O-N 3.4Å
586	K	92.2	Very high	86.6	Confident	148 Å²	148	55.5 Å²	55.5	64%	0.643	27%	0.27	S	S	*	.	H	α-helix	trans	-65.6	-45.7	174.2	-68.4	179.1	-178.5	172.6	0	112.1	T584 L589 V590	T584-K586 PolarHBondContact O-N 3.02Å; T584-K586 VanDerWaalsContact O-N 3.13Å; K586-L589 PolarHBondContact O-N 3.21Å; K586-V590 WeakPolarHBondContact O-CG2 3.23Å; K586-V590 PolarHBondContact O-N 2.91Å
587	Q	91.7	Very high	84.9	Confident	95 Å²	95	56.7 Å²	56.7	44%	0.444	28%	0.278	S	S	.	.	H	α-helix	trans	-64.5	-42.7	175.3	-72.5	156.7	-39.5	0	0	111.1	T584 L589 V590 D591	T584-Q587 PolarHBondContact O-N 3.03Å; T584-Q587 VanDerWaalsContact OG1-CD 3.3Å; T584-Q587 WeakPolarHBondContact OG1-CG 3.1Å; T584-Q587 PolarHBondContact OG1-N 3.1Å; T584-Q587 PolarHBondContact OG1-OE1 3.1Å; Q587-L589 VanDerWaalsContact C-N 3.29Å; Q587-L589 PolarHBondContact O-N 3.34Å; Q587-V590 PolarHBondContact O-N 3.28Å; Q587-V590 VanDerWaalsContact O-N 3.09Å; Q587-D591 PolarHBondContact O-N 3.42Å; Q587-D591 VanDerWaalsContact O-N 3.1Å
588	L	93.9	Very high	83.1	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-64.2	-29.1	176.9	-66.3	172	0	0	0	113.2	L445 V518 F521 I570 T584 V590 F594	L445-L588 HydrophobicContact CD1-CB 3.87Å; L445-L588 HydrophobicContact CD2-CB 3.83Å; L445-L588 HydrophobicContact CD2-CD1 3.86Å; V518-L588 HydrophobicContact CG1-CD1 4.25Å; F521-L588 HydrophobicContact CD1-CD1 4.17Å; F521-L588 HydrophobicContact CE1-CD1 4.19Å; I570-L588 HydrophobicContact CG2-CD2 4.16Å; T584-L588 WeakPolarHBondContact O-CG 3.34Å; T584-L588 PolarHBondContact O-N 2.73Å; L588-V590 VanDerWaalsContact C-N 3.3Å; L588-F594 WeakPolarHBondContact O-CD2 3.48Å
589	L	90.5	Very high	81.5	Confident	51 Å²	51	58 Å²	58	27%	0.267	29%	0.292	S	S	.	.	H	α-helix	trans	-76	-14.5	174.3	-79.6	171.1	0	0	0	114.2	L445 K446 V585 K586 Q587	L445-L589 HydrophobicContact CB-CD2 3.57Å; L445-L589 HydrophobicContact CB-CG 3.91Å; K446-L589 HydrophobicContact CG-CD2 3.97Å; V585-L589 HydrophobicContact CG1-CD1 4.24Å; V585-L589 WeakPolarHBondContact O-CB 3.14Å; V585-L589 WeakPolarHBondContact O-CG 3.34Å; V585-L589 PolarHBondContact O-N 3.4Å; K586-L589 PolarHBondContact O-N 3.21Å; Q587-L589 VanDerWaalsContact C-N 3.29Å; Q587-L589 PolarHBondContact O-N 3.34Å
590	V	84.9	Confident	80.1	Confident	87 Å²	87	54.4 Å²	54.4	53%	0.527	28%	0.28	S	S	.	.	H	α-helix	trans	-101.3	-19.4	179.1	177	0	0	0	0	112	K586 Q587 L588 D592	K586-V590 WeakPolarHBondContact O-CG2 3.23Å; K586-V590 PolarHBondContact O-N 2.91Å; Q587-V590 PolarHBondContact O-N 3.28Å; Q587-V590 VanDerWaalsContact O-N 3.09Å; L588-V590 VanDerWaalsContact C-N 3.3Å; V590-D592 PolarHBondContact O-N 2.86Å
591	D	83.9	Confident	78.9	Confident	29 Å²	29	48.5 Å²	48.5	16%	0.155	25%	0.254	C	S	.	.	S	Bend	trans	-52.7	130.5	176.7	-172.9	-60.1	0	0	0	112.5	R573 Q587 F593 F594 T595	R573-D591 IonicContact CZ-OD2 3.54Å; R573-D591 IonicContact NH1-OD2 3.8Å; R573-D591 PolarHBondContact NH1-OD2 3.17Å; R573-D591 IonicContact NH2-OD2 2.74Å; R573-D591 PolarHBondContact NH2-OD2 3Å; Q587-D591 PolarHBondContact O-N 3.42Å; Q587-D591 VanDerWaalsContact O-N 3.1Å; D591-F593 PolarHBondContact O-N 3.34Å; D591-F593 VanDerWaalsContact OD1-CB 3.29Å; D591-F593 WeakPolarHBondContact OD1-CB 3.24Å; D591-F593 PolarHBondContact OD1-N 2.91Å; D591-F594 HydrophobicContact CB-CD2 4.22Å; D591-F594 PolarHBondContact O-N 2.84Å; D591-T595 PolarHBondContact O-N 2.99Å
592	D	78.1	Confident	78.3	Confident	36 Å²	36	46.2 Å²	46.2	19%	0.193	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-49	-37.8	-176.7	-59.9	-81.7	0	0	0	113.3	V590 F594 T595 K682	V590-D592 PolarHBondContact O-N 2.86Å; D592-F594 PolarHBondContact O-N 2.91Å; D592-T595 PolarHBondContact O-N 3.48Å; D592-T595 VanDerWaalsContact O-N 3.12Å; D592-T595 PolarHBondContact O-OG1 3.42Å; D592-K682 IonicContact OD1-NZ 2.76Å; D592-K682 VanDerWaalsContact OD2-CE 3.27Å; D592-K682 WeakPolarHBondContact OD2-CE 3.49Å; D592-K682 IonicContact OD2-NZ 2.8Å; D592-K682 PolarHBondContact OD2-NZ 2.74Å
593	F	81.7	Confident	77.5	Confident	6 Å²	6	50 Å²	50	3%	0.026	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-61.8	-32.3	-178.4	-179.8	-99.1	0	0	0	112.3	I434 K438 E566 I567 I570 D591	I434-F593 HydrophobicContact CD1-CE2 3.82Å; I434-F593 HydrophobicContact CD1-CZ 3.67Å; K438-F593 HydrophobicContact CD-CE2 4.27Å; K438-F593 HydrophobicContact CD-CZ 4.3Å; K438-F593 WeakPolarHBondContact CD-O 3.28Å; K438-F593 WeakPolarHBondContact CE-O 3.25Å; K438-F593 HydrophobicContact CG-CD1 4.25Å; K438-F593 HydrophobicContact CG-CE1 3.72Å; K438-F593 HydrophobicContact CG-CE2 4.09Å; K438-F593 HydrophobicContact CG-CZ 3.62Å; K438-F593 WeakPolarHBondContact CG-O 3.43Å; E566-F593 HydrophobicContact CG-CB 4.21Å; E566-F593 HydrophobicContact CG-CD2 3.34Å; E566-F593 HydrophobicContact CG-CE2 4.02Å; E566-F593 HydrophobicContact CG-CG 4.05Å; E566-F593 WeakPolarHBondContact OE1-CD2 3.28Å; I567-F593 HydrophobicContact CD1-CE2 3.76Å; I567-F593 HydrophobicContact CD1-CZ 3.52Å; I567-F593 HydrophobicContact CG1-CD2 4.22Å; I567-F593 HydrophobicContact CG1-CE1 4.09Å; I567-F593 HydrophobicContact CG1-CE2 3.4Å; I567-F593 VanDerWaalsContact CG1-CE2 3.4Å; I567-F593 HydrophobicContact CG1-CZ 3.35Å; I570-F593 HydrophobicContact CD1-CB 3.47Å; I570-F593 VanDerWaalsContact CD1-CB 3.47Å; I570-F593 HydrophobicContact CD1-CD1 3.69Å; I570-F593 HydrophobicContact CD1-CG 3.69Å; D591-F593 PolarHBondContact O-N 3.34Å; D591-F593 VanDerWaalsContact OD1-CB 3.29Å; D591-F593 WeakPolarHBondContact OD1-CB 3.24Å; D591-F593 PolarHBondContact OD1-N 2.91Å
594	F	82.4	Confident	77.3	Confident	3 Å²	3	49.5 Å²	49.5	1%	0.013	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-95.7	-4.3	177.5	-58.9	-61.3	0	0	0	113.5	C441 R442 L445 F521 L525 I570 L588 D591 D592	C441-F594 HydrophobicContact CB-CD1 3.86Å; C441-F594 HydrophobicContact CB-CE1 3.24Å; C441-F594 HydrophobicContact CB-CZ 4.05Å; R442-F594 WeakPolarHBondContact CD-O 3.17Å; R442-F594 PolarHBondContact NH1-O 3.33Å; L445-F594 HydrophobicContact CD1-CD2 3.94Å; L445-F594 HydrophobicContact CD1-CE2 3.98Å; L445-F594 HydrophobicContact CD1-CG 4.23Å; L445-F594 HydrophobicContact CD1-CZ 4.34Å; F521-F594 HydrophobicContact CE1-CZ 4.44Å; F521-F594 AromaticContact CZ-CZ 3.97Å; F521-F594 HydrophobicContact CZ-CZ 3.97Å; L525-F594 HydrophobicContact CD2-CZ 4.3Å; I570-F594 HydrophobicContact CD1-CE2 3.97Å; I570-F594 HydrophobicContact CD1-CZ 4.31Å; I570-F594 HydrophobicContact CG2-CE2 3.84Å; I570-F594 HydrophobicContact CG2-CZ 4.01Å; L588-F594 WeakPolarHBondContact O-CD2 3.48Å; D591-F594 HydrophobicContact CB-CD2 4.22Å; D591-F594 PolarHBondContact O-N 2.84Å; D592-F594 PolarHBondContact O-N 2.91Å
595	T	70	Confident	76.9	Confident	36 Å²	36	47.8 Å²	47.8	22%	0.221	24%	0.241	C	C	.	.	S	Bend	trans	-62.6	145	166	70	0	0	0	0	110.1	D591 D592 E597	D591-T595 PolarHBondContact O-N 2.99Å; D592-T595 PolarHBondContact O-N 3.48Å; D592-T595 VanDerWaalsContact O-N 3.12Å; D592-T595 PolarHBondContact O-OG1 3.42Å; T595-E597 PolarHBondContact O-N 2.95Å
596	P	62.3	Low	76.7	Confident	35 Å²	35	48.4 Å²	48.4	23%	0.227	24%	0.244	C	C	.	.			trans	-80.6	110	179.7	-6.6	24.6	0	0	0	110.3	D598 L599	P596-D598 PolarHBondContact O-N 3.39Å; P596-L599 HydrophobicContact CB-CB 4.19Å; P596-L599 HydrophobicContact CB-CD1 4.14Å; P596-L599 HydrophobicContact CG-CB 4.49Å; P596-L599 HydrophobicContact CG-CD1 4.41Å; P596-L599 HydrophobicContact CG-CD2 4.44Å; P596-L599 WeakPolarHBondContact O-CB 3.38Å; P596-L599 PolarHBondContact O-N 3.21Å
597	E	56.8	Low	76.4	Confident	77 Å²	77	45.7 Å²	45.7	36%	0.36	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-44.9	-47.4	175.3	-64.5	163	173.1	0	0	111.9	K435 K438 T595 L599 I600 G601	K435-E597 VanDerWaalsContact CE-OE2 3.25Å; K435-E597 WeakPolarHBondContact CE-OE2 3.33Å; K435-E597 IonicContact NZ-OE2 3.99Å; K438-E597 IonicContact NZ-OE1 2.76Å; K438-E597 PolarHBondContact NZ-OE1 2.85Å; T595-E597 PolarHBondContact O-N 2.95Å; E597-L599 VanDerWaalsContact C-N 3.25Å; E597-L599 PolarHBondContact O-N 2.96Å; E597-I600 PolarHBondContact O-N 2.68Å; E597-I600 VanDerWaalsContact O-N 3.17Å; E597-G601 PolarHBondContact O-N 3.3Å
598	D	51	Low	76.1	Confident	92 Å²	92	44.9 Å²	44.9	49%	0.492	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-78.7	1.5	-174.9	-50.2	-40.4	0	0	0	113.9	W58 K435 P596	W58-D598 HydrophobicContact CH2-CB 3.99Å; W58-D598 HydrophobicContact CZ3-CB 4.2Å; W58-D598 VanDerWaalsContact CZ3-OD2 3.3Å; W58-D598 WeakPolarHBondContact CZ3-OD2 3.23Å; K435-D598 IonicContact NZ-OD1 3.8Å; K435-D598 PolarHBondContact NZ-OD1 3.3Å; K435-D598 IonicContact NZ-OD2 2.75Å; K435-D598 PolarHBondContact NZ-OD2 3.12Å; P596-D598 PolarHBondContact O-N 3.39Å
599	L	50.8	Low	75.7	Confident	124 Å²	124	47.5 Å²	47.5	65%	0.649	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-89.4	-15.9	167.1	-112.1	75.1	0	0	0	113	P596 E597	P596-L599 HydrophobicContact CB-CB 4.19Å; P596-L599 HydrophobicContact CB-CD1 4.14Å; P596-L599 HydrophobicContact CG-CB 4.49Å; P596-L599 HydrophobicContact CG-CD1 4.41Å; P596-L599 HydrophobicContact CG-CD2 4.44Å; P596-L599 WeakPolarHBondContact O-CB 3.38Å; P596-L599 PolarHBondContact O-N 3.21Å; E597-L599 VanDerWaalsContact C-N 3.25Å; E597-L599 PolarHBondContact O-N 2.96Å
600	I	58.2	Low	75.3	Confident	20 Å²	20	50.8 Å²	50.8	10%	0.103	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.5	-45.8	-167.3	-59.6	-174.9	0	0	0	109.9	E597 I602 K631 M674 L678	E597-I600 PolarHBondContact O-N 2.68Å; E597-I600 VanDerWaalsContact O-N 3.17Å; I600-I602 HydrophobicContact CG2-CB 3.82Å; I600-I602 HydrophobicContact CG2-CD1 3.97Å; I600-I602 HydrophobicContact CG2-CG1 4.23Å; I600-I602 WeakPolarHBondContact CG2-O 3.18Å; I600-I602 WeakPolarHBondContact O-CD1 3.3Å; I600-I602 WeakPolarHBondContact O-CG1 3.24Å; I600-I602 PolarHBondContact O-N 3.43Å; I600-K631 WeakPolarHBondContact O-CE 3.34Å; I600-K631 PolarHBondContact O-NZ 2.69Å; I600-M674 HydrophobicContact CD1-SD 3.98Å; I600-M674 HydrophobicContact CG1-CE 4.26Å; I600-M674 HydrophobicContact CG1-CG 4.47Å; I600-M674 HydrophobicContact CG1-SD 3.92Å; I600-M674 HydrophobicContact CG2-CG 3.82Å; I600-M674 HydrophobicContact CG2-SD 4.38Å; I600-L678 HydrophobicContact CD1-CD2 4.34Å; I600-L678 HydrophobicContact CG2-CD1 4.03Å
601	G	64.9	Low	75.3	Confident	7 Å²	7	48.8 Å²	48.8	7%	0.072	25%	0.251	C	S	.	.	S	Bend	trans	73.1	2.1	-175.4	0	0	0	0	0	114.3	E597 V626 Y627 D628	E597-G601 PolarHBondContact O-N 3.3Å; G601-V626 CarbonylContact O-C 3.49Å; G601-V626 WeakPolarHBondContact O-CA 3.37Å; G601-Y627 PolarHBondContact O-N 2.75Å; G601-D628 PolarHBondContact O-N 2.79Å
602	I	75.8	Confident	75.5	Confident	12 Å²	12	47.8 Å²	47.8	6%	0.062	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	144.5	-169.8	-43.6	143.2	0	0	0	108.4	I600 L624 R625 V626 K631 Y635 D671 I675 L678	I600-I602 HydrophobicContact CG2-CB 3.82Å; I600-I602 HydrophobicContact CG2-CD1 3.97Å; I600-I602 HydrophobicContact CG2-CG1 4.23Å; I600-I602 WeakPolarHBondContact CG2-O 3.18Å; I600-I602 WeakPolarHBondContact O-CD1 3.3Å; I600-I602 WeakPolarHBondContact O-CG1 3.24Å; I600-I602 PolarHBondContact O-N 3.43Å; I602-L624 HydrophobicContact CG2-CD1 3.4Å; I602-L624 VanDerWaalsContact CG2-CD1 3.4Å; I602-L624 HydrophobicContact CG2-CG 4Å; I602-R625 CarbonylContact C-O 3.58Å; I602-R625 WeakPolarHBondContact CA-O 3.39Å; I602-V626 HydrophobicContact CG1-CG2 4.18Å; I602-V626 HydrophobicContact CG2-CG2 4.15Å; I602-K631 HydrophobicContact CG1-CD 4.41Å; I602-Y635 VanDerWaalsContact CD1-OH 3.28Å; I602-Y635 WeakPolarHBondContact CD1-OH 3.5Å; I602-D671 HydrophobicContact CD1-CB 4.25Å; I602-I675 HydrophobicContact CD1-CD1 4.18Å; I602-I675 HydrophobicContact CD1-CG1 4.17Å; I602-I675 HydrophobicContact CG2-CD1 4.4Å; I602-I675 HydrophobicContact CG2-CG1 4.43Å; I602-L678 HydrophobicContact CB-CD1 4.48Å
603	R	78	Confident	75.9	Confident	96 Å²	96	47.1 Å²	47.1	36%	0.362	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	143.8	174.5	-168.8	-179.7	-174.3	-158.3	13.8	109.9	E566 E605 L624 R625 Y627	E566-R603 IonicContact OE1-NH2 3.31Å; R603-E605 VanDerWaalsContact CD-OE1 3.3Å; R603-E605 WeakPolarHBondContact CD-OE1 3.48Å; R603-E605 HydrophobicContact CG-CG 4.27Å; R603-E605 IonicContact CZ-OE1 2.87Å; R603-E605 IonicContact NE-OE1 2.87Å; R603-E605 IonicContact NH1-OE1 2.76Å; R603-E605 PolarHBondContact NH1-OE1 2.88Å; R603-L624 CarbonylContact O-C 3.49Å; R603-L624 WeakPolarHBondContact O-CA 3.47Å; R603-R625 PolarHBondContact N-O 3.38Å; R603-R625 PolarHBondContact O-N 3.07Å; R603-Y627 HydrophobicContact CB-CD2 4.25Å; R603-Y627 HydrophobicContact CB-CE2 3.85Å
604	V	87	Confident	76	Confident	3 Å²	3	50.9 Å²	50.9	2%	0.018	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	134.5	165.2	-179.4	0	0	0	0	108.7	M622 Q623 L624 F645 L678 I679 K682	V604-M622 HydrophobicContact CG1-CE 3.7Å; V604-Q623 WeakPolarHBondContact CA-O 3.44Å; V604-L624 HydrophobicContact CG2-CD1 3.57Å; V604-F645 HydrophobicContact CG1-CZ 4.44Å; V604-L678 HydrophobicContact CB-CB 4.28Å; V604-L678 HydrophobicContact CG2-CB 3.66Å; V604-L678 HydrophobicContact CG2-CD1 4.27Å; V604-I679 HydrophobicContact CG1-CG1 4.38Å; V604-I679 HydrophobicContact CG2-CG1 4.17Å; V604-K682 HydrophobicContact CB-CG 4.28Å; V604-K682 HydrophobicContact CG1-CG 4.13Å; V604-K682 WeakPolarHBondContact O-CE 3.31Å
605	E	86.2	Confident	76.2	Confident	37 Å²	37	56.2 Å²	56.2	17%	0.173	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	153.8	176	-70	171.2	-149.6	0	0	109.6	R603 M622 Q623 R625	R603-E605 VanDerWaalsContact CD-OE1 3.3Å; R603-E605 WeakPolarHBondContact CD-OE1 3.48Å; R603-E605 HydrophobicContact CG-CG 4.27Å; R603-E605 IonicContact CZ-OE1 2.87Å; R603-E605 IonicContact NE-OE1 2.87Å; R603-E605 IonicContact NH1-OE1 2.76Å; R603-E605 PolarHBondContact NH1-OE1 2.88Å; E605-M622 CarbonylContact O-C 3.52Å; E605-M622 VanDerWaalsContact O-CA 3.31Å; E605-M622 WeakPolarHBondContact O-CA 3.31Å; E605-Q623 PolarHBondContact N-O 3.39Å; E605-Q623 PolarHBondContact O-N 2.92Å; E605-R625 IonicContact OE1-CZ 2.71Å; E605-R625 IonicContact OE1-NH1 2.7Å; E605-R625 PolarHBondContact OE1-NH1 2.84Å; E605-R625 IonicContact OE2-CZ 2.83Å; E605-R625 IonicContact OE2-NH1 2.65Å; E605-R625 PolarHBondContact OE2-NH1 2.81Å; E605-R625 IonicContact OE2-NH2 2.91Å; E605-R625 PolarHBondContact OE2-NH2 2.86Å
606	I	89.7	Confident	76.9	Confident	22 Å²	22	57.1 Å²	57.1	11%	0.113	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	119.9	167.5	-59.5	169.5	0	0	0	105.9	R609 I620 Q621 M622 F686	I606-R609 HydrophobicContact CB-CB 4.22Å; I606-R609 HydrophobicContact CG2-CB 4.12Å; I606-I620 HydrophobicContact CD1-CD1 3.86Å; I606-I620 HydrophobicContact CG1-CD1 4.25Å; I606-I620 HydrophobicContact CG2-CB 4.26Å; I606-I620 HydrophobicContact CG2-CD1 4.46Å; I606-Q621 CarbonylContact C-O 3.6Å; I606-M622 HydrophobicContact CG1-CE 4.04Å; I606-M622 HydrophobicContact CG1-CG 4.39Å; I606-F686 HydrophobicContact CD1-CB 3.94Å; I606-F686 HydrophobicContact CD1-CD2 3.69Å; I606-F686 HydrophobicContact CD1-CG 4.15Å
607	K	86.7	Confident	78.1	Confident	91 Å²	91	58.2 Å²	58.2	40%	0.396	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-47.2	-168.5	-81.2	-165.5	167.2	-168.9	0	113	Q621 Q623	K607-Q621 HydrophobicContact CB-CB 4.41Å; K607-Q621 PolarHBondContact N-O 3.07Å; K607-Q623 VanDerWaalsContact CE-CD 3.45Å; K607-Q623 HydrophobicContact CG-CB 4.19Å
608	N	86.3	Confident	79.7	Confident	77 Å²	77	57 Å²	57	41%	0.412	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	25.4	-171.1	-61.5	-14.5	0	0	0	112.3	D610 A611 D612	N608-D610 PolarHBondContact O-N 3.48Å; N608-A611 HydrophobicContact CB-CB 4.48Å; N608-A611 WeakPolarHBondContact O-CA 3.44Å; N608-A611 WeakPolarHBondContact O-CB 3.46Å; N608-A611 PolarHBondContact O-N 2.91Å; N608-D612 VanDerWaalsContact C-OD2 3.23Å; N608-D612 WeakPolarHBondContact CB-OD2 3.33Å; N608-D612 PolarHBondContact O-N 3.49Å
609	R	85.4	Confident	81.6	Confident	56 Å²	56	58.2 Å²	58.2	21%	0.211	30%	0.299	C	S	.	.	H	α-helix	trans	-39.1	-46.7	-171.4	172.9	170.4	163.1	84.1	-10.4	114.5	E569 I606 L613 F686 D689	E569-R609 VanDerWaalsContact CD-NH2 3.34Å; E569-R609 IonicContact OE1-NH2 2.67Å; E569-R609 PolarHBondContact OE1-NH2 2.94Å; E569-R609 IonicContact OE2-CZ 3.15Å; E569-R609 IonicContact OE2-NE 2.76Å; E569-R609 IonicContact OE2-NH2 3.41Å; E569-R609 PolarHBondContact OE2-NH2 2.94Å; I606-R609 HydrophobicContact CB-CB 4.22Å; I606-R609 HydrophobicContact CG2-CB 4.12Å; R609-L613 HydrophobicContact CG-CD1 3.83Å; R609-L613 VanDerWaalsContact O-CB 3.26Å; R609-L613 WeakPolarHBondContact O-CB 3.5Å; R609-L613 WeakPolarHBondContact O-CG 3.27Å; R609-L613 PolarHBondContact O-N 3.02Å; R609-F686 HydrophobicContact CG-CD2 4.49Å; R609-F686 HydrophobicContact CG-CE2 4.48Å; R609-D689 IonicContact CZ-OD2 3.6Å; R609-D689 IonicContact NH1-OD2 3.7Å; R609-D689 PolarHBondContact NH1-OD2 3.44Å; R609-D689 IonicContact NH2-OD2 2.68Å; R609-D689 PolarHBondContact NH2-OD2 3.27Å
610	D	82.1	Confident	83.6	Confident	120 Å²	120	52.3 Å²	52.3	64%	0.642	27%	0.268	S	S	*	.	H	α-helix	trans	-72.4	-32.4	-177.8	-65.9	-19.6	0	0	0	113.4	N608 N614	N608-D610 PolarHBondContact O-N 3.48Å; D610-N614 PolarHBondContact O-N 3.36Å; D610-N614 PolarHBondContact O-ND2 3.36Å
611	A	84.7	Confident	85.2	Confident	46 Å²	46	55.1 Å²	55.1	38%	0.38	28%	0.281	S	S	.	.	H	α-helix	trans	-73.7	-50.4	172.9	0	0	0	0	0	109.9	N608 L613 N614 D615	N608-A611 HydrophobicContact CB-CB 4.48Å; N608-A611 WeakPolarHBondContact O-CA 3.44Å; N608-A611 WeakPolarHBondContact O-CB 3.46Å; N608-A611 PolarHBondContact O-N 2.91Å; A611-L613 PolarHBondContact O-N 3.36Å; A611-L613 VanDerWaalsContact O-N 3.16Å; A611-N614 PolarHBondContact O-N 2.71Å; A611-D615 PolarHBondContact O-N 2.91Å
612	D	88	Confident	86.5	Confident	8 Å²	8	54.8 Å²	54.8	4%	0.043	28%	0.277	C	S	.	.	H	α-helix	trans	-57.3	-35	-179.6	-57.9	-36.6	0	0	0	112.3	N608 L616 N617 I620 F686	N608-D612 VanDerWaalsContact C-OD2 3.23Å; N608-D612 WeakPolarHBondContact CB-OD2 3.33Å; N608-D612 PolarHBondContact O-N 3.49Å; D612-L616 WeakPolarHBondContact O-CA 3.5Å; D612-L616 PolarHBondContact O-N 2.73Å; D612-L616 VanDerWaalsContact O-N 3.09Å; D612-N617 HydrophobicContact CB-CB 4.16Å; D612-N617 PolarHBondContact O-N 3.13Å; D612-N617 PolarHBondContact OD1-ND2 3.36Å; D612-I620 HydrophobicContact CB-CG2 3.89Å; D612-F686 HydrophobicContact CB-CE2 3.86Å; D612-F686 HydrophobicContact CB-CZ 3.57Å
613	L	85.3	Confident	87.2	Confident	22 Å²	22	54.8 Å²	54.8	12%	0.115	28%	0.277	C	S	.	.	H	α-helix	trans	-74.7	-26.4	174.4	-85.6	165.7	0	0	0	114.9	R609 A611 F686 D689 R690	R609-L613 HydrophobicContact CG-CD1 3.83Å; R609-L613 VanDerWaalsContact O-CB 3.26Å; R609-L613 WeakPolarHBondContact O-CB 3.5Å; R609-L613 WeakPolarHBondContact O-CG 3.27Å; R609-L613 PolarHBondContact O-N 3.02Å; A611-L613 PolarHBondContact O-N 3.36Å; A611-L613 VanDerWaalsContact O-N 3.16Å; L613-F686 HydrophobicContact CD1-CE2 4.27Å; L613-F686 HydrophobicContact CD2-CE1 4.37Å; L613-F686 HydrophobicContact CD2-CE2 4.25Å; L613-F686 HydrophobicContact CD2-CZ 4.13Å; L613-F686 HydrophobicContact CG-CD2 4.23Å; L613-F686 HydrophobicContact CG-CE2 3.65Å; L613-F686 HydrophobicContact CG-CZ 3.81Å; L613-D689 HydrophobicContact CD1-CB 4.09Å; L613-D689 HydrophobicContact CD2-CB 3.68Å; L613-R690 HydrophobicContact CD2-CB 4.25Å
614	N	83.6	Confident	87.7	Confident	84 Å²	84	50.3 Å²	50.3	45%	0.449	26%	0.26	S	S	.	.	H	α-helix	trans	-86.3	-40.2	178.4	-82.6	-62.5	0	0	0	111.9	D610 A611 L616 R693	D610-N614 PolarHBondContact O-N 3.36Å; D610-N614 PolarHBondContact O-ND2 3.36Å; A611-N614 PolarHBondContact O-N 2.71Å; N614-L616 VanDerWaalsContact C-N 3.27Å; N614-R693 PolarHBondContact OD1-NH2 3.28Å
615	D	86.6	Confident	87.5	Confident	115 Å²	115	53.4 Å²	53.4	62%	0.615	27%	0.272	S	S	*	.	H	α-helix	trans	-81.8	-9.5	178.4	-60.2	-30.8	0	0	0	112.2	A611 N617	A611-D615 PolarHBondContact O-N 2.91Å; D615-N617 VanDerWaalsContact C-N 3.32Å
616	L	86.2	Confident	87.1	Confident	55 Å²	55	52.3 Å²	52.3	29%	0.288	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	35.4	-179.1	-58.2	165.7	0	0	0	113.2	D612 N614 R690 L694	D612-L616 WeakPolarHBondContact O-CA 3.5Å; D612-L616 PolarHBondContact O-N 2.73Å; D612-L616 VanDerWaalsContact O-N 3.09Å; N614-L616 VanDerWaalsContact C-N 3.27Å; L616-R690 HydrophobicContact CD2-CG 3.84Å; L616-L694 HydrophobicContact CD1-CD2 3.74Å; L616-L694 HydrophobicContact CD2-CD2 4.1Å; L616-L694 HydrophobicContact CD2-CG 4.11Å
617	N	87	Confident	86.2	Confident	58 Å²	58	57.1 Å²	57.1	31%	0.31	29%	0.285	S	S	.	.			trans	-56.7	141.2	-178.4	-68.9	-20.5	0	0	0	111.9	D612 D615	D612-N617 HydrophobicContact CB-CB 4.16Å; D612-N617 PolarHBondContact O-N 3.13Å; D612-N617 PolarHBondContact OD1-ND2 3.36Å; D615-N617 VanDerWaalsContact C-N 3.32Å
618	V	89.5	Confident	85.4	Confident	51 Å²	51	55.6 Å²	55.6	31%	0.309	28%	0.281	S	S	.	.	S	Bend	trans	-90.5	-40.2	175.3	-178.6	0	0	0	0	111	D648 I649 E650	V618-D648 WeakPolarHBondContact CG1-OD1 3.37Å; V618-I649 WeakPolarHBondContact O-CB 3.31Å; V618-I649 WeakPolarHBondContact O-CD1 3.47Å; V618-I649 VanDerWaalsContact O-CG1 3.26Å; V618-I649 WeakPolarHBondContact O-CG1 3.43Å; V618-I649 PolarHBondContact O-N 2.78Å; V618-E650 HydrophobicContact CG1-CB 4.03Å; V618-E650 HydrophobicContact CG1-CG 3.99Å
619	E	92.1	Very high	84.5	Confident	119 Å²	119	58.2 Å²	58.2	56%	0.556	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	127.1	169.9	-170.7	-170	161.5	0	0	109.9	A646	E619-A646 HydrophobicContact CG-CB 4.11Å; E619-A646 VanDerWaalsContact OE1-CB 3.25Å; E619-A646 WeakPolarHBondContact OE1-CB 3.5Å
620	I	92.5	Very high	83.7	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	141.8	177	53.5	167.8	0	0	0	112.2	I606 D612 M622 A646 F647 I649 F686	I606-I620 HydrophobicContact CD1-CD1 3.86Å; I606-I620 HydrophobicContact CG1-CD1 4.25Å; I606-I620 HydrophobicContact CG2-CB 4.26Å; I606-I620 HydrophobicContact CG2-CD1 4.46Å; D612-I620 HydrophobicContact CB-CG2 3.89Å; I620-M622 HydrophobicContact CD1-CG 4.3Å; I620-M622 HydrophobicContact CD1-SD 4.4Å; I620-M622 HydrophobicContact CG1-CG 4.35Å; I620-A646 CarbonylContact O-C 3.27Å; I620-F647 HydrophobicContact CG1-CB 4.25Å; I620-F647 VanDerWaalsContact CG1-O 3.32Å; I620-F647 WeakPolarHBondContact CG1-O 3.36Å; I620-F647 PolarHBondContact N-O 2.93Å; I620-F647 PolarHBondContact O-N 2.86Å; I620-I649 HydrophobicContact CB-CD1 4.48Å; I620-I649 HydrophobicContact CD1-CD1 4.12Å; I620-I649 HydrophobicContact CD1-CG1 3.99Å; I620-I649 HydrophobicContact CG1-CD1 4.11Å; I620-I649 HydrophobicContact CG1-CG1 3.98Å; I620-I649 HydrophobicContact CG2-CD1 3.62Å; I620-I649 HydrophobicContact CG2-CG1 4.41Å; I620-F686 HydrophobicContact CD1-CG 4.4Å; I620-F686 HydrophobicContact CG2-CE1 4Å; I620-F686 HydrophobicContact CG2-CE2 4.1Å; I620-F686 HydrophobicContact CG2-CZ 3.77Å
621	Q	92.3	Very high	83.1	Confident	79 Å²	79	58.4 Å²	58.4	37%	0.369	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	112.9	177.5	-65.8	-170	4	0	0	111	I606 K607	I606-Q621 CarbonylContact C-O 3.6Å; K607-Q621 HydrophobicContact CB-CB 4.41Å; K607-Q621 PolarHBondContact N-O 3.07Å
622	M	91.5	Very high	82.3	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	155.4	179.7	-56.2	-168.4	88.1	0	0	111.6	V604 E605 I606 I620 Q644 F645 F647 I679 K682 V683	V604-M622 HydrophobicContact CG1-CE 3.7Å; E605-M622 CarbonylContact O-C 3.52Å; E605-M622 VanDerWaalsContact O-CA 3.31Å; E605-M622 WeakPolarHBondContact O-CA 3.31Å; I606-M622 HydrophobicContact CG1-CE 4.04Å; I606-M622 HydrophobicContact CG1-CG 4.39Å; I620-M622 HydrophobicContact CD1-CG 4.3Å; I620-M622 HydrophobicContact CD1-SD 4.4Å; I620-M622 HydrophobicContact CG1-CG 4.35Å; M622-Q644 WeakPolarHBondContact O-CA 3.48Å; M622-F645 HydrophobicContact CB-CD1 4.15Å; M622-F645 HydrophobicContact CB-CD2 3.94Å; M622-F645 HydrophobicContact CB-CE1 3.69Å; M622-F645 HydrophobicContact CB-CE2 3.47Å; M622-F645 VanDerWaalsContact CB-CE2 3.47Å; M622-F645 HydrophobicContact CB-CG 4.26Å; M622-F645 HydrophobicContact CB-CZ 3.32Å; M622-F645 HydrophobicContact CG-CE2 3.98Å; M622-F645 HydrophobicContact CG-CZ 4.18Å; M622-F645 PolarHBondContact N-O 3.02Å; M622-F645 PolarHBondContact O-N 2.95Å; M622-F645 VanDerWaalsContact O-O 3.11Å; M622-F645 HydrophobicContact SD-CE2 3.6Å; M622-F645 VanDerWaalsContact SD-CE2 3.6Å; M622-F645 HydrophobicContact SD-CZ 3.93Å; M622-F647 HydrophobicContact CG-CB 4.04Å; M622-F647 HydrophobicContact SD-CB 3.57Å; M622-F647 VanDerWaalsContact SD-CB 3.57Å; M622-F647 HydrophobicContact SD-CD2 4.22Å; M622-F647 HydrophobicContact SD-CG 3.92Å; M622-I679 HydrophobicContact CE-CG2 4.38Å; M622-I679 HydrophobicContact SD-CG2 4.16Å; M622-K682 HydrophobicContact CE-CB 3.64Å; M622-K682 HydrophobicContact CE-CG 4.4Å; M622-V683 HydrophobicContact CE-CG2 4.3Å; M622-V683 HydrophobicContact SD-CG2 4.35Å
623	Q	89.6	Confident	81.5	Confident	12 Å²	12	68.3 Å²	68.3	6%	0.056	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	120.8	178.5	-169.4	-175.8	5.1	0	0	111.4	V604 E605 K607 R625 E641 L643	V604-Q623 WeakPolarHBondContact CA-O 3.44Å; E605-Q623 PolarHBondContact N-O 3.39Å; E605-Q623 PolarHBondContact O-N 2.92Å; K607-Q623 VanDerWaalsContact CE-CD 3.45Å; K607-Q623 HydrophobicContact CG-CB 4.19Å; Q623-R625 HydrophobicContact CG-CG 4.28Å; Q623-R625 VanDerWaalsContact NE2-NE 3.2Å; Q623-E641 PolarHBondContact NE2-O 2.81Å; Q623-L643 CarbonylContact C-O 3.59Å; Q623-L643 WeakPolarHBondContact CA-O 3.35Å
624	L	88.7	Confident	80.9	Confident	1 Å²	1	71.5 Å²	71.5	1%	0.005	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	130.5	172.8	-175.7	78.3	0	0	0	109.8	I602 R603 V604 F637 G642 L643 F645 I667 I675	I602-L624 HydrophobicContact CG2-CD1 3.4Å; I602-L624 VanDerWaalsContact CG2-CD1 3.4Å; I602-L624 HydrophobicContact CG2-CG 4Å; R603-L624 CarbonylContact O-C 3.49Å; R603-L624 WeakPolarHBondContact O-CA 3.47Å; V604-L624 HydrophobicContact CG2-CD1 3.57Å; L624-F637 HydrophobicContact CD2-CE1 4.12Å; L624-G642 CarbonylContact O-C 3.58Å; L624-G642 WeakPolarHBondContact O-CA 3.37Å; L624-L643 HydrophobicContact CB-CB 4.2Å; L624-L643 HydrophobicContact CD2-CB 4.44Å; L624-L643 HydrophobicContact CD2-CD2 4.14Å; L624-L643 PolarHBondContact N-O 3.24Å; L624-L643 PolarHBondContact O-N 3.49Å; L624-F645 HydrophobicContact CB-CE1 4.24Å; L624-I667 HydrophobicContact CD2-CD1 3.56Å; L624-I667 HydrophobicContact CD2-CG1 3.95Å; L624-I675 HydrophobicContact CD1-CD1 4.25Å; L624-I675 HydrophobicContact CD1-CG1 4.28Å; L624-I675 HydrophobicContact CD1-CG2 3.87Å; L624-I675 HydrophobicContact CD2-CD1 4.2Å
625	R	83.3	Confident	80.6	Confident	69 Å²	69	68.1 Å²	68.1	26%	0.26	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	137.7	176.5	-62.6	-172.4	-168.1	134.9	10.1	111.2	I602 R603 E605 Q623 Y627	I602-R625 CarbonylContact C-O 3.58Å; I602-R625 WeakPolarHBondContact CA-O 3.39Å; R603-R625 PolarHBondContact N-O 3.38Å; R603-R625 PolarHBondContact O-N 3.07Å; E605-R625 IonicContact OE1-CZ 2.71Å; E605-R625 IonicContact OE1-NH1 2.7Å; E605-R625 PolarHBondContact OE1-NH1 2.84Å; E605-R625 IonicContact OE2-CZ 2.83Å; E605-R625 IonicContact OE2-NH1 2.65Å; E605-R625 PolarHBondContact OE2-NH1 2.81Å; E605-R625 IonicContact OE2-NH2 2.91Å; E605-R625 PolarHBondContact OE2-NH2 2.86Å; Q623-R625 HydrophobicContact CG-CG 4.28Å; Q623-R625 VanDerWaalsContact NE2-NE 3.2Å; R625-Y627 HydrophobicContact CB-CD2 4.38Å; R625-Y627 HydrophobicContact CB-CE2 3.74Å
626	V	78.7	Confident	79.8	Confident	13 Å²	13	71.9 Å²	71.9	8%	0.079	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	113.2	177.6	174.1	0	0	0	0	109.5	G601 I602 K631 R632 Y635 F637	G601-V626 CarbonylContact O-C 3.49Å; G601-V626 WeakPolarHBondContact O-CA 3.37Å; I602-V626 HydrophobicContact CG1-CG2 4.18Å; I602-V626 HydrophobicContact CG2-CG2 4.15Å; V626-K631 HydrophobicContact CG1-CB 3.89Å; V626-R632 HydrophobicContact CG1-CG 3.94Å; V626-Y635 HydrophobicContact CG1-CD2 4.22Å; V626-Y635 HydrophobicContact CG1-CE2 4.44Å; V626-Y635 HydrophobicContact CG2-CD1 3.83Å; V626-Y635 HydrophobicContact CG2-CD2 3.74Å; V626-Y635 HydrophobicContact CG2-CE1 3.87Å; V626-Y635 HydrophobicContact CG2-CE2 3.83Å; V626-Y635 HydrophobicContact CG2-CG 3.76Å; V626-F637 HydrophobicContact CB-CZ 4.34Å; V626-F637 HydrophobicContact CG2-CE1 4.48Å; V626-F637 HydrophobicContact CG2-CZ 3.77Å
627	Y	70.8	Confident	79.1	Confident	124 Å²	124	70.9 Å²	70.9	49%	0.486	31%	0.314	S	S	.	.			trans	-91.9	-34	-178.4	-71.9	-87	0	0	0	112.4	G601 R603 R625 E629 R632	G601-Y627 PolarHBondContact O-N 2.75Å; R603-Y627 HydrophobicContact CB-CD2 4.25Å; R603-Y627 HydrophobicContact CB-CE2 3.85Å; R625-Y627 HydrophobicContact CB-CD2 4.38Å; R625-Y627 HydrophobicContact CB-CE2 3.74Å; Y627-E629 PolarHBondContact O-N 3.4Å; Y627-R632 PolarHBondContact O-NH2 2.89Å
628	D	68.4	Low	78	Confident	58 Å²	58	74.5 Å²	74.5	31%	0.31	33%	0.327	S	S	.	.			trans	-69.5	114.2	179.6	177.9	15.8	0	0	0	111.6	G601 K630 K631 R632	G601-D628 PolarHBondContact O-N 2.79Å; D628-K630 PolarHBondContact O-N 2.93Å; D628-K630 WeakPolarHBondContact OD1-CB 3.45Å; D628-K630 PolarHBondContact OD1-N 3.42Å; D628-K631 HydrophobicContact CB-CB 4.22Å; D628-K631 HydrophobicContact CB-CG 4.45Å; D628-K631 PolarHBondContact O-N 3.49Å; D628-R632 WeakPolarHBondContact O-CG 3.32Å; D628-R632 PolarHBondContact O-N 2.97Å
629	E	67.7	Low	76.4	Confident	132 Å²	132	78.3 Å²	78.3	62%	0.617	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-24.6	178.7	-163.9	148.3	-84.7	0	0	113.8	Y627 R632	Y627-E629 PolarHBondContact O-N 3.4Å; E629-R632 IonicContact OE1-CZ 2.55Å; E629-R632 IonicContact OE1-NH1 3.84Å; E629-R632 PolarHBondContact OE1-NH1 3.01Å; E629-R632 IonicContact OE1-NH2 3.65Å; E629-R632 PolarHBondContact OE1-NH2 2.8Å; E629-R632 VanDerWaalsContact OE1-NH2 3.09Å
630	K	68.8	Low	74.6	Confident	141 Å²	141	80.2 Å²	80.2	61%	0.613	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-42.2	173.5	-62.5	173.1	-175.6	171.1	0	111.1	M54 D628	M54-K630 PolarHBondContact SD-NZ 2.86Å; D628-K630 PolarHBondContact O-N 2.93Å; D628-K630 WeakPolarHBondContact OD1-CB 3.45Å; D628-K630 PolarHBondContact OD1-N 3.42Å
631	K	70	Confident	73.2	Confident	39 Å²	39	85.6 Å²	85.6	17%	0.17	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-33.1	177.3	-78.3	-168.5	168.2	-162.9	0	113.8	I600 I602 V626 D628 K633 Q634 Y635 D671	I600-K631 WeakPolarHBondContact O-CE 3.34Å; I600-K631 PolarHBondContact O-NZ 2.69Å; I602-K631 HydrophobicContact CG1-CD 4.41Å; V626-K631 HydrophobicContact CG1-CB 3.89Å; D628-K631 HydrophobicContact CB-CB 4.22Å; D628-K631 HydrophobicContact CB-CG 4.45Å; D628-K631 PolarHBondContact O-N 3.49Å; K631-K633 PolarHBondContact O-N 2.95Å; K631-Q634 WeakPolarHBondContact O-CB 3.46Å; K631-Q634 PolarHBondContact O-N 2.75Å; K631-Y635 HydrophobicContact CB-CE2 4.26Å; K631-Y635 WeakPolarHBondContact O-CD2 3.27Å; K631-D671 WeakPolarHBondContact CE-OD2 3.49Å; K631-D671 IonicContact NZ-OD1 2.79Å; K631-D671 PolarHBondContact NZ-OD1 2.97Å; K631-D671 IonicContact NZ-OD2 3.43Å; K631-D671 PolarHBondContact NZ-OD2 3.4Å
632	R	68.7	Low	72.5	Confident	69 Å²	69	82.5 Å²	82.5	26%	0.26	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-47.1	-37.6	-176.4	-73.7	-173.5	-143.4	133	15.7	114.1	V626 Y627 D628 E629 Q634 Y635 E639	V626-R632 HydrophobicContact CG1-CG 3.94Å; Y627-R632 PolarHBondContact O-NH2 2.89Å; D628-R632 WeakPolarHBondContact O-CG 3.32Å; D628-R632 PolarHBondContact O-N 2.97Å; E629-R632 IonicContact OE1-CZ 2.55Å; E629-R632 IonicContact OE1-NH1 3.84Å; E629-R632 PolarHBondContact OE1-NH1 3.01Å; E629-R632 IonicContact OE1-NH2 3.65Å; E629-R632 PolarHBondContact OE1-NH2 2.8Å; E629-R632 VanDerWaalsContact OE1-NH2 3.09Å; R632-Q634 PolarHBondContact O-N 3.05Å; R632-Y635 PolarHBondContact O-N 3.04Å; R632-E639 WeakPolarHBondContact CD-OE1 3.47Å; R632-E639 IonicContact NH1-OE1 3.01Å
633	K	69.9	Low	72.2	Confident	194 Å²	194	83.3 Å²	83.3	84%	0.843	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-65.1	-18.7	179.2	-63.7	-173.9	179.1	-176.5	0	115.2	K631	K631-K633 PolarHBondContact O-N 2.95Å
634	Q	72.6	Confident	72.2	Confident	88 Å²	88	86.9 Å²	86.9	41%	0.411	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-92.9	-18.2	-178.3	-159.6	178.4	-10.4	0	0	112.2	K631 R632 P668 E670	K631-Q634 WeakPolarHBondContact O-CB 3.46Å; K631-Q634 PolarHBondContact O-N 2.75Å; R632-Q634 PolarHBondContact O-N 3.05Å; Q634-P668 HydrophobicContact CG-CB 3.77Å; Q634-P668 HydrophobicContact CG-CG 3.83Å; Q634-E670 PolarHBondContact NE2-OE2 2.79Å
635	Y	77.4	Confident	72.3	Confident	13 Å²	13	88 Å²	88	5%	0.051	40%	0.396	C	S	.	.			trans	-95	147.9	176.5	-70.6	-99.5	0	0	0	110.5	I602 V626 K631 R632 F637 H666 I667 P668 D671 I675	I602-Y635 VanDerWaalsContact CD1-OH 3.28Å; I602-Y635 WeakPolarHBondContact CD1-OH 3.5Å; V626-Y635 HydrophobicContact CG1-CD2 4.22Å; V626-Y635 HydrophobicContact CG1-CE2 4.44Å; V626-Y635 HydrophobicContact CG2-CD1 3.83Å; V626-Y635 HydrophobicContact CG2-CD2 3.74Å; V626-Y635 HydrophobicContact CG2-CE1 3.87Å; V626-Y635 HydrophobicContact CG2-CE2 3.83Å; V626-Y635 HydrophobicContact CG2-CG 3.76Å; K631-Y635 HydrophobicContact CB-CE2 4.26Å; K631-Y635 WeakPolarHBondContact O-CD2 3.27Å; R632-Y635 PolarHBondContact O-N 3.04Å; Y635-F637 HydrophobicContact CD1-CD1 4.4Å; Y635-F637 AromaticContact CD1-CE1 3.64Å; Y635-F637 HydrophobicContact CD1-CE1 3.64Å; Y635-F637 HydrophobicContact CD1-CZ 4.25Å; Y635-F637 HydrophobicContact CG-CE1 4.23Å; Y635-H666 WeakPolarHBondContact CD1-O 3.44Å; Y635-I667 HydrophobicContact CE1-CB 4.46Å; Y635-I667 HydrophobicContact CE1-CG1 4.24Å; Y635-I667 HydrophobicContact CE1-CG2 4.3Å; Y635-P668 HydrophobicContact CE1-CG 4.41Å; Y635-P668 HydrophobicContact CE2-CG 4.01Å; Y635-D671 VanDerWaalsContact OH-CB 3.3Å; Y635-D671 WeakPolarHBondContact OH-CB 3.15Å; Y635-D671 VanDerWaalsContact OH-CG 3.31Å; Y635-D671 PolarHBondContact OH-OD2 3.06Å; Y635-I675 HydrophobicContact CE1-CD1 4.09Å
636	R	70	Confident	72.8	Confident	194 Å²	194	86.9 Å²	86.9	73%	0.732	40%	0.401	S	S	*	.			trans	-100.1	-3.5	-173.9	-64.3	-60.6	-169.3	165.4	2.1	115.4	Q665	R636-Q665 WeakPolarHBondContact CB-O 3.49Å; R636-Q665 WeakPolarHBondContact CG-O 3.5Å
637	F	71.1	Confident	73.5	Confident	35 Å²	35	86.3 Å²	86.3	15%	0.154	40%	0.397	C	S	.	.	S	Bend	trans	-89.3	155.9	176.8	61.9	-102.5	0	0	0	112.6	L624 V626 Y635 L643	L624-F637 HydrophobicContact CD2-CE1 4.12Å; V626-F637 HydrophobicContact CB-CZ 4.34Å; V626-F637 HydrophobicContact CG2-CE1 4.48Å; V626-F637 HydrophobicContact CG2-CZ 3.77Å; Y635-F637 HydrophobicContact CD1-CD1 4.4Å; Y635-F637 AromaticContact CD1-CE1 3.64Å; Y635-F637 HydrophobicContact CD1-CE1 3.64Å; Y635-F637 HydrophobicContact CD1-CZ 4.25Å; Y635-F637 HydrophobicContact CG-CE1 4.23Å; F637-L643 HydrophobicContact CD1-CB 3.68Å; F637-L643 HydrophobicContact CE1-CB 3.84Å; F637-L643 HydrophobicContact CG-CB 4.13Å; F637-L643 HydrophobicContact CZ-CB 4.44Å
638	K	63.6	Low	74.6	Confident	133 Å²	133	82.1 Å²	82.1	58%	0.578	38%	0.383	S	S	*	.			trans	-63.6	140	-177.7	-71.3	160.8	168.5	-179.1	0	112.2	N640 E641	K638-N640 PolarHBondContact O-N 3.26Å; K638-E641 HydrophobicContact CB-CB 4.48Å; K638-E641 VanDerWaalsContact CD-CD 3.49Å; K638-E641 HydrophobicContact CD-CG 4.43Å; K638-E641 WeakPolarHBondContact CD-OE2 3.39Å; K638-E641 IonicContact NZ-OE1 2.73Å; K638-E641 PolarHBondContact NZ-OE1 3.37Å; K638-E641 IonicContact NZ-OE2 3.89Å; K638-E641 PolarHBondContact NZ-OE2 2.81Å; K638-E641 PolarHBondContact O-N 3.19Å
639	E	56.9	Low	75.7	Confident	132 Å²	132	79.3 Å²	79.3	62%	0.617	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-24.1	-170.2	-60.1	-170	111	0	0	115.8	R632	R632-E639 WeakPolarHBondContact CD-OE1 3.47Å; R632-E639 IonicContact NH1-OE1 3.01Å
640	N	54.1	Low	76.7	Confident	159 Å²	159	78.4 Å²	78.4	85%	0.85	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	-14.8	-175.6	-64.1	-37.1	0	0	0	114.9	K638	K638-N640 PolarHBondContact O-N 3.26Å
641	E	64	Low	77.7	Confident	113 Å²	113	77.8 Å²	77.8	53%	0.528	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-27.8	-171.2	-70.9	173.6	-170.6	0	0	112.5	Q623 K638	Q623-E641 PolarHBondContact NE2-O 2.81Å; K638-E641 HydrophobicContact CB-CB 4.48Å; K638-E641 VanDerWaalsContact CD-CD 3.49Å; K638-E641 HydrophobicContact CD-CG 4.43Å; K638-E641 WeakPolarHBondContact CD-OE2 3.39Å; K638-E641 IonicContact NZ-OE1 2.73Å; K638-E641 PolarHBondContact NZ-OE1 3.37Å; K638-E641 IonicContact NZ-OE2 3.89Å; K638-E641 PolarHBondContact NZ-OE2 2.81Å; K638-E641 PolarHBondContact O-N 3.19Å
642	G	75.8	Confident	78.8	Confident	14 Å²	14	78.6 Å²	78.6	14%	0.144	37%	0.374	C	S	.	.			trans	69.9	164	-174.7	0	0	0	0	0	113.4	L624 Q644	L624-G642 CarbonylContact O-C 3.58Å; L624-G642 WeakPolarHBondContact O-CA 3.37Å; G642-Q644 PolarHBondContact O-N 3.02Å
643	L	85.8	Confident	79.9	Confident	17 Å²	17	77 Å²	77	9%	0.089	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	108	169.3	176.3	70.8	0	0	0	108.5	Q623 L624 F637 M661 H666 I667	Q623-L643 CarbonylContact C-O 3.59Å; Q623-L643 WeakPolarHBondContact CA-O 3.35Å; L624-L643 HydrophobicContact CB-CB 4.2Å; L624-L643 HydrophobicContact CD2-CB 4.44Å; L624-L643 HydrophobicContact CD2-CD2 4.14Å; L624-L643 PolarHBondContact N-O 3.24Å; L624-L643 PolarHBondContact O-N 3.49Å; F637-L643 HydrophobicContact CD1-CB 3.68Å; F637-L643 HydrophobicContact CE1-CB 3.84Å; F637-L643 HydrophobicContact CG-CB 4.13Å; F637-L643 HydrophobicContact CZ-CB 4.44Å; L643-M661 HydrophobicContact CD2-CB 4.4Å; L643-M661 HydrophobicContact CD2-CE 4.33Å; L643-M661 HydrophobicContact CD2-CG 3.94Å; L643-M661 HydrophobicContact CD2-SD 3.98Å; L643-H666 HydrophobicContact CD1-CB 4.14Å; L643-H666 VanDerWaalsContact CD1-CD2 3.44Å; L643-H666 WeakPolarHBondContact CD1-CD2 3.37Å; L643-H666 HydrophobicContact CD2-CB 3.79Å; L643-I667 HydrophobicContact CD2-CD1 4.24Å; L643-I667 HydrophobicContact CD2-CG1 4.33Å
644	Q	89.2	Confident	81	Confident	86 Å²	86	68.7 Å²	68.7	40%	0.402	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	140.3	169.8	175.7	172.9	-6.8	0	0	110.2	M622 G642	M622-Q644 WeakPolarHBondContact O-CA 3.48Å; G642-Q644 PolarHBondContact O-N 3.02Å
645	F	92	Very high	81.9	Confident	26 Å²	26	69.4 Å²	69.4	11%	0.114	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	158.1	177	57.8	-77.3	0	0	0	110	V604 M622 L624 V657 M661 I679	V604-F645 HydrophobicContact CG1-CZ 4.44Å; M622-F645 HydrophobicContact CB-CD1 4.15Å; M622-F645 HydrophobicContact CB-CD2 3.94Å; M622-F645 HydrophobicContact CB-CE1 3.69Å; M622-F645 HydrophobicContact CB-CE2 3.47Å; M622-F645 VanDerWaalsContact CB-CE2 3.47Å; M622-F645 HydrophobicContact CB-CG 4.26Å; M622-F645 HydrophobicContact CB-CZ 3.32Å; M622-F645 HydrophobicContact CG-CE2 3.98Å; M622-F645 HydrophobicContact CG-CZ 4.18Å; M622-F645 PolarHBondContact N-O 3.02Å; M622-F645 PolarHBondContact O-N 2.95Å; M622-F645 VanDerWaalsContact O-O 3.11Å; M622-F645 HydrophobicContact SD-CE2 3.6Å; M622-F645 VanDerWaalsContact SD-CE2 3.6Å; M622-F645 HydrophobicContact SD-CZ 3.93Å; L624-F645 HydrophobicContact CB-CE1 4.24Å; F645-V657 HydrophobicContact CD2-CG1 3.9Å; F645-V657 HydrophobicContact CE2-CG1 4.05Å; F645-M661 HydrophobicContact CB-CE 3.79Å; F645-M661 HydrophobicContact CD1-CE 3.36Å; F645-M661 HydrophobicContact CD2-CE 3.34Å; F645-M661 HydrophobicContact CE1-CE 3.65Å; F645-M661 HydrophobicContact CE2-CE 3.62Å; F645-M661 HydrophobicContact CG-CE 3.21Å; F645-M661 HydrophobicContact CZ-CE 3.77Å; F645-I679 HydrophobicContact CE2-CD1 3.76Å; F645-I679 HydrophobicContact CE2-CG1 4.29Å; F645-I679 HydrophobicContact CZ-CD1 3.54Å; F645-I679 HydrophobicContact CZ-CG1 3.87Å
646	A	92.6	Very high	82.6	Confident	45 Å²	45	74.5 Å²	74.5	37%	0.372	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	157.1	165.7	0	0	0	0	0	109.8	E619 I620	E619-A646 HydrophobicContact CG-CB 4.11Å; E619-A646 VanDerWaalsContact OE1-CB 3.25Å; E619-A646 WeakPolarHBondContact OE1-CB 3.5Å; I620-A646 CarbonylContact O-C 3.27Å
647	F	94.9	Very high	83.7	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	121.8	170.9	-169.7	-76.9	0	0	0	109.2	I620 M622 D652 P654 V657 I679 V683	I620-F647 HydrophobicContact CG1-CB 4.25Å; I620-F647 VanDerWaalsContact CG1-O 3.32Å; I620-F647 WeakPolarHBondContact CG1-O 3.36Å; I620-F647 PolarHBondContact N-O 2.93Å; I620-F647 PolarHBondContact O-N 2.86Å; M622-F647 HydrophobicContact CG-CB 4.04Å; M622-F647 HydrophobicContact SD-CB 3.57Å; M622-F647 VanDerWaalsContact SD-CB 3.57Å; M622-F647 HydrophobicContact SD-CD2 4.22Å; M622-F647 HydrophobicContact SD-CG 3.92Å; F647-D652 WeakPolarHBondContact CA-OD2 3.48Å; F647-D652 HydrophobicContact CD1-CB 4.19Å; F647-D652 HydrophobicContact CD2-CB 4.11Å; F647-D652 HydrophobicContact CE1-CB 3.85Å; F647-D652 HydrophobicContact CE2-CB 3.78Å; F647-D652 HydrophobicContact CG-CB 4.29Å; F647-D652 HydrophobicContact CZ-CB 3.63Å; F647-D652 VanDerWaalsContact CZ-O 3.31Å; F647-D652 WeakPolarHBondContact CZ-O 3.36Å; F647-P654 HydrophobicContact CE2-CG 4.19Å; F647-P654 HydrophobicContact CZ-CG 3.94Å; F647-V657 HydrophobicContact CD2-CB 4.33Å; F647-V657 HydrophobicContact CD2-CG1 4.26Å; F647-V657 HydrophobicContact CD2-CG2 3.87Å; F647-V657 HydrophobicContact CE2-CB 4.27Å; F647-V657 HydrophobicContact CE2-CG2 3.83Å; F647-I679 HydrophobicContact CD2-CG2 3.86Å; F647-I679 HydrophobicContact CE2-CG2 3.75Å; F647-V683 HydrophobicContact CD1-CG2 3.64Å; F647-V683 HydrophobicContact CD2-CG2 4.49Å; F647-V683 HydrophobicContact CE1-CB 4.33Å; F647-V683 HydrophobicContact CE1-CG1 3.89Å; F647-V683 HydrophobicContact CE1-CG2 3.51Å; F647-V683 HydrophobicContact CE2-CG2 4.38Å; F647-V683 HydrophobicContact CG-CG2 4.17Å; F647-V683 HydrophobicContact CZ-CG2 3.91Å
648	D	93	Very high	84.7	Confident	36 Å²	36	64.1 Å²	64.1	19%	0.193	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	116.4	172.5	-174.2	-46.4	0	0	0	110.2	V618 E650 N651 D652	V618-D648 WeakPolarHBondContact CG1-OD1 3.37Å; D648-E650 PolarHBondContact O-N 2.99Å; D648-E650 VanDerWaalsContact O-N 3.15Å; D648-E650 WeakPolarHBondContact OD1-CA 3.38Å; D648-E650 PolarHBondContact OD1-N 3.14Å; D648-N651 HydrophobicContact CB-CB 4.15Å; D648-N651 VanDerWaalsContact CG-ND2 3.3Å; D648-N651 PolarHBondContact OD1-N 3.13Å; D648-N651 PolarHBondContact OD1-ND2 3.2Å; D648-N651 PolarHBondContact OD2-ND2 3.09Å; D648-D652 HydrophobicContact CB-CB 4.33Å; D648-D652 PolarHBondContact N-OD2 3.19Å; D648-D652 WeakPolarHBondContact O-CB 3.25Å; D648-D652 PolarHBondContact O-N 2.68Å
649	I	90.7	Very high	86	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-22	-175.6	-68.8	161.8	0	0	0	113	V618 I620 F686 R687	V618-I649 WeakPolarHBondContact O-CB 3.31Å; V618-I649 WeakPolarHBondContact O-CD1 3.47Å; V618-I649 VanDerWaalsContact O-CG1 3.26Å; V618-I649 WeakPolarHBondContact O-CG1 3.43Å; V618-I649 PolarHBondContact O-N 2.78Å; I620-I649 HydrophobicContact CB-CD1 4.48Å; I620-I649 HydrophobicContact CD1-CD1 4.12Å; I620-I649 HydrophobicContact CD1-CG1 3.99Å; I620-I649 HydrophobicContact CG1-CD1 4.11Å; I620-I649 HydrophobicContact CG1-CG1 3.98Å; I620-I649 HydrophobicContact CG2-CD1 3.62Å; I620-I649 HydrophobicContact CG2-CG1 4.41Å; I649-F686 HydrophobicContact CD1-CD1 3.37Å; I649-F686 HydrophobicContact CD1-CE1 3.34Å; I649-F686 HydrophobicContact CD1-CG 4.41Å; I649-F686 HydrophobicContact CD1-CZ 4.34Å; I649-F686 HydrophobicContact CG1-CD1 4.39Å; I649-R687 HydrophobicContact CG2-CG 3.56Å; I649-R687 PolarHBondContact O-NE 2.64Å; I649-R687 PolarHBondContact O-NH2 3.45Å
650	E	89.6	Confident	87.6	Confident	112 Å²	112	61.3 Å²	61.3	52%	0.523	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-30.6	-173.8	-66.7	-178.4	-174	0	0	112.6	V618 D648 R690	V618-E650 HydrophobicContact CG1-CB 4.03Å; V618-E650 HydrophobicContact CG1-CG 3.99Å; D648-E650 PolarHBondContact O-N 2.99Å; D648-E650 VanDerWaalsContact O-N 3.15Å; D648-E650 WeakPolarHBondContact OD1-CA 3.38Å; D648-E650 PolarHBondContact OD1-N 3.14Å; E650-R690 IonicContact OE1-CZ 2.69Å; E650-R690 IonicContact OE1-NH1 3.3Å; E650-R690 PolarHBondContact OE1-NH1 3.07Å; E650-R690 IonicContact OE1-NH2 3.58Å; E650-R690 PolarHBondContact OE1-NH2 3.35Å
651	N	90.2	Very high	89.2	Confident	129 Å²	129	54.1 Å²	54.1	69%	0.69	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	-33.1	-178.2	-60.4	-61.4	0	0	0	114.8	D648	D648-N651 HydrophobicContact CB-CB 4.15Å; D648-N651 VanDerWaalsContact CG-ND2 3.3Å; D648-N651 PolarHBondContact OD1-N 3.13Å; D648-N651 PolarHBondContact OD1-ND2 3.2Å; D648-N651 PolarHBondContact OD2-ND2 3.09Å
652	D	93.1	Very high	90.4	Very high	55 Å²	55	49.8 Å²	49.8	29%	0.294	26%	0.261	S	S	.	.			trans	-84	143.2	-171.7	-75.3	-23.3	0	0	0	114.1	F647 D648 V657	F647-D652 WeakPolarHBondContact CA-OD2 3.48Å; F647-D652 HydrophobicContact CD1-CB 4.19Å; F647-D652 HydrophobicContact CD2-CB 4.11Å; F647-D652 HydrophobicContact CE1-CB 3.85Å; F647-D652 HydrophobicContact CE2-CB 3.78Å; F647-D652 HydrophobicContact CG-CB 4.29Å; F647-D652 HydrophobicContact CZ-CB 3.63Å; F647-D652 VanDerWaalsContact CZ-O 3.31Å; F647-D652 WeakPolarHBondContact CZ-O 3.36Å; D648-D652 HydrophobicContact CB-CB 4.33Å; D648-D652 PolarHBondContact N-OD2 3.19Å; D648-D652 WeakPolarHBondContact O-CB 3.25Å; D648-D652 PolarHBondContact O-N 2.68Å; D652-V657 HydrophobicContact CB-CG2 3.97Å
653	S	92.3	Very high	91	Very high	37 Å²	37	56.6 Å²	56.6	26%	0.259	29%	0.29	S	S	.	.			trans	-97.8	128.4	169.5	178.4	0	0	0	0	111.1	D655 E656 V657	S653-D655 PolarHBondContact O-N 2.9Å; S653-E656 PolarHBondContact O-N 3.45Å; S653-V657 PolarHBondContact O-N 3.36Å
654	P	92.5	Very high	91	Very high	19 Å²	19	61 Å²	61	12%	0.123	31%	0.31	C	S	.	.	H	α-helix	trans	-57.6	-28.5	175.4	-26.5	36.1	0	0	0	114.3	F647 V658 T676 I679 K680	F647-P654 HydrophobicContact CE2-CG 4.19Å; F647-P654 HydrophobicContact CZ-CG 3.94Å; P654-V658 VanDerWaalsContact O-CG2 3.31Å; P654-V658 WeakPolarHBondContact O-CG2 3.21Å; P654-V658 PolarHBondContact O-N 3.01Å; P654-T676 HydrophobicContact CB-CG2 4.24Å; P654-I679 HydrophobicContact CB-CB 4.41Å; P654-I679 HydrophobicContact CB-CG2 4.02Å; P654-I679 HydrophobicContact CG-CG2 4.44Å; P654-K680 HydrophobicContact CB-CB 4.1Å; P654-K680 HydrophobicContact CG-CB 3.99Å; P654-K680 HydrophobicContact CG-CG 4.47Å
655	D	92.2	Very high	90.5	Very high	102 Å²	102	63.7 Å²	63.7	55%	0.545	32%	0.322	S	S	.	.	H	α-helix	trans	-71.9	-41.1	176.1	-66.8	-102	0	0	0	111.1	S653 Q659 T676	S653-D655 PolarHBondContact O-N 2.9Å; D655-Q659 WeakPolarHBondContact O-CB 3.26Å; D655-Q659 PolarHBondContact O-N 3.43Å; D655-T676 HydrophobicContact CB-CG2 4.28Å; D655-T676 WeakPolarHBondContact OD1-CG2 3.45Å
656	E	92.3	Very high	90	Very high	121 Å²	121	65.3 Å²	65.3	57%	0.565	33%	0.33	S	S	*	.	H	α-helix	trans	-73.2	-42.2	-179.2	-65.6	174.4	-177.8	0	0	112	S653 V658 Q659 Q660	S653-E656 PolarHBondContact O-N 3.45Å; E656-V658 VanDerWaalsContact C-N 3.3Å; E656-V658 PolarHBondContact O-N 2.99Å; E656-Q659 WeakPolarHBondContact O-CB 3.48Å; E656-Q659 PolarHBondContact O-N 2.88Å; E656-Q659 VanDerWaalsContact O-N 3.11Å; E656-Q660 WeakPolarHBondContact O-CG 3.36Å; E656-Q660 PolarHBondContact O-N 3.48Å
657	V	93	Very high	89.5	Confident	10 Å²	10	63.5 Å²	63.5	6%	0.061	31%	0.314	C	S	.	.	H	α-helix	trans	-60.6	-40	176	170.1	0	0	0	0	111.2	F645 F647 D652 S653 Q660 M661 I679	F645-V657 HydrophobicContact CD2-CG1 3.9Å; F645-V657 HydrophobicContact CE2-CG1 4.05Å; F647-V657 HydrophobicContact CD2-CB 4.33Å; F647-V657 HydrophobicContact CD2-CG1 4.26Å; F647-V657 HydrophobicContact CD2-CG2 3.87Å; F647-V657 HydrophobicContact CE2-CB 4.27Å; F647-V657 HydrophobicContact CE2-CG2 3.83Å; D652-V657 HydrophobicContact CB-CG2 3.97Å; S653-V657 PolarHBondContact O-N 3.36Å; V657-Q660 PolarHBondContact O-N 3.14Å; V657-M661 HydrophobicContact CG1-CE 3.57Å; V657-M661 HydrophobicContact CG1-SD 4.49Å; V657-M661 VanDerWaalsContact O-CG 3.29Å; V657-M661 WeakPolarHBondContact O-CG 3.32Å; V657-M661 PolarHBondContact O-N 3.19Å; V657-I679 HydrophobicContact CG1-CD1 4.46Å
658	V	92	Very high	88.9	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-71	-36.2	174	175.8	0	0	0	0	111.9	P654 E656 Q660 M661 I662 T672 I675 I679	P654-V658 VanDerWaalsContact O-CG2 3.31Å; P654-V658 WeakPolarHBondContact O-CG2 3.21Å; P654-V658 PolarHBondContact O-N 3.01Å; E656-V658 VanDerWaalsContact C-N 3.3Å; E656-V658 PolarHBondContact O-N 2.99Å; V658-Q660 VanDerWaalsContact C-N 3.29Å; V658-Q660 PolarHBondContact O-N 3.31Å; V658-M661 HydrophobicContact CG2-SD 4.48Å; V658-M661 WeakPolarHBondContact O-CB 3.32Å; V658-M661 PolarHBondContact O-N 3.44Å; V658-M661 VanDerWaalsContact O-N 3.13Å; V658-I662 HydrophobicContact CG1-CD1 4Å; V658-I662 HydrophobicContact CG1-CG1 4.49Å; V658-I662 WeakPolarHBondContact O-CG1 3.34Å; V658-I662 PolarHBondContact O-N 3.41Å; V658-T672 HydrophobicContact CG1-CG2 3.97Å; V658-I675 HydrophobicContact CG2-CG2 3.98Å; V658-I679 HydrophobicContact CG2-CD1 3.67Å
659	Q	90.5	Very high	88.4	Confident	110 Å²	110	68 Å²	68	51%	0.514	34%	0.339	S	S	.	.	H	α-helix	trans	-62	-37	175.7	-171.2	56.4	81	0	0	112.3	D655 E656 I662 E663	D655-Q659 WeakPolarHBondContact O-CB 3.26Å; D655-Q659 PolarHBondContact O-N 3.43Å; E656-Q659 WeakPolarHBondContact O-CB 3.48Å; E656-Q659 PolarHBondContact O-N 2.88Å; E656-Q659 VanDerWaalsContact O-N 3.11Å; Q659-I662 PolarHBondContact O-N 3Å; Q659-E663 PolarHBondContact O-N 3.01Å
660	Q	90.1	Very high	88	Confident	97 Å²	97	74.6 Å²	74.6	45%	0.453	37%	0.37	S	S	.	.	H	α-helix	trans	-65.8	-39.9	171.8	-67.3	175.7	34.3	0	0	112.3	E656 V657 V658 I662 E663 Q664	E656-Q660 WeakPolarHBondContact O-CG 3.36Å; E656-Q660 PolarHBondContact O-N 3.48Å; V657-Q660 PolarHBondContact O-N 3.14Å; V658-Q660 VanDerWaalsContact C-N 3.29Å; V658-Q660 PolarHBondContact O-N 3.31Å; Q660-I662 VanDerWaalsContact C-N 3.28Å; Q660-I662 PolarHBondContact O-N 3.14Å; Q660-E663 PolarHBondContact O-N 2.76Å; Q660-Q664 WeakPolarHBondContact O-CB 3.33Å; Q660-Q664 VanDerWaalsContact O-CG 3.23Å; Q660-Q664 WeakPolarHBondContact O-CG 3.3Å; Q660-Q664 PolarHBondContact O-N 2.93Å
661	M	88.7	Confident	87.6	Confident	7 Å²	7	70 Å²	70	3%	0.034	35%	0.349	C	S	.	.	H	α-helix	trans	-66	-29.5	176.5	-65.6	167.7	179.5	0	0	113.3	L643 F645 V657 V658 Q665 H666 I667 I679	L643-M661 HydrophobicContact CD2-CB 4.4Å; L643-M661 HydrophobicContact CD2-CE 4.33Å; L643-M661 HydrophobicContact CD2-CG 3.94Å; L643-M661 HydrophobicContact CD2-SD 3.98Å; F645-M661 HydrophobicContact CB-CE 3.79Å; F645-M661 HydrophobicContact CD1-CE 3.36Å; F645-M661 HydrophobicContact CD2-CE 3.34Å; F645-M661 HydrophobicContact CE1-CE 3.65Å; F645-M661 HydrophobicContact CE2-CE 3.62Å; F645-M661 HydrophobicContact CG-CE 3.21Å; F645-M661 HydrophobicContact CZ-CE 3.77Å; V657-M661 HydrophobicContact CG1-CE 3.57Å; V657-M661 HydrophobicContact CG1-SD 4.49Å; V657-M661 VanDerWaalsContact O-CG 3.29Å; V657-M661 WeakPolarHBondContact O-CG 3.32Å; V657-M661 PolarHBondContact O-N 3.19Å; V658-M661 HydrophobicContact CG2-SD 4.48Å; V658-M661 WeakPolarHBondContact O-CB 3.32Å; V658-M661 PolarHBondContact O-N 3.44Å; V658-M661 VanDerWaalsContact O-N 3.13Å; M661-Q665 PolarHBondContact O-N 3.45Å; M661-H666 PolarHBondContact O-N 2.92Å; M661-I667 HydrophobicContact CB-CB 4.42Å; M661-I667 HydrophobicContact CB-CD1 3.52Å; M661-I667 HydrophobicContact CB-CG1 3.97Å; M661-I667 HydrophobicContact CG-CD1 4.04Å; M661-I667 PolarHBondContact O-N 3.08Å; M661-I667 HydrophobicContact SD-CD1 3.43Å; M661-I667 WeakPolarHBondContact SD-CD1 3.25Å; M661-I679 HydrophobicContact CE-CD1 4.28Å; M661-I679 HydrophobicContact SD-CD1 4.43Å
662	I	88.5	Confident	87.5	Confident	22 Å²	22	65.4 Å²	65.4	11%	0.113	33%	0.325	C	S	.	.	H	α-helix	trans	-72.6	-45.6	172.4	-68.4	162	0	0	0	110.3	V658 Q659 Q660 Q664 Q665 I667 D669 T672	V658-I662 HydrophobicContact CG1-CD1 4Å; V658-I662 HydrophobicContact CG1-CG1 4.49Å; V658-I662 WeakPolarHBondContact O-CG1 3.34Å; V658-I662 PolarHBondContact O-N 3.41Å; Q659-I662 PolarHBondContact O-N 3Å; Q660-I662 VanDerWaalsContact C-N 3.28Å; Q660-I662 PolarHBondContact O-N 3.14Å; I662-Q664 VanDerWaalsContact C-N 3.28Å; I662-Q664 PolarHBondContact O-N 3.48Å; I662-Q665 WeakPolarHBondContact O-CA 3.42Å; I662-Q665 PolarHBondContact O-N 2.65Å; I662-I667 HydrophobicContact CG1-CB 4.46Å; I662-I667 HydrophobicContact CG1-CG2 4.46Å; I662-D669 WeakPolarHBondContact CG2-OD1 3.3Å; I662-T672 HydrophobicContact CD1-CG2 3.75Å; I662-T672 WeakPolarHBondContact CD1-OG1 3.43Å
663	E	88.4	Confident	87.1	Confident	158 Å²	158	73 Å²	73	74%	0.738	35%	0.35	S	S	*	.	H	α-helix	trans	-60.3	-38.2	176.6	-173.7	171.7	-160.4	0	0	112	Q659 Q660 Q665	Q659-E663 PolarHBondContact O-N 3.01Å; Q660-E663 PolarHBondContact O-N 2.76Å; E663-Q665 PolarHBondContact O-N 2.83Å
664	Q	86	Confident	86.6	Confident	109 Å²	109	74.5 Å²	74.5	51%	0.509	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	1.5	172.1	-65.9	167.3	11.8	0	0	113.9	Q660 I662 H666	Q660-Q664 WeakPolarHBondContact O-CB 3.33Å; Q660-Q664 VanDerWaalsContact O-CG 3.23Å; Q660-Q664 WeakPolarHBondContact O-CG 3.3Å; Q660-Q664 PolarHBondContact O-N 2.93Å; I662-Q664 VanDerWaalsContact C-N 3.28Å; I662-Q664 PolarHBondContact O-N 3.48Å; Q664-H666 PolarHBondContact O-N 3.02Å; Q664-H666 PolarHBondContact OE1-CD2 3.46Å
665	Q	78.6	Confident	86.4	Confident	143 Å²	143	73.6 Å²	73.6	67%	0.668	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.4	25.5	-177.7	-55.9	-171	1.8	0	0	114.9	R636 M661 I662 E663	R636-Q665 WeakPolarHBondContact CB-O 3.49Å; R636-Q665 WeakPolarHBondContact CG-O 3.5Å; M661-Q665 PolarHBondContact O-N 3.45Å; I662-Q665 WeakPolarHBondContact O-CA 3.42Å; I662-Q665 PolarHBondContact O-N 2.65Å; E663-Q665 PolarHBondContact O-N 2.83Å
666	H	80.6	Confident	86.3	Confident	60 Å²	60	69.3 Å²	69.3	28%	0.278	33%	0.326	S	S	.	.	S	Bend	trans	-79.8	-26	176.8	-67.9	-34.8	0	0	0	113	Y635 L643 M661 Q664	Y635-H666 WeakPolarHBondContact CD1-O 3.44Å; L643-H666 HydrophobicContact CD1-CB 4.14Å; L643-H666 VanDerWaalsContact CD1-CD2 3.44Å; L643-H666 WeakPolarHBondContact CD1-CD2 3.37Å; L643-H666 HydrophobicContact CD2-CB 3.79Å; M661-H666 PolarHBondContact O-N 2.92Å; Q664-H666 PolarHBondContact O-N 3.02Å; Q664-H666 PolarHBondContact OE1-CD2 3.46Å
667	I	83.3	Confident	85.9	Confident	7 Å²	7	68.4 Å²	68.4	4%	0.036	32%	0.32	C	S	.	.	S	Bend	trans	-130.9	141	-172.4	-63.4	-178.3	0	0	0	110.1	L624 Y635 L643 M661 I662 I675	L624-I667 HydrophobicContact CD2-CD1 3.56Å; L624-I667 HydrophobicContact CD2-CG1 3.95Å; Y635-I667 HydrophobicContact CE1-CB 4.46Å; Y635-I667 HydrophobicContact CE1-CG1 4.24Å; Y635-I667 HydrophobicContact CE1-CG2 4.3Å; L643-I667 HydrophobicContact CD2-CD1 4.24Å; L643-I667 HydrophobicContact CD2-CG1 4.33Å; M661-I667 HydrophobicContact CB-CB 4.42Å; M661-I667 HydrophobicContact CB-CD1 3.52Å; M661-I667 HydrophobicContact CB-CG1 3.97Å; M661-I667 HydrophobicContact CG-CD1 4.04Å; M661-I667 PolarHBondContact O-N 3.08Å; M661-I667 HydrophobicContact SD-CD1 3.43Å; M661-I667 WeakPolarHBondContact SD-CD1 3.25Å; I662-I667 HydrophobicContact CG1-CB 4.46Å; I662-I667 HydrophobicContact CG1-CG2 4.46Å; I667-I675 HydrophobicContact CD1-CD1 3.97Å; I667-I675 HydrophobicContact CD1-CG2 4.15Å; I667-I675 HydrophobicContact CG1-CD1 4.4Å; I667-I675 HydrophobicContact CG2-CD1 3.66Å
668	P	81.9	Confident	85.6	Confident	15 Å²	15	68.5 Å²	68.5	10%	0.097	32%	0.32	C	S	.	.			trans	-84.5	145.2	174.1	34.1	-35.4	0	0	0	114.1	Q634 Y635 E670 D671	Q634-P668 HydrophobicContact CG-CB 3.77Å; Q634-P668 HydrophobicContact CG-CG 3.83Å; Y635-P668 HydrophobicContact CE1-CG 4.41Å; Y635-P668 HydrophobicContact CE2-CG 4.01Å; P668-E670 PolarHBondContact O-N 2.92Å; P668-E670 VanDerWaalsContact O-N 3.11Å; P668-D671 HydrophobicContact CG-CB 4.44Å; P668-D671 PolarHBondContact O-N 2.91Å; P668-D671 VanDerWaalsContact O-N 3.12Å
669	D	83.1	Confident	85.5	Confident	116 Å²	116	68.5 Å²	68.5	62%	0.62	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-30.5	-175.7	-62.7	-27.7	0	0	0	114.7	I662 D671 T672	I662-D669 WeakPolarHBondContact CG2-OD1 3.3Å; D669-D671 VanDerWaalsContact C-N 3.32Å; D669-D671 PolarHBondContact O-N 2.76Å; D669-T672 WeakPolarHBondContact CA-OG1 3.4Å; D669-T672 WeakPolarHBondContact O-CB 3.42Å; D669-T672 PolarHBondContact O-N 3.01Å; D669-T672 PolarHBondContact O-OG1 2.9Å
670	E	81.6	Confident	85.5	Confident	137 Å²	137	68.3 Å²	68.3	64%	0.64	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-31.4	-178.2	-60.2	89.3	168.2	0	0	112.8	Q634 P668	Q634-E670 PolarHBondContact NE2-OE2 2.79Å; P668-E670 PolarHBondContact O-N 2.92Å; P668-E670 VanDerWaalsContact O-N 3.11Å
671	D	81.9	Confident	85.2	Confident	16 Å²	16	65.4 Å²	65.4	9%	0.086	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-6.1	-177.9	-85.4	-32.7	0	0	0	113.5	I602 K631 Y635 P668 D669 R673 M674 I675	I602-D671 HydrophobicContact CD1-CB 4.25Å; K631-D671 WeakPolarHBondContact CE-OD2 3.49Å; K631-D671 IonicContact NZ-OD1 2.79Å; K631-D671 PolarHBondContact NZ-OD1 2.97Å; K631-D671 IonicContact NZ-OD2 3.43Å; K631-D671 PolarHBondContact NZ-OD2 3.4Å; Y635-D671 VanDerWaalsContact OH-CB 3.3Å; Y635-D671 WeakPolarHBondContact OH-CB 3.15Å; Y635-D671 VanDerWaalsContact OH-CG 3.31Å; Y635-D671 PolarHBondContact OH-OD2 3.06Å; P668-D671 HydrophobicContact CG-CB 4.44Å; P668-D671 PolarHBondContact O-N 2.91Å; P668-D671 VanDerWaalsContact O-N 3.12Å; D669-D671 VanDerWaalsContact C-N 3.32Å; D669-D671 PolarHBondContact O-N 2.76Å; D671-R673 PolarHBondContact O-N 3.22Å; D671-M674 WeakPolarHBondContact O-CA 3.47Å; D671-M674 VanDerWaalsContact O-CB 3.23Å; D671-M674 WeakPolarHBondContact O-CB 3.27Å; D671-M674 PolarHBondContact O-N 2.85Å; D671-I675 HydrophobicContact CB-CD1 4.15Å; D671-I675 PolarHBondContact O-N 3.01Å
672	T	86.8	Confident	85.2	Confident	32 Å²	32	67 Å²	67	20%	0.196	31%	0.312	C	S	.	.	H	α-helix	trans	-41	-61.7	179.3	-58.5	0	0	0	0	113	V658 I662 D669 M674 I675 T676	V658-T672 HydrophobicContact CG1-CG2 3.97Å; I662-T672 HydrophobicContact CD1-CG2 3.75Å; I662-T672 WeakPolarHBondContact CD1-OG1 3.43Å; D669-T672 WeakPolarHBondContact CA-OG1 3.4Å; D669-T672 WeakPolarHBondContact O-CB 3.42Å; D669-T672 PolarHBondContact O-N 3.01Å; D669-T672 PolarHBondContact O-OG1 2.9Å; T672-M674 PolarHBondContact O-N 3.49Å; T672-M674 VanDerWaalsContact O-N 3.11Å; T672-I675 PolarHBondContact O-N 3.36Å; T672-T676 WeakPolarHBondContact O-CB 3.42Å; T672-T676 PolarHBondContact O-N 3.04Å; T672-T676 PolarHBondContact O-OG1 2.7Å; T672-T676 VanDerWaalsContact O-OG1 3.06Å
673	R	84.4	Confident	85.3	Confident	215 Å²	215	66.1 Å²	66.1	81%	0.811	31%	0.307	S	S	*	.	H	α-helix	trans	-61.8	-24.5	-177.7	-68.2	-179.6	-67.5	-163.3	-4.1	113.5	D671 K677	D671-R673 PolarHBondContact O-N 3.22Å; R673-K677 WeakPolarHBondContact O-CB 3.43Å; R673-K677 PolarHBondContact O-N 3.05Å
674	M	82.3	Confident	85.3	Confident	68 Å²	68	61.3 Å²	61.3	34%	0.335	29%	0.287	S	S	.	.	H	α-helix	trans	-76.6	-45.6	175.7	-167.3	71.7	78.5	0	0	110.3	I600 D671 T672 K677 L678	I600-M674 HydrophobicContact CD1-SD 3.98Å; I600-M674 HydrophobicContact CG1-CE 4.26Å; I600-M674 HydrophobicContact CG1-CG 4.47Å; I600-M674 HydrophobicContact CG1-SD 3.92Å; I600-M674 HydrophobicContact CG2-CG 3.82Å; I600-M674 HydrophobicContact CG2-SD 4.38Å; D671-M674 WeakPolarHBondContact O-CA 3.47Å; D671-M674 VanDerWaalsContact O-CB 3.23Å; D671-M674 WeakPolarHBondContact O-CB 3.27Å; D671-M674 PolarHBondContact O-N 2.85Å; T672-M674 PolarHBondContact O-N 3.49Å; T672-M674 VanDerWaalsContact O-N 3.11Å; M674-K677 WeakPolarHBondContact O-CB 3.17Å; M674-K677 PolarHBondContact O-N 2.78Å; M674-L678 WeakPolarHBondContact O-CG 3.42Å; M674-L678 PolarHBondContact O-N 2.85Å
675	I	87.5	Confident	85.1	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-76.4	-39.2	-175.7	-63.3	171.2	0	0	0	111.5	I602 L624 Y635 V658 I667 D671 T672 K677 L678 I679	I602-I675 HydrophobicContact CD1-CD1 4.18Å; I602-I675 HydrophobicContact CD1-CG1 4.17Å; I602-I675 HydrophobicContact CG2-CD1 4.4Å; I602-I675 HydrophobicContact CG2-CG1 4.43Å; L624-I675 HydrophobicContact CD1-CD1 4.25Å; L624-I675 HydrophobicContact CD1-CG1 4.28Å; L624-I675 HydrophobicContact CD1-CG2 3.87Å; L624-I675 HydrophobicContact CD2-CD1 4.2Å; Y635-I675 HydrophobicContact CE1-CD1 4.09Å; V658-I675 HydrophobicContact CG2-CG2 3.98Å; I667-I675 HydrophobicContact CD1-CD1 3.97Å; I667-I675 HydrophobicContact CD1-CG2 4.15Å; I667-I675 HydrophobicContact CG1-CD1 4.4Å; I667-I675 HydrophobicContact CG2-CD1 3.66Å; D671-I675 HydrophobicContact CB-CD1 4.15Å; D671-I675 PolarHBondContact O-N 3.01Å; T672-I675 PolarHBondContact O-N 3.36Å; I675-K677 PolarHBondContact O-N 3.26Å; I675-L678 PolarHBondContact O-N 3.5Å; I675-L678 VanDerWaalsContact O-N 3.09Å; I675-I679 HydrophobicContact CG2-CD1 4.03Å; I675-I679 HydrophobicContact CG2-CG1 4.34Å; I675-I679 WeakPolarHBondContact O-CG1 3.47Å; I675-I679 PolarHBondContact O-N 3.33Å
676	T	90.1	Very high	85.7	Confident	13 Å²	13	50.1 Å²	50.1	8%	0.08	24%	0.237	C	C	.	.	H	α-helix	trans	-54	-43	169.3	-59	0	0	0	0	110.7	P654 D655 T672 K680	P654-T676 HydrophobicContact CB-CG2 4.24Å; D655-T676 HydrophobicContact CB-CG2 4.28Å; D655-T676 WeakPolarHBondContact OD1-CG2 3.45Å; T672-T676 WeakPolarHBondContact O-CB 3.42Å; T672-T676 PolarHBondContact O-N 3.04Å; T672-T676 PolarHBondContact O-OG1 2.7Å; T672-T676 VanDerWaalsContact O-OG1 3.06Å; T676-K680 VanDerWaalsContact O-CB 3.29Å; T676-K680 WeakPolarHBondContact O-CB 3.47Å; T676-K680 PolarHBondContact O-N 2.71Å
677	K	85.4	Confident	86.1	Confident	101 Å²	101	51.5 Å²	51.5	44%	0.439	24%	0.24	S	C	.	.	H	α-helix	trans	-65.4	-46.3	175.1	-167.2	-167.1	-179.6	-60.4	0	111.9	R673 M674 I675 I679 K680 D681	R673-K677 WeakPolarHBondContact O-CB 3.43Å; R673-K677 PolarHBondContact O-N 3.05Å; M674-K677 WeakPolarHBondContact O-CB 3.17Å; M674-K677 PolarHBondContact O-N 2.78Å; I675-K677 PolarHBondContact O-N 3.26Å; K677-I679 PolarHBondContact O-N 2.66Å; K677-K680 PolarHBondContact O-N 3.36Å; K677-D681 IonicContact NZ-OD1 3.84Å; K677-D681 PolarHBondContact NZ-OD1 3.4Å; K677-D681 IonicContact NZ-OD2 2.74Å; K677-D681 PolarHBondContact NZ-OD2 2.8Å; K677-D681 WeakPolarHBondContact O-CB 3.18Å; K677-D681 PolarHBondContact O-N 2.94Å
678	L	86.9	Confident	86.2	Confident	12 Å²	12	57.8 Å²	57.8	6%	0.063	26%	0.263	C	S	.	.	H	α-helix	trans	-60.9	-41.9	178.7	-71	170.7	0	0	0	112.5	I600 I602 V604 M674 I675 K682	I600-L678 HydrophobicContact CD1-CD2 4.34Å; I600-L678 HydrophobicContact CG2-CD1 4.03Å; I602-L678 HydrophobicContact CB-CD1 4.48Å; V604-L678 HydrophobicContact CB-CB 4.28Å; V604-L678 HydrophobicContact CG2-CB 3.66Å; V604-L678 HydrophobicContact CG2-CD1 4.27Å; M674-L678 WeakPolarHBondContact O-CG 3.42Å; M674-L678 PolarHBondContact O-N 2.85Å; I675-L678 PolarHBondContact O-N 3.5Å; I675-L678 VanDerWaalsContact O-N 3.09Å; L678-K682 WeakPolarHBondContact O-CB 3.08Å; L678-K682 VanDerWaalsContact O-CG 3.3Å; L678-K682 WeakPolarHBondContact O-CG 3.49Å; L678-K682 PolarHBondContact O-N 2.69Å; L678-K682 VanDerWaalsContact O-N 3.13Å
679	I	90.1	Very high	86.3	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-64.5	-47.7	176	-67.4	176.8	0	0	0	109.6	V604 M622 F645 F647 P654 V657 V658 M661 I675 K677 K682 V683	V604-I679 HydrophobicContact CG1-CG1 4.38Å; V604-I679 HydrophobicContact CG2-CG1 4.17Å; M622-I679 HydrophobicContact CE-CG2 4.38Å; M622-I679 HydrophobicContact SD-CG2 4.16Å; F645-I679 HydrophobicContact CE2-CD1 3.76Å; F645-I679 HydrophobicContact CE2-CG1 4.29Å; F645-I679 HydrophobicContact CZ-CD1 3.54Å; F645-I679 HydrophobicContact CZ-CG1 3.87Å; F647-I679 HydrophobicContact CD2-CG2 3.86Å; F647-I679 HydrophobicContact CE2-CG2 3.75Å; P654-I679 HydrophobicContact CB-CB 4.41Å; P654-I679 HydrophobicContact CB-CG2 4.02Å; P654-I679 HydrophobicContact CG-CG2 4.44Å; V657-I679 HydrophobicContact CG1-CD1 4.46Å; V658-I679 HydrophobicContact CG2-CD1 3.67Å; M661-I679 HydrophobicContact CE-CD1 4.28Å; M661-I679 HydrophobicContact SD-CD1 4.43Å; I675-I679 HydrophobicContact CG2-CD1 4.03Å; I675-I679 HydrophobicContact CG2-CG1 4.34Å; I675-I679 WeakPolarHBondContact O-CG1 3.47Å; I675-I679 PolarHBondContact O-N 3.33Å; K677-I679 PolarHBondContact O-N 2.66Å; I679-K682 WeakPolarHBondContact O-CB 3.19Å; I679-K682 PolarHBondContact O-N 3.13Å; I679-V683 HydrophobicContact CG2-CG2 4.32Å; I679-V683 WeakPolarHBondContact O-CG2 3.37Å; I679-V683 PolarHBondContact O-N 3.18Å
680	K	89.7	Confident	86.6	Confident	106 Å²	106	55 Å²	55	46%	0.461	24%	0.244	S	C	.	.	H	α-helix	trans	-59.6	-49.2	176.8	-178.2	168.4	-178.2	164.7	0	113.2	P654 T676 K677 K682 V683 D684	P654-K680 HydrophobicContact CB-CB 4.1Å; P654-K680 HydrophobicContact CG-CB 3.99Å; P654-K680 HydrophobicContact CG-CG 4.47Å; T676-K680 VanDerWaalsContact O-CB 3.29Å; T676-K680 WeakPolarHBondContact O-CB 3.47Å; T676-K680 PolarHBondContact O-N 2.71Å; K677-K680 PolarHBondContact O-N 3.36Å; K680-K682 PolarHBondContact O-N 3.28Å; K680-V683 PolarHBondContact O-N 2.89Å; K680-D684 VanDerWaalsContact CE-OD2 3.23Å; K680-D684 WeakPolarHBondContact CE-OD2 3.4Å; K680-D684 WeakPolarHBondContact CG-OD2 3.28Å; K680-D684 WeakPolarHBondContact O-CB 3.47Å; K680-D684 PolarHBondContact O-N 3.28Å
681	D	84.1	Confident	86.9	Confident	36 Å²	36	52.2 Å²	52.2	19%	0.193	23%	0.234	C	C	.	.	H	α-helix	trans	-57.1	-36.7	178.3	-67.1	-27	0	0	0	110.9	K677 A685	K677-D681 IonicContact NZ-OD1 3.84Å; K677-D681 PolarHBondContact NZ-OD1 3.4Å; K677-D681 IonicContact NZ-OD2 2.74Å; K677-D681 PolarHBondContact NZ-OD2 2.8Å; K677-D681 WeakPolarHBondContact O-CB 3.18Å; K677-D681 PolarHBondContact O-N 2.94Å; D681-A685 WeakPolarHBondContact O-CB 3.48Å; D681-A685 PolarHBondContact O-N 2.81Å; D681-A685 VanDerWaalsContact O-N 3.08Å
682	K	87.4	Confident	87	Confident	42 Å²	42	55.3 Å²	55.3	18%	0.183	25%	0.248	C	C	.	.	H	α-helix	trans	-71.7	-43.6	175.1	-74.6	-57.5	-172.4	-169.2	0	114	D592 V604 M622 L678 I679 K680 A685 F686	D592-K682 IonicContact OD1-NZ 2.76Å; D592-K682 VanDerWaalsContact OD2-CE 3.27Å; D592-K682 WeakPolarHBondContact OD2-CE 3.49Å; D592-K682 IonicContact OD2-NZ 2.8Å; D592-K682 PolarHBondContact OD2-NZ 2.74Å; V604-K682 HydrophobicContact CB-CG 4.28Å; V604-K682 HydrophobicContact CG1-CG 4.13Å; V604-K682 WeakPolarHBondContact O-CE 3.31Å; M622-K682 HydrophobicContact CE-CB 3.64Å; M622-K682 HydrophobicContact CE-CG 4.4Å; L678-K682 WeakPolarHBondContact O-CB 3.08Å; L678-K682 VanDerWaalsContact O-CG 3.3Å; L678-K682 WeakPolarHBondContact O-CG 3.49Å; L678-K682 PolarHBondContact O-N 2.69Å; L678-K682 VanDerWaalsContact O-N 3.13Å; I679-K682 WeakPolarHBondContact O-CB 3.19Å; I679-K682 PolarHBondContact O-N 3.13Å; K680-K682 PolarHBondContact O-N 3.28Å; K682-A685 PolarHBondContact O-N 2.91Å; K682-F686 PolarHBondContact O-N 3.04Å
683	V	91.3	Very high	87	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.012	25%	0.253	C	S	.	.	H	α-helix	trans	-67.1	-44	177.6	172.6	0	0	0	0	110.6	M622 F647 I679 K680 A685 F686 R687	M622-V683 HydrophobicContact CE-CG2 4.3Å; M622-V683 HydrophobicContact SD-CG2 4.35Å; F647-V683 HydrophobicContact CD1-CG2 3.64Å; F647-V683 HydrophobicContact CD2-CG2 4.49Å; F647-V683 HydrophobicContact CE1-CB 4.33Å; F647-V683 HydrophobicContact CE1-CG1 3.89Å; F647-V683 HydrophobicContact CE1-CG2 3.51Å; F647-V683 HydrophobicContact CE2-CG2 4.38Å; F647-V683 HydrophobicContact CG-CG2 4.17Å; F647-V683 HydrophobicContact CZ-CG2 3.91Å; I679-V683 HydrophobicContact CG2-CG2 4.32Å; I679-V683 WeakPolarHBondContact O-CG2 3.37Å; I679-V683 PolarHBondContact O-N 3.18Å; K680-V683 PolarHBondContact O-N 2.89Å; V683-A685 PolarHBondContact O-N 2.9Å; V683-F686 PolarHBondContact O-N 2.85Å; V683-R687 HydrophobicContact CG1-CG 4.39Å; V683-R687 WeakPolarHBondContact O-CB 3.48Å; V683-R687 WeakPolarHBondContact O-CG 3.41Å; V683-R687 PolarHBondContact O-N 3.49Å
684	D	88.1	Confident	87.2	Confident	58 Å²	58	51.1 Å²	51.1	31%	0.31	23%	0.233	S	C	.	.	H	α-helix	trans	-69.8	-17.3	175.8	-72.4	-21.8	0	0	0	112.7	K680 R687 R688	K680-D684 VanDerWaalsContact CE-OD2 3.23Å; K680-D684 WeakPolarHBondContact CE-OD2 3.4Å; K680-D684 WeakPolarHBondContact CG-OD2 3.28Å; K680-D684 WeakPolarHBondContact O-CB 3.47Å; K680-D684 PolarHBondContact O-N 3.28Å; D684-R687 IonicContact OD1-NH1 3.2Å; D684-R687 PolarHBondContact OD1-NH1 3.23Å; D684-R688 WeakPolarHBondContact O-CG 3.45Å; D684-R688 PolarHBondContact O-NE 2.79Å; D684-R688 PolarHBondContact O-NH2 3.39Å
685	A	82.8	Confident	87.4	Confident	16 Å²	16	53.5 Å²	53.5	13%	0.132	25%	0.247	C	C	.	.	H	α-helix	trans	-77.4	-53.7	164.7	0	0	0	0	0	111.7	D681 K682 V683 R687 R688 D689	D681-A685 WeakPolarHBondContact O-CB 3.48Å; D681-A685 PolarHBondContact O-N 2.81Å; D681-A685 VanDerWaalsContact O-N 3.08Å; K682-A685 PolarHBondContact O-N 2.91Å; V683-A685 PolarHBondContact O-N 2.9Å; A685-R687 VanDerWaalsContact C-N 3.33Å; A685-R687 PolarHBondContact O-N 3.19Å; A685-R688 PolarHBondContact O-N 3.18Å; A685-R688 VanDerWaalsContact O-N 3.12Å; A685-D689 PolarHBondContact O-N 2.95Å
686	F	89.5	Confident	87.3	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59	-41.6	-178.2	-169.7	-80.1	0	0	0	112.5	I606 R609 D612 L613 I620 I649 K682 V683 R688 D689 R690	I606-F686 HydrophobicContact CD1-CB 3.94Å; I606-F686 HydrophobicContact CD1-CD2 3.69Å; I606-F686 HydrophobicContact CD1-CG 4.15Å; R609-F686 HydrophobicContact CG-CD2 4.49Å; R609-F686 HydrophobicContact CG-CE2 4.48Å; D612-F686 HydrophobicContact CB-CE2 3.86Å; D612-F686 HydrophobicContact CB-CZ 3.57Å; L613-F686 HydrophobicContact CD1-CE2 4.27Å; L613-F686 HydrophobicContact CD2-CE1 4.37Å; L613-F686 HydrophobicContact CD2-CE2 4.25Å; L613-F686 HydrophobicContact CD2-CZ 4.13Å; L613-F686 HydrophobicContact CG-CD2 4.23Å; L613-F686 HydrophobicContact CG-CE2 3.65Å; L613-F686 HydrophobicContact CG-CZ 3.81Å; I620-F686 HydrophobicContact CD1-CG 4.4Å; I620-F686 HydrophobicContact CG2-CE1 4Å; I620-F686 HydrophobicContact CG2-CE2 4.1Å; I620-F686 HydrophobicContact CG2-CZ 3.77Å; I649-F686 HydrophobicContact CD1-CD1 3.37Å; I649-F686 HydrophobicContact CD1-CE1 3.34Å; I649-F686 HydrophobicContact CD1-CG 4.41Å; I649-F686 HydrophobicContact CD1-CZ 4.34Å; I649-F686 HydrophobicContact CG1-CD1 4.39Å; K682-F686 PolarHBondContact O-N 3.04Å; V683-F686 PolarHBondContact O-N 2.85Å; F686-R688 PolarHBondContact O-N 3.24Å; F686-D689 PolarHBondContact O-N 3.14Å; F686-R690 WeakPolarHBondContact O-CB 3.25Å; F686-R690 PolarHBondContact O-N 2.86Å
687	R	89.3	Confident	87.1	Confident	90 Å²	90	59.7 Å²	59.7	34%	0.34	28%	0.276	S	S	.	.	H	α-helix	trans	-54.5	-49.7	173.4	-76.6	172.7	171.4	172.4	-7.2	112	I649 V683 D684 A685 D689 R690 D691	I649-R687 HydrophobicContact CG2-CG 3.56Å; I649-R687 PolarHBondContact O-NE 2.64Å; I649-R687 PolarHBondContact O-NH2 3.45Å; V683-R687 HydrophobicContact CG1-CG 4.39Å; V683-R687 WeakPolarHBondContact O-CB 3.48Å; V683-R687 WeakPolarHBondContact O-CG 3.41Å; V683-R687 PolarHBondContact O-N 3.49Å; D684-R687 IonicContact OD1-NH1 3.2Å; D684-R687 PolarHBondContact OD1-NH1 3.23Å; A685-R687 VanDerWaalsContact C-N 3.33Å; A685-R687 PolarHBondContact O-N 3.19Å; R687-D689 VanDerWaalsContact C-N 3.31Å; R687-D689 PolarHBondContact O-N 2.78Å; R687-R690 WeakPolarHBondContact O-CB 3.42Å; R687-R690 PolarHBondContact O-N 3.46Å; R687-D691 PolarHBondContact O-N 3.17Å
688	R	86.1	Confident	87.3	Confident	139 Å²	139	61.1 Å²	61.1	53%	0.525	28%	0.282	S	S	.	.	H	α-helix	trans	-63.3	-35.3	178.5	-73.6	-179.6	-70.8	122.8	-5	113.1	D684 A685 F686 H692	D684-R688 WeakPolarHBondContact O-CG 3.45Å; D684-R688 PolarHBondContact O-NE 2.79Å; D684-R688 PolarHBondContact O-NH2 3.39Å; A685-R688 PolarHBondContact O-N 3.18Å; A685-R688 VanDerWaalsContact O-N 3.12Å; F686-R688 PolarHBondContact O-N 3.24Å; R688-H692 WeakPolarHBondContact O-CB 3.49Å; R688-H692 PolarHBondContact O-N 2.88Å
689	D	84.8	Confident	87.2	Confident	34 Å²	34	66.6 Å²	66.6	18%	0.182	30%	0.302	C	S	.	.	H	α-helix	trans	-72.7	-38	177.4	-61.1	-32.8	0	0	0	111.1	R609 L613 A685 F686 R687 H692 R693	R609-D689 IonicContact CZ-OD2 3.6Å; R609-D689 IonicContact NH1-OD2 3.7Å; R609-D689 PolarHBondContact NH1-OD2 3.44Å; R609-D689 IonicContact NH2-OD2 2.68Å; R609-D689 PolarHBondContact NH2-OD2 3.27Å; L613-D689 HydrophobicContact CD1-CB 4.09Å; L613-D689 HydrophobicContact CD2-CB 3.68Å; A685-D689 PolarHBondContact O-N 2.95Å; F686-D689 PolarHBondContact O-N 3.14Å; R687-D689 VanDerWaalsContact C-N 3.31Å; R687-D689 PolarHBondContact O-N 2.78Å; D689-H692 PolarHBondContact O-N 2.75Å; D689-R693 WeakPolarHBondContact O-CB 3.44Å; D689-R693 PolarHBondContact O-N 3.47Å
690	R	88.5	Confident	87	Confident	39 Å²	39	69.4 Å²	69.4	15%	0.147	33%	0.325	C	S	.	.	H	α-helix	trans	-60.5	-47.3	171.3	-169	-177.7	78.7	160.2	3	110.9	L613 L616 E650 F686 R687 R693 L694	L613-R690 HydrophobicContact CD2-CB 4.25Å; L616-R690 HydrophobicContact CD2-CG 3.84Å; E650-R690 IonicContact OE1-CZ 2.69Å; E650-R690 IonicContact OE1-NH1 3.3Å; E650-R690 PolarHBondContact OE1-NH1 3.07Å; E650-R690 IonicContact OE1-NH2 3.58Å; E650-R690 PolarHBondContact OE1-NH2 3.35Å; F686-R690 WeakPolarHBondContact O-CB 3.25Å; F686-R690 PolarHBondContact O-N 2.86Å; R687-R690 WeakPolarHBondContact O-CB 3.42Å; R687-R690 PolarHBondContact O-N 3.46Å; R690-R693 PolarHBondContact O-N 3.18Å; R690-L694 HydrophobicContact CG-CD1 4.36Å; R690-L694 WeakPolarHBondContact O-CG 3.24Å; R690-L694 PolarHBondContact O-N 3.01Å
691	D	88.5	Confident	86.9	Confident	77 Å²	77	70.9 Å²	70.9	41%	0.412	33%	0.331	S	S	.	.	H	α-helix	trans	-63.4	-42.8	177.8	-62.5	-20.3	0	0	0	111.6	R687 R693 L694 L695	R687-D691 PolarHBondContact O-N 3.17Å; D691-R693 VanDerWaalsContact C-N 3.34Å; D691-R693 PolarHBondContact O-N 3.22Å; D691-L694 PolarHBondContact O-N 3.33Å; D691-L695 WeakPolarHBondContact O-CD1 3.23Å; D691-L695 PolarHBondContact O-N 2.99Å
692	H	83.8	Confident	86.9	Confident	82 Å²	82	73.7 Å²	73.7	38%	0.38	34%	0.343	S	S	.	.	H	α-helix	trans	-60.7	-42.6	174.6	-176.1	-80.6	0	0	0	111.6	R688 D689 L695 E696	R688-H692 WeakPolarHBondContact O-CB 3.49Å; R688-H692 PolarHBondContact O-N 2.88Å; D689-H692 PolarHBondContact O-N 2.75Å; H692-L695 PolarHBondContact O-N 2.78Å; H692-E696 PolarHBondContact O-N 3.27Å
693	R	86.3	Confident	86.7	Confident	84 Å²	84	76.1 Å²	76.1	32%	0.317	36%	0.355	S	S	.	.	H	α-helix	trans	-65.9	-39.2	176.6	-171	56.6	162.9	167.6	-0.7	112.4	N614 D689 R690 D691 E696 I697	N614-R693 PolarHBondContact OD1-NH2 3.28Å; D689-R693 WeakPolarHBondContact O-CB 3.44Å; D689-R693 PolarHBondContact O-N 3.47Å; R690-R693 PolarHBondContact O-N 3.18Å; D691-R693 VanDerWaalsContact C-N 3.34Å; D691-R693 PolarHBondContact O-N 3.22Å; R693-E696 IonicContact CZ-OE2 2.69Å; R693-E696 IonicContact NH1-OE2 3.82Å; R693-E696 PolarHBondContact NH1-OE2 2.96Å; R693-E696 PolarHBondContact O-N 2.78Å; R693-I697 HydrophobicContact CG-CD1 4.09Å; R693-I697 WeakPolarHBondContact O-CB 3.31Å; R693-I697 VanDerWaalsContact O-CG1 3.28Å; R693-I697 WeakPolarHBondContact O-CG1 3.2Å; R693-I697 PolarHBondContact O-N 2.71Å
694	L	88.4	Confident	86.3	Confident	75 Å²	75	81.3 Å²	81.3	39%	0.393	38%	0.379	S	S	.	.	H	α-helix	trans	-62.1	-42.3	172.3	-73.9	167.5	0	0	0	111.9	L616 R690 D691 K698	L616-L694 HydrophobicContact CD1-CD2 3.74Å; L616-L694 HydrophobicContact CD2-CD2 4.1Å; L616-L694 HydrophobicContact CD2-CG 4.11Å; R690-L694 HydrophobicContact CG-CD1 4.36Å; R690-L694 WeakPolarHBondContact O-CG 3.24Å; R690-L694 PolarHBondContact O-N 3.01Å; D691-L694 PolarHBondContact O-N 3.33Å; L694-K698 WeakPolarHBondContact O-CB 3.18Å; L694-K698 PolarHBondContact O-N 3.11Å
695	L	87.9	Confident	86.2	Confident	117 Å²	117	84.3 Å²	84.3	61%	0.613	39%	0.392	S	S	*	.	H	α-helix	trans	-65.4	-36.7	173.7	-93.1	79.7	0	0	0	112.6	D691 H692 K698 R699	D691-L695 WeakPolarHBondContact O-CD1 3.23Å; D691-L695 PolarHBondContact O-N 2.99Å; H692-L695 PolarHBondContact O-N 2.78Å; L695-K698 PolarHBondContact O-N 3.42Å; L695-R699 WeakPolarHBondContact O-CB 3.41Å; L695-R699 PolarHBondContact O-N 3.21Å
696	E	84.2	Confident	86.3	Confident	88 Å²	88	89.2 Å²	89.2	41%	0.411	41%	0.407	S	S	.	.	H	α-helix	trans	-67.3	-45.6	176.1	-172.8	177.4	-131.1	0	0	111.7	H692 R693 K698 R699 A700	H692-E696 PolarHBondContact O-N 3.27Å; R693-E696 IonicContact CZ-OE2 2.69Å; R693-E696 IonicContact NH1-OE2 3.82Å; R693-E696 PolarHBondContact NH1-OE2 2.96Å; R693-E696 PolarHBondContact O-N 2.78Å; E696-K698 VanDerWaalsContact C-N 3.31Å; E696-K698 PolarHBondContact O-N 2.98Å; E696-R699 PolarHBondContact O-N 3.25Å; E696-A700 WeakPolarHBondContact O-CB 3.46Å; E696-A700 PolarHBondContact O-N 2.95Å
697	I	86.8	Confident	86.2	Confident	56 Å²	56	93.7 Å²	93.7	29%	0.287	43%	0.43	S	S	.	.	H	α-helix	trans	-61.4	-40.2	174.5	-69	164.9	0	0	0	110.8	R693 A700 K701	R693-I697 HydrophobicContact CG-CD1 4.09Å; R693-I697 WeakPolarHBondContact O-CB 3.31Å; R693-I697 VanDerWaalsContact O-CG1 3.28Å; R693-I697 WeakPolarHBondContact O-CG1 3.2Å; R693-I697 PolarHBondContact O-N 2.71Å; I697-A700 PolarHBondContact O-N 3.25Å; I697-K701 HydrophobicContact CG2-CD 4.46Å; I697-K701 WeakPolarHBondContact O-CG 3.42Å; I697-K701 PolarHBondContact O-N 3.45Å; I697-K701 VanDerWaalsContact O-N 3.08Å
698	K	88.5	Confident	86	Confident	130 Å²	130	97 Å²	97	57%	0.565	44%	0.442	S	S	*	.	H	α-helix	trans	-62.1	-50.8	174.3	176.4	168.3	172.1	169	0	111.6	L694 L695 E696 A700 K701 E702	L694-K698 WeakPolarHBondContact O-CB 3.18Å; L694-K698 PolarHBondContact O-N 3.11Å; L695-K698 PolarHBondContact O-N 3.42Å; E696-K698 VanDerWaalsContact C-N 3.31Å; E696-K698 PolarHBondContact O-N 2.98Å; K698-A700 VanDerWaalsContact C-N 3.28Å; K698-A700 PolarHBondContact O-N 3.13Å; K698-K701 PolarHBondContact O-N 2.97Å; K698-K701 VanDerWaalsContact O-N 3.13Å; K698-E702 WeakPolarHBondContact CE-OE1 3.21Å; K698-E702 HydrophobicContact CG-CG 4.43Å; K698-E702 IonicContact NZ-OE1 2.64Å; K698-E702 WeakPolarHBondContact O-CG 3.44Å; K698-E702 PolarHBondContact O-N 3.16Å
699	R	85.3	Confident	86	Confident	128 Å²	128	95.6 Å²	95.6	48%	0.483	44%	0.442	S	S	.	.	H	α-helix	trans	-59.6	-37.7	177.8	-174.1	-173.2	-67.5	167.6	-3.1	112.3	E581 L695 E696 E702 E703	E581-R699 IonicContact OE1-NH1 3.6Å; E581-R699 IonicContact OE1-NH2 3.19Å; L695-R699 WeakPolarHBondContact O-CB 3.41Å; L695-R699 PolarHBondContact O-N 3.21Å; E696-R699 PolarHBondContact O-N 3.25Å; R699-E702 PolarHBondContact O-N 2.62Å; R699-E703 WeakPolarHBondContact O-CB 3.33Å; R699-E703 PolarHBondContact O-N 2.73Å
700	A	85.3	Confident	85.9	Confident	58 Å²	58	100.1 Å²	100.1	48%	0.479	46%	0.462	S	S	.	.	H	α-helix	trans	-66.1	-39.5	176.5	0	0	0	0	0	112.2	E696 I697 K698 E703 E704	E696-A700 WeakPolarHBondContact O-CB 3.46Å; E696-A700 PolarHBondContact O-N 2.95Å; I697-A700 PolarHBondContact O-N 3.25Å; K698-A700 VanDerWaalsContact C-N 3.28Å; K698-A700 PolarHBondContact O-N 3.13Å; A700-E703 PolarHBondContact O-N 3.37Å; A700-E704 PolarHBondContact O-N 2.86Å
701	K	87.4	Confident	85.8	Confident	137 Å²	137	101 Å²	101	60%	0.596	48%	0.477	S	S	*	.	H	α-helix	trans	-65.8	-45.4	173.3	-72.1	175.5	178.9	-177.2	0	112	I697 K698 E703 E704 E705	I697-K701 HydrophobicContact CG2-CD 4.46Å; I697-K701 WeakPolarHBondContact O-CG 3.42Å; I697-K701 PolarHBondContact O-N 3.45Å; I697-K701 VanDerWaalsContact O-N 3.08Å; K698-K701 PolarHBondContact O-N 2.97Å; K698-K701 VanDerWaalsContact O-N 3.13Å; K701-E703 PolarHBondContact O-N 2.86Å; K701-E704 PolarHBondContact O-N 3.25Å; K701-E705 VanDerWaalsContact O-CB 3.27Å; K701-E705 WeakPolarHBondContact O-CB 3.21Å; K701-E705 PolarHBondContact O-N 3.03Å
702	E	85.2	Confident	85.7	Confident	95 Å²	95	104 Å²	104	44%	0.444	49%	0.489	S	S	.	.	H	α-helix	trans	-59.8	-34.1	175.4	-69.2	168.1	167.9	0	0	112.1	K698 R699 R706	K698-E702 WeakPolarHBondContact CE-OE1 3.21Å; K698-E702 HydrophobicContact CG-CG 4.43Å; K698-E702 IonicContact NZ-OE1 2.64Å; K698-E702 WeakPolarHBondContact O-CG 3.44Å; K698-E702 PolarHBondContact O-N 3.16Å; R699-E702 PolarHBondContact O-N 2.62Å; E702-R706 WeakPolarHBondContact O-CB 3.3Å; E702-R706 PolarHBondContact O-N 3.41Å; E702-R706 VanDerWaalsContact O-N 3.13Å
703	E	81.9	Confident	85.8	Confident	93 Å²	93	105 Å²	105	44%	0.435	50%	0.496	S	S	.	.	H	α-helix	trans	-75.6	-40.5	174.4	-179.8	134.8	-103	0	0	112.9	R699 A700 K701 R706 I707	R699-E703 WeakPolarHBondContact O-CB 3.33Å; R699-E703 PolarHBondContact O-N 2.73Å; A700-E703 PolarHBondContact O-N 3.37Å; K701-E703 PolarHBondContact O-N 2.86Å; E703-R706 PolarHBondContact O-N 3.27Å; E703-R706 IonicContact OE1-CZ 3.78Å; E703-R706 IonicContact OE1-NH1 3.73Å; E703-R706 PolarHBondContact OE1-NH1 2.79Å; E703-R706 IonicContact OE1-NH2 3.18Å; E703-R706 PolarHBondContact OE1-NH2 2.82Å; E703-I707 HydrophobicContact CG-CD1 3.93Å; E703-I707 WeakPolarHBondContact O-CB 3.48Å; E703-I707 WeakPolarHBondContact O-CD1 3.18Å; E703-I707 VanDerWaalsContact O-CG1 3.24Å; E703-I707 WeakPolarHBondContact O-CG1 3.49Å; E703-I707 PolarHBondContact O-N 2.87Å
704	E	83	Confident	85.8	Confident	111 Å²	111	108.2 Å²	108.2	52%	0.519	51%	0.512	S	S	.	.	H	α-helix	trans	-63.6	-42	174.5	-161.9	-159.3	133.1	0	0	111.6	A700 K701 I707 R708	A700-E704 PolarHBondContact O-N 2.86Å; K701-E704 PolarHBondContact O-N 3.25Å; E704-I707 PolarHBondContact O-N 2.84Å; E704-R708 WeakPolarHBondContact O-CB 3.47Å; E704-R708 PolarHBondContact O-N 3.07Å; E704-R708 IonicContact OE1-CZ 3.56Å; E704-R708 IonicContact OE1-NH2 2.9Å; E704-R708 PolarHBondContact OE1-NH2 2.8Å
705	E	86.4	Confident	85.7	Confident	122 Å²	122	109.6 Å²	109.6	57%	0.57	52%	0.517	S	S	*	.	H	α-helix	trans	-60	-50.8	175.4	-174	162.8	-134.1	0	0	110.9	K701 I707 R708 E709	K701-E705 VanDerWaalsContact O-CB 3.27Å; K701-E705 WeakPolarHBondContact O-CB 3.21Å; K701-E705 PolarHBondContact O-N 3.03Å; E705-I707 VanDerWaalsContact C-N 3.31Å; E705-I707 PolarHBondContact O-N 3.5Å; E705-R708 CarbonylContact O-C 3.24Å; E705-R708 WeakPolarHBondContact O-CA 3.19Å; E705-R708 WeakPolarHBondContact O-CB 3.25Å; E705-R708 PolarHBondContact O-N 2.9Å; E705-E709 WeakPolarHBondContact O-CG 3.49Å; E705-E709 PolarHBondContact O-N 2.63Å
706	R	85.1	Confident	85.6	Confident	118 Å²	118	109.1 Å²	109.1	45%	0.445	51%	0.511	S	S	.	.	H	α-helix	trans	-59.7	-37.3	175.7	-166.4	-165.1	74.2	-120.6	-0	113.3	E702 E703 R708 E710	E702-R706 WeakPolarHBondContact O-CB 3.3Å; E702-R706 PolarHBondContact O-N 3.41Å; E702-R706 VanDerWaalsContact O-N 3.13Å; E703-R706 PolarHBondContact O-N 3.27Å; E703-R706 IonicContact OE1-CZ 3.78Å; E703-R706 IonicContact OE1-NH1 3.73Å; E703-R706 PolarHBondContact OE1-NH1 2.79Å; E703-R706 IonicContact OE1-NH2 3.18Å; E703-R706 PolarHBondContact OE1-NH2 2.82Å; R706-R708 VanDerWaalsContact C-N 3.34Å; R706-E710 WeakPolarHBondContact O-CB 3.41Å; R706-E710 PolarHBondContact O-N 2.91Å
707	I	87.1	Confident	85.6	Confident	95 Å²	95	110.3 Å²	110.3	49%	0.487	52%	0.52	S	S	.	.	H	α-helix	trans	-69.2	-35	175.7	-71.4	165.8	0	0	0	110.9	E703 E704 E705 A711	E703-I707 HydrophobicContact CG-CD1 3.93Å; E703-I707 WeakPolarHBondContact O-CB 3.48Å; E703-I707 WeakPolarHBondContact O-CD1 3.18Å; E703-I707 VanDerWaalsContact O-CG1 3.24Å; E703-I707 WeakPolarHBondContact O-CG1 3.49Å; E703-I707 PolarHBondContact O-N 2.87Å; E704-I707 PolarHBondContact O-N 2.84Å; E705-I707 VanDerWaalsContact C-N 3.31Å; E705-I707 PolarHBondContact O-N 3.5Å; I707-A711 WeakPolarHBondContact O-CB 2.99Å; I707-A711 PolarHBondContact O-N 2.88Å
708	R	86.4	Confident	85.6	Confident	158 Å²	158	114 Å²	114	60%	0.596	53%	0.53	S	S	*	.	H	α-helix	trans	-68.6	-44.4	175.7	-164.5	-176.8	-63.3	-173	0.2	111.4	E704 E705 R706 A711 E712	E704-R708 WeakPolarHBondContact O-CB 3.47Å; E704-R708 PolarHBondContact O-N 3.07Å; E704-R708 IonicContact OE1-CZ 3.56Å; E704-R708 IonicContact OE1-NH2 2.9Å; E704-R708 PolarHBondContact OE1-NH2 2.8Å; E705-R708 CarbonylContact O-C 3.24Å; E705-R708 WeakPolarHBondContact O-CA 3.19Å; E705-R708 WeakPolarHBondContact O-CB 3.25Å; E705-R708 PolarHBondContact O-N 2.9Å; R706-R708 VanDerWaalsContact C-N 3.34Å; R708-A711 PolarHBondContact O-N 2.86Å; R708-E712 PolarHBondContact O-N 2.82Å
709	E	85.1	Confident	85.5	Confident	110 Å²	110	112.3 Å²	112.3	51%	0.514	53%	0.527	S	S	.	.	H	α-helix	trans	-59	-46.2	171.9	-69.4	-178.3	148.7	0	0	111.8	E705 A711 E712 I713	E705-E709 WeakPolarHBondContact O-CG 3.49Å; E705-E709 PolarHBondContact O-N 2.63Å; E709-A711 VanDerWaalsContact C-N 3.29Å; E709-A711 PolarHBondContact O-N 2.93Å; E709-E712 PolarHBondContact O-N 3.05Å; E709-I713 WeakPolarHBondContact O-CB 3.44Å; E709-I713 VanDerWaalsContact O-CG1 3.28Å; E709-I713 WeakPolarHBondContact O-CG1 3.43Å; E709-I713 PolarHBondContact O-N 2.83Å
710	E	82.6	Confident	85.4	Confident	130 Å²	130	113.4 Å²	113.4	61%	0.607	53%	0.531	S	S	*	.	H	α-helix	trans	-62.2	-36.9	177.4	-168.2	-175.9	155.1	0	0	111.7	R706 K714	R706-E710 WeakPolarHBondContact O-CB 3.41Å; R706-E710 PolarHBondContact O-N 2.91Å; E710-K714 WeakPolarHBondContact O-CB 3.48Å; E710-K714 PolarHBondContact O-N 3Å; E710-K714 VanDerWaalsContact O-N 3.12Å
711	A	86.3	Confident	85.4	Confident	57 Å²	57	113.3 Å²	113.3	47%	0.471	53%	0.53	S	S	.	.	H	α-helix	trans	-67.9	-42.8	175	0	0	0	0	0	112.6	I707 R708 E709 K714 E715	I707-A711 WeakPolarHBondContact O-CB 2.99Å; I707-A711 PolarHBondContact O-N 2.88Å; R708-A711 PolarHBondContact O-N 2.86Å; E709-A711 VanDerWaalsContact C-N 3.29Å; E709-A711 PolarHBondContact O-N 2.93Å; A711-K714 WeakPolarHBondContact O-CB 3.48Å; A711-K714 PolarHBondContact O-N 2.83Å; A711-E715 PolarHBondContact O-N 2.93Å
712	E	87.7	Confident	85.3	Confident	140 Å²	140	109.7 Å²	109.7	65%	0.654	52%	0.515	S	S	*	.	H	α-helix	trans	-66.6	-46	178.7	-174.3	168.2	-174.4	0	0	111.8	R708 E709 K714 E715 E716	R708-E712 PolarHBondContact O-N 2.82Å; E709-E712 PolarHBondContact O-N 3.05Å; E712-K714 PolarHBondContact O-N 3.21Å; E712-E715 PolarHBondContact O-N 3.33Å; E712-E715 VanDerWaalsContact O-N 3.07Å; E712-E716 PolarHBondContact O-N 2.79Å
713	I	85.7	Confident	85.4	Confident	103 Å²	103	107.9 Å²	107.9	53%	0.528	52%	0.517	S	S	.	.	H	α-helix	trans	-58.3	-38.8	174	-69.6	166.5	0	0	0	111	E709 L717	E709-I713 WeakPolarHBondContact O-CB 3.44Å; E709-I713 VanDerWaalsContact O-CG1 3.28Å; E709-I713 WeakPolarHBondContact O-CG1 3.43Å; E709-I713 PolarHBondContact O-N 2.83Å; I713-L717 HydrophobicContact CG2-CD1 4.18Å; I713-L717 WeakPolarHBondContact O-CB 3.33Å; I713-L717 PolarHBondContact O-N 3.38Å
714	K	85.6	Confident	85.5	Confident	151 Å²	151	110 Å²	110	66%	0.657	53%	0.525	S	S	*	.	H	α-helix	trans	-70	-32.3	177.2	-176.5	177.8	-179.3	179	0	112.6	E710 A711 E712 R718	E710-K714 WeakPolarHBondContact O-CB 3.48Å; E710-K714 PolarHBondContact O-N 3Å; E710-K714 VanDerWaalsContact O-N 3.12Å; A711-K714 WeakPolarHBondContact O-CB 3.48Å; A711-K714 PolarHBondContact O-N 2.83Å; E712-K714 PolarHBondContact O-N 3.21Å; K714-R718 PolarHBondContact O-N 2.66Å
715	E	86.6	Confident	85.4	Confident	105 Å²	105	111.4 Å²	111.4	49%	0.491	53%	0.531	S	S	.	.	H	α-helix	trans	-74	-42	172.7	-177	149.4	-147.7	0	0	112.2	A711 E712 L717 R718 L719	A711-E715 PolarHBondContact O-N 2.93Å; E712-E715 PolarHBondContact O-N 3.33Å; E712-E715 VanDerWaalsContact O-N 3.07Å; E715-L717 VanDerWaalsContact C-N 3.32Å; E715-L717 PolarHBondContact O-N 3.32Å; E715-R718 WeakPolarHBondContact O-CB 3.35Å; E715-R718 PolarHBondContact O-N 2.68Å; E715-R718 IonicContact OE1-NH1 2.78Å; E715-L719 HydrophobicContact CG-CD1 4.18Å; E715-L719 HydrophobicContact CG-CG 4.44Å; E715-L719 WeakPolarHBondContact O-CG 2.91Å; E715-L719 PolarHBondContact O-N 3.04Å
716	E	85.1	Confident	85.3	Confident	106 Å²	106	111.7 Å²	111.7	50%	0.495	53%	0.531	S	S	.	.	H	α-helix	trans	-58	-45.7	172.9	-163.6	-140.8	133.2	0	0	110.7	E712 R718 L719 R720	E712-E716 PolarHBondContact O-N 2.79Å; E716-R718 VanDerWaalsContact C-N 3.27Å; E716-R718 PolarHBondContact O-N 3.08Å; E716-L719 PolarHBondContact O-N 2.97Å; E716-R720 WeakPolarHBondContact O-CB 3.23Å; E716-R720 PolarHBondContact O-N 2.73Å; E716-R720 IonicContact OE1-NH1 2.66Å; E716-R720 PolarHBondContact OE1-NH1 2.74Å; E716-R720 VanDerWaalsContact OE1-NH1 3.11Å
717	L	83.9	Confident	85.1	Confident	114 Å²	114	112.1 Å²	112.1	60%	0.597	54%	0.538	S	S	*	.	H	α-helix	trans	-58.5	-36.4	174.8	-90.2	161.9	0	0	0	112.8	I713 E715 A721	I713-L717 HydrophobicContact CG2-CD1 4.18Å; I713-L717 WeakPolarHBondContact O-CB 3.33Å; I713-L717 PolarHBondContact O-N 3.38Å; E715-L717 VanDerWaalsContact C-N 3.32Å; E715-L717 PolarHBondContact O-N 3.32Å; L717-A721 WeakPolarHBondContact O-CB 3.38Å; L717-A721 PolarHBondContact O-N 2.98Å; L717-A721 VanDerWaalsContact O-N 3.09Å
718	R	87.2	Confident	84.9	Confident	134 Å²	134	114.3 Å²	114.3	51%	0.506	54%	0.544	S	S	.	.	H	α-helix	trans	-69.7	-50.3	176.6	-153	-165.5	86.9	-134.7	-2.9	111.2	K714 E715 E716 R720 A721 E722	K714-R718 PolarHBondContact O-N 2.66Å; E715-R718 WeakPolarHBondContact O-CB 3.35Å; E715-R718 PolarHBondContact O-N 2.68Å; E715-R718 IonicContact OE1-NH1 2.78Å; E716-R718 VanDerWaalsContact C-N 3.27Å; E716-R718 PolarHBondContact O-N 3.08Å; R718-R720 VanDerWaalsContact C-N 3.25Å; R718-R720 PolarHBondContact O-N 2.8Å; R718-A721 WeakPolarHBondContact O-CB 3.26Å; R718-A721 PolarHBondContact O-N 2.97Å; R718-E722 IonicContact CZ-OE1 3.32Å; R718-E722 VanDerWaalsContact CZ-OE1 3.23Å; R718-E722 IonicContact NE-OE1 2.71Å; R718-E722 PolarHBondContact NE-OE1 3.27Å; R718-E722 IonicContact NH2-OE1 2.96Å; R718-E722 PolarHBondContact NH2-OE1 3.11Å; R718-E722 WeakPolarHBondContact O-CG 3.26Å; R718-E722 PolarHBondContact O-N 3.4Å
719	L	86.4	Confident	84.6	Confident	93 Å²	93	113.3 Å²	113.3	49%	0.487	55%	0.546	S	S	.	.	H	α-helix	trans	-58.9	-38.1	177.5	-68.9	170.9	0	0	0	111.7	E715 E716 E722 A723	E715-L719 HydrophobicContact CG-CD1 4.18Å; E715-L719 HydrophobicContact CG-CG 4.44Å; E715-L719 WeakPolarHBondContact O-CG 2.91Å; E715-L719 PolarHBondContact O-N 3.04Å; E716-L719 PolarHBondContact O-N 2.97Å; L719-E722 PolarHBondContact O-N 3.27Å; L719-A723 WeakPolarHBondContact O-CB 3.47Å; L719-A723 PolarHBondContact O-N 2.97Å
720	R	83.6	Confident	84.6	Confident	151 Å²	151	117.4 Å²	117.4	57%	0.57	56%	0.557	S	S	*	*	H	α-helix	trans	-73.4	-24.2	177.5	-163	169	-171.4	162.6	-2	113.5	E716 R718 K724	E716-R720 WeakPolarHBondContact O-CB 3.23Å; E716-R720 PolarHBondContact O-N 2.73Å; E716-R720 IonicContact OE1-NH1 2.66Å; E716-R720 PolarHBondContact OE1-NH1 2.74Å; E716-R720 VanDerWaalsContact OE1-NH1 3.11Å; R718-R720 VanDerWaalsContact C-N 3.25Å; R718-R720 PolarHBondContact O-N 2.8Å; R720-K724 WeakPolarHBondContact O-CG 3.37Å
721	A	84.2	Confident	84.5	Confident	57 Å²	57	116.3 Å²	116.3	47%	0.471	55%	0.554	S	S	.	*	H	α-helix	trans	-74.5	-49.1	168.3	0	0	0	0	0	111.1	L717 R718 A723 K724 E725	L717-A721 WeakPolarHBondContact O-CB 3.38Å; L717-A721 PolarHBondContact O-N 2.98Å; L717-A721 VanDerWaalsContact O-N 3.09Å; R718-A721 WeakPolarHBondContact O-CB 3.26Å; R718-A721 PolarHBondContact O-N 2.97Å; A721-A723 PolarHBondContact O-N 3.39Å; A721-K724 PolarHBondContact O-N 2.95Å; A721-K724 VanDerWaalsContact O-N 3.09Å; A721-E725 PolarHBondContact O-N 2.8Å
722	E	86	Confident	84.3	Confident	60 Å²	60	118.9 Å²	118.9	28%	0.28	56%	0.557	S	S	.	*	H	α-helix	trans	-56.7	-37	176.3	-69	177.7	-146.5	0	0	112.4	R718 L719 K726	R718-E722 IonicContact CZ-OE1 3.32Å; R718-E722 VanDerWaalsContact CZ-OE1 3.23Å; R718-E722 IonicContact NE-OE1 2.71Å; R718-E722 PolarHBondContact NE-OE1 3.27Å; R718-E722 IonicContact NH2-OE1 2.96Å; R718-E722 PolarHBondContact NH2-OE1 3.11Å; R718-E722 WeakPolarHBondContact O-CG 3.26Å; R718-E722 PolarHBondContact O-N 3.4Å; L719-E722 PolarHBondContact O-N 3.27Å; E722-K726 WeakPolarHBondContact O-CD 3.1Å; E722-K726 WeakPolarHBondContact O-CG 3.17Å; E722-K726 PolarHBondContact O-N 2.69Å; E722-K726 IonicContact OE2-NZ 2.74Å
723	A	87.2	Confident	83.9	Confident	58 Å²	58	119.4 Å²	119.4	48%	0.479	56%	0.557	S	S	.	*	H	α-helix	trans	-65.3	-42.7	175.7	0	0	0	0	0	112.8	L719 A721 K726 E727	L719-A723 WeakPolarHBondContact O-CB 3.47Å; L719-A723 PolarHBondContact O-N 2.97Å; A721-A723 PolarHBondContact O-N 3.39Å; A723-K726 PolarHBondContact O-N 3.3Å; A723-E727 PolarHBondContact O-N 3.02Å
724	K	83.4	Confident	83.7	Confident	137 Å²	137	118.5 Å²	118.5	60%	0.596	55%	0.55	S	S	*	*	H	α-helix	trans	-68.3	-33.9	177.3	-76.5	179.7	174.6	-176.7	0	112.7	R720 A721 E727 K728	R720-K724 WeakPolarHBondContact O-CG 3.37Å; A721-K724 PolarHBondContact O-N 2.95Å; A721-K724 VanDerWaalsContact O-N 3.09Å; K724-E727 PolarHBondContact O-N 2.8Å; K724-K728 WeakPolarHBondContact O-CB 3.35Å; K724-K728 PolarHBondContact O-N 3.43Å
725	E	81.7	Confident	83.4	Confident	141 Å²	141	121 Å²	121	66%	0.659	56%	0.556	S	S	*	*	H	α-helix	trans	-65.1	-46.6	175.4	-173	162.8	-142.5	0	0	111.1	A721 E727 K728 E729	A721-E725 PolarHBondContact O-N 2.8Å; E725-E727 VanDerWaalsContact C-N 3.32Å; E725-E727 PolarHBondContact O-N 2.81Å; E725-K728 PolarHBondContact O-N 2.8Å; E725-E729 PolarHBondContact O-N 2.82Å
726	K	83.6	Confident	83	Confident	128 Å²	128	121.3 Å²	121.3	56%	0.557	56%	0.56	S	S	*	*	H	α-helix	trans	-61.8	-35.7	174	-70.9	163.8	-176.6	158.2	0	112.9	E722 A723 R730	E722-K726 WeakPolarHBondContact O-CD 3.1Å; E722-K726 WeakPolarHBondContact O-CG 3.17Å; E722-K726 PolarHBondContact O-N 2.69Å; E722-K726 IonicContact OE2-NZ 2.74Å; A723-K726 PolarHBondContact O-N 3.3Å; K726-R730 WeakPolarHBondContact O-CB 3.42Å; K726-R730 PolarHBondContact O-N 2.87Å
727	E	82.9	Confident	82.6	Confident	126 Å²	126	122.6 Å²	122.6	59%	0.589	57%	0.566	S	S	*	*	H	α-helix	trans	-66.5	-44.3	173.6	-175.9	174.1	-147.2	0	0	112	A723 K724 E725 R730 L731	A723-E727 PolarHBondContact O-N 3.02Å; K724-E727 PolarHBondContact O-N 2.8Å; E725-E727 VanDerWaalsContact C-N 3.32Å; E725-E727 PolarHBondContact O-N 2.81Å; E727-R730 PolarHBondContact O-N 2.93Å; E727-L731 PolarHBondContact O-N 3.32Å
728	K	81.9	Confident	82.3	Confident	142 Å²	142	123.5 Å²	123.5	62%	0.617	57%	0.565	S	S	*	*	H	α-helix	trans	-61.5	-46.7	175.4	-175.7	-165.7	169.6	-160.2	0	111.6	K724 E725 R730 L731 E732	K724-K728 WeakPolarHBondContact O-CB 3.35Å; K724-K728 PolarHBondContact O-N 3.43Å; E725-K728 PolarHBondContact O-N 2.8Å; K728-R730 VanDerWaalsContact C-N 3.31Å; K728-R730 PolarHBondContact O-N 2.82Å; K728-L731 PolarHBondContact O-N 2.93Å; K728-E732 WeakPolarHBondContact O-CB 3.44Å; K728-E732 PolarHBondContact O-N 2.65Å
729	E	80.7	Confident	81.7	Confident	137 Å²	137	124.8 Å²	124.8	64%	0.64	57%	0.574	S	S	*	*	H	α-helix	trans	-59.3	-42.6	177.5	-171.3	-170.9	-176	0	0	111.2	E725 E732 K733	E725-E729 PolarHBondContact O-N 2.82Å; E729-E732 PolarHBondContact O-N 3.11Å; E729-K733 WeakPolarHBondContact O-CB 3.23Å; E729-K733 PolarHBondContact O-N 3.06Å
730	R	84.2	Confident	81	Confident	196 Å²	196	123.2 Å²	123.2	74%	0.74	58%	0.575	S	S	*	*	H	α-helix	trans	-62.3	-43.2	176.1	-173.7	179.3	178.1	-167.1	-0.9	112.4	K726 E727 K728 K733 E734	K726-R730 WeakPolarHBondContact O-CB 3.42Å; K726-R730 PolarHBondContact O-N 2.87Å; E727-R730 PolarHBondContact O-N 2.93Å; K728-R730 VanDerWaalsContact C-N 3.31Å; K728-R730 PolarHBondContact O-N 2.82Å; R730-K733 PolarHBondContact O-N 2.97Å; R730-E734 PolarHBondContact O-N 3.44Å
731	L	81.4	Confident	80.4	Confident	106 Å²	106	118.7 Å²	118.7	56%	0.555	57%	0.57	S	S	*	*	H	α-helix	trans	-66.6	-37.3	175.5	-89.5	165.4	0	0	0	112.7	E727 K728 E734 R735	E727-L731 PolarHBondContact O-N 3.32Å; K728-L731 PolarHBondContact O-N 2.93Å; L731-E734 PolarHBondContact O-N 2.75Å; L731-R735 WeakPolarHBondContact O-CB 3.45Å; L731-R735 PolarHBondContact O-N 2.82Å
732	E	80.6	Confident	79.6	Confident	112 Å²	112	119 Å²	119	52%	0.523	57%	0.573	S	S	.	*	H	α-helix	trans	-68.7	-40.4	175.7	-177.4	151.3	-155.7	0	0	111.6	K728 E729 R735 L736	K728-E732 WeakPolarHBondContact O-CB 3.44Å; K728-E732 PolarHBondContact O-N 2.65Å; E729-E732 PolarHBondContact O-N 3.11Å; E732-R735 PolarHBondContact O-N 2.69Å; E732-L736 HydrophobicContact CG-CD1 4.43Å; E732-L736 WeakPolarHBondContact O-CB 3.38Å; E732-L736 PolarHBondContact O-N 3.28Å
733	K	80.8	Confident	78.4	Confident	150 Å²	150	119.5 Å²	119.5	65%	0.652	59%	0.587	S	S	*	*	H	α-helix	trans	-60.5	-46.6	171.5	-174	173.9	-179.1	175.5	0	111.9	E729 R730 R735 L736 E737	E729-K733 WeakPolarHBondContact O-CB 3.23Å; E729-K733 PolarHBondContact O-N 3.06Å; R730-K733 PolarHBondContact O-N 2.97Å; K733-R735 VanDerWaalsContact C-N 3.28Å; K733-R735 PolarHBondContact O-N 2.76Å; K733-L736 PolarHBondContact O-N 3.35Å; K733-E737 WeakPolarHBondContact O-CB 3.25Å; K733-E737 PolarHBondContact O-N 3.09Å
734	E	80.4	Confident	77.1	Confident	85 Å²	85	120.2 Å²	120.2	40%	0.397	59%	0.592	S	S	.	*	H	α-helix	trans	-63.1	-35.1	176.1	-163.8	-165.7	128	0	0	111.9	R730 L731 K738	R730-E734 PolarHBondContact O-N 3.44Å; L731-E734 PolarHBondContact O-N 2.75Å; E734-K738 HydrophobicContact CG-CD 4.47Å; E734-K738 WeakPolarHBondContact O-CB 3.38Å; E734-K738 WeakPolarHBondContact O-CG 3.35Å; E734-K738 PolarHBondContact O-N 3.2Å; E734-K738 WeakPolarHBondContact OE1-CE 3.29Å; E734-K738 IonicContact OE1-NZ 3.09Å; E734-K738 PolarHBondContact OE1-NZ 2.79Å
735	R	80.3	Confident	76	Confident	203 Å²	203	117.8 Å²	117.8	77%	0.766	60%	0.598	S	S	*	*	H	α-helix	trans	-70.5	-38.8	175.1	-172.6	175.3	-177.2	168.3	0.9	112.4	L731 E732 K733 K739	L731-R735 WeakPolarHBondContact O-CB 3.45Å; L731-R735 PolarHBondContact O-N 2.82Å; E732-R735 PolarHBondContact O-N 2.69Å; K733-R735 VanDerWaalsContact C-N 3.28Å; K733-R735 PolarHBondContact O-N 2.76Å; R735-K739 WeakPolarHBondContact O-CB 3.37Å; R735-K739 PolarHBondContact O-N 2.77Å
736	L	77.2	Confident	74.6	Confident	111 Å²	111	115 Å²	115	58%	0.581	60%	0.599	S	S	*	*	H	α-helix	trans	-64.6	-43.3	172	-89.6	162.6	0	0	0	111.1	E732 K733 K739 A740	E732-L736 HydrophobicContact CG-CD1 4.43Å; E732-L736 WeakPolarHBondContact O-CB 3.38Å; E732-L736 PolarHBondContact O-N 3.28Å; K733-L736 PolarHBondContact O-N 3.35Å; L736-K739 CarbonylContact O-C 3.56Å; L736-K739 PolarHBondContact O-N 2.89Å; L736-A740 WeakPolarHBondContact O-CB 3.13Å; L736-A740 PolarHBondContact O-N 3.31Å
737	E	77.5	Confident	72.7	Confident	134 Å²	134	115.5 Å²	115.5	63%	0.626	61%	0.608	S	S	*	*	H	α-helix	trans	-63.8	-43.8	176.2	-171.8	165.4	-162.3	0	0	111.5	K733 K739 A740 A741	K733-E737 WeakPolarHBondContact O-CB 3.25Å; K733-E737 PolarHBondContact O-N 3.09Å; E737-K739 VanDerWaalsContact C-N 3.34Å; E737-K739 PolarHBondContact O-N 2.99Å; E737-A740 PolarHBondContact O-N 2.89Å; E737-A741 VanDerWaalsContact O-CB 3.29Å; E737-A741 WeakPolarHBondContact O-CB 3.41Å; E737-A741 PolarHBondContact O-N 2.95Å
738	K	77.6	Confident	70.6	Confident	133 Å²	133	115.1 Å²	115.1	58%	0.578	62%	0.616	S	S	*	*	H	α-helix	trans	-62.6	-36	171.3	-79.3	170.5	171.6	169.3	0	113.1	E734 A742	E734-K738 HydrophobicContact CG-CD 4.47Å; E734-K738 WeakPolarHBondContact O-CB 3.38Å; E734-K738 WeakPolarHBondContact O-CG 3.35Å; E734-K738 PolarHBondContact O-N 3.2Å; E734-K738 WeakPolarHBondContact OE1-CE 3.29Å; E734-K738 IonicContact OE1-NZ 3.09Å; E734-K738 PolarHBondContact OE1-NZ 2.79Å; K738-A742 WeakPolarHBondContact O-CB 3.45Å; K738-A742 PolarHBondContact O-N 2.82Å
739	K	74.2	Confident	68.5	Low	160 Å²	160	116 Å²	116	70%	0.696	63%	0.628	S	S	*	*	H	α-helix	trans	-73.9	-35.7	176.8	-163.7	178.7	-177.7	-172.7	0	112.1	R735 L736 E737 A743	R735-K739 WeakPolarHBondContact O-CB 3.37Å; R735-K739 PolarHBondContact O-N 2.77Å; L736-K739 CarbonylContact O-C 3.56Å; L736-K739 PolarHBondContact O-N 2.89Å; E737-K739 VanDerWaalsContact C-N 3.34Å; E737-K739 PolarHBondContact O-N 2.99Å; K739-A743 WeakPolarHBondContact O-CB 3.45Å; K739-A743 PolarHBondContact O-N 3.44Å
740	A	71.7	Confident	66.5	Low	60 Å²	60	114.5 Å²	114.5	50%	0.496	63%	0.63	S	S	.	*	H	α-helix	trans	-68.2	-41.9	172.2	0	0	0	0	0	111.3	L736 E737 A743 A744	L736-A740 WeakPolarHBondContact O-CB 3.13Å; L736-A740 PolarHBondContact O-N 3.31Å; E737-A740 PolarHBondContact O-N 2.89Å; A740-A743 PolarHBondContact O-N 2.81Å; A740-A744 WeakPolarHBondContact O-CB 3.22Å; A740-A744 PolarHBondContact O-N 3.12Å
741	A	70.2	Confident	64.4	Low	57 Å²	57	111.9 Å²	111.9	47%	0.471	64%	0.636	S	S	.	*	H	α-helix	trans	-62.4	-41.4	173.1	0	0	0	0	0	111.9	E737 A743 A744 A745	E737-A741 VanDerWaalsContact O-CB 3.29Å; E737-A741 WeakPolarHBondContact O-CB 3.41Å; E737-A741 PolarHBondContact O-N 2.95Å; A741-A743 VanDerWaalsContact C-N 3.34Å; A741-A743 PolarHBondContact O-N 3.41Å; A741-A744 PolarHBondContact O-N 3.37Å; A741-A745 VanDerWaalsContact O-CB 3.26Å; A741-A745 WeakPolarHBondContact O-CB 3.35Å; A741-A745 PolarHBondContact O-N 3.3Å
742	A	67.5	Low	62.3	Low	64 Å²	64	112.4 Å²	112.4	53%	0.529	65%	0.646	S	S	.	*	H	α-helix	trans	-64.7	-35.4	174.1	0	0	0	0	0	113	K738	K738-A742 WeakPolarHBondContact O-CB 3.45Å; K738-A742 PolarHBondContact O-N 2.82Å
743	A	60.9	Low	60.5	Low	70 Å²	70	114.9 Å²	114.9	58%	0.579	66%	0.661	S	S	*	*	H	α-helix	trans	-73.1	-38.7	173.9	0	0	0	0	0	112.6	K739 A740 A741 A746	K739-A743 WeakPolarHBondContact O-CB 3.45Å; K739-A743 PolarHBondContact O-N 3.44Å; A740-A743 PolarHBondContact O-N 2.81Å; A741-A743 VanDerWaalsContact C-N 3.34Å; A741-A743 PolarHBondContact O-N 3.41Å; A743-A746 WeakPolarHBondContact O-CB 3.35Å; A743-A746 PolarHBondContact O-N 2.91Å
744	A	60.4	Low	59	Low	72 Å²	72	113 Å²	113	60%	0.595	66%	0.664	S	S	*	*	H	α-helix	trans	-69.8	-33.7	176.8	0	0	0	0	0	112.4	A740 A741 A746 N747	A740-A744 WeakPolarHBondContact O-CB 3.22Å; A740-A744 PolarHBondContact O-N 3.12Å; A741-A744 PolarHBondContact O-N 3.37Å; A744-A746 PolarHBondContact O-N 2.89Å; A744-N747 PolarHBondContact O-N 3.41Å
745	A	59.4	Low	57.3	Low	87 Å²	87	114 Å²	114	72%	0.719	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-11.8	173.4	0	0	0	0	0	113.7	A741	A741-A745 VanDerWaalsContact O-CB 3.26Å; A741-A745 WeakPolarHBondContact O-CB 3.35Å; A741-A745 PolarHBondContact O-N 3.3Å
746	A	53.6	Low	55.2	Low	82 Å²	82	110.6 Å²	110.6	68%	0.678	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	1.3	-178.5	0	0	0	0	0	114.6	A743 A744	A743-A746 WeakPolarHBondContact O-CB 3.35Å; A743-A746 PolarHBondContact O-N 2.91Å; A744-A746 PolarHBondContact O-N 2.89Å
747	N	42.7	Very low	53.8	Low	138 Å²	138	111.2 Å²	111.2	74%	0.738	69%	0.691	S	S	*	*	S	Bend	trans	-147.1	107.2	176.1	-156	2.1	0	0	0	112.9	A744	A744-N747 PolarHBondContact O-N 3.41Å
748	P	39	Very low	51.9	Low	118 Å²	118	109.2 Å²	109.2	77%	0.766	70%	0.697	S	S	*	*			trans	-92.6	108.6	-170.8	33.8	-32.6	0	0	0	113.4
749	N	38.9	Very low	49.9	Very low	161 Å²	161	109.5 Å²	109.5	86%	0.861	71%	0.71	S	S	*	*			trans	-157.4	130.3	149.6	-136.3	-2.2	0	0	0	112.5
750	P	38	Very low	48.4	Very low	105 Å²	105	106.9 Å²	106.9	68%	0.682	71%	0.709	S	S	*	*			trans	-103.3	152.7	-178.8	37	-31.5	0	0	0	113.6
751	T	39.7	Very low	46.7	Very low	141 Å²	141	113 Å²	113	87%	0.865	73%	0.727	S	S	*	*			trans	-166.2	127.8	151	-1.2	0	0	0	0	111.3
752	P	38.4	Very low	45.2	Very low	118 Å²	118	115.2 Å²	115.2	77%	0.766	74%	0.739	S	S	*	*			trans	-108.3	137.9	-179.6	36.7	-29.9	0	0	0	113.7
753	I	42.8	Very low	43.7	Very low	163 Å²	163	117.5 Å²	117.5	84%	0.836	75%	0.751	S	S	*	*			trans	-145.8	117.6	171.9	-50.8	178.5	0	0	0	111
754	P	49.5	Very low	42.5	Very low	112 Å²	112	118 Å²	118	73%	0.727	76%	0.756	S	S	*	*			trans	-100.8	-174.7	164.6	42.4	-35.4	0	0	0	110.5
755	P	43.6	Very low	41.3	Very low	106 Å²	106	122.8 Å²	122.8	69%	0.688	77%	0.765	S	S	*	*			cis	-140.4	-167	6.5	41.4	-20.5	0	0	0	116.1
756	T	36.9	Very low	40.2	Very low	131 Å²	131	126.5 Å²	126.5	80%	0.804	77%	0.768	S	S	*	*			trans	73.6	155.5	153.6	42.5	0	0	0	0	121.3
757	P	48.1	Very low	39.3	Very low	124 Å²	124	131.7 Å²	131.7	81%	0.805	78%	0.778	S	S	*	*			trans	-120	164	-161.3	42.2	-30	0	0	0	116.2
758	A	36.3	Very low	39	Very low	91 Å²	91	130.5 Å²	130.5	75%	0.752	78%	0.778	S	S	*	*			trans	-154.9	120.7	161.8	0	0	0	0	0	113.5
759	T	36.5	Very low	38.8	Very low	139 Å²	139	132.5 Å²	132.5	85%	0.853	78%	0.781	S	S	*	*			trans	31.8	151.4	145.8	41.5	0	0	0	0	124.7
760	P	43.1	Very low	38.7	Very low	106 Å²	106	130.5 Å²	130.5	69%	0.688	78%	0.777	S	S	*	*			trans	-100.9	-177.7	-169.9	42.7	-38.4	0	0	0	114.4
761	H	35.9	Very low	38.8	Very low	188 Å²	188	131.3 Å²	131.3	87%	0.87	78%	0.782	S	S	*	*			trans	-166.2	161.9	142.4	-96.2	-59.6	0	0	0	113.9
762	S	37.5	Very low	38.6	Very low	103 Å²	103	130.8 Å²	130.8	72%	0.72	78%	0.781	S	S	*	*			trans	76.4	87.2	156.1	-58.6	0	0	0	0	122.8
763	S	36.4	Very low	38.4	Very low	112 Å²	112	132.9 Å²	132.9	78%	0.783	79%	0.785	S	S	*	*				54.8	123.9	114	67.2	0	0	0	0	122.9
764	A	36.3	Very low	38	Very low	81 Å²	81	129.8 Å²	129.8	67%	0.669	78%	0.778	S	S	*	*				155.6	128.5	91.1	0	0	0	0	0	115
765	Q	35.2	Very low	37.1	Very low	172 Å²	172	130.4 Å²	130.4	80%	0.804	78%	0.779	S	S	*	*			trans	56.5	159.8	142.7	-67.9	-177.6	-54.5	0	0	121.9
766	Q	35.2	Very low	36.6	Very low	165 Å²	165	133.7 Å²	133.7	77%	0.771	79%	0.785	S	S	*	*			cis	-179.4	142.2	-42.8	-118.5	176	-11.6	0	0	108.4
767	Q	35.8	Very low	36.4	Very low	192 Å²	192	132.9 Å²	132.9	90%	0.897	78%	0.781	S	S	*	*			trans	168.5	157.8	142.9	-84.5	-103.5	-24.9	0	0	110.7
768	P	36.4	Very low	35.8	Very low	113 Å²	113	132.9 Å²	132.9	73%	0.734	78%	0.783	S	S	*	*			trans	-126.7	-178.2	-148.5	40.9	-25.5	0	0	0	117.8
769	I	33.9	Very low	35.6	Very low	159 Å²	159	133.1 Å²	133.1	82%	0.815	79%	0.786	S	S	*	*			trans	-109.2	148.9	-177.8	-64.4	171.7	0	0	0	110
770	P	36.8	Very low	35.4	Very low	120 Å²	120	134.9 Å²	134.9	78%	0.779	78%	0.784	S	S	*	*			trans	-77.9	153.4	178.4	31.6	-37.5	0	0	0	114.9
771	P	40.5	Very low	34.9	Very low	121 Å²	121	136.5 Å²	136.5	79%	0.786	79%	0.786	S	S	*	*			trans	-110.4	161.1	-178.1	40.2	-34.1	0	0	0	116
772	P	36.4	Very low	34.7	Very low	130 Å²	130	135.6 Å²	135.6	84%	0.844	78%	0.782	S	S	*	*			trans	-102.3	-158	171.9	41.5	-35.8	0	0	0	113.8
773	L	32.6	Very low	34.6	Very low	163 Å²	163	138.9 Å²	138.9	85%	0.853	79%	0.786	S	S	*	*			trans	-72	162.5	-171.9	-105.6	71.7	0	0	0	117.1
774	S	34.2	Very low	34.3	Very low	98 Å²	98	139.7 Å²	139.7	69%	0.685	79%	0.791	S	S	*	*			trans	109	104.9	146.9	-59.9	0	0	0	0	121.3
775	T	31.3	Very low	34	Very low	125 Å²	125	140.6 Å²	140.6	77%	0.767	80%	0.799	S	S	*	*			trans	60.3	140.2	135	59.3	0	0	0	0	124.7
776	Q	34	Very low	33.7	Very low	174 Å²	174	141.9 Å²	141.9	81%	0.813	81%	0.805	S	S	*	*			trans	97.9	103.2	152.9	-78.4	-176.5	79.3	0	0	122.8
777	T	32.1	Very low	33.4	Very low	115 Å²	115	142.8 Å²	142.8	71%	0.706	81%	0.809	S	S	*	*			trans	62.1	121	130.3	54.7	0	0	0	0	125.7
778	S	34.6	Very low	33.1	Very low	123 Å²	123	139.8 Å²	139.8	86%	0.86	81%	0.806	S	S	*	*				79.7	170.2	129.4	-56.6	0	0	0	0	121.4
779	A	33.1	Very low	32.6	Very low	97 Å²	97	139.3 Å²	139.3	80%	0.802	81%	0.805	S	S	*	*			trans	-145.3	-171	-152.2	0	0	0	0	0	115.5
780	E	32.3	Very low	32.3	Very low	176 Å²	176	137.2 Å²	137.2	82%	0.822	80%	0.8	S	S	*	*			trans	92.3	94.9	173.2	-62.4	-160.3	93.5	0	0	120.8
781	I	32.2	Very low	31.9	Very low	140 Å²	140	138 Å²	138	72%	0.718	81%	0.805	S	S	*	*				52.2	117.8	115.2	-59.9	174.3	0	0	0	120.7
782	Q	32.3	Very low	31.3	Very low	169 Å²	169	137.4 Å²	137.4	79%	0.79	80%	0.799	S	S	*	*			trans	82.3	138.9	150.2	-82.6	-179.4	13.9	0	0	123.4
783	Q	34.1	Very low	30.9	Very low	172 Å²	172	136.6 Å²	136.6	80%	0.804	79%	0.791	S	S	*	*			trans	79.6	135.9	162.2	-65.5	-176.3	41.1	0	0	120.8
784	S	31.8	Very low	30.8	Very low	128 Å²	128	136.3 Å²	136.3	90%	0.895	79%	0.788	S	S	*	*			trans	69.3	140.6	172.3	72.1	0	0	0	0	118.6
785	A	29.1	Very low	30.7	Very low	100 Å²	100	138.6 Å²	138.6	83%	0.826	79%	0.791	S	S	*	*			trans	-79.9	141.8	-158.3	0	0	0	0	0	116.6
786	Q	29.3	Very low	30.8	Very low	199 Å²	199	136.5 Å²	136.5	93%	0.93	79%	0.786	S	S	*	*			trans	-152.8	171.1	138.7	-112.6	173.9	30.3	0	0	111.6
787	Q	29.6	Very low	30.5	Very low	185 Å²	185	135 Å²	135	86%	0.864	78%	0.784	S	S	*	*			trans	-100.9	157.5	-161.1	-75.2	-177.6	-37.4	0	0	115
788	P	29.2	Very low	30.5	Very low	129 Å²	129	135.8 Å²	135.8	84%	0.838	78%	0.782	S	S	*	*			trans	-98.5	107.3	-176.5	35.6	-31	0	0	0	113.8
789	S	25.9	Very low	30.4	Very low	102 Å²	102	136 Å²	136	71%	0.713	78%	0.781	S	S	*	*			trans	-171	162.1	161.3	54.2	0	0	0	0	113.2
790	V	28	Very low	30.1	Very low	116 Å²	116	135.1 Å²	135.1	70%	0.703	77%	0.773	S	S	*	*			trans	55.5	130.3	167.9	-58.1	0	0	0	0	120.1	V792	V790-V792 PolarHBondContact O-N 3.34Å
791	P	27.8	Very low	30.3	Very low	136 Å²	136	135.3 Å²	135.3	88%	0.883	78%	0.776	S	S	*	*	S	Bend	trans	-94	63.5	172.8	37.8	-34	0	0	0	112.2
792	V	26.9	Very low	30.3	Very low	108 Å²	108	133.5 Å²	133.5	66%	0.655	78%	0.776	S	S	*	*			trans	-145.2	144.2	173.7	-164.5	0	0	0	0	110.1	V790	V790-V792 PolarHBondContact O-N 3.34Å
793	T	29.4	Very low	30.5	Very low	113 Å²	113	130.5 Å²	130.5	69%	0.693	77%	0.771	S	S	*	*			trans	65.5	108.3	162	31	0	0	0	0	120.7
794	M	30.2	Very low	30.4	Very low	158 Å²	158	128.2 Å²	128.2	78%	0.778	77%	0.769	S	S	*	*				69.2	122.1	114.1	-73.7	-174.6	175.4	0	0	123.9
795	I	32.2	Very low	30.3	Very low	146 Å²	146	127.7 Å²	127.7	75%	0.749	77%	0.765	S	S	*	*				89.6	133.4	120	-69.4	173.4	0	0	0	122
796	A	33	Very low	30.5	Very low	80 Å²	80	127.5 Å²	127.5	66%	0.661	76%	0.764	S	S	*	*			trans	76.8	134.4	151.3	0	0	0	0	0	122.7
797	N	26.8	Very low	30.5	Very low	144 Å²	144	126.3 Å²	126.3	77%	0.77	76%	0.758	S	S	*	*				-153.1	120.3	107.9	-114.1	6.1	0	0	0	113.8
798	I	33.4	Very low	30.6	Very low	131 Å²	131	123.2 Å²	123.2	67%	0.672	76%	0.755	S	S	*	*			trans	7.8	153.3	131.4	24.6	172.7	0	0	0	119.8
799	P	31.5	Very low	30.7	Very low	128 Å²	128	124.8 Å²	124.8	83%	0.831	75%	0.751	S	S	*	*			cis	-112.8	173.2	46.1	39.9	-35.8	0	0	0	115.3
800	A	27.4	Very low	31.1	Very low	78 Å²	78	124.9 Å²	124.9	65%	0.645	75%	0.749	S	S	*	*			cis	-175.7	-176.9	-28.1	0	0	0	0	0	107.1
801	M	37.1	Very low	31.3	Very low	179 Å²	179	125.2 Å²	125.2	88%	0.882	75%	0.751	S	S	*	*			trans	80.6	84.4	171.9	-52.5	-171.6	71.5	0	0	118.1
802	S	31.3	Very low	31.5	Very low	103 Å²	103	125.5 Å²	125.5	72%	0.72	74%	0.744	S	S	*	*				-21.1	169.3	125	47.3	0	0	0	0	118.5
803	P	37.3	Very low	31.7	Very low	105 Å²	105	125.2 Å²	125.2	68%	0.682	75%	0.747	S	S	*	*			cis	-139.7	-165.6	-8.1	25.8	0.3	0	0	0	115.3
804	T	31.7	Very low	32.1	Very low	125 Å²	125	124.6 Å²	124.6	77%	0.767	75%	0.745	S	S	*	*			trans	74.3	117.2	142.3	31.6	0	0	0	0	122.3
805	S	28.7	Very low	32.2	Very low	116 Å²	116	123.1 Å²	123.1	81%	0.811	75%	0.745	S	S	*	*				43	113.5	118.4	174.3	0	0	0	0	120.3
806	A	34	Very low	32.1	Very low	97 Å²	97	121 Å²	121	80%	0.802	74%	0.744	S	S	*	*				-159	130.8	124.5	0	0	0	0	0	113.1
807	Q	28.6	Very low	32.1	Very low	173 Å²	173	121.8 Å²	121.8	81%	0.808	75%	0.749	S	S	*	*			trans	-73.2	157.7	148.6	-109.2	-179	-46.9	0	0	108.3
808	P	32.3	Very low	32.4	Very low	121 Å²	121	119.6 Å²	119.6	79%	0.786	75%	0.752	S	S	*	*				-150.9	-179.5	56.6	42.3	-21.7	0	0	0	117.7
809	Q	30.8	Very low	32.4	Very low	161 Å²	161	119.8 Å²	119.8	75%	0.752	76%	0.759	S	S	*	*			trans	-81.1	-164.3	156.5	-46.1	-178.4	-35.6	0	0	109
810	P	35.5	Very low	32.6	Very low	105 Å²	105	119.3 Å²	119.3	68%	0.682	76%	0.756	S	S	*	*			cis	-128.1	-142.2	-15.1	38.5	-19.1	0	0	0	111.6
811	V	30.8	Very low	32.8	Very low	123 Å²	123	121.2 Å²	121.2	75%	0.745	76%	0.759	S	S	*	*			trans	87	145.4	165.7	-40.1	0	0	0	0	119.2
812	L	31.7	Very low	32.7	Very low	142 Å²	142	118.8 Å²	118.8	74%	0.743	76%	0.757	S	S	*	*			cis	-167.7	113.3	-28.5	-107	173.7	0	0	0	108.7
813	S	32.1	Very low	32.6	Very low	101 Å²	101	119.6 Å²	119.6	71%	0.706	76%	0.757	S	S	*	*			trans	58.6	-175.9	139.2	72.9	0	0	0	0	119.9
814	P	38.9	Very low	32.2	Very low	101 Å²	101	120.7 Å²	120.7	66%	0.656	76%	0.762	S	S	*	*				-132.3	-173.7	-58.7	32.2	-13.2	0	0	0	113.9
815	T	30.5	Very low	32.1	Very low	127 Å²	127	122.2 Å²	122.2	78%	0.779	76%	0.762	S	S	*	*			trans	70.4	158	152.4	27.5	0	0	0	0	118.4
816	S	31.4	Very low	32.1	Very low	102 Å²	102	123.5 Å²	123.5	71%	0.713	76%	0.759	S	S	*	*			cis	-153.6	162.2	0.2	-148.6	0	0	0	0	112.7
817	A	32.7	Very low	31.9	Very low	95 Å²	95	126.5 Å²	126.5	79%	0.785	76%	0.756	S	S	*	*			trans	60.8	148.7	151.2	0	0	0	0	0	120.2
818	A	33.3	Very low	31.9	Very low	99 Å²	99	123.9 Å²	123.9	82%	0.818	75%	0.751	S	S	*	*			cis	-159	156.9	-18.6	0	0	0	0	0	111.6
819	V	33.7	Very low	31.8	Very low	135 Å²	135	123.8 Å²	123.8	82%	0.818	75%	0.751	S	S	*	*			trans	-77.9	163.8	164.7	-116.6	0	0	0	0	110
820	P	35.5	Very low	32	Very low	118 Å²	118	122.8 Å²	122.8	77%	0.766	74%	0.744	S	S	*	*				-148.9	176.3	51.9	41.7	-20.6	0	0	0	119
821	V	30.9	Very low	32	Very low	117 Å²	117	122.8 Å²	122.8	71%	0.709	74%	0.744	S	S	*	*			trans	-67.8	159.7	165.3	-77.7	0	0	0	0	113.9
822	P	35.7	Very low	31.9	Very low	129 Å²	129	120.3 Å²	120.3	84%	0.838	73%	0.732	S	S	*	*			trans	-115	102.1	147.2	34.2	-23.1	0	0	0	111.5
823	T	28.4	Very low	31.9	Very low	120 Å²	120	119.6 Å²	119.6	74%	0.736	73%	0.725	S	S	*	*			trans	-114.1	127.2	159.2	-56.4	0	0	0	0	107.6
824	T	29.5	Very low	31.9	Very low	127 Å²	127	119.6 Å²	119.6	78%	0.779	72%	0.716	S	S	*	*			trans	150	149.6	171.5	38.7	0	0	0	0	107.6
825	M	28.3	Very low	31.8	Very low	157 Å²	157	119.7 Å²	119.7	77%	0.773	72%	0.716	S	S	*	*			cis	-167.5	176.5	-0.7	-112.1	-90.3	-173.7	0	0	110.3
826	I	29.6	Very low	31.8	Very low	143 Å²	143	119 Å²	119	73%	0.733	71%	0.712	S	S	*	*			trans	79	120.7	151.6	-70.8	149.1	0	0	0	120.5
827	H	29.2	Very low	31.9	Very low	160 Å²	160	122 Å²	122	74%	0.741	72%	0.715	S	S	*	*			trans	66.2	140.2	152.7	-95.7	45.3	0	0	0	120.5
828	V	28.8	Very low	31.9	Very low	118 Å²	118	123.5 Å²	123.5	72%	0.715	71%	0.71	S	S	*	*			cis	75.9	131.6	23.6	-176.6	0	0	0	0	112.9
829	P	30.9	Very low	31.9	Very low	120 Å²	120	124.1 Å²	124.1	78%	0.779	70%	0.703	S	S	*	*			cis	-131.7	-166.1	20.9	35.4	-13.3	0	0	0	116.6
830	K	34.3	Very low	31.8	Very low	139 Å²	139	122 Å²	122	60%	0.604	70%	0.699	S	S	*	*			trans	-129.2	135.9	176.5	168.9	-167.3	-178.8	-177.7	0	110.6	H1615	K830-H1615 PolarHBondContact NZ-O 2.86Å
831	P	35.2	Very low	31.8	Very low	106 Å²	106	121.3 Å²	121.3	69%	0.688	69%	0.693	S	S	*	*			trans	-125.2	152.2	140.9	1	22.5	0	0	0	111.1
832	S	30.1	Very low	32	Very low	70 Å²	70	122.2 Å²	122.2	49%	0.49	70%	0.699	S	S	.	*				77.3	144.9	63.1	-59.5	0	0	0	0	113.2
833	E	31	Very low	31.9	Very low	128 Å²	128	120.5 Å²	120.5	60%	0.598	70%	0.696	S	S	*	*			cis	-164.9	149.6	4.8	-116.5	169.7	118.7	0	0	109.9
834	I	32.5	Very low	32.2	Very low	100 Å²	100	119.1 Å²	119.1	51%	0.513	70%	0.697	S	S	.	*				60.3	147.4	101.9	-79.2	-178.2	0	0	0	117.3
835	P	36.2	Very low	32.8	Very low	103 Å²	103	119 Å²	119	67%	0.669	70%	0.698	S	S	*	*			cis	-106.4	-123.7	-14.5	34.1	-19.2	0	0	0	113.7
836	V	31.7	Very low	33.1	Very low	114 Å²	114	117.9 Å²	117.9	69%	0.691	70%	0.7	S	S	*	*			cis	-145.1	144.9	18.5	-144.1	0	0	0	0	112.7
837	Q	32.2	Very low	33.4	Very low	164 Å²	164	115.6 Å²	115.6	77%	0.766	70%	0.702	S	S	*	*			trans	17	151	144.6	-65.9	174.7	-14.8	0	0	122.9
838	N	32.2	Very low	33.8	Very low	127 Å²	127	112.4 Å²	112.4	68%	0.679	70%	0.704	S	S	*	*			cis	-158.7	145.6	11.1	-127.1	7.7	0	0	0	115.7
839	V	33.1	Very low	34.1	Very low	112 Å²	112	114.2 Å²	114.2	68%	0.679	71%	0.709	S	S	*	*			trans	48.7	104.3	133.6	173.3	0	0	0	0	119
840	A	33.6	Very low	34.2	Very low	89 Å²	89	114.9 Å²	114.9	74%	0.736	71%	0.706	S	S	*	*				92.6	175	72.3	0	0	0	0	0	113.4
841	T	35.3	Very low	34.2	Very low	105 Å²	105	114 Å²	114	64%	0.644	71%	0.712	S	S	*	*			cis	-164.8	144.6	20.3	-23.6	0	0	0	0	112.9
842	T	33.5	Very low	34.3	Very low	135 Å²	135	114.1 Å²	114.1	83%	0.828	71%	0.713	S	S	*	*			trans	58.6	171	146	43	0	0	0	0	120.4
843	A	34.4	Very low	35	Very low	93 Å²	93	116 Å²	116	77%	0.769	72%	0.724	S	S	*	*			cis	-167.9	175.3	-8.9	0	0	0	0	0	107.6
844	A	34.9	Very low	35.3	Very low	92 Å²	92	115.3 Å²	115.3	76%	0.76	73%	0.733	S	S	*	*			cis	-168.1	167.4	-24.5	0	0	0	0	0	108.5
845	P	41	Very low	35.7	Very low	123 Å²	123	116.5 Å²	116.5	80%	0.799	75%	0.747	S	S	*	*			trans	-109.1	-170.2	-174.8	42.6	-35.3	0	0	0	114.1
846	V	35.1	Very low	35.6	Very low	135 Å²	135	116.4 Å²	116.4	82%	0.818	76%	0.755	S	S	*	*			trans	-176.7	117.4	152.8	138.3	0	0	0	0	106.7
847	A	35.6	Very low	35.7	Very low	94 Å²	94	115.8 Å²	115.8	78%	0.777	75%	0.753	S	S	*	*				67	144.5	79.6	0	0	0	0	0	114.2
848	A	38	Very low	35.7	Very low	94 Å²	94	116.7 Å²	116.7	78%	0.777	76%	0.755	S	S	*	*			cis	-138.5	-156.6	3.6	0	0	0	0	0	109.5
849	N	35.6	Very low	35.7	Very low	155 Å²	155	119.3 Å²	119.3	83%	0.829	76%	0.76	S	S	*	*			cis	-148.1	-143.7	7.8	-161.6	19.1	0	0	0	112.8
850	N	32.8	Very low	35.8	Very low	135 Å²	135	119.4 Å²	119.4	72%	0.722	76%	0.761	S	S	*	*			trans	-160.1	176.2	-143.8	-163	8.2	0	0	0	116.5
851	V	34.7	Very low	35.8	Very low	119 Å²	119	124.5 Å²	124.5	72%	0.721	77%	0.77	S	S	*	*			trans	98.7	116	156.3	-170.2	0	0	0	0	121.8
852	P	37.1	Very low	35.6	Very low	109 Å²	109	125.5 Å²	125.5	71%	0.708	77%	0.771	S	S	*	*			trans	-118.7	-149.7	157.8	44.1	-31.3	0	0	0	110.9
853	P	44.8	Very low	35.7	Very low	110 Å²	110	127.1 Å²	127.1	71%	0.714	77%	0.773	S	S	*	*			cis	-139	-155.4	-13	40	-17	0	0	0	115.3
854	S	36.5	Very low	35.4	Very low	114 Å²	114	128 Å²	128	80%	0.797	76%	0.761	S	S	*	*			trans	107.7	153.2	145.9	-76.6	0	0	0	0	124
855	P	40.6	Very low	35.5	Very low	125 Å²	125	129 Å²	129	81%	0.812	76%	0.758	S	S	*	*			trans	-140	-177.1	-149.3	44.7	-25.7	0	0	0	118.7
856	A	35.4	Very low	35.3	Very low	100 Å²	100	129.2 Å²	129.2	83%	0.826	76%	0.759	S	S	*	*			trans	-169.8	164.6	156.5	0	0	0	0	0	114.2
857	P	33.9	Very low	35.3	Very low	101 Å²	101	128.5 Å²	128.5	66%	0.656	76%	0.756	S	S	*	*			trans	-128.5	176.5	-164.9	43.5	-29.9	0	0	0	117.9
858	F	31.8	Very low	35.2	Very low	183 Å²	183	132 Å²	132	80%	0.803	76%	0.761	S	S	*	*				161.1	133	127.4	-88	-57.6	0	0	0	117.7
859	K	32.3	Very low	34.9	Very low	183 Å²	183	130.5 Å²	130.5	80%	0.796	75%	0.748	S	S	*	*			trans	63.9	164.2	147.1	-65.4	-177.3	-179.1	-175	0	121.7
860	T	34.2	Very low	34.5	Very low	113 Å²	113	131.4 Å²	131.4	69%	0.693	75%	0.747	S	S	*	*			cis	179.5	132.8	-35.4	-81.2	0	0	0	0	108.5
861	E	35.3	Very low	34.2	Very low	196 Å²	196	131.8 Å²	131.8	92%	0.916	75%	0.749	S	S	*	*			trans	-169.7	164.2	138.7	-115.1	173.3	-163.8	0	0	113
862	D	30.7	Very low	33.8	Very low	126 Å²	126	131.6 Å²	131.6	67%	0.674	75%	0.749	S	S	*	*			trans	-112.7	165.5	-164.6	-86.5	-82	0	0	0	114.1
863	I	34.7	Very low	33.3	Very low	170 Å²	170	132.6 Å²	132.6	87%	0.872	75%	0.752	S	S	*	*				-165.8	144.7	125.5	-101.4	157.5	0	0	0	112.1
864	Q	28.6	Very low	32.5	Very low	110 Å²	110	132.3 Å²	132.3	51%	0.514	75%	0.75	S	S	.	*			trans	-89.1	145.5	-170.5	-71.4	163.3	19.9	0	0	111.7
865	T	36.7	Very low	32.2	Very low	115 Å²	115	138.6 Å²	138.6	71%	0.706	76%	0.757	S	S	*	*				43.4	145.1	81.5	91.3	0	0	0	0	115.5
866	P	37.2	Very low	31.4	Very low	126 Å²	126	138 Å²	138	82%	0.818	75%	0.751	S	S	*	*				-140.7	135.7	90.8	36.4	-22.5	0	0	0	115.7
867	T	35.5	Very low	30.9	Very low	120 Å²	120	140.6 Å²	140.6	74%	0.736	75%	0.749	S	S	*	*			trans	-85.1	155.1	149.3	38.9	0	0	0	0	110.7
868	L	33.7	Very low	30.5	Very low	169 Å²	169	140.6 Å²	140.6	89%	0.885	75%	0.752	S	S	*	*			trans	-117.6	110.6	152.8	-131.1	71.3	0	0	0	105.8
869	A	29.9	Very low	30.3	Very low	62 Å²	62	137.4 Å²	137.4	51%	0.512	75%	0.747	S	S	.	*			cis	64.6	142.5	47	0	0	0	0	0	112
870	Q	27.5	Very low	29.9	Very low	173 Å²	173	136.1 Å²	136.1	81%	0.808	75%	0.749	S	S	*	*			cis	-170.3	158.8	-11.8	-115.3	165.7	-11.4	0	0	106.2
871	N	27.7	Very low	29.6	Very low	144 Å²	144	134.6 Å²	134.6	77%	0.77	75%	0.748	S	S	*	*			trans	138.2	137.4	154.6	-70.9	-25.2	0	0	0	112.5
872	T	26.3	Very low	29.2	Very low	115 Å²	115	131.3 Å²	131.3	71%	0.706	75%	0.747	S	S	*	*			cis	87.2	143.6	23.7	-52.7	0	0	0	0	114.5
873	V	27	Very low	29	Very low	129 Å²	129	128.7 Å²	128.7	78%	0.782	75%	0.75	S	S	*	*			trans	61.2	163.6	178.8	-73.3	0	0	0	0	117.5
874	P	27.1	Very low	28.8	Very low	104 Å²	104	128.1 Å²	128.1	68%	0.675	75%	0.747	S	S	*	*				-138.4	-169.5	-56.6	42.1	-26.2	0	0	0	113.9
875	R	29	Very low	28.6	Very low	246 Å²	246	128.2 Å²	128.2	93%	0.928	76%	0.756	S	S	*	*			trans	-69.8	123.9	155.6	-81.3	177.6	167.9	169.9	-4.6	110.9
876	T	24.9	Very low	28.2	Very low	112 Å²	112	129.8 Å²	129.8	69%	0.687	76%	0.758	S	S	*	*			trans	-172	128.4	145.8	23.7	0	0	0	0	107.4
877	I	24.8	Very low	27.7	Very low	155 Å²	155	130.9 Å²	130.9	80%	0.795	76%	0.757	S	S	*	*				55.6	96.3	78.2	-54.7	176.7	0	0	0	113
878	S	24.8	Very low	27.6	Very low	101 Å²	101	131.1 Å²	131.1	71%	0.706	76%	0.758	S	S	*	*			trans	163.4	121	137.5	-89.5	0	0	0	0	106.8
879	T	27.4	Very low	27.6	Very low	116 Å²	116	128.4 Å²	128.4	71%	0.712	75%	0.751	S	S	*	*				47.5	86.5	59	72.6	0	0	0	0	113.1
880	D	24.4	Very low	27.5	Very low	156 Å²	156	129.4 Å²	129.4	83%	0.834	76%	0.759	S	S	*	*				-145.9	141.5	105.7	-81.4	-35.8	0	0	0	108.3
881	A	27.9	Very low	27.6	Very low	81 Å²	81	126.5 Å²	126.5	67%	0.669	76%	0.758	S	S	*	*			cis	87.2	76.3	28.5	0	0	0	0	0	114.8
882	S	27.4	Very low	27.5	Very low	127 Å²	127	127.1 Å²	127.1	89%	0.888	76%	0.76	S	S	*	*			trans	-178.6	113.1	154.1	-80.1	0	0	0	0	105.6
883	G	27.2	Very low	27.7	Very low	72 Å²	72	125.6 Å²	125.6	74%	0.742	76%	0.759	S	S	*	*				102.4	123.3	74.3	0	0	0	0	0	106.8
884	L	28.9	Very low	27.9	Very low	157 Å²	157	124.9 Å²	124.9	82%	0.822	76%	0.76	S	S	*	*			cis	-127.8	142.8	38.7	-102	59.8	0	0	0	112
885	V	26.1	Very low	28.1	Very low	113 Å²	113	125.9 Å²	125.9	69%	0.685	77%	0.766	S	S	*	*				55	88.7	92.1	-178.8	0	0	0	0	110.5
886	I	26.6	Very low	28.3	Very low	147 Å²	147	119.1 Å²	119.1	75%	0.754	76%	0.756	S	S	*	*				48.6	102.7	78.8	-54.4	176.9	0	0	0	111.6
887	N	28.1	Very low	28.8	Very low	149 Å²	149	119.2 Å²	119.2	80%	0.797	76%	0.759	S	S	*	*			trans	-160.9	96.5	144.9	-108.9	-14.5	0	0	0	111.7	P889	N887-P889 WeakPolarHBondContact O-CD 3.48Å
888	T	32.9	Very low	29	Very low	125 Å²	125	116.1 Å²	116.1	77%	0.767	76%	0.756	S	S	*	*			trans	-84.4	120.7	150.9	45.9	0	0	0	0	109.2
889	P	34.2	Very low	29.6	Very low	112 Å²	112	116.6 Å²	116.6	73%	0.727	76%	0.757	S	S	*	*			trans	-101.2	120.6	135	31.4	-26.3	0	0	0	107.1	N887	N887-P889 WeakPolarHBondContact O-CD 3.48Å
890	A	26.5	Very low	29.7	Very low	84 Å²	84	116.3 Å²	116.3	69%	0.694	76%	0.76	S	S	*	*			cis	63.4	97.7	39.7	0	0	0	0	0	113
891	S	29.9	Very low	30	Very low	111 Å²	111	113.1 Å²	113.1	78%	0.776	76%	0.755	S	S	*	*			trans	48.8	133.4	146.1	-157.4	0	0	0	0	120.9
892	I	26.5	Very low	30.3	Very low	158 Å²	158	114.7 Å²	114.7	81%	0.81	76%	0.757	S	S	*	*				174.1	132.2	121.2	-90.4	154.7	0	0	0	110.7
893	A	29.8	Very low	30.5	Very low	83 Å²	83	115.2 Å²	115.2	69%	0.686	75%	0.75	S	S	*	*			trans	59.1	142	165.8	0	0	0	0	0	117.6
894	S	31.3	Very low	30.9	Very low	114 Å²	114	117.9 Å²	117.9	80%	0.797	75%	0.751	S	S	*	*			cis	69.2	144.9	29.8	-51.4	0	0	0	0	114.5
895	P	31.8	Very low	31.3	Very low	124 Å²	124	114.7 Å²	114.7	81%	0.805	75%	0.747	S	S	*	*			cis	-130.2	-171.4	8.2	37	-16.5	0	0	0	115.3
896	S	33.9	Very low	31.6	Very low	104 Å²	104	114.4 Å²	114.4	73%	0.727	75%	0.75	S	S	*	*			trans	-57.9	174.6	154.3	-142.3	0	0	0	0	111.1
897	P	34.8	Very low	31.8	Very low	114 Å²	114	112.9 Å²	112.9	74%	0.74	75%	0.748	S	S	*	*			cis	-152.4	-153.5	23.6	41.6	-16.5	0	0	0	116.4
898	A	28.9	Very low	32.1	Very low	90 Å²	90	112.3 Å²	112.3	74%	0.744	75%	0.75	S	S	*	*			trans	93.9	154.6	145.7	0	0	0	0	0	119.7
899	P	36.7	Very low	32.1	Very low	112 Å²	112	110.5 Å²	110.5	73%	0.727	75%	0.748	S	S	*	*			trans	-138.4	-169.2	-146.5	42	-21.9	0	0	0	116.5
900	S	30	Very low	32.5	Very low	110 Å²	110	111 Å²	111	77%	0.769	75%	0.751	S	S	*	*			trans	82.7	149.3	150	-60.7	0	0	0	0	120.7
901	A	30.7	Very low	32.8	Very low	88 Å²	88	113.7 Å²	113.7	73%	0.727	76%	0.758	S	S	*	*			trans	74.7	140.7	151	0	0	0	0	0	118.1
902	T	34	Very low	33.1	Very low	115 Å²	115	114.1 Å²	114.1	71%	0.706	76%	0.756	S	S	*	*			cis	-159.1	156.5	-6.1	4.4	0	0	0	0	112.5
903	D	31.4	Very low	33.7	Very low	138 Å²	138	111.8 Å²	111.8	74%	0.738	75%	0.752	S	S	*	*			trans	65.3	157.9	146.2	-64.1	-36.3	0	0	0	120.3
904	V	36.5	Very low	34	Very low	128 Å²	128	112.4 Å²	112.4	78%	0.776	76%	0.757	S	S	*	*			cis	-141.4	144.4	15.3	-142.1	0	0	0	0	112.5
905	A	35.9	Very low	34.3	Very low	89 Å²	89	112 Å²	112	74%	0.736	75%	0.752	S	S	*	*			trans	50.1	148.2	143.9	0	0	0	0	0	121.6
906	S	32.8	Very low	34.4	Very low	107 Å²	107	112.4 Å²	112.4	75%	0.748	75%	0.752	S	S	*	*			cis	-177.5	177.4	-5.7	51.2	0	0	0	0	108.9
907	T	32	Very low	34.7	Very low	115 Å²	115	112.4 Å²	112.4	71%	0.706	75%	0.749	S	S	*	*			cis	-172.4	150.7	-37.7	-78.8	0	0	0	0	108.3
908	T	33.6	Very low	34.6	Very low	138 Å²	138	113 Å²	113	85%	0.847	75%	0.751	S	S	*	*			trans	64.1	156.4	169.1	46.5	0	0	0	0	118.7
909	A	33.4	Very low	34.7	Very low	87 Å²	87	113.9 Å²	113.9	72%	0.719	75%	0.747	S	S	*	*			cis	-166.4	166	-18.4	0	0	0	0	0	110.4
910	P	42.3	Very low	34.4	Very low	122 Å²	122	112.2 Å²	112.2	79%	0.792	74%	0.735	S	S	*	*			trans	-104.2	178.5	-173.3	40.6	-36.1	0	0	0	115.2
911	V	33.5	Very low	34.5	Very low	140 Å²	140	110.2 Å²	110.2	85%	0.848	72%	0.719	S	S	*	*			trans	174.5	152.5	135.9	149	0	0	0	0	113.7
912	T	34.6	Very low	34.5	Very low	120 Å²	120	113.1 Å²	113.1	74%	0.736	72%	0.722	S	S	*	*			trans	-76.1	-170.2	177.5	22.8	0	0	0	0	115.9
913	P	39.5	Very low	34.3	Very low	110 Å²	110	111.4 Å²	111.4	71%	0.714	73%	0.727	S	S	*	*			cis	-140	158.1	-26.8	32.6	-12.7	0	0	0	117.6
914	A	35.4	Very low	34.2	Very low	96 Å²	96	108.7 Å²	108.7	79%	0.793	73%	0.731	S	S	*	*			trans	50.7	-174.3	145.3	0	0	0	0	0	120.7
915	P	39.1	Very low	33.9	Very low	106 Å²	106	107.2 Å²	107.2	69%	0.688	73%	0.732	S	S	*	*			cis	-134.4	148.6	-18.7	37.8	-19.3	0	0	0	117.6
916	T	34.2	Very low	33.7	Very low	132 Å²	132	108 Å²	108	81%	0.81	74%	0.74	S	S	*	*			trans	66.2	-179.4	146.1	65	0	0	0	0	119.7
917	P	40.4	Very low	33.7	Very low	103 Å²	103	107.4 Å²	107.4	67%	0.669	74%	0.741	S	S	*	*				-134.2	175.1	-88.7	40.8	-22.5	0	0	0	116.2
918	T	32.7	Very low	33.7	Very low	128 Å²	128	106.4 Å²	106.4	79%	0.785	74%	0.744	S	S	*	*			trans	160.7	116.2	132.6	38.4	0	0	0	0	117.1
919	T	30.4	Very low	33.5	Very low	108 Å²	108	105.3 Å²	105.3	66%	0.663	74%	0.742	S	S	*	*			trans	63.4	129.2	131.8	-17.7	0	0	0	0	126
920	T	30.9	Very low	33.3	Very low	76 Å²	76	107.7 Å²	107.7	47%	0.466	75%	0.748	S	S	.	*			trans	102.9	147.4	136.4	12.9	0	0	0	0	124.7	N1205 M1206	T920-N1205 PolarHBondContact O-ND2 2.96Å; T920-M1206 WeakPolarHBondContact O-CG 3.29Å
921	T	31.4	Very low	32.8	Very low	69 Å²	69	108.6 Å²	108.6	42%	0.423	75%	0.751	S	S	.	*			trans	27.7	126.5	155.4	34.6	0	0	0	0	127.1
922	D	29.7	Very low	32.5	Very low	149 Å²	149	107.5 Å²	107.5	80%	0.797	75%	0.745	S	S	*	*				63.5	147.5	124.3	-59	-5	0	0	0	124.2
923	G	29.6	Very low	32.4	Very low	78 Å²	78	109.5 Å²	109.5	80%	0.804	75%	0.746	S	S	*	*			trans	-171.8	-96.3	178.7	0	0	0	0	0	115.5
924	G	29.8	Very low	31.9	Very low	81 Å²	81	110.5 Å²	110.5	84%	0.835	75%	0.745	S	S	*	*			trans	80.5	168.3	-166.6	0	0	0	0	0	113.1
925	A	30.9	Very low	31.8	Very low	97 Å²	97	114.9 Å²	114.9	80%	0.802	75%	0.747	S	S	*	*			cis	-164.5	159	-12.3	0	0	0	0	0	110.2
926	A	32.2	Very low	31.3	Very low	107 Å²	107	117.3 Å²	117.3	88%	0.884	75%	0.749	S	S	*	*			trans	64.1	148	159.9	0	0	0	0	0	119.1
927	A	32.3	Very low	31.2	Very low	93 Å²	93	120.8 Å²	120.8	77%	0.769	76%	0.756	S	S	*	*			cis	-157.8	155.7	-12.1	0	0	0	0	0	112.8
928	A	31.4	Very low	31	Very low	95 Å²	95	125.6 Å²	125.6	79%	0.785	77%	0.766	S	S	*	*			trans	45.4	113.6	148.6	0	0	0	0	0	121.3
929	S	29.5	Very low	31	Very low	114 Å²	114	131 Å²	131	80%	0.797	77%	0.772	S	S	*	*				-160.6	123.3	115.7	11.2	0	0	0	0	114
930	T	29.2	Very low	31.3	Very low	138 Å²	138	134.3 Å²	134.3	85%	0.847	78%	0.778	S	S	*	*			trans	4.7	122	148.8	-42.9	0	0	0	0	120.6
931	T	31.1	Very low	31.3	Very low	140 Å²	140	135 Å²	135	86%	0.859	79%	0.785	S	S	*	*			trans	-148.9	155.4	146	-8	0	0	0	0	112.3
932	T	28.7	Very low	31.6	Very low	118 Å²	118	138.7 Å²	138.7	72%	0.724	80%	0.802	S	S	*	*			trans	-100.9	164.1	-175.8	50.7	0	0	0	0	112.7
933	E	32	Very low	32.3	Very low	162 Å²	162	138.1 Å²	138.1	76%	0.757	79%	0.793	S	S	*	*				-179.8	137.6	117.4	-96.5	-160.5	170.6	0	0	117.7
934	N	29.6	Very low	33.9	Very low	130 Å²	130	140.3 Å²	140.3	70%	0.695	78%	0.777	S	S	*	*			trans	47.3	116.2	134.5	-56	-25.8	0	0	0	125.1
935	K	32.4	Very low	36.3	Very low	189 Å²	189	142.1 Å²	142.1	82%	0.822	76%	0.762	S	S	*	*			trans	-173.6	154.1	131.7	-99.4	-170.1	174.5	-98.3	0	108.3
936	E	29.4	Very low	39.1	Very low	156 Å²	156	137.6 Å²	137.6	73%	0.729	72%	0.724	S	S	*	*			cis	-167.8	117.6	-21.8	-178.5	175.9	160.6	0	0	107.1
937	E	32.1	Very low	42	Very low	206 Å²	206	133.3 Å²	133.3	96%	0.963	69%	0.687	S	S	*	*			trans	-137.1	147.2	-171.7	-153.4	179.8	-146.9	0	0	114.6
938	K	34.9	Very low	44.9	Very low	204 Å²	204	128.9 Å²	128.9	89%	0.887	65%	0.65	S	S	*	*			trans	-115.3	94.9	-151.6	-166.5	173.6	-177.5	175.7	0	114.7
939	R	33.6	Very low	47.9	Very low	240 Å²	240	126.1 Å²	126.1	91%	0.906	62%	0.621	S	S	*	*			trans	21.1	109.9	156.5	-66.5	-178.8	170.9	-172	-4.7	118.8
940	K	35.9	Very low	50.9	Low	179 Å²	179	120.9 Å²	120.9	78%	0.778	58%	0.584	S	S	*	*			trans	-138.1	141.8	142.8	-156.1	166.4	-173.6	175.6	0	109.4
941	S	31.5	Very low	53.8	Low	90 Å²	90	117.9 Å²	117.9	63%	0.629	56%	0.563	S	S	*	*			trans	-84.4	131.9	-165.5	-171.9	0	0	0	0	113.5
942	N	37.6	Very low	56.5	Low	146 Å²	146	112.1 Å²	112.1	78%	0.781	53%	0.531	S	S	*	.			trans	-141.3	119.6	164.8	-97.2	-20.7	0	0	0	107.7	R944	N942-R944 PolarHBondContact O-N 3.29Å
943	K	44.8	Very low	59.1	Low	137 Å²	137	108.3 Å²	108.3	60%	0.596	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-62.8	124.3	179.4	-65.3	-160.6	178.2	-153.3	0	110	V1031 D1033	K943-V1031 HydrophobicContact CB-CG1 4.42Å; K943-V1031 HydrophobicContact CD-CG1 4.41Å; K943-D1033 WeakPolarHBondContact CE-OD2 2.95Å; K943-D1033 IonicContact NZ-OD2 3.37Å; K943-D1033 PolarHBondContact NZ-OD2 3.49Å
944	R	63.3	Low	61.3	Low	124 Å²	124	102.8 Å²	102.8	47%	0.468	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	120.3	-175.9	-58.7	-179.1	-174.5	-175.4	1.2	109.3	N942 L1032	N942-R944 PolarHBondContact O-N 3.29Å; R944-L1032 HydrophobicContact CB-CB 4.19Å; R944-L1032 HydrophobicContact CB-CD1 3.89Å; R944-L1032 WeakPolarHBondContact O-CB 3.47Å; R944-L1032 PolarHBondContact O-N 2.8Å
945	K	80.9	Confident	63.2	Low	120 Å²	120	102 Å²	102	52%	0.522	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	136.3	175.9	-165.4	176.6	-176.9	172	0	109.7	V947 T1030 V1031	K945-V947 HydrophobicContact CD-CG2 3.96Å; K945-V947 HydrophobicContact CG-CG2 3.81Å; K945-T1030 WeakPolarHBondContact CA-O 3.45Å; K945-V1031 HydrophobicContact CG-CG2 4.24Å
946	V	88.6	Confident	64.3	Low	1 Å²	1	97.8 Å²	97.8	1%	0.006	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.1	171.8	-179.2	0	0	0	0	107.5	L966 I1004 V1005 Q1008 T1030 L1032	V946-L966 HydrophobicContact CG1-CD1 3.84Å; V946-I1004 HydrophobicContact CB-CG2 4.07Å; V946-I1004 HydrophobicContact CG1-CG2 4.11Å; V946-I1004 HydrophobicContact CG2-CG2 4.49Å; V946-V1005 HydrophobicContact CG1-CG2 4.22Å; V946-Q1008 PolarHBondContact O-NE2 3.5Å; V946-T1030 PolarHBondContact N-O 3.43Å; V946-T1030 PolarHBondContact O-N 3.05Å; V946-L1032 HydrophobicContact CG2-CD1 4.3Å
947	V	92.5	Very high	65.8	Low	17 Å²	17	97.5 Å²	97.5	10%	0.103	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	134.3	-173.6	-174.8	0	0	0	0	109.9	K945 L966 D967 K1027 L1028 A1029	K945-V947 HydrophobicContact CD-CG2 3.96Å; K945-V947 HydrophobicContact CG-CG2 3.81Å; V947-L966 WeakPolarHBondContact O-CA 3.35Å; V947-D967 HydrophobicContact CB-CB 4.31Å; V947-D967 PolarHBondContact N-O 3.47Å; V947-D967 PolarHBondContact O-N 3.4Å; V947-K1027 HydrophobicContact CG1-CD 4.16Å; V947-K1027 HydrophobicContact CG1-CG 3.71Å; V947-L1028 CarbonylContact C-O 3.59Å; V947-L1028 VanDerWaalsContact CA-O 3.3Å; V947-L1028 WeakPolarHBondContact CA-O 3.23Å; V947-L1028 WeakPolarHBondContact CG1-O 3.4Å; V947-A1029 HydrophobicContact CG2-CB 4.15Å
948	M	93.8	Very high	67.1	Low	1 Å²	1	95.3 Å²	95.3	1%	0.005	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	138.2	175.5	-175.5	138.3	54	0	0	110.7	C964 R965 L966 F975 V1005 Q1008 L1009 K1027 L1028	M948-C964 HydrophobicContact CG-CB 4.27Å; M948-C964 HydrophobicContact SD-CB 4.22Å; M948-R965 CarbonylContact C-O 3.51Å; M948-R965 VanDerWaalsContact CA-O 3.28Å; M948-R965 WeakPolarHBondContact CA-O 3.34Å; M948-L966 HydrophobicContact CB-CD1 4.41Å; M948-L966 HydrophobicContact SD-CB 4.28Å; M948-L966 HydrophobicContact SD-CD1 4.43Å; M948-F975 HydrophobicContact SD-CE1 4.07Å; M948-F975 HydrophobicContact SD-CZ 3.78Å; M948-V1005 HydrophobicContact CE-CG1 4.27Å; M948-Q1008 HydrophobicContact CE-CB 3.37Å; M948-L1009 HydrophobicContact CE-CD2 4.42Å; M948-L1009 HydrophobicContact CE-CG 3.98Å; M948-K1027 CarbonylContact O-C 3.49Å; M948-K1027 WeakPolarHBondContact O-CA 3.38Å; M948-L1028 PolarHBondContact N-O 2.82Å; M948-L1028 PolarHBondContact O-N 3.48Å
949	E	94	Very high	68.5	Low	37 Å²	37	92.2 Å²	92.2	17%	0.173	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	123.4	-171.9	-174.9	178	107	0	0	109.9	L951 C964 R965 T1026 K1027	E949-L951 PolarHBondContact O-N 3.27Å; E949-C964 CarbonylContact O-C 3.4Å; E949-C964 WeakPolarHBondContact O-CA 3.36Å; E949-R965 PolarHBondContact N-O 3.21Å; E949-R965 PolarHBondContact O-N 3.01Å; E949-R965 IonicContact OE1-CZ 2.63Å; E949-R965 IonicContact OE1-NH1 2.94Å; E949-R965 PolarHBondContact OE1-NH1 3.05Å; E949-R965 IonicContact OE1-NH2 2.71Å; E949-R965 PolarHBondContact OE1-NH2 3.38Å; E949-R965 VanDerWaalsContact OE1-NH2 3.15Å; E949-R965 IonicContact OE2-CZ 2.65Å; E949-R965 IonicContact OE2-NH1 3.63Å; E949-R965 IonicContact OE2-NH2 2.84Å; E949-R965 PolarHBondContact OE2-NH2 3.31Å; E949-T1026 WeakPolarHBondContact CA-O 3.41Å; E949-K1027 HydrophobicContact CB-CG 4.33Å; E949-K1027 HydrophobicContact CG-CD 4.48Å; E949-K1027 HydrophobicContact CG-CG 4.49Å; E949-K1027 VanDerWaalsContact OE2-CD 3.32Å; E949-K1027 WeakPolarHBondContact OE2-CD 3.26Å; E949-K1027 WeakPolarHBondContact OE2-CE 3.21Å; E949-K1027 IonicContact OE2-NZ 3.6Å; E949-K1027 PolarHBondContact OE2-NZ 3.21Å
950	I	93.4	Very high	70.3	Confident	3 Å²	3	82.8 Å²	82.8	2%	0.015	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	114.3	179.2	-56.3	175.2	0	0	0	108.3	V1012 L1015 I1016 G1023 G1025 T1026	I950-V1012 HydrophobicContact CD1-CB 4.39Å; I950-V1012 HydrophobicContact CD1-CG1 3.9Å; I950-V1012 HydrophobicContact CD1-CG2 4.05Å; I950-V1012 HydrophobicContact CG1-CG1 4.05Å; I950-V1012 HydrophobicContact CG1-CG2 4.01Å; I950-L1015 HydrophobicContact CD1-CD2 3.87Å; I950-I1016 HydrophobicContact CD1-CD1 4.27Å; I950-I1016 HydrophobicContact CG2-CD1 4.12Å; I950-G1023 WeakPolarHBondContact CD1-O 3.46Å; I950-G1025 WeakPolarHBondContact O-CA 3.49Å; I950-G1025 PolarHBondContact O-N 3.13Å; I950-T1026 PolarHBondContact N-O 2.97Å
951	L	90.9	Very high	72.8	Confident	76 Å²	76	75.9 Å²	75.9	40%	0.398	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-27.5	-176.6	-59.6	179.1	0	0	0	113.4	E949 S963 R965 T974	E949-L951 PolarHBondContact O-N 3.27Å; L951-S963 PolarHBondContact N-O 3.17Å; L951-R965 HydrophobicContact CD1-CB 4.15Å; L951-R965 HydrophobicContact CD2-CB 4.16Å; L951-R965 HydrophobicContact CG-CB 4.27Å; L951-T974 HydrophobicContact CD1-CG2 3.87Å
952	G	86.7	Confident	75.6	Confident	18 Å²	18	71.6 Å²	71.6	19%	0.186	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169	160.5	-177.5	0	0	0	0	0	113.2	S963	G952-S963 PolarHBondContact N-O 3.49Å; G952-S963 PolarHBondContact O-N 2.89Å
953	C	84	Confident	78.2	Confident	38 Å²	38	65.7 Å²	65.7	26%	0.257	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	125.4	171.2	-168.3	0	0	0	0	108.6	L961	C953-L961 WeakPolarHBondContact CA-O 3.35Å
954	D	77.5	Confident	80.5	Confident	47 Å²	47	59.2 Å²	59.2	25%	0.251	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	106.6	177.8	-178.9	10.9	0	0	0	109.6	S956 R957 A960 L961	D954-S956 VanDerWaalsContact C-N 3.35Å; D954-S956 VanDerWaalsContact OD1-CB 3.23Å; D954-S956 WeakPolarHBondContact OD1-CB 3.26Å; D954-S956 PolarHBondContact OD1-N 2.71Å; D954-S956 PolarHBondContact OD1-OG 2.95Å; D954-S956 PolarHBondContact OD2-OG 3.11Å; D954-R957 IonicContact OD2-NE 2.65Å; D954-A960 WeakPolarHBondContact O-CA 3.45Å; D954-L961 HydrophobicContact CB-CB 4.33Å; D954-L961 PolarHBondContact N-O 3Å; D954-L961 PolarHBondContact O-N 3.45Å
955	E	70	Confident	82	Confident	114 Å²	114	55.9 Å²	55.9	53%	0.533	29%	0.289	S	S	.	.			trans	-86.8	-1.1	177.2	-63.9	174.5	155.7	0	0	112.7	R957 K1021	E955-R957 PolarHBondContact O-N 2.92Å; E955-R957 VanDerWaalsContact O-N 3.11Å; E955-K1021 IonicContact OE1-NZ 2.73Å; E955-K1021 PolarHBondContact OE1-NZ 3.4Å; E955-K1021 WeakPolarHBondContact OE2-CE 3.38Å; E955-K1021 IonicContact OE2-NZ 2.98Å; E955-K1021 PolarHBondContact OE2-NZ 2.93Å
956	S	55.9	Low	82.7	Confident	99 Å²	99	50.1 Å²	50.1	69%	0.692	26%	0.264	S	S	*	.	S	Bend	trans	-79	11.7	-171	71.4	0	0	0	0	115.4	D954	D954-S956 VanDerWaalsContact C-N 3.35Å; D954-S956 VanDerWaalsContact OD1-CB 3.23Å; D954-S956 WeakPolarHBondContact OD1-CB 3.26Å; D954-S956 PolarHBondContact OD1-N 2.71Å; D954-S956 PolarHBondContact OD1-OG 2.95Å; D954-S956 PolarHBondContact OD2-OG 3.11Å
957	R	59.5	Low	82.8	Confident	151 Å²	151	52.1 Å²	52.1	57%	0.57	27%	0.274	S	S	*	.	S	Bend	trans	-135.5	162.4	-179.4	-50.5	-169.8	-160.6	-168.4	6	110.6	D954 E955 F959	D954-R957 IonicContact OD2-NE 2.65Å; E955-R957 PolarHBondContact O-N 2.92Å; E955-R957 VanDerWaalsContact O-N 3.11Å; R957-F959 CarbonylContact O-C 3.57Å; R957-F959 PolarHBondContact O-N 3.39Å
958	N	60.8	Low	82.6	Confident	160 Å²	160	52.3 Å²	52.3	86%	0.856	28%	0.276	S	S	*	.	S	Bend	trans	-56	-14	-178.3	-64.7	23.3	0	0	0	115.2
959	F	63	Low	81.8	Confident	139 Å²	139	55.8 Å²	55.8	61%	0.61	30%	0.3	S	S	*	.	S	Bend	trans	-132	132.5	169.6	-49.9	-78.6	0	0	0	108	R957 L961 A978	R957-F959 CarbonylContact O-C 3.57Å; R957-F959 PolarHBondContact O-N 3.39Å; F959-L961 PolarHBondContact O-N 3.15Å; F959-A978 HydrophobicContact CB-CB 4.32Å
960	A	72.6	Confident	81.1	Confident	42 Å²	42	58.3 Å²	58.3	35%	0.347	31%	0.311	S	S	.	.			trans	-62.5	129.9	175.1	0	0	0	0	0	110.3	D954 P979	D954-A960 WeakPolarHBondContact O-CA 3.45Å; A960-P979 WeakPolarHBondContact O-CD 3.5Å
961	L	86.6	Confident	80.6	Confident	33 Å²	33	62 Å²	62	17%	0.173	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	119.2	-178.7	-77.5	169.7	0	0	0	111.2	C953 D954 F959 A978	C953-L961 WeakPolarHBondContact CA-O 3.35Å; D954-L961 HydrophobicContact CB-CB 4.33Å; D954-L961 PolarHBondContact N-O 3Å; D954-L961 PolarHBondContact O-N 3.45Å; F959-L961 PolarHBondContact O-N 3.15Å; L961-A978 HydrophobicContact CD2-CB 4.31Å
962	V	90.4	Very high	80.6	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	124.5	178.8	177.1	0	0	0	0	109.3	Q976 F977 P979 V1012 I1016	V962-Q976 VanDerWaalsContact O-CA 3.25Å; V962-Q976 WeakPolarHBondContact O-CA 3.49Å; V962-F977 HydrophobicContact CB-CD1 4.26Å; V962-F977 HydrophobicContact CB-CE1 3.9Å; V962-F977 HydrophobicContact CB-CE2 4.4Å; V962-F977 HydrophobicContact CB-CZ 3.98Å; V962-F977 HydrophobicContact CG1-CD1 4.41Å; V962-F977 HydrophobicContact CG1-CE1 3.64Å; V962-F977 HydrophobicContact CG1-CZ 3.79Å; V962-F977 PolarHBondContact N-O 3.35Å; V962-F977 PolarHBondContact O-N 2.82Å; V962-F977 VanDerWaalsContact O-N 3.09Å; V962-P979 HydrophobicContact CG2-CG 3.82Å; V962-V1012 HydrophobicContact CG1-CG1 3.93Å; V962-I1016 HydrophobicContact CB-CD1 4.09Å; V962-I1016 HydrophobicContact CG1-CD1 3.4Å; V962-I1016 HydrophobicContact CG2-CD1 3.48Å; V962-I1016 VanDerWaalsContact CG2-CD1 3.48Å; V962-I1016 HydrophobicContact CG2-CG2 4Å
963	S	92	Very high	80.8	Confident	23 Å²	23	62.3 Å²	62.3	16%	0.161	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	125.4	174.8	-54.7	0	0	0	0	110.2	L951 G952 Q976	L951-S963 PolarHBondContact N-O 3.17Å; G952-S963 PolarHBondContact N-O 3.49Å; G952-S963 PolarHBondContact O-N 2.89Å; S963-Q976 WeakPolarHBondContact OG-CG 3.48Å; S963-Q976 PolarHBondContact OG-NE2 3.49Å
964	C	94.4	Very high	81.3	Confident	0 Å²	0	65 Å²	65	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	146.2	176.6	-74.2	0	0	0	0	111.7	M948 E949 T974 F975	M948-C964 HydrophobicContact CG-CB 4.27Å; M948-C964 HydrophobicContact SD-CB 4.22Å; E949-C964 CarbonylContact O-C 3.4Å; E949-C964 WeakPolarHBondContact O-CA 3.36Å; C964-T974 CarbonylContact O-C 3.28Å; C964-T974 VanDerWaalsContact O-CA 3.28Å; C964-T974 WeakPolarHBondContact O-CA 3.29Å; C964-F975 HydrophobicContact CB-CE1 4.11Å; C964-F975 HydrophobicContact CB-CE2 4.36Å; C964-F975 HydrophobicContact CB-CZ 3.95Å; C964-F975 PolarHBondContact N-O 2.81Å; C964-F975 PolarHBondContact O-N 2.73Å
965	R	95	Very high	82.1	Confident	54 Å²	54	64.1 Å²	64.1	20%	0.204	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	135	159.7	-167.7	174.2	75.1	-101.7	-16.7	109.3	M948 E949 L951 D967 V973 T974	M948-R965 CarbonylContact C-O 3.51Å; M948-R965 VanDerWaalsContact CA-O 3.28Å; M948-R965 WeakPolarHBondContact CA-O 3.34Å; E949-R965 PolarHBondContact N-O 3.21Å; E949-R965 PolarHBondContact O-N 3.01Å; E949-R965 IonicContact OE1-CZ 2.63Å; E949-R965 IonicContact OE1-NH1 2.94Å; E949-R965 PolarHBondContact OE1-NH1 3.05Å; E949-R965 IonicContact OE1-NH2 2.71Å; E949-R965 PolarHBondContact OE1-NH2 3.38Å; E949-R965 VanDerWaalsContact OE1-NH2 3.15Å; E949-R965 IonicContact OE2-CZ 2.65Å; E949-R965 IonicContact OE2-NH1 3.63Å; E949-R965 IonicContact OE2-NH2 2.84Å; E949-R965 PolarHBondContact OE2-NH2 3.31Å; L951-R965 HydrophobicContact CD1-CB 4.15Å; L951-R965 HydrophobicContact CD2-CB 4.16Å; L951-R965 HydrophobicContact CG-CB 4.27Å; R965-D967 IonicContact CZ-OD2 3.73Å; R965-D967 IonicContact NE-OD1 3.14Å; R965-D967 PolarHBondContact NE-OD1 3.45Å; R965-D967 VanDerWaalsContact NE-OD1 3.1Å; R965-D967 IonicContact NE-OD2 2.76Å; R965-D967 PolarHBondContact NE-OD2 3.25Å; R965-D967 IonicContact NH2-OD2 3.69Å; R965-D967 PolarHBondContact NH2-OD2 2.86Å; R965-V973 CarbonylContact C-O 3.57Å; R965-V973 WeakPolarHBondContact CA-O 3.45Å; R965-T974 HydrophobicContact CB-CG2 3.96Å; R965-T974 HydrophobicContact CG-CG2 3.83Å
966	L	94.5	Very high	83.2	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	113.5	174.6	169.4	63.3	0	0	0	108.8	V946 V947 M948 T968 S972 V973 F975 L991 L997 V1005	V946-L966 HydrophobicContact CG1-CD1 3.84Å; V947-L966 WeakPolarHBondContact O-CA 3.35Å; M948-L966 HydrophobicContact CB-CD1 4.41Å; M948-L966 HydrophobicContact SD-CB 4.28Å; M948-L966 HydrophobicContact SD-CD1 4.43Å; L966-T968 HydrophobicContact CD1-CG2 4.32Å; L966-T968 HydrophobicContact CG-CG2 4.17Å; L966-S972 WeakPolarHBondContact O-CA 3.22Å; L966-V973 HydrophobicContact CB-CG1 3.93Å; L966-V973 HydrophobicContact CD2-CG1 4.14Å; L966-V973 HydrophobicContact CG-CG1 4.29Å; L966-V973 PolarHBondContact N-O 3.44Å; L966-V973 PolarHBondContact O-N 2.95Å; L966-F975 HydrophobicContact CB-CE1 3.94Å; L966-F975 HydrophobicContact CD2-CE1 4.33Å; L966-L991 HydrophobicContact CD2-CD1 3.89Å; L966-L997 HydrophobicContact CD2-CD1 4.41Å; L966-L997 HydrophobicContact CD2-CD2 4.15Å; L966-L997 HydrophobicContact CD2-CG 4.39Å; L966-V1005 HydrophobicContact CD1-CG2 3.9Å; L966-V1005 HydrophobicContact CD2-CG1 4.03Å; L966-V1005 HydrophobicContact CD2-CG2 3.98Å
967	D	91	Very high	84.9	Confident	43 Å²	43	59.6 Å²	59.6	23%	0.23	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	116.7	-179.8	-63.7	-48.6	0	0	0	109.1	V947 R965 S972	V947-D967 HydrophobicContact CB-CB 4.31Å; V947-D967 PolarHBondContact N-O 3.47Å; V947-D967 PolarHBondContact O-N 3.4Å; R965-D967 IonicContact CZ-OD2 3.73Å; R965-D967 IonicContact NE-OD1 3.14Å; R965-D967 PolarHBondContact NE-OD1 3.45Å; R965-D967 VanDerWaalsContact NE-OD1 3.1Å; R965-D967 IonicContact NE-OD2 2.76Å; R965-D967 PolarHBondContact NE-OD2 3.25Å; R965-D967 IonicContact NH2-OD2 3.69Å; R965-D967 PolarHBondContact NH2-OD2 2.86Å; D967-S972 WeakPolarHBondContact OD1-CB 3.39Å; D967-S972 PolarHBondContact OD1-OG 3.35Å
968	T	88.1	Confident	86.4	Confident	21 Å²	21	52.7 Å²	52.7	13%	0.129	28%	0.284	C	S	.	.			trans	-117.6	177.7	177.7	75.6	0	0	0	0	111.6	L966 H970 K971 L997	L966-T968 HydrophobicContact CD1-CG2 4.32Å; L966-T968 HydrophobicContact CG-CG2 4.17Å; T968-H970 PolarHBondContact O-N 2.83Å; T968-H970 VanDerWaalsContact O-N 3.11Å; T968-H970 PolarHBondContact OG1-CE1 3.07Å; T968-H970 PolarHBondContact OG1-N 2.79Å; T968-H970 PolarHBondContact OG1-ND1 2.82Å; T968-K971 PolarHBondContact N-O 3.21Å; T968-K971 PolarHBondContact OG1-N 3.01Å; T968-K971 PolarHBondContact OG1-O 2.94Å; T968-L997 HydrophobicContact CG2-CD2 3.86Å
969	S	77.7	Confident	87.6	Confident	74 Å²	74	46 Å²	46	52%	0.517	25%	0.25	S	C	.	.	S	Bend	trans	-63.9	-10.5	177.3	66.8	0	0	0	0	116
970	H	77.9	Confident	88.4	Confident	89 Å²	89	43 Å²	43	41%	0.412	26%	0.258	S	S	.	.	S	Bend	trans	-142.9	-19.9	-169.2	55.5	-75.3	0	0	0	114.2	T968 H1001	T968-H970 PolarHBondContact O-N 2.83Å; T968-H970 VanDerWaalsContact O-N 3.11Å; T968-H970 PolarHBondContact OG1-CE1 3.07Å; T968-H970 PolarHBondContact OG1-N 2.79Å; T968-H970 PolarHBondContact OG1-ND1 2.82Å; H970-H1001 AromaticContact CE1-CE1 3.71Å; H970-H1001 AromaticContact CE1-ND1 3.73Å
971	K	84.5	Confident	89	Confident	81 Å²	81	45.3 Å²	45.3	35%	0.352	27%	0.268	S	S	.	.			trans	-146.4	145.8	176.4	-142.8	-178.2	-161.4	168.8	0	110.7	T968 E994 D995 C996	T968-K971 PolarHBondContact N-O 3.21Å; T968-K971 PolarHBondContact OG1-N 3.01Å; T968-K971 PolarHBondContact OG1-O 2.94Å; K971-E994 PolarHBondContact NZ-O 3.37Å; K971-D995 VanDerWaalsContact CD-O 3.29Å; K971-D995 WeakPolarHBondContact CD-O 3.48Å; K971-D995 PolarHBondContact NZ-O 2.82Å; K971-C996 HydrophobicContact CD-CB 4.1Å; K971-C996 PolarHBondContact NZ-SG 3.31Å
972	S	89.4	Confident	89.1	Confident	73 Å²	73	46 Å²	46	51%	0.51	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	132	162.6	160.2	0	0	0	0	107.3	L966 D967	L966-S972 WeakPolarHBondContact O-CA 3.22Å; D967-S972 WeakPolarHBondContact OD1-CB 3.39Å; D967-S972 PolarHBondContact OD1-OG 3.35Å
973	V	92	Very high	89.2	Confident	27 Å²	27	52.8 Å²	52.8	16%	0.164	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	136.7	-178.7	64.2	0	0	0	0	110.7	R965 L966 F975 L991 C996	R965-V973 CarbonylContact C-O 3.57Å; R965-V973 WeakPolarHBondContact CA-O 3.45Å; L966-V973 HydrophobicContact CB-CG1 3.93Å; L966-V973 HydrophobicContact CD2-CG1 4.14Å; L966-V973 HydrophobicContact CG-CG1 4.29Å; L966-V973 PolarHBondContact N-O 3.44Å; L966-V973 PolarHBondContact O-N 2.95Å; V973-F975 HydrophobicContact CG1-CD1 4.46Å; V973-L991 HydrophobicContact CG1-CD2 4.11Å; V973-L991 HydrophobicContact CG2-CD2 4.36Å; V973-C996 HydrophobicContact CB-CB 4.48Å; V973-C996 HydrophobicContact CG1-CB 4.23Å
974	T	93.8	Very high	89.2	Confident	94 Å²	94	53.3 Å²	53.3	58%	0.577	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	124.9	170.8	50.9	0	0	0	0	109.3	L951 C964 R965	L951-T974 HydrophobicContact CD1-CG2 3.87Å; C964-T974 CarbonylContact O-C 3.28Å; C964-T974 VanDerWaalsContact O-CA 3.28Å; C964-T974 WeakPolarHBondContact O-CA 3.29Å; R965-T974 HydrophobicContact CB-CG2 3.96Å; R965-T974 HydrophobicContact CG-CG2 3.83Å
975	F	94.1	Very high	89.1	Confident	29 Å²	29	55.9 Å²	55.9	13%	0.127	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	160.5	-178.5	64.9	-85.8	0	0	0	111.3	M948 C964 L966 V973 F977 I987 L991 L1009	M948-F975 HydrophobicContact SD-CE1 4.07Å; M948-F975 HydrophobicContact SD-CZ 3.78Å; C964-F975 HydrophobicContact CB-CE1 4.11Å; C964-F975 HydrophobicContact CB-CE2 4.36Å; C964-F975 HydrophobicContact CB-CZ 3.95Å; C964-F975 PolarHBondContact N-O 2.81Å; C964-F975 PolarHBondContact O-N 2.73Å; L966-F975 HydrophobicContact CB-CE1 3.94Å; L966-F975 HydrophobicContact CD2-CE1 4.33Å; V973-F975 HydrophobicContact CG1-CD1 4.46Å; F975-F977 AromaticContact CD2-CD1 3.97Å; F975-F977 HydrophobicContact CD2-CD1 3.97Å; F975-F977 AromaticContact CE2-CD1 3.59Å; F975-F977 HydrophobicContact CE2-CD1 3.59Å; F975-F977 AromaticContact CE2-CE1 3.95Å; F975-F977 HydrophobicContact CE2-CE1 3.95Å; F975-I987 HydrophobicContact CD2-CG2 4.08Å; F975-I987 HydrophobicContact CE2-CG2 3.68Å; F975-I987 HydrophobicContact CZ-CG2 4.29Å; F975-L991 HydrophobicContact CD1-CD1 4.28Å; F975-L991 HydrophobicContact CD1-CD2 4.38Å; F975-L991 HydrophobicContact CE1-CD1 4.03Å; F975-L991 HydrophobicContact CZ-CD1 4.25Å; F975-L1009 HydrophobicContact CE2-CD2 4.05Å; F975-L1009 HydrophobicContact CZ-CD2 4.09Å
976	Q	93	Very high	88.9	Confident	114 Å²	114	56.2 Å²	56.2	53%	0.533	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	144.8	172.9	-74.7	-177.3	-18.4	0	0	110.2	V962 S963	V962-Q976 VanDerWaalsContact O-CA 3.25Å; V962-Q976 WeakPolarHBondContact O-CA 3.49Å; S963-Q976 WeakPolarHBondContact OG-CG 3.48Å; S963-Q976 PolarHBondContact OG-NE2 3.49Å
977	F	93.5	Very high	88.9	Confident	4 Å²	4	56.7 Å²	56.7	2%	0.018	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	157.2	174.4	69.5	-81.1	0	0	0	110.3	V962 F975 P979 D982 I987 L1009 V1012 I1013	V962-F977 HydrophobicContact CB-CD1 4.26Å; V962-F977 HydrophobicContact CB-CE1 3.9Å; V962-F977 HydrophobicContact CB-CE2 4.4Å; V962-F977 HydrophobicContact CB-CZ 3.98Å; V962-F977 HydrophobicContact CG1-CD1 4.41Å; V962-F977 HydrophobicContact CG1-CE1 3.64Å; V962-F977 HydrophobicContact CG1-CZ 3.79Å; V962-F977 PolarHBondContact N-O 3.35Å; V962-F977 PolarHBondContact O-N 2.82Å; V962-F977 VanDerWaalsContact O-N 3.09Å; F975-F977 AromaticContact CD2-CD1 3.97Å; F975-F977 HydrophobicContact CD2-CD1 3.97Å; F975-F977 AromaticContact CE2-CD1 3.59Å; F975-F977 HydrophobicContact CE2-CD1 3.59Å; F975-F977 AromaticContact CE2-CE1 3.95Å; F975-F977 HydrophobicContact CE2-CE1 3.95Å; F977-P979 HydrophobicContact CE2-CB 4.17Å; F977-D982 HydrophobicContact CB-CB 4.02Å; F977-D982 HydrophobicContact CD2-CB 4.44Å; F977-I987 HydrophobicContact CB-CD1 3.76Å; F977-I987 HydrophobicContact CB-CG1 4.35Å; F977-I987 HydrophobicContact CD1-CD1 4.32Å; F977-I987 HydrophobicContact CD2-CD1 3.63Å; F977-I987 HydrophobicContact CE2-CD1 4.26Å; F977-I987 HydrophobicContact CG-CD1 3.65Å; F977-L1009 HydrophobicContact CD1-CD2 4.36Å; F977-L1009 HydrophobicContact CE1-CD2 3.78Å; F977-L1009 HydrophobicContact CE2-CD2 4.3Å; F977-L1009 HydrophobicContact CZ-CD2 3.74Å; F977-V1012 HydrophobicContact CE1-CG1 4.42Å; F977-V1012 HydrophobicContact CZ-CG1 3.82Å; F977-I1013 HydrophobicContact CE2-CD1 4.26Å; F977-I1013 HydrophobicContact CE2-CG1 3.77Å; F977-I1013 HydrophobicContact CZ-CG1 4.39Å
978	A	89.6	Confident	89	Confident	6 Å²	6	54.7 Å²	54.7	5%	0.05	32%	0.321	C	S	.	.			trans	-102	112.5	174.5	0	0	0	0	0	109.5	F959 L961 G980 T981 D982	F959-A978 HydrophobicContact CB-CB 4.32Å; L961-A978 HydrophobicContact CD2-CB 4.31Å; A978-G980 PolarHBondContact O-N 3.48Å; A978-T981 WeakPolarHBondContact CB-OG1 3.43Å; A978-T981 PolarHBondContact O-N 2.93Å; A978-T981 PolarHBondContact O-OG1 3.29Å; A978-D982 PolarHBondContact N-OD2 3.09Å; A978-D982 PolarHBondContact O-N 3.42Å
979	P	86.1	Confident	89.1	Confident	20 Å²	20	57.6 Å²	57.6	13%	0.13	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-12.4	-172.1	27	-35.7	0	0	0	114.1	A960 V962 F977 I1013	A960-P979 WeakPolarHBondContact O-CD 3.5Å; V962-P979 HydrophobicContact CG2-CG 3.82Å; F977-P979 HydrophobicContact CE2-CB 4.17Å; P979-I1013 HydrophobicContact CB-CB 4.5Å; P979-I1013 HydrophobicContact CB-CG1 3.99Å; P979-I1013 HydrophobicContact CB-CG2 4.25Å
980	G	80.2	Confident	89.7	Confident	77 Å²	77	59.9 Å²	59.9	79%	0.794	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-10.5	172	0	0	0	0	0	115.3	A978	A978-G980 PolarHBondContact O-N 3.48Å
981	T	84.4	Confident	90.5	Very high	89 Å²	89	56.1 Å²	56.1	55%	0.546	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.4	-35.7	-176	56.1	0	0	0	0	114.2	A978	A978-T981 WeakPolarHBondContact CB-OG1 3.43Å; A978-T981 PolarHBondContact O-N 2.93Å; A978-T981 PolarHBondContact O-OG1 3.29Å
982	D	89.7	Confident	90.8	Very high	47 Å²	47	54.7 Å²	54.7	25%	0.251	32%	0.319	S	S	.	.			trans	-88.7	119	-178.2	-68.5	-61.1	0	0	0	111.6	F977 A978 I987	F977-D982 HydrophobicContact CB-CB 4.02Å; F977-D982 HydrophobicContact CD2-CB 4.44Å; A978-D982 PolarHBondContact N-OD2 3.09Å; A978-D982 PolarHBondContact O-N 3.42Å; D982-I987 HydrophobicContact CB-CD1 3.88Å; D982-I987 HydrophobicContact CB-CG1 4Å
983	K	91.3	Very high	90.9	Very high	143 Å²	143	55 Å²	55	62%	0.622	33%	0.326	S	S	*	.			trans	-80.4	143.6	176.6	-62.7	-178.5	-179.9	-180	0	111.2	C985 T986 I987	K983-C985 VanDerWaalsContact C-N 3.31Å; K983-C985 PolarHBondContact O-N 2.92Å; K983-T986 WeakPolarHBondContact O-CB 3.41Å; K983-T986 PolarHBondContact O-N 3.4Å; K983-I987 PolarHBondContact O-N 3.26Å; K983-I987 VanDerWaalsContact O-N 3.12Å
984	P	92.8	Very high	90.7	Very high	34 Å²	34	60.2 Å²	60.2	22%	0.221	35%	0.349	C	S	.	.	H	α-helix	trans	-48.5	-46	177.1	-33	37.5	0	0	0	114.8	T986 I987 A988 E1006 L1009 I1013	P984-T986 PolarHBondContact O-N 3.45Å; P984-I987 PolarHBondContact O-N 3.44Å; P984-A988 WeakPolarHBondContact O-CB 3.46Å; P984-A988 PolarHBondContact O-N 3.17Å; P984-E1006 HydrophobicContact CB-CB 4.48Å; P984-L1009 HydrophobicContact CB-CB 3.83Å; P984-L1009 HydrophobicContact CB-CD1 4.44Å; P984-L1009 HydrophobicContact CG-CB 4.14Å; P984-I1013 HydrophobicContact CG-CD1 3.73Å
985	C	92.1	Very high	90.4	Very high	54 Å²	54	62 Å²	62	37%	0.365	35%	0.354	S	S	.	.	H	α-helix	trans	-64.7	-36.6	179	60	0	0	0	0	113.1	K983 T989 E1006	K983-C985 VanDerWaalsContact C-N 3.31Å; K983-C985 PolarHBondContact O-N 2.92Å; C985-T989 WeakPolarHBondContact O-CB 3.47Å; C985-T989 PolarHBondContact O-N 2.87Å; C985-T989 PolarHBondContact O-OG1 2.92Å; C985-E1006 WeakPolarHBondContact CA-OE1 3.38Å; C985-E1006 WeakPolarHBondContact CB-OE1 3.33Å
986	T	92.1	Very high	90	Very high	61 Å²	61	60.9 Å²	60.9	37%	0.374	35%	0.35	S	S	.	.	H	α-helix	trans	-65.6	-41.9	175.9	-52	0	0	0	0	111	K983 P984 K990	K983-T986 WeakPolarHBondContact O-CB 3.41Å; K983-T986 PolarHBondContact O-N 3.4Å; P984-T986 PolarHBondContact O-N 3.45Å; T986-K990 WeakPolarHBondContact O-CG 3.25Å; T986-K990 PolarHBondContact O-N 2.85Å
987	I	93.1	Very high	89.9	Confident	11 Å²	11	55.7 Å²	55.7	6%	0.056	33%	0.326	C	S	.	.	H	α-helix	trans	-66.8	-49.7	177.2	-58.3	163.2	0	0	0	110	F975 F977 D982 K983 P984 T989 K990 L991 L1009	F975-I987 HydrophobicContact CD2-CG2 4.08Å; F975-I987 HydrophobicContact CE2-CG2 3.68Å; F975-I987 HydrophobicContact CZ-CG2 4.29Å; F977-I987 HydrophobicContact CB-CD1 3.76Å; F977-I987 HydrophobicContact CB-CG1 4.35Å; F977-I987 HydrophobicContact CD1-CD1 4.32Å; F977-I987 HydrophobicContact CD2-CD1 3.63Å; F977-I987 HydrophobicContact CE2-CD1 4.26Å; F977-I987 HydrophobicContact CG-CD1 3.65Å; D982-I987 HydrophobicContact CB-CD1 3.88Å; D982-I987 HydrophobicContact CB-CG1 4Å; K983-I987 PolarHBondContact O-N 3.26Å; K983-I987 VanDerWaalsContact O-N 3.12Å; P984-I987 PolarHBondContact O-N 3.44Å; I987-T989 VanDerWaalsContact C-N 3.3Å; I987-T989 PolarHBondContact O-N 3.34Å; I987-K990 PolarHBondContact O-N 3.09Å; I987-L991 HydrophobicContact CG2-CD1 3.95Å; I987-L991 HydrophobicContact CG2-CG 4.44Å; I987-L991 WeakPolarHBondContact O-CG 3.44Å; I987-L991 PolarHBondContact O-N 2.88Å; I987-L1009 HydrophobicContact CB-CD1 3.72Å; I987-L1009 HydrophobicContact CD1-CD1 4.09Å; I987-L1009 HydrophobicContact CD1-CD2 3.98Å; I987-L1009 HydrophobicContact CG2-CD1 3.67Å; I987-L1009 HydrophobicContact CG2-CD2 4.45Å
988	A	93.5	Very high	89.6	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-62.2	-35.9	179	0	0	0	0	0	112.5	P984 L991 L992 V1002 V1005 E1006	P984-A988 WeakPolarHBondContact O-CB 3.46Å; P984-A988 PolarHBondContact O-N 3.17Å; A988-L991 PolarHBondContact O-N 2.95Å; A988-L992 WeakPolarHBondContact O-CB 3.32Å; A988-L992 PolarHBondContact O-N 3.46Å; A988-V1002 HydrophobicContact CB-CG1 4.13Å; A988-V1005 HydrophobicContact CB-CG1 4.48Å; A988-E1006 HydrophobicContact CB-CG 3.63Å
989	T	90.4	Very high	89.5	Confident	82 Å²	82	67.3 Å²	67.3	50%	0.503	38%	0.379	S	S	.	.	H	α-helix	trans	-69.2	-41	174.9	-57.8	0	0	0	0	112.1	C985 I987 L992 A993	C985-T989 WeakPolarHBondContact O-CB 3.47Å; C985-T989 PolarHBondContact O-N 2.87Å; C985-T989 PolarHBondContact O-OG1 2.92Å; I987-T989 VanDerWaalsContact C-N 3.3Å; I987-T989 PolarHBondContact O-N 3.34Å; T989-L992 PolarHBondContact O-N 3.05Å; T989-A993 WeakPolarHBondContact O-CB 3.47Å; T989-A993 PolarHBondContact O-N 2.84Å
990	K	90.8	Very high	89.4	Confident	123 Å²	123	70.5 Å²	70.5	54%	0.535	40%	0.397	S	S	.	.	H	α-helix	trans	-62.1	-44.7	172.1	-77.2	178.1	176.9	178.8	0	111.6	T986 I987 L992 A993 E994	T986-K990 WeakPolarHBondContact O-CG 3.25Å; T986-K990 PolarHBondContact O-N 2.85Å; I987-K990 PolarHBondContact O-N 3.09Å; K990-L992 VanDerWaalsContact C-N 3.28Å; K990-L992 PolarHBondContact O-N 3.37Å; K990-A993 PolarHBondContact O-N 3.26Å; K990-A993 VanDerWaalsContact O-N 3.08Å; K990-E994 PolarHBondContact O-N 2.83Å
991	L	93.2	Very high	89.8	Confident	10 Å²	10	66.9 Å²	66.9	5%	0.052	36%	0.36	C	S	.	.	H	α-helix	trans	-64.5	-31.1	176.5	-70	171.9	0	0	0	112.5	L966 V973 F975 I987 A988 C996 L997 V1005	L966-L991 HydrophobicContact CD2-CD1 3.89Å; V973-L991 HydrophobicContact CG1-CD2 4.11Å; V973-L991 HydrophobicContact CG2-CD2 4.36Å; F975-L991 HydrophobicContact CD1-CD1 4.28Å; F975-L991 HydrophobicContact CD1-CD2 4.38Å; F975-L991 HydrophobicContact CE1-CD1 4.03Å; F975-L991 HydrophobicContact CZ-CD1 4.25Å; I987-L991 HydrophobicContact CG2-CD1 3.95Å; I987-L991 HydrophobicContact CG2-CG 4.44Å; I987-L991 WeakPolarHBondContact O-CG 3.44Å; I987-L991 PolarHBondContact O-N 2.88Å; A988-L991 PolarHBondContact O-N 2.95Å; L991-C996 HydrophobicContact CB-CB 4.23Å; L991-C996 HydrophobicContact CD2-CB 3.92Å; L991-C996 CarbonylContact O-C 3.52Å; L991-C996 VanDerWaalsContact O-CA 3.23Å; L991-C996 WeakPolarHBondContact O-CA 3.5Å; L991-C996 WeakPolarHBondContact O-CB 3.3Å; L991-C996 PolarHBondContact O-N 3.06Å; L991-L997 HydrophobicContact CB-CD1 3.67Å; L991-L997 HydrophobicContact CB-CG 4.16Å; L991-L997 HydrophobicContact CD1-CD1 4.26Å; L991-L997 PolarHBondContact O-N 3.08Å; L991-L997 VanDerWaalsContact O-N 3.1Å; L991-V1005 HydrophobicContact CD1-CG1 4.36Å
992	L	92.6	Very high	90.1	Very high	50 Å²	50	63.6 Å²	63.6	26%	0.262	34%	0.34	S	S	.	.	H	α-helix	trans	-68.9	-41.1	169.3	178.9	65.3	0	0	0	111.8	A988 T989 K990 D995 L997 K999 V1002	A988-L992 WeakPolarHBondContact O-CB 3.32Å; A988-L992 PolarHBondContact O-N 3.46Å; T989-L992 PolarHBondContact O-N 3.05Å; K990-L992 VanDerWaalsContact C-N 3.28Å; K990-L992 PolarHBondContact O-N 3.37Å; L992-D995 PolarHBondContact O-N 2.99Å; L992-L997 WeakPolarHBondContact CD1-O 3.43Å; L992-K999 HydrophobicContact CD1-CG 4Å; L992-K999 HydrophobicContact CD2-CG 4.2Å; L992-V1002 HydrophobicContact CB-CG2 4.48Å; L992-V1002 HydrophobicContact CD2-CG2 4.06Å
993	A	89.6	Confident	90	Very high	81 Å²	81	68.2 Å²	68.2	67%	0.669	36%	0.36	S	S	*	.	H	α-helix	trans	-70.7	-26.4	-178.6	0	0	0	0	0	114.2	T989 K990 D995	T989-A993 WeakPolarHBondContact O-CB 3.47Å; T989-A993 PolarHBondContact O-N 2.84Å; K990-A993 PolarHBondContact O-N 3.26Å; K990-A993 VanDerWaalsContact O-N 3.08Å; A993-D995 VanDerWaalsContact C-N 3.33Å
994	E	89.2	Confident	89.9	Confident	136 Å²	136	61.9 Å²	61.9	64%	0.636	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	22.1	174.9	-66.1	-174.6	-167.1	0	0	113.5	K971 K990 C996	K971-E994 PolarHBondContact NZ-O 3.37Å; K990-E994 PolarHBondContact O-N 2.83Å; E994-C996 PolarHBondContact O-N 3.48Å; E994-C996 PolarHBondContact O-SG 3.21Å; E994-C996 VanDerWaalsContact O-SG 3.38Å
995	D	87.8	Confident	89.9	Confident	130 Å²	130	60.2 Å²	60.2	70%	0.695	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	33.8	-175	-77.5	-42.8	0	0	0	113	K971 L992 A993	K971-D995 VanDerWaalsContact CD-O 3.29Å; K971-D995 WeakPolarHBondContact CD-O 3.48Å; K971-D995 PolarHBondContact NZ-O 2.82Å; L992-D995 PolarHBondContact O-N 2.99Å; A993-D995 VanDerWaalsContact C-N 3.33Å
996	C	85.8	Confident	90	Very high	6 Å²	6	59.9 Å²	59.9	4%	0.041	32%	0.315	C	S	.	.	S	Bend	trans	-94	-12.4	176.6	-64.9	0	0	0	0	113.2	K971 V973 L991 E994	K971-C996 HydrophobicContact CD-CB 4.1Å; K971-C996 PolarHBondContact NZ-SG 3.31Å; V973-C996 HydrophobicContact CB-CB 4.48Å; V973-C996 HydrophobicContact CG1-CB 4.23Å; L991-C996 HydrophobicContact CB-CB 4.23Å; L991-C996 HydrophobicContact CD2-CB 3.92Å; L991-C996 CarbonylContact O-C 3.52Å; L991-C996 VanDerWaalsContact O-CA 3.23Å; L991-C996 WeakPolarHBondContact O-CA 3.5Å; L991-C996 WeakPolarHBondContact O-CB 3.3Å; L991-C996 PolarHBondContact O-N 3.06Å; E994-C996 PolarHBondContact O-N 3.48Å; E994-C996 PolarHBondContact O-SG 3.21Å; E994-C996 VanDerWaalsContact O-SG 3.38Å
997	L	89.3	Confident	89.9	Confident	5 Å²	5	59 Å²	59	3%	0.026	31%	0.314	C	S	.	.	S	Bend	trans	-138.4	153.6	173.9	-75.2	167.9	0	0	0	111.1	L966 T968 L991 L992 H1001 V1005	L966-L997 HydrophobicContact CD2-CD1 4.41Å; L966-L997 HydrophobicContact CD2-CD2 4.15Å; L966-L997 HydrophobicContact CD2-CG 4.39Å; T968-L997 HydrophobicContact CG2-CD2 3.86Å; L991-L997 HydrophobicContact CB-CD1 3.67Å; L991-L997 HydrophobicContact CB-CG 4.16Å; L991-L997 HydrophobicContact CD1-CD1 4.26Å; L991-L997 PolarHBondContact O-N 3.08Å; L991-L997 VanDerWaalsContact O-N 3.1Å; L992-L997 WeakPolarHBondContact CD1-O 3.43Å; L997-H1001 HydrophobicContact CD2-CB 3.61Å; L997-V1005 HydrophobicContact CD1-CB 4Å; L997-V1005 HydrophobicContact CD1-CG1 4.07Å; L997-V1005 HydrophobicContact CD1-CG2 3.84Å; L997-V1005 HydrophobicContact CD2-CG2 3.69Å; L997-V1005 HydrophobicContact CG-CG2 4.43Å
998	L	88.5	Confident	89.9	Confident	77 Å²	77	58.5 Å²	58.5	40%	0.403	31%	0.311	S	S	.	.			trans	-87.5	151.5	161.8	-67.8	167.8	0	0	0	109.1	V1000 H1001	L998-V1000 HydrophobicContact CB-CG1 4.08Å; L998-V1000 PolarHBondContact O-N 2.82Å; L998-H1001 PolarHBondContact O-N 2.64Å
999	K	86.8	Confident	89.9	Confident	178 Å²	178	58.5 Å²	58.5	77%	0.774	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-47.1	-38.9	176.4	-73.1	-174.7	176.3	179.7	0	113.3	L992 H1001 V1002	L992-K999 HydrophobicContact CD1-CG 4Å; L992-K999 HydrophobicContact CD2-CG 4.2Å; K999-H1001 PolarHBondContact O-N 2.97Å; K999-V1002 WeakPolarHBondContact O-CG2 3.27Å; K999-V1002 PolarHBondContact O-N 3.41Å
1000	V	85.2	Confident	90	Very high	86 Å²	86	56 Å²	56	52%	0.521	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-68.1	-11.4	179.6	70.6	0	0	0	0	114.8	L998	L998-V1000 HydrophobicContact CB-CG1 4.08Å; L998-V1000 PolarHBondContact O-N 2.82Å
1001	H	88.3	Confident	89.9	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-100.2	-8.9	178	-59.4	163.6	0	0	0	113.7	H970 L997 L998 K999 H1003 I1004 V1005	H970-H1001 AromaticContact CE1-CE1 3.71Å; H970-H1001 AromaticContact CE1-ND1 3.73Å; L997-H1001 HydrophobicContact CD2-CB 3.61Å; L998-H1001 PolarHBondContact O-N 2.64Å; K999-H1001 PolarHBondContact O-N 2.97Å; H1001-H1003 PolarHBondContact O-N 3.46Å; H1001-I1004 PolarHBondContact O-N 2.87Å; H1001-V1005 PolarHBondContact O-N 3.1Å; H1001-V1005 VanDerWaalsContact O-N 3.1Å
1002	V	89.9	Confident	89.7	Confident	20 Å²	20	53.2 Å²	53.2	12%	0.121	29%	0.29	C	S	.	.	H	α-helix	trans	-55.9	-58.4	-171.3	173.8	0	0	0	0	111.5	A988 L992 K999 I1004 V1005 E1006	A988-V1002 HydrophobicContact CB-CG1 4.13Å; L992-V1002 HydrophobicContact CB-CG2 4.48Å; L992-V1002 HydrophobicContact CD2-CG2 4.06Å; K999-V1002 WeakPolarHBondContact O-CG2 3.27Å; K999-V1002 PolarHBondContact O-N 3.41Å; V1002-I1004 PolarHBondContact O-N 2.9Å; V1002-V1005 PolarHBondContact O-N 3.18Å; V1002-E1006 HydrophobicContact CG1-CG 4.29Å; V1002-E1006 WeakPolarHBondContact O-CG 3.41Å; V1002-E1006 PolarHBondContact O-N 2.91Å
1003	H	87.7	Confident	89.6	Confident	145 Å²	145	52 Å²	52	67%	0.671	28%	0.284	S	S	*	.	H	α-helix	trans	-62.1	-27.4	-178.1	-60.9	-40.3	0	0	0	114.3	H1001 E1006 A1007	H1001-H1003 PolarHBondContact O-N 3.46Å; H1003-E1006 WeakPolarHBondContact CA-OE2 3.38Å; H1003-E1006 IonicContact CE1-OE2 2.61Å; H1003-E1006 IonicContact CG-OE2 2.64Å; H1003-E1006 IonicContact ND1-OE2 3.72Å; H1003-E1006 PolarHBondContact ND1-OE2 2.71Å; H1003-A1007 WeakPolarHBondContact O-CB 3.47Å; H1003-A1007 PolarHBondContact O-N 3.01Å
1004	I	90.1	Very high	89.4	Confident	9 Å²	9	54.4 Å²	54.4	5%	0.046	28%	0.281	C	S	.	.	H	α-helix	trans	-71	-42	175	-68.6	170.4	0	0	0	110.4	V946 H1001 V1002 A1007 Q1008 T1030 L1032 P1040	V946-I1004 HydrophobicContact CB-CG2 4.07Å; V946-I1004 HydrophobicContact CG1-CG2 4.11Å; V946-I1004 HydrophobicContact CG2-CG2 4.49Å; H1001-I1004 PolarHBondContact O-N 2.87Å; V1002-I1004 PolarHBondContact O-N 2.9Å; I1004-A1007 PolarHBondContact O-N 2.92Å; I1004-Q1008 WeakPolarHBondContact O-CB 3.29Å; I1004-Q1008 VanDerWaalsContact O-CG 3.32Å; I1004-Q1008 WeakPolarHBondContact O-CG 3.46Å; I1004-Q1008 PolarHBondContact O-N 2.99Å; I1004-T1030 HydrophobicContact CD1-CG2 4.08Å; I1004-T1030 HydrophobicContact CG1-CG2 4.27Å; I1004-T1030 HydrophobicContact CG2-CG2 3.9Å; I1004-L1032 HydrophobicContact CD1-CD1 3.8Å; I1004-L1032 HydrophobicContact CD1-CD2 3.58Å; I1004-L1032 HydrophobicContact CD1-CG 3.6Å; I1004-P1040 HydrophobicContact CG1-CB 4.3Å; I1004-P1040 HydrophobicContact CG1-CG 4.19Å
1005	V	92.6	Very high	89.1	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-73.2	-34.4	177.7	176.4	0	0	0	0	111.4	V946 M948 L966 A988 L991 L997 H1001 V1002 L1009	V946-V1005 HydrophobicContact CG1-CG2 4.22Å; M948-V1005 HydrophobicContact CE-CG1 4.27Å; L966-V1005 HydrophobicContact CD1-CG2 3.9Å; L966-V1005 HydrophobicContact CD2-CG1 4.03Å; L966-V1005 HydrophobicContact CD2-CG2 3.98Å; A988-V1005 HydrophobicContact CB-CG1 4.48Å; L991-V1005 HydrophobicContact CD1-CG1 4.36Å; L997-V1005 HydrophobicContact CD1-CB 4Å; L997-V1005 HydrophobicContact CD1-CG1 4.07Å; L997-V1005 HydrophobicContact CD1-CG2 3.84Å; L997-V1005 HydrophobicContact CD2-CG2 3.69Å; L997-V1005 HydrophobicContact CG-CG2 4.43Å; H1001-V1005 PolarHBondContact O-N 3.1Å; H1001-V1005 VanDerWaalsContact O-N 3.1Å; V1002-V1005 PolarHBondContact O-N 3.18Å; V1005-L1009 HydrophobicContact CG1-CD1 3.92Å; V1005-L1009 HydrophobicContact CG1-CG 4.39Å; V1005-L1009 VanDerWaalsContact O-CB 3.26Å; V1005-L1009 WeakPolarHBondContact O-CB 3.35Å; V1005-L1009 VanDerWaalsContact O-CG 3.31Å; V1005-L1009 WeakPolarHBondContact O-CG 3.33Å; V1005-L1009 PolarHBondContact O-N 3.22Å
1006	E	93.4	Very high	88.9	Confident	46 Å²	46	44.4 Å²	44.4	22%	0.215	23%	0.232	C	C	.	.	H	α-helix	trans	-59	-47.3	170.3	-70	178.3	131.2	0	0	111.8	P984 C985 A988 V1002 H1003 L1009 G1010	P984-E1006 HydrophobicContact CB-CB 4.48Å; C985-E1006 WeakPolarHBondContact CA-OE1 3.38Å; C985-E1006 WeakPolarHBondContact CB-OE1 3.33Å; A988-E1006 HydrophobicContact CB-CG 3.63Å; V1002-E1006 HydrophobicContact CG1-CG 4.29Å; V1002-E1006 WeakPolarHBondContact O-CG 3.41Å; V1002-E1006 PolarHBondContact O-N 2.91Å; H1003-E1006 WeakPolarHBondContact CA-OE2 3.38Å; H1003-E1006 IonicContact CE1-OE2 2.61Å; H1003-E1006 IonicContact CG-OE2 2.64Å; H1003-E1006 IonicContact ND1-OE2 3.72Å; H1003-E1006 PolarHBondContact ND1-OE2 2.71Å; E1006-L1009 PolarHBondContact O-N 3.03Å; E1006-G1010 PolarHBondContact O-N 3.15Å
1007	A	90.9	Very high	88.7	Confident	44 Å²	44	49.4 Å²	49.4	36%	0.364	26%	0.258	S	S	.	.	H	α-helix	trans	-66.7	-44.4	178.6	0	0	0	0	0	112.3	H1003 I1004 L1009 G1010 E1011 I1042	H1003-A1007 WeakPolarHBondContact O-CB 3.47Å; H1003-A1007 PolarHBondContact O-N 3.01Å; I1004-A1007 PolarHBondContact O-N 2.92Å; A1007-L1009 VanDerWaalsContact C-N 3.3Å; A1007-L1009 PolarHBondContact O-N 2.79Å; A1007-G1010 PolarHBondContact O-N 2.82Å; A1007-E1011 PolarHBondContact O-N 2.95Å; A1007-E1011 VanDerWaalsContact O-N 3.09Å; A1007-I1042 HydrophobicContact CB-CD1 3.91Å
1008	Q	92.6	Very high	88	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.9	-31.4	174.8	-70.9	-180	2.5	0	0	112.5	V946 M948 I1004 E1011 V1012 L1028 T1030 I1042	V946-Q1008 PolarHBondContact O-NE2 3.5Å; M948-Q1008 HydrophobicContact CE-CB 3.37Å; I1004-Q1008 WeakPolarHBondContact O-CB 3.29Å; I1004-Q1008 VanDerWaalsContact O-CG 3.32Å; I1004-Q1008 WeakPolarHBondContact O-CG 3.46Å; I1004-Q1008 PolarHBondContact O-N 2.99Å; Q1008-E1011 WeakPolarHBondContact O-CB 3.35Å; Q1008-V1012 WeakPolarHBondContact O-CG2 3.46Å; Q1008-V1012 PolarHBondContact O-N 2.86Å; Q1008-V1012 VanDerWaalsContact O-N 3.09Å; Q1008-L1028 HydrophobicContact CB-CD1 4.02Å; Q1008-L1028 HydrophobicContact CG-CB 4.27Å; Q1008-L1028 HydrophobicContact CG-CD1 4.39Å; Q1008-L1028 VanDerWaalsContact O-CD1 3.31Å; Q1008-L1028 WeakPolarHBondContact O-CD1 3.35Å; Q1008-T1030 PolarHBondContact NE2-OG1 2.87Å; Q1008-I1042 HydrophobicContact CG-CD1 4.05Å; Q1008-I1042 HydrophobicContact CG-CG1 4.4Å; Q1008-I1042 HydrophobicContact CG-CG2 4.44Å
1009	L	94	Very high	87	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-69.6	-36.9	171.8	-83.8	164.6	0	0	0	112.3	M948 F975 F977 P984 I987 V1005 E1006 A1007 V1012 I1013	M948-L1009 HydrophobicContact CE-CD2 4.42Å; M948-L1009 HydrophobicContact CE-CG 3.98Å; F975-L1009 HydrophobicContact CE2-CD2 4.05Å; F975-L1009 HydrophobicContact CZ-CD2 4.09Å; F977-L1009 HydrophobicContact CD1-CD2 4.36Å; F977-L1009 HydrophobicContact CE1-CD2 3.78Å; F977-L1009 HydrophobicContact CE2-CD2 4.3Å; F977-L1009 HydrophobicContact CZ-CD2 3.74Å; P984-L1009 HydrophobicContact CB-CB 3.83Å; P984-L1009 HydrophobicContact CB-CD1 4.44Å; P984-L1009 HydrophobicContact CG-CB 4.14Å; I987-L1009 HydrophobicContact CB-CD1 3.72Å; I987-L1009 HydrophobicContact CD1-CD1 4.09Å; I987-L1009 HydrophobicContact CD1-CD2 3.98Å; I987-L1009 HydrophobicContact CG2-CD1 3.67Å; I987-L1009 HydrophobicContact CG2-CD2 4.45Å; V1005-L1009 HydrophobicContact CG1-CD1 3.92Å; V1005-L1009 HydrophobicContact CG1-CG 4.39Å; V1005-L1009 VanDerWaalsContact O-CB 3.26Å; V1005-L1009 WeakPolarHBondContact O-CB 3.35Å; V1005-L1009 VanDerWaalsContact O-CG 3.31Å; V1005-L1009 WeakPolarHBondContact O-CG 3.33Å; V1005-L1009 PolarHBondContact O-N 3.22Å; E1006-L1009 PolarHBondContact O-N 3.03Å; A1007-L1009 VanDerWaalsContact C-N 3.3Å; A1007-L1009 PolarHBondContact O-N 2.79Å; L1009-V1012 PolarHBondContact O-N 3.31Å; L1009-I1013 VanDerWaalsContact O-CG1 3.31Å; L1009-I1013 WeakPolarHBondContact O-CG1 3.23Å; L1009-I1013 PolarHBondContact O-N 3.13Å
1010	G	91.9	Very high	85.8	Confident	28 Å²	28	45.6 Å²	45.6	29%	0.289	26%	0.259	S	S	.	.	H	α-helix	trans	-57.2	-49.4	171.8	0	0	0	0	0	111.9	E1006 A1007 V1012 I1013 Q1014	E1006-G1010 PolarHBondContact O-N 3.15Å; A1007-G1010 PolarHBondContact O-N 2.82Å; G1010-V1012 PolarHBondContact O-N 2.94Å; G1010-I1013 PolarHBondContact O-N 3.33Å; G1010-Q1014 WeakPolarHBondContact O-CB 3.26Å; G1010-Q1014 PolarHBondContact O-N 3.38Å
1011	E	89.1	Confident	84.7	Confident	75 Å²	75	48.3 Å²	48.3	35%	0.35	26%	0.264	S	S	.	.	H	α-helix	trans	-53.5	-51.2	171.8	-82.8	-91.4	135.1	0	0	112	A1007 Q1008 I1013 Q1014 L1015 L1028 I1042	A1007-E1011 PolarHBondContact O-N 2.95Å; A1007-E1011 VanDerWaalsContact O-N 3.09Å; Q1008-E1011 WeakPolarHBondContact O-CB 3.35Å; E1011-I1013 PolarHBondContact O-N 3.1Å; E1011-Q1014 PolarHBondContact O-N 3.38Å; E1011-L1015 WeakPolarHBondContact O-CB 3.36Å; E1011-L1015 PolarHBondContact O-N 2.92Å; E1011-L1028 HydrophobicContact CB-CD1 3.67Å; E1011-L1028 HydrophobicContact CB-CD2 4.41Å; E1011-I1042 HydrophobicContact CG-CD1 4.11Å
1012	V	89.5	Confident	83.4	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.006	29%	0.292	C	S	.	.	H	α-helix	trans	-60.3	-44	179.9	174.1	0	0	0	0	112.1	I950 V962 F977 Q1008 L1009 G1010 L1015 I1016 L1028	I950-V1012 HydrophobicContact CD1-CB 4.39Å; I950-V1012 HydrophobicContact CD1-CG1 3.9Å; I950-V1012 HydrophobicContact CD1-CG2 4.05Å; I950-V1012 HydrophobicContact CG1-CG1 4.05Å; I950-V1012 HydrophobicContact CG1-CG2 4.01Å; V962-V1012 HydrophobicContact CG1-CG1 3.93Å; F977-V1012 HydrophobicContact CE1-CG1 4.42Å; F977-V1012 HydrophobicContact CZ-CG1 3.82Å; Q1008-V1012 WeakPolarHBondContact O-CG2 3.46Å; Q1008-V1012 PolarHBondContact O-N 2.86Å; Q1008-V1012 VanDerWaalsContact O-N 3.09Å; L1009-V1012 PolarHBondContact O-N 3.31Å; G1010-V1012 PolarHBondContact O-N 2.94Å; V1012-L1015 PolarHBondContact O-N 3.49Å; V1012-I1016 HydrophobicContact CG1-CD1 3.86Å; V1012-I1016 WeakPolarHBondContact O-CG1 3.23Å; V1012-I1016 PolarHBondContact O-N 3.01Å; V1012-L1028 HydrophobicContact CG2-CD1 3.79Å
1013	I	88.9	Confident	82.4	Confident	25 Å²	25	54 Å²	54	13%	0.128	29%	0.288	C	S	.	.	H	α-helix	trans	-62	-45.7	177.4	-69.7	169.8	0	0	0	110.2	F977 P979 P984 L1009 G1010 E1011 L1015 I1016 N1017	F977-I1013 HydrophobicContact CE2-CD1 4.26Å; F977-I1013 HydrophobicContact CE2-CG1 3.77Å; F977-I1013 HydrophobicContact CZ-CG1 4.39Å; P979-I1013 HydrophobicContact CB-CB 4.5Å; P979-I1013 HydrophobicContact CB-CG1 3.99Å; P979-I1013 HydrophobicContact CB-CG2 4.25Å; P984-I1013 HydrophobicContact CG-CD1 3.73Å; L1009-I1013 VanDerWaalsContact O-CG1 3.31Å; L1009-I1013 WeakPolarHBondContact O-CG1 3.23Å; L1009-I1013 PolarHBondContact O-N 3.13Å; G1010-I1013 PolarHBondContact O-N 3.33Å; E1011-I1013 PolarHBondContact O-N 3.1Å; I1013-L1015 PolarHBondContact O-N 3.09Å; I1013-I1016 PolarHBondContact O-N 3.1Å; I1013-N1017 WeakPolarHBondContact CG2-ND2 3.23Å; I1013-N1017 VanDerWaalsContact O-CB 3.24Å; I1013-N1017 WeakPolarHBondContact O-CB 3.49Å; I1013-N1017 PolarHBondContact O-N 2.94Å; I1013-N1017 PolarHBondContact O-ND2 3.07Å
1014	Q	85.2	Confident	82	Confident	131 Å²	131	50 Å²	50	61%	0.612	27%	0.273	S	S	*	.	H	α-helix	trans	-64.4	-39.6	179.2	-170.2	168.6	2.9	0	0	111.9	G1010 E1011 S1018	G1010-Q1014 WeakPolarHBondContact O-CB 3.26Å; G1010-Q1014 PolarHBondContact O-N 3.38Å; E1011-Q1014 PolarHBondContact O-N 3.38Å; Q1014-S1018 WeakPolarHBondContact O-CB 3.44Å; Q1014-S1018 PolarHBondContact O-N 2.77Å; Q1014-S1018 VanDerWaalsContact O-N 3.12Å; Q1014-S1018 PolarHBondContact O-OG 2.95Å
1015	L	84.8	Confident	81.5	Confident	41 Å²	41	51.2 Å²	51.2	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-63.9	-45	178.4	-150.3	75.9	0	0	0	112	I950 E1011 V1012 I1013 S1018 D1019 T1026 M1046	I950-L1015 HydrophobicContact CD1-CD2 3.87Å; E1011-L1015 WeakPolarHBondContact O-CB 3.36Å; E1011-L1015 PolarHBondContact O-N 2.92Å; V1012-L1015 PolarHBondContact O-N 3.49Å; I1013-L1015 PolarHBondContact O-N 3.09Å; L1015-S1018 PolarHBondContact O-N 2.99Å; L1015-D1019 PolarHBondContact O-N 3.3Å; L1015-D1019 VanDerWaalsContact O-N 3.08Å; L1015-T1026 HydrophobicContact CD2-CG2 3.88Å; L1015-M1046 HydrophobicContact CD1-CE 3.82Å; L1015-M1046 HydrophobicContact CD2-CE 4.45Å
1016	I	82.2	Confident	81.2	Confident	15 Å²	15	51.3 Å²	51.3	8%	0.077	29%	0.288	C	S	.	.	H	α-helix	trans	-79.8	-32.4	-175.6	-67.4	177.3	0	0	0	112	I950 V962 V1012 I1013 S1018 G1020	I950-I1016 HydrophobicContact CD1-CD1 4.27Å; I950-I1016 HydrophobicContact CG2-CD1 4.12Å; V962-I1016 HydrophobicContact CB-CD1 4.09Å; V962-I1016 HydrophobicContact CG1-CD1 3.4Å; V962-I1016 HydrophobicContact CG2-CD1 3.48Å; V962-I1016 VanDerWaalsContact CG2-CD1 3.48Å; V962-I1016 HydrophobicContact CG2-CG2 4Å; V1012-I1016 HydrophobicContact CG1-CD1 3.86Å; V1012-I1016 WeakPolarHBondContact O-CG1 3.23Å; V1012-I1016 PolarHBondContact O-N 3.01Å; I1013-I1016 PolarHBondContact O-N 3.1Å; I1016-S1018 PolarHBondContact O-N 3.08Å; I1016-G1020 WeakPolarHBondContact O-CA 3.14Å; I1016-G1020 PolarHBondContact O-N 2.95Å
1017	N	81.1	Confident	81	Confident	111 Å²	111	52.8 Å²	52.8	59%	0.594	29%	0.294	S	S	*	.	H	α-helix	trans	-68.8	-18.8	168.9	-69.6	-9.9	0	0	0	112.7	I1013	I1013-N1017 WeakPolarHBondContact CG2-ND2 3.23Å; I1013-N1017 VanDerWaalsContact O-CB 3.24Å; I1013-N1017 WeakPolarHBondContact O-CB 3.49Å; I1013-N1017 PolarHBondContact O-N 2.94Å; I1013-N1017 PolarHBondContact O-ND2 3.07Å
1018	S	75	Confident	81	Confident	95 Å²	95	51 Å²	51	66%	0.664	28%	0.278	S	S	*	.	H	α-helix	trans	-86.4	-47.6	176.6	-60	0	0	0	0	112.6	Q1014 L1015 I1016	Q1014-S1018 WeakPolarHBondContact O-CB 3.44Å; Q1014-S1018 PolarHBondContact O-N 2.77Å; Q1014-S1018 VanDerWaalsContact O-N 3.12Å; Q1014-S1018 PolarHBondContact O-OG 2.95Å; L1015-S1018 PolarHBondContact O-N 2.99Å; I1016-S1018 PolarHBondContact O-N 3.08Å
1019	D	67.6	Low	80.7	Confident	63 Å²	63	51.8 Å²	51.8	34%	0.337	29%	0.285	S	S	.	.			trans	-155.9	89.1	178.2	-161.7	-36.7	0	0	0	111.1	L1015 K1021 K1022	L1015-D1019 PolarHBondContact O-N 3.3Å; L1015-D1019 VanDerWaalsContact O-N 3.08Å; D1019-K1021 PolarHBondContact O-N 3.33Å; D1019-K1022 HydrophobicContact CB-CB 4.27Å; D1019-K1022 HydrophobicContact CB-CD 4.29Å; D1019-K1022 HydrophobicContact CB-CG 4.42Å; D1019-K1022 PolarHBondContact O-N 3.49Å; D1019-K1022 VanDerWaalsContact OD2-CD 3.27Å; D1019-K1022 WeakPolarHBondContact OD2-CD 3.43Å; D1019-K1022 WeakPolarHBondContact OD2-CE 3.47Å; D1019-K1022 IonicContact OD2-NZ 3.06Å; D1019-K1022 PolarHBondContact OD2-NZ 2.84Å
1020	G	62.7	Low	80.3	Confident	22 Å²	22	52 Å²	52	23%	0.227	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-9.6	-167.2	0	0	0	0	0	116.8	I1016	I1016-G1020 WeakPolarHBondContact O-CA 3.14Å; I1016-G1020 PolarHBondContact O-N 2.95Å
1021	K	60.8	Low	79.4	Confident	143 Å²	143	54.5 Å²	54.5	62%	0.622	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	-13.1	177.2	-71.5	179.8	171.8	86	0	114.4	E955 D1019	E955-K1021 IonicContact OE1-NZ 2.73Å; E955-K1021 PolarHBondContact OE1-NZ 3.4Å; E955-K1021 WeakPolarHBondContact OE2-CE 3.38Å; E955-K1021 IonicContact OE2-NZ 2.98Å; E955-K1021 PolarHBondContact OE2-NZ 2.93Å; D1019-K1021 PolarHBondContact O-N 3.33Å
1022	K	60.7	Low	78.3	Confident	139 Å²	139	52.9 Å²	52.9	60%	0.604	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-16.9	176.8	-67.8	-177.5	-172.4	141	0	114.5	D1019 V1024	D1019-K1022 HydrophobicContact CB-CB 4.27Å; D1019-K1022 HydrophobicContact CB-CD 4.29Å; D1019-K1022 HydrophobicContact CB-CG 4.42Å; D1019-K1022 PolarHBondContact O-N 3.49Å; D1019-K1022 VanDerWaalsContact OD2-CD 3.27Å; D1019-K1022 WeakPolarHBondContact OD2-CD 3.43Å; D1019-K1022 WeakPolarHBondContact OD2-CE 3.47Å; D1019-K1022 IonicContact OD2-NZ 3.06Å; D1019-K1022 PolarHBondContact OD2-NZ 2.84Å; K1022-V1024 VanDerWaalsContact C-N 3.34Å; K1022-V1024 PolarHBondContact O-N 3.35Å
1023	G	68.9	Low	76.9	Confident	2 Å²	2	56.7 Å²	56.7	2%	0.021	31%	0.309	C	S	.	.	S	Bend	trans	-70.3	-25.5	-179.6	0	0	0	0	0	114.6	I950 G1025 T1026	I950-G1023 WeakPolarHBondContact CD1-O 3.46Å; G1023-G1025 PolarHBondContact O-N 3.08Å; G1023-T1026 WeakPolarHBondContact O-CB 3.28Å; G1023-T1026 PolarHBondContact O-N 3.45Å; G1023-T1026 PolarHBondContact O-OG1 2.88Å
1024	V	79.5	Confident	74.9	Confident	60 Å²	60	60.2 Å²	60.2	36%	0.364	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	132	-173.1	-176.6	0	0	0	0	111.4	K1022 T1026 P1047	K1022-V1024 VanDerWaalsContact C-N 3.34Å; K1022-V1024 PolarHBondContact O-N 3.35Å; V1024-T1026 VanDerWaalsContact C-N 3.3Å; V1024-P1047 WeakPolarHBondContact O-CG 3.35Å
1025	G	79.9	Confident	73	Confident	34 Å²	34	61 Å²	61	35%	0.351	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	-4.5	-174.1	0	0	0	0	0	114.9	I950 G1023	I950-G1025 WeakPolarHBondContact O-CA 3.49Å; I950-G1025 PolarHBondContact O-N 3.13Å; G1023-G1025 PolarHBondContact O-N 3.08Å
1026	T	86.2	Confident	71.1	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.012	36%	0.355	C	S	.	.			trans	-66.8	134.8	174.9	-55.8	0	0	0	0	110.6	E949 I950 L1015 G1023 V1024 V1045 M1046	E949-T1026 WeakPolarHBondContact CA-O 3.41Å; I950-T1026 PolarHBondContact N-O 2.97Å; L1015-T1026 HydrophobicContact CD2-CG2 3.88Å; G1023-T1026 WeakPolarHBondContact O-CB 3.28Å; G1023-T1026 PolarHBondContact O-N 3.45Å; G1023-T1026 PolarHBondContact O-OG1 2.88Å; V1024-T1026 VanDerWaalsContact C-N 3.3Å; T1026-V1045 WeakPolarHBondContact CA-O 3.35Å; T1026-M1046 HydrophobicContact CG2-CG 4.02Å
1027	K	89.3	Confident	69.4	Low	78 Å²	78	68.7 Å²	68.7	34%	0.339	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	111.4	-175.4	-162.8	162.2	-169.9	154	0	110.8	V947 M948 E949 V1045	V947-K1027 HydrophobicContact CG1-CD 4.16Å; V947-K1027 HydrophobicContact CG1-CG 3.71Å; M948-K1027 CarbonylContact O-C 3.49Å; M948-K1027 WeakPolarHBondContact O-CA 3.38Å; E949-K1027 HydrophobicContact CB-CG 4.33Å; E949-K1027 HydrophobicContact CG-CD 4.48Å; E949-K1027 HydrophobicContact CG-CG 4.49Å; E949-K1027 VanDerWaalsContact OE2-CD 3.32Å; E949-K1027 WeakPolarHBondContact OE2-CD 3.26Å; E949-K1027 WeakPolarHBondContact OE2-CE 3.21Å; E949-K1027 IonicContact OE2-NZ 3.6Å; E949-K1027 PolarHBondContact OE2-NZ 3.21Å; K1027-V1045 PolarHBondContact N-O 2.87Å; K1027-V1045 PolarHBondContact O-N 2.82Å
1028	L	90.3	Very high	67.5	Low	5 Å²	5	70.7 Å²	70.7	3%	0.026	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	136.4	174.8	-58	176.9	0	0	0	109.3	V947 M948 Q1008 E1011 V1012 I1042 T1043 A1044	V947-L1028 CarbonylContact C-O 3.59Å; V947-L1028 VanDerWaalsContact CA-O 3.3Å; V947-L1028 WeakPolarHBondContact CA-O 3.23Å; V947-L1028 WeakPolarHBondContact CG1-O 3.4Å; M948-L1028 PolarHBondContact N-O 2.82Å; M948-L1028 PolarHBondContact O-N 3.48Å; Q1008-L1028 HydrophobicContact CB-CD1 4.02Å; Q1008-L1028 HydrophobicContact CG-CB 4.27Å; Q1008-L1028 HydrophobicContact CG-CD1 4.39Å; Q1008-L1028 VanDerWaalsContact O-CD1 3.31Å; Q1008-L1028 WeakPolarHBondContact O-CD1 3.35Å; E1011-L1028 HydrophobicContact CB-CD1 3.67Å; E1011-L1028 HydrophobicContact CB-CD2 4.41Å; V1012-L1028 HydrophobicContact CG2-CD1 3.79Å; L1028-I1042 HydrophobicContact CB-CG2 4.19Å; L1028-I1042 HydrophobicContact CD2-CG2 4.04Å; L1028-T1043 CarbonylContact C-O 3.42Å; L1028-T1043 WeakPolarHBondContact CA-O 3.39Å; L1028-A1044 HydrophobicContact CD2-CB 3.66Å
1029	A	87.5	Confident	66.3	Low	18 Å²	18	71.6 Å²	71.6	15%	0.149	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	140.1	177.6	0	0	0	0	0	112.3	V947 T1043	V947-A1029 HydrophobicContact CG2-CB 4.15Å; A1029-T1043 PolarHBondContact N-O 3.19Å; A1029-T1043 PolarHBondContact O-N 3.02Å
1030	T	85.5	Confident	65.8	Low	3 Å²	3	71.8 Å²	71.8	2%	0.018	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	140.4	176.8	-59	0	0	0	0	109.3	K945 V946 I1004 Q1008 P1040	K945-T1030 WeakPolarHBondContact CA-O 3.45Å; V946-T1030 PolarHBondContact N-O 3.43Å; V946-T1030 PolarHBondContact O-N 3.05Å; I1004-T1030 HydrophobicContact CD1-CG2 4.08Å; I1004-T1030 HydrophobicContact CG1-CG2 4.27Å; I1004-T1030 HydrophobicContact CG2-CG2 3.9Å; Q1008-T1030 PolarHBondContact NE2-OG1 2.87Å; T1030-P1040 HydrophobicContact CG2-CB 3.74Å
1031	V	73.9	Confident	65.8	Low	82 Å²	82	76.2 Å²	76.2	50%	0.497	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	121.7	176.9	-179.6	0	0	0	0	108.7	K943 K945	K943-V1031 HydrophobicContact CB-CG1 4.42Å; K943-V1031 HydrophobicContact CD-CG1 4.41Å; K945-V1031 HydrophobicContact CG-CG2 4.24Å
1032	L	65.4	Low	66.4	Low	40 Å²	40	71.7 Å²	71.7	21%	0.209	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	120.3	172.9	-76.3	140.6	0	0	0	110.1	R944 V946 I1004	R944-L1032 HydrophobicContact CB-CB 4.19Å; R944-L1032 HydrophobicContact CB-CD1 3.89Å; R944-L1032 WeakPolarHBondContact O-CB 3.47Å; R944-L1032 PolarHBondContact O-N 2.8Å; V946-L1032 HydrophobicContact CG2-CD1 4.3Å; I1004-L1032 HydrophobicContact CD1-CD1 3.8Å; I1004-L1032 HydrophobicContact CD1-CD2 3.58Å; I1004-L1032 HydrophobicContact CD1-CG 3.6Å
1033	D	58.6	Low	67.3	Low	81 Å²	81	69.1 Å²	69.1	43%	0.433	41%	0.41	S	S	.	.			trans	-100.6	117.4	159.2	-122.5	-51.6	0	0	0	108.6	K943 N1035 S1036	K943-D1033 WeakPolarHBondContact CE-OD2 2.95Å; K943-D1033 IonicContact NZ-OD2 3.37Å; K943-D1033 PolarHBondContact NZ-OD2 3.49Å; D1033-N1035 PolarHBondContact O-N 2.85Å; D1033-S1036 PolarHBondContact O-N 3.21Å
1034	P	48.6	Very low	67.5	Low	99 Å²	99	71.6 Å²	71.6	64%	0.643	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	13.6	-164.9	32.1	-38.3	0	0	0	115
1035	N	43.8	Very low	67.1	Low	147 Å²	147	72.9 Å²	72.9	79%	0.786	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.8	0.7	-173	-106.6	49.9	0	0	0	113.2	D1033	D1033-N1035 PolarHBondContact O-N 2.85Å
1036	S	46.2	Very low	66.2	Low	69 Å²	69	76.7 Å²	76.7	48%	0.483	45%	0.448	S	S	.	.			trans	-97.7	142.4	178.8	-172.3	0	0	0	0	112.2	D1033 E1038	D1033-S1036 PolarHBondContact O-N 3.21Å; S1036-E1038 PolarHBondContact OG-N 3.26Å
1037	T	46.4	Very low	64.4	Low	149 Å²	149	79.5 Å²	79.5	91%	0.914	47%	0.467	S	S	*	.			trans	-92.7	-2.1	173.1	-19.7	0	0	0	0	112.6
1038	E	41.4	Very low	62	Low	154 Å²	154	85.5 Å²	85.5	72%	0.72	49%	0.492	S	S	*	.	S	Bend	trans	-79.3	152.1	-176.2	-66.2	-175	137.7	0	0	113.1	S1036	S1036-E1038 PolarHBondContact OG-N 3.26Å
1039	P	49.5	Very low	59.4	Low	113 Å²	113	91.6 Å²	91.6	73%	0.734	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-64	140.7	176.8	26.6	-34.8	0	0	0	111.8	T1041	P1039-T1041 PolarHBondContact O-N 2.93Å
1040	P	56.4	Low	56.6	Low	67 Å²	67	96.6 Å²	96.6	44%	0.435	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-69.7	117.1	-171.5	26.6	-34.5	0	0	0	112.7	I1004 T1030 I1042	I1004-P1040 HydrophobicContact CG1-CB 4.3Å; I1004-P1040 HydrophobicContact CG1-CG 4.19Å; T1030-P1040 HydrophobicContact CG2-CB 3.74Å; P1040-I1042 PolarHBondContact O-N 2.6Å
1041	T	63.2	Low	54.1	Low	116 Å²	116	101.7 Å²	101.7	71%	0.712	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-64.5	124.5	175.2	-38	0	0	0	0	111.2	P1039	P1039-T1041 PolarHBondContact O-N 2.93Å
1042	I	74.1	Confident	51.9	Low	48 Å²	48	102.8 Å²	102.8	25%	0.246	61%	0.613	C	S	.	*	P	Polyproline II helix	trans	-93.3	130.3	170.9	-57.7	177.1	0	0	0	108.4	A1007 Q1008 E1011 L1028 P1040	A1007-I1042 HydrophobicContact CB-CD1 3.91Å; Q1008-I1042 HydrophobicContact CG-CD1 4.05Å; Q1008-I1042 HydrophobicContact CG-CG1 4.4Å; Q1008-I1042 HydrophobicContact CG-CG2 4.44Å; E1011-I1042 HydrophobicContact CG-CD1 4.11Å; L1028-I1042 HydrophobicContact CB-CG2 4.19Å; L1028-I1042 HydrophobicContact CD2-CG2 4.04Å; P1040-I1042 PolarHBondContact O-N 2.6Å
1043	T	77.9	Confident	50.2	Low	84 Å²	84	105.4 Å²	105.4	52%	0.515	64%	0.64	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.6	115.6	172.7	-50	0	0	0	0	109.4	L1028 A1029	L1028-T1043 CarbonylContact C-O 3.42Å; L1028-T1043 WeakPolarHBondContact CA-O 3.39Å; A1029-T1043 PolarHBondContact N-O 3.19Å; A1029-T1043 PolarHBondContact O-N 3.02Å
1044	A	74.6	Confident	48.8	Very low	55 Å²	55	108.5 Å²	108.5	46%	0.455	66%	0.662	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.2	137.1	175.1	0	0	0	0	0	111.6	L1028	L1028-A1044 HydrophobicContact CD2-CB 3.66Å
1045	V	71	Confident	48.1	Very low	87 Å²	87	108.2 Å²	108.2	53%	0.527	67%	0.668	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.3	115.9	172.1	-175.5	0	0	0	0	108.9	T1026 K1027	T1026-V1045 WeakPolarHBondContact CA-O 3.35Å; K1027-V1045 PolarHBondContact N-O 2.87Å; K1027-V1045 PolarHBondContact O-N 2.82Å
1046	M	61.5	Low	47.5	Very low	114 Å²	114	106.6 Å²	106.6	56%	0.562	67%	0.668	S	S	*	*			trans	-88.7	154.9	176.3	-68.8	178.6	173.1	0	0	111.8	L1015 T1026	L1015-M1046 HydrophobicContact CD1-CE 3.82Å; L1015-M1046 HydrophobicContact CD2-CE 4.45Å; T1026-M1046 HydrophobicContact CG2-CG 4.02Å
1047	P	47.6	Very low	46.6	Very low	61 Å²	61	110.6 Å²	110.6	40%	0.396	68%	0.684	S	S	.	*			trans	-61.7	159.6	164.5	-18.6	33	0	0	0	111.6	V1024	V1024-P1047 WeakPolarHBondContact O-CG 3.35Å
1048	K	38.5	Very low	45.9	Very low	203 Å²	203	109.3 Å²	109.3	88%	0.883	68%	0.677	S	S	*	*			trans	-115.2	91.7	178	-166.5	171.8	-173.9	174.6	0	109.6
1049	D	37	Very low	45.3	Very low	133 Å²	133	111 Å²	111	71%	0.711	68%	0.682	S	S	*	*			trans	-57.1	150.5	-173.7	-73.3	-35.3	0	0	0	113.7
1050	S	27.6	Very low	44.4	Very low	123 Å²	123	112.1 Å²	112.1	86%	0.86	69%	0.689	S	S	*	*			trans	-149.4	62.1	179.6	-71.2	0	0	0	0	111
1051	S	32.2	Very low	43.1	Very low	110 Å²	110	115.7 Å²	115.7	77%	0.769	70%	0.697	S	S	*	*			trans	-142.4	101.9	176.7	58.2	0	0	0	0	111.9
1052	A	28.9	Very low	41.7	Very low	106 Å²	106	117.9 Å²	117.9	88%	0.876	70%	0.703	S	S	*	*			trans	-148.4	93.2	173.2	0	0	0	0	0	111.2
1053	A	29.5	Very low	39.5	Very low	95 Å²	95	122 Å²	122	79%	0.785	72%	0.721	S	S	*	*			trans	-160.9	140.7	167.7	0	0	0	0	0	113
1054	T	28.8	Very low	37.5	Very low	146 Å²	146	125.1 Å²	125.1	90%	0.896	73%	0.733	S	S	*	*			trans	89.9	69.3	157.6	-31.2	0	0	0	0	119.6
1055	A	34.8	Very low	35.4	Very low	93 Å²	93	129.5 Å²	129.5	77%	0.769	74%	0.744	S	S	*	*			trans	-164.7	94	145.5	0	0	0	0	0	108.4
1056	S	31	Very low	33.6	Very low	113 Å²	113	132.8 Å²	132.8	79%	0.79	75%	0.751	S	S	*	*				81	93.5	83	72	0	0	0	0	116.1
1057	N	27.8	Very low	32.2	Very low	153 Å²	153	133 Å²	133	82%	0.818	76%	0.76	S	S	*	*			trans	88	155.7	144.6	-146.8	8.3	0	0	0	121.2
1058	T	31.7	Very low	31.9	Very low	122 Å²	122	135.8 Å²	135.8	75%	0.748	78%	0.778	S	S	*	*			trans	64.2	114	167.1	42.2	0	0	0	0	120.6
1059	K	27.7	Very low	32.2	Very low	190 Å²	190	131.8 Å²	131.8	83%	0.826	77%	0.772	S	S	*	*			trans	-71.2	162.5	157.4	-75.1	-178.4	175.3	177.4	0	111.2
1060	P	31	Very low	31.9	Very low	136 Å²	136	132 Å²	132	88%	0.883	78%	0.778	S	S	*	*				-122.4	177	108.5	35.7	-33.3	0	0	0	114
1061	K	28.9	Very low	32.1	Very low	141 Å²	141	136.9 Å²	136.9	61%	0.613	78%	0.778	S	S	*	*			trans	-136.8	120.6	-172.3	176.4	-127.9	179.1	-164.8	0	111.5	E1063	K1061-E1063 VanDerWaalsContact CE-OE2 3.3Å; K1061-E1063 WeakPolarHBondContact CE-OE2 3.48Å; K1061-E1063 IonicContact NZ-OE1 2.79Å; K1061-E1063 PolarHBondContact NZ-OE1 2.79Å; K1061-E1063 IonicContact NZ-OE2 2.62Å; K1061-E1063 PolarHBondContact NZ-OE2 2.91Å
1062	I	34.7	Very low	32	Very low	163 Å²	163	138.5 Å²	138.5	84%	0.836	78%	0.778	S	S	*	*			trans	-150.8	119.1	160.5	-48.4	178.5	0	0	0	104
1063	E	27.3	Very low	32.1	Very low	133 Å²	133	137.4 Å²	137.4	62%	0.621	77%	0.769	S	S	*	*			cis	95.7	147	28.7	-161	148.6	-131.7	0	0	113.8	K1061	K1061-E1063 VanDerWaalsContact CE-OE2 3.3Å; K1061-E1063 WeakPolarHBondContact CE-OE2 3.48Å; K1061-E1063 IonicContact NZ-OE1 2.79Å; K1061-E1063 PolarHBondContact NZ-OE1 2.79Å; K1061-E1063 IonicContact NZ-OE2 2.62Å; K1061-E1063 PolarHBondContact NZ-OE2 2.91Å
1064	I	35.7	Very low	32.2	Very low	151 Å²	151	138.1 Å²	138.1	77%	0.774	77%	0.768	S	S	*	*			trans	79.3	102.7	-159.1	-50.1	162.4	0	0	0	110.9
1065	E	30.5	Very low	32.2	Very low	147 Å²	147	139.9 Å²	139.9	69%	0.687	77%	0.766	S	S	*	*			cis	81.7	137.8	47.4	-162	-170.9	-139.6	0	0	112.3
1066	K	33.9	Very low	32	Very low	155 Å²	155	143.2 Å²	143.2	67%	0.674	77%	0.766	S	S	*	*			cis	-148.8	168.9	20.7	-121.7	137.9	-172.6	145	0	107.8
1067	T	31.7	Very low	32.2	Very low	120 Å²	120	142.6 Å²	142.6	74%	0.736	76%	0.759	S	S	*	*			cis	-169.4	161.1	-21.4	22.3	0	0	0	0	109.2
1068	P	40.9	Very low	32.5	Very low	119 Å²	119	141.5 Å²	141.5	77%	0.773	75%	0.754	S	S	*	*			trans	-98.8	173.8	179	40	-35.8	0	0	0	114.3
1069	P	44.4	Very low	32.5	Very low	118 Å²	118	141 Å²	141	77%	0.766	75%	0.746	S	S	*	*			trans	-111.4	138.1	174.8	37.3	-28.1	0	0	0	115
1070	T	31.1	Very low	32.7	Very low	137 Å²	137	137.3 Å²	137.3	84%	0.84	74%	0.739	S	S	*	*			trans	-157.7	134.3	154.4	-60.4	0	0	0	0	109.7
1071	R	31.8	Very low	32.6	Very low	226 Å²	226	138.1 Å²	138.1	85%	0.853	73%	0.731	S	S	*	*			trans	76.4	128	171.1	-98.3	-176.7	171.2	131.3	0.6	121
1072	D	29.9	Very low	32.6	Very low	144 Å²	144	136.4 Å²	136.4	77%	0.77	73%	0.733	S	S	*	*			trans	106.6	137	135.6	-93.1	-59	0	0	0	123.7
1073	A	31.1	Very low	32.6	Very low	83 Å²	83	133.8 Å²	133.8	69%	0.686	72%	0.724	S	S	*	*			trans	54.2	115.5	160.8	0	0	0	0	0	124
1074	S	31.6	Very low	32.8	Very low	111 Å²	111	134 Å²	134	78%	0.776	73%	0.73	S	S	*	*			trans	89.3	127.8	132.5	-61.1	0	0	0	0	123.8
1075	Q	29.2	Very low	32.7	Very low	183 Å²	183	131.2 Å²	131.2	86%	0.855	72%	0.719	S	S	*	*			trans	62	109.4	155.1	-65.6	177.5	-46.9	0	0	118.9
1076	E	30.4	Very low	32.8	Very low	163 Å²	163	134.8 Å²	134.8	76%	0.762	73%	0.727	S	S	*	*				56	139	82	-85.9	-100.1	92.6	0	0	114.6	N1078	E1076-N1078 PolarHBondContact OE1-N 2.87Å; E1076-N1078 VanDerWaalsContact OE1-N 3.16Å
1077	P	35.9	Very low	32.8	Very low	99 Å²	99	136.6 Å²	136.6	64%	0.643	73%	0.734	S	S	*	*			cis	-144.4	166.3	38.4	43.2	-25.5	0	0	0	119.6
1078	N	34	Very low	32.8	Very low	131 Å²	131	135.4 Å²	135.4	70%	0.701	73%	0.727	S	S	*	*			trans	68.4	148.9	144.8	-75.7	-34.7	0	0	0	119.6	E1076	E1076-N1078 PolarHBondContact OE1-N 2.87Å; E1076-N1078 VanDerWaalsContact OE1-N 3.16Å
1079	N	30.4	Very low	32.4	Very low	110 Å²	110	135 Å²	135	59%	0.588	73%	0.727	S	S	*	*			cis	-167.7	128.7	-16.9	-178.6	21.9	0	0	0	105.7	Q1081	N1079-Q1081 PolarHBondContact OD1-NE2 3.36Å
1080	V	31.8	Very low	31.7	Very low	114 Å²	114	135.7 Å²	135.7	69%	0.691	72%	0.72	S	S	*	*				170.2	113.7	102	158.5	0	0	0	0	103.5
1081	Q	30.2	Very low	31.8	Very low	153 Å²	153	136.5 Å²	136.5	72%	0.715	71%	0.714	S	S	*	*				67.5	138.7	83.4	-71.7	-167.8	43.9	0	0	113.3	N1079	N1079-Q1081 PolarHBondContact OD1-NE2 3.36Å
1082	V	28.5	Very low	31.9	Very low	105 Å²	105	129.9 Å²	129.9	64%	0.636	70%	0.702	S	S	*	*			cis	-166	150.5	13.8	89.8	0	0	0	0	114.8
1083	T	34.9	Very low	31.9	Very low	107 Å²	107	130.3 Å²	130.3	66%	0.656	71%	0.705	S	S	*	*			trans	69.1	153.5	153.6	64.4	0	0	0	0	122.5
1084	N	30.2	Very low	31.9	Very low	139 Å²	139	130.3 Å²	130.3	74%	0.743	71%	0.705	S	S	*	*			cis	-166.1	161.5	-13.2	-114.2	-15.7	0	0	0	117.7
1085	V	33.7	Very low	32	Very low	91 Å²	91	133.2 Å²	133.2	55%	0.552	71%	0.706	S	S	*	*			trans	82.4	107.1	136.8	163	0	0	0	0	123.7
1086	R	33.6	Very low	32	Very low	223 Å²	223	128.9 Å²	128.9	84%	0.842	70%	0.696	S	S	*	*			trans	59.3	158.2	134.7	-52.2	176.9	-179.5	128.8	-2.9	119.6
1087	K	33.8	Very low	32	Very low	193 Å²	193	126.4 Å²	126.4	84%	0.839	69%	0.692	S	S	*	*			cis	-149.7	134.4	13.4	-165.3	174.6	175.9	-174.1	0	114.4
1088	V	30.4	Very low	31.6	Very low	94 Å²	94	129.6 Å²	129.6	57%	0.57	70%	0.698	S	S	*	*			trans	-8.6	131.6	151.7	176.5	0	0	0	0	120.3	Q1090	V1088-Q1090 HydrophobicContact CG1-CG 4.37Å
1089	S	33.6	Very low	31.3	Very low	111 Å²	111	128.4 Å²	128.4	78%	0.776	70%	0.7	S	S	*	*				-161.6	157.2	103.3	-57.4	0	0	0	0	109.8
1090	Q	29.9	Very low	31.4	Very low	133 Å²	133	131.2 Å²	131.2	62%	0.621	71%	0.713	S	S	*	*			cis	78.5	141.1	21.7	-62.9	177.4	-114.3	0	0	114.3	V1088	V1088-Q1090 HydrophobicContact CG1-CG 4.37Å
1091	E	33.4	Very low	31.3	Very low	154 Å²	154	131.1 Å²	131.1	72%	0.72	72%	0.715	S	S	*	*			cis	-172.8	168	-6.6	-106.7	154.5	-176.4	0	0	107.9
1092	S	32.7	Very low	31.6	Very low	86 Å²	86	135.1 Å²	135.1	60%	0.601	72%	0.723	S	S	*	*			cis	-175.7	-170.6	-21.4	55.3	0	0	0	0	111.3
1093	N	30.2	Very low	31.9	Very low	154 Å²	154	136.3 Å²	136.3	82%	0.824	73%	0.733	S	S	*	*			trans	73	156.5	165.8	-61.5	-17.4	0	0	0	118.8
1094	A	31.9	Very low	31.8	Very low	83 Å²	83	135 Å²	135	69%	0.686	74%	0.741	S	S	*	*			cis	-167.1	170.7	-24.2	0	0	0	0	0	106.7
1095	E	32.9	Very low	31.8	Very low	172 Å²	172	131.6 Å²	131.6	80%	0.804	74%	0.739	S	S	*	*			cis	-163.9	170.8	13.9	-143	179.6	107.8	0	0	110.3
1096	S	30	Very low	31.6	Very low	92 Å²	92	135.2 Å²	135.2	64%	0.643	75%	0.753	S	S	*	*			trans	35.5	146.2	142.1	-69.2	0	0	0	0	123.9
1097	V	30.4	Very low	31.4	Very low	111 Å²	111	131.1 Å²	131.1	67%	0.673	75%	0.747	S	S	*	*			cis	-166.2	144.3	-7.8	115.3	0	0	0	0	111.9
1098	Q	27.6	Very low	31.2	Very low	166 Å²	166	127.6 Å²	127.6	78%	0.776	74%	0.741	S	S	*	*			trans	28.5	126.4	149.7	-53.7	162.4	-10.4	0	0	124.2
1099	S	26.9	Very low	31.4	Very low	105 Å²	105	131.4 Å²	131.4	73%	0.734	76%	0.755	S	S	*	*			trans	27.9	138.7	134.1	66.5	0	0	0	0	124.3
1100	I	32.2	Very low	31.1	Very low	169 Å²	169	131.1 Å²	131.1	87%	0.867	75%	0.753	S	S	*	*			trans	-167.9	157.2	132.7	-104.6	153.8	0	0	0	110.9
1101	P	31.3	Very low	31.6	Very low	113 Å²	113	130.1 Å²	130.1	73%	0.734	76%	0.758	S	S	*	*			trans	-114.3	176.3	-158.5	41.6	-34.2	0	0	0	118.1
1102	R	35	Very low	31.5	Very low	237 Å²	237	128.1 Å²	128.1	89%	0.894	76%	0.757	S	S	*	*			trans	-40.4	150.5	158.1	-73.8	-176.4	177.5	-160	-1.3	112.2
1103	P	36.5	Very low	31.3	Very low	129 Å²	129	130.5 Å²	130.5	84%	0.838	76%	0.762	S	S	*	*				-158.9	178.3	63.9	43.7	-23	0	0	0	119.5
1104	G	32.1	Very low	31.4	Very low	81 Å²	81	132.3 Å²	132.3	84%	0.835	77%	0.766	S	S	*	*			trans	86.6	148.5	160.6	0	0	0	0	0	115.6
1105	G	29.2	Very low	31.2	Very low	67 Å²	67	134.5 Å²	134.5	69%	0.691	77%	0.771	S	S	*	*			cis	148.1	169.2	-1.9	0	0	0	0	0	111.3
1106	I	31.1	Very low	31.2	Very low	167 Å²	167	133.5 Å²	133.5	86%	0.856	77%	0.771	S	S	*	*			trans	73.6	141	172.8	-58.4	170.7	0	0	0	115
1107	I	29.3	Very low	31.2	Very low	137 Å²	137	132 Å²	132	70%	0.703	76%	0.761	S	S	*	*			cis	-171	148.1	-32.1	-134.7	166.9	0	0	0	109
1108	V	28.4	Very low	31.3	Very low	119 Å²	119	130.7 Å²	130.7	72%	0.721	76%	0.761	S	S	*	*			trans	66.7	150.4	157.6	167.3	0	0	0	0	116.1
1109	M	34	Very low	31.8	Very low	173 Å²	173	128.3 Å²	128.3	85%	0.852	76%	0.761	S	S	*	*			cis	-140.2	162.3	12.8	-146.3	139.5	-172.7	0	0	112.5
1110	S	28.8	Very low	32.7	Very low	106 Å²	106	128.7 Å²	128.7	74%	0.741	76%	0.76	S	S	*	*			trans	-107.5	-168.7	166.1	-37.9	0	0	0	0	109.2
1111	P	39.7	Very low	33.1	Very low	111 Å²	111	126 Å²	126	72%	0.721	75%	0.754	S	S	*	*			cis	-140.9	-142.6	-5.5	40.3	-17.6	0	0	0	113.4
1112	T	32.3	Very low	33.3	Very low	113 Å²	113	127.4 Å²	127.4	69%	0.693	76%	0.761	S	S	*	*			trans	89.3	100.7	151.3	27.5	0	0	0	0	122.6
1113	N	28.1	Very low	33.3	Very low	136 Å²	136	120 Å²	120	73%	0.727	76%	0.758	S	S	*	*				37.6	117.9	121.6	-59.4	2.4	0	0	0	120.5
1114	Q	31.3	Very low	33.2	Very low	191 Å²	191	118.9 Å²	118.9	89%	0.893	76%	0.76	S	S	*	*				-165.6	153.3	92.6	-105.9	147.3	116.4	0	0	113.8
1115	T	29.1	Very low	33.2	Very low	130 Å²	130	119.8 Å²	119.8	80%	0.798	76%	0.759	S	S	*	*			trans	-74.9	135.7	160.5	44.5	0	0	0	0	110.2
1116	D	31.7	Very low	33.5	Very low	150 Å²	150	121 Å²	121	80%	0.802	76%	0.763	S	S	*	*				-165.6	-161.4	117.5	-137.8	-59.6	0	0	0	110.9
1117	S	30	Very low	33.7	Very low	62 Å²	62	122.4 Å²	122.4	43%	0.434	76%	0.762	S	S	.	*			trans	-128.7	169.2	-148.4	62.8	0	0	0	0	116.2	Q1676	S1117-Q1676 VanDerWaalsContact CB-NE2 3.3Å; S1117-Q1676 PolarHBondContact OG-NE2 2.62Å; S1117-Q1676 PolarHBondContact OG-OE1 2.79Å
1118	A	32.4	Very low	34.3	Very low	82 Å²	82	121.9 Å²	121.9	68%	0.678	77%	0.768	S	S	*	*			trans	82.5	157	161.7	0	0	0	0	0	120.7
1119	P	37.7	Very low	34.8	Very low	117 Å²	117	121.3 Å²	121.3	76%	0.76	77%	0.77	S	S	*	*			trans	-128	-153	-170	39.5	-18.8	0	0	0	112.9
1120	P	46.8	Very low	35.1	Very low	113 Å²	113	123 Å²	123	73%	0.734	77%	0.766	S	S	*	*				-105.3	-163.5	-68.7	35.9	-19.2	0	0	0	111.1
1121	P	40.2	Very low	35.3	Very low	113 Å²	113	127.3 Å²	127.3	73%	0.734	77%	0.772	S	S	*	*				-156.7	157.7	97.7	40.9	-21.9	0	0	0	119.1
1122	T	36	Very low	35	Very low	142 Å²	142	128.6 Å²	128.6	87%	0.871	77%	0.768	S	S	*	*			trans	25.6	129.3	148.2	61.1	0	0	0	0	123.8
1123	G	33.9	Very low	35.1	Very low	81 Å²	81	130.3 Å²	130.3	84%	0.835	78%	0.778	S	S	*	*			trans	-167	135.9	156.4	0	0	0	0	0	112.7
1124	A	35	Very low	35.4	Very low	106 Å²	106	127.4 Å²	127.4	88%	0.876	77%	0.766	S	S	*	*			trans	-87.1	170.3	-174.8	0	0	0	0	0	113.1
1125	A	33.3	Very low	35.6	Very low	100 Å²	100	127.3 Å²	127.3	83%	0.826	76%	0.762	S	S	*	*			cis	-136.6	-141.5	10	0	0	0	0	0	110.6
1126	A	33.8	Very low	36	Very low	92 Å²	92	127 Å²	127	76%	0.76	77%	0.765	S	S	*	*			cis	-155.8	173.1	1.2	0	0	0	0	0	110.7
1127	K	36.9	Very low	36.2	Very low	196 Å²	196	124.2 Å²	124.2	85%	0.852	76%	0.763	S	S	*	*			trans	-155.8	161.6	175.3	-64.6	-172.8	-178	178	0	112.6
1128	P	40.2	Very low	36.3	Very low	126 Å²	126	128.7 Å²	128.7	82%	0.818	78%	0.782	S	S	*	*				-140.9	160.9	118.2	36.6	-23.9	0	0	0	112.5
1129	S	40.7	Very low	36.8	Very low	108 Å²	108	129.4 Å²	129.4	76%	0.755	78%	0.78	S	S	*	*			cis	76.6	128.2	-6.6	-167.5	0	0	0	0	119.9
1130	R	40.1	Very low	36.3	Very low	207 Å²	207	131.4 Å²	131.4	78%	0.781	78%	0.783	S	S	*	*			cis	-171.2	149.2	-17.5	158.4	172	173.8	165.4	4.7	109.7
1131	F	31.9	Very low	35.6	Very low	197 Å²	197	129.7 Å²	129.7	86%	0.864	78%	0.778	S	S	*	*			trans	-80.1	147.3	167.3	-107.6	-82.7	0	0	0	115.8
1132	Q	34.5	Very low	35.2	Very low	138 Å²	138	130.6 Å²	130.6	65%	0.645	78%	0.782	S	S	*	*			trans	-146.2	163.5	-174.3	-57.6	-176.6	12.2	0	0	112.9	T1134	Q1132-T1134 HydrophobicContact CB-CG2 4.29Å
1133	V	34	Very low	35.3	Very low	149 Å²	149	129.5 Å²	129.5	90%	0.903	78%	0.777	S	S	*	*			trans	-143.5	151.4	148.8	144	0	0	0	0	106.4
1134	T	34.6	Very low	35.2	Very low	75 Å²	75	133.7 Å²	133.7	46%	0.46	78%	0.779	S	S	.	*			trans	-148.1	147.8	-164.9	76.3	0	0	0	0	115.9	Q1132	Q1132-T1134 HydrophobicContact CB-CG2 4.29Å
1135	K	35	Very low	35	Very low	190 Å²	190	134.3 Å²	134.3	83%	0.826	78%	0.777	S	S	*	*			trans	80.1	150.6	159.6	-54.6	151	-170.8	173.8	0	115.8
1136	S	36.6	Very low	34.9	Very low	123 Å²	123	134.6 Å²	134.6	86%	0.86	77%	0.772	S	S	*	*			cis	-113.4	-151.8	5.8	-61.1	0	0	0	0	111
1137	A	36.9	Very low	34.7	Very low	92 Å²	92	134.9 Å²	134.9	76%	0.76	77%	0.769	S	S	*	*			cis	-156.6	177.6	4.1	0	0	0	0	0	111.9
1138	D	31.7	Very low	34.3	Very low	155 Å²	155	133 Å²	133	83%	0.829	77%	0.766	S	S	*	*			trans	-156	169	-172.9	-104.1	-39.6	0	0	0	109.9
1139	P	42.2	Very low	33.8	Very low	98 Å²	98	131.6 Å²	131.6	64%	0.636	76%	0.76	S	S	*	*			cis	-145.3	-166.1	-24.7	41.8	-22.8	0	0	0	115.1
1140	I	29.1	Very low	33.1	Very low	159 Å²	159	132.7 Å²	132.7	82%	0.815	76%	0.762	S	S	*	*			trans	83.9	136.5	146.8	-78.9	171.3	0	0	0	122.4
1141	A	30.4	Very low	32.8	Very low	76 Å²	76	127.9 Å²	127.9	63%	0.628	77%	0.767	S	S	*	*			trans	87.1	123.2	149.6	0	0	0	0	0	125
1142	T	32	Very low	32.6	Very low	132 Å²	132	123.8 Å²	123.8	81%	0.81	76%	0.758	S	S	*	*			trans	67.5	137.4	137.6	51.9	0	0	0	0	123.5
1143	P	38.8	Very low	32.5	Very low	120 Å²	120	124.2 Å²	124.2	78%	0.779	77%	0.77	S	S	*	*			trans	-98.5	152	165.3	38.4	-32.2	0	0	0	113.2
1144	I	32	Very low	32.3	Very low	169 Å²	169	122.7 Å²	122.7	87%	0.867	76%	0.755	S	S	*	*			trans	-163.3	158	165.5	-104.1	145.8	0	0	0	110.4
1145	S	29.8	Very low	32.6	Very low	119 Å²	119	124.8 Å²	124.8	83%	0.832	77%	0.77	S	S	*	*			trans	-102.8	137.6	-177.6	-51.2	0	0	0	0	113.9
1146	S	32.7	Very low	32.2	Very low	105 Å²	105	122.1 Å²	122.1	73%	0.734	76%	0.764	S	S	*	*			trans	-178.6	137	152.6	38.4	0	0	0	0	108.1
1147	S	29.5	Very low	32.1	Very low	99 Å²	99	122.5 Å²	122.5	69%	0.692	76%	0.761	S	S	*	*			cis	95	119.8	26.7	78.9	0	0	0	0	115.4
1148	I	28.4	Very low	31.6	Very low	155 Å²	155	122.8 Å²	122.8	80%	0.795	76%	0.763	S	S	*	*			trans	87.8	109.8	146.4	-67.9	168	0	0	0	119.7
1149	S	28.6	Very low	31.8	Very low	98 Å²	98	120.2 Å²	120.2	69%	0.685	76%	0.763	S	S	*	*			trans	73.6	114.8	135.5	-64.7	0	0	0	0	125.7
1150	T	27.4	Very low	31.2	Very low	130 Å²	130	122 Å²	122	80%	0.798	77%	0.772	S	S	*	*				48.9	123.9	112.4	-26.6	0	0	0	0	121.7
1151	A	32.5	Very low	31.8	Very low	107 Å²	107	119.4 Å²	119.4	88%	0.884	77%	0.766	S	S	*	*			trans	-150.8	132.8	150.5	0	0	0	0	0	112.4
1152	T	28.1	Very low	31.9	Very low	110 Å²	110	122.1 Å²	122.1	68%	0.675	78%	0.775	S	S	*	*			trans	-98.1	147.5	-174.7	-54.9	0	0	0	0	112.8	I1154	T1152-I1154 HydrophobicContact CG2-CG1 4.04Å
1153	V	33.1	Very low	31.6	Very low	148 Å²	148	122.6 Å²	122.6	90%	0.897	77%	0.772	S	S	*	*			trans	-144	151.9	152.7	-177	0	0	0	0	110.3
1154	I	29.2	Very low	31.4	Very low	116 Å²	116	124 Å²	124	60%	0.595	77%	0.772	S	S	*	*			trans	-135	153.7	-171.4	-33.7	173.4	0	0	0	110.2	T1152 I1156	T1152-I1154 HydrophobicContact CG2-CG1 4.04Å; I1154-I1156 HydrophobicContact CB-CD1 4.4Å; I1154-I1156 HydrophobicContact CB-CG1 4.28Å; I1154-I1156 HydrophobicContact CG2-CG1 3.98Å
1155	P	41.2	Very low	31.3	Very low	120 Å²	120	121.5 Å²	121.5	78%	0.779	77%	0.765	S	S	*	*				-132.4	137.6	129.4	36.1	-26.3	0	0	0	111
1156	I	27.1	Very low	31.6	Very low	133 Å²	133	121 Å²	121	68%	0.682	76%	0.761	S	S	*	*			cis	77	134	30.5	-46.4	179.1	0	0	0	113.9	I1154	I1154-I1156 HydrophobicContact CB-CD1 4.4Å; I1154-I1156 HydrophobicContact CB-CG1 4.28Å; I1154-I1156 HydrophobicContact CG2-CG1 3.98Å
1157	V	32.6	Very low	31.5	Very low	132 Å²	132	124.1 Å²	124.1	80%	0.8	76%	0.764	S	S	*	*			trans	75.2	113.9	-177.3	-163.7	0	0	0	0	114.2
1158	A	27.4	Very low	31.8	Very low	98 Å²	98	124.2 Å²	124.2	81%	0.81	76%	0.763	S	S	*	*			cis	99.5	112.4	18.5	0	0	0	0	0	116.4
1159	A	34.8	Very low	32	Very low	101 Å²	101	122.7 Å²	122.7	84%	0.835	76%	0.76	S	S	*	*			trans	-163.8	164.6	163.2	0	0	0	0	0	111.1
1160	T	31	Very low	31.8	Very low	135 Å²	135	124.9 Å²	124.9	83%	0.828	76%	0.763	S	S	*	*			trans	-142.9	-164.7	-170.4	56	0	0	0	0	110.5
1161	P	40.1	Very low	32	Very low	104 Å²	104	124.6 Å²	124.6	68%	0.675	76%	0.76	S	S	*	*				-124.9	-153	-56	29.9	-8.7	0	0	0	111.9
1162	T	32.5	Very low	31.8	Very low	134 Å²	134	127.8 Å²	127.8	82%	0.822	76%	0.757	S	S	*	*			trans	81	152.5	165.4	73	0	0	0	0	117.8
1163	N	27.1	Very low	32.2	Very low	141 Å²	141	127.5 Å²	127.5	75%	0.754	76%	0.757	S	S	*	*			cis	-170.5	-177.3	-28.1	-173.6	16.8	0	0	0	107.2
1164	I	33.9	Very low	32.1	Very low	150 Å²	150	127.4 Å²	127.4	77%	0.769	75%	0.75	S	S	*	*			trans	83.6	135.7	168	-48.8	159.3	0	0	0	114.6
1165	T	30.5	Very low	32.2	Very low	117 Å²	117	127.7 Å²	127.7	72%	0.718	76%	0.757	S	S	*	*			cis	-170.6	158	-26.2	-88.8	0	0	0	0	108.1
1166	S	35.8	Very low	31.9	Very low	108 Å²	108	126.9 Å²	126.9	76%	0.755	76%	0.761	S	S	*	*			trans	77.6	148.9	164.1	71.4	0	0	0	0	120.1
1167	E	30.8	Very low	32.1	Very low	170 Å²	170	128.9 Å²	128.9	79%	0.794	77%	0.767	S	S	*	*			cis	-168.4	149.6	-26.6	-105.6	-87.6	110.6	0	0	108.3
1168	P	36	Very low	32	Very low	102 Å²	102	128.2 Å²	128.2	66%	0.662	76%	0.763	S	S	*	*			trans	-122.7	128.1	-177.2	37.8	-23.9	0	0	0	116.9
1169	V	31.7	Very low	32.2	Very low	123 Å²	123	130.2 Å²	130.2	75%	0.745	76%	0.759	S	S	*	*			trans	-148.9	132.8	175.4	-165.8	0	0	0	0	107.8
1170	I	25.3	Very low	32.1	Very low	144 Å²	144	131.1 Å²	131.1	74%	0.738	75%	0.754	S	S	*	*			cis	90.7	149.7	33.4	-56	172.6	0	0	0	113.6
1171	V	30.3	Very low	32.1	Very low	123 Å²	123	132 Å²	132	75%	0.745	75%	0.748	S	S	*	*			trans	81.6	112.1	179.9	-167.2	0	0	0	0	114.2
1172	Q	28.6	Very low	31.7	Very low	174 Å²	174	135 Å²	135	81%	0.813	76%	0.758	S	S	*	*			cis	97.9	173	46.6	-67.3	-166.2	32.7	0	0	113.1
1173	P	37.6	Very low	31.5	Very low	104 Å²	104	132.2 Å²	132.2	68%	0.675	75%	0.749	S	S	*	*				-134.9	-152	-108.8	32.8	-5.3	0	0	0	115.1
1174	I	29.8	Very low	31.7	Very low	147 Å²	147	132.2 Å²	132.2	75%	0.754	75%	0.754	S	S	*	*			trans	108.4	101.1	155.8	-59.2	166.9	0	0	0	118.8
1175	T	32	Very low	31.7	Very low	122 Å²	122	130.5 Å²	130.5	75%	0.748	75%	0.753	S	S	*	*				48.8	118	129.3	-47.9	0	0	0	0	123.2
1176	A	34.6	Very low	31.8	Very low	103 Å²	103	130.1 Å²	130.1	85%	0.851	75%	0.754	S	S	*	*				-160.8	133.5	124.5	0	0	0	0	0	112.9
1177	Q	32.5	Very low	31.8	Very low	175 Å²	175	130.8 Å²	130.8	82%	0.818	76%	0.756	S	S	*	*			trans	-78.1	168.5	-172.6	-58	162.3	-27.4	0	0	114.8
1178	V	30	Very low	31.6	Very low	117 Å²	117	128.9 Å²	128.9	71%	0.709	76%	0.756	S	S	*	*				160.7	112.5	112.3	161.2	0	0	0	0	112.5
1179	I	30.7	Very low	31.3	Very low	141 Å²	141	128.7 Å²	128.7	72%	0.723	76%	0.757	S	S	*	*			trans	57.9	135.3	142.5	-61.7	177	0	0	0	118.3
1180	T	32.8	Very low	31.1	Very low	119 Å²	119	131.1 Å²	131.1	73%	0.73	76%	0.76	S	S	*	*			cis	-142.7	157.4	27.4	-28.3	0	0	0	0	114.4
1181	H	31.9	Very low	31.2	Very low	153 Å²	153	129.2 Å²	129.2	71%	0.708	76%	0.759	S	S	*	*			trans	-47.1	168.8	169.1	-41.7	-67.5	0	0	0	117.5
1182	L	30.7	Very low	31.1	Very low	167 Å²	167	129.8 Å²	129.8	87%	0.874	76%	0.758	S	S	*	*			cis	-153.3	162.6	8.9	-160.2	66.6	0	0	0	110.8
1183	A	28.4	Very low	31.2	Very low	77 Å²	77	125.5 Å²	125.5	64%	0.636	75%	0.747	S	S	*	*			trans	-148.8	163.9	-179	0	0	0	0	0	114.4
1184	T	31.6	Very low	30.8	Very low	140 Å²	140	123.6 Å²	123.6	86%	0.859	74%	0.736	S	S	*	*			trans	64.4	172.2	162.4	47.7	0	0	0	0	116.2
1185	P	35	Very low	30.7	Very low	115 Å²	115	121.1 Å²	121.1	75%	0.747	72%	0.724	S	S	*	*			cis	-137.6	-176.9	9.3	46.4	-29.3	0	0	0	117.1
1186	S	31.5	Very low	30.6	Very low	108 Å²	108	119.2 Å²	119.2	76%	0.755	72%	0.716	S	S	*	*			trans	-78.1	160.6	151.5	-44.2	0	0	0	0	109.9
1187	P	35.6	Very low	30.6	Very low	122 Å²	122	117 Å²	117	79%	0.792	69%	0.694	S	S	*	*				-153.6	-175	87.1	40.9	-22.2	0	0	0	114.9
1188	V	27.7	Very low	30.7	Very low	130 Å²	130	112.8 Å²	112.8	79%	0.788	68%	0.682	S	S	*	*			trans	-87	143.9	159.9	-71.4	0	0	0	0	110.7
1189	S	28.4	Very low	30.8	Very low	99 Å²	99	111.8 Å²	111.8	69%	0.692	68%	0.68	S	S	*	*			trans	159	128	137.6	-77.7	0	0	0	0	115.1
1190	H	28.4	Very low	30.9	Very low	174 Å²	174	109.3 Å²	109.3	81%	0.806	68%	0.681	S	S	*	*			trans	50.2	135.7	141.3	-59.4	-68.5	0	0	0	124.7
1191	S	27	Very low	30.8	Very low	103 Å²	103	108.8 Å²	108.8	72%	0.72	68%	0.677	S	S	*	*			trans	81.9	122.8	137.3	46.7	0	0	0	0	123
1192	L	27.5	Very low	30.8	Very low	136 Å²	136	107.3 Å²	107.3	71%	0.712	68%	0.68	S	S	*	*			trans	74	111.3	141.5	-61.9	166.1	0	0	0	120.4	T1359	L1192-T1359 HydrophobicContact CD2-CG2 3.89Å
1193	S	30.6	Very low	30.9	Very low	84 Å²	84	107.3 Å²	107.3	59%	0.587	68%	0.675	S	S	*	*				50.2	144.9	108.4	-52.5	0	0	0	0	120.6
1194	S	30.7	Very low	31.3	Very low	63 Å²	63	108.3 Å²	108.3	44%	0.441	68%	0.677	S	S	.	*			cis	174.2	-175.5	-0.8	44.9	0	0	0	0	110.8	P1360	S1194-P1360 VanDerWaalsContact CB-C 3.42Å; S1194-P1360 WeakPolarHBondContact OG-CA 3.41Å; S1194-P1360 PolarHBondContact OG-O 2.84Å
1195	N	26.6	Very low	31.4	Very low	95 Å²	95	107.4 Å²	107.4	51%	0.508	67%	0.667	S	S	.	*			trans	69.5	149.9	178.1	-118.8	90.8	0	0	0	113.2	P1360 Q1361	N1195-P1360 PolarHBondContact OD1-O 3.19Å; N1195-P1360 VanDerWaalsContact OD1-O 3.05Å; N1195-Q1361 VanDerWaalsContact CA-C 3.44Å; N1195-Q1361 PolarHBondContact OD1-N 3.23Å; N1195-Q1361 PolarHBondContact OD1-O 3.48Å; N1195-Q1361 VanDerWaalsContact OD1-O 3.04Å
1196	S	29.5	Very low	31.5	Very low	83 Å²	83	106.5 Å²	106.5	58%	0.58	65%	0.654	S	S	*	*			cis	-155.8	163.2	12.5	-39.6	0	0	0	0	107.9	T1362 I1363	S1196-T1362 CarbonylContact C-O 3.2Å; S1196-T1362 VanDerWaalsContact C-O 3.27Å; S1196-T1362 WeakPolarHBondContact CA-O 3.35Å; S1196-I1363 CarbonylContact C-O 3.6Å
1197	S	35.5	Very low	31.8	Very low	56 Å²	56	104.7 Å²	104.7	39%	0.392	64%	0.642	S	S	.	*			cis	-172.3	-171.3	-22.8	-142.8	0	0	0	0	107.8	T1362 I1363	S1197-T1362 WeakPolarHBondContact CA-O 3.39Å; S1197-T1362 PolarHBondContact N-O 2.98Å; S1197-I1363 PolarHBondContact N-O 2.98Å; S1197-I1363 VanDerWaalsContact N-O 3.17Å; S1197-I1363 CarbonylContact O-C 3.55Å; S1197-I1363 VanDerWaalsContact O-C 3.24Å
1198	P	34.6	Very low	31.8	Very low	86 Å²	86	103.6 Å²	103.6	56%	0.558	64%	0.637	S	S	*	*			cis	-128.8	166.5	-14.7	46.6	-29.9	0	0	0	113.1
1199	S	31.7	Very low	32.2	Very low	96 Å²	96	104.6 Å²	104.6	67%	0.671	64%	0.636	S	S	*	*				64	146.9	91.2	-49.1	0	0	0	0	119.1
1200	A	32.8	Very low	32.4	Very low	89 Å²	89	108.1 Å²	108.1	74%	0.736	64%	0.642	S	S	*	*			cis	-152	-101.3	-21.7	0	0	0	0	0	112.4
1201	T	31.1	Very low	32.6	Very low	108 Å²	108	104.4 Å²	104.4	66%	0.663	64%	0.635	S	S	*	*			cis	-161.7	87.7	-0.1	-42.6	0	0	0	0	114.5
1202	T	31.1	Very low	32.7	Very low	123 Å²	123	105.4 Å²	105.4	76%	0.755	64%	0.637	S	S	*	*			trans	68.5	163.9	147	70.7	0	0	0	0	120.7
1203	H	34.4	Very low	32.6	Very low	166 Å²	166	104.9 Å²	104.9	77%	0.769	64%	0.64	S	S	*	*			cis	-153.8	-161.9	4.5	-136.1	-23.9	0	0	0	110.1
1204	S	35.6	Very low	32.5	Very low	99 Å²	99	105.9 Å²	105.9	69%	0.692	65%	0.646	S	S	*	*			cis	-164.3	-169.4	1.7	39.8	0	0	0	0	111.5
1205	N	34.7	Very low	32.7	Very low	121 Å²	121	109.3 Å²	109.3	65%	0.647	66%	0.664	S	S	*	*			trans	-98.3	-168.2	-174.1	-57	4.3	0	0	0	112.9	T920	T920-N1205 PolarHBondContact O-ND2 2.96Å
1206	M	37.3	Very low	33.4	Very low	95 Å²	95	110.4 Å²	110.4	47%	0.468	68%	0.677	S	S	.	*			cis	-173.1	167.1	21.4	-155.9	-172	160.2	0	0	114.9	T920	T920-M1206 WeakPolarHBondContact O-CG 3.29Å
1207	S	36.9	Very low	33.5	Very low	71 Å²	71	110 Å²	110	50%	0.497	69%	0.686	S	S	.	*			trans	94	113	140	-84.7	0	0	0	0	125.6
1208	S	36.1	Very low	33.3	Very low	99 Å²	99	118.3 Å²	118.3	69%	0.692	71%	0.709	S	S	*	*				87.4	132.8	115.4	-64.2	0	0	0	0	126.5
1209	I	35.4	Very low	33.1	Very low	151 Å²	151	123.4 Å²	123.4	77%	0.774	72%	0.717	S	S	*	*			trans	92.7	110.1	145.9	-67.1	159.2	0	0	0	123
1210	Q	33.4	Very low	33	Very low	173 Å²	173	127.4 Å²	127.4	81%	0.808	72%	0.723	S	S	*	*			trans	44.2	142.1	137.8	-56.5	-176.1	-10.1	0	0	126.2
1211	S	32.1	Very low	33	Very low	95 Å²	95	129.2 Å²	129.2	66%	0.664	73%	0.725	S	S	*	*			trans	100.8	112.4	138.8	-69.7	0	0	0	0	123.7
1212	T	28.9	Very low	32.8	Very low	124 Å²	124	130.1 Å²	130.1	76%	0.761	73%	0.73	S	S	*	*			trans	81.1	136.3	134	53	0	0	0	0	125
1213	T	26.1	Very low	32.6	Very low	126 Å²	126	132.6 Å²	132.6	77%	0.773	73%	0.733	S	S	*	*			trans	79	131.8	148.3	42.2	0	0	0	0	123.9
1214	S	27.6	Very low	32.6	Very low	104 Å²	104	130.3 Å²	130.3	73%	0.727	73%	0.733	S	S	*	*			trans	58.4	122.2	157.1	42.8	0	0	0	0	120
1215	V	36.2	Very low	32.2	Very low	135 Å²	135	132.5 Å²	132.5	82%	0.818	74%	0.742	S	S	*	*			cis	70.1	134.6	37.9	-174.7	0	0	0	0	112.8
1216	P	39.9	Very low	32.1	Very low	118 Å²	118	131.6 Å²	131.6	77%	0.766	75%	0.745	S	S	*	*			cis	-135.9	165.6	-0.9	36.4	-17.7	0	0	0	118.7
1217	G	31.5	Very low	31.7	Very low	76 Å²	76	136.4 Å²	136.4	78%	0.784	77%	0.766	S	S	*	*			trans	74.1	165.5	133.7	0	0	0	0	0	120.2
1218	R	32.7	Very low	31.2	Very low	229 Å²	229	137.1 Å²	137.1	86%	0.864	78%	0.776	S	S	*	*			cis	-147.5	135.1	-4.7	-98.2	-178	175.3	-173.3	-0.4	108
1219	R	29.2	Very low	30.9	Very low	193 Å²	193	141.2 Å²	141.2	73%	0.728	78%	0.784	S	S	*	*				67.5	123.3	92.8	-151.6	169.6	-156.6	177.9	8.5	113
1220	F	30.6	Very low	30.6	Very low	181 Å²	181	139.8 Å²	139.8	79%	0.794	79%	0.788	S	S	*	*				-131.9	149.5	52.7	-90.5	-96.9	0	0	0	117.7
1221	T	31.8	Very low	30.4	Very low	126 Å²	126	135.1 Å²	135.1	77%	0.773	79%	0.787	S	S	*	*			trans	-150.9	143.3	172.3	47.2	0	0	0	0	110.1
1222	V	28.4	Very low	30.4	Very low	128 Å²	128	139.1 Å²	139.1	78%	0.776	80%	0.798	S	S	*	*			trans	-158.8	131.3	169.7	-178.5	0	0	0	0	107.1
1223	Q	26.7	Very low	30.5	Very low	174 Å²	174	138.5 Å²	138.5	81%	0.813	80%	0.799	S	S	*	*			cis	-159.7	138.9	-20.8	-124.6	176.3	-6.4	0	0	109.2
1224	P	33.5	Very low	30.9	Very low	118 Å²	118	138 Å²	138	77%	0.766	80%	0.801	S	S	*	*			trans	-113.2	163.8	137.9	36.7	-31.2	0	0	0	110.2
1225	V	26.9	Very low	31	Very low	145 Å²	145	138 Å²	138	88%	0.879	80%	0.801	S	S	*	*			trans	163.4	159.4	150.6	150	0	0	0	0	111.4
1226	S	32	Very low	30.8	Very low	102 Å²	102	139.4 Å²	139.4	71%	0.713	80%	0.802	S	S	*	*			trans	-109.9	175.9	-171.6	-45.9	0	0	0	0	114.1
1227	Q	29.4	Very low	30.4	Very low	197 Å²	197	138.1 Å²	138.1	92%	0.921	80%	0.796	S	S	*	*			trans	70.2	136	167.3	-60.8	176.1	-22.7	0	0	115.4
1228	A	27.5	Very low	30.2	Very low	85 Å²	85	140.8 Å²	140.8	70%	0.702	80%	0.797	S	S	*	*				-162.2	168.2	57.3	0	0	0	0	0	114.6
1229	E	29.1	Very low	30.3	Very low	185 Å²	185	135.1 Å²	135.1	86%	0.864	79%	0.79	S	S	*	*			trans	17.1	136.8	150.5	-55.3	178.6	113.5	0	0	120.1
1230	S	29.7	Very low	30.4	Very low	121 Å²	121	134.5 Å²	134.5	85%	0.846	80%	0.795	S	S	*	*			cis	-167.7	163.7	47.1	40.5	0	0	0	0	111.5
1231	G	28.7	Very low	30.6	Very low	76 Å²	76	130 Å²	130	78%	0.784	78%	0.784	S	S	*	*			trans	-92.9	177.9	-163	0	0	0	0	0	118
1232	I	31.6	Very low	30.7	Very low	178 Å²	178	132.6 Å²	132.6	91%	0.913	79%	0.788	S	S	*	*			trans	-113.4	137.2	157.5	51.9	173.6	0	0	0	108.6
1233	S	31.6	Very low	31.1	Very low	112 Å²	112	131.6 Å²	131.6	78%	0.783	78%	0.783	S	S	*	*			trans	-107	167.8	-171.1	-68.3	0	0	0	0	113
1234	S	33.8	Very low	31.4	Very low	115 Å²	115	129.2 Å²	129.2	80%	0.804	78%	0.781	S	S	*	*			trans	74.7	140.9	167.2	76.1	0	0	0	0	116.8
1235	S	31	Very low	31.6	Very low	103 Å²	103	129.2 Å²	129.2	72%	0.72	78%	0.781	S	S	*	*			cis	-167.5	168.9	-11.6	-104.7	0	0	0	0	110.5
1236	I	31.5	Very low	31.7	Very low	165 Å²	165	125.9 Å²	125.9	85%	0.846	77%	0.769	S	S	*	*			trans	71.8	145.2	158.4	-82.1	165.4	0	0	0	117
1237	S	30.4	Very low	31.6	Very low	92 Å²	92	128.4 Å²	128.4	64%	0.643	77%	0.773	S	S	*	*			cis	-172.6	135.1	-34.3	-130.2	0	0	0	0	111.9
1238	T	29.2	Very low	31.6	Very low	132 Å²	132	124.6 Å²	124.6	81%	0.81	76%	0.763	S	S	*	*			trans	62.5	168.8	150.4	25.6	0	0	0	0	118.7
1239	P	34.5	Very low	31.8	Very low	110 Å²	110	125.5 Å²	125.5	71%	0.714	76%	0.764	S	S	*	*			trans	-136.6	-174.7	-134.7	45.4	-28.7	0	0	0	118.2
1240	H	30.7	Very low	31.9	Very low	179 Å²	179	122.7 Å²	122.7	83%	0.829	76%	0.763	S	S	*	*			trans	78.7	174.6	152.2	-129.9	-119.5	0	0	0	116.3
1241	P	35.2	Very low	32.3	Very low	87 Å²	87	122.5 Å²	122.5	57%	0.565	76%	0.759	S	S	*	*				-122.3	171.2	-84.4	43.9	-34	0	0	0	114.8
1242	E	33.6	Very low	32.8	Very low	181 Å²	181	124.2 Å²	124.2	85%	0.846	76%	0.757	S	S	*	*			trans	53.3	170.4	152.2	-90.5	-168.3	104.3	0	0	120.6
1243	P	35.8	Very low	33.5	Very low	106 Å²	106	121.9 Å²	121.9	69%	0.688	75%	0.753	S	S	*	*			cis	-122.3	-158.6	-25.8	35.7	-17.6	0	0	0	111.9
1244	T	34.6	Very low	33.8	Very low	124 Å²	124	122.7 Å²	122.7	76%	0.761	75%	0.753	S	S	*	*			trans	-57.3	170.3	169.6	58.7	0	0	0	0	114.9
1245	P	36.9	Very low	33.9	Very low	118 Å²	118	123 Å²	123	77%	0.766	75%	0.752	S	S	*	*			cis	-140	-169.1	6.7	40.2	-19.7	0	0	0	116.4
1246	A	29.1	Very low	34	Very low	76 Å²	76	123.3 Å²	123.3	63%	0.628	75%	0.754	S	S	*	*			trans	82.3	120.5	137.5	0	0	0	0	0	123.6
1247	I	29.9	Very low	34.4	Very low	155 Å²	155	121.9 Å²	121.9	80%	0.795	75%	0.753	S	S	*	*			trans	60.2	116.4	138.2	-45.7	161.3	0	0	0	116.5
1248	T	29.5	Very low	34.7	Very low	117 Å²	117	122.3 Å²	122.3	72%	0.718	75%	0.754	S	S	*	*				-174	151.2	78.1	-43.5	0	0	0	0	111.1
1249	S	31.1	Very low	35.5	Very low	104 Å²	104	122.5 Å²	122.5	73%	0.727	76%	0.757	S	S	*	*			trans	46.6	122.6	155.2	58.5	0	0	0	0	119.7
1250	C	31.8	Very low	35.5	Very low	125 Å²	125	123.4 Å²	123.4	85%	0.845	76%	0.761	S	S	*	*			cis	-153	170.4	40.7	-90.9	0	0	0	0	113
1251	P	38.9	Very low	35.8	Very low	117 Å²	117	121.4 Å²	121.4	76%	0.76	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-91.4	161.6	-172.1	1.3	19.2	0	0	0	115
1252	P	37.6	Very low	35.8	Very low	112 Å²	112	121.1 Å²	121.1	73%	0.727	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-82.1	156.6	173.9	34.9	-35.8	0	0	0	113.2
1253	P	46.6	Very low	36	Very low	130 Å²	130	120.1 Å²	120.1	84%	0.844	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-75.1	136.2	173.5	30.8	-33.8	0	0	0	112.3
1254	V	37.6	Very low	36.1	Very low	128 Å²	128	118.5 Å²	118.5	78%	0.776	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-86.2	156.7	177.1	-83	0	0	0	0	112.7
1255	P	35.5	Very low	36.1	Very low	122 Å²	122	118.3 Å²	118.3	79%	0.792	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-73.4	154.9	175.3	31.6	-36.2	0	0	0	112.7
1256	S	34.6	Very low	36	Very low	109 Å²	109	118.4 Å²	118.4	76%	0.762	76%	0.756	S	S	*	*			trans	-150.8	126.1	169.7	-72.3	0	0	0	0	108.8
1257	V	39.2	Very low	36.3	Very low	135 Å²	135	119.9 Å²	119.9	82%	0.818	75%	0.753	S	S	*	*			cis	94.9	133.7	49.2	169	0	0	0	0	110.6
1258	P	37.6	Very low	36.7	Very low	101 Å²	101	117.5 Å²	117.5	66%	0.656	74%	0.742	S	S	*	*			trans	-88	170.8	-154.2	35.8	-37.5	0	0	0	115
1259	P	45.1	Very low	36.9	Very low	136 Å²	136	119.2 Å²	119.2	88%	0.883	74%	0.741	S	S	*	*			trans	-67.8	138.5	-175.6	26.3	-36.1	0	0	0	114.6
1260	V	34.7	Very low	37	Very low	130 Å²	130	120.1 Å²	120.1	79%	0.788	74%	0.742	S	S	*	*			trans	-138.6	137.9	178.6	171.7	0	0	0	0	109.9
1261	V	36.8	Very low	37.2	Very low	136 Å²	136	118.7 Å²	118.7	82%	0.824	74%	0.739	S	S	*	*			trans	-153.1	126.4	171.6	-171.8	0	0	0	0	107.4
1262	S	36.1	Very low	37.3	Very low	82 Å²	82	118.8 Å²	118.8	57%	0.573	74%	0.74	S	S	*	*			cis	-161.3	151.6	-8	-105.7	0	0	0	0	113.9
1263	N	36.6	Very low	37.2	Very low	159 Å²	159	122 Å²	122	85%	0.85	74%	0.743	S	S	*	*			trans	66.2	138.7	146.4	-55.5	1.6	0	0	0	122.1
1264	G	37.8	Very low	36.5	Very low	72 Å²	72	123.1 Å²	123.1	74%	0.742	74%	0.737	S	S	*	*			trans	-173.4	-60.7	173	0	0	0	0	0	118.7
1265	T	35.1	Very low	36.1	Very low	120 Å²	120	123 Å²	123	74%	0.736	74%	0.737	S	S	*	*			trans	54.3	125	157.2	-26.3	0	0	0	0	123.3
1266	L	35.4	Very low	36.2	Very low	120 Å²	120	123 Å²	123	63%	0.628	74%	0.737	S	S	*	*				153.6	139.7	123.6	-81	174.6	0	0	0	117.5	P1645 S1646	L1266-P1645 WeakPolarHBondContact O-CA 3.3Å; L1266-P1645 WeakPolarHBondContact O-CB 3.43Å; L1266-S1646 WeakPolarHBondContact O-CB 3.46Å; L1266-S1646 PolarHBondContact O-OG 3.24Å
1267	N	35.7	Very low	36	Very low	107 Å²	107	123.3 Å²	123.3	57%	0.572	74%	0.739	S	S	*	*			trans	-89.5	176.2	-155.2	-50.4	-5.5	0	0	0	118.2	C1644	N1267-C1644 VanDerWaalsContact C-CB 3.44Å; N1267-C1644 VanDerWaalsContact O-CB 3.31Å; N1267-C1644 WeakPolarHBondContact O-CB 3.5Å
1268	L	36.6	Very low	35.6	Very low	105 Å²	105	120.7 Å²	120.7	55%	0.55	73%	0.731	S	S	.	*				155.2	92.2	91.2	-161.9	71.3	0	0	0	119.6	P1643 C1644	L1268-P1643 WeakPolarHBondContact O-CB 3.39Å; L1268-P1643 WeakPolarHBondContact O-CG 3.36Å; L1268-C1644 VanDerWaalsContact N-C 3.33Å; L1268-C1644 PolarHBondContact N-O 2.65Å
1269	E	34.1	Very low	35.2	Very low	153 Å²	153	121.8 Å²	121.8	72%	0.715	74%	0.736	S	S	*	*			trans	77.8	167.3	133.1	-150.7	172.2	110.6	0	0	125.1	P1643	E1269-P1643 VanDerWaalsContact O-CG 3.23Å; E1269-P1643 WeakPolarHBondContact O-CG 3.37Å
1270	V	34.5	Very low	34.4	Very low	123 Å²	123	121.7 Å²	121.7	75%	0.745	73%	0.728	S	S	*	*			trans	113.7	85.1	150.9	-165.9	0	0	0	0	121.7
1271	A	34.7	Very low	34.4	Very low	95 Å²	95	123.6 Å²	123.6	79%	0.785	73%	0.729	S	S	*	*				58.7	157.7	121.5	0	0	0	0	0	126.7
1272	P	41.6	Very low	34	Very low	120 Å²	120	123.2 Å²	123.2	78%	0.779	72%	0.722	S	S	*	*			trans	-130.9	-177.9	-165.2	45.1	-29.6	0	0	0	117.4
1273	K	34.6	Very low	34	Very low	179 Å²	179	125.3 Å²	125.3	78%	0.778	73%	0.731	S	S	*	*			trans	-178.1	141.9	147.3	-108.1	168.9	175.9	-178	0	119.2
1274	Q	31.9	Very low	33.7	Very low	153 Å²	153	123.4 Å²	123.4	72%	0.715	72%	0.721	S	S	*	*			trans	63.8	119.2	137.1	-74	163.6	-25	0	0	126.1
1275	T	30.2	Very low	33.5	Very low	126 Å²	126	125.3 Å²	125.3	77%	0.773	72%	0.718	S	S	*	*				0.1	163.7	125.8	57.1	0	0	0	0	121.4
1276	P	36.6	Very low	33.3	Very low	123 Å²	123	126.1 Å²	126.1	80%	0.799	71%	0.714	S	S	*	*			cis	-146.3	-179.6	23.2	43.3	-22.4	0	0	0	120.2
1277	S	30.6	Very low	33.3	Very low	115 Å²	115	127.7 Å²	127.7	80%	0.804	72%	0.718	S	S	*	*			trans	-25	151.6	163.2	-159.3	0	0	0	0	122.4
1278	A	30.7	Very low	33.3	Very low	80 Å²	80	126.8 Å²	126.8	66%	0.661	72%	0.72	S	S	*	*				147.6	149.2	105.9	0	0	0	0	0	118.8
1279	T	30.5	Very low	33.1	Very low	124 Å²	124	126.9 Å²	126.9	76%	0.761	73%	0.729	S	S	*	*			trans	84.3	115.3	142.4	15.2	0	0	0	0	125.3
1280	N	28.2	Very low	33.1	Very low	134 Å²	134	123.8 Å²	123.8	72%	0.717	72%	0.724	S	S	*	*				106.9	147.8	112.4	-120.4	-14.7	0	0	0	124.1
1281	Q	34.5	Very low	33	Very low	169 Å²	169	124.3 Å²	124.3	79%	0.79	73%	0.728	S	S	*	*			trans	69	152.7	157.5	-66.6	173.1	46.7	0	0	119.9
1282	N	28.4	Very low	32.8	Very low	129 Å²	129	124 Å²	124	69%	0.69	73%	0.726	S	S	*	*			cis	-169.3	-176	-29.7	-170.1	30.5	0	0	0	108.5
1283	V	36.4	Very low	32.3	Very low	126 Å²	126	123 Å²	123	76%	0.764	72%	0.721	S	S	*	*			trans	84.4	140.5	161.4	-176.6	0	0	0	0	116
1284	D	30.8	Very low	31.9	Very low	118 Å²	118	120.2 Å²	120.2	63%	0.631	72%	0.72	S	S	*	*			cis	-173.4	178.3	-40.5	-138.9	-56.7	0	0	0	108.3
1285	T	33.4	Very low	31.7	Very low	112 Å²	112	117.2 Å²	117.2	69%	0.687	72%	0.721	S	S	*	*			trans	68.6	134.1	155.9	-57.9	0	0	0	0	117.7
1286	Q	30.3	Very low	31.6	Very low	137 Å²	137	116.9 Å²	116.9	64%	0.64	72%	0.719	S	S	*	*			cis	-179.4	168.2	-23.1	-124.5	168.1	15.9	0	0	109
1287	H	34.4	Very low	31.2	Very low	154 Å²	154	118.1 Å²	118.1	71%	0.713	72%	0.718	S	S	*	*			trans	63.5	143.4	153.9	-66.2	-47.7	0	0	0	119.7
1288	S	36.7	Very low	31	Very low	88 Å²	88	118.7 Å²	118.7	62%	0.615	72%	0.716	S	S	*	*			cis	-162	148.5	-6.4	-109.5	0	0	0	0	111.7
1289	S	32.3	Very low	30.8	Very low	107 Å²	107	118.7 Å²	118.7	75%	0.748	71%	0.711	S	S	*	*			trans	38.1	151.8	135.2	83.5	0	0	0	0	121.3
1290	S	33.9	Very low	30.5	Very low	88 Å²	88	121 Å²	121	62%	0.615	71%	0.713	S	S	*	*			cis	-173.7	150.6	30.7	50.9	0	0	0	0	111.5
1291	T	31.5	Very low	30.4	Very low	133 Å²	133	120.7 Å²	120.7	82%	0.816	72%	0.717	S	S	*	*			trans	49.3	148.5	139.4	57.6	0	0	0	0	120.8
1292	A	31.9	Very low	30.3	Very low	90 Å²	90	118.5 Å²	118.5	74%	0.744	72%	0.717	S	S	*	*			cis	-175.1	-178.3	-4	0	0	0	0	0	105.6
1293	S	31.1	Very low	30.2	Very low	98 Å²	98	116.8 Å²	116.8	69%	0.685	72%	0.721	S	S	*	*			cis	-156.7	136.2	0.1	-129.7	0	0	0	0	106.5
1294	T	26.4	Very low	29.7	Very low	121 Å²	121	116.4 Å²	116.4	74%	0.742	72%	0.719	S	S	*	*				78.3	144.7	99.7	-55.9	0	0	0	0	115.5
1295	A	27.1	Very low	29.6	Very low	89 Å²	89	117.3 Å²	117.3	74%	0.736	73%	0.729	S	S	*	*			trans	72.5	140.6	167	0	0	0	0	0	117
1296	T	28.6	Very low	29.4	Very low	120 Å²	120	119.5 Å²	119.5	74%	0.736	73%	0.731	S	S	*	*			cis	-155.7	175	-8.8	-97.3	0	0	0	0	109.5
1297	L	26.7	Very low	29.3	Very low	149 Å²	149	118.8 Å²	118.8	78%	0.78	74%	0.736	S	S	*	*			trans	-48.8	168.6	164.7	-55.7	83.1	0	0	0	111.2
1298	V	27.5	Very low	29.2	Very low	126 Å²	126	117 Å²	117	76%	0.764	74%	0.735	S	S	*	*				-159.9	122.5	58	-175.9	0	0	0	0	105.9
1299	S	25.6	Very low	28.9	Very low	81 Å²	81	118.5 Å²	118.5	57%	0.566	74%	0.743	S	S	*	*				58.8	122.9	88.2	-135.6	0	0	0	0	115.5
1300	E	25.8	Very low	29	Very low	171 Å²	171	121.3 Å²	121.3	80%	0.799	75%	0.748	S	S	*	*			trans	62	154.2	154.8	-59.4	151.4	110.4	0	0	117.2
1301	T	25.6	Very low	28.9	Very low	129 Å²	129	121.9 Å²	121.9	79%	0.791	75%	0.752	S	S	*	*			cis	-145.3	166.2	24.1	45	0	0	0	0	112.8
1302	P	32.7	Very low	28.8	Very low	122 Å²	122	121.8 Å²	121.8	79%	0.792	75%	0.751	S	S	*	*			trans	-98.9	143.3	170.6	36.7	-32.1	0	0	0	114.5
1303	A	25.6	Very low	28.9	Very low	94 Å²	94	123.2 Å²	123.2	78%	0.777	75%	0.753	S	S	*	*			trans	-162.7	138.9	154.7	0	0	0	0	0	108.3
1304	T	25.4	Very low	28.9	Very low	118 Å²	118	122.9 Å²	122.9	72%	0.724	76%	0.756	S	S	*	*			cis	86.2	80	32	-51.7	0	0	0	0	114.9
1305	V	29.8	Very low	29.2	Very low	137 Å²	137	122.7 Å²	122.7	83%	0.83	76%	0.757	S	S	*	*			trans	-144.6	106.4	137	-173	0	0	0	0	105.7
1306	H	27.8	Very low	29.2	Very low	158 Å²	158	124.6 Å²	124.6	73%	0.731	76%	0.759	S	S	*	*				82.4	154.1	58	-131	-79.9	0	0	0	114.8
1307	V	29.7	Very low	29.2	Very low	122 Å²	122	127.2 Å²	127.2	74%	0.739	76%	0.763	S	S	*	*			trans	86.9	117.7	-175.3	-177	0	0	0	0	114.5
1308	T	31.5	Very low	29.2	Very low	115 Å²	115	128.5 Å²	128.5	71%	0.706	77%	0.765	S	S	*	*			cis	-159.2	138.7	-12.4	18.5	0	0	0	0	110.4
1309	P	31.2	Very low	29.5	Very low	121 Å²	121	127.5 Å²	127.5	79%	0.786	76%	0.761	S	S	*	*			trans	-108.1	150.8	168.5	37.8	-30.7	0	0	0	114.1
1310	I	33.7	Very low	29.6	Very low	165 Å²	165	130.8 Å²	130.8	85%	0.846	77%	0.771	S	S	*	*			trans	-153.1	148.1	175.5	-54.9	179.1	0	0	0	108.1
1311	S	30.8	Very low	29.6	Very low	100 Å²	100	128.4 Å²	128.4	70%	0.699	77%	0.768	S	S	*	*			cis	-168.9	142.5	-35.8	179.7	0	0	0	0	109.4
1312	V	30.6	Very low	29.9	Very low	131 Å²	131	129.7 Å²	129.7	79%	0.794	77%	0.769	S	S	*	*			trans	-40.3	162.4	166.2	-103.2	0	0	0	0	115.6
1313	P	34.6	Very low	29.7	Very low	121 Å²	121	130 Å²	130	79%	0.786	76%	0.764	S	S	*	*			cis	-148	-169.9	36.5	44.6	-24.3	0	0	0	118.5
1314	A	31.1	Very low	30.2	Very low	91 Å²	91	132.6 Å²	132.6	75%	0.752	76%	0.759	S	S	*	*			trans	-126.4	149.4	165.1	0	0	0	0	0	112
1315	P	32.4	Very low	30.7	Very low	116 Å²	116	134.6 Å²	134.6	75%	0.753	76%	0.76	S	S	*	*			trans	-129.5	154.2	143.4	36.6	-25.2	0	0	0	111
1316	V	26.9	Very low	30.9	Very low	130 Å²	130	131.7 Å²	131.7	79%	0.788	75%	0.746	S	S	*	*			cis	85.8	91.3	25.8	-174.7	0	0	0	0	115.2
1317	Q	27.7	Very low	31.1	Very low	175 Å²	175	130.4 Å²	130.4	82%	0.818	74%	0.744	S	S	*	*			trans	160.1	119.8	150.9	-90.9	166.5	-18.4	0	0	107.8
1318	E	27.2	Very low	31.1	Very low	176 Å²	176	131 Å²	131	82%	0.822	75%	0.748	S	S	*	*				70.4	145	65.5	-76.6	-159.2	139.6	0	0	115.4
1319	P	34.1	Very low	31.2	Very low	104 Å²	104	132.6 Å²	132.6	68%	0.675	75%	0.752	S	S	*	*			cis	-142.1	-166	-24.5	35.3	-13.2	0	0	0	114.9
1320	L	26.6	Very low	31.3	Very low	151 Å²	151	133.1 Å²	133.1	79%	0.791	75%	0.753	S	S	*	*			trans	96.5	94.6	155.9	-65	161.8	0	0	0	122.5
1321	V	26.6	Very low	31.1	Very low	121 Å²	121	131.3 Å²	131.3	73%	0.733	74%	0.741	S	S	*	*				30	130.9	118	-159.8	0	0	0	0	117.8
1322	I	30.9	Very low	31.2	Very low	156 Å²	156	133.6 Å²	133.6	80%	0.8	74%	0.744	S	S	*	*				-157.2	153	73.6	-71.4	159	0	0	0	112.6
1323	D	30.3	Very low	31.4	Very low	128 Å²	128	135 Å²	135	68%	0.684	75%	0.747	S	S	*	*			trans	-37.5	158.8	169.5	-67.5	-70.7	0	0	0	118.9
1324	H	35.3	Very low	31.4	Very low	149 Å²	149	134.7 Å²	134.7	69%	0.69	75%	0.748	S	S	*	*			cis	-144.4	-143.1	7.1	-139.3	49.1	0	0	0	109.8
1325	H	34.9	Very low	31.6	Very low	160 Å²	160	135.8 Å²	135.8	74%	0.741	74%	0.738	S	S	*	*			cis	-160.1	161.5	10.8	-143	-63	0	0	0	112.6
1326	S	33.7	Very low	31.6	Very low	75 Å²	75	138.3 Å²	138.3	52%	0.524	74%	0.744	S	S	.	*			trans	-65.1	172.3	173.8	61.9	0	0	0	0	117.7
1327	D	32	Very low	32	Very low	132 Å²	132	143 Å²	143	71%	0.706	75%	0.747	S	S	*	*			cis	-176	131.6	-29	-94.2	-55.3	0	0	0	108.9
1328	V	30.4	Very low	32.3	Very low	135 Å²	135	143.4 Å²	143.4	82%	0.818	75%	0.746	S	S	*	*	S	Bend	trans	-155.1	147.1	161	-152.4	0	0	0	0	111.4
1329	L	33	Very low	32.5	Very low	148 Å²	148	141.4 Å²	141.4	78%	0.775	75%	0.746	S	S	*	*	S	Bend	trans	77	9.4	170.4	-67.7	178.1	0	0	0	119.7	L1332	L1329-L1332 HydrophobicContact CD2-CD1 4.44Å
1330	T	34.3	Very low	32.4	Very low	132 Å²	132	142.7 Å²	142.7	81%	0.81	76%	0.757	S	S	*	*	S	Bend	trans	-102.6	31.4	158	41.1	0	0	0	0	112.7
1331	Q	30.2	Very low	32.7	Very low	127 Å²	127	138.3 Å²	138.3	59%	0.593	75%	0.749	S	S	*	*			trans	-145.2	66.2	-175.7	-163.1	164.6	14.2	0	0	112.2	E1335	Q1331-E1335 HydrophobicContact CG-CB 4.43Å; Q1331-E1335 HydrophobicContact CG-CG 3.77Å
1332	L	32	Very low	32.9	Very low	148 Å²	148	139.2 Å²	139.2	78%	0.775	75%	0.754	S	S	*	*	S	Bend	trans	-150.2	22.4	-179.5	-125.7	151.9	0	0	0	116.3	L1329	L1329-L1332 HydrophobicContact CD2-CD1 4.44Å
1333	D	34.7	Very low	33	Very low	161 Å²	161	136.1 Å²	136.1	86%	0.861	75%	0.747	S	S	*	*	S	Bend	trans	-142.9	-0.4	159.5	-151.3	26.7	0	0	0	114.1
1334	S	35.2	Very low	33.2	Very low	114 Å²	114	138.3 Å²	138.3	80%	0.797	75%	0.752	S	S	*	*	S	Bend	trans	-102.9	-2.5	176.5	-54.6	0	0	0	0	114.1
1335	E	35.4	Very low	33.1	Very low	114 Å²	114	136.8 Å²	136.8	53%	0.533	76%	0.759	S	S	.	*	S	Bend	trans	-123	34	-167.6	-83.9	-69	178.6	0	0	113.8	Q1331	Q1331-E1335 HydrophobicContact CG-CB 4.43Å; Q1331-E1335 HydrophobicContact CG-CG 3.77Å
1336	L	32.5	Very low	33	Very low	169 Å²	169	133.4 Å²	133.4	89%	0.885	76%	0.758	S	S	*	*	S	Bend	trans	-118.6	22.7	170.4	-107.5	169.7	0	0	0	113.3
1337	R	34.9	Very low	33	Very low	228 Å²	228	135.5 Å²	135.5	86%	0.86	77%	0.773	S	S	*	*	S	Bend	trans	-136.8	83.1	174.8	-70.7	-175.4	177.3	177.4	0.2	112.1
1338	K	33.1	Very low	33.6	Very low	184 Å²	184	134.8 Å²	134.8	80%	0.8	78%	0.775	S	S	*	*			trans	76.1	140.5	170.3	-51.2	172.1	-176.9	178.8	0	113.1
1339	V	32.1	Very low	34	Very low	133 Å²	133	133.3 Å²	133.3	81%	0.806	77%	0.771	S	S	*	*			cis	-161.3	149.6	3.6	-112.3	0	0	0	0	110.7
1340	S	33.2	Very low	34	Very low	131 Å²	131	132 Å²	132	92%	0.916	77%	0.769	S	S	*	*			trans	-166.2	125.1	130.1	-163.5	0	0	0	0	111.5
1341	G	31.5	Very low	33.9	Very low	60 Å²	60	131.9 Å²	131.9	62%	0.619	77%	0.768	S	S	*	*			cis	176.6	154.2	-9.3	0	0	0	0	0	114.6
1342	V	30.4	Very low	34	Very low	140 Å²	140	130.8 Å²	130.8	85%	0.848	77%	0.77	S	S	*	*	S	Bend	trans	-137.5	107.4	150	175.5	0	0	0	0	108
1343	S	34.6	Very low	33.9	Very low	91 Å²	91	131.7 Å²	131.7	64%	0.636	77%	0.77	S	S	*	*			trans	51.2	97.9	145.8	-54.3	0	0	0	0	123.1
1344	H	34.2	Very low	33.7	Very low	173 Å²	173	127.9 Å²	127.9	80%	0.801	76%	0.756	S	S	*	*				77	134.8	115.2	-60	-52.7	0	0	0	124.9
1345	S	32.7	Very low	33.5	Very low	118 Å²	118	129.5 Å²	129.5	83%	0.825	76%	0.755	S	S	*	*			trans	81.7	139.4	145.7	73.3	0	0	0	0	119.8
1346	A	33.8	Very low	33.3	Very low	88 Å²	88	129.4 Å²	129.4	73%	0.727	76%	0.762	S	S	*	*			cis	-161.1	142.4	-17	0	0	0	0	0	114.9
1347	S	33	Very low	33.3	Very low	119 Å²	119	126 Å²	126	83%	0.832	75%	0.752	S	S	*	*			trans	77.6	152.9	142.7	-62.8	0	0	0	0	123.2
1348	P	45.2	Very low	32.9	Very low	117 Å²	117	122.2 Å²	122.2	76%	0.76	75%	0.747	S	S	*	*			trans	-136.6	-165.8	-158.4	43.5	-23.1	0	0	0	114.4
1349	S	37.3	Very low	32.8	Very low	104 Å²	104	116.4 Å²	116.4	73%	0.727	73%	0.727	S	S	*	*			trans	162.5	149	143.8	-77.6	0	0	0	0	111.4
1350	T	33.9	Very low	33	Very low	120 Å²	120	114 Å²	114	74%	0.736	71%	0.714	S	S	*	*			cis	-168.4	166.4	-15.2	22.4	0	0	0	0	109.7
1351	V	32.4	Very low	32.8	Very low	131 Å²	131	113.7 Å²	113.7	79%	0.794	70%	0.698	S	S	*	*			trans	74.8	134	145.8	149	0	0	0	0	119.2
1352	V	31.3	Very low	32.7	Very low	103 Å²	103	114.1 Å²	114.1	62%	0.624	69%	0.688	S	S	*	*			cis	-168.8	145.3	-13.6	87	0	0	0	0	113
1353	E	30.3	Very low	32.7	Very low	167 Å²	167	111.5 Å²	111.5	78%	0.78	67%	0.669	S	S	*	*			trans	52.1	158.9	146.4	-72.4	168.3	159.7	0	0	123.4
1354	S	30.9	Very low	32.8	Very low	82 Å²	82	111.3 Å²	111.3	57%	0.573	67%	0.665	S	S	*	*			cis	-162.2	140.2	-5.7	-110.4	0	0	0	0	111.5
1355	L	29.9	Very low	32.6	Very low	148 Å²	148	110.9 Å²	110.9	78%	0.775	67%	0.668	S	S	*	*				74.5	145.9	85	-63.1	-175.6	0	0	0	117.1
1356	T	31.8	Very low	32.5	Very low	111 Å²	111	109.6 Å²	109.6	68%	0.681	67%	0.665	S	S	*	*			cis	179.2	162	-35.7	26.1	0	0	0	0	113.2
1357	S	32	Very low	32.3	Very low	97 Å²	97	110.5 Å²	110.5	68%	0.678	67%	0.665	S	S	*	*			trans	56.5	177.3	150.1	63.2	0	0	0	0	120.4
1358	M	27.8	Very low	32.1	Very low	150 Å²	150	113.3 Å²	113.3	74%	0.739	67%	0.665	S	S	*	*			cis	-135.2	-179.7	1.5	-74.6	-94.3	91.1	0	0	109
1359	T	30.8	Very low	31.4	Very low	62 Å²	62	113.2 Å²	113.2	38%	0.38	66%	0.662	S	S	.	*			cis	79	159.3	8.2	63.4	0	0	0	0	119.2	L1192	L1192-T1359 HydrophobicContact CD2-CG2 3.89Å
1360	P	36	Very low	31	Very low	82 Å²	82	114.3 Å²	114.3	53%	0.532	66%	0.664	S	S	.	*			cis	-121.3	-140.2	-9.6	41.4	-21.3	0	0	0	111.5	S1194 N1195	S1194-P1360 VanDerWaalsContact CB-C 3.42Å; S1194-P1360 WeakPolarHBondContact OG-CA 3.41Å; S1194-P1360 PolarHBondContact OG-O 2.84Å; N1195-P1360 PolarHBondContact OD1-O 3.19Å; N1195-P1360 VanDerWaalsContact OD1-O 3.05Å
1361	Q	29.6	Very low	31.2	Very low	125 Å²	125	114 Å²	114	58%	0.584	66%	0.664	S	S	*	*			cis	-156.9	123.5	-26.9	-130.6	-138.6	98.5	0	0	113.4	N1195	N1195-Q1361 VanDerWaalsContact CA-C 3.44Å; N1195-Q1361 PolarHBondContact OD1-N 3.23Å; N1195-Q1361 PolarHBondContact OD1-O 3.48Å; N1195-Q1361 VanDerWaalsContact OD1-O 3.04Å
1362	T	29	Very low	31	Very low	68 Å²	68	112.4 Å²	112.4	42%	0.417	66%	0.664	S	S	.	*			trans	64.5	159.1	137.5	-34.6	0	0	0	0	127	S1196 S1197	S1196-T1362 CarbonylContact C-O 3.2Å; S1196-T1362 VanDerWaalsContact C-O 3.27Å; S1196-T1362 WeakPolarHBondContact CA-O 3.35Å; S1197-T1362 WeakPolarHBondContact CA-O 3.39Å; S1197-T1362 PolarHBondContact N-O 2.98Å
1363	I	30.1	Very low	31.1	Very low	85 Å²	85	112.6 Å²	112.6	44%	0.436	67%	0.67	S	S	.	*			trans	108.7	158.1	148.6	21.5	-176.3	0	0	0	123.1	S1196 S1197	S1196-I1363 CarbonylContact C-O 3.6Å; S1197-I1363 PolarHBondContact N-O 2.98Å; S1197-I1363 VanDerWaalsContact N-O 3.17Å; S1197-I1363 CarbonylContact O-C 3.55Å; S1197-I1363 VanDerWaalsContact O-C 3.24Å
1364	P	36.1	Very low	31	Very low	88 Å²	88	112.4 Å²	112.4	57%	0.571	67%	0.673	S	S	*	*				-147.7	-164.5	-126.7	48.9	-26	0	0	0	121.2
1365	L	31.3	Very low	31	Very low	163 Å²	163	111.7 Å²	111.7	85%	0.853	68%	0.678	S	S	*	*				134.9	130.8	126.5	-145.1	81.4	0	0	0	120.7
1366	A	30.7	Very low	31.1	Very low	91 Å²	91	114.2 Å²	114.2	75%	0.752	69%	0.686	S	S	*	*			trans	63	157.8	155.8	0	0	0	0	0	121
1367	C	29.4	Very low	30.8	Very low	108 Å²	108	113.2 Å²	113.2	73%	0.73	69%	0.689	S	S	*	*			cis	-160.7	150.5	2.7	-149.1	0	0	0	0	114
1368	Q	28.9	Very low	31.2	Very low	178 Å²	178	115 Å²	115	83%	0.832	70%	0.698	S	S	*	*			trans	56.9	154.5	155.9	-82	-172.2	39.5	0	0	121.2
1369	T	28.9	Very low	31.3	Very low	114 Å²	114	112 Å²	112	70%	0.699	70%	0.698	S	S	*	*			cis	-150.7	166.2	2.5	-102.9	0	0	0	0	112.5
1370	V	30.8	Very low	31.3	Very low	127 Å²	127	114.9 Å²	114.9	77%	0.77	72%	0.715	S	S	*	*			trans	-87.4	-173.9	-176.7	-91.8	0	0	0	0	114.5
1371	P	37	Very low	30.9	Very low	114 Å²	114	115.6 Å²	115.6	74%	0.74	71%	0.714	S	S	*	*			cis	-138.2	178.2	-2.4	34.4	-12.6	0	0	0	118.5
1372	A	29.5	Very low	30.9	Very low	97 Å²	97	113.6 Å²	113.6	80%	0.802	72%	0.718	S	S	*	*			trans	70.9	153.7	142.8	0	0	0	0	0	121.8
1373	S	32.4	Very low	30.9	Very low	107 Å²	107	114.7 Å²	114.7	75%	0.748	73%	0.734	S	S	*	*			cis	-171.6	171.3	-25.3	-169.2	0	0	0	0	110.5
1374	I	28.6	Very low	30.9	Very low	163 Å²	163	114.5 Å²	114.5	84%	0.836	75%	0.745	S	S	*	*			trans	73.1	136.5	170.3	-47.7	168.2	0	0	0	115.2
1375	G	31.5	Very low	30.7	Very low	67 Å²	67	119.3 Å²	119.3	69%	0.691	76%	0.76	S	S	*	*			cis	158.3	167.5	-11.9	0	0	0	0	0	115.6
1376	Q	30.6	Very low	30.7	Very low	201 Å²	201	115.5 Å²	115.5	94%	0.939	75%	0.752	S	S	*	*			trans	84	145.5	168.4	-57.3	-167.4	-0.2	0	0	120.7
1377	A	27	Very low	30.8	Very low	90 Å²	90	116 Å²	116	74%	0.744	76%	0.756	S	S	*	*			trans	-142.5	158.3	169	0	0	0	0	0	107.7
1378	P	39.4	Very low	30.8	Very low	134 Å²	134	115.8 Å²	115.8	87%	0.87	76%	0.756	S	S	*	*			trans	-86.3	154.3	-176.5	34	-34.9	0	0	0	113.5
1379	A	30.8	Very low	31	Very low	88 Å²	88	115.3 Å²	115.3	73%	0.727	76%	0.758	S	S	*	*			trans	-151.6	130.9	179.1	0	0	0	0	0	113.6
1380	V	29.1	Very low	31.1	Very low	122 Å²	122	117.4 Å²	117.4	74%	0.739	76%	0.763	S	S	*	*				72.3	116	125.5	175.3	0	0	0	0	120.7
1381	I	27.5	Very low	31.5	Very low	98 Å²	98	116.2 Å²	116.2	50%	0.503	76%	0.758	S	S	.	*			trans	60.4	126.9	146.9	-60	167	0	0	0	117.5	V552	V552-I1381 HydrophobicContact CB-CD1 4.29Å; V552-I1381 HydrophobicContact CG1-CD1 3.81Å; V552-I1381 HydrophobicContact CG2-CD1 3.48Å; V552-I1381 VanDerWaalsContact CG2-CD1 3.48Å; V552-I1381 HydrophobicContact CG2-CG1 3.91Å
1382	A	30.1	Very low	31.2	Very low	82 Å²	82	118 Å²	118	68%	0.678	76%	0.762	S	S	*	*			cis	97.4	146.3	29	0	0	0	0	0	116.7
1383	A	29.4	Very low	31.2	Very low	92 Å²	92	117.8 Å²	117.8	76%	0.76	76%	0.76	S	S	*	*			trans	73.7	152	172.2	0	0	0	0	0	118.4
1384	A	30.9	Very low	31.1	Very low	81 Å²	81	118.3 Å²	118.3	67%	0.669	76%	0.764	S	S	*	*			cis	-173.8	156	-8.6	0	0	0	0	0	114.8
1385	H	31.2	Very low	31.3	Very low	188 Å²	188	116.1 Å²	116.1	87%	0.87	76%	0.757	S	S	*	*			trans	69.3	153.4	146.4	-77.1	-134.5	0	0	0	121.3
1386	A	31.6	Very low	31.4	Very low	83 Å²	83	118.6 Å²	118.6	69%	0.686	76%	0.761	S	S	*	*			cis	-170.7	171	-13.5	0	0	0	0	0	113.5
1387	A	31.7	Very low	31.4	Very low	103 Å²	103	116.7 Å²	116.7	85%	0.851	75%	0.752	S	S	*	*			trans	71	148.9	160.9	0	0	0	0	0	119.6
1388	S	29.9	Very low	31.7	Very low	102 Å²	102	117.4 Å²	117.4	71%	0.713	75%	0.752	S	S	*	*			cis	-167.9	147	-15.1	174.8	0	0	0	0	111
1389	L	32.4	Very low	31.8	Very low	168 Å²	168	115.8 Å²	115.8	88%	0.88	74%	0.742	S	S	*	*			trans	157.3	164.2	145	-84.1	163.2	0	0	0	113.2
1390	I	32.7	Very low	32	Very low	158 Å²	158	116.7 Å²	116.7	81%	0.81	74%	0.742	S	S	*	*			trans	-140.8	177.8	-157.9	5.7	174.4	0	0	0	111
1391	P	38.5	Very low	32.2	Very low	103 Å²	103	120 Å²	120	67%	0.669	74%	0.741	S	S	*	*			cis	-139.5	-178.3	-10.3	36.7	-15.2	0	0	0	118.1
1392	N	29.4	Very low	32.7	Very low	152 Å²	152	120.7 Å²	120.7	81%	0.813	75%	0.746	S	S	*	*			trans	83.9	127.8	144.3	-84.9	10.7	0	0	0	126.1
1393	A	29.6	Very low	32.8	Very low	92 Å²	92	123.3 Å²	123.3	76%	0.76	75%	0.748	S	S	*	*			trans	65.4	144.1	141.2	0	0	0	0	0	121.3
1394	S	31.6	Very low	33.2	Very low	118 Å²	118	123.2 Å²	123.2	83%	0.825	75%	0.748	S	S	*	*			cis	-148.4	169.8	4.3	-84.4	0	0	0	0	112.8
1395	V	32	Very low	33.3	Very low	116 Å²	116	126 Å²	126	70%	0.703	75%	0.747	S	S	*	*			trans	-87.1	165.3	-179.4	-145.3	0	0	0	0	112.9	Q1397	V1395-Q1397 HydrophobicContact CG1-CG 4.45Å
1396	P	33.8	Very low	33.6	Very low	119 Å²	119	124.3 Å²	124.3	77%	0.773	75%	0.75	S	S	*	*				-145.1	167.9	99.9	39	-23.4	0	0	0	116.2
1397	Q	31	Very low	33.7	Very low	161 Å²	161	124.1 Å²	124.1	75%	0.752	76%	0.756	S	S	*	*			trans	-95	-170.9	-179.3	-47.1	94	-82.2	0	0	111.7	V1395	V1395-Q1397 HydrophobicContact CG1-CG 4.45Å
1398	S	33.4	Very low	34.3	Very low	106 Å²	106	125.4 Å²	125.4	74%	0.741	75%	0.747	S	S	*	*			cis	-171.4	-160.5	17.9	60.4	0	0	0	0	108
1399	P	40.4	Very low	34.7	Very low	100 Å²	100	122.9 Å²	122.9	65%	0.649	73%	0.733	S	S	*	*			cis	-142.1	176.2	-12.5	41	-22.7	0	0	0	118.1
1400	S	36.1	Very low	35	Very low	106 Å²	106	116.9 Å²	116.9	74%	0.741	71%	0.711	S	S	*	*			trans	76.6	168.1	144	80.2	0	0	0	0	118.6
1401	R	33.8	Very low	35.6	Very low	191 Å²	191	114.1 Å²	114.1	72%	0.721	70%	0.698	S	S	*	*			cis	-157.7	157.8	10.7	-152	178.3	93.3	-103.5	5.2	112.2
1402	L	36.6	Very low	36.2	Very low	113 Å²	113	115.1 Å²	115.1	59%	0.592	69%	0.693	S	S	*	*			trans	69.5	164.6	172.4	-52.8	-168.1	0	0	0	114.4
1403	D	33.5	Very low	37.3	Very low	138 Å²	138	114.8 Å²	114.8	74%	0.738	69%	0.687	S	S	*	*			cis	-168.2	160	-26.3	-96.4	-8.4	0	0	0	106.1
1404	A	37.6	Very low	38.5	Very low	90 Å²	90	117.4 Å²	117.4	74%	0.744	68%	0.681	S	S	*	*			cis	-156.9	178.7	-15	0	0	0	0	0	107.7
1405	E	33.5	Very low	39.8	Very low	140 Å²	140	117.3 Å²	117.3	65%	0.654	67%	0.671	S	S	*	*			trans	-137.9	157.4	-156.3	-59.1	-175.6	87.5	0	0	117.8
1406	T	37.3	Very low	41.1	Very low	152 Å²	152	116.5 Å²	116.5	93%	0.933	66%	0.659	S	S	*	*	S	Bend	trans	-157.7	118.8	134.2	14.8	0	0	0	0	109.2
1407	G	33.5	Very low	42.7	Very low	78 Å²	78	113.5 Å²	113.5	80%	0.804	64%	0.644	S	S	*	*	S	Bend	trans	153	-25.5	170.5	0	0	0	0	0	118.6
1408	L	43.4	Very low	44.1	Very low	130 Å²	130	111.7 Å²	111.7	68%	0.681	64%	0.639	S	S	*	*	S	Bend	trans	-133.4	-11.6	-176.5	-96.7	167.8	0	0	0	116.3	G1410 L1411	L1408-G1410 PolarHBondContact O-N 3.1Å; L1408-G1410 VanDerWaalsContact O-N 3.07Å; L1408-L1411 HydrophobicContact CD2-CD1 3.98Å; L1408-L1411 PolarHBondContact O-N 3.49Å; L1408-L1411 VanDerWaalsContact O-N 3.08Å
1409	A	37.9	Very low	45.9	Very low	50 Å²	50	113 Å²	113	41%	0.413	63%	0.632	S	S	.	*	G	3₁₀ helix	trans	-50.1	-36.6	-176.7	0	0	0	0	0	115.3	L1411 H1412 E1413	A1409-L1411 PolarHBondContact O-N 2.88Å; A1409-H1412 PolarHBondContact O-N 3.04Å; A1409-E1413 PolarHBondContact O-N 2.89Å
1410	G	39.7	Very low	46.9	Very low	41 Å²	41	114.3 Å²	114.3	42%	0.423	63%	0.631	S	S	.	*	G	3₁₀ helix	trans	-68	-1.3	-179.3	0	0	0	0	0	115.8	L1408 K1414	L1408-G1410 PolarHBondContact O-N 3.1Å; L1408-G1410 VanDerWaalsContact O-N 3.07Å; G1410-K1414 WeakPolarHBondContact O-CB 3.36Å; G1410-K1414 WeakPolarHBondContact O-CD 3.35Å; G1410-K1414 VanDerWaalsContact O-CG 3.26Å; G1410-K1414 WeakPolarHBondContact O-CG 3.43Å
1411	L	45.3	Very low	48.3	Very low	100 Å²	100	112 Å²	112	52%	0.524	61%	0.608	S	S	.	*	G	3₁₀ helix	trans	-93.4	-33.3	173.5	-109.8	169.2	0	0	0	113.3	L1408 A1409 K1414 L1415	L1408-L1411 HydrophobicContact CD2-CD1 3.98Å; L1408-L1411 PolarHBondContact O-N 3.49Å; L1408-L1411 VanDerWaalsContact O-N 3.08Å; A1409-L1411 PolarHBondContact O-N 2.88Å; L1411-K1414 PolarHBondContact O-N 2.91Å; L1411-L1415 HydrophobicContact CD2-CD1 4.47Å; L1411-L1415 PolarHBondContact O-N 3.36Å
1412	H	49.9	Very low	49.4	Very low	125 Å²	125	108 Å²	108	58%	0.579	60%	0.598	S	S	*	*	H	α-helix	trans	-68.3	-48.6	171.4	-162.8	-81.5	0	0	0	109.7	A1409 K1414 L1415 E1416	A1409-H1412 PolarHBondContact O-N 3.04Å; H1412-K1414 PolarHBondContact O-N 3.22Å; H1412-L1415 PolarHBondContact O-N 2.87Å; H1412-E1416 IonicContact CE1-OE1 3.51Å; H1412-E1416 IonicContact CE1-OE2 2.75Å; H1412-E1416 PolarHBondContact CE1-OE2 3.46Å; H1412-E1416 IonicContact ND1-OE2 3.6Å; H1412-E1416 PolarHBondContact ND1-OE2 2.83Å; H1412-E1416 WeakPolarHBondContact O-CB 3.47Å; H1412-E1416 PolarHBondContact O-N 3.48Å
1413	E	52.4	Low	50.2	Low	145 Å²	145	106.8 Å²	106.8	68%	0.678	59%	0.592	S	S	*	*	H	α-helix	trans	-57.9	-33.7	176.6	-169.8	178.9	-157	0	0	112	A1409 A1417	A1409-E1413 PolarHBondContact O-N 2.89Å; E1413-A1417 WeakPolarHBondContact O-CB 3.15Å; E1413-A1417 PolarHBondContact O-N 3.12Å
1414	K	56.7	Low	51.1	Low	146 Å²	146	106.6 Å²	106.6	64%	0.635	58%	0.581	S	S	*	*	H	α-helix	trans	-74.6	-37.9	172.6	-81.4	178.7	-179.8	174.1	0	114.1	G1410 L1411 H1412 E1416 L1418	G1410-K1414 WeakPolarHBondContact O-CB 3.36Å; G1410-K1414 WeakPolarHBondContact O-CD 3.35Å; G1410-K1414 VanDerWaalsContact O-CG 3.26Å; G1410-K1414 WeakPolarHBondContact O-CG 3.43Å; L1411-K1414 PolarHBondContact O-N 2.91Å; H1412-K1414 PolarHBondContact O-N 3.22Å; K1414-E1416 VanDerWaalsContact C-N 3.31Å; K1414-L1418 VanDerWaalsContact O-CB 3.25Å; K1414-L1418 WeakPolarHBondContact O-CB 3.32Å; K1414-L1418 WeakPolarHBondContact O-CD1 3.3Å; K1414-L1418 VanDerWaalsContact O-CG 3.25Å; K1414-L1418 WeakPolarHBondContact O-CG 3.4Å; K1414-L1418 PolarHBondContact O-N 2.98Å
1415	L	58.4	Low	51.8	Low	117 Å²	117	111 Å²	111	61%	0.613	58%	0.578	S	S	*	*	H	α-helix	trans	-65.4	-38.7	173	-118.1	78	0	0	0	111.2	L1411 H1412 L1418 K1419	L1411-L1415 HydrophobicContact CD2-CD1 4.47Å; L1411-L1415 PolarHBondContact O-N 3.36Å; H1412-L1415 PolarHBondContact O-N 2.87Å; L1415-L1418 PolarHBondContact O-N 3.01Å; L1415-K1419 VanDerWaalsContact O-CB 3.29Å; L1415-K1419 WeakPolarHBondContact O-CB 3.34Å; L1415-K1419 PolarHBondContact O-N 2.89Å
1416	E	58.7	Low	52.6	Low	98 Å²	98	111.2 Å²	111.2	46%	0.458	58%	0.579	S	S	.	*	H	α-helix	trans	-78.8	-34.6	-176.9	-161.5	153.5	-133.7	0	0	111.5	H1412 K1414 K1419 M1420	H1412-E1416 IonicContact CE1-OE1 3.51Å; H1412-E1416 IonicContact CE1-OE2 2.75Å; H1412-E1416 PolarHBondContact CE1-OE2 3.46Å; H1412-E1416 IonicContact ND1-OE2 3.6Å; H1412-E1416 PolarHBondContact ND1-OE2 2.83Å; H1412-E1416 WeakPolarHBondContact O-CB 3.47Å; H1412-E1416 PolarHBondContact O-N 3.48Å; K1414-E1416 VanDerWaalsContact C-N 3.31Å; E1416-K1419 PolarHBondContact O-N 2.79Å; E1416-M1420 WeakPolarHBondContact O-CB 3.28Å; E1416-M1420 WeakPolarHBondContact O-CG 3.32Å; E1416-M1420 PolarHBondContact O-N 3.27Å
1417	A	66.7	Low	53.1	Low	56 Å²	56	110.8 Å²	110.8	46%	0.463	57%	0.571	S	S	.	*	H	α-helix	trans	-69.9	-35	166.9	0	0	0	0	0	112.8	E1413 E1421	E1413-A1417 WeakPolarHBondContact O-CB 3.15Å; E1413-A1417 PolarHBondContact O-N 3.12Å; A1417-E1421 VanDerWaalsContact O-CB 3.24Å; A1417-E1421 WeakPolarHBondContact O-CB 3.43Å; A1417-E1421 PolarHBondContact O-N 2.91Å
1418	L	61.8	Low	53.5	Low	123 Å²	123	113.5 Å²	113.5	64%	0.644	57%	0.565	S	S	*	*	H	α-helix	trans	-66.5	-39.8	170.7	-81.7	167.2	0	0	0	111.4	K1414 L1415 E1421 Q1422	K1414-L1418 VanDerWaalsContact O-CB 3.25Å; K1414-L1418 WeakPolarHBondContact O-CB 3.32Å; K1414-L1418 WeakPolarHBondContact O-CD1 3.3Å; K1414-L1418 VanDerWaalsContact O-CG 3.25Å; K1414-L1418 WeakPolarHBondContact O-CG 3.4Å; K1414-L1418 PolarHBondContact O-N 2.98Å; L1415-L1418 PolarHBondContact O-N 3.01Å; L1418-E1421 PolarHBondContact O-N 2.87Å; L1418-Q1422 WeakPolarHBondContact O-CB 3.41Å; L1418-Q1422 PolarHBondContact O-N 2.78Å
1419	K	69.9	Low	53.1	Low	134 Å²	134	110.6 Å²	110.6	58%	0.583	57%	0.566	S	S	*	*	H	α-helix	trans	-67.4	-44	175.4	-169.3	175	179.8	-175.4	0	111.7	L1415 E1416 E1421 Q1422 D1423	L1415-K1419 VanDerWaalsContact O-CB 3.29Å; L1415-K1419 WeakPolarHBondContact O-CB 3.34Å; L1415-K1419 PolarHBondContact O-N 2.89Å; E1416-K1419 PolarHBondContact O-N 2.79Å; K1419-E1421 PolarHBondContact O-N 2.84Å; K1419-Q1422 WeakPolarHBondContact O-CB 3.43Å; K1419-Q1422 PolarHBondContact O-N 3.43Å; K1419-Q1422 VanDerWaalsContact O-N 3.13Å; K1419-D1423 PolarHBondContact O-N 2.81Å
1420	M	62.2	Low	52.9	Low	128 Å²	128	115.9 Å²	115.9	63%	0.631	59%	0.587	S	S	*	*	H	α-helix	trans	-64	-36.7	171.9	-76.2	-168.6	-177	0	0	112.4	E1416 Q1422 R1424	E1416-M1420 WeakPolarHBondContact O-CB 3.28Å; E1416-M1420 WeakPolarHBondContact O-CG 3.32Å; E1416-M1420 PolarHBondContact O-N 3.27Å; M1420-Q1422 VanDerWaalsContact C-N 3.25Å; M1420-Q1422 PolarHBondContact O-N 2.79Å; M1420-R1424 WeakPolarHBondContact O-CA 3.36Å; M1420-R1424 WeakPolarHBondContact O-CB 3.42Å; M1420-R1424 PolarHBondContact O-N 2.86Å
1421	E	65.3	Low	52.7	Low	58 Å²	58	121.9 Å²	121.9	27%	0.271	61%	0.61	S	S	.	*	H	α-helix	trans	-74.7	-15.1	174.8	-178.7	56.3	-163.6	0	0	112.8	A1417 L1418 K1419 R1424 R1425	A1417-E1421 VanDerWaalsContact O-CB 3.24Å; A1417-E1421 WeakPolarHBondContact O-CB 3.43Å; A1417-E1421 PolarHBondContact O-N 2.91Å; L1418-E1421 PolarHBondContact O-N 2.87Å; K1419-E1421 PolarHBondContact O-N 2.84Å; E1421-R1424 VanDerWaalsContact CD-NH2 3.28Å; E1421-R1424 IonicContact OE1-NH2 3.07Å; E1421-R1424 PolarHBondContact OE1-NH2 3.33Å; E1421-R1424 VanDerWaalsContact OE1-NH2 3.07Å; E1421-R1424 IonicContact OE2-CZ 3.24Å; E1421-R1424 VanDerWaalsContact OE2-CZ 3.24Å; E1421-R1424 IonicContact OE2-NE 2.95Å; E1421-R1424 PolarHBondContact OE2-NE 3.02Å; E1421-R1424 IonicContact OE2-NH2 2.71Å; E1421-R1424 PolarHBondContact OE2-NH2 3.24Å; E1421-R1425 WeakPolarHBondContact O-CD 3.34Å; E1421-R1425 WeakPolarHBondContact O-CG 3.4Å; E1421-R1425 PolarHBondContact O-NE 3.09Å; E1421-R1425 IonicContact OE1-CZ 3.21Å; E1421-R1425 IonicContact OE1-NE 2.81Å; E1421-R1425 PolarHBondContact OE1-NE 3.18Å; E1421-R1425 IonicContact OE1-NH2 2.75Å; E1421-R1425 PolarHBondContact OE1-NH2 3.41Å
1422	Q	57.3	Low	52.2	Low	107 Å²	107	120.8 Å²	120.8	50%	0.5	62%	0.615	S	S	.	*	H	α-helix	trans	-81.7	-54.3	166.1	-174.7	168.9	-6.4	0	0	111.1	L1418 K1419 M1420 R1424 R1425 E1426	L1418-Q1422 WeakPolarHBondContact O-CB 3.41Å; L1418-Q1422 PolarHBondContact O-N 2.78Å; K1419-Q1422 WeakPolarHBondContact O-CB 3.43Å; K1419-Q1422 PolarHBondContact O-N 3.43Å; K1419-Q1422 VanDerWaalsContact O-N 3.13Å; M1420-Q1422 VanDerWaalsContact C-N 3.25Å; M1420-Q1422 PolarHBondContact O-N 2.79Å; Q1422-R1424 VanDerWaalsContact C-N 3.27Å; Q1422-R1424 PolarHBondContact O-N 3.03Å; Q1422-R1425 WeakPolarHBondContact O-CA 3.48Å; Q1422-R1425 WeakPolarHBondContact O-CB 3.32Å; Q1422-R1425 PolarHBondContact O-N 2.78Å; Q1422-E1426 PolarHBondContact NE2-OE1 3.5Å; Q1422-E1426 PolarHBondContact O-N 3.06Å
1423	D	53.9	Low	51.4	Low	87 Å²	87	123.2 Å²	123.2	47%	0.465	63%	0.631	S	S	.	*	H	α-helix	trans	-56.2	-41.2	177	-66.5	-25.8	0	0	0	111	K1419 R1425 E1426 D1427	K1419-D1423 PolarHBondContact O-N 2.81Å; D1423-R1425 PolarHBondContact O-N 3.09Å; D1423-E1426 PolarHBondContact O-N 2.87Å; D1423-D1427 PolarHBondContact O-N 3.35Å
1424	R	52.2	Low	50.5	Low	134 Å²	134	119.1 Å²	119.1	51%	0.506	63%	0.627	S	S	.	*	H	α-helix	trans	-75.3	2.6	176.7	-158.8	-156	63.4	62.8	1.4	114.1	M1420 E1421 Q1422	M1420-R1424 WeakPolarHBondContact O-CA 3.36Å; M1420-R1424 WeakPolarHBondContact O-CB 3.42Å; M1420-R1424 PolarHBondContact O-N 2.86Å; E1421-R1424 VanDerWaalsContact CD-NH2 3.28Å; E1421-R1424 IonicContact OE1-NH2 3.07Å; E1421-R1424 PolarHBondContact OE1-NH2 3.33Å; E1421-R1424 VanDerWaalsContact OE1-NH2 3.07Å; E1421-R1424 IonicContact OE2-CZ 3.24Å; E1421-R1424 VanDerWaalsContact OE2-CZ 3.24Å; E1421-R1424 IonicContact OE2-NE 2.95Å; E1421-R1424 PolarHBondContact OE2-NE 3.02Å; E1421-R1424 IonicContact OE2-NH2 2.71Å; E1421-R1424 PolarHBondContact OE2-NH2 3.24Å; Q1422-R1424 VanDerWaalsContact C-N 3.27Å; Q1422-R1424 PolarHBondContact O-N 3.03Å
1425	R	51.7	Low	49.3	Very low	181 Å²	181	118.7 Å²	118.7	68%	0.683	64%	0.637	S	S	*	*	H	α-helix	trans	-104.4	-16.5	165.1	-73.8	172.6	-171.6	-165.9	4.5	112.7	E1421 Q1422 D1423	E1421-R1425 WeakPolarHBondContact O-CD 3.34Å; E1421-R1425 WeakPolarHBondContact O-CG 3.4Å; E1421-R1425 PolarHBondContact O-NE 3.09Å; E1421-R1425 IonicContact OE1-CZ 3.21Å; E1421-R1425 IonicContact OE1-NE 2.81Å; E1421-R1425 PolarHBondContact OE1-NE 3.18Å; E1421-R1425 IonicContact OE1-NH2 2.75Å; E1421-R1425 PolarHBondContact OE1-NH2 3.41Å; Q1422-R1425 WeakPolarHBondContact O-CA 3.48Å; Q1422-R1425 WeakPolarHBondContact O-CB 3.32Å; Q1422-R1425 PolarHBondContact O-N 2.78Å; D1423-R1425 PolarHBondContact O-N 3.09Å
1426	E	49.9	Very low	48.1	Very low	146 Å²	146	119 Å²	119	68%	0.682	64%	0.644	S	S	*	*	H	α-helix	trans	-97.9	-17.8	178.1	-64.4	178.9	-154.6	0	0	111.9	Q1422 D1423	Q1422-E1426 PolarHBondContact NE2-OE1 3.5Å; Q1422-E1426 PolarHBondContact O-N 3.06Å; D1423-E1426 PolarHBondContact O-N 2.87Å
1427	D	49.1	Very low	46.9	Very low	142 Å²	142	120.1 Å²	120.1	76%	0.759	66%	0.657	S	S	*	*	S	Bend	trans	-111.9	48.1	-179.8	-162.4	29.7	0	0	0	114.9	D1423	D1423-D1427 PolarHBondContact O-N 3.35Å
1428	M	41.5	Very low	45.4	Very low	136 Å²	136	123.2 Å²	123.2	67%	0.67	67%	0.671	S	S	*	*			trans	-140.2	91	160.7	-89.6	-162.5	170.6	0	0	110.1
1429	G	34.6	Very low	44.1	Very low	69 Å²	69	124.5 Å²	124.5	71%	0.711	68%	0.679	S	S	*	*			trans	-78.2	166.7	179.3	0	0	0	0	0	115.2
1430	D	33.4	Very low	42.5	Very low	161 Å²	161	121 Å²	121	86%	0.861	68%	0.68	S	S	*	*			trans	29.7	109.3	147.9	-56	-28.4	0	0	0	119.3
1431	D	35	Very low	41.4	Very low	167 Å²	167	124 Å²	124	89%	0.893	69%	0.689	S	S	*	*				-162.4	167.6	112.7	-129.4	-35.2	0	0	0	113.3
1432	A	34.9	Very low	40.3	Very low	77 Å²	77	127.5 Å²	127.5	64%	0.636	71%	0.71	S	S	*	*	S	Bend	trans	74.2	76	166.5	0	0	0	0	0	120.6
1433	I	34.1	Very low	39.9	Very low	176 Å²	176	131.8 Å²	131.8	90%	0.903	73%	0.73	S	S	*	*				57.4	119.6	122	-56.4	152.3	0	0	0	118.7
1434	G	32.5	Very low	39.7	Very low	59 Å²	59	129.7 Å²	129.7	61%	0.608	72%	0.718	S	S	*	*			cis	166.1	179.6	-2.9	0	0	0	0	0	114.5
1435	T	32.8	Very low	39.8	Very low	137 Å²	137	127.5 Å²	127.5	84%	0.84	72%	0.722	S	S	*	*			trans	66.2	127.5	178.5	68.1	0	0	0	0	117
1436	T	33.1	Very low	40.1	Very low	122 Å²	122	124.1 Å²	124.1	75%	0.748	72%	0.716	S	S	*	*			cis	-158.7	134.7	-10.6	16.2	0	0	0	0	109.6
1437	T	33.1	Very low	40.8	Very low	122 Å²	122	124.9 Å²	124.9	75%	0.748	73%	0.725	S	S	*	*			trans	12.5	140.3	144.4	56.4	0	0	0	0	119.5
1438	T	34.1	Very low	41.9	Very low	121 Å²	121	121.1 Å²	121.1	74%	0.742	71%	0.707	S	S	*	*			cis	-170.4	176.9	0.4	17.4	0	0	0	0	106
1439	D	35.4	Very low	42.8	Very low	151 Å²	151	122.2 Å²	122.2	81%	0.807	72%	0.715	S	S	*	*			cis	-152.3	173.8	3.8	-105.2	-42.9	0	0	0	106.8
1440	G	36.7	Very low	44.5	Very low	59 Å²	59	125.5 Å²	125.5	61%	0.608	71%	0.709	S	S	*	*			cis	147.7	73.8	-0.4	0	0	0	0	0	113.1
1441	K	38.6	Very low	46.5	Very low	192 Å²	192	118 Å²	118	84%	0.835	67%	0.669	S	S	*	*			trans	-172.1	88.8	159.2	-112.3	160.2	-172.9	167.1	0	116.3
1442	D	42.7	Very low	48	Very low	131 Å²	131	114.2 Å²	114.2	70%	0.701	65%	0.649	S	S	*	*			trans	50.3	87.4	131.2	-37	-29.2	0	0	0	120
1443	E	48.3	Very low	49.7	Very low	197 Å²	197	113.2 Å²	113.2	92%	0.921	64%	0.641	S	S	*	*			trans	-73.7	142.8	153.5	-66.9	-173	123	0	0	110.6
1444	I	50.1	Low	51.4	Low	43 Å²	43	108.9 Å²	108.9	22%	0.221	62%	0.617	C	S	.	*			trans	-93.5	129.2	175	-68.8	175.7	0	0	0	109.5	I1446 G1451 E1454 K1458	I1444-I1446 PolarHBondContact O-N 2.85Å; I1444-G1451 VanDerWaalsContact CG2-CA 3.45Å; I1444-E1454 HydrophobicContact CD1-CB 3.91Å; I1444-K1458 HydrophobicContact CD1-CD 3.91Å; I1444-K1458 VanDerWaalsContact CD1-NZ 3.29Å
1445	P	53.5	Low	53	Low	89 Å²	89	107.4 Å²	107.4	58%	0.578	60%	0.599	S	S	*	*			trans	-66.1	103.8	168.2	-19.9	33.1	0	0	0	111.2	D1447 T1448	P1445-D1447 PolarHBondContact O-N 3Å; P1445-T1448 PolarHBondContact O-OG1 2.76Å
1446	I	58.9	Low	54.4	Low	110 Å²	110	105.2 Å²	105.2	56%	0.564	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-23.7	-175.1	-60.5	178	0	0	0	111.8	I1444 T1448	I1444-I1446 PolarHBondContact O-N 2.85Å; I1446-T1448 PolarHBondContact O-N 2.9Å; I1446-T1448 VanDerWaalsContact O-N 3.14Å
1447	D	63.6	Low	56	Low	162 Å²	162	100.9 Å²	100.9	87%	0.866	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-2.8	-175.4	-52.8	-57.5	0	0	0	114.8	P1445	P1445-D1447 PolarHBondContact O-N 3Å
1448	T	72.4	Confident	57.4	Low	62 Å²	62	101.2 Å²	101.2	38%	0.38	55%	0.552	S	S	.	*	S	Bend	trans	-102.6	143.5	174.3	64.3	0	0	0	0	111.4	P1445 I1446 K1450 G1451 L1452	P1445-T1448 PolarHBondContact O-OG1 2.76Å; I1446-T1448 PolarHBondContact O-N 2.9Å; I1446-T1448 VanDerWaalsContact O-N 3.14Å; T1448-K1450 PolarHBondContact O-N 3.28Å; T1448-K1450 VanDerWaalsContact O-N 3.15Å; T1448-G1451 CarbonylContact O-C 3.49Å; T1448-G1451 PolarHBondContact O-N 2.7Å; T1448-G1451 WeakPolarHBondContact OG1-CA 3.3Å; T1448-G1451 PolarHBondContact OG1-N 2.65Å; T1448-L1452 WeakPolarHBondContact O-CB 3.35Å; T1448-L1452 PolarHBondContact O-N 3.33Å
1449	L	61.2	Low	58.2	Low	160 Å²	160	100.8 Å²	100.8	84%	0.838	55%	0.549	S	S	*	.	H	α-helix	trans	-60	-29.4	178.5	-147.6	155.9	0	0	0	111.9	A1453	L1449-A1453 WeakPolarHBondContact O-CB 3.3Å; L1449-A1453 PolarHBondContact O-N 3.09Å; L1449-A1453 VanDerWaalsContact O-N 3.11Å
1450	K	70.6	Confident	58.9	Low	138 Å²	138	99.5 Å²	99.5	60%	0.6	54%	0.541	S	S	*	.	H	α-helix	trans	-69.7	-48.4	169.5	-177.5	178.5	178.2	-65.2	0	112.3	T1448 L1452 A1453 E1454	T1448-K1450 PolarHBondContact O-N 3.28Å; T1448-K1450 VanDerWaalsContact O-N 3.15Å; K1450-L1452 VanDerWaalsContact C-N 3.33Å; K1450-L1452 PolarHBondContact O-N 3.12Å; K1450-A1453 PolarHBondContact O-N 3.45Å; K1450-E1454 WeakPolarHBondContact CE-OE1 3.23Å; K1450-E1454 IonicContact NZ-OE1 2.67Å; K1450-E1454 PolarHBondContact NZ-OE1 3Å; K1450-E1454 IonicContact NZ-OE2 3.74Å; K1450-E1454 PolarHBondContact NZ-OE2 3.21Å; K1450-E1454 WeakPolarHBondContact O-CG 3.47Å; K1450-E1454 PolarHBondContact O-N 2.93Å
1451	G	75	Confident	59.5	Low	2 Å²	2	104 Å²	104	2%	0.021	55%	0.546	C	S	.	.	H	α-helix	trans	-63.2	-37.1	178	0	0	0	0	0	113	I1444 T1448 E1454 A1455	I1444-G1451 VanDerWaalsContact CG2-CA 3.45Å; T1448-G1451 CarbonylContact O-C 3.49Å; T1448-G1451 PolarHBondContact O-N 2.7Å; T1448-G1451 WeakPolarHBondContact OG1-CA 3.3Å; T1448-G1451 PolarHBondContact OG1-N 2.65Å; G1451-E1454 PolarHBondContact O-N 2.84Å; G1451-A1455 VanDerWaalsContact O-CB 3.25Å; G1451-A1455 WeakPolarHBondContact O-CB 3.41Å; G1451-A1455 PolarHBondContact O-N 2.61Å
1452	L	66.1	Low	59.6	Low	88 Å²	88	98.6 Å²	98.6	46%	0.461	54%	0.537	S	S	.	.	H	α-helix	trans	-67.9	-40.1	173	-166.1	151.5	0	0	0	111.5	T1448 K1450 A1455 L1456	T1448-L1452 WeakPolarHBondContact O-CB 3.35Å; T1448-L1452 PolarHBondContact O-N 3.33Å; K1450-L1452 VanDerWaalsContact C-N 3.33Å; K1450-L1452 PolarHBondContact O-N 3.12Å; L1452-A1455 PolarHBondContact O-N 2.88Å; L1452-L1456 HydrophobicContact CD2-CD1 3.67Å; L1452-L1456 HydrophobicContact CD2-CG 4.19Å; L1452-L1456 WeakPolarHBondContact O-CB 3.16Å; L1452-L1456 WeakPolarHBondContact O-CG 3.45Å; L1452-L1456 PolarHBondContact O-N 2.86Å
1453	A	70	Confident	59.2	Low	57 Å²	57	100.4 Å²	100.4	47%	0.471	55%	0.547	S	S	.	.	H	α-helix	trans	-65.4	-37.1	172.6	0	0	0	0	0	112.8	L1449 K1450 G1457	L1449-A1453 WeakPolarHBondContact O-CB 3.3Å; L1449-A1453 PolarHBondContact O-N 3.09Å; L1449-A1453 VanDerWaalsContact O-N 3.11Å; K1450-A1453 PolarHBondContact O-N 3.45Å; A1453-G1457 PolarHBondContact O-N 3.45Å
1454	E	70.1	Confident	58.4	Low	85 Å²	85	94.4 Å²	94.4	40%	0.397	54%	0.537	S	S	.	.	H	α-helix	trans	-74.5	-33.4	175.8	-74.2	173.1	-177	0	0	112.4	I1444 K1450 G1451 G1457 K1458	I1444-E1454 HydrophobicContact CD1-CB 3.91Å; K1450-E1454 WeakPolarHBondContact CE-OE1 3.23Å; K1450-E1454 IonicContact NZ-OE1 2.67Å; K1450-E1454 PolarHBondContact NZ-OE1 3Å; K1450-E1454 IonicContact NZ-OE2 3.74Å; K1450-E1454 PolarHBondContact NZ-OE2 3.21Å; K1450-E1454 WeakPolarHBondContact O-CG 3.47Å; K1450-E1454 PolarHBondContact O-N 2.93Å; G1451-E1454 PolarHBondContact O-N 2.84Å; E1454-G1457 PolarHBondContact O-N 3.29Å; E1454-K1458 WeakPolarHBondContact O-CB 3.19Å; E1454-K1458 WeakPolarHBondContact O-CG 3.44Å; E1454-K1458 PolarHBondContact O-N 2.9Å
1455	A	66.5	Low	57.6	Low	28 Å²	28	102.9 Å²	102.9	23%	0.231	57%	0.566	C	S	.	*	H	α-helix	trans	-66.2	-47	171	0	0	0	0	0	111.2	G1451 L1452 G1457 K1458 V1459	G1451-A1455 VanDerWaalsContact O-CB 3.25Å; G1451-A1455 WeakPolarHBondContact O-CB 3.41Å; G1451-A1455 PolarHBondContact O-N 2.61Å; L1452-A1455 PolarHBondContact O-N 2.88Å; A1455-G1457 VanDerWaalsContact C-N 3.34Å; A1455-G1457 PolarHBondContact O-N 3.38Å; A1455-K1458 PolarHBondContact O-N 3.3Å; A1455-V1459 WeakPolarHBondContact O-CG2 3.43Å; A1455-V1459 PolarHBondContact O-N 3.24Å
1456	L	62	Low	56.7	Low	91 Å²	91	105.9 Å²	105.9	48%	0.476	57%	0.573	S	S	.	*	H	α-helix	trans	-60.8	-42	172	-73.3	176.8	0	0	0	111.4	L1452 K1458 V1459 I1460	L1452-L1456 HydrophobicContact CD2-CD1 3.67Å; L1452-L1456 HydrophobicContact CD2-CG 4.19Å; L1452-L1456 WeakPolarHBondContact O-CB 3.16Å; L1452-L1456 WeakPolarHBondContact O-CG 3.45Å; L1452-L1456 PolarHBondContact O-N 2.86Å; L1456-K1458 PolarHBondContact O-N 3.49Å; L1456-V1459 PolarHBondContact O-N 3.42Å; L1456-I1460 HydrophobicContact CB-CD1 4.36Å; L1456-I1460 VanDerWaalsContact O-CB 3.31Å; L1456-I1460 WeakPolarHBondContact O-CB 3.45Å; L1456-I1460 WeakPolarHBondContact O-CD1 3.42Å; L1456-I1460 VanDerWaalsContact O-CG1 3.23Å; L1456-I1460 WeakPolarHBondContact O-CG1 3.44Å; L1456-I1460 PolarHBondContact O-N 3.46Å
1457	G	66.8	Low	55.3	Low	31 Å²	31	107.4 Å²	107.4	32%	0.32	59%	0.588	S	S	.	*	H	α-helix	trans	-59.5	-41.8	174.4	0	0	0	0	0	113.1	A1453 E1454 A1455 H1461	A1453-G1457 PolarHBondContact O-N 3.45Å; E1454-G1457 PolarHBondContact O-N 3.29Å; A1455-G1457 VanDerWaalsContact C-N 3.34Å; A1455-G1457 PolarHBondContact O-N 3.38Å; G1457-H1461 PolarHBondContact O-CD2 3.07Å; G1457-H1461 PolarHBondContact O-N 3.39Å
1458	K	63.2	Low	53.8	Low	129 Å²	129	106.1 Å²	106.1	56%	0.561	59%	0.586	S	S	*	*	H	α-helix	trans	-66.5	-38.2	173.9	-76.7	179.5	178.5	-177.7	0	112.3	I1444 E1454 A1455 L1456 A1462	I1444-K1458 HydrophobicContact CD1-CD 3.91Å; I1444-K1458 VanDerWaalsContact CD1-NZ 3.29Å; E1454-K1458 WeakPolarHBondContact O-CB 3.19Å; E1454-K1458 WeakPolarHBondContact O-CG 3.44Å; E1454-K1458 PolarHBondContact O-N 2.9Å; A1455-K1458 PolarHBondContact O-N 3.3Å; L1456-K1458 PolarHBondContact O-N 3.49Å; K1458-A1462 WeakPolarHBondContact O-CB 3.17Å; K1458-A1462 PolarHBondContact O-N 2.86Å
1459	V	51.4	Low	51.8	Low	111 Å²	111	108.9 Å²	108.9	67%	0.673	60%	0.604	S	S	*	*	H	α-helix	trans	-72.3	-35.9	177.8	171.1	0	0	0	0	112.4	A1455 L1456	A1455-V1459 WeakPolarHBondContact O-CG2 3.43Å; A1455-V1459 PolarHBondContact O-N 3.24Å; L1456-V1459 PolarHBondContact O-N 3.42Å
1460	I	49.6	Very low	50.4	Low	124 Å²	124	109.8 Å²	109.8	64%	0.636	61%	0.607	S	S	*	*	H	α-helix	trans	-79.6	-18.1	-177.3	-68.4	166.4	0	0	0	112.5	L1456	L1456-I1460 HydrophobicContact CB-CD1 4.36Å; L1456-I1460 VanDerWaalsContact O-CB 3.31Å; L1456-I1460 WeakPolarHBondContact O-CB 3.45Å; L1456-I1460 WeakPolarHBondContact O-CD1 3.42Å; L1456-I1460 VanDerWaalsContact O-CG1 3.23Å; L1456-I1460 WeakPolarHBondContact O-CG1 3.44Å; L1456-I1460 PolarHBondContact O-N 3.46Å
1461	H	48.2	Very low	48.6	Very low	155 Å²	155	108 Å²	108	72%	0.718	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	11.3	177	-71.1	-63.8	0	0	0	114.8	G1457 D1463	G1457-H1461 PolarHBondContact O-CD2 3.07Å; G1457-H1461 PolarHBondContact O-N 3.39Å; H1461-D1463 VanDerWaalsContact C-N 3.26Å; H1461-D1463 PolarHBondContact O-N 2.94Å; H1461-D1463 VanDerWaalsContact O-N 3.11Å
1462	A	41.8	Very low	46.6	Very low	78 Å²	78	113.1 Å²	113.1	65%	0.645	64%	0.642	S	S	*	*			trans	-83.9	42.9	-179.4	0	0	0	0	0	114.8	K1458	K1458-A1462 WeakPolarHBondContact O-CB 3.17Å; K1458-A1462 PolarHBondContact O-N 2.86Å
1463	D	34.6	Very low	45	Very low	169 Å²	169	116 Å²	116	90%	0.904	66%	0.658	S	S	*	*	S	Bend	trans	-156	71.3	164.9	-134.8	-8.7	0	0	0	110.9	H1461	H1461-D1463 VanDerWaalsContact C-N 3.26Å; H1461-D1463 PolarHBondContact O-N 2.94Å; H1461-D1463 VanDerWaalsContact O-N 3.11Å
1464	G	31.7	Very low	43.2	Very low	70 Å²	70	122.2 Å²	122.2	72%	0.722	68%	0.677	S	S	*	*			trans	164.4	53.8	-176.3	0	0	0	0	0	116.8
1465	R	33.2	Very low	41.5	Very low	221 Å²	221	123.5 Å²	123.5	83%	0.834	69%	0.693	S	S	*	*			trans	-145.9	125.2	166.9	-111	-170.8	160.8	100	5.5	115.3
1466	E	33.3	Very low	39.8	Very low	153 Å²	153	129.4 Å²	129.4	72%	0.715	72%	0.72	S	S	*	*			trans	56.1	94.1	143.7	-69.1	165	125.3	0	0	118.5
1467	T	30.6	Very low	38.5	Very low	142 Å²	142	132.7 Å²	132.7	87%	0.871	74%	0.737	S	S	*	*			trans	-64.4	148.1	156.4	45.7	0	0	0	0	111.6
1468	T	31.4	Very low	36.8	Very low	135 Å²	135	137.9 Å²	137.9	83%	0.828	76%	0.763	S	S	*	*			trans	-148.3	126.5	167.1	-49.4	0	0	0	0	110.1
1469	P	31.3	Very low	35.4	Very low	119 Å²	119	139.2 Å²	139.2	77%	0.773	78%	0.776	S	S	*	*			trans	-115.2	157.4	-168.3	40.8	-33.8	0	0	0	115.6
1470	M	31.1	Very low	34.6	Very low	180 Å²	180	138 Å²	138	89%	0.887	78%	0.778	S	S	*	*			trans	179	161.1	153.5	-108	-177.8	73.8	0	0	110
1471	P	32.5	Very low	33.9	Very low	100 Å²	100	137.8 Å²	137.8	65%	0.649	79%	0.788	S	S	*	*			cis	-125.2	170.2	-26.9	39.5	-25.8	0	0	0	113
1472	P	33.1	Very low	33.2	Very low	109 Å²	109	136.3 Å²	136.3	71%	0.708	79%	0.789	S	S	*	*			trans	-92.3	176.6	169.6	38.1	-35.1	0	0	0	113.7
1473	D	31.8	Very low	32.8	Very low	150 Å²	150	136.6 Å²	136.6	80%	0.802	80%	0.8	S	S	*	*			trans	61.8	93.4	159.3	-56.9	-24.5	0	0	0	120.2
1474	H	32.3	Very low	32.7	Very low	187 Å²	187	135.5 Å²	135.5	87%	0.866	79%	0.79	S	S	*	*			trans	-147.2	134.5	132.2	-126.8	-84.9	0	0	0	110
1475	P	35	Very low	32.9	Very low	112 Å²	112	140.7 Å²	140.7	73%	0.727	80%	0.797	S	S	*	*			trans	-92.4	174.2	-175.5	36.5	-37.1	0	0	0	114.2
1476	D	31.3	Very low	33	Very low	151 Å²	151	135.7 Å²	135.7	81%	0.807	79%	0.787	S	S	*	*			trans	88.4	156.3	164.5	-143.2	-6.9	0	0	0	117.9
1477	L	34.5	Very low	33.3	Very low	160 Å²	160	135.2 Å²	135.2	84%	0.838	79%	0.789	S	S	*	*			trans	70.6	86.4	-178.9	-55.6	-178	0	0	0	117.5
1478	T	30.2	Very low	33.3	Very low	140 Å²	140	137.2 Å²	137.2	86%	0.859	79%	0.788	S	S	*	*			trans	-70.3	145.6	162.7	51.3	0	0	0	0	113.8
1479	D	34	Very low	33.6	Very low	158 Å²	158	136.3 Å²	136.3	85%	0.845	79%	0.787	S	S	*	*				-161.2	160.2	115.9	-143.7	-16.1	0	0	0	113.8
1480	A	35.3	Very low	34.2	Very low	85 Å²	85	135.2 Å²	135.2	70%	0.702	77%	0.772	S	S	*	*			trans	10.2	139.3	161.2	0	0	0	0	0	121.5
1481	S	35.3	Very low	35.5	Very low	120 Å²	120	130.6 Å²	130.6	84%	0.839	75%	0.751	S	S	*	*			cis	-160.7	150.6	-1.2	178.8	0	0	0	0	111.2
1482	T	32.4	Very low	37.2	Very low	123 Å²	123	130.1 Å²	130.1	76%	0.755	75%	0.748	S	S	*	*			trans	-107	133.5	-171.1	-57.7	0	0	0	0	112.7	Q1484	T1482-Q1484 VanDerWaalsContact C-N 3.31Å; T1482-Q1484 PolarHBondContact O-N 3.34Å
1483	G	33.5	Very low	38.7	Very low	84 Å²	84	132 Å²	132	87%	0.866	75%	0.747	S	S	*	*			trans	-76	72.6	172.8	0	0	0	0	0	113.4
1484	Q	32.2	Very low	40	Very low	147 Å²	147	126.9 Å²	126.9	69%	0.687	72%	0.721	S	S	*	*			trans	-73.1	128.5	175.1	-175.2	170.5	-55.4	0	0	110.7	T1482 D1486	T1482-Q1484 VanDerWaalsContact C-N 3.31Å; T1482-Q1484 PolarHBondContact O-N 3.34Å; Q1484-D1486 PolarHBondContact NE2-OD1 2.95Å
1485	M	37.6	Very low	41.6	Very low	178 Å²	178	122.2 Å²	122.2	88%	0.877	70%	0.701	S	S	*	*			trans	-94.8	109.4	165.3	-74.9	-165.5	-64	0	0	108.5	L1487	M1485-L1487 PolarHBondContact O-N 3.41Å
1486	D	34.2	Very low	43.3	Very low	116 Å²	116	122.9 Å²	122.9	62%	0.62	70%	0.695	S	S	*	*			trans	-67.6	127.2	-175.5	-67.6	-44.2	0	0	0	112.5	Q1484 E1488	Q1484-D1486 PolarHBondContact NE2-OD1 2.95Å; D1486-E1488 VanDerWaalsContact C-N 3.32Å
1487	L	40.1	Very low	45.3	Very low	144 Å²	144	121.1 Å²	121.1	75%	0.754	68%	0.683	S	S	*	*			trans	-99	35.3	171.4	-96	162.6	0	0	0	111	M1485 E1490	M1485-L1487 PolarHBondContact O-N 3.41Å; L1487-E1490 HydrophobicContact CD2-CG 4.23Å
1488	E	31.1	Very low	47	Very low	184 Å²	184	117.6 Å²	117.6	86%	0.86	66%	0.664	S	S	*	*			trans	-107.4	44.1	-175.3	-62.6	-149.4	140.5	0	0	113.8	D1486	D1486-E1488 VanDerWaalsContact C-N 3.32Å
1489	S	37	Very low	49.4	Very low	116 Å²	116	114.7 Å²	114.7	81%	0.811	65%	0.646	S	S	*	*	S	Bend	trans	-148.6	9.2	162.7	81.7	0	0	0	0	115.4
1490	E	43.8	Very low	51.6	Low	95 Å²	95	114.5 Å²	114.5	44%	0.444	63%	0.634	S	S	.	*			trans	-84.3	128	178.9	-73.3	-89.1	104.2	0	0	110.3	L1487 V1494 I1495	L1487-E1490 HydrophobicContact CD2-CG 4.23Å; E1490-V1494 WeakPolarHBondContact OE2-CG1 3.31Å; E1490-I1495 HydrophobicContact CB-CD1 4.46Å; E1490-I1495 HydrophobicContact CB-CG1 4.35Å
1491	D	59.5	Low	53.8	Low	84 Å²	84	115.2 Å²	115.2	45%	0.449	62%	0.622	S	S	.	*			trans	-58.4	137	-179.1	-169.2	-47.9	0	0	0	111.4	E1493 V1494 I1495	D1491-E1493 PolarHBondContact O-N 2.57Å; D1491-E1493 VanDerWaalsContact O-N 3.13Å; D1491-E1493 WeakPolarHBondContact OD1-CB 3.49Å; D1491-E1493 PolarHBondContact OD1-N 2.98Å; D1491-V1494 HydrophobicContact CB-CB 4.37Å; D1491-V1494 HydrophobicContact CB-CG2 4.02Å; D1491-V1494 WeakPolarHBondContact O-CA 3.34Å; D1491-V1494 WeakPolarHBondContact O-CB 3.31Å; D1491-V1494 PolarHBondContact O-N 2.96Å; D1491-I1495 PolarHBondContact O-N 2.87Å; D1491-I1495 VanDerWaalsContact O-N 3.08Å
1492	P	67.6	Low	55.8	Low	90 Å²	90	118.6 Å²	118.6	58%	0.584	62%	0.617	S	S	*	*	H	α-helix	trans	-55.2	-26.4	173.5	22.7	-34.5	0	0	0	114	Q1496	P1492-Q1496 WeakPolarHBondContact O-CB 3.44Å; P1492-Q1496 VanDerWaalsContact O-CG 3.3Å; P1492-Q1496 WeakPolarHBondContact O-CG 3.25Å; P1492-Q1496 PolarHBondContact O-N 2.88Å
1493	E	63.6	Low	58.1	Low	148 Å²	148	118.8 Å²	118.8	69%	0.692	61%	0.611	S	S	*	*	H	α-helix	trans	-66.5	-38.2	169.3	-68.8	-153.3	144	0	0	112.5	D1491 Q1496 M1497	D1491-E1493 PolarHBondContact O-N 2.57Å; D1491-E1493 VanDerWaalsContact O-N 3.13Å; D1491-E1493 WeakPolarHBondContact OD1-CB 3.49Å; D1491-E1493 PolarHBondContact OD1-N 2.98Å; E1493-Q1496 PolarHBondContact O-N 3.44Å; E1493-M1497 WeakPolarHBondContact O-CB 3.39Å; E1493-M1497 PolarHBondContact O-N 3.35Å
1494	V	59	Low	60.5	Low	43 Å²	43	119.8 Å²	119.8	26%	0.261	59%	0.593	S	S	.	*	H	α-helix	trans	-68.1	-43.2	177.3	174.4	0	0	0	0	110.5	E1490 D1491 M1497 I1498	E1490-V1494 WeakPolarHBondContact OE2-CG1 3.31Å; D1491-V1494 HydrophobicContact CB-CB 4.37Å; D1491-V1494 HydrophobicContact CB-CG2 4.02Å; D1491-V1494 WeakPolarHBondContact O-CA 3.34Å; D1491-V1494 WeakPolarHBondContact O-CB 3.31Å; D1491-V1494 PolarHBondContact O-N 2.96Å; V1494-M1497 HydrophobicContact CG2-CE 4.15Å; V1494-M1497 PolarHBondContact O-N 3.41Å; V1494-I1498 HydrophobicContact CG1-CD1 3.94Å; V1494-I1498 WeakPolarHBondContact O-CG1 3.4Å; V1494-I1498 PolarHBondContact O-N 2.89Å
1495	I	66.2	Low	62.6	Low	88 Å²	88	117 Å²	117	45%	0.451	58%	0.58	S	S	.	*	H	α-helix	trans	-62.8	-45.6	174.7	-61	177.5	0	0	0	110.4	E1490 D1491 M1497 I1498 V1499	E1490-I1495 HydrophobicContact CB-CD1 4.46Å; E1490-I1495 HydrophobicContact CB-CG1 4.35Å; D1491-I1495 PolarHBondContact O-N 2.87Å; D1491-I1495 VanDerWaalsContact O-N 3.08Å; I1495-M1497 VanDerWaalsContact C-N 3.31Å; I1495-M1497 PolarHBondContact O-N 2.89Å; I1495-I1498 PolarHBondContact O-N 3.04Å; I1495-V1499 WeakPolarHBondContact O-CG2 3.26Å; I1495-V1499 PolarHBondContact O-N 2.96Å
1496	Q	72.1	Confident	64.8	Low	127 Å²	127	114.7 Å²	114.7	59%	0.593	57%	0.566	S	S	*	*	H	α-helix	trans	-62.3	-36	174.3	-77.6	-175.2	53.2	0	0	112.9	P1492 E1493 R1500	P1492-Q1496 WeakPolarHBondContact O-CB 3.44Å; P1492-Q1496 VanDerWaalsContact O-CG 3.3Å; P1492-Q1496 WeakPolarHBondContact O-CG 3.25Å; P1492-Q1496 PolarHBondContact O-N 2.88Å; E1493-Q1496 PolarHBondContact O-N 3.44Å; Q1496-R1500 WeakPolarHBondContact O-CB 3.03Å; Q1496-R1500 PolarHBondContact O-N 3.46Å
1497	M	72.6	Confident	67.2	Low	113 Å²	113	117.2 Å²	117.2	56%	0.557	57%	0.572	S	S	*	*	H	α-helix	trans	-68.4	-40.7	176.7	174.3	165.7	43.8	0	0	111.9	E1493 V1494 I1495 R1500 H1501	E1493-M1497 WeakPolarHBondContact O-CB 3.39Å; E1493-M1497 PolarHBondContact O-N 3.35Å; V1494-M1497 HydrophobicContact CG2-CE 4.15Å; V1494-M1497 PolarHBondContact O-N 3.41Å; I1495-M1497 VanDerWaalsContact C-N 3.31Å; I1495-M1497 PolarHBondContact O-N 2.89Å; M1497-R1500 PolarHBondContact O-N 3.01Å; M1497-H1501 WeakPolarHBondContact O-CB 3.21Å; M1497-H1501 PolarHBondContact O-N 2.83Å
1498	I	70.6	Confident	69.2	Low	87 Å²	87	114.7 Å²	114.7	45%	0.446	56%	0.559	S	S	.	*	H	α-helix	trans	-64.6	-44.7	173.9	-69	165.7	0	0	0	110.6	V1494 I1495 H1501 R1502	V1494-I1498 HydrophobicContact CG1-CD1 3.94Å; V1494-I1498 WeakPolarHBondContact O-CG1 3.4Å; V1494-I1498 PolarHBondContact O-N 2.89Å; I1495-I1498 PolarHBondContact O-N 3.04Å; I1498-H1501 PolarHBondContact O-N 3.48Å; I1498-R1502 WeakPolarHBondContact O-CB 3.24Å; I1498-R1502 PolarHBondContact O-N 2.88Å
1499	V	78.9	Confident	71.5	Confident	79 Å²	79	111 Å²	111	48%	0.479	55%	0.545	S	S	.	.	H	α-helix	trans	-62.7	-46.9	175.9	170.3	0	0	0	0	111	I1495 H1501 R1502 M1503	I1495-V1499 WeakPolarHBondContact O-CG2 3.26Å; I1495-V1499 PolarHBondContact O-N 2.96Å; V1499-H1501 PolarHBondContact O-N 3.08Å; V1499-R1502 PolarHBondContact O-N 3.4Å; V1499-M1503 HydrophobicContact CG1-CE 4.23Å; V1499-M1503 WeakPolarHBondContact O-CB 3.47Å; V1499-M1503 PolarHBondContact O-N 3.08Å
1500	R	81.5	Confident	73.8	Confident	153 Å²	153	109 Å²	109	58%	0.577	52%	0.522	S	S	*	.	H	α-helix	trans	-57.4	-49.2	175.6	-178.4	-174.4	-116.7	110.6	-4.6	111	Q1496 M1497 R1502 M1503 E1504	Q1496-R1500 WeakPolarHBondContact O-CB 3.03Å; Q1496-R1500 PolarHBondContact O-N 3.46Å; M1497-R1500 PolarHBondContact O-N 3.01Å; R1500-R1502 PolarHBondContact O-N 3.29Å; R1500-M1503 WeakPolarHBondContact O-CB 2.98Å; R1500-M1503 PolarHBondContact O-N 3.39Å; R1500-E1504 WeakPolarHBondContact CG-OE1 3.19Å; R1500-E1504 WeakPolarHBondContact O-CG 3.43Å; R1500-E1504 PolarHBondContact O-N 3.29Å
1501	H	81.1	Confident	75.7	Confident	101 Å²	101	112 Å²	112	47%	0.468	53%	0.534	S	S	.	.	H	α-helix	trans	-63.9	-42.3	-180	-169.3	69.5	0	0	0	112.2	M1497 I1498 V1499 M1503 E1504 Q1505	M1497-H1501 WeakPolarHBondContact O-CB 3.21Å; M1497-H1501 PolarHBondContact O-N 2.83Å; I1498-H1501 PolarHBondContact O-N 3.48Å; V1499-H1501 PolarHBondContact O-N 3.08Å; H1501-M1503 VanDerWaalsContact C-N 3.3Å; H1501-M1503 PolarHBondContact O-N 2.83Å; H1501-E1504 PolarHBondContact O-N 2.65Å; H1501-Q1505 PolarHBondContact CE1-NE2 3.48Å; H1501-Q1505 PolarHBondContact NE2-NE2 2.62Å; H1501-Q1505 VanDerWaalsContact O-CG 3.26Å; H1501-Q1505 WeakPolarHBondContact O-CG 3.48Å; H1501-Q1505 PolarHBondContact O-N 3.01Å
1502	R	76.9	Confident	76.8	Confident	190 Å²	190	113 Å²	113	72%	0.717	54%	0.536	S	S	*	.	H	α-helix	trans	-62.8	-37.3	175.4	-171.5	177.8	-74.4	-177	-2.3	111.7	I1498 V1499 R1500 H1506	I1498-R1502 WeakPolarHBondContact O-CB 3.24Å; I1498-R1502 PolarHBondContact O-N 2.88Å; V1499-R1502 PolarHBondContact O-N 3.4Å; R1500-R1502 PolarHBondContact O-N 3.29Å; R1502-H1506 PolarHBondContact O-N 3.08Å; R1502-H1506 VanDerWaalsContact O-N 3.09Å
1503	M	81.5	Confident	77.6	Confident	128 Å²	128	116.2 Å²	116.2	63%	0.631	54%	0.536	S	S	*	.	H	α-helix	trans	-69.7	-39.1	175.8	-160.7	-172.4	-56.9	0	0	112.3	V1499 R1500 H1501 H1506 K1507	V1499-M1503 HydrophobicContact CG1-CE 4.23Å; V1499-M1503 WeakPolarHBondContact O-CB 3.47Å; V1499-M1503 PolarHBondContact O-N 3.08Å; R1500-M1503 WeakPolarHBondContact O-CB 2.98Å; R1500-M1503 PolarHBondContact O-N 3.39Å; H1501-M1503 VanDerWaalsContact C-N 3.3Å; H1501-M1503 PolarHBondContact O-N 2.83Å; M1503-H1506 PolarHBondContact O-N 2.71Å; M1503-K1507 WeakPolarHBondContact O-CB 3.46Å; M1503-K1507 PolarHBondContact O-N 3.11Å
1504	E	83.9	Confident	78.5	Confident	105 Å²	105	113.1 Å²	113.1	49%	0.491	53%	0.527	S	S	.	.	H	α-helix	trans	-65.5	-41.8	174.2	-75.5	171.7	-176.5	0	0	112.2	R1500 H1501 K1507 L1508	R1500-E1504 WeakPolarHBondContact CG-OE1 3.19Å; R1500-E1504 WeakPolarHBondContact O-CG 3.43Å; R1500-E1504 PolarHBondContact O-N 3.29Å; H1501-E1504 PolarHBondContact O-N 2.65Å; E1504-K1507 PolarHBondContact O-N 2.87Å; E1504-L1508 WeakPolarHBondContact O-CB 3.49Å; E1504-L1508 PolarHBondContact O-N 2.96Å
1505	Q	76.5	Confident	79.5	Confident	89 Å²	89	115 Å²	115	42%	0.416	53%	0.533	S	S	.	.	H	α-helix	trans	-59.7	-45.9	172.7	-69.7	-73	-1.8	0	0	111.5	H1501 K1507 L1508 L1509	H1501-Q1505 PolarHBondContact CE1-NE2 3.48Å; H1501-Q1505 PolarHBondContact NE2-NE2 2.62Å; H1501-Q1505 VanDerWaalsContact O-CG 3.26Å; H1501-Q1505 WeakPolarHBondContact O-CG 3.48Å; H1501-Q1505 PolarHBondContact O-N 3.01Å; Q1505-K1507 VanDerWaalsContact C-N 3.34Å; Q1505-K1507 PolarHBondContact O-N 3.12Å; Q1505-L1508 PolarHBondContact O-N 3.46Å; Q1505-L1509 WeakPolarHBondContact O-CG 3.44Å; Q1505-L1509 PolarHBondContact O-N 2.67Å
1506	H	83.2	Confident	80	Confident	128 Å²	128	115.2 Å²	115.2	59%	0.593	53%	0.534	S	S	*	.	H	α-helix	trans	-63.5	-39	176.5	-163.3	-60.9	0	0	0	112.1	R1502 M1503 L1508 L1509 E1510	R1502-H1506 PolarHBondContact O-N 3.08Å; R1502-H1506 VanDerWaalsContact O-N 3.09Å; M1503-H1506 PolarHBondContact O-N 2.71Å; H1506-L1508 VanDerWaalsContact C-N 3.35Å; H1506-L1509 PolarHBondContact O-N 2.94Å; H1506-E1510 PolarHBondContact O-N 3.43Å
1507	K	84.8	Confident	80.2	Confident	169 Å²	169	114 Å²	114	74%	0.735	53%	0.529	S	S	*	.	H	α-helix	trans	-68	-33	176.6	-166.3	171.2	-174.1	173.1	0	112.5	M1503 E1504 Q1505 K1511	M1503-K1507 WeakPolarHBondContact O-CB 3.46Å; M1503-K1507 PolarHBondContact O-N 3.11Å; E1504-K1507 PolarHBondContact O-N 2.87Å; Q1505-K1507 VanDerWaalsContact C-N 3.34Å; Q1505-K1507 PolarHBondContact O-N 3.12Å; K1507-K1511 WeakPolarHBondContact O-CB 3.36Å; K1507-K1511 PolarHBondContact O-N 3.49Å; K1507-K1511 VanDerWaalsContact O-N 3.09Å
1508	L	81.9	Confident	80.5	Confident	91 Å²	91	115.7 Å²	115.7	48%	0.476	53%	0.529	S	S	.	.	H	α-helix	trans	-72.4	-42.1	173.9	-175.9	61.4	0	0	0	111.9	E1504 Q1505 H1506 K1511 Q1512	E1504-L1508 WeakPolarHBondContact O-CB 3.49Å; E1504-L1508 PolarHBondContact O-N 2.96Å; Q1505-L1508 PolarHBondContact O-N 3.46Å; H1506-L1508 VanDerWaalsContact C-N 3.35Å; L1508-K1511 PolarHBondContact O-N 2.93Å; L1508-Q1512 WeakPolarHBondContact O-CG 3.41Å; L1508-Q1512 PolarHBondContact O-N 2.89Å
1509	L	79.8	Confident	80.7	Confident	108 Å²	108	115.5 Å²	115.5	57%	0.565	53%	0.528	S	S	*	.	H	α-helix	trans	-61.2	-46.9	174.4	-78.4	166.6	0	0	0	111.7	Q1505 H1506 K1511 Q1512 R1513	Q1505-L1509 WeakPolarHBondContact O-CG 3.44Å; Q1505-L1509 PolarHBondContact O-N 2.67Å; H1506-L1509 PolarHBondContact O-N 2.94Å; L1509-K1511 VanDerWaalsContact C-N 3.32Å; L1509-K1511 PolarHBondContact O-N 3.23Å; L1509-Q1512 PolarHBondContact O-N 3.36Å; L1509-R1513 PolarHBondContact O-N 3.41Å
1510	E	84.1	Confident	80.3	Confident	73 Å²	73	119.1 Å²	119.1	34%	0.341	53%	0.533	S	S	.	.	H	α-helix	trans	-66.4	-35.7	177.7	-163.4	60.4	-154	0	0	111.4	H1506 Q1512 R1513 V1514	H1506-E1510 PolarHBondContact O-N 3.43Å; E1510-Q1512 VanDerWaalsContact C-N 3.35Å; E1510-Q1512 PolarHBondContact O-N 3.03Å; E1510-R1513 WeakPolarHBondContact O-CB 3.49Å; E1510-R1513 PolarHBondContact O-N 2.65Å; E1510-R1513 WeakPolarHBondContact OE1-CD 3.41Å; E1510-R1513 IonicContact OE1-CZ 3.48Å; E1510-R1513 IonicContact OE1-NE 2.69Å; E1510-R1513 IonicContact OE1-NH1 2.72Å; E1510-R1513 PolarHBondContact OE1-NH1 2.91Å; E1510-R1513 WeakPolarHBondContact OE2-CD 3.38Å; E1510-R1513 IonicContact OE2-NH1 3.61Å; E1510-R1513 PolarHBondContact OE2-NH1 3.24Å; E1510-V1514 WeakPolarHBondContact O-CB 3.38Å; E1510-V1514 WeakPolarHBondContact O-CG2 3.34Å; E1510-V1514 PolarHBondContact O-N 3.28Å
1511	K	85.1	Confident	79.7	Confident	157 Å²	157	116 Å²	116	68%	0.683	54%	0.535	S	S	*	.	H	α-helix	trans	-63.1	-38.7	172.2	-171.8	175.9	-179.3	-179.1	0	112.4	K1507 L1508 L1509 E1515	K1507-K1511 WeakPolarHBondContact O-CB 3.36Å; K1507-K1511 PolarHBondContact O-N 3.49Å; K1507-K1511 VanDerWaalsContact O-N 3.09Å; L1508-K1511 PolarHBondContact O-N 2.93Å; L1509-K1511 VanDerWaalsContact C-N 3.32Å; L1509-K1511 PolarHBondContact O-N 3.23Å; K1511-E1515 PolarHBondContact O-N 3.42Å
1512	Q	81.3	Confident	79.1	Confident	107 Å²	107	116.1 Å²	116.1	50%	0.5	53%	0.534	S	S	.	.	H	α-helix	trans	-67.1	-41.8	173.3	-72.2	-177	19.8	0	0	111.8	L1508 L1509 E1510 E1515 I1516	L1508-Q1512 WeakPolarHBondContact O-CG 3.41Å; L1508-Q1512 PolarHBondContact O-N 2.89Å; L1509-Q1512 PolarHBondContact O-N 3.36Å; E1510-Q1512 VanDerWaalsContact C-N 3.35Å; E1510-Q1512 PolarHBondContact O-N 3.03Å; Q1512-E1515 PolarHBondContact O-N 2.86Å; Q1512-I1516 WeakPolarHBondContact O-CB 3.31Å; Q1512-I1516 VanDerWaalsContact O-CG1 3.25Å; Q1512-I1516 WeakPolarHBondContact O-CG1 3.23Å; Q1512-I1516 PolarHBondContact O-N 2.61Å
1513	R	85.8	Confident	78	Confident	157 Å²	157	114 Å²	114	59%	0.592	54%	0.535	S	S	*	.	H	α-helix	trans	-59.4	-48	175.4	-175.6	-177.7	175.4	-146	7.5	111.5	L1509 E1510 I1516 E1517	L1509-R1513 PolarHBondContact O-N 3.41Å; E1510-R1513 WeakPolarHBondContact O-CB 3.49Å; E1510-R1513 PolarHBondContact O-N 2.65Å; E1510-R1513 WeakPolarHBondContact OE1-CD 3.41Å; E1510-R1513 IonicContact OE1-CZ 3.48Å; E1510-R1513 IonicContact OE1-NE 2.69Å; E1510-R1513 IonicContact OE1-NH1 2.72Å; E1510-R1513 PolarHBondContact OE1-NH1 2.91Å; E1510-R1513 WeakPolarHBondContact OE2-CD 3.38Å; E1510-R1513 IonicContact OE2-NH1 3.61Å; E1510-R1513 PolarHBondContact OE2-NH1 3.24Å; R1513-I1516 PolarHBondContact O-N 3.23Å; R1513-E1517 PolarHBondContact O-N 3.45Å
1514	V	81.8	Confident	76.2	Confident	83 Å²	83	118.2 Å²	118.2	50%	0.503	54%	0.544	S	S	.	.	H	α-helix	trans	-63.9	-39.8	177.9	170.9	0	0	0	0	112	E1510 E1517 R1518	E1510-V1514 WeakPolarHBondContact O-CB 3.38Å; E1510-V1514 WeakPolarHBondContact O-CG2 3.34Å; E1510-V1514 PolarHBondContact O-N 3.28Å; V1514-E1517 PolarHBondContact O-N 2.96Å; V1514-R1518 VanDerWaalsContact O-CB 3.23Å; V1514-R1518 WeakPolarHBondContact O-CB 3.45Å; V1514-R1518 PolarHBondContact O-N 3.09Å
1515	E	79.3	Confident	74.1	Confident	83 Å²	83	118.8 Å²	118.8	39%	0.388	55%	0.554	S	S	.	*	H	α-helix	trans	-71.4	-35	175.7	-166.7	60.3	-141.6	0	0	112.1	K1511 Q1512 E1517 R1518 L1519 K1522	K1511-E1515 PolarHBondContact O-N 3.42Å; Q1512-E1515 PolarHBondContact O-N 2.86Å; E1515-E1517 VanDerWaalsContact C-N 3.35Å; E1515-R1518 PolarHBondContact O-N 3.13Å; E1515-R1518 WeakPolarHBondContact OE2-CD 3.24Å; E1515-L1519 HydrophobicContact CG-CD1 4.25Å; E1515-L1519 HydrophobicContact CG-CG 4.5Å; E1515-L1519 WeakPolarHBondContact O-CB 3.38Å; E1515-L1519 VanDerWaalsContact O-CG 3.23Å; E1515-L1519 WeakPolarHBondContact O-CG 3.17Å; E1515-L1519 PolarHBondContact O-N 3.46Å; E1515-K1522 IonicContact OE1-NZ 3.86Å
1516	I	76.4	Confident	72.3	Confident	91 Å²	91	119.8 Å²	119.8	47%	0.467	57%	0.569	S	S	.	*	H	α-helix	trans	-62.1	-43.1	171.7	-71.9	165.6	0	0	0	110.7	Q1512 R1513 L1519 R1520	Q1512-I1516 WeakPolarHBondContact O-CB 3.31Å; Q1512-I1516 VanDerWaalsContact O-CG1 3.25Å; Q1512-I1516 WeakPolarHBondContact O-CG1 3.23Å; Q1512-I1516 PolarHBondContact O-N 2.61Å; R1513-I1516 PolarHBondContact O-N 3.23Å; I1516-L1519 PolarHBondContact O-N 2.91Å; I1516-R1520 WeakPolarHBondContact O-CB 3.27Å; I1516-R1520 WeakPolarHBondContact O-CG 3.42Å; I1516-R1520 PolarHBondContact O-N 2.87Å
1517	E	77.4	Confident	69.8	Low	102 Å²	102	125.6 Å²	125.6	48%	0.477	59%	0.586	S	S	.	*	H	α-helix	trans	-70	-36.7	177.8	-146	58.5	-121.6	0	0	111.7	R1513 V1514 E1515 L1519 R1520 S1521	R1513-E1517 PolarHBondContact O-N 3.45Å; V1514-E1517 PolarHBondContact O-N 2.96Å; E1515-E1517 VanDerWaalsContact C-N 3.35Å; E1517-L1519 PolarHBondContact O-N 3.41Å; E1517-R1520 PolarHBondContact O-N 2.84Å; E1517-R1520 IonicContact OE2-NH1 2.79Å; E1517-S1521 WeakPolarHBondContact O-CB 3.48Å; E1517-S1521 PolarHBondContact O-N 3.16Å
1518	R	78.2	Confident	67.5	Low	148 Å²	148	122.1 Å²	122.1	56%	0.558	59%	0.588	S	S	*	*	H	α-helix	trans	-63.1	-38.7	171.6	-172.5	175.8	-177.5	76.3	-3.9	111.9	V1514 E1515 K1522	V1514-R1518 VanDerWaalsContact O-CB 3.23Å; V1514-R1518 WeakPolarHBondContact O-CB 3.45Å; V1514-R1518 PolarHBondContact O-N 3.09Å; E1515-R1518 PolarHBondContact O-N 3.13Å; E1515-R1518 WeakPolarHBondContact OE2-CD 3.24Å; R1518-K1522 WeakPolarHBondContact O-CB 3.38Å; R1518-K1522 WeakPolarHBondContact O-CD 3.44Å; R1518-K1522 VanDerWaalsContact O-CG 3.23Å; R1518-K1522 WeakPolarHBondContact O-CG 3.36Å; R1518-K1522 PolarHBondContact O-N 3.39Å
1519	L	74.7	Confident	65.2	Low	84 Å²	84	124.3 Å²	124.3	44%	0.44	61%	0.605	S	S	.	*	H	α-helix	trans	-70.1	-42.4	174.3	-73.5	167	0	0	0	111.7	E1515 I1516 E1517 S1521 K1522 I1523	E1515-L1519 HydrophobicContact CG-CD1 4.25Å; E1515-L1519 HydrophobicContact CG-CG 4.5Å; E1515-L1519 WeakPolarHBondContact O-CB 3.38Å; E1515-L1519 VanDerWaalsContact O-CG 3.23Å; E1515-L1519 WeakPolarHBondContact O-CG 3.17Å; E1515-L1519 PolarHBondContact O-N 3.46Å; I1516-L1519 PolarHBondContact O-N 2.91Å; E1517-L1519 PolarHBondContact O-N 3.41Å; L1519-S1521 PolarHBondContact O-N 3.47Å; L1519-K1522 HydrophobicContact CD2-CD 4.48Å; L1519-K1522 PolarHBondContact O-N 3.5Å; L1519-I1523 WeakPolarHBondContact O-CD1 3.47Å; L1519-I1523 VanDerWaalsContact O-CG1 3.3Å; L1519-I1523 WeakPolarHBondContact O-CG1 3.4Å; L1519-I1523 PolarHBondContact O-N 3.02Å
1520	R	70.4	Confident	62.9	Low	155 Å²	155	124.3 Å²	124.3	59%	0.585	62%	0.615	S	S	*	*	H	α-helix	trans	-59.3	-45	172.5	-76.6	172.5	164.1	-159.3	-8.3	111.8	I1516 E1517 K1522 I1523 R1524	I1516-R1520 WeakPolarHBondContact O-CB 3.27Å; I1516-R1520 WeakPolarHBondContact O-CG 3.42Å; I1516-R1520 PolarHBondContact O-N 2.87Å; E1517-R1520 PolarHBondContact O-N 2.84Å; E1517-R1520 IonicContact OE2-NH1 2.79Å; R1520-K1522 PolarHBondContact O-N 2.89Å; R1520-I1523 PolarHBondContact O-N 3.5Å; R1520-R1524 WeakPolarHBondContact O-CB 3.31Å; R1520-R1524 PolarHBondContact O-N 2.85Å
1521	S	69.1	Low	60.6	Low	87 Å²	87	126.8 Å²	126.8	61%	0.608	64%	0.635	S	S	*	*	H	α-helix	trans	-64.5	-37.9	176.2	-168.3	0	0	0	0	112.6	E1517 L1519 I1523 R1524	E1517-S1521 WeakPolarHBondContact O-CB 3.48Å; E1517-S1521 PolarHBondContact O-N 3.16Å; L1519-S1521 PolarHBondContact O-N 3.47Å; S1521-I1523 VanDerWaalsContact C-N 3.31Å; S1521-I1523 PolarHBondContact O-N 3.38Å; S1521-R1524 PolarHBondContact O-N 3.12Å
1522	K	68.3	Low	58.1	Low	103 Å²	103	126.8 Å²	126.8	45%	0.448	64%	0.642	S	S	.	*	H	α-helix	trans	-67.1	-28.2	173.6	-77.1	166.4	177.3	171.8	0	113.5	E1515 R1518 L1519 R1520	E1515-K1522 IonicContact OE1-NZ 3.86Å; R1518-K1522 WeakPolarHBondContact O-CB 3.38Å; R1518-K1522 WeakPolarHBondContact O-CD 3.44Å; R1518-K1522 VanDerWaalsContact O-CG 3.23Å; R1518-K1522 WeakPolarHBondContact O-CG 3.36Å; R1518-K1522 PolarHBondContact O-N 3.39Å; L1519-K1522 HydrophobicContact CD2-CD 4.48Å; L1519-K1522 PolarHBondContact O-N 3.5Å; R1520-K1522 PolarHBondContact O-N 2.89Å
1523	I	55	Low	55.7	Low	145 Å²	145	127.6 Å²	127.6	74%	0.744	66%	0.656	S	S	*	*	H	α-helix	trans	-82.4	-22	176.7	-68.8	165	0	0	0	111	L1519 R1520 S1521 V1525	L1519-I1523 WeakPolarHBondContact O-CD1 3.47Å; L1519-I1523 VanDerWaalsContact O-CG1 3.3Å; L1519-I1523 WeakPolarHBondContact O-CG1 3.4Å; L1519-I1523 PolarHBondContact O-N 3.02Å; R1520-I1523 PolarHBondContact O-N 3.5Å; S1521-I1523 VanDerWaalsContact C-N 3.31Å; S1521-I1523 PolarHBondContact O-N 3.38Å; I1523-V1525 VanDerWaalsContact C-N 3.34Å; I1523-V1525 PolarHBondContact O-N 3.31Å
1524	R	43	Very low	53.2	Low	218 Å²	218	129.3 Å²	129.3	82%	0.823	67%	0.671	S	S	*	*			trans	-89.4	58	-179.3	-159.1	178.8	-161.3	161.6	5.5	112.9	R1520 S1521 P1526	R1520-R1524 WeakPolarHBondContact O-CB 3.31Å; R1520-R1524 PolarHBondContact O-N 2.85Å; S1521-R1524 PolarHBondContact O-N 3.12Å; R1524-P1526 WeakPolarHBondContact O-CD 3.4Å
1525	V	40.2	Very low	50.8	Low	116 Å²	116	133.4 Å²	133.4	70%	0.703	69%	0.687	S	S	*	*			trans	-81.3	118.6	173.3	-177.9	0	0	0	0	110	I1523	I1523-V1525 VanDerWaalsContact C-N 3.34Å; I1523-V1525 PolarHBondContact O-N 3.31Å
1526	P	37.8	Very low	48.8	Very low	110 Å²	110	137.5 Å²	137.5	71%	0.714	71%	0.71	S	S	*	*			trans	-73.9	129.6	172.5	30.5	-32.8	0	0	0	110.3	R1524 A1528	R1524-P1526 WeakPolarHBondContact O-CD 3.4Å; P1526-A1528 PolarHBondContact O-N 3.23Å; P1526-A1528 VanDerWaalsContact O-N 3.12Å
1527	R	30.8	Very low	46.8	Very low	251 Å²	251	136.1 Å²	136.1	95%	0.947	72%	0.718	S	S	*	*			trans	-82.8	87.4	-178.8	-174.3	178.2	-179.8	165.1	-0.3	111
1528	A	36.8	Very low	44.6	Very low	96 Å²	96	138.8 Å²	138.8	79%	0.793	74%	0.735	S	S	*	*			trans	-105.3	149.8	166.8	0	0	0	0	0	110.9	P1526	P1526-A1528 PolarHBondContact O-N 3.23Å; P1526-A1528 VanDerWaalsContact O-N 3.12Å
1529	T	34.2	Very low	42.6	Very low	136 Å²	136	139.2 Å²	139.2	83%	0.834	75%	0.749	S	S	*	*			trans	-100.7	139	-174.3	47.7	0	0	0	0	112.5
1530	S	31.5	Very low	40.7	Very low	109 Å²	109	143.8 Å²	143.8	76%	0.762	77%	0.768	S	S	*	*				179.5	127.4	128.5	-161.5	0	0	0	0	113.5
1531	V	34.6	Very low	38.9	Very low	125 Å²	125	140.6 Å²	140.6	76%	0.758	78%	0.775	S	S	*	*			trans	38.5	127.2	139.7	-177.1	0	0	0	0	121.3
1532	N	33.2	Very low	37.1	Very low	157 Å²	157	143.9 Å²	143.9	84%	0.84	79%	0.786	S	S	*	*			trans	-68.7	142.5	162.7	-70.4	-0	0	0	0	112.5
1533	P	32.3	Very low	35.3	Very low	123 Å²	123	144.4 Å²	144.4	80%	0.799	80%	0.798	S	S	*	*			trans	-137.9	118.3	139.7	34	-18.5	0	0	0	112.6
1534	E	32.5	Very low	34.3	Very low	194 Å²	194	143.9 Å²	143.9	91%	0.907	80%	0.801	S	S	*	*			trans	-147.8	90.8	159.4	-154.6	166.8	-158.4	0	0	109.2
1535	M	30.8	Very low	33.5	Very low	168 Å²	168	141.3 Å²	141.3	83%	0.828	80%	0.803	S	S	*	*			trans	-168.3	130.1	-179.2	-104.2	-73.3	-69	0	0	105.2
1536	I	37.4	Very low	32.9	Very low	170 Å²	170	142 Å²	142	87%	0.872	81%	0.807	S	S	*	*			trans	68.6	130	-161.3	-44.1	156	0	0	0	109.5
1537	G	33.9	Very low	32.4	Very low	62 Å²	62	141 Å²	141	64%	0.639	81%	0.809	S	S	*	*			cis	148.1	145.9	9.4	0	0	0	0	0	107.3
1538	D	32.3	Very low	32.5	Very low	157 Å²	157	136.5 Å²	136.5	84%	0.84	80%	0.803	S	S	*	*			trans	-72.4	177.2	-168.9	-55.6	-93.1	0	0	0	115.1
1539	D	37	Very low	32	Very low	158 Å²	158	140 Å²	140	85%	0.845	80%	0.803	S	S	*	*			trans	100.4	137.3	159.4	-65.9	-39.7	0	0	0	122.3
1540	E	34.8	Very low	31.6	Very low	180 Å²	180	139.1 Å²	139.1	84%	0.841	80%	0.802	S	S	*	*			trans	40	104.9	158.7	-57.9	-149.5	116.9	0	0	123.1
1541	A	32.3	Very low	31.6	Very low	88 Å²	88	138.7 Å²	138.7	73%	0.727	81%	0.805	S	S	*	*				49.2	115.3	108.2	0	0	0	0	0	122.1
1542	D	30.5	Very low	31.5	Very low	156 Å²	156	141.3 Å²	141.3	83%	0.834	81%	0.814	S	S	*	*			trans	81.1	154.5	132.1	-139.6	-9.6	0	0	0	121.2
1543	T	30.9	Very low	31.6	Very low	114 Å²	114	136.7 Å²	136.7	70%	0.699	80%	0.804	S	S	*	*			trans	80.5	150.8	166.8	-15.2	0	0	0	0	120.4
1544	T	33.1	Very low	31.6	Very low	133 Å²	133	138.9 Å²	138.9	82%	0.816	81%	0.808	S	S	*	*			trans	79.6	75.6	163.8	61.8	0	0	0	0	120.3
1545	L	26.2	Very low	31.8	Very low	164 Å²	164	133.8 Å²	133.8	86%	0.859	80%	0.799	S	S	*	*			trans	-54.5	143.6	141.3	-104	163.3	0	0	0	112.6
1546	T	27.2	Very low	31.8	Very low	130 Å²	130	131 Å²	131	80%	0.798	80%	0.796	S	S	*	*			trans	72.9	88.6	151	-42.7	0	0	0	0	120.1
1547	A	29.2	Very low	31.6	Very low	91 Å²	91	130.4 Å²	130.4	75%	0.752	79%	0.794	S	S	*	*			trans	-166.4	144.1	151.3	0	0	0	0	0	109.4
1548	L	31.7	Very low	31.3	Very low	155 Å²	155	131.5 Å²	131.5	81%	0.812	79%	0.792	S	S	*	*			cis	-120.5	162.3	-22.5	-71.2	103	0	0	0	107.5
1549	Q	25.9	Very low	31.5	Very low	170 Å²	170	131.9 Å²	131.9	79%	0.794	79%	0.793	S	S	*	*			cis	85.5	100.9	36	-128.5	174.8	11	0	0	115.9
1550	S	26.2	Very low	31.4	Very low	117 Å²	117	130.5 Å²	130.5	82%	0.818	79%	0.793	S	S	*	*			trans	58.3	100.8	153.6	57.4	0	0	0	0	121.7
1551	A	31.9	Very low	31.1	Very low	100 Å²	100	125.9 Å²	125.9	83%	0.826	79%	0.786	S	S	*	*			trans	-150.4	148.4	142.3	0	0	0	0	0	111.2
1552	L	33.3	Very low	31.1	Very low	180 Å²	180	127.2 Å²	127.2	94%	0.942	79%	0.79	S	S	*	*			trans	-59.2	157.5	-165.4	-53.6	78.7	0	0	0	115.7
1553	G	33.9	Very low	31.5	Very low	61 Å²	61	125.4 Å²	125.4	63%	0.629	79%	0.787	S	S	*	*			cis	153.5	153.5	-6.5	0	0	0	0	0	114.2
1554	N	33.4	Very low	31.9	Very low	168 Å²	168	125.4 Å²	125.4	90%	0.898	79%	0.788	S	S	*	*			trans	67.2	138.1	169.4	-52.8	-18.6	0	0	0	117.3
1555	A	35.8	Very low	32.3	Very low	87 Å²	87	124.2 Å²	124.2	72%	0.719	78%	0.783	S	S	*	*			cis	-146.6	126.7	-9.7	0	0	0	0	0	107.1
1556	S	30.9	Very low	32.4	Very low	109 Å²	109	121.7 Å²	121.7	76%	0.762	77%	0.77	S	S	*	*				69.6	112.8	73.8	-62	0	0	0	0	114.8
1557	L	32.5	Very low	32.5	Very low	159 Å²	159	120.4 Å²	120.4	83%	0.832	76%	0.763	S	S	*	*				154.5	93.6	128.8	-78.4	172.6	0	0	0	108.5
1558	S	28.5	Very low	32.4	Very low	84 Å²	84	123.8 Å²	123.8	59%	0.587	76%	0.763	S	S	*	*				52.6	111.4	88.2	71.8	0	0	0	0	113.3
1559	L	35.6	Very low	32.3	Very low	165 Å²	165	121.2 Å²	121.2	86%	0.864	75%	0.754	S	S	*	*				63	144	81.6	-65.8	168.5	0	0	0	113
1560	P	34.7	Very low	32.5	Very low	129 Å²	129	118.8 Å²	118.8	84%	0.838	75%	0.75	S	S	*	*			cis	-137.9	-144.8	29.1	43.2	-22.9	0	0	0	115
1561	A	29.5	Very low	32.5	Very low	84 Å²	84	121.6 Å²	121.6	69%	0.694	75%	0.748	S	S	*	*			trans	-108.4	168.1	-159.6	0	0	0	0	0	116.8
1562	S	33.2	Very low	32.6	Very low	116 Å²	116	123 Å²	123	81%	0.811	75%	0.746	S	S	*	*			trans	71.4	163.6	160.2	-55.8	0	0	0	0	117.2
1563	P	37.4	Very low	32.3	Very low	118 Å²	118	120.3 Å²	120.3	77%	0.766	73%	0.733	S	S	*	*			cis	-129.1	179.9	4.9	43.2	-27.8	0	0	0	116
1564	P	39.5	Very low	31.9	Very low	113 Å²	113	123.6 Å²	123.6	73%	0.734	74%	0.741	S	S	*	*			trans	-102.3	-173.3	162.8	42.6	-35.6	0	0	0	111.4
1565	P	41.4	Very low	31.6	Very low	108 Å²	108	121 Å²	121	70%	0.701	73%	0.731	S	S	*	*			cis	-124.3	-145.8	-18.5	34.5	-13.1	0	0	0	111.2
1566	N	29.2	Very low	31.1	Very low	111 Å²	111	122 Å²	122	59%	0.594	73%	0.728	S	S	*	*			trans	88	101.2	151.4	-84	24	0	0	0	122.7
1567	T	29.1	Very low	31.3	Very low	104 Å²	104	122.6 Å²	122.6	64%	0.638	72%	0.721	S	S	*	*				69.6	161	120.7	57.8	0	0	0	0	122.6
1568	E	27.5	Very low	31.2	Very low	161 Å²	161	121 Å²	121	75%	0.752	72%	0.72	S	S	*	*			trans	82	96	162.4	-69.7	-94.1	66	0	0	118.3
1569	T	28.8	Very low	31.2	Very low	102 Å²	102	120.8 Å²	120.8	63%	0.626	72%	0.719	S	S	*	*				50.5	109.9	111.8	-49.3	0	0	0	0	118
1570	T	30.1	Very low	30.8	Very low	118 Å²	118	119.8 Å²	119.8	72%	0.724	71%	0.714	S	S	*	*				-163.1	133.3	105.1	-81.1	0	0	0	0	112.9
1571	K	27.4	Very low	30.6	Very low	177 Å²	177	119.7 Å²	119.7	77%	0.77	71%	0.711	S	S	*	*			trans	-8.1	142.3	152	-44.4	153.6	-168.1	165	0	115.9
1572	V	32.7	Very low	30.5	Very low	130 Å²	130	122.3 Å²	122.3	79%	0.788	71%	0.713	S	S	*	*				-164.5	146.3	102.8	142.1	0	0	0	0	110.3
1573	N	27.4	Very low	30.1	Very low	123 Å²	123	121 Å²	121	66%	0.658	71%	0.708	S	S	*	*			trans	-21.3	147.6	163.9	-57.7	1.8	0	0	0	115.4
1574	T	26.5	Very low	29.6	Very low	130 Å²	130	120.9 Å²	120.9	80%	0.798	71%	0.706	S	S	*	*				53.9	151.6	59.9	-47.6	0	0	0	0	112
1575	T	25.8	Very low	28.9	Very low	113 Å²	113	125.7 Å²	125.7	69%	0.693	71%	0.71	S	S	*	*			trans	76.9	136.6	172.9	-31.1	0	0	0	0	113.4
1576	V	25.2	Very low	28.1	Very low	107 Å²	107	127.2 Å²	127.2	65%	0.648	71%	0.709	S	S	*	*			cis	-174.3	160.6	-31.1	108.5	0	0	0	0	106.9
1577	I	34.8	Very low	28	Very low	122 Å²	122	127.1 Å²	127.1	63%	0.626	71%	0.713	S	S	*	*			trans	6.9	120.8	145.5	-43.6	160.7	0	0	0	115	S1579	I1577-S1579 VanDerWaalsContact CG2-N 3.35Å; I1577-S1579 WeakPolarHBondContact CG2-OG 3.43Å
1578	P	31.4	Very low	27.9	Very low	126 Å²	126	129.5 Å²	129.5	82%	0.818	72%	0.719	S	S	*	*				-102.3	135.8	87.8	-18.6	34.3	0	0	0	112.4
1579	S	28.6	Very low	28.1	Very low	79 Å²	79	127 Å²	127	55%	0.552	72%	0.718	S	S	*	*			cis	68.1	126.7	45.6	-79.1	0	0	0	0	114	I1577	I1577-S1579 VanDerWaalsContact CG2-N 3.35Å; I1577-S1579 WeakPolarHBondContact CG2-OG 3.43Å
1580	D	27.4	Very low	28	Very low	144 Å²	144	129 Å²	129	77%	0.77	72%	0.721	S	S	*	*			trans	57.2	123.1	153.3	-49.9	-40.4	0	0	0	118.5
1581	V	29.5	Very low	27.9	Very low	128 Å²	128	128 Å²	128	78%	0.776	72%	0.719	S	S	*	*				-160.9	136	103.7	142	0	0	0	0	109.3
1582	L	27.7	Very low	28	Very low	139 Å²	139	124.6 Å²	124.6	73%	0.728	72%	0.717	S	S	*	*			trans	11.8	130.8	157	-70.1	50.8	0	0	0	117.5
1583	A	25.1	Very low	27.9	Very low	87 Å²	87	123.7 Å²	123.7	72%	0.719	71%	0.712	S	S	*	*				54.5	143.3	67.8	0	0	0	0	0	114.2
1584	T	26.4	Very low	28.1	Very low	117 Å²	117	126.8 Å²	126.8	72%	0.718	72%	0.719	S	S	*	*			trans	77.2	105.3	-172.6	-34.5	0	0	0	0	111.2
1585	R	24.4	Very low	28.3	Very low	213 Å²	213	125.2 Å²	125.2	80%	0.804	71%	0.714	S	S	*	*				72.2	143.8	58.1	-168.4	-164.8	-171.8	-173.9	5.2	111.4
1586	M	26.1	Very low	28.6	Very low	140 Å²	140	124.3 Å²	124.3	69%	0.69	71%	0.712	S	S	*	*			trans	79.1	150.6	175.3	-50.9	-165	176.8	0	0	115.9
1587	T	27	Very low	28.7	Very low	110 Å²	110	126.4 Å²	126.4	68%	0.675	72%	0.72	S	S	*	*			cis	-169.9	160.9	-31.3	37.1	0	0	0	0	108.6
1588	M	27.4	Very low	28.9	Very low	154 Å²	154	127.2 Å²	127.2	76%	0.759	73%	0.73	S	S	*	*			trans	72.6	151.6	167.2	-49.7	-155.2	173.6	0	0	114.2	Q1590	M1588-Q1590 PolarHBondContact SD-NE2 3.11Å
1589	S	30.9	Very low	29	Very low	107 Å²	107	126 Å²	126	75%	0.748	73%	0.725	S	S	*	*			cis	-101.6	154.6	9.9	65	0	0	0	0	112.1
1590	Q	26.3	Very low	29	Very low	146 Å²	146	129 Å²	129	68%	0.682	74%	0.739	S	S	*	*				52.7	128.1	55.8	-55.2	-161.7	71.2	0	0	111.2	M1588	M1588-Q1590 PolarHBondContact SD-NE2 3.11Å
1591	S	28.6	Very low	29.3	Very low	97 Å²	97	126 Å²	126	68%	0.678	73%	0.73	S	S	*	*			cis	-163.2	163.2	12.6	55.3	0	0	0	0	110.8
1592	S	28.3	Very low	29.3	Very low	105 Å²	105	124.4 Å²	124.4	73%	0.734	72%	0.724	S	S	*	*			trans	71.5	142.4	157.8	-56.7	0	0	0	0	117.2
1593	T	31.7	Very low	29.4	Very low	110 Å²	110	127.9 Å²	127.9	68%	0.675	73%	0.728	S	S	*	*			cis	-161	139.4	-2.3	15.8	0	0	0	0	110.9
1594	K	31.3	Very low	29.9	Very low	188 Å²	188	131.2 Å²	131.2	82%	0.817	73%	0.728	S	S	*	*			trans	60.3	141.3	144.5	-63.7	177.2	-179.7	178.9	0	119.4
1595	S	31.1	Very low	30.2	Very low	97 Å²	97	135 Å²	135	68%	0.678	73%	0.729	S	S	*	*			cis	-164.1	151.9	-5.1	-107.3	0	0	0	0	113.3
1596	S	31.6	Very low	30.5	Very low	95 Å²	95	130.4 Å²	130.4	66%	0.664	72%	0.721	S	S	*	*			trans	55.1	119.1	147	61.8	0	0	0	0	122.1
1597	N	28.2	Very low	30.7	Very low	151 Å²	151	129.3 Å²	129.3	81%	0.807	72%	0.718	S	S	*	*				54.2	133.9	124.9	-53.4	-5.7	0	0	0	118.8
1598	V	37	Very low	30.9	Very low	139 Å²	139	131.7 Å²	131.7	84%	0.842	72%	0.721	S	S	*	*				-124.7	153.1	52.9	177.1	0	0	0	0	113.4
1599	S	33.6	Very low	31.1	Very low	100 Å²	100	129.1 Å²	129.1	70%	0.699	72%	0.718	S	S	*	*			trans	-152.5	116.6	173.5	-73.7	0	0	0	0	113.1
1600	V	29.8	Very low	31	Very low	141 Å²	141	128.5 Å²	128.5	86%	0.855	72%	0.719	S	S	*	*			trans	-146.6	91.2	152	-175.2	0	0	0	0	104.3
1601	S	33.2	Very low	31.5	Very low	82 Å²	82	127.3 Å²	127.3	57%	0.573	72%	0.724	S	S	*	*			cis	71.8	132.9	30	-155.2	0	0	0	0	114.5
1602	S	30.1	Very low	31.9	Very low	94 Å²	94	127.7 Å²	127.7	66%	0.657	73%	0.725	S	S	*	*			trans	89.1	140.3	163.9	83.1	0	0	0	0	119.1
1603	R	30.3	Very low	31.9	Very low	213 Å²	213	131.9 Å²	131.9	80%	0.804	72%	0.724	S	S	*	*			cis	-154.6	150.8	-14.8	-113.6	162.5	-161.4	164.6	4.8	107.5
1604	H	33.9	Very low	32	Very low	156 Å²	156	133.1 Å²	133.1	72%	0.722	72%	0.722	S	S	*	*				37.1	141	99	-70.2	-35.5	0	0	0	114.6
1605	R	32.7	Very low	32.1	Very low	196 Å²	196	130.8 Å²	130.8	74%	0.74	71%	0.714	S	S	*	*			cis	-169.9	-177.1	34.4	-146.5	175.7	-148.6	172	1	111.8
1606	D	32	Very low	32.2	Very low	118 Å²	118	131.3 Å²	131.3	63%	0.631	71%	0.705	S	S	*	*			trans	74.8	138.6	146.5	-69.2	-35	0	0	0	117.4
1607	N	29.8	Very low	32.4	Very low	117 Å²	117	131.6 Å²	131.6	63%	0.626	70%	0.696	S	S	*	*			cis	-169	162.5	-18.7	-141	-30.4	0	0	0	110.5
1608	Q	31	Very low	32.6	Very low	159 Å²	159	131.5 Å²	131.5	74%	0.743	69%	0.691	S	S	*	*			trans	63.4	164.4	155.6	-65.6	162.4	57.7	0	0	117.9
1609	S	31.2	Very low	32.6	Very low	101 Å²	101	129.7 Å²	129.7	71%	0.706	68%	0.682	S	S	*	*			cis	-167.9	131.4	-32.7	-93.4	0	0	0	0	111.6
1610	A	29.8	Very low	32.7	Very low	93 Å²	93	133.5 Å²	133.5	77%	0.769	69%	0.688	S	S	*	*			trans	65.5	-173.1	143.7	0	0	0	0	0	117.3
1611	P	37.2	Very low	33.6	Very low	122 Å²	122	131.6 Å²	131.6	79%	0.792	68%	0.679	S	S	*	*				-123	-115.2	-116.5	25.3	1.9	0	0	0	117.8
1612	P	35.6	Very low	34	Very low	105 Å²	105	133.4 Å²	133.4	68%	0.682	69%	0.689	S	S	*	*				-124.6	175.4	-108.7	40.1	-25.8	0	0	0	117.8
1613	R	29.3	Very low	34.4	Very low	193 Å²	193	136.7 Å²	136.7	73%	0.728	69%	0.693	S	S	*	*			trans	67.8	140.9	146.2	-95.3	-176.8	-177.9	-179.9	3.8	121.5
1614	H	32.8	Very low	35	Very low	135 Å²	135	133.3 Å²	133.3	63%	0.625	69%	0.686	S	S	*	*			trans	72.9	123.1	152.8	-73.7	-71.2	0	0	0	124
1615	H	33.3	Very low	35.5	Very low	140 Å²	140	131.7 Å²	131.7	65%	0.648	69%	0.69	S	S	*	*			trans	61.3	147.5	145.7	-58.1	-51.1	0	0	0	119.8	K830	K830-H1615 PolarHBondContact NZ-O 2.86Å
1616	H	34.2	Very low	35.7	Very low	107 Å²	107	128.3 Å²	128.3	50%	0.495	68%	0.682	S	S	.	*			cis	-170.2	159.9	35.7	-150.8	47.2	0	0	0	111.2
1617	H	34.5	Very low	35.9	Very low	101 Å²	101	130.8 Å²	130.8	47%	0.468	69%	0.694	S	S	.	*			trans	11.4	129.9	161.9	-65.8	-35.1	0	0	0	125
1618	Q	33.6	Very low	36	Very low	150 Å²	150	131.2 Å²	131.2	70%	0.701	69%	0.692	S	S	*	*				47.6	168.2	120.2	-94.1	-177.1	-0.9	0	0	122.7
1619	P	36.9	Very low	36.2	Very low	101 Å²	101	130.6 Å²	130.6	66%	0.656	69%	0.694	S	S	*	*			cis	-133.2	-160.3	-6.1	35.7	-13	0	0	0	115.9
1620	H	36.2	Very low	36.3	Very low	180 Å²	180	132.1 Å²	132.1	83%	0.833	69%	0.69	S	S	*	*			trans	-81.4	-161	173.6	-69.8	-93.8	0	0	0	113.6
1621	P	48.9	Very low	36.6	Very low	100 Å²	100	137.1 Å²	137.1	65%	0.649	69%	0.69	S	S	*	*				-127.9	-173.9	-72.2	40.4	-24.1	0	0	0	113.5
1622	P	41.8	Very low	36.4	Very low	121 Å²	121	139.4 Å²	139.4	79%	0.786	69%	0.69	S	S	*	*				-140.3	137.6	128.2	22.1	-1.6	0	0	0	113.4
1623	H	38.1	Very low	36.5	Very low	163 Å²	163	139.9 Å²	139.9	76%	0.755	69%	0.693	S	S	*	*				86.1	112.8	64.9	-93.8	-87	0	0	0	117.1
1624	H	41.3	Very low	36.7	Very low	142 Å²	142	135.7 Å²	135.7	66%	0.657	69%	0.691	S	S	*	*				31.5	141.9	129.8	-87.3	-73.5	0	0	0	122	H1626	H1624-H1626 AromaticContact ND1-CD2 3.81Å
1625	P	45.8	Very low	36.6	Very low	122 Å²	122	137.2 Å²	137.2	79%	0.792	70%	0.698	S	S	*	*				-128.3	148.5	78	34.5	-23	0	0	0	114.2
1626	H	36	Very low	36.4	Very low	124 Å²	124	136.4 Å²	136.4	57%	0.574	70%	0.699	S	S	*	*				78.6	116.1	51.3	-101.2	-84.2	0	0	0	115.4	H1624 Q1628	H1624-H1626 AromaticContact ND1-CD2 3.81Å; H1626-Q1628 PolarHBondContact CE1-OE1 3.12Å; H1626-Q1628 VanDerWaalsContact CE1-OE1 3.26Å; H1626-Q1628 PolarHBondContact ND1-OE1 3.16Å
1627	L	36.6	Very low	36.2	Very low	170 Å²	170	139 Å²	139	89%	0.89	71%	0.71	S	S	*	*			trans	156.6	96.9	153.5	-90.1	163	0	0	0	107.7
1628	Q	31.3	Very low	36	Very low	126 Å²	126	140.2 Å²	140.2	59%	0.589	73%	0.725	S	S	*	*			cis	84.2	101.2	27.4	-162.6	175	-9.8	0	0	115.1	H1626	H1626-Q1628 PolarHBondContact CE1-OE1 3.12Å; H1626-Q1628 VanDerWaalsContact CE1-OE1 3.26Å; H1626-Q1628 PolarHBondContact ND1-OE1 3.16Å
1629	N	35.9	Very low	35.8	Very low	147 Å²	147	138.7 Å²	138.7	79%	0.786	73%	0.731	S	S	*	*			trans	174.8	158.5	155.4	-91.8	-24	0	0	0	109.1
1630	H	33.9	Very low	35.7	Very low	132 Å²	132	138 Å²	138	61%	0.611	74%	0.735	S	S	*	*			cis	-169.5	168.9	-48	-122	-41	0	0	0	108.1
1631	Y	35.3	Very low	35.8	Very low	199 Å²	199	136 Å²	136	78%	0.78	74%	0.735	S	S	*	*			trans	69.4	127.7	179.7	-57.1	-82.3	0	0	0	115.5
1632	H	33.9	Very low	35.3	Very low	170 Å²	170	134.6 Å²	134.6	79%	0.787	73%	0.732	S	S	*	*				72.1	149.9	58.6	-73.5	-71.7	0	0	0	114.5
1633	P	38	Very low	35.1	Very low	115 Å²	115	132.5 Å²	132.5	75%	0.747	72%	0.718	S	S	*	*			cis	-119.7	-40.4	-11.1	35.3	-29.5	0	0	0	125.1
1634	P	32	Very low	35.3	Very low	104 Å²	104	127.3 Å²	127.3	68%	0.675	70%	0.7	S	S	*	*				-126.4	139.4	-127.3	38.7	-22.9	0	0	0	120.7
1635	Q	30.2	Very low	35.2	Very low	167 Å²	167	124.9 Å²	124.9	78%	0.78	70%	0.697	S	S	*	*				32.5	147	124	-62.5	-178.6	-3.9	0	0	124.5
1636	N	29.7	Very low	34.7	Very low	123 Å²	123	122.7 Å²	122.7	66%	0.658	68%	0.684	S	S	*	*			trans	62.2	111.2	139.1	-64.6	3.2	0	0	0	119.3
1637	H	30.3	Very low	34.6	Very low	161 Å²	161	121 Å²	121	75%	0.745	69%	0.692	S	S	*	*				92.6	119.1	75.9	-84	-57.8	0	0	0	115.6
1638	T	29.8	Very low	34.5	Very low	127 Å²	127	120.6 Å²	120.6	78%	0.779	69%	0.687	S	S	*	*			trans	74.5	152.6	143.6	56.8	0	0	0	0	123
1639	S	30.4	Very low	34.5	Very low	118 Å²	118	120.2 Å²	120.2	83%	0.825	69%	0.693	S	S	*	*			trans	72.9	86.4	158.3	58.4	0	0	0	0	121.7
1640	A	34.9	Very low	34.4	Very low	88 Å²	88	119.7 Å²	119.7	73%	0.727	69%	0.686	S	S	*	*			trans	-166.3	115.1	132.3	0	0	0	0	0	107.6
1641	T	37	Very low	34.3	Very low	136 Å²	136	119.5 Å²	119.5	83%	0.834	69%	0.689	S	S	*	*				57.5	83.2	82.6	-47.7	0	0	0	0	110.4
1642	A	39.5	Very low	34	Very low	71 Å²	71	118 Å²	118	59%	0.587	69%	0.689	S	S	*	*				75.8	143.5	89.7	0	0	0	0	0	112.7
1643	P	37.2	Very low	33.8	Very low	78 Å²	78	114.4 Å²	114.4	51%	0.506	69%	0.689	S	S	.	*			cis	-97.2	148.8	15.7	35.7	-30.6	0	0	0	114	L1268 E1269	L1268-P1643 WeakPolarHBondContact O-CB 3.39Å; L1268-P1643 WeakPolarHBondContact O-CG 3.36Å; E1269-P1643 VanDerWaalsContact O-CG 3.23Å; E1269-P1643 WeakPolarHBondContact O-CG 3.37Å
1644	C	43	Very low	33.6	Very low	53 Å²	53	115.3 Å²	115.3	36%	0.358	69%	0.692	S	S	.	*			cis	79.5	136.2	37.5	-59.9	0	0	0	0	113.7	N1267 L1268 S1646	N1267-C1644 VanDerWaalsContact C-CB 3.44Å; N1267-C1644 VanDerWaalsContact O-CB 3.31Å; N1267-C1644 WeakPolarHBondContact O-CB 3.5Å; L1268-C1644 VanDerWaalsContact N-C 3.33Å; L1268-C1644 PolarHBondContact N-O 2.65Å; C1644-S1646 WeakPolarHBondContact CB-OG 3.48Å; C1644-S1646 PolarHBondContact SG-OG 3.21Å
1645	P	39.2	Very low	33.7	Very low	92 Å²	92	114.4 Å²	114.4	60%	0.597	69%	0.688	S	S	*	*	S	Bend	cis	-75.6	118.9	2.3	30.3	-31.4	0	0	0	112	L1266	L1266-P1645 WeakPolarHBondContact O-CA 3.3Å; L1266-P1645 WeakPolarHBondContact O-CB 3.43Å
1646	S	34.5	Very low	34	Very low	75 Å²	75	112.2 Å²	112.2	52%	0.524	68%	0.681	S	S	.	*				73	113.1	64.6	-59.4	0	0	0	0	111.6	L1266 C1644	L1266-S1646 WeakPolarHBondContact O-CB 3.46Å; L1266-S1646 PolarHBondContact O-OG 3.24Å; C1644-S1646 WeakPolarHBondContact CB-OG 3.48Å; C1644-S1646 PolarHBondContact SG-OG 3.21Å
1647	A	34.1	Very low	34.3	Very low	90 Å²	90	112.1 Å²	112.1	74%	0.744	68%	0.681	S	S	*	*			cis	-156.2	156	-8.3	0	0	0	0	0	107.7
1648	M	33.7	Very low	34.5	Very low	160 Å²	160	110.7 Å²	110.7	79%	0.788	68%	0.679	S	S	*	*				34.3	126.4	77.4	-87.3	-171.2	165.4	0	0	113.1
1649	V	33	Very low	34.9	Very low	119 Å²	119	110.2 Å²	110.2	72%	0.721	68%	0.676	S	S	*	*			cis	-147.8	129.5	33.3	164.3	0	0	0	0	105.9
1650	Q	33.2	Very low	35.1	Very low	136 Å²	136	111.1 Å²	111.1	64%	0.636	67%	0.671	S	S	*	*				74	146.1	50.4	-148.4	-165.6	-8.1	0	0	113.5
1651	L	31	Very low	35.4	Very low	127 Å²	127	111.4 Å²	111.4	67%	0.665	67%	0.666	S	S	*	*			trans	65.6	149.5	167.6	-54.9	177.7	0	0	0	116.5
1652	Q	29.7	Very low	35.3	Very low	169 Å²	169	111.7 Å²	111.7	79%	0.79	66%	0.661	S	S	*	*			cis	160.4	152.7	-22	-113.3	-174.3	-0.9	0	0	104.6
1653	A	30.3	Very low	35.3	Very low	94 Å²	94	115.4 Å²	115.4	78%	0.777	67%	0.666	S	S	*	*			trans	62	158.5	178.1	0	0	0	0	0	113.8
1654	V	33	Very low	35.3	Very low	133 Å²	133	119.7 Å²	119.7	81%	0.806	68%	0.679	S	S	*	*			cis	-96.6	133.1	3.5	-159.4	0	0	0	0	106.6
1655	S	34.9	Very low	35.2	Very low	85 Å²	85	122.2 Å²	122.2	59%	0.594	70%	0.695	S	S	*	*				50	143.5	74.8	-95.6	0	0	0	0	112.9
1656	N	36.2	Very low	35.2	Very low	121 Å²	121	122.4 Å²	122.4	65%	0.647	70%	0.696	S	S	*	*			cis	-152.5	158.7	8.1	-136.7	-14.1	0	0	0	112.5
1657	N	36.1	Very low	35.5	Very low	122 Å²	122	127.5 Å²	127.5	65%	0.652	71%	0.711	S	S	*	*			trans	35.7	117.1	141.2	-75.2	-19.4	0	0	0	120.1
1658	N	34.2	Very low	35.9	Very low	131 Å²	131	128.5 Å²	128.5	70%	0.701	71%	0.711	S	S	*	*				86.4	160.4	68	-176.4	28.4	0	0	0	111.5
1659	V	38.4	Very low	36.1	Very low	117 Å²	117	127.7 Å²	127.7	71%	0.709	71%	0.714	S	S	*	*			trans	69.3	91.7	-179.3	-158.2	0	0	0	0	111.3
1660	N	33.7	Very low	36.3	Very low	137 Å²	137	127.2 Å²	127.2	73%	0.733	72%	0.716	S	S	*	*			cis	66.4	161.4	47	-146.1	20.7	0	0	0	111.9
1661	P	42.2	Very low	36.6	Very low	94 Å²	94	125.8 Å²	125.8	61%	0.61	72%	0.721	S	S	*	*				-107.9	174.7	-89.7	35.7	-23.8	0	0	0	112.2
1662	L	35.1	Very low	36.9	Very low	142 Å²	142	128.2 Å²	128.2	74%	0.743	73%	0.729	S	S	*	*			trans	-166.5	152.7	131.4	-129.3	68.3	0	0	0	113.9
1663	H	39	Very low	37.6	Very low	148 Å²	148	127.4 Å²	127.4	69%	0.685	73%	0.729	S	S	*	*			trans	46.9	116	148.7	-76.2	7.9	0	0	0	120.4
1664	Q	37.6	Very low	38.3	Very low	168 Å²	168	128.2 Å²	128.2	79%	0.785	73%	0.726	S	S	*	*				94.1	164.5	74.7	-95.3	-158.5	8.2	0	0	112.6
1665	P	40	Very low	38.6	Very low	106 Å²	106	126.7 Å²	126.7	69%	0.688	72%	0.719	S	S	*	*			trans	-94.8	-151.1	-146.7	45	-42.7	0	0	0	111
1666	P	40.1	Very low	38.6	Very low	96 Å²	96	128 Å²	128	62%	0.623	72%	0.715	S	S	*	*			cis	-143	177.5	-6	41.5	-22.1	0	0	0	118.3
1667	H	40.6	Very low	38.4	Very low	182 Å²	182	128.3 Å²	128.3	84%	0.843	74%	0.735	S	S	*	*			trans	68.6	162	145.6	-76.7	-47.8	0	0	0	121.6
1668	P	42.2	Very low	38.5	Very low	112 Å²	112	128.6 Å²	128.6	73%	0.727	74%	0.739	S	S	*	*			trans	-131.7	160	-153.8	42.3	-25.9	0	0	0	117.1
1669	V	38.7	Very low	38.7	Very low	142 Å²	142	128.5 Å²	128.5	86%	0.861	74%	0.741	S	S	*	*			trans	-147.8	124	161.6	-170.7	0	0	0	0	105.7
1670	S	36.7	Very low	38.7	Very low	110 Å²	110	129.1 Å²	129.1	77%	0.769	74%	0.743	S	S	*	*			cis	90.9	91.7	32.4	-168.2	0	0	0	0	115
1671	S	39.1	Very low	39	Very low	105 Å²	105	128.6 Å²	128.6	73%	0.734	74%	0.743	S	S	*	*			trans	-167.3	106.8	153.3	58.4	0	0	0	0	113.3
1672	Q	38.3	Very low	38.8	Very low	178 Å²	178	130.8 Å²	130.8	83%	0.832	75%	0.752	S	S	*	*			trans	43.2	131.7	136.9	-64.7	164.8	-9.3	0	0	121
1673	I	43.9	Very low	39.1	Very low	152 Å²	152	130.1 Å²	130.1	78%	0.779	75%	0.752	S	S	*	*			cis	72.8	139.9	38.7	-56	167.1	0	0	0	111.8
1674	P	45.4	Very low	39.1	Very low	112 Å²	112	128.8 Å²	128.8	73%	0.727	76%	0.757	S	S	*	*			cis	-121.7	-139	-10.3	41.6	-22.6	0	0	0	109.9
1675	P	37.5	Very low	39.2	Very low	100 Å²	100	125.8 Å²	125.8	65%	0.649	76%	0.755	S	S	*	*			cis	-128	141	-29	32.2	-13.4	0	0	0	116.5
1676	Q	34.9	Very low	39.1	Very low	112 Å²	112	127.4 Å²	127.4	52%	0.523	76%	0.761	S	S	.	*			trans	35.4	133.3	134.9	-58.9	-168.6	11.7	0	0	122.7	S1117	S1117-Q1676 VanDerWaalsContact CB-NE2 3.3Å; S1117-Q1676 PolarHBondContact OG-NE2 2.62Å; S1117-Q1676 PolarHBondContact OG-OE1 2.79Å
1677	A	32.3	Very low	39.1	Very low	128 Å²	128	130.3 Å²	130.3	100%	1.058	77%	0.773	S	S	*	*				-174	0	77.5	0	0	0	0	0	111.4	M1	M1-A1677 CarbonylContact C-O 3.54Å; M1-A1677 VanDerWaalsContact N-CA 3.31Å; M1-A1677 VanDerWaalsContact N-CB 3.34Å; M1-A1677 PolarHBondContact N-O 3.34Å; M1-A1677 PolarHBondContact O-N 3.32Å; M1-A1677 VanDerWaalsContact O-N 3.09Å

Retrieved 1,677 of 1,677 residues in 947.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).