WNK_CAEEL Loading...

Isoform g 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 X5M5N0-8 (canonical: X5M5N0), Species CAEEL (Caenorhabditis elegans), Gene wnk-1, Length 1,841 aa.

						>WNK_CAEEL|X5M5N0-8|wnk-1
MPDSITNGGRPPAPPSSVSSTTASTTGNFGTRRRLVNRIKKVDELHPAQENPTMGSHWLSEQERSRLEAVQQDWRRTRPMKWTSKKRPDDPTTSSPSTVSISNALENSTPSLNNVSSITNSSSPFSLSSAATSTASAIIPFTSNVATNHPHLNHHVSRIPQAIVTGGTNGSLPPLLISPTSAAAATPLISGKAGPMSPSTGSPINVAATVLQNAVSSPQHSIFDRSRLNKIPPNTSLASSSSPSDAANNDKPIQQRHSILSNVRTLTQAMVNDGPRTLTGDDMDKMVSEEERARKEQEKREEEEKAARRIDVEDDFDAQEKPIDKSKNGRFLKFDEELGRGSFKTVFRGLDTETGVAVAWCELQESKLNKTERQRFREEAEMLKDLQHPNIVRFYDYWESADLCGKRKYIVLVTELMTSGTLKMYLKRFKRINIKVLKSWCRQILKGLSFLHTRNPPVIHRDLKCDNIFITGTTGSVKIGDLGLATLKNKSFAKSVIGTPEFMAPEMYEEMYDESVDVYAFGMCLLEMVTGEYPYSECMNPATIYRKVISGVKPECFSRIPAQYPEIREIIDRCIRVRREERSTVKQLLVDDFFTPEDLIGIRVEIKNRDADLNDLNVEIQMQLRVYDEKKRKQYRFKENEGLQFAFDIENDSPDEVVQQMIEQQHIPDEDTRMITKLIKDKVDAFRRDRDHRLLEIKRAKEEEERIREEAEIKEELRLRAEAKEKEKERLEKERLEKKAAAAAAANPNPTPIPPTPATPHSSAQQQPIPPPLSTQTSAEIQQSAQQPSVPVTMIANIPAMSPTSAQPQPVLSPTSAAVPVPTTMIHVPKPSEIPVQNVATTAAPVAANNVPPSPAPFKTEDIQTPTLAQNTVPRTISTDASGLVINTPASIASPSPAPSATDVASTTAPVTPAPTPTTTTDGGAAAASTTTENKEEKRKSNKRKVVMEILGCDESRNFALVSCRLDTSHKSVTFQFAPGTDKPCTIATKLLAEDCLLKVHVHIVEAQLGEVIQLINSDGKKGVGTKLATVLDPNSTEPPTITAVMPKDSSAATASNTKPKIEIEKTPPTRDASQEPNNVQVTNVRKVSQESNAESVQSIPRPGGIIVMSPTNQTDSAPPPTGAAAKPSRFQVTKSADPIATPISSSISTATVIPIVAATPTNITSEPVIVQPITAQVITHLATPSPVSHSLSSNSSPSATTHSNMSSIQSTTSVPGRRFTVQPVSQAESGISSSISTPHPEPTPAITSCPPPVPSVPPVVSNGTLNLEVAPKQTPSATNQNVDTQHSSSTASTATLVSETPATVHVTPISVPAPVQEPLVIDHHSDVLTQLDSELRKCFQVSGVSHSASPSTVVESLTSMTPQTIPLACQTVPASIGQAPAVIAAAHAASLIPNASVPQSPSRLDAETGLAGLHEKLEALKMEQDRREDMGDDAIGTTTTDGKDEIPIDTLKGLAEALGKVIHADGRETTPMPPDHPDLTDASTQQLISPSNPDVLTTMSSAVEGSASSTMIEDIDASTSAVDASMMNSMPPGAQNSTDQIPAAMTLSMDQECAQSMTSSITRNTTGTKLATFENLETALSSTLGTHIRQPNAPSSRDETTAPMTPSFTNERIGGGGGGGATSFSIGTPPSHSPFPVSECDYDLKGQMDLESEDPEVIQMIVRHRMEQHKLLEKQRVEIERLRSKIRVPRATSVNPEMIGDDEADTTLTALQSALGNASLSLPASPPPNTETTKVNTTVIPSDVLATRMTMSQSSTKSSNVSVSSRHRDNQSAPPRHHHHQPHPPHHPHLQNHYHPPQNHTSATAPCPSAMVQLQAVSNNNVNPLHQPPHPVSSQIPPQA
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.1	Very low	34.2	Very low	225 Å²	225	112.3 Å²	112.3	100%	1.108	65%	0.645	S	S	*	*				0	124.9	0	-69.6	-51.2	-176	0	0	106.5
2	P	33.7	Very low	34.2	Very low	108 Å²	108	112.3 Å²	112.3	70%	0.701	65%	0.652	S	S	*	*				-109.6	133.8	-100.3	-1.5	21.1	0	0	0	112.2
3	D	31.8	Very low	35	Very low	138 Å²	138	110.5 Å²	110.5	74%	0.738	66%	0.659	S	S	*	*				81.8	136.3	75.9	-67.6	-60.1	0	0	0	113.8
4	S	31.4	Very low	35.3	Very low	80 Å²	80	111.4 Å²	111.4	56%	0.559	67%	0.669	S	S	*	*			trans	75.6	151.6	147.8	-66.4	0	0	0	0	119.5
5	I	31.4	Very low	35.3	Very low	107 Å²	107	112.2 Å²	112.2	55%	0.549	68%	0.677	S	S	.	*			cis	-161.4	131.2	-2.9	-115.9	167.4	0	0	0	113.5	N1267	I5-N1267 PolarHBondContact O-OD1 2.9Å
6	T	34.4	Very low	35.4	Very low	67 Å²	67	112.8 Å²	112.8	41%	0.411	69%	0.688	S	S	.	*			trans	57.5	162.4	146.2	66.8	0	0	0	0	125.9	N1267	T6-N1267 VanDerWaalsContact O-CA 3.23Å; T6-N1267 WeakPolarHBondContact O-CA 3.48Å; T6-N1267 PolarHBondContact O-N 3.27Å
7	N	32.2	Very low	35.5	Very low	76 Å²	76	112.1 Å²	112.1	41%	0.406	69%	0.689	S	S	.	*			trans	64.9	141.6	158.6	-55.2	-18.7	0	0	0	118.3	N1267 L1268 E1269	N7-N1267 CarbonylContact O-C 3.59Å; N7-N1267 VanDerWaalsContact O-O 3.13Å; N7-L1268 WeakPolarHBondContact O-CA 3.3Å; N7-L1268 PolarHBondContact O-N 2.89Å; N7-E1269 HydrophobicContact CB-CB 4.04Å; N7-E1269 HydrophobicContact CB-CG 3.98Å; N7-E1269 WeakPolarHBondContact CB-OE1 3.35Å; N7-E1269 VanDerWaalsContact CB-OE2 3.23Å; N7-E1269 WeakPolarHBondContact CB-OE2 3.46Å; N7-E1269 VanDerWaalsContact ND2-CD 3.26Å; N7-E1269 PolarHBondContact ND2-OE1 3.38Å; N7-E1269 VanDerWaalsContact ND2-OE1 3.14Å; N7-E1269 PolarHBondContact ND2-OE2 3.47Å
8	G	32.7	Very low	35.3	Very low	49 Å²	49	113.4 Å²	113.4	51%	0.505	70%	0.697	S	S	.	*			cis	130.9	122.6	8.3	0	0	0	0	0	111	E1269 V1270	G8-E1269 WeakPolarHBondContact O-CA 3.21Å; G8-V1270 PolarHBondContact O-N 3.06Å
9	G	30.3	Very low	35.1	Very low	60 Å²	60	112.6 Å²	112.6	62%	0.619	70%	0.696	S	S	*	*			trans	176	21.5	-176.5	0	0	0	0	0	123.1	P11	G9-P11 WeakPolarHBondContact O-CD 3.27Å
10	R	43.6	Very low	35	Very low	225 Å²	225	112.4 Å²	112.4	85%	0.849	70%	0.699	S	S	*	*			trans	-78.9	134.3	-179.3	-174.4	-174	-177	-121.5	0.1	114
11	P	40.5	Very low	34.8	Very low	100 Å²	100	112.8 Å²	112.8	65%	0.649	70%	0.701	S	S	*	*			trans	-142.7	-176.5	137.6	40.8	-26.7	0	0	0	112.3	G9	G9-P11 WeakPolarHBondContact O-CD 3.27Å
12	P	33.9	Very low	34.6	Very low	113 Å²	113	108.1 Å²	108.1	73%	0.734	69%	0.686	S	S	*	*			cis	-120.7	-179.7	-10.5	40.3	-26.7	0	0	0	113.9
13	A	44.6	Very low	34.6	Very low	89 Å²	89	107.3 Å²	107.3	74%	0.736	69%	0.688	S	S	*	*			trans	-149	143.6	162.9	0	0	0	0	0	110.1
14	P	39.4	Very low	34.6	Very low	123 Å²	123	105.5 Å²	105.5	80%	0.799	69%	0.686	S	S	*	*			trans	-145.3	177.5	148.1	40	-24.9	0	0	0	113
15	P	36.1	Very low	34.8	Very low	123 Å²	123	107.4 Å²	107.4	80%	0.799	70%	0.695	S	S	*	*			cis	-119.2	157.9	-8.6	37.7	-24.9	0	0	0	114.1
16	S	36.3	Very low	34.8	Very low	122 Å²	122	108.5 Å²	108.5	85%	0.853	71%	0.706	S	S	*	*			trans	-132	131.3	160.4	60.2	0	0	0	0	108.8
17	S	36.9	Very low	34.8	Very low	100 Å²	100	108.6 Å²	108.6	70%	0.699	72%	0.72	S	S	*	*			trans	-142.3	112.1	-176	56.2	0	0	0	0	112.9
18	V	32.6	Very low	34.8	Very low	137 Å²	137	111.6 Å²	111.6	83%	0.83	74%	0.736	S	S	*	*			trans	28.5	141.7	133	-73	0	0	0	0	120
19	S	31.1	Very low	34.6	Very low	98 Å²	98	118.2 Å²	118.2	69%	0.685	75%	0.752	S	S	*	*			cis	-173.4	173.6	8.4	37.1	0	0	0	0	112
20	S	32.9	Very low	34.6	Very low	107 Å²	107	118.5 Å²	118.5	75%	0.748	76%	0.755	S	S	*	*			trans	73.6	147.2	155.2	74.9	0	0	0	0	117.6
21	T	31.3	Very low	34.1	Very low	122 Å²	122	113.9 Å²	113.9	75%	0.748	75%	0.752	S	S	*	*			cis	-159.7	162.7	-14.7	-100.5	0	0	0	0	109.9
22	T	29.7	Very low	33.6	Very low	127 Å²	127	119.7 Å²	119.7	78%	0.779	76%	0.761	S	S	*	*			trans	-25	154.9	171.9	63.5	0	0	0	0	117.8
23	A	34.1	Very low	33.5	Very low	90 Å²	90	124 Å²	124	74%	0.744	76%	0.762	S	S	*	*			cis	-160.9	173.7	42.6	0	0	0	0	0	117.3
24	S	31.4	Very low	32.8	Very low	101 Å²	101	130.9 Å²	130.9	71%	0.706	77%	0.769	S	S	*	*			trans	-44.4	161.5	170.5	54.9	0	0	0	0	115.9
25	T	34.6	Very low	32.3	Very low	120 Å²	120	132.7 Å²	132.7	74%	0.736	77%	0.771	S	S	*	*				-166.4	112.4	81.2	-65.9	0	0	0	0	114.8
26	T	32.3	Very low	32.2	Very low	129 Å²	129	132.1 Å²	132.1	79%	0.791	77%	0.766	S	S	*	*			trans	29.7	128.9	147.7	65.4	0	0	0	0	124.2
27	G	33.7	Very low	31.8	Very low	69 Å²	69	132.7 Å²	132.7	71%	0.711	76%	0.759	S	S	*	*				98.3	165.8	121.8	0	0	0	0	0	119.1
28	N	33	Very low	31.4	Very low	139 Å²	139	135.7 Å²	135.7	74%	0.743	76%	0.755	S	S	*	*			cis	-167.2	130.2	-16.2	-135.2	24.8	0	0	0	111.6
29	F	28.6	Very low	31.3	Very low	189 Å²	189	135.1 Å²	135.1	83%	0.829	75%	0.746	S	S	*	*			trans	59.8	140.2	161.8	-70.5	-119.6	0	0	0	117.2
30	G	31.2	Very low	31.4	Very low	66 Å²	66	134.8 Å²	134.8	68%	0.68	73%	0.732	S	S	*	*				82.5	132.6	83.5	0	0	0	0	0	111.7
31	T	31.7	Very low	31.4	Very low	128 Å²	128	135.9 Å²	135.9	79%	0.785	72%	0.723	S	S	*	*			cis	-171.9	171	31.8	-24.9	0	0	0	0	112.1
32	R	30.2	Very low	31.5	Very low	222 Å²	222	135.3 Å²	135.3	84%	0.838	72%	0.719	S	S	*	*			trans	69.9	106	150	-75.2	167	-173.9	-120.1	-3.4	122.1
33	R	32.1	Very low	31.7	Very low	203 Å²	203	132.7 Å²	132.7	77%	0.766	70%	0.701	S	S	*	*				20.6	142	123.3	-69.6	-178.8	174.3	172.8	-1.9	121
34	R	29.8	Very low	31.7	Very low	233 Å²	233	133.9 Å²	133.9	88%	0.879	69%	0.691	S	S	*	*			trans	76.4	150.2	167	-62.3	173.3	-179.9	166.3	0.9	113.1
35	L	29.8	Very low	31.9	Very low	161 Å²	161	135.4 Å²	135.4	84%	0.843	69%	0.69	S	S	*	*			cis	-140.5	177	28.7	-165.7	60.4	0	0	0	113.6
36	V	33	Very low	32	Very low	112 Å²	112	133.1 Å²	133.1	68%	0.679	67%	0.671	S	S	*	*			trans	-90.5	162	176.5	-172.6	0	0	0	0	110.9
37	N	28.2	Very low	32.4	Very low	134 Å²	134	129.9 Å²	129.9	72%	0.717	65%	0.652	S	S	*	*			trans	80.2	153	177.6	-54.8	-53.6	0	0	0	114.3
38	R	28.2	Very low	32.3	Very low	163 Å²	163	128.3 Å²	128.3	62%	0.615	63%	0.632	S	S	*	*			cis	-168.6	-179.4	-14.1	-107.3	-163.5	175.7	163.7	0.3	107.9	E1229	R38-E1229 WeakPolarHBondContact CB-OE1 3.3Å; R38-E1229 WeakPolarHBondContact CD-OE1 3.36Å; R38-E1229 WeakPolarHBondContact CG-OE1 3.22Å; R38-E1229 IonicContact NE-OE1 3.2Å
39	I	31.7	Very low	32.2	Very low	125 Å²	125	130.4 Å²	130.4	64%	0.641	64%	0.638	S	S	*	*			trans	72.4	115.9	162.5	-68.8	149.2	0	0	0	114.4	E1229	I39-E1229 WeakPolarHBondContact CA-OE2 3.41Å; I39-E1229 PolarHBondContact N-OE1 3.02Å
40	K	31.5	Very low	32.4	Very low	91 Å²	91	128.4 Å²	128.4	40%	0.396	63%	0.631	S	S	.	*				68.1	142.5	79.1	-76.3	-177.8	175.9	85.6	0	113.1	A1228 E1229	K40-A1228 WeakPolarHBondContact CE-O 3.37Å; K40-A1228 HydrophobicContact CG-CB 3.73Å; K40-A1228 PolarHBondContact NZ-O 2.8Å; K40-E1229 WeakPolarHBondContact CG-OE2 3.25Å; K40-E1229 PolarHBondContact NZ-O 3.31Å; K40-E1229 IonicContact NZ-OE2 2.66Å; K40-E1229 PolarHBondContact NZ-OE2 3.42Å
41	K	32.5	Very low	32.4	Very low	130 Å²	130	132 Å²	132	57%	0.565	63%	0.634	S	S	*	*			cis	-154	-171.1	-0.3	-149.6	-169	171.3	-86.3	0	109.6	D43	K41-D43 IonicContact NZ-OD1 2.77Å; K41-D43 IonicContact NZ-OD2 2.59Å; K41-D43 PolarHBondContact NZ-OD2 3.01Å
42	V	33.4	Very low	32.5	Very low	109 Å²	109	131.8 Å²	131.8	66%	0.661	64%	0.636	S	S	*	*			trans	87.6	104.5	168.6	-168.6	0	0	0	0	113
43	D	35.7	Very low	32.8	Very low	73 Å²	73	128.1 Å²	128.1	39%	0.39	64%	0.638	S	S	.	*				79.8	124.3	54	-51.1	-48.6	0	0	0	111.9	K41 V1225	K41-D43 IonicContact NZ-OD1 2.77Å; K41-D43 IonicContact NZ-OD2 2.59Å; K41-D43 PolarHBondContact NZ-OD2 3.01Å; D43-V1225 HydrophobicContact CB-CG1 4.4Å; D43-V1225 WeakPolarHBondContact OD1-CG1 3.35Å
44	E	33.8	Very low	32.8	Very low	114 Å²	114	128 Å²	128	53%	0.533	65%	0.649	S	S	.	*			cis	-164.1	161.7	-5.8	-101.8	-168.6	118.1	0	0	109.1	Q1223 V1225	E44-Q1223 HydrophobicContact CB-CG 3.74Å; E44-Q1223 HydrophobicContact CG-CG 3.73Å; E44-Q1223 WeakPolarHBondContact OE1-CB 3.34Å; E44-Q1223 VanDerWaalsContact OE1-CG 3.27Å; E44-Q1223 WeakPolarHBondContact OE1-CG 3.46Å; E44-Q1223 PolarHBondContact OE1-OE1 3.36Å; E44-V1225 HydrophobicContact CG-CB 3.97Å; E44-V1225 HydrophobicContact CG-CG1 4.31Å
45	L	35.9	Very low	32.9	Very low	133 Å²	133	119.7 Å²	119.7	70%	0.696	64%	0.636	S	S	*	*			trans	170.8	139.3	144	-87.5	-172.6	0	0	0	115.4	Q1223 P1224	L45-Q1223 VanDerWaalsContact CA-CD 3.48Å; L45-Q1223 VanDerWaalsContact CA-NE2 3.31Å; L45-P1224 WeakPolarHBondContact O-CD 3.17Å; L45-P1224 VanDerWaalsContact O-CG 3.26Å; L45-P1224 WeakPolarHBondContact O-CG 3.28Å
46	H	36.4	Very low	33.1	Very low	73 Å²	73	117.8 Å²	117.8	34%	0.338	64%	0.636	S	S	.	*			trans	-72.9	168.2	-151.2	-107.6	-78.6	0	0	0	119.4	S1147 I1148 V1222 Q1223 P1224	H46-S1147 PolarHBondContact O-OG 2.17Å; H46-I1148 HydrophobicContact CB-CD1 3.93Å; H46-I1148 HydrophobicContact CB-CG2 4.06Å; H46-I1148 WeakPolarHBondContact O-CG2 3.4Å; H46-V1222 VanDerWaalsContact CB-C 3.48Å; H46-V1222 VanDerWaalsContact CB-CA 3.43Å; H46-V1222 HydrophobicContact CB-CB 4Å; H46-V1222 HydrophobicContact CB-CG1 3.55Å; H46-V1222 VanDerWaalsContact CD2-CA 3.46Å; H46-V1222 WeakPolarHBondContact CD2-CA 3.37Å; H46-V1222 PolarHBondContact CD2-O 2.18Å; H46-V1222 WeakPolarHBondContact CE1-CA 3.48Å; H46-V1222 PolarHBondContact CE1-O 2.39Å; H46-V1222 VanDerWaalsContact CG-O 3.27Å; H46-V1222 WeakPolarHBondContact ND1-CA 3.36Å; H46-V1222 PolarHBondContact ND1-N 2.19Å; H46-V1222 VanDerWaalsContact ND1-N 3.13Å; H46-V1222 PolarHBondContact ND1-O 2.16Å; H46-V1222 PolarHBondContact NE2-O 2.9Å; H46-Q1223 WeakPolarHBondContact CD2-CA 3.17Å; H46-Q1223 WeakPolarHBondContact CD2-CB 3.48Å; H46-Q1223 PolarHBondContact CD2-N 3.4Å; H46-Q1223 PolarHBondContact CD2-NE2 2.71Å; H46-Q1223 PolarHBondContact CE1-N 3.5Å; H46-Q1223 VanDerWaalsContact CG-NE2 3.32Å; H46-Q1223 WeakPolarHBondContact ND1-CA 3.31Å; H46-Q1223 PolarHBondContact ND1-N 2.64Å; H46-Q1223 PolarHBondContact NE2-N 2.88Å; H46-P1224 VanDerWaalsContact CA-CD 3.4Å
47	P	39.4	Very low	33.5	Very low	61 Å²	61	117.4 Å²	117.4	40%	0.396	63%	0.626	S	S	.	*			trans	-117.6	161.3	-164.9	42	-31.4	0	0	0	118.7	I1148	P47-I1148 WeakPolarHBondContact O-CD1 3.48Å
48	A	33.1	Very low	34.2	Very low	35 Å²	35	123.2 Å²	123.2	29%	0.289	64%	0.638	S	S	.	*			trans	-158.6	111.7	173.3	0	0	0	0	0	119.3	S1146 I1148	A48-S1146 VanDerWaalsContact O-CA 3.23Å; A48-S1146 WeakPolarHBondContact O-CA 3.4Å; A48-S1146 WeakPolarHBondContact O-CB 3.23Å; A48-I1148 HydrophobicContact CB-CB 4.14Å; A48-I1148 HydrophobicContact CB-CG1 4.18Å
49	Q	29.9	Very low	35.6	Very low	183 Å²	183	119 Å²	119	86%	0.855	63%	0.627	S	S	*	*			trans	33.2	119.9	134	-174.1	177.7	-13.9	0	0	122.5
50	E	33.7	Very low	37.7	Very low	148 Å²	148	115.5 Å²	115.5	69%	0.692	61%	0.614	S	S	*	*			trans	-145	173.2	150.8	-81.4	-147.8	134	0	0	112.5
51	N	30.3	Very low	39.2	Very low	140 Å²	140	118.9 Å²	118.9	75%	0.749	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-83.2	154.2	-150.1	-59.4	-56.8	0	0	0	118.6
52	P	35	Very low	40.8	Very low	125 Å²	125	119.3 Å²	119.3	81%	0.812	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-98.6	127.4	159.6	35.5	-27.8	0	0	0	112.7
53	T	35.6	Very low	42.4	Very low	145 Å²	145	118.4 Å²	118.4	89%	0.89	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-87.4	145.7	171.5	28.5	0	0	0	0	112.3
54	M	32.2	Very low	44.1	Very low	200 Å²	200	122.1 Å²	122.1	99%	0.985	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-75.2	129.9	-175.9	-64.2	-171.3	-170.5	0	0	113
55	G	31.3	Very low	46	Very low	59 Å²	59	119.5 Å²	119.5	61%	0.608	63%	0.627	S	S	*	*			trans	167.3	138	163.3	0	0	0	0	0	115.5	H57	G55-H57 PolarHBondContact O-N 3.46Å
56	S	35.4	Very low	47.9	Very low	121 Å²	121	121.6 Å²	121.6	85%	0.846	63%	0.626	S	S	*	*	S	Bend	trans	64.3	32.2	156.5	68.3	0	0	0	0	120.4
57	H	40.4	Very low	49.5	Very low	104 Å²	104	122.4 Å²	122.4	48%	0.481	63%	0.632	S	S	.	*			trans	-131.3	77.5	170.6	-142.2	-99.1	0	0	0	113.4	G55 L59 R64	G55-H57 PolarHBondContact O-N 3.46Å; H57-L59 PolarHBondContact CE1-O 3.05Å; H57-L59 PolarHBondContact ND1-O 3.4Å; H57-R64 PolarHBondContact NE2-NH1 3.19Å
58	W	43.1	Very low	51.3	Low	255 Å²	255	125 Å²	125	97%	0.966	64%	0.639	S	S	*	*			trans	-85.5	-5.7	-177.4	-83.2	96.8	0	0	0	115.3
59	L	57.7	Low	53.5	Low	74 Å²	74	126 Å²	126	39%	0.387	65%	0.647	S	S	.	*	S	Bend	trans	-115.4	133.1	174.7	-71.1	161.4	0	0	0	107.1	H57 E63 L67	H57-L59 PolarHBondContact CE1-O 3.05Å; H57-L59 PolarHBondContact ND1-O 3.4Å; L59-E63 HydrophobicContact CB-CB 4.32Å; L59-E63 HydrophobicContact CD2-CB 4.02Å; L59-L67 HydrophobicContact CD1-CD1 3.65Å; L59-L67 HydrophobicContact CD2-CD1 3.92Å; L59-L67 HydrophobicContact CG-CD1 4.44Å
60	S	76.2	Confident	55.6	Low	52 Å²	52	121.8 Å²	121.8	36%	0.364	63%	0.634	S	S	.	*			trans	-58.7	155.2	168.7	63.3	0	0	0	0	110.4	Q62 E63 R64	S60-Q62 PolarHBondContact O-N 3.45Å; S60-Q62 VanDerWaalsContact O-N 3.1Å; S60-E63 VanDerWaalsContact CB-OE2 3.28Å; S60-E63 WeakPolarHBondContact CB-OE2 3.49Å; S60-E63 PolarHBondContact N-OE2 2.85Å; S60-E63 PolarHBondContact O-N 3.46Å; S60-E63 WeakPolarHBondContact OG-CG 3.5Å; S60-E63 PolarHBondContact OG-N 3.19Å; S60-E63 VanDerWaalsContact OG-N 3.11Å; S60-E63 PolarHBondContact OG-OE2 3.26Å; S60-R64 PolarHBondContact O-N 2.92Å
61	E	62.3	Low	57.5	Low	162 Å²	162	119.6 Å²	119.6	76%	0.757	62%	0.623	S	S	*	*	H	α-helix	trans	-54.1	-32.2	171.4	-68.6	-170.2	122.5	0	0	111.8	R64 S65	E61-R64 PolarHBondContact O-N 2.87Å; E61-S65 WeakPolarHBondContact O-CB 3.37Å; E61-S65 PolarHBondContact O-N 3.11Å
62	Q	65.9	Low	59.5	Low	139 Å²	139	117 Å²	117	65%	0.65	61%	0.607	S	S	*	*	H	α-helix	trans	-67.2	-36.8	176.5	-158.3	71.5	87.7	0	0	112.7	S60 R66	S60-Q62 PolarHBondContact O-N 3.45Å; S60-Q62 VanDerWaalsContact O-N 3.1Å; Q62-R66 WeakPolarHBondContact O-CB 3.37Å; Q62-R66 VanDerWaalsContact O-CG 3.23Å; Q62-R66 WeakPolarHBondContact O-CG 3.46Å; Q62-R66 PolarHBondContact O-N 2.77Å
63	E	68.3	Low	61.4	Low	90 Å²	90	115.3 Å²	115.3	42%	0.421	59%	0.591	S	S	.	*	H	α-helix	trans	-78.2	-37.7	174.6	-71.7	159.6	126	0	0	112.2	L59 S60 R66 L67	L59-E63 HydrophobicContact CB-CB 4.32Å; L59-E63 HydrophobicContact CD2-CB 4.02Å; S60-E63 VanDerWaalsContact CB-OE2 3.28Å; S60-E63 WeakPolarHBondContact CB-OE2 3.49Å; S60-E63 PolarHBondContact N-OE2 2.85Å; S60-E63 PolarHBondContact O-N 3.46Å; S60-E63 WeakPolarHBondContact OG-CG 3.5Å; S60-E63 PolarHBondContact OG-N 3.19Å; S60-E63 VanDerWaalsContact OG-N 3.11Å; S60-E63 PolarHBondContact OG-OE2 3.26Å; E63-R66 PolarHBondContact O-N 2.99Å; E63-L67 WeakPolarHBondContact O-CB 3.37Å; E63-L67 PolarHBondContact O-N 3.47Å
64	R	70.8	Confident	62.8	Low	151 Å²	151	115.8 Å²	115.8	57%	0.57	58%	0.576	S	S	*	*	H	α-helix	trans	-61.5	-45.3	173.5	-161.6	177.4	-171	-172.4	7.3	110.5	H57 S60 E61 R66 L67 E68	H57-R64 PolarHBondContact NE2-NH1 3.19Å; S60-R64 PolarHBondContact O-N 2.92Å; E61-R64 PolarHBondContact O-N 2.87Å; R64-R66 PolarHBondContact O-N 3.2Å; R64-L67 PolarHBondContact O-N 3.36Å; R64-E68 VanDerWaalsContact O-CB 3.28Å; R64-E68 WeakPolarHBondContact O-CB 3.48Å; R64-E68 PolarHBondContact O-N 2.61Å
65	S	74	Confident	64.6	Low	60 Å²	60	113.8 Å²	113.8	42%	0.42	56%	0.558	S	S	.	*	H	α-helix	trans	-64.8	-33.8	172.7	179.9	0	0	0	0	112.7	E61 A69	E61-S65 WeakPolarHBondContact O-CB 3.37Å; E61-S65 PolarHBondContact O-N 3.11Å; S65-A69 WeakPolarHBondContact O-CB 3.25Å; S65-A69 PolarHBondContact O-N 2.88Å
66	R	74.3	Confident	66.1	Low	177 Å²	177	119.9 Å²	119.9	67%	0.668	56%	0.562	S	S	*	*	H	α-helix	trans	-69.3	-41	172	-79	175.1	73.6	-171.8	2.8	112.7	Q62 E63 R64 A69 V70	Q62-R66 WeakPolarHBondContact O-CB 3.37Å; Q62-R66 VanDerWaalsContact O-CG 3.23Å; Q62-R66 WeakPolarHBondContact O-CG 3.46Å; Q62-R66 PolarHBondContact O-N 2.77Å; E63-R66 PolarHBondContact O-N 2.99Å; R64-R66 PolarHBondContact O-N 3.2Å; R66-A69 PolarHBondContact O-N 3.2Å; R66-V70 WeakPolarHBondContact O-CB 3.16Å; R66-V70 VanDerWaalsContact O-CG2 3.3Å; R66-V70 WeakPolarHBondContact O-CG2 3.09Å; R66-V70 PolarHBondContact O-N 3.17Å
67	L	70.6	Confident	67.1	Low	90 Å²	90	118.4 Å²	118.4	47%	0.471	55%	0.549	S	S	.	.	H	α-helix	trans	-65.7	-41.8	174.8	-84.2	162	0	0	0	111.5	L59 E63 R64 V70 Q71	L59-L67 HydrophobicContact CD1-CD1 3.65Å; L59-L67 HydrophobicContact CD2-CD1 3.92Å; L59-L67 HydrophobicContact CG-CD1 4.44Å; E63-L67 WeakPolarHBondContact O-CB 3.37Å; E63-L67 PolarHBondContact O-N 3.47Å; R64-L67 PolarHBondContact O-N 3.36Å; L67-V70 PolarHBondContact O-N 3.05Å; L67-Q71 PolarHBondContact O-N 2.93Å
68	E	78.4	Confident	67.6	Low	116 Å²	116	118.7 Å²	118.7	54%	0.542	55%	0.545	S	S	.	.	H	α-helix	trans	-67.7	-38.4	175.8	-172.1	167.6	-134.3	0	0	111.9	R64 Q71 Q72	R64-E68 VanDerWaalsContact O-CB 3.28Å; R64-E68 WeakPolarHBondContact O-CB 3.48Å; R64-E68 PolarHBondContact O-N 2.61Å; E68-Q71 PolarHBondContact O-N 2.91Å; E68-Q72 WeakPolarHBondContact O-CB 3.42Å; E68-Q72 WeakPolarHBondContact O-CG 3.47Å; E68-Q72 PolarHBondContact O-N 3.26Å
69	A	78.4	Confident	67.4	Low	54 Å²	54	111.7 Å²	111.7	45%	0.446	53%	0.533	S	S	.	.	H	α-helix	trans	-63.2	-43.9	170.8	0	0	0	0	0	111.8	S65 R66 Q72 D73	S65-A69 WeakPolarHBondContact O-CB 3.25Å; S65-A69 PolarHBondContact O-N 2.88Å; R66-A69 PolarHBondContact O-N 3.2Å; A69-Q72 PolarHBondContact O-N 3.43Å; A69-D73 VanDerWaalsContact O-CB 3.29Å; A69-D73 WeakPolarHBondContact O-CB 3.48Å; A69-D73 PolarHBondContact O-N 3.25Å
70	V	74.3	Confident	66.4	Low	96 Å²	96	116.4 Å²	116.4	58%	0.582	56%	0.555	S	S	*	*	H	α-helix	trans	-64.7	-38.3	175.1	168	0	0	0	0	111.5	R66 L67 D73 W74	R66-V70 WeakPolarHBondContact O-CB 3.16Å; R66-V70 VanDerWaalsContact O-CG2 3.3Å; R66-V70 WeakPolarHBondContact O-CG2 3.09Å; R66-V70 PolarHBondContact O-N 3.17Å; L67-V70 PolarHBondContact O-N 3.05Å; V70-D73 PolarHBondContact O-N 2.89Å; V70-W74 VanDerWaalsContact O-CB 3.25Å; V70-W74 WeakPolarHBondContact O-CB 3.42Å; V70-W74 PolarHBondContact O-N 3.41Å
71	Q	74	Confident	64.5	Low	101 Å²	101	120.3 Å²	120.3	47%	0.472	57%	0.565	S	S	.	*	H	α-helix	trans	-69	-34.2	172.6	-78.1	-163	2.4	0	0	113.1	L67 E68 R75	L67-Q71 PolarHBondContact O-N 2.93Å; E68-Q71 PolarHBondContact O-N 2.91Å; Q71-R75 WeakPolarHBondContact O-CB 3.05Å; Q71-R75 WeakPolarHBondContact O-CG 3.37Å; Q71-R75 PolarHBondContact O-N 2.97Å
72	Q	71.6	Confident	62.9	Low	87 Å²	87	122.8 Å²	122.8	41%	0.407	57%	0.568	S	S	.	*	H	α-helix	trans	-70.1	-40.3	173.1	-78.7	-162.5	35.4	0	0	111.4	E68 A69 R75 R76	E68-Q72 WeakPolarHBondContact O-CB 3.42Å; E68-Q72 WeakPolarHBondContact O-CG 3.47Å; E68-Q72 PolarHBondContact O-N 3.26Å; A69-Q72 PolarHBondContact O-N 3.43Å; Q72-R75 CarbonylContact O-C 3.58Å; Q72-R75 PolarHBondContact O-N 3Å; Q72-R76 WeakPolarHBondContact O-CB 3.28Å; Q72-R76 WeakPolarHBondContact O-CD 3.4Å; Q72-R76 WeakPolarHBondContact O-CG 3.41Å; Q72-R76 PolarHBondContact O-N 2.82Å; Q72-R76 VanDerWaalsContact OE1-NH2 3.1Å
73	D	75.7	Confident	61.4	Low	88 Å²	88	121.2 Å²	121.2	47%	0.471	57%	0.568	S	S	.	*	H	α-helix	trans	-63.3	-47.4	176.2	-168.7	32.8	0	0	0	110.7	A69 V70 R75 R76 T77	A69-D73 VanDerWaalsContact O-CB 3.29Å; A69-D73 WeakPolarHBondContact O-CB 3.48Å; A69-D73 PolarHBondContact O-N 3.25Å; V70-D73 PolarHBondContact O-N 2.89Å; D73-R75 VanDerWaalsContact C-N 3.29Å; D73-R75 PolarHBondContact O-N 3.49Å; D73-R76 PolarHBondContact O-N 3.13Å; D73-T77 WeakPolarHBondContact O-CB 3.32Å; D73-T77 WeakPolarHBondContact O-CG2 3.06Å; D73-T77 PolarHBondContact O-N 3.42Å; D73-T77 PolarHBondContact O-OG1 2.93Å
74	W	63.9	Low	59.4	Low	155 Å²	155	121.8 Å²	121.8	59%	0.587	58%	0.582	S	S	*	*	H	α-helix	trans	-60.6	-33	172.9	-172.1	75.3	0	0	0	113.6	V70 T77	V70-W74 VanDerWaalsContact O-CB 3.25Å; V70-W74 WeakPolarHBondContact O-CB 3.42Å; V70-W74 PolarHBondContact O-N 3.41Å; W74-T77 WeakPolarHBondContact CA-OG1 3.34Å
75	R	70.3	Confident	57.4	Low	159 Å²	159	123.7 Å²	123.7	60%	0.6	59%	0.594	S	S	*	*	H	α-helix	trans	-75.8	-29.8	172.1	-76.3	173.3	177.4	118.9	-0.5	113.5	Q71 Q72 D73	Q71-R75 WeakPolarHBondContact O-CB 3.05Å; Q71-R75 WeakPolarHBondContact O-CG 3.37Å; Q71-R75 PolarHBondContact O-N 2.97Å; Q72-R75 CarbonylContact O-C 3.58Å; Q72-R75 PolarHBondContact O-N 3Å; D73-R75 VanDerWaalsContact C-N 3.29Å; D73-R75 PolarHBondContact O-N 3.49Å
76	R	61.8	Low	55.3	Low	186 Å²	186	130 Å²	130	70%	0.702	61%	0.614	S	S	*	*	H	α-helix	trans	-84.8	-25.8	-179.8	-74	166.6	-173.1	-114.1	5.9	113.3	Q72 D73	Q72-R76 WeakPolarHBondContact O-CB 3.28Å; Q72-R76 WeakPolarHBondContact O-CD 3.4Å; Q72-R76 WeakPolarHBondContact O-CG 3.41Å; Q72-R76 PolarHBondContact O-N 2.82Å; Q72-R76 VanDerWaalsContact OE1-NH2 3.1Å; D73-R76 PolarHBondContact O-N 3.13Å
77	T	57.1	Low	53.1	Low	91 Å²	91	132.2 Å²	132.2	56%	0.558	62%	0.623	S	S	*	*	S	Bend	trans	-87	-9.5	-179.6	48.1	0	0	0	0	113.8	D73 W74	D73-T77 WeakPolarHBondContact O-CB 3.32Å; D73-T77 WeakPolarHBondContact O-CG2 3.06Å; D73-T77 PolarHBondContact O-N 3.42Å; D73-T77 PolarHBondContact O-OG1 2.93Å; W74-T77 WeakPolarHBondContact CA-OG1 3.34Å
78	R	50.6	Low	51.2	Low	110 Å²	110	133.8 Å²	133.8	42%	0.415	64%	0.638	S	S	.	*	S	Bend	trans	-71.6	128.7	165.2	-91.5	-162.1	173.4	-91.9	7.7	110.5	M80 E320	R78-M80 PolarHBondContact O-N 3.31Å; R78-E320 IonicContact CZ-OE1 2.62Å; R78-E320 IonicContact NH1-OE1 3.76Å; R78-E320 PolarHBondContact NH1-OE1 3.17Å; R78-E320 IonicContact NH1-OE2 3.69Å; R78-E320 PolarHBondContact NH1-OE2 2.99Å; R78-E320 IonicContact NH2-OE1 2.77Å; R78-E320 PolarHBondContact NH2-OE1 3.3Å
79	P	38.7	Very low	49	Very low	108 Å²	108	135.9 Å²	135.9	70%	0.701	65%	0.653	S	S	*	*			trans	-64.4	104.3	174	-21.6	33.7	0	0	0	111.7	K81	P79-K81 PolarHBondContact O-N 2.93Å
80	M	36.5	Very low	46.9	Very low	172 Å²	172	140 Å²	140	85%	0.847	67%	0.668	S	S	*	*			trans	-81.7	57.7	-176.7	-154.5	172	-164.6	0	0	112.2	R78 W82	R78-M80 PolarHBondContact O-N 3.31Å; M80-W82 PolarHBondContact O-N 3.33Å
81	K	37.1	Very low	44.9	Very low	134 Å²	134	140.3 Å²	140.3	58%	0.583	67%	0.671	S	S	*	*			trans	-68.8	61.4	173.7	-75.3	-177.8	-173.9	165.2	0	111.2	P79 T83 D317	P79-K81 PolarHBondContact O-N 2.93Å; K81-T83 HydrophobicContact CB-CG2 4.37Å; K81-T83 PolarHBondContact O-N 3.44Å; K81-D317 IonicContact NZ-OD2 2.65Å; K81-D317 PolarHBondContact NZ-OD2 3.25Å
82	W	29	Very low	42.8	Very low	215 Å²	215	141.9 Å²	141.9	81%	0.814	69%	0.688	S	S	*	*			trans	-73.2	78.5	165.7	-163.5	-57.8	0	0	0	108.7	M80 S84	M80-W82 PolarHBondContact O-N 3.33Å; W82-S84 VanDerWaalsContact C-N 3.29Å; W82-S84 PolarHBondContact O-N 3.09Å
83	T	33.2	Very low	40.9	Very low	106 Å²	106	143.9 Å²	143.9	65%	0.65	71%	0.706	S	S	*	*			trans	-75.7	82	-176.4	52.3	0	0	0	0	111.2	K81 K85	K81-T83 HydrophobicContact CB-CG2 4.37Å; K81-T83 PolarHBondContact O-N 3.44Å; T83-K85 PolarHBondContact O-N 3.26Å
84	S	27.8	Very low	38.7	Very low	102 Å²	102	144.6 Å²	144.6	71%	0.713	72%	0.718	S	S	*	*			trans	-66.3	55	155.5	-63.7	0	0	0	0	110.3	W82 K86	W82-S84 VanDerWaalsContact C-N 3.29Å; W82-S84 PolarHBondContact O-N 3.09Å; S84-K86 PolarHBondContact O-N 2.98Å
85	K	29	Very low	37.1	Very low	191 Å²	191	142.6 Å²	142.6	83%	0.83	73%	0.728	S	S	*	*			trans	-80.8	105.4	-179.2	-150.6	168.8	-172.4	178.8	0	106.9	T83	T83-K85 PolarHBondContact O-N 3.26Å
86	K	28.8	Very low	35.1	Very low	192 Å²	192	140.2 Å²	140.2	84%	0.835	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-50.4	154.9	172.3	-66.8	179.9	176.6	-178.5	0	109.8	S84	S84-K86 PolarHBondContact O-N 2.98Å
87	R	27.4	Very low	33.6	Very low	224 Å²	224	136.8 Å²	136.8	85%	0.845	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-48	141.7	167.1	-66.4	-178.3	177.7	-172.7	-1.9	109.4	D89	R87-D89 PolarHBondContact O-N 2.69Å
88	P	32.5	Very low	32.3	Very low	122 Å²	122	137.8 Å²	137.8	79%	0.792	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-60.3	129.2	159.4	28.7	-32	0	0	0	107.6
89	D	31.1	Very low	31.2	Very low	161 Å²	161	139.1 Å²	139.1	86%	0.861	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-69.6	128.1	164.1	-68.6	-58.6	0	0	0	107.3	R87 P91	R87-D89 PolarHBondContact O-N 2.69Å; D89-P91 VanDerWaalsContact O-CD 3.31Å; D89-P91 WeakPolarHBondContact O-CD 3.5Å
90	D	34.2	Very low	30.7	Very low	141 Å²	141	138.1 Å²	138.1	75%	0.754	76%	0.759	S	S	*	*			trans	-99.5	108.3	-166.3	-173.8	10.7	0	0	0	111
91	P	31.8	Very low	30.3	Very low	101 Å²	101	137.2 Å²	137.2	66%	0.656	76%	0.756	S	S	*	*			trans	-89.6	133.3	175.9	34.6	-30.3	0	0	0	111	D89	D89-P91 VanDerWaalsContact O-CD 3.31Å; D89-P91 WeakPolarHBondContact O-CD 3.5Å
92	T	30.8	Very low	30	Very low	134 Å²	134	135.1 Å²	135.1	82%	0.822	76%	0.758	S	S	*	*			trans	85.6	81.1	169.1	72.9	0	0	0	0	118.2
93	T	31.7	Very low	29.9	Very low	129 Å²	129	132.2 Å²	132.2	79%	0.791	76%	0.759	S	S	*	*			trans	-141.6	126.7	132.7	-25.7	0	0	0	0	112.3
94	S	29.7	Very low	29.8	Very low	103 Å²	103	131 Å²	131	72%	0.72	76%	0.759	S	S	*	*			trans	-9.5	116.9	172.4	55.3	0	0	0	0	119.8
95	S	29.7	Very low	29.9	Very low	114 Å²	114	133.2 Å²	133.2	80%	0.797	76%	0.763	S	S	*	*			trans	-88	119.1	147.2	54.4	0	0	0	0	110.2
96	P	29.4	Very low	29.9	Very low	109 Å²	109	131 Å²	131	71%	0.708	76%	0.755	S	S	*	*			trans	-84.3	154.7	169.5	34.5	-33.6	0	0	0	111.3
97	S	28.7	Very low	29.9	Very low	113 Å²	113	127.9 Å²	127.9	79%	0.79	75%	0.747	S	S	*	*			trans	62.7	146.6	-179.6	69.7	0	0	0	0	115.1
98	T	30.9	Very low	30.2	Very low	112 Å²	112	122.5 Å²	122.5	69%	0.687	74%	0.744	S	S	*	*			cis	-131.5	121.3	22.7	-60	0	0	0	0	112.2
99	V	28.2	Very low	30.1	Very low	138 Å²	138	122.9 Å²	122.9	84%	0.836	74%	0.744	S	S	*	*			trans	-85	110.1	158.1	176.9	0	0	0	0	107.1
100	S	27.4	Very low	30.3	Very low	87 Å²	87	120.6 Å²	120.6	61%	0.608	74%	0.739	S	S	*	*			trans	-79	147.5	168	-62.2	0	0	0	0	109.8
101	I	27.7	Very low	30	Very low	153 Å²	153	118.7 Å²	118.7	79%	0.785	74%	0.736	S	S	*	*			trans	74.6	123.3	174.8	-48.1	157.2	0	0	0	110.9
102	S	30.1	Very low	29.8	Very low	90 Å²	90	120.8 Å²	120.8	63%	0.629	74%	0.741	S	S	*	*			cis	-155.6	154.6	20.1	20.9	0	0	0	0	115
103	N	28.5	Very low	29.6	Very low	155 Å²	155	121 Å²	121	83%	0.829	74%	0.738	S	S	*	*			trans	69.9	153	140.8	-65.3	-0.1	0	0	0	122.1
104	A	31.4	Very low	29.5	Very low	79 Å²	79	122 Å²	122	65%	0.653	74%	0.738	S	S	*	*			trans	71.4	103.7	150.9	0	0	0	0	0	115.8
105	L	29.8	Very low	29.5	Very low	150 Å²	150	123.7 Å²	123.7	79%	0.785	74%	0.744	S	S	*	*				81.8	136.6	87.6	-96.5	60.3	0	0	0	111.2
106	E	28.9	Very low	29.5	Very low	145 Å²	145	123.4 Å²	123.4	68%	0.678	74%	0.741	S	S	*	*			cis	-166.4	162.8	-14.6	-132.5	-178.2	-155.3	0	0	108.7
107	N	28.8	Very low	29.5	Very low	125 Å²	125	122.7 Å²	122.7	67%	0.668	74%	0.739	S	S	*	*			trans	48.3	151.2	143	-66.3	-28.2	0	0	0	123.2
108	S	32.7	Very low	29.4	Very low	112 Å²	112	124.4 Å²	124.4	78%	0.783	74%	0.738	S	S	*	*			trans	87.7	80.9	153.1	-53	0	0	0	0	119.4
109	T	30.4	Very low	29.2	Very low	129 Å²	129	123.9 Å²	123.9	79%	0.791	73%	0.734	S	S	*	*				-52.2	178.2	125.4	56.4	0	0	0	0	111.3
110	P	36.2	Very low	29.2	Very low	114 Å²	114	124 Å²	124	74%	0.74	73%	0.73	S	S	*	*			cis	-145	-176.8	14.3	44.8	-25.5	0	0	0	117.9
111	S	27.3	Very low	29.3	Very low	101 Å²	101	124.8 Å²	124.8	71%	0.706	74%	0.736	S	S	*	*			trans	71.7	117.1	144.4	-157.1	0	0	0	0	120.3
112	L	27.2	Very low	29.5	Very low	145 Å²	145	122.6 Å²	122.6	76%	0.759	73%	0.734	S	S	*	*				-178.2	128.2	106.4	-94.5	161.7	0	0	0	113.3
113	N	27.2	Very low	29.8	Very low	139 Å²	139	124.1 Å²	124.1	74%	0.743	75%	0.745	S	S	*	*			trans	66.8	129.6	151.9	-61.3	-13.4	0	0	0	123.5
114	N	29.6	Very low	30.2	Very low	150 Å²	150	121.6 Å²	121.6	80%	0.802	74%	0.737	S	S	*	*			trans	76.1	140	150.5	-82.7	-0.2	0	0	0	122.1
115	V	29.9	Very low	30.3	Very low	138 Å²	138	127.9 Å²	127.9	84%	0.836	75%	0.75	S	S	*	*			trans	49.3	94.2	167.5	-171.9	0	0	0	0	115.3
116	S	28.7	Very low	30.3	Very low	107 Å²	107	125.3 Å²	125.3	75%	0.748	75%	0.745	S	S	*	*			trans	-156.2	123.3	169.6	-77.5	0	0	0	0	111.5
117	S	28.9	Very low	30.5	Very low	95 Å²	95	126.2 Å²	126.2	66%	0.664	75%	0.753	S	S	*	*			trans	44.4	176.7	135	68.8	0	0	0	0	121.8
118	I	26.9	Very low	30.6	Very low	149 Å²	149	124.9 Å²	124.9	76%	0.764	75%	0.754	S	S	*	*			trans	70.7	131.1	159.1	-65.6	164.3	0	0	0	115.9
119	T	27.9	Very low	30.4	Very low	100 Å²	100	124.6 Å²	124.6	61%	0.613	75%	0.752	S	S	*	*			cis	-164	-160.8	-19.4	37.7	0	0	0	0	106.5
120	N	27.7	Very low	30.4	Very low	140 Å²	140	123.2 Å²	123.2	75%	0.749	75%	0.753	S	S	*	*			trans	87	148.3	159.9	-40.7	-32.1	0	0	0	113.9
121	S	30.2	Very low	30.1	Very low	105 Å²	105	121.9 Å²	121.9	73%	0.734	75%	0.752	S	S	*	*			cis	-143.8	122.8	10.4	-48.2	0	0	0	0	107.7
122	S	31.3	Very low	30.3	Very low	106 Å²	106	123 Å²	123	74%	0.741	76%	0.755	S	S	*	*				80.1	106.1	62.3	78	0	0	0	0	115.6
123	S	36.8	Very low	30.5	Very low	123 Å²	123	120.9 Å²	120.9	86%	0.86	75%	0.752	S	S	*	*			trans	-163.2	91.1	157.1	58.6	0	0	0	0	112.5
124	P	36.3	Very low	30.6	Very low	102 Å²	102	120.1 Å²	120.1	66%	0.662	75%	0.753	S	S	*	*			trans	-105	158.8	175.4	38.7	-32.1	0	0	0	112.9
125	F	33.7	Very low	30.7	Very low	210 Å²	210	117.7 Å²	117.7	92%	0.921	75%	0.754	S	S	*	*			trans	-169	129.3	150.2	-92.9	-76	0	0	0	106.6
126	S	29.5	Very low	30.7	Very low	97 Å²	97	116.4 Å²	116.4	68%	0.678	75%	0.751	S	S	*	*			cis	105.6	111.6	17.2	-65	0	0	0	0	113.8
127	L	34.3	Very low	30.8	Very low	163 Å²	163	115.7 Å²	115.7	85%	0.853	75%	0.751	S	S	*	*			trans	173.6	121.7	157.1	-92.8	154.8	0	0	0	105.2
128	S	29.8	Very low	30.7	Very low	97 Å²	97	118.2 Å²	118.2	68%	0.678	76%	0.756	S	S	*	*			cis	67.1	133.4	30	91.6	0	0	0	0	113.2
129	S	28.1	Very low	30.9	Very low	106 Å²	106	118.4 Å²	118.4	74%	0.741	76%	0.757	S	S	*	*			cis	-174.1	174.6	6.2	38.9	0	0	0	0	111.3
130	A	31.1	Very low	31.2	Very low	100 Å²	100	118.2 Å²	118.2	83%	0.826	76%	0.757	S	S	*	*			trans	71.6	155.2	162.3	0	0	0	0	0	117.3
131	A	30.8	Very low	31.2	Very low	87 Å²	87	120 Å²	120	72%	0.719	76%	0.759	S	S	*	*			cis	-167.7	-170.7	-23.5	0	0	0	0	0	107.1
132	T	30.5	Very low	31	Very low	125 Å²	125	120.7 Å²	120.7	77%	0.767	76%	0.758	S	S	*	*			cis	-159.4	156.5	10.9	-33	0	0	0	0	110.2
133	S	32.2	Very low	30.9	Very low	99 Å²	99	121 Å²	121	69%	0.692	76%	0.761	S	S	*	*			trans	66.5	131.8	158.5	-74.4	0	0	0	0	119.9
134	T	28	Very low	30.4	Very low	123 Å²	123	122 Å²	122	76%	0.755	76%	0.756	S	S	*	*			cis	104.2	95.1	21.8	64.9	0	0	0	0	115.7
135	A	32.9	Very low	29.9	Very low	100 Å²	100	123.4 Å²	123.4	83%	0.826	76%	0.763	S	S	*	*			trans	-173.6	119.6	145.8	0	0	0	0	0	107.3
136	S	28.6	Very low	29.6	Very low	111 Å²	111	117 Å²	117	78%	0.776	75%	0.749	S	S	*	*			cis	82.5	69.2	12.7	-48.1	0	0	0	0	117.2
137	A	31.3	Very low	29.5	Very low	91 Å²	91	117.7 Å²	117.7	75%	0.752	75%	0.749	S	S	*	*			trans	-147.1	122.5	147.6	0	0	0	0	0	105.7
138	I	27.2	Very low	29.1	Very low	148 Å²	148	116.9 Å²	116.9	76%	0.759	75%	0.746	S	S	*	*				59.7	109.7	50.3	-41.5	166.7	0	0	0	107.8
139	I	31.6	Very low	29.4	Very low	154 Å²	154	120.2 Å²	120.2	79%	0.79	75%	0.75	S	S	*	*				-152.3	152.8	71.9	-77.4	167	0	0	0	111
140	P	34.4	Very low	29.6	Very low	96 Å²	96	120.7 Å²	120.7	62%	0.623	75%	0.75	S	S	*	*			trans	-112.7	-158.8	178.7	22.2	2.5	0	0	0	112.6
141	F	26.4	Very low	29.3	Very low	178 Å²	178	123.2 Å²	123.2	78%	0.781	75%	0.745	S	S	*	*			trans	76.5	113.5	162.6	-84.1	-94.4	0	0	0	120.7
142	T	27.1	Very low	29.1	Very low	118 Å²	118	125.2 Å²	125.2	72%	0.724	74%	0.743	S	S	*	*			trans	41.8	117.6	131.3	62.1	0	0	0	0	122
143	S	27.9	Very low	28.8	Very low	113 Å²	113	125 Å²	125	79%	0.79	74%	0.737	S	S	*	*				-163.3	126.1	109.9	52.7	0	0	0	0	108.6
144	N	26.2	Very low	28.7	Very low	144 Å²	144	127.4 Å²	127.4	77%	0.77	74%	0.737	S	S	*	*			cis	76.1	125.3	49.7	-152.6	27.9	0	0	0	112.8
145	V	27.6	Very low	28.7	Very low	132 Å²	132	129.2 Å²	129.2	80%	0.8	74%	0.737	S	S	*	*			trans	70.5	139.6	167.3	176.6	0	0	0	0	115
146	A	26.8	Very low	28.5	Very low	75 Å²	75	130.5 Å²	130.5	62%	0.62	73%	0.734	S	S	*	*			cis	-145.1	154.1	12.2	0	0	0	0	0	115
147	T	26.5	Very low	28.6	Very low	111 Å²	111	129.2 Å²	129.2	68%	0.681	73%	0.725	S	S	*	*			trans	9.7	132.3	134	65	0	0	0	0	118.6
148	N	26.7	Very low	28.6	Very low	147 Å²	147	137 Å²	137	79%	0.786	74%	0.735	S	S	*	*				-177.6	148.8	74.3	-92.5	-54.7	0	0	0	113.1
149	H	35.2	Very low	29	Very low	167 Å²	167	135.4 Å²	135.4	77%	0.773	73%	0.726	S	S	*	*			trans	-71.5	146.6	149.7	-82.6	-87.2	0	0	0	109.4
150	P	32.2	Very low	29.3	Very low	115 Å²	115	134.7 Å²	134.7	75%	0.747	73%	0.732	S	S	*	*				-130	142.5	104.1	37.9	-31	0	0	0	110.7
151	H	26	Very low	29.2	Very low	153 Å²	153	138.1 Å²	138.1	71%	0.708	74%	0.74	S	S	*	*			cis	64.6	131.8	45.8	-102.6	-86.4	0	0	0	115.4
152	L	25.5	Very low	29.3	Very low	130 Å²	130	133.5 Å²	133.5	68%	0.681	73%	0.734	S	S	*	*			trans	67.3	110.7	164.1	-87.6	65.8	0	0	0	119.6
153	N	25.6	Very low	29.5	Very low	120 Å²	120	135.2 Å²	135.2	64%	0.642	74%	0.737	S	S	*	*				98.7	123.7	114.1	-75.1	3.1	0	0	0	122.8
154	H	28.5	Very low	29.5	Very low	150 Å²	150	135.1 Å²	135.1	69%	0.694	73%	0.732	S	S	*	*			trans	74.4	127.4	131.1	-77.6	-49.1	0	0	0	121.9
155	H	28.4	Very low	29.5	Very low	161 Å²	161	135 Å²	135	75%	0.745	74%	0.736	S	S	*	*			trans	66.8	154.8	148.4	-81.1	-88.2	0	0	0	116.6
156	V	28.9	Very low	29.5	Very low	126 Å²	126	132.1 Å²	132.1	76%	0.764	73%	0.734	S	S	*	*			cis	-125.9	151.5	5.2	-174.6	0	0	0	0	110.2
157	S	31.2	Very low	29.6	Very low	84 Å²	84	132.1 Å²	132.1	59%	0.587	74%	0.741	S	S	*	*			trans	-50.9	158.4	168.2	-30.7	0	0	0	0	114.6
158	R	32	Very low	29.6	Very low	256 Å²	256	133 Å²	133	97%	0.966	75%	0.746	S	S	*	*			trans	-143.9	143.7	133.2	-114.4	171.3	-154.3	-145.7	3.2	112.8
159	I	34.4	Very low	29.7	Very low	113 Å²	113	133.8 Å²	133.8	58%	0.579	75%	0.75	S	S	*	*			trans	-115.5	148.5	-168.8	-70.7	165.7	0	0	0	107.7	Q161	I159-Q161 HydrophobicContact CG2-CB 3.65Å; I159-Q161 HydrophobicContact CG2-CG 3.91Å
160	P	38.5	Very low	29.5	Very low	139 Å²	139	129.6 Å²	129.6	90%	0.903	75%	0.753	S	S	*	*			trans	-107.4	142.4	131.9	-14.7	32.1	0	0	0	111.8
161	Q	32.4	Very low	29.3	Very low	169 Å²	169	129.8 Å²	129.8	79%	0.79	76%	0.757	S	S	*	*			trans	-130.9	173.6	-167	-139.2	-175.9	17.8	0	0	111.6	I159	I159-Q161 HydrophobicContact CG2-CB 3.65Å; I159-Q161 HydrophobicContact CG2-CG 3.91Å
162	A	29	Very low	29.8	Very low	81 Å²	81	129.1 Å²	129.1	67%	0.669	76%	0.757	S	S	*	*			trans	69.5	157.7	176	0	0	0	0	0	114.1
163	I	30.3	Very low	30.2	Very low	154 Å²	154	129.1 Å²	129.1	79%	0.79	77%	0.765	S	S	*	*			cis	-127.6	121.1	11.1	-67.2	170.1	0	0	0	106.2
164	V	27.7	Very low	30.9	Very low	110 Å²	110	127.2 Å²	127.2	67%	0.667	76%	0.76	S	S	*	*				76.9	131.5	67.3	170.1	0	0	0	0	113.7
165	T	27.5	Very low	30.9	Very low	141 Å²	141	127.1 Å²	127.1	87%	0.865	76%	0.763	S	S	*	*			trans	62	147.1	177.6	49.5	0	0	0	0	118
166	G	27.1	Very low	30.8	Very low	73 Å²	73	125.5 Å²	125.5	75%	0.753	76%	0.76	S	S	*	*			cis	159.3	135.1	-10.3	0	0	0	0	0	114
167	G	27.9	Very low	30.9	Very low	74 Å²	74	126.3 Å²	126.3	76%	0.763	76%	0.758	S	S	*	*			trans	79	164.7	176.1	0	0	0	0	0	115.3
168	T	27.6	Very low	30.7	Very low	130 Å²	130	127.2 Å²	127.2	80%	0.798	77%	0.765	S	S	*	*			cis	-151.3	143.9	-9.5	44.5	0	0	0	0	111.6
169	N	27.9	Very low	31.2	Very low	163 Å²	163	120.7 Å²	120.7	87%	0.872	76%	0.755	S	S	*	*			trans	13.7	133.9	144.4	-51.7	-13.4	0	0	0	120.7
170	G	30.5	Very low	30.8	Very low	80 Å²	80	122.4 Å²	122.4	83%	0.825	77%	0.771	S	S	*	*			trans	123.6	131.6	152.4	0	0	0	0	0	114.9
171	S	29.6	Very low	30.2	Very low	119 Å²	119	120.8 Å²	120.8	83%	0.832	76%	0.763	S	S	*	*			cis	-153.4	147.8	-10.5	-170.3	0	0	0	0	113.1
172	L	34.9	Very low	30	Very low	138 Å²	138	117.4 Å²	117.4	72%	0.723	76%	0.764	S	S	*	*			trans	-48.2	157.3	151.7	-61.1	167.2	0	0	0	110.4	P174	L172-P174 HydrophobicContact CB-CG 4.43Å; L172-P174 HydrophobicContact CD2-CG 3.88Å
173	P	35.5	Very low	29.9	Very low	130 Å²	130	118.3 Å²	118.3	84%	0.844	77%	0.772	S	S	*	*				-140.1	163.9	53.9	34.7	-12.9	0	0	0	119.5
174	P	38.9	Very low	29.8	Very low	81 Å²	81	115.5 Å²	115.5	53%	0.526	77%	0.771	S	S	.	*			trans	-138.9	-147.4	-153.4	24.6	5.6	0	0	0	111.9	L172	L172-P174 HydrophobicContact CB-CG 4.43Å; L172-P174 HydrophobicContact CD2-CG 3.88Å
175	L	28.8	Very low	29.8	Very low	147 Å²	147	114.4 Å²	114.4	77%	0.77	77%	0.774	S	S	*	*			trans	73	165	154.9	-54.6	171.7	0	0	0	114.9
176	L	27.4	Very low	29.9	Very low	128 Å²	128	113.6 Å²	113.6	67%	0.67	77%	0.769	S	S	*	*			cis	-161.6	-177.1	-14.4	-120.3	170.7	0	0	0	109.5
177	I	30.6	Very low	30.2	Very low	143 Å²	143	114.9 Å²	114.9	73%	0.733	76%	0.764	S	S	*	*			trans	72.7	113.6	164.8	-55.6	123.4	0	0	0	113.3
178	S	27.1	Very low	30.2	Very low	103 Å²	103	118.5 Å²	118.5	72%	0.72	77%	0.765	S	S	*	*			cis	86.4	143.7	39.8	-54.9	0	0	0	0	114.2
179	P	41.2	Very low	30.3	Very low	119 Å²	119	119 Å²	119	77%	0.773	76%	0.761	S	S	*	*			trans	-100.9	163.8	-158.8	39	-36.8	0	0	0	114.6
180	T	26.7	Very low	30.3	Very low	149 Å²	149	116.5 Å²	116.5	91%	0.914	76%	0.757	S	S	*	*			trans	-156.7	170.1	153.1	-15.6	0	0	0	0	112.3
181	S	26.4	Very low	30.3	Very low	104 Å²	104	116.4 Å²	116.4	73%	0.727	76%	0.755	S	S	*	*			trans	-105.2	172.8	-169	56.2	0	0	0	0	113.9
182	A	27.4	Very low	30.3	Very low	99 Å²	99	116.9 Å²	116.9	82%	0.818	74%	0.743	S	S	*	*			trans	71.8	162.5	164.5	0	0	0	0	0	115.7
183	A	26.9	Very low	30	Very low	100 Å²	100	113.3 Å²	113.3	83%	0.826	73%	0.733	S	S	*	*			cis	-139	179.4	7.3	0	0	0	0	0	113.3
184	A	27.3	Very low	29.6	Very low	94 Å²	94	109.3 Å²	109.3	78%	0.777	72%	0.715	S	S	*	*			trans	-71.9	148.5	-174.5	0	0	0	0	0	115.5
185	A	28.5	Very low	29.1	Very low	88 Å²	88	110.5 Å²	110.5	73%	0.727	72%	0.723	S	S	*	*				-160.5	112.8	129.3	0	0	0	0	0	107.9
186	T	29.4	Very low	29	Very low	123 Å²	123	111.3 Å²	111.3	76%	0.755	73%	0.725	S	S	*	*				59.3	144.4	68.4	65.6	0	0	0	0	115
187	P	33	Very low	29.3	Very low	100 Å²	100	110.4 Å²	110.4	65%	0.649	73%	0.729	S	S	*	*			cis	-139.2	-159.1	-15.2	27.6	-1.6	0	0	0	112.9
188	L	27.5	Very low	29.4	Very low	150 Å²	150	109 Å²	109	79%	0.785	73%	0.729	S	S	*	*			trans	74.3	144.8	159.8	-52.6	164.6	0	0	0	115.6
189	I	31.1	Very low	29.4	Very low	141 Å²	141	108.8 Å²	108.8	72%	0.723	73%	0.728	S	S	*	*			cis	-148.2	125.1	-5.4	-111.1	158.9	0	0	0	105.5
190	S	27.6	Very low	29	Very low	111 Å²	111	110 Å²	110	78%	0.776	73%	0.734	S	S	*	*				62.1	96.6	81.3	166.9	0	0	0	0	115
191	G	31.1	Very low	29.4	Very low	77 Å²	77	106.3 Å²	106.3	79%	0.794	72%	0.724	S	S	*	*			trans	-163.4	78.2	-179	0	0	0	0	0	116.4
192	K	29.5	Very low	29.8	Very low	130 Å²	130	106.4 Å²	106.4	57%	0.565	73%	0.725	S	S	*	*			trans	-21.6	126.9	168.2	-64.1	168.9	-179.8	176.6	0	115.7	S891 I892 A893	K192-S891 VanDerWaalsContact CB-OG 3.26Å; K192-S891 WeakPolarHBondContact CB-OG 3.19Å; K192-S891 PolarHBondContact O-OG 2.84Å; K192-I892 HydrophobicContact CD-CG1 3.92Å; K192-A893 HydrophobicContact CD-CB 4.34Å
193	A	27.8	Very low	30.7	Very low	63 Å²	63	107.3 Å²	107.3	52%	0.521	72%	0.723	S	S	.	*				61.9	152.7	69.1	0	0	0	0	0	114.1	S891 I892	A193-S891 CarbonylContact O-C 3.53Å; A193-S891 VanDerWaalsContact O-CA 3.32Å; A193-S891 WeakPolarHBondContact O-CA 3.46Å; A193-S891 PolarHBondContact O-OG 2.91Å; A193-I892 PolarHBondContact O-N 2.89Å
194	G	26.8	Very low	30.8	Very low	46 Å²	46	109.1 Å²	109.1	47%	0.474	72%	0.717	S	S	.	*			trans	135.6	116.8	169.4	0	0	0	0	0	115.2	I892	G194-I892 WeakPolarHBondContact CA-O 3.38Å
195	P	29.5	Very low	31	Very low	105 Å²	105	111.1 Å²	111.1	68%	0.682	72%	0.715	S	S	*	*			trans	-121.4	-156.5	-176.5	36.3	-17.9	0	0	0	113
196	M	25.6	Very low	31	Very low	164 Å²	164	113.1 Å²	113.1	81%	0.808	72%	0.718	S	S	*	*			trans	81.6	127.5	171.2	-49	171.4	76.1	0	0	113.4
197	S	34.7	Very low	31.3	Very low	110 Å²	110	111.1 Å²	111.1	77%	0.769	71%	0.714	S	S	*	*			cis	66	139.3	48.2	-53.1	0	0	0	0	111.7
198	P	31.7	Very low	31.2	Very low	113 Å²	113	110.6 Å²	110.6	73%	0.734	72%	0.718	S	S	*	*			cis	-147.2	-160.9	43.6	41.5	-20.7	0	0	0	115.5
199	S	28.7	Very low	31.4	Very low	98 Å²	98	110 Å²	110	69%	0.685	72%	0.721	S	S	*	*			trans	75.4	142.5	144.9	71.3	0	0	0	0	118.5
200	T	30.9	Very low	31.4	Very low	146 Å²	146	108.8 Å²	108.8	90%	0.896	72%	0.72	S	S	*	*			cis	-158.7	152.5	-8.7	6.5	0	0	0	0	108.7
201	G	36.4	Very low	31.6	Very low	70 Å²	70	110.6 Å²	110.6	72%	0.722	72%	0.72	S	S	*	*			trans	166.9	5	172.7	0	0	0	0	0	120.2
202	S	33.8	Very low	31.5	Very low	107 Å²	107	114.8 Å²	114.8	75%	0.748	72%	0.718	S	S	*	*			trans	-62.9	139.1	173	-47.2	0	0	0	0	111.4
203	P	46.9	Very low	31.4	Very low	117 Å²	117	115.6 Å²	115.6	76%	0.76	73%	0.729	S	S	*	*				-97.2	149.3	105.3	-24.7	38.2	0	0	0	113.1
204	I	29.6	Very low	31.3	Very low	139 Å²	139	116.9 Å²	116.9	71%	0.713	74%	0.74	S	S	*	*			cis	74.7	121.3	38.4	-67.2	169.6	0	0	0	110.1
205	N	30.1	Very low	31.3	Very low	135 Å²	135	121.5 Å²	121.5	72%	0.722	76%	0.759	S	S	*	*			cis	-167.4	179.7	5.6	-130.7	-3.2	0	0	0	114.4
206	V	30.4	Very low	31.3	Very low	131 Å²	131	121.6 Å²	121.6	79%	0.794	76%	0.761	S	S	*	*			trans	69.1	135.1	145.1	156.6	0	0	0	0	117.7
207	A	35	Very low	31.4	Very low	81 Å²	81	119.5 Å²	119.5	67%	0.669	76%	0.763	S	S	*	*			cis	-149.6	147.3	-11.9	0	0	0	0	0	107.6
208	A	30.1	Very low	31.6	Very low	89 Å²	89	119.6 Å²	119.6	74%	0.736	76%	0.761	S	S	*	*			cis	82.6	147.8	41.5	0	0	0	0	0	114.3
209	T	32	Very low	31.4	Very low	137 Å²	137	122.8 Å²	122.8	84%	0.84	77%	0.766	S	S	*	*			trans	96.5	123.8	178.5	-44.2	0	0	0	0	114.9
210	V	32.1	Very low	31.5	Very low	116 Å²	116	125.7 Å²	125.7	70%	0.703	77%	0.769	S	S	*	*			cis	-165.1	173.2	-19.5	90.7	0	0	0	0	111
211	L	31	Very low	31.7	Very low	149 Å²	149	123.4 Å²	123.4	78%	0.78	76%	0.758	S	S	*	*			trans	70.9	124.9	-175.9	-49.1	-174.4	0	0	0	114.8
212	Q	29.2	Very low	31.7	Very low	164 Å²	164	127 Å²	127	77%	0.766	76%	0.76	S	S	*	*			cis	84.7	134.3	2.1	-136.9	175.3	31.8	0	0	117.9
213	N	27	Very low	31.8	Very low	147 Å²	147	132 Å²	132	79%	0.786	77%	0.768	S	S	*	*			trans	73	118.4	-176.7	-53.8	-21.6	0	0	0	114.3
214	A	26.7	Very low	31	Very low	91 Å²	91	131.8 Å²	131.8	75%	0.752	76%	0.761	S	S	*	*			cis	99.8	169.9	45	0	0	0	0	0	112.2
215	V	25.6	Very low	31	Very low	143 Å²	143	137 Å²	137	87%	0.867	77%	0.772	S	S	*	*			trans	90.1	133.3	177.4	-177.3	0	0	0	0	116.3
216	S	29.3	Very low	30.9	Very low	106 Å²	106	135.2 Å²	135.2	74%	0.741	77%	0.77	S	S	*	*			trans	-85.9	165.6	170.5	-45	0	0	0	0	111.2
217	S	28	Very low	30.9	Very low	120 Å²	120	140.3 Å²	140.3	84%	0.839	78%	0.775	S	S	*	*	S	Bend	trans	72.9	167.2	178.6	-85.9	0	0	0	0	115
218	P	38.4	Very low	30.5	Very low	113 Å²	113	143.5 Å²	143.5	73%	0.734	78%	0.78	S	S	*	*			trans	-104.7	164.4	-150.9	39.2	-36.6	0	0	0	115.4
219	Q	28.8	Very low	30.5	Very low	179 Å²	179	145.6 Å²	145.6	84%	0.836	78%	0.778	S	S	*	*			trans	177.5	173.1	136.1	-96.6	-67.3	-14.4	0	0	112.7
220	H	31	Very low	30.4	Very low	160 Å²	160	147.6 Å²	147.6	74%	0.741	78%	0.776	S	S	*	*			trans	-76.6	161.5	-166.7	-110.4	-94.1	0	0	0	118.8
221	S	35.2	Very low	30.2	Very low	97 Å²	97	149.2 Å²	149.2	68%	0.678	78%	0.779	S	S	*	*			trans	72	165.7	142.4	-75	0	0	0	0	118.8
222	I	35.2	Very low	30.3	Very low	147 Å²	147	147.8 Å²	147.8	75%	0.754	78%	0.778	S	S	*	*			cis	-151.8	160.3	20.7	-142.5	147.6	0	0	0	112.8
223	F	36.9	Very low	30.6	Very low	210 Å²	210	144.6 Å²	144.6	92%	0.921	77%	0.772	S	S	*	*			trans	-102.8	132.6	156.2	-147.4	-83.2	0	0	0	107.7
224	D	28.8	Very low	30.5	Very low	113 Å²	113	144 Å²	144	60%	0.604	77%	0.769	S	S	*	*			trans	-89.3	136.3	-161	-177	20	0	0	0	114.4	S226	D224-S226 PolarHBondContact OD1-N 2.94Å; D224-S226 PolarHBondContact OD1-OG 2.91Å
225	R	30.6	Very low	30.5	Very low	250 Å²	250	146 Å²	146	94%	0.943	77%	0.772	S	S	*	*			trans	-160.7	69.2	148.9	-117.4	175	-166.9	-132.9	2.1	113.4
226	S	28.3	Very low	30.6	Very low	97 Å²	97	143.2 Å²	143.2	68%	0.678	76%	0.759	S	S	*	*			trans	-92.7	98.7	173.2	55.3	0	0	0	0	113.3	D224	D224-S226 PolarHBondContact OD1-N 2.94Å; D224-S226 PolarHBondContact OD1-OG 2.91Å
227	R	29.5	Very low	30.5	Very low	238 Å²	238	146.2 Å²	146.2	90%	0.898	77%	0.765	S	S	*	*			trans	-168	123.8	162.6	-109.4	157.7	-158.3	-117	3.4	116.4
228	L	27.5	Very low	30.6	Very low	148 Å²	148	144 Å²	144	78%	0.775	75%	0.754	S	S	*	*			trans	72.8	137.4	151.9	-102.1	65.1	0	0	0	122.6
229	N	30.4	Very low	30.2	Very low	132 Å²	132	144.1 Å²	144.1	71%	0.706	76%	0.758	S	S	*	*			trans	66.2	110.5	162.1	-64.1	-12	0	0	0	117.6
230	K	28.8	Very low	30.5	Very low	180 Å²	180	141 Å²	141	78%	0.783	76%	0.756	S	S	*	*				70.1	114.6	81.6	-77.6	-172.8	172.6	-175.9	0	112.3
231	I	27.2	Very low	30.7	Very low	150 Å²	150	138.2 Å²	138.2	77%	0.769	75%	0.754	S	S	*	*				60.5	122.7	76	-63.6	171	0	0	0	110.5
232	P	33.6	Very low	30.6	Very low	119 Å²	119	138.3 Å²	138.3	77%	0.773	76%	0.755	S	S	*	*			cis	-130.2	-124.9	19.6	36	-10.4	0	0	0	113.9
233	P	35.4	Very low	30.8	Very low	97 Å²	97	136.8 Å²	136.8	63%	0.63	76%	0.755	S	S	*	*			trans	-134.7	-162	-135.6	41	-16	0	0	0	115.4
234	N	26.1	Very low	30.7	Very low	135 Å²	135	131.7 Å²	131.7	72%	0.722	75%	0.745	S	S	*	*			trans	58.3	146.6	146.3	-74.9	0.1	0	0	0	121.5
235	T	27	Very low	31.1	Very low	132 Å²	132	133.2 Å²	133.2	81%	0.81	75%	0.753	S	S	*	*			trans	64.8	149.5	148.2	47.5	0	0	0	0	118.4
236	S	27	Very low	31.4	Very low	85 Å²	85	125.6 Å²	125.6	59%	0.594	74%	0.744	S	S	*	*			cis	178.3	158.8	-18.3	54.7	0	0	0	0	109.6
237	L	27.8	Very low	31.8	Very low	168 Å²	168	125.6 Å²	125.6	88%	0.88	75%	0.749	S	S	*	*			trans	62.8	160.6	164.9	-83	69	0	0	0	114.7
238	A	28.3	Very low	32.1	Very low	73 Å²	73	120.7 Å²	120.7	60%	0.603	74%	0.741	S	S	*	*			cis	-172.2	175.3	-23.2	0	0	0	0	0	108
239	S	30.5	Very low	32.6	Very low	117 Å²	117	120.1 Å²	120.1	82%	0.818	74%	0.739	S	S	*	*			trans	62.6	146.6	164.2	50.3	0	0	0	0	118.2
240	S	34.6	Very low	32.9	Very low	114 Å²	114	119.2 Å²	119.2	80%	0.797	73%	0.734	S	S	*	*			cis	-175.8	161.2	-14	49.7	0	0	0	0	107.2
241	S	35.5	Very low	33.4	Very low	100 Å²	100	119 Å²	119	70%	0.699	73%	0.733	S	S	*	*			cis	-143.1	-173.5	7.2	58.3	0	0	0	0	108.1
242	S	33.9	Very low	33.9	Very low	99 Å²	99	116.8 Å²	116.8	69%	0.692	73%	0.728	S	S	*	*			cis	68.2	153.2	17.1	58.5	0	0	0	0	117.3
243	P	39.1	Very low	33.8	Very low	116 Å²	116	118.6 Å²	118.6	75%	0.753	73%	0.73	S	S	*	*			cis	-93.5	-168.6	-6.9	43.6	-35.2	0	0	0	110.4
244	S	35.8	Very low	33.7	Very low	103 Å²	103	122.6 Å²	122.6	72%	0.72	74%	0.74	S	S	*	*			cis	-167.2	172.1	20.8	47.8	0	0	0	0	108.3
245	D	36.8	Very low	34.1	Very low	144 Å²	144	125 Å²	125	77%	0.77	75%	0.747	S	S	*	*			cis	173.1	166.8	-25.9	-87	-53	0	0	0	104.2
246	A	36.2	Very low	34.5	Very low	90 Å²	90	130.2 Å²	130.2	74%	0.744	75%	0.752	S	S	*	*			cis	-174.3	170.6	-18.8	0	0	0	0	0	104.5
247	A	36.8	Very low	34.8	Very low	97 Å²	97	135.9 Å²	135.9	80%	0.802	77%	0.768	S	S	*	*			cis	-171.5	168.7	-4.9	0	0	0	0	0	106.1
248	N	36.2	Very low	35	Very low	136 Å²	136	132.1 Å²	132.1	73%	0.727	76%	0.757	S	S	*	*			cis	-179.3	170	-18.8	-176.9	27.8	0	0	0	107.9
249	N	37	Very low	35.5	Very low	136 Å²	136	135.5 Å²	135.5	73%	0.727	76%	0.763	S	S	*	*			trans	128.8	107.8	166.1	-70.8	-20.6	0	0	0	111.8
250	D	37	Very low	35.9	Very low	112 Å²	112	138.7 Å²	138.7	60%	0.599	77%	0.77	S	S	*	*				86.8	133	77.3	-91.5	-1.4	0	0	0	112.9
251	K	39.2	Very low	36.1	Very low	177 Å²	177	136.5 Å²	136.5	77%	0.77	75%	0.754	S	S	*	*			cis	-150.1	170.7	15.1	-114.2	149.1	178	128.9	0	112.2
252	P	38.4	Very low	36.4	Very low	102 Å²	102	137 Å²	137	66%	0.662	75%	0.749	S	S	*	*			trans	-126.3	165.8	-143.9	44.9	-36.6	0	0	0	119.9
253	I	30.8	Very low	36.6	Very low	157 Å²	157	138 Å²	138	81%	0.805	75%	0.751	S	S	*	*			trans	38.8	124.1	136.4	-56.4	165.3	0	0	0	120.2
254	Q	34.2	Very low	36.6	Very low	182 Å²	182	143.1 Å²	143.1	85%	0.85	76%	0.755	S	S	*	*			trans	-157.7	166.8	140.9	-115.3	168.9	54.2	0	0	112.8
255	Q	34.5	Very low	36.8	Very low	184 Å²	184	143 Å²	143	86%	0.86	75%	0.75	S	S	*	*			trans	62.1	70.8	172	-65.9	-169.9	-19	0	0	119.6
256	R	34.5	Very low	36.9	Very low	242 Å²	242	143.3 Å²	143.3	91%	0.913	75%	0.751	S	S	*	*			trans	-136.8	91.9	140.5	-97.7	-174.8	170.2	161	-3.3	109.4
257	H	34	Very low	37	Very low	204 Å²	204	145.2 Å²	145.2	94%	0.944	75%	0.754	S	S	*	*			trans	174.4	86.5	157.9	-99.2	-66.1	0	0	0	109.6
258	S	32	Very low	37.1	Very low	90 Å²	90	149 Å²	149	63%	0.629	76%	0.755	S	S	*	*			trans	-156.6	-178.1	167.7	-169.6	0	0	0	0	108.4	L260	S258-L260 PolarHBondContact O-N 2.97Å
259	I	38.3	Very low	37.3	Very low	144 Å²	144	146.3 Å²	146.3	74%	0.738	75%	0.752	S	S	*	*	S	Bend	trans	75.2	-35.4	177.3	-53.8	173.5	0	0	0	115.1	S261	I259-S261 PolarHBondContact O-N 3.19Å; I259-S261 VanDerWaalsContact O-N 3.14Å
260	L	38	Very low	37.3	Very low	183 Å²	183	148.7 Å²	148.7	96%	0.958	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	0.8	172.3	-81.1	175.9	0	0	0	115.2	S258	S258-L260 PolarHBondContact O-N 2.97Å
261	S	39.3	Very low	37.6	Very low	68 Å²	68	148.9 Å²	148.9	48%	0.476	77%	0.766	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.1	-20.1	-178.5	49.6	0	0	0	0	115.2	I259	I259-S261 PolarHBondContact O-N 3.19Å; I259-S261 VanDerWaalsContact O-N 3.14Å
262	N	41.8	Very low	37.7	Very low	110 Å²	110	147.7 Å²	147.7	59%	0.588	77%	0.768	S	S	*	*	S	Bend	trans	-99.4	-19.1	-157.6	-69	13.1	0	0	0	115.1
263	V	38.5	Very low	37.8	Very low	122 Å²	122	151.1 Å²	151.1	74%	0.739	78%	0.78	S	S	*	*	G	3₁₀ helix	trans	-83	-21.7	-179.2	-174.7	0	0	0	0	112.2	T265	V263-T265 PolarHBondContact O-N 3.39Å
264	R	38.4	Very low	38.2	Very low	223 Å²	223	146.5 Å²	146.5	84%	0.842	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-73.4	-12.1	178.2	-144.9	179	-161.5	109.7	3.6	113.8
265	T	41.5	Very low	38.4	Very low	100 Å²	100	144.1 Å²	144.1	61%	0.613	77%	0.772	S	S	*	*	G	3₁₀ helix	trans	-90.2	-20.5	-174.1	-41.8	0	0	0	0	113	V263	V263-T265 PolarHBondContact O-N 3.39Å
266	L	37.9	Very low	38.8	Very low	151 Å²	151	147.2 Å²	147.2	79%	0.791	78%	0.776	S	S	*	*	G	3₁₀ helix	trans	-86.7	-22.8	-174	-144.9	73	0	0	0	113.7	Q268	L266-Q268 VanDerWaalsContact C-N 3.33Å; L266-Q268 PolarHBondContact O-N 2.95Å
267	T	39.2	Very low	39	Very low	130 Å²	130	141.8 Å²	141.8	80%	0.798	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-87.1	3.7	-177	-24.9	0	0	0	0	114
268	Q	38.2	Very low	39.3	Very low	175 Å²	175	139.5 Å²	139.5	82%	0.818	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-128	10.7	-173.8	-152.6	168.6	11	0	0	113.8	L266	L266-Q268 VanDerWaalsContact C-N 3.33Å; L266-Q268 PolarHBondContact O-N 2.95Å
269	A	39.5	Very low	40.1	Very low	80 Å²	80	138.9 Å²	138.9	66%	0.661	76%	0.756	S	S	*	*	S	Bend	trans	-113.3	7.9	-174.7	0	0	0	0	0	114.8
270	M	37.6	Very low	40.7	Very low	187 Å²	187	134.7 Å²	134.7	92%	0.921	75%	0.748	S	S	*	*			trans	-123.7	59.1	177.7	-72.6	-172.2	160.7	0	0	111.8
271	V	42.9	Very low	41.4	Very low	116 Å²	116	132.1 Å²	132.1	70%	0.703	74%	0.736	S	S	*	*			trans	-131.7	132.7	163.6	178.5	0	0	0	0	106.6
272	N	41.5	Very low	42	Very low	152 Å²	152	132.3 Å²	132.3	81%	0.813	73%	0.732	S	S	*	*			trans	71.8	91.2	-169.2	-46.9	-33.4	0	0	0	114.7
273	D	41.9	Very low	42.5	Very low	173 Å²	173	132 Å²	132	93%	0.925	73%	0.728	S	S	*	*				-154.5	161.3	103.5	-122.9	-33.4	0	0	0	112.2
274	G	39.2	Very low	43.4	Very low	60 Å²	60	132.2 Å²	132.2	62%	0.619	73%	0.725	S	S	*	*			trans	-82.4	157.8	-163.3	0	0	0	0	0	117
275	P	38.6	Very low	44.2	Very low	133 Å²	133	128.6 Å²	128.6	86%	0.864	72%	0.715	S	S	*	*			trans	-78.9	149.6	-172.4	32.3	-36.5	0	0	0	114
276	R	42.8	Very low	45	Very low	248 Å²	248	129.1 Å²	129.1	94%	0.936	71%	0.712	S	S	*	*			trans	-127.6	127.6	158.2	-74.6	-169.6	171.8	-157.1	-2.3	110.3
277	T	37.2	Very low	46	Very low	128 Å²	128	125.9 Å²	125.9	79%	0.785	70%	0.698	S	S	*	*			trans	-76.2	178.7	173	50.5	0	0	0	0	111.9
278	L	40.7	Very low	47.2	Very low	156 Å²	156	122.4 Å²	122.4	82%	0.817	68%	0.679	S	S	*	*			trans	97.1	135.4	-171.3	-56.6	160	0	0	0	110.9
279	T	50.1	Low	48.5	Very low	77 Å²	77	120.6 Å²	120.6	47%	0.472	67%	0.671	S	S	.	*			cis	-141.5	174.9	-0.9	-5.4	0	0	0	0	111.6	D282	T279-D282 WeakPolarHBondContact CA-OD2 3.39Å; T279-D282 WeakPolarHBondContact CB-OD2 3.27Å; T279-D282 PolarHBondContact N-OD2 3.24Å; T279-D282 PolarHBondContact O-N 3.49Å; T279-D282 PolarHBondContact OG1-OD2 3.34Å
280	G	50.3	Low	49.8	Very low	56 Å²	56	121.3 Å²	121.3	58%	0.577	66%	0.66	S	S	*	*	H	α-helix	trans	-63.6	-41.5	-176.7	0	0	0	0	0	114.1	D282 M283	G280-D282 PolarHBondContact O-N 3.41Å; G280-M283 WeakPolarHBondContact O-CB 3.25Å; G280-M283 PolarHBondContact O-N 3.48Å
281	D	52.3	Low	51.4	Low	130 Å²	130	117.7 Å²	117.7	70%	0.695	64%	0.641	S	S	*	*	H	α-helix	trans	-69	-17	-178.3	-49	-70.4	0	0	0	113.3
282	D	52.4	Low	52.9	Low	72 Å²	72	119.7 Å²	119.7	39%	0.385	64%	0.636	S	S	.	*	H	α-helix	trans	-77.1	-24.3	176.7	-55.9	-67.5	0	0	0	111.8	T279 G280 M286	T279-D282 WeakPolarHBondContact CA-OD2 3.39Å; T279-D282 WeakPolarHBondContact CB-OD2 3.27Å; T279-D282 PolarHBondContact N-OD2 3.24Å; T279-D282 PolarHBondContact O-N 3.49Å; T279-D282 PolarHBondContact OG1-OD2 3.34Å; G280-D282 PolarHBondContact O-N 3.41Å; D282-M286 PolarHBondContact O-N 3.08Å
283	M	51.6	Low	54.5	Low	103 Å²	103	115 Å²	115	51%	0.507	62%	0.618	S	S	.	*	H	α-helix	trans	-70	-44.8	176.5	-66.2	-74	94.6	0	0	112	G280 K285 M286 V287	G280-M283 WeakPolarHBondContact O-CB 3.25Å; G280-M283 PolarHBondContact O-N 3.48Å; M283-K285 PolarHBondContact O-N 3.48Å; M283-M286 HydrophobicContact CE-CE 4.49Å; M283-M286 HydrophobicContact CE-SD 3.57Å; M283-M286 VanDerWaalsContact CE-SD 3.57Å; M283-M286 PolarHBondContact O-N 2.98Å; M283-V287 WeakPolarHBondContact O-CG2 3.49Å; M283-V287 PolarHBondContact O-N 3.12Å
284	D	57.9	Low	56.2	Low	126 Å²	126	114.3 Å²	114.3	67%	0.674	60%	0.603	S	S	*	*	H	α-helix	trans	-64.3	-30.5	177.2	-78.6	-17.8	0	0	0	111.9	S288	D284-S288 WeakPolarHBondContact O-CB 3.45Å; D284-S288 PolarHBondContact O-N 3.31Å
285	K	55.7	Low	57.9	Low	147 Å²	147	116.7 Å²	116.7	64%	0.639	60%	0.596	S	S	*	*	H	α-helix	trans	-68.5	-49.7	170	-83.5	-173.5	174	179.8	0	112.6	M283 V287 S288 E289	M283-K285 PolarHBondContact O-N 3.48Å; K285-V287 VanDerWaalsContact C-N 3.27Å; K285-V287 PolarHBondContact O-N 3.34Å; K285-S288 PolarHBondContact O-N 2.92Å; K285-E289 PolarHBondContact O-N 2.63Å
286	M	56.7	Low	59.6	Low	112 Å²	112	117.3 Å²	117.3	55%	0.552	59%	0.587	S	S	*	*	H	α-helix	trans	-56.6	-42.5	175.7	-81.4	-175.8	59.4	0	0	111.5	D282 M283 E289 E290	D282-M286 PolarHBondContact O-N 3.08Å; M283-M286 HydrophobicContact CE-CE 4.49Å; M283-M286 HydrophobicContact CE-SD 3.57Å; M283-M286 VanDerWaalsContact CE-SD 3.57Å; M283-M286 PolarHBondContact O-N 2.98Å; M286-E289 PolarHBondContact O-N 2.72Å; M286-E290 WeakPolarHBondContact O-CB 3.19Å; M286-E290 PolarHBondContact O-N 2.88Å
287	V	60.5	Low	61	Low	83 Å²	83	111.1 Å²	111.1	50%	0.503	57%	0.569	S	S	.	*	H	α-helix	trans	-64.1	-40.6	175.1	172.8	0	0	0	0	111.3	M283 K285 E289 E290 E291	M283-V287 WeakPolarHBondContact O-CG2 3.49Å; M283-V287 PolarHBondContact O-N 3.12Å; K285-V287 VanDerWaalsContact C-N 3.27Å; K285-V287 PolarHBondContact O-N 3.34Å; V287-E289 PolarHBondContact O-N 2.85Å; V287-E290 PolarHBondContact O-N 3.01Å; V287-E291 WeakPolarHBondContact O-CB 3.38Å; V287-E291 PolarHBondContact O-N 3.32Å
288	S	64.4	Low	62.8	Low	56 Å²	56	111.5 Å²	111.5	39%	0.392	56%	0.562	S	S	.	*	H	α-helix	trans	-72.5	-24	177.8	-157.4	0	0	0	0	114.5	D284 K285 R292	D284-S288 WeakPolarHBondContact O-CB 3.45Å; D284-S288 PolarHBondContact O-N 3.31Å; K285-S288 PolarHBondContact O-N 2.92Å; S288-R292 WeakPolarHBondContact O-CG 3.48Å; S288-R292 PolarHBondContact O-N 3.33Å; S288-R292 PolarHBondContact O-NH1 3.27Å; S288-R292 PolarHBondContact OG-NH1 2.81Å
289	E	64.9	Low	64.7	Low	138 Å²	138	109.4 Å²	109.4	65%	0.645	55%	0.546	S	S	*	.	H	α-helix	trans	-81	-37.8	168.8	-79.1	-174	134	0	0	111.8	K285 M286 V287 R292 A293	K285-E289 PolarHBondContact O-N 2.63Å; M286-E289 PolarHBondContact O-N 2.72Å; V287-E289 PolarHBondContact O-N 2.85Å; E289-R292 WeakPolarHBondContact O-CB 3.45Å; E289-R292 PolarHBondContact O-N 3.15Å; E289-A293 WeakPolarHBondContact O-CB 3.46Å; E289-A293 PolarHBondContact O-N 2.82Å
290	E	66.9	Low	66	Low	95 Å²	95	115 Å²	115	44%	0.444	56%	0.559	S	S	.	*	H	α-helix	trans	-67.3	-40.2	175.1	-160.1	-171.8	145.1	0	0	111.8	M286 V287 R292 A293 R294	M286-E290 WeakPolarHBondContact O-CB 3.19Å; M286-E290 PolarHBondContact O-N 2.88Å; V287-E290 PolarHBondContact O-N 3.01Å; E290-R292 VanDerWaalsContact C-N 3.28Å; E290-R292 PolarHBondContact O-N 3.03Å; E290-A293 PolarHBondContact O-N 3.19Å; E290-R294 WeakPolarHBondContact O-CB 3.46Å; E290-R294 VanDerWaalsContact O-CG 3.23Å; E290-R294 WeakPolarHBondContact O-CG 3.35Å; E290-R294 PolarHBondContact O-N 2.79Å; E290-R294 IonicContact OE1-CZ 3.8Å; E290-R294 IonicContact OE1-NE 3.06Å; E290-R294 PolarHBondContact OE1-NE 3.08Å; E290-R294 IonicContact OE1-NH2 2.7Å; E290-R294 PolarHBondContact OE1-NH2 3.5Å
291	E	71.1	Confident	67.2	Low	110 Å²	110	117.7 Å²	117.7	51%	0.514	56%	0.556	S	S	.	*	H	α-helix	trans	-59.8	-37.7	172.4	-171.1	76.9	-145.2	0	0	111.4	V287 K295	V287-E291 WeakPolarHBondContact O-CB 3.38Å; V287-E291 PolarHBondContact O-N 3.32Å; E291-K295 PolarHBondContact O-N 2.91Å; E291-K295 VanDerWaalsContact O-N 3.09Å
292	R	74.1	Confident	68.3	Low	159 Å²	159	117.4 Å²	117.4	60%	0.6	55%	0.551	S	S	*	*	H	α-helix	trans	-69.1	-48.1	172.9	-82.3	-179.3	-179.7	75.9	-0.9	112	S288 E289 E290 R294 K295 E296	S288-R292 WeakPolarHBondContact O-CG 3.48Å; S288-R292 PolarHBondContact O-N 3.33Å; S288-R292 PolarHBondContact O-NH1 3.27Å; S288-R292 PolarHBondContact OG-NH1 2.81Å; E289-R292 WeakPolarHBondContact O-CB 3.45Å; E289-R292 PolarHBondContact O-N 3.15Å; E290-R292 VanDerWaalsContact C-N 3.28Å; E290-R292 PolarHBondContact O-N 3.03Å; R292-R294 VanDerWaalsContact C-N 3.26Å; R292-R294 PolarHBondContact O-N 2.96Å; R292-K295 PolarHBondContact O-N 2.92Å; R292-E296 WeakPolarHBondContact O-CB 3.37Å; R292-E296 PolarHBondContact O-N 2.69Å
293	A	74.8	Confident	69.5	Low	53 Å²	53	119 Å²	119	44%	0.438	56%	0.556	S	S	.	*	H	α-helix	trans	-58.7	-40.1	178.1	0	0	0	0	0	111.4	E289 E290 E296 Q297	E289-A293 WeakPolarHBondContact O-CB 3.46Å; E289-A293 PolarHBondContact O-N 2.82Å; E290-A293 PolarHBondContact O-N 3.19Å; A293-E296 PolarHBondContact O-N 3.31Å; A293-Q297 VanDerWaalsContact O-CB 3.26Å; A293-Q297 WeakPolarHBondContact O-CB 3.41Å; A293-Q297 PolarHBondContact O-N 3.09Å
294	R	77.7	Confident	70.6	Confident	158 Å²	158	118.8 Å²	118.8	60%	0.596	55%	0.553	S	S	*	*	H	α-helix	trans	-62.7	-48.7	173.7	-73.4	169.2	179.1	-133.2	6.2	112.1	E290 R292 E296 Q297 E298	E290-R294 WeakPolarHBondContact O-CB 3.46Å; E290-R294 VanDerWaalsContact O-CG 3.23Å; E290-R294 WeakPolarHBondContact O-CG 3.35Å; E290-R294 PolarHBondContact O-N 2.79Å; E290-R294 IonicContact OE1-CZ 3.8Å; E290-R294 IonicContact OE1-NE 3.06Å; E290-R294 PolarHBondContact OE1-NE 3.08Å; E290-R294 IonicContact OE1-NH2 2.7Å; E290-R294 PolarHBondContact OE1-NH2 3.5Å; R292-R294 VanDerWaalsContact C-N 3.26Å; R292-R294 PolarHBondContact O-N 2.96Å; R294-E296 VanDerWaalsContact C-N 3.34Å; R294-E296 PolarHBondContact O-N 2.78Å; R294-Q297 PolarHBondContact O-N 2.81Å; R294-E298 WeakPolarHBondContact O-CB 3.48Å; R294-E298 PolarHBondContact O-N 2.74Å
295	K	74.9	Confident	71.5	Confident	111 Å²	111	119.1 Å²	119.1	48%	0.483	55%	0.549	S	S	.	.	H	α-helix	trans	-64.6	-35.1	176.2	-78.9	-167.1	173.6	-170.7	0	113.5	E291 R292 K299	E291-K295 PolarHBondContact O-N 2.91Å; E291-K295 VanDerWaalsContact O-N 3.09Å; R292-K295 PolarHBondContact O-N 2.92Å; K295-K299 WeakPolarHBondContact O-CB 3.05Å; K295-K299 PolarHBondContact O-N 3.49Å
296	E	74.4	Confident	72.4	Confident	145 Å²	145	114.1 Å²	114.1	68%	0.678	54%	0.535	S	S	*	.	H	α-helix	trans	-75.2	-33.6	178.3	-166.5	153.9	-134.7	0	0	111.7	R292 A293 R294 R300	R292-E296 WeakPolarHBondContact O-CB 3.37Å; R292-E296 PolarHBondContact O-N 2.69Å; A293-E296 PolarHBondContact O-N 3.31Å; R294-E296 VanDerWaalsContact C-N 3.34Å; R294-E296 PolarHBondContact O-N 2.78Å; E296-R300 WeakPolarHBondContact O-CB 3.24Å; E296-R300 PolarHBondContact O-N 3.32Å; E296-R300 VanDerWaalsContact O-N 3.12Å
297	Q	72.5	Confident	73.3	Confident	119 Å²	119	111.1 Å²	111.1	56%	0.556	53%	0.528	S	S	*	.	H	α-helix	trans	-69.1	-43.1	169.1	-177.2	172.5	-25.3	0	0	112.2	A293 R294 K299 R300 E301	A293-Q297 VanDerWaalsContact O-CB 3.26Å; A293-Q297 WeakPolarHBondContact O-CB 3.41Å; A293-Q297 PolarHBondContact O-N 3.09Å; R294-Q297 PolarHBondContact O-N 2.81Å; Q297-K299 PolarHBondContact O-N 2.95Å; Q297-R300 CarbonylContact O-C 3.59Å; Q297-R300 WeakPolarHBondContact O-CA 3.22Å; Q297-R300 WeakPolarHBondContact O-CB 3.18Å; Q297-R300 PolarHBondContact O-N 2.87Å; Q297-E301 PolarHBondContact NE2-OE1 2.77Å; Q297-E301 PolarHBondContact O-N 3.24Å
298	E	75.9	Confident	73.7	Confident	136 Å²	136	114.9 Å²	114.9	64%	0.636	53%	0.533	S	S	*	.	H	α-helix	trans	-59.9	-44.8	175.8	-177.8	175.4	-146.1	0	0	111.3	R294 R300 E301 E302	R294-E298 WeakPolarHBondContact O-CB 3.48Å; R294-E298 PolarHBondContact O-N 2.74Å; E298-R300 VanDerWaalsContact C-N 3.28Å; E298-R300 PolarHBondContact O-N 3.36Å; E298-E301 PolarHBondContact O-N 3.5Å; E298-E302 PolarHBondContact O-N 3.29Å
299	K	79.1	Confident	73.8	Confident	112 Å²	112	119.7 Å²	119.7	49%	0.487	54%	0.543	S	S	.	.	H	α-helix	trans	-58.2	-40.2	171.7	178.7	-179.9	175.4	-70.5	0	112	K295 Q297 E302 E303	K295-K299 WeakPolarHBondContact O-CB 3.05Å; K295-K299 PolarHBondContact O-N 3.49Å; Q297-K299 PolarHBondContact O-N 2.95Å; K299-E302 PolarHBondContact O-N 2.83Å; K299-E303 IonicContact NZ-OE1 3.42Å; K299-E303 PolarHBondContact NZ-OE1 2.85Å; K299-E303 IonicContact NZ-OE2 2.94Å; K299-E303 PolarHBondContact NZ-OE2 2.86Å; K299-E303 PolarHBondContact O-N 2.9Å
300	R	78	Confident	73.7	Confident	194 Å²	194	118.1 Å²	118.1	73%	0.732	54%	0.538	S	S	*	.	H	α-helix	trans	-71.4	-38.7	-178.7	-157.7	176.1	-163.7	166.9	4.4	112.1	E296 Q297 E298 E302 E303 E304	E296-R300 WeakPolarHBondContact O-CB 3.24Å; E296-R300 PolarHBondContact O-N 3.32Å; E296-R300 VanDerWaalsContact O-N 3.12Å; Q297-R300 CarbonylContact O-C 3.59Å; Q297-R300 WeakPolarHBondContact O-CA 3.22Å; Q297-R300 WeakPolarHBondContact O-CB 3.18Å; Q297-R300 PolarHBondContact O-N 2.87Å; E298-R300 VanDerWaalsContact C-N 3.28Å; E298-R300 PolarHBondContact O-N 3.36Å; R300-E302 VanDerWaalsContact C-N 3.34Å; R300-E303 PolarHBondContact O-N 2.96Å; R300-E304 WeakPolarHBondContact O-CB 3.38Å; R300-E304 PolarHBondContact O-N 2.84Å
301	E	76.5	Confident	73	Confident	112 Å²	112	119.1 Å²	119.1	52%	0.523	55%	0.546	S	S	.	.	H	α-helix	trans	-64.9	-36.5	169.8	-75.1	-173.6	-162.1	0	0	111.5	Q297 E298 K305	Q297-E301 PolarHBondContact NE2-OE1 2.77Å; Q297-E301 PolarHBondContact O-N 3.24Å; E298-E301 PolarHBondContact O-N 3.5Å; E301-K305 WeakPolarHBondContact O-CB 3.5Å; E301-K305 PolarHBondContact O-N 2.82Å
302	E	75.1	Confident	72.4	Confident	124 Å²	124	118.1 Å²	118.1	58%	0.579	55%	0.548	S	S	*	.	H	α-helix	trans	-68.8	-40.7	174.6	-171.7	164.9	-125.4	0	0	112.4	E298 K299 R300 K305 A306	E298-E302 PolarHBondContact O-N 3.29Å; K299-E302 PolarHBondContact O-N 2.83Å; R300-E302 VanDerWaalsContact C-N 3.34Å; E302-K305 CarbonylContact O-C 3.59Å; E302-K305 PolarHBondContact O-N 2.77Å; E302-A306 WeakPolarHBondContact O-CB 3.45Å; E302-A306 PolarHBondContact O-N 2.74Å
303	E	76.2	Confident	71.3	Confident	107 Å²	107	116.9 Å²	116.9	50%	0.5	55%	0.549	S	S	.	.	H	α-helix	trans	-64.2	-41.2	172.8	-79.5	173.6	155.7	0	0	112.1	K299 R300 A306 A307	K299-E303 IonicContact NZ-OE1 3.42Å; K299-E303 PolarHBondContact NZ-OE1 2.85Å; K299-E303 IonicContact NZ-OE2 2.94Å; K299-E303 PolarHBondContact NZ-OE2 2.86Å; K299-E303 PolarHBondContact O-N 2.9Å; R300-E303 PolarHBondContact O-N 2.96Å; E303-A306 PolarHBondContact O-N 3.15Å; E303-A307 PolarHBondContact O-N 3.09Å
304	E	75.9	Confident	70.2	Confident	97 Å²	97	119 Å²	119	45%	0.453	55%	0.552	S	S	.	*	H	α-helix	trans	-67.2	-38.3	174.9	-163.3	-168.7	138.2	0	0	111.9	R300 A306 A307 R308	R300-E304 WeakPolarHBondContact O-CB 3.38Å; R300-E304 PolarHBondContact O-N 2.84Å; E304-A306 VanDerWaalsContact C-N 3.28Å; E304-A306 PolarHBondContact O-N 3.36Å; E304-A307 PolarHBondContact O-N 2.85Å; E304-R308 WeakPolarHBondContact O-CB 2.98Å; E304-R308 VanDerWaalsContact O-CG 3.31Å; E304-R308 WeakPolarHBondContact O-CG 3.33Å; E304-R308 PolarHBondContact O-N 3.41Å; E304-R308 IonicContact OE1-CZ 2.66Å; E304-R308 IonicContact OE1-NE 2.87Å; E304-R308 PolarHBondContact OE1-NE 3.14Å; E304-R308 IonicContact OE1-NH2 2.78Å; E304-R308 PolarHBondContact OE1-NH2 2.91Å
305	K	76.2	Confident	69	Low	133 Å²	133	117 Å²	117	58%	0.578	55%	0.554	S	S	*	*	H	α-helix	trans	-73.2	-19.3	176.4	-168.6	178.7	-162	167.6	0	112.7	E301 E302 R309	E301-K305 WeakPolarHBondContact O-CB 3.5Å; E301-K305 PolarHBondContact O-N 2.82Å; E302-K305 CarbonylContact O-C 3.59Å; E302-K305 PolarHBondContact O-N 2.77Å; K305-R309 WeakPolarHBondContact O-CD 3.48Å; K305-R309 VanDerWaalsContact O-CG 3.3Å; K305-R309 WeakPolarHBondContact O-CG 3.37Å
306	A	75.1	Confident	67.7	Low	42 Å²	42	119.1 Å²	119.1	35%	0.347	56%	0.563	S	S	.	*	H	α-helix	trans	-78.6	-44.8	165.4	0	0	0	0	0	111.2	E302 E303 E304 R308 R309 I310	E302-A306 WeakPolarHBondContact O-CB 3.45Å; E302-A306 PolarHBondContact O-N 2.74Å; E303-A306 PolarHBondContact O-N 3.15Å; E304-A306 VanDerWaalsContact C-N 3.28Å; E304-A306 PolarHBondContact O-N 3.36Å; A306-R308 PolarHBondContact O-N 2.84Å; A306-R309 WeakPolarHBondContact O-CB 3.5Å; A306-R309 PolarHBondContact O-N 3.35Å; A306-I310 WeakPolarHBondContact O-CG1 3.28Å; A306-I310 PolarHBondContact O-N 3.01Å; A306-I310 VanDerWaalsContact O-N 3.11Å
307	A	74.2	Confident	66.6	Low	49 Å²	49	116.1 Å²	116.1	41%	0.405	55%	0.552	S	S	.	*	H	α-helix	trans	-58.3	-48.3	174.6	0	0	0	0	0	111.9	E303 E304 R309 I310 D311	E303-A307 PolarHBondContact O-N 3.09Å; E304-A307 PolarHBondContact O-N 2.85Å; A307-R309 PolarHBondContact O-N 3.42Å; A307-R309 VanDerWaalsContact O-N 3.12Å; A307-I310 WeakPolarHBondContact O-CB 3.45Å; A307-I310 PolarHBondContact O-N 2.94Å; A307-D311 PolarHBondContact O-N 3.37Å
308	R	70.5	Confident	65.6	Low	162 Å²	162	111.8 Å²	111.8	61%	0.611	54%	0.536	S	S	*	.	H	α-helix	trans	-63.6	-13.2	174	-68.8	173.7	-178.2	-115.6	10.6	114.3	E304 A306 V312	E304-R308 WeakPolarHBondContact O-CB 2.98Å; E304-R308 VanDerWaalsContact O-CG 3.31Å; E304-R308 WeakPolarHBondContact O-CG 3.33Å; E304-R308 PolarHBondContact O-N 3.41Å; E304-R308 IonicContact OE1-CZ 2.66Å; E304-R308 IonicContact OE1-NE 2.87Å; E304-R308 PolarHBondContact OE1-NE 3.14Å; E304-R308 IonicContact OE1-NH2 2.78Å; E304-R308 PolarHBondContact OE1-NH2 2.91Å; A306-R308 PolarHBondContact O-N 2.84Å; R308-V312 VanDerWaalsContact O-CG2 3.28Å; R308-V312 WeakPolarHBondContact O-CG2 3.47Å
309	R	66.2	Low	64.5	Low	158 Å²	158	112.9 Å²	112.9	60%	0.596	54%	0.541	S	S	*	.	H	α-helix	trans	-85.1	-37.4	168.6	-78.8	169.6	178.6	167.5	1.2	111.5	K305 A306 A307 V312 E313	K305-R309 WeakPolarHBondContact O-CD 3.48Å; K305-R309 VanDerWaalsContact O-CG 3.3Å; K305-R309 WeakPolarHBondContact O-CG 3.37Å; A306-R309 WeakPolarHBondContact O-CB 3.5Å; A306-R309 PolarHBondContact O-N 3.35Å; A307-R309 PolarHBondContact O-N 3.42Å; A307-R309 VanDerWaalsContact O-N 3.12Å; R309-V312 PolarHBondContact O-N 3.22Å; R309-E313 WeakPolarHBondContact O-CG 3.47Å; R309-E313 PolarHBondContact O-N 2.87Å
310	I	61.6	Low	63.8	Low	105 Å²	105	112.2 Å²	112.2	54%	0.538	54%	0.54	S	S	.	.	H	α-helix	trans	-66	-43.2	177.6	-64	165.4	0	0	0	110.3	A306 A307 V312 E313 D314	A306-I310 WeakPolarHBondContact O-CG1 3.28Å; A306-I310 PolarHBondContact O-N 3.01Å; A306-I310 VanDerWaalsContact O-N 3.11Å; A307-I310 WeakPolarHBondContact O-CB 3.45Å; A307-I310 PolarHBondContact O-N 2.94Å; I310-V312 VanDerWaalsContact C-N 3.29Å; I310-V312 PolarHBondContact O-N 3.25Å; I310-E313 PolarHBondContact O-N 3.44Å; I310-E313 VanDerWaalsContact O-N 3.08Å; I310-D314 PolarHBondContact O-N 2.83Å
311	D	54.1	Low	63.9	Low	115 Å²	115	109.3 Å²	109.3	62%	0.615	53%	0.532	S	S	*	.	H	α-helix	trans	-57.1	-41.7	173	-81	-30.7	0	0	0	112	A307 E313 D314 D315	A307-D311 PolarHBondContact O-N 3.37Å; D311-E313 VanDerWaalsContact C-N 3.28Å; D311-E313 PolarHBondContact O-N 2.88Å; D311-D314 PolarHBondContact O-N 2.88Å; D311-D315 PolarHBondContact O-N 3.24Å
312	V	57.1	Low	64.5	Low	90 Å²	90	107.3 Å²	107.3	55%	0.545	53%	0.529	S	S	.	.	H	α-helix	trans	-73.4	-18.9	179.2	172.4	0	0	0	0	112.6	R308 R309 I310	R308-V312 VanDerWaalsContact O-CG2 3.28Å; R308-V312 WeakPolarHBondContact O-CG2 3.47Å; R309-V312 PolarHBondContact O-N 3.22Å; I310-V312 VanDerWaalsContact C-N 3.29Å; I310-V312 PolarHBondContact O-N 3.25Å
313	E	52.3	Low	65.3	Low	133 Å²	133	105.5 Å²	105.5	62%	0.621	52%	0.523	S	S	*	.	H	α-helix	trans	-84	-36.5	172	-74.3	174	-178.6	0	0	111.7	R309 I310 D311 D315 F316 D317	R309-E313 WeakPolarHBondContact O-CG 3.47Å; R309-E313 PolarHBondContact O-N 2.87Å; I310-E313 PolarHBondContact O-N 3.44Å; I310-E313 VanDerWaalsContact O-N 3.08Å; D311-E313 VanDerWaalsContact C-N 3.28Å; D311-E313 PolarHBondContact O-N 2.88Å; E313-D315 VanDerWaalsContact C-N 3.31Å; E313-D315 PolarHBondContact O-N 2.97Å; E313-F316 WeakPolarHBondContact O-CB 3.16Å; E313-F316 PolarHBondContact O-N 2.74Å; E313-D317 PolarHBondContact O-N 2.97Å
314	D	50	Low	66	Low	97 Å²	97	102.6 Å²	102.6	52%	0.519	51%	0.51	S	S	.	.	H	α-helix	trans	-69.2	-26.4	170.7	-95.3	0.7	0	0	0	112.4	I310 D311 F316 D317 A318	I310-D314 PolarHBondContact O-N 2.83Å; D311-D314 PolarHBondContact O-N 2.88Å; D314-F316 VanDerWaalsContact C-N 3.28Å; D314-F316 PolarHBondContact O-N 2.94Å; D314-D317 CarbonylContact O-C 3.53Å; D314-D317 PolarHBondContact O-N 3.5Å; D314-A318 PolarHBondContact O-N 2.77Å
315	D	52.6	Low	66.8	Low	116 Å²	116	104.5 Å²	104.5	62%	0.62	52%	0.517	S	S	*	.	H	α-helix	trans	-70.5	-22.9	173.3	-139.9	18.3	0	0	0	112.6	D311 E313 A318	D311-D315 PolarHBondContact O-N 3.24Å; E313-D315 VanDerWaalsContact C-N 3.31Å; E313-D315 PolarHBondContact O-N 2.97Å; D315-A318 WeakPolarHBondContact O-CB 3.45Å; D315-A318 PolarHBondContact O-N 3.27Å
316	F	48.9	Very low	67.6	Low	155 Å²	155	98.3 Å²	98.3	68%	0.68	49%	0.491	S	S	*	.	H	α-helix	trans	-74.5	-41.9	167.6	-103	-89.6	0	0	0	111.8	E313 D314 A318 Q319	E313-F316 WeakPolarHBondContact O-CB 3.16Å; E313-F316 PolarHBondContact O-N 2.74Å; D314-F316 VanDerWaalsContact C-N 3.28Å; D314-F316 PolarHBondContact O-N 2.94Å; F316-A318 PolarHBondContact O-N 3.37Å; F316-Q319 PolarHBondContact O-N 2.8Å
317	D	51.8	Low	68.3	Low	83 Å²	83	103.7 Å²	103.7	44%	0.444	51%	0.506	S	S	.	.	H	α-helix	trans	-64.3	-15.8	170.6	-86	-4.1	0	0	0	111.2	K81 E313 D314	K81-D317 IonicContact NZ-OD2 2.65Å; K81-D317 PolarHBondContact NZ-OD2 3.25Å; E313-D317 PolarHBondContact O-N 2.97Å; D314-D317 CarbonylContact O-C 3.53Å; D314-D317 PolarHBondContact O-N 3.5Å
318	A	50.1	Low	69.1	Low	27 Å²	27	106.1 Å²	106.1	22%	0.223	51%	0.512	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-23	173.7	0	0	0	0	0	114.7	D314 D315 F316 K321	D314-A318 PolarHBondContact O-N 2.77Å; D315-A318 WeakPolarHBondContact O-CB 3.45Å; D315-A318 PolarHBondContact O-N 3.27Å; F316-A318 PolarHBondContact O-N 3.37Å; A318-K321 WeakPolarHBondContact O-CD 3.45Å; A318-K321 WeakPolarHBondContact O-CG 3.34Å
319	Q	53.4	Low	70.1	Confident	160 Å²	160	100 Å²	100	75%	0.748	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-18.3	-177.2	-68.1	-174.3	-16.7	0	0	114.4	F316 K321	F316-Q319 PolarHBondContact O-N 2.8Å; Q319-K321 PolarHBondContact O-N 3.4Å
320	E	64.5	Low	71.6	Confident	97 Å²	97	95.2 Å²	95.2	45%	0.453	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	21.9	171.9	-151.3	176	-163.4	0	0	112.1	R78 F334	R78-E320 IonicContact CZ-OE1 2.62Å; R78-E320 IonicContact NH1-OE1 3.76Å; R78-E320 PolarHBondContact NH1-OE1 3.17Å; R78-E320 IonicContact NH1-OE2 3.69Å; R78-E320 PolarHBondContact NH1-OE2 2.99Å; R78-E320 IonicContact NH2-OE1 2.77Å; R78-E320 PolarHBondContact NH2-OE1 3.3Å; E320-F334 HydrophobicContact CG-CD1 4.47Å; E320-F334 HydrophobicContact CG-CE1 4.06Å; E320-F334 WeakPolarHBondContact O-CE1 3.37Å
321	K	79.9	Confident	73.2	Confident	133 Å²	133	90.3 Å²	90.3	58%	0.578	46%	0.456	S	S	*	.			trans	-81.4	127.7	176.2	-71.6	173.4	-175	152.2	0	111.1	A318 Q319	A318-K321 WeakPolarHBondContact O-CD 3.45Å; A318-K321 WeakPolarHBondContact O-CG 3.34Å; Q319-K321 PolarHBondContact O-N 3.4Å
322	P	88.4	Confident	75.2	Confident	70 Å²	70	86.6 Å²	86.6	46%	0.455	44%	0.436	S	S	.	.			trans	-76.2	134.3	-179.7	31	-35.2	0	0	0	111.9	L332 K333 F334	P322-L332 HydrophobicContact CB-CB 3.97Å; P322-L332 HydrophobicContact CB-CD1 4.29Å; P322-L332 HydrophobicContact CB-CD2 4.33Å; P322-L332 HydrophobicContact CB-CG 4.42Å; P322-L332 HydrophobicContact CG-CD1 4.32Å; P322-K333 CarbonylContact C-O 3.26Å; P322-K333 WeakPolarHBondContact CA-O 3.13Å; P322-F334 HydrophobicContact CB-CE1 4.32Å
323	I	91.5	Very high	77.1	Confident	87 Å²	87	83.2 Å²	83.2	45%	0.446	41%	0.414	S	S	.	.			trans	-96.3	-23.7	-174.7	53.1	160.2	0	0	0	114.3	K333 D335	I323-K333 HydrophobicContact CD1-CD 3.71Å; I323-K333 HydrophobicContact CD1-CG 4.04Å; I323-K333 HydrophobicContact CG1-CB 4.21Å; I323-K333 HydrophobicContact CG1-CD 3.91Å; I323-K333 HydrophobicContact CG1-CG 3.93Å; I323-K333 WeakPolarHBondContact CG1-O 3.45Å; I323-K333 PolarHBondContact N-O 2.93Å; I323-D335 HydrophobicContact CD1-CB 3.86Å; I323-D335 HydrophobicContact CG1-CB 4.47Å; I323-D335 HydrophobicContact CG2-CB 4.15Å
324	D	91	Very high	79.1	Confident	45 Å²	45	77.9 Å²	77.9	24%	0.241	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	165.6	174.3	-162.8	3.8	0	0	0	109.7	K333 W360 Y409	D324-K333 HydrophobicContact CB-CB 3.86Å; D324-K333 HydrophobicContact CB-CD 3.79Å; D324-K333 HydrophobicContact CB-CG 4.46Å; D324-K333 PolarHBondContact O-N 3.49Å; D324-W360 HydrophobicContact CB-CH2 4.12Å; D324-W360 HydrophobicContact CB-CZ2 3.92Å; D324-W360 WeakPolarHBondContact OD2-CZ2 3.26Å; D324-Y409 PolarHBondContact OD2-OH 2.95Å
325	K	92.9	Very high	81.1	Confident	137 Å²	137	79.4 Å²	79.4	60%	0.596	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.9	148.2	-179.2	65.6	-170.6	177	-173.1	0	112.1	F331 L332	K325-F331 CarbonylContact C-O 3.52Å; K325-F331 VanDerWaalsContact CA-O 3.26Å; K325-F331 WeakPolarHBondContact CA-O 3.44Å; K325-L332 HydrophobicContact CB-CD2 3.85Å
326	S	93.2	Very high	83	Confident	3 Å²	3	77.7 Å²	77.7	2%	0.021	39%	0.386	C	S	.	.			trans	-63.6	160.4	176.2	64.1	0	0	0	0	112.1	N328 G329 R330 F331	S326-N328 WeakPolarHBondContact CB-OD1 3.32Å; S326-N328 PolarHBondContact O-N 3.04Å; S326-N328 VanDerWaalsContact O-N 3.17Å; S326-N328 PolarHBondContact OG-OD1 3.34Å; S326-G329 WeakPolarHBondContact O-CA 3.31Å; S326-G329 PolarHBondContact O-N 2.9Å; S326-G329 PolarHBondContact OG-N 3.41Å; S326-R330 PolarHBondContact OG-N 2.67Å; S326-R330 VanDerWaalsContact OG-N 3.08Å; S326-F331 PolarHBondContact N-O 2.84Å; S326-F331 PolarHBondContact OG-N 2.99Å
327	K	90	Very high	85.1	Confident	155 Å²	155	74.9 Å²	74.9	67%	0.674	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-28.7	-176.8	-62.7	-178.9	-178.7	177.2	0	114	W398 E399	K327-W398 HydrophobicContact CD-CB 4.16Å; K327-W398 HydrophobicContact CD-CG 4.26Å; K327-W398 HydrophobicContact CG-CG 4.31Å; K327-E399 WeakPolarHBondContact CE-O 3.47Å; K327-E399 PolarHBondContact NZ-O 2.97Å
328	N	91.2	Very high	86.9	Confident	100 Å²	100	74.5 Å²	74.5	54%	0.535	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-0.5	174.3	54.2	11.8	0	0	0	113.4	S326 R330	S326-N328 WeakPolarHBondContact CB-OD1 3.32Å; S326-N328 PolarHBondContact O-N 3.04Å; S326-N328 VanDerWaalsContact O-N 3.17Å; S326-N328 PolarHBondContact OG-OD1 3.34Å; N328-R330 PolarHBondContact O-N 2.82Å; N328-R330 WeakPolarHBondContact OD1-CB 3.21Å; N328-R330 PolarHBondContact OD1-N 2.92Å
329	G	92.3	Very high	88.6	Confident	33 Å²	33	74.7 Å²	74.7	34%	0.34	38%	0.376	S	S	.	.	S	Bend	trans	73.9	-5.1	-176.5	0	0	0	0	0	115.4	S326	S326-G329 WeakPolarHBondContact O-CA 3.31Å; S326-G329 PolarHBondContact O-N 2.9Å; S326-G329 PolarHBondContact OG-N 3.41Å
330	R	96.2	Very high	90.1	Very high	58 Å²	58	75.3 Å²	75.3	22%	0.219	37%	0.372	C	S	.	.			trans	-61.5	-44.8	-175.8	179.3	176.7	175.5	162.8	-8.9	113.3	S326 N328 D351 T352 E353	S326-R330 PolarHBondContact OG-N 2.67Å; S326-R330 VanDerWaalsContact OG-N 3.08Å; N328-R330 PolarHBondContact O-N 2.82Å; N328-R330 WeakPolarHBondContact OD1-CB 3.21Å; N328-R330 PolarHBondContact OD1-N 2.92Å; R330-D351 VanDerWaalsContact CG-OD1 3.28Å; R330-D351 WeakPolarHBondContact CG-OD1 3.5Å; R330-D351 IonicContact CZ-OD1 3.44Å; R330-D351 IonicContact CZ-OD2 3.6Å; R330-D351 IonicContact NE-OD1 3.48Å; R330-D351 PolarHBondContact NE-OD1 3.18Å; R330-D351 IonicContact NE-OD2 3.31Å; R330-D351 PolarHBondContact NE-OD2 3.01Å; R330-D351 IonicContact NH2-OD1 3.28Å; R330-D351 IonicContact NH2-OD2 3.79Å; R330-D351 PolarHBondContact NH2-OD2 3.41Å; R330-T352 WeakPolarHBondContact CA-OG1 3.36Å; R330-T352 WeakPolarHBondContact O-CB 3.41Å; R330-T352 WeakPolarHBondContact O-CG2 3.44Å; R330-T352 PolarHBondContact O-N 2.94Å; R330-T352 PolarHBondContact O-OG1 2.81Å; R330-E353 VanDerWaalsContact CD-CD 3.44Å; R330-E353 WeakPolarHBondContact CD-OE1 3.46Å; R330-E353 HydrophobicContact CG-CG 4Å; R330-E353 IonicContact CZ-OE2 3.17Å; R330-E353 IonicContact NE-OE1 2.65Å; R330-E353 IonicContact NE-OE2 3.3Å; R330-E353 PolarHBondContact NE-OE2 3.41Å; R330-E353 IonicContact NH1-OE2 2.79Å; R330-E353 PolarHBondContact NH1-OE2 3.15Å; R330-E353 IonicContact NH2-OE2 2.69Å
331	F	96.9	Very high	90.5	Very high	2 Å²	2	72.6 Å²	72.6	1%	0.009	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	135.2	-176.3	-52.5	-72.5	0	0	0	110.5	K325 S326 L350 D351 V358 W360 Y395 D396 W398 V413	K325-F331 CarbonylContact C-O 3.52Å; K325-F331 VanDerWaalsContact CA-O 3.26Å; K325-F331 WeakPolarHBondContact CA-O 3.44Å; S326-F331 PolarHBondContact N-O 2.84Å; S326-F331 PolarHBondContact OG-N 2.99Å; F331-L350 WeakPolarHBondContact CA-O 3.48Å; F331-D351 HydrophobicContact CD1-CB 3.87Å; F331-D351 HydrophobicContact CE1-CB 3.79Å; F331-V358 HydrophobicContact CD1-CG2 4.24Å; F331-W360 HydrophobicContact CB-CE3 4.33Å; F331-W360 HydrophobicContact CB-CZ3 4.15Å; F331-Y395 HydrophobicContact CZ-CG 4.49Å; F331-D396 HydrophobicContact CE2-CB 3.73Å; F331-D396 HydrophobicContact CZ-CB 4.39Å; F331-W398 HydrophobicContact CB-CH2 4.41Å; F331-W398 HydrophobicContact CD2-CH2 4.1Å; F331-W398 AromaticContact CD2-CZ3 3.97Å; F331-W398 HydrophobicContact CD2-CZ3 3.97Å; F331-V413 HydrophobicContact CB-CG2 4.4Å; F331-V413 HydrophobicContact CD1-CG1 3.75Å; F331-V413 HydrophobicContact CD2-CB 4.49Å; F331-V413 HydrophobicContact CD2-CG1 4.42Å; F331-V413 HydrophobicContact CD2-CG2 4.05Å; F331-V413 HydrophobicContact CE1-CG1 3.9Å; F331-V413 HydrophobicContact CG-CG1 4.02Å; F331-V413 HydrophobicContact CG-CG2 4.12Å; F331-V413 HydrophobicContact CZ-CG1 4.31Å
332	L	95.7	Very high	89.8	Confident	38 Å²	38	71.3 Å²	71.3	20%	0.199	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	143	173.7	-58.3	177	0	0	0	110	P322 K325 F334 G349 L350 T352	P322-L332 HydrophobicContact CB-CB 3.97Å; P322-L332 HydrophobicContact CB-CD1 4.29Å; P322-L332 HydrophobicContact CB-CD2 4.33Å; P322-L332 HydrophobicContact CB-CG 4.42Å; P322-L332 HydrophobicContact CG-CD1 4.32Å; K325-L332 HydrophobicContact CB-CD2 3.85Å; L332-F334 HydrophobicContact CB-CE2 4.27Å; L332-F334 HydrophobicContact CB-CZ 4.37Å; L332-G349 CarbonylContact O-C 3.53Å; L332-G349 WeakPolarHBondContact O-CA 3.46Å; L332-L350 PolarHBondContact N-O 3.37Å; L332-L350 PolarHBondContact O-N 2.85Å; L332-T352 HydrophobicContact CD1-CG2 3.67Å; L332-T352 HydrophobicContact CG-CG2 3.74Å
333	K	95.8	Very high	88.9	Confident	18 Å²	18	72.9 Å²	72.9	8%	0.078	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	139.2	171.9	-173.4	-168.8	-178	179.7	0	110	P322 I323 D324 F347 W360 E362	P322-K333 CarbonylContact C-O 3.26Å; P322-K333 WeakPolarHBondContact CA-O 3.13Å; I323-K333 HydrophobicContact CD1-CD 3.71Å; I323-K333 HydrophobicContact CD1-CG 4.04Å; I323-K333 HydrophobicContact CG1-CB 4.21Å; I323-K333 HydrophobicContact CG1-CD 3.91Å; I323-K333 HydrophobicContact CG1-CG 3.93Å; I323-K333 WeakPolarHBondContact CG1-O 3.45Å; I323-K333 PolarHBondContact N-O 2.93Å; D324-K333 HydrophobicContact CB-CB 3.86Å; D324-K333 HydrophobicContact CB-CD 3.79Å; D324-K333 HydrophobicContact CB-CG 4.46Å; D324-K333 PolarHBondContact O-N 3.49Å; K333-F347 HydrophobicContact CD-CG 4.47Å; K333-F347 HydrophobicContact CG-CB 4.09Å; K333-F347 HydrophobicContact CG-CG 4.4Å; K333-W360 HydrophobicContact CB-CD2 3.76Å; K333-W360 HydrophobicContact CB-CE3 3.92Å; K333-W360 HydrophobicContact CB-CG 4.25Å; K333-W360 HydrophobicContact CB-CH2 4.08Å; K333-W360 HydrophobicContact CB-CZ2 3.97Å; K333-W360 HydrophobicContact CB-CZ3 4.08Å; K333-W360 HydrophobicContact CD-CD2 4.42Å; K333-W360 HydrophobicContact CD-CG 4.49Å; K333-W360 HydrophobicContact CD-CZ2 4.19Å; K333-W360 HydrophobicContact CG-CD2 4.02Å; K333-W360 HydrophobicContact CG-CG 4.02Å; K333-W360 HydrophobicContact CG-CZ2 4.46Å; K333-E362 WeakPolarHBondContact CE-OE1 3.36Å; K333-E362 IonicContact NZ-OE1 2.61Å; K333-E362 PolarHBondContact NZ-OE1 2.85Å; K333-E362 IonicContact NZ-OE2 3.39Å; K333-E362 PolarHBondContact NZ-OE2 2.94Å
334	F	94	Very high	88.4	Confident	22 Å²	22	70.8 Å²	70.8	10%	0.096	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	157.8	170	-57	-92.2	0	0	0	110	E320 P322 L332 E336 R348 L350	E320-F334 HydrophobicContact CG-CD1 4.47Å; E320-F334 HydrophobicContact CG-CE1 4.06Å; E320-F334 WeakPolarHBondContact O-CE1 3.37Å; P322-F334 HydrophobicContact CB-CE1 4.32Å; L332-F334 HydrophobicContact CB-CE2 4.27Å; L332-F334 HydrophobicContact CB-CZ 4.37Å; F334-E336 PolarHBondContact O-N 3.34Å; F334-R348 PolarHBondContact N-O 3.31Å; F334-L350 HydrophobicContact CE2-CB 3.63Å; F334-L350 HydrophobicContact CZ-CB 4.07Å; F334-L350 HydrophobicContact CZ-CD2 4.5Å
335	D	92.2	Very high	88.3	Confident	129 Å²	129	69.3 Å²	69.3	69%	0.69	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.7	43.5	-179.7	-153.3	26.4	0	0	0	112.9	I323	I323-D335 HydrophobicContact CD1-CB 3.86Å; I323-D335 HydrophobicContact CG1-CB 4.47Å; I323-D335 HydrophobicContact CG2-CB 4.15Å
336	E	92.5	Very high	88.2	Confident	80 Å²	80	63.8 Å²	63.8	37%	0.374	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	94.7	176.4	-174.2	-176.6	145.8	0	0	108.2	F334 L338 F347 R348	F334-E336 PolarHBondContact O-N 3.34Å; E336-L338 HydrophobicContact CG-CD2 4.33Å; E336-L338 PolarHBondContact O-N 3.49Å; E336-F347 CarbonylContact O-C 3.56Å; E336-F347 WeakPolarHBondContact O-CA 3.43Å; E336-R348 HydrophobicContact CB-CB 3.95Å; E336-R348 VanDerWaalsContact CD-CD 3.41Å; E336-R348 HydrophobicContact CG-CB 4.34Å; E336-R348 PolarHBondContact O-N 3.12Å; E336-R348 IonicContact OE1-NH1 2.63Å; E336-R348 WeakPolarHBondContact OE2-CD 3.4Å; E336-R348 IonicContact OE2-CZ 3.39Å; E336-R348 IonicContact OE2-NE 2.68Å; E336-R348 IonicContact OE2-NH1 3.27Å; E336-R348 PolarHBondContact OE2-NH1 2.76Å
337	E	93.2	Very high	88.3	Confident	96 Å²	96	64.6 Å²	64.6	45%	0.449	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	112.8	172.9	-169.6	-177.1	114.3	0	0	109.3	R340 T345 F347	E337-R340 VanDerWaalsContact OE1-CB 3.25Å; E337-R340 WeakPolarHBondContact OE1-CB 3.2Å; E337-R340 IonicContact OE2-NH1 2.86Å; E337-T345 HydrophobicContact CG-CG2 3.7Å; E337-T345 WeakPolarHBondContact OE2-CG2 3.39Å; E337-F347 HydrophobicContact CB-CE1 4.43Å
338	L	90.5	Very high	88.6	Confident	75 Å²	75	61.2 Å²	61.2	39%	0.393	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-20.7	177.8	-62.6	175.2	0	0	0	112.5	E336 V346 R348 L416	E336-L338 HydrophobicContact CG-CD2 4.33Å; E336-L338 PolarHBondContact O-N 3.49Å; L338-V346 HydrophobicContact CB-CG1 4.3Å; L338-V346 HydrophobicContact CD1-CG1 4.37Å; L338-V346 PolarHBondContact N-O 3.22Å; L338-R348 HydrophobicContact CD1-CB 4.04Å; L338-R348 HydrophobicContact CD2-CB 4.26Å; L338-R348 HydrophobicContact CG-CB 4.16Å; L338-L416 HydrophobicContact CD1-CD1 3.42Å; L338-L416 VanDerWaalsContact CD1-CD1 3.42Å
339	G	85.7	Confident	88.8	Confident	30 Å²	30	56.5 Å²	56.5	31%	0.309	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	163.5	159	174.5	0	0	0	0	0	113.4	V346	G339-V346 PolarHBondContact N-O 2.74Å; G339-V346 WeakPolarHBondContact O-CB 3.34Å; G339-V346 PolarHBondContact O-N 3.38Å
340	R	85.3	Confident	89	Confident	174 Å²	174	57.2 Å²	57.2	66%	0.657	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.3	143.5	-170.6	179.5	171.3	171.7	-179.5	-3.7	111.8	E337 T345	E337-R340 VanDerWaalsContact OE1-CB 3.25Å; E337-R340 WeakPolarHBondContact OE1-CB 3.2Å; E337-R340 IonicContact OE2-NH1 2.86Å; R340-T345 HydrophobicContact CB-CG2 4.43Å
341	G	71.8	Confident	89.1	Confident	40 Å²	40	54.4 Å²	54.4	41%	0.412	28%	0.282	S	S	.	.			trans	-129.6	-171.4	176.5	0	0	0	0	0	111.7	F343 K344	G341-F343 VanDerWaalsContact C-N 3.27Å; G341-F343 PolarHBondContact O-N 3.32Å; G341-K344 PolarHBondContact N-O 2.98Å
342	S	66.1	Low	89	Confident	105 Å²	105	57.7 Å²	57.7	73%	0.734	30%	0.302	S	S	*	.	S	Bend	trans	-63.7	-26.5	-176.5	46.4	0	0	0	0	115
343	F	70	Confident	88.9	Confident	103 Å²	103	62.2 Å²	62.2	45%	0.452	32%	0.322	S	S	.	.	S	Bend	trans	-130.9	-8	-178.3	-55	-74.4	0	0	0	114.2	G341 L363 Q364 K367	G341-F343 VanDerWaalsContact C-N 3.27Å; G341-F343 PolarHBondContact O-N 3.32Å; F343-L363 WeakPolarHBondContact O-CA 3.42Å; F343-Q364 PolarHBondContact O-N 2.87Å; F343-K367 HydrophobicContact CE1-CD 4.17Å
344	K	80.8	Confident	88.8	Confident	44 Å²	44	65.1 Å²	65.1	19%	0.191	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	141.4	-174	83.9	-175.2	-164.5	179.2	0	112	G341 V346 E362 L363 D481 L484	G341-K344 PolarHBondContact N-O 2.98Å; K344-V346 HydrophobicContact CD-CG2 4.33Å; K344-V346 HydrophobicContact CG-CG2 4.39Å; K344-E362 WeakPolarHBondContact CA-O 3.33Å; K344-L363 HydrophobicContact CB-CD2 3.42Å; K344-L363 VanDerWaalsContact CB-CD2 3.42Å; K344-D481 IonicContact NZ-OD1 3.56Å; K344-D481 PolarHBondContact NZ-OD1 2.94Å; K344-D481 IonicContact NZ-OD2 3.57Å; K344-D481 PolarHBondContact NZ-OD2 2.68Å; K344-L484 HydrophobicContact CD-CD1 3.59Å
345	T	88	Confident	88.8	Confident	14 Å²	14	66.3 Å²	66.3	9%	0.086	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	133.9	159.6	-54.9	0	0	0	0	108.4	E337 R340 F347 E362	E337-T345 HydrophobicContact CG-CG2 3.7Å; E337-T345 WeakPolarHBondContact OE2-CG2 3.39Å; R340-T345 HydrophobicContact CB-CG2 4.43Å; T345-F347 HydrophobicContact CG2-CD2 4.01Å; T345-F347 HydrophobicContact CG2-CE1 4.47Å; T345-F347 HydrophobicContact CG2-CE2 3.37Å; T345-F347 HydrophobicContact CG2-CZ 3.64Å; T345-E362 PolarHBondContact N-O 2.9Å; T345-E362 PolarHBondContact O-N 3.48Å
346	V	91.7	Very high	88.9	Confident	21 Å²	21	63.5 Å²	63.5	13%	0.127	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	121.3	-179.6	-173.7	0	0	0	0	108.5	L338 G339 K344 A359 W360 C361	L338-V346 HydrophobicContact CB-CG1 4.3Å; L338-V346 HydrophobicContact CD1-CG1 4.37Å; L338-V346 PolarHBondContact N-O 3.22Å; G339-V346 PolarHBondContact N-O 2.74Å; G339-V346 WeakPolarHBondContact O-CB 3.34Å; G339-V346 PolarHBondContact O-N 3.38Å; K344-V346 HydrophobicContact CD-CG2 4.33Å; K344-V346 HydrophobicContact CG-CG2 4.39Å; V346-A359 HydrophobicContact CG1-CB 3.98Å; V346-W360 WeakPolarHBondContact CA-O 3.34Å; V346-C361 HydrophobicContact CG2-CB 4.5Å
347	F	95	Very high	89	Confident	20 Å²	20	61.5 Å²	61.5	9%	0.088	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	158	176.1	-65.5	-93.3	0	0	0	110.4	K333 E336 E337 T345 W360 E362	K333-F347 HydrophobicContact CD-CG 4.47Å; K333-F347 HydrophobicContact CG-CB 4.09Å; K333-F347 HydrophobicContact CG-CG 4.4Å; E336-F347 CarbonylContact O-C 3.56Å; E336-F347 WeakPolarHBondContact O-CA 3.43Å; E337-F347 HydrophobicContact CB-CE1 4.43Å; T345-F347 HydrophobicContact CG2-CD2 4.01Å; T345-F347 HydrophobicContact CG2-CE1 4.47Å; T345-F347 HydrophobicContact CG2-CE2 3.37Å; T345-F347 HydrophobicContact CG2-CZ 3.64Å; F347-W360 HydrophobicContact CB-CB 4.35Å; F347-W360 PolarHBondContact N-O 3.42Å; F347-W360 PolarHBondContact O-N 2.81Å; F347-E362 HydrophobicContact CD2-CG 4.4Å; F347-E362 HydrophobicContact CE2-CG 4.45Å; F347-E362 WeakPolarHBondContact CE2-OE2 3.45Å
348	R	96	Very high	89.2	Confident	84 Å²	84	56.9 Å²	56.9	32%	0.317	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	139.4	166.5	-170.5	177.4	168.6	-173.1	-10.2	110.2	F334 E336 L338 L416	F334-R348 PolarHBondContact N-O 3.31Å; E336-R348 HydrophobicContact CB-CB 3.95Å; E336-R348 VanDerWaalsContact CD-CD 3.41Å; E336-R348 HydrophobicContact CG-CB 4.34Å; E336-R348 PolarHBondContact O-N 3.12Å; E336-R348 IonicContact OE1-NH1 2.63Å; E336-R348 WeakPolarHBondContact OE2-CD 3.4Å; E336-R348 IonicContact OE2-CZ 3.39Å; E336-R348 IonicContact OE2-NE 2.68Å; E336-R348 IonicContact OE2-NH1 3.27Å; E336-R348 PolarHBondContact OE2-NH1 2.76Å; L338-R348 HydrophobicContact CD1-CB 4.04Å; L338-R348 HydrophobicContact CD2-CB 4.26Å; L338-R348 HydrophobicContact CG-CB 4.16Å; R348-L416 HydrophobicContact CG-CD2 4.47Å
349	G	96.1	Very high	89.4	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.01	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	177.5	171.6	0	0	0	0	0	113.4	L332 A357 V358	L332-G349 CarbonylContact O-C 3.53Å; L332-G349 WeakPolarHBondContact O-CA 3.46Å; G349-A357 CarbonylContact O-C 3.46Å; G349-A357 WeakPolarHBondContact O-CA 3.45Å; G349-V358 PolarHBondContact N-O 3.39Å; G349-V358 PolarHBondContact O-N 3.33Å
350	L	96.5	Very high	89.9	Confident	47 Å²	47	52.3 Å²	52.3	25%	0.246	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	130.3	175.3	-179.9	72	0	0	0	109.8	F331 L332 F334	F331-L350 WeakPolarHBondContact CA-O 3.48Å; L332-L350 PolarHBondContact N-O 3.37Å; L332-L350 PolarHBondContact O-N 2.85Å; F334-L350 HydrophobicContact CE2-CB 3.63Å; F334-L350 HydrophobicContact CZ-CB 4.07Å; F334-L350 HydrophobicContact CZ-CD2 4.5Å
351	D	96.9	Very high	90.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	110.7	164.8	178.3	8.8	0	0	0	109.3	R330 F331 E353 T354 G355 V356 V358	R330-D351 VanDerWaalsContact CG-OD1 3.28Å; R330-D351 WeakPolarHBondContact CG-OD1 3.5Å; R330-D351 IonicContact CZ-OD1 3.44Å; R330-D351 IonicContact CZ-OD2 3.6Å; R330-D351 IonicContact NE-OD1 3.48Å; R330-D351 PolarHBondContact NE-OD1 3.18Å; R330-D351 IonicContact NE-OD2 3.31Å; R330-D351 PolarHBondContact NE-OD2 3.01Å; R330-D351 IonicContact NH2-OD1 3.28Å; R330-D351 IonicContact NH2-OD2 3.79Å; R330-D351 PolarHBondContact NH2-OD2 3.41Å; F331-D351 HydrophobicContact CD1-CB 3.87Å; F331-D351 HydrophobicContact CE1-CB 3.79Å; D351-E353 VanDerWaalsContact C-N 3.31Å; D351-E353 PolarHBondContact O-N 3.26Å; D351-E353 PolarHBondContact OD1-N 3.21Å; D351-E353 VanDerWaalsContact OD1-N 3.17Å; D351-T354 WeakPolarHBondContact CB-OG1 3.4Å; D351-T354 PolarHBondContact O-N 2.94Å; D351-T354 VanDerWaalsContact OD2-CG2 3.24Å; D351-T354 WeakPolarHBondContact OD2-CG2 3.27Å; D351-T354 PolarHBondContact OD2-OG1 3.22Å; D351-G355 WeakPolarHBondContact O-CA 3.33Å; D351-G355 PolarHBondContact O-N 3.29Å; D351-V356 PolarHBondContact N-O 2.86Å; D351-V358 HydrophobicContact CB-CG1 4Å
352	T	95	Very high	91	Very high	70 Å²	70	44.1 Å²	44.1	43%	0.429	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-21.4	-176.4	59.8	0	0	0	0	113.6	R330 L332	R330-T352 WeakPolarHBondContact CA-OG1 3.36Å; R330-T352 WeakPolarHBondContact O-CB 3.41Å; R330-T352 WeakPolarHBondContact O-CG2 3.44Å; R330-T352 PolarHBondContact O-N 2.94Å; R330-T352 PolarHBondContact O-OG1 2.81Å; L332-T352 HydrophobicContact CD1-CG2 3.67Å; L332-T352 HydrophobicContact CG-CG2 3.74Å
353	E	94.5	Very high	91.7	Very high	134 Å²	134	39.5 Å²	39.5	63%	0.626	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-34	176.1	-72.8	174.8	-164.6	0	0	111.9	R330 D351	R330-E353 VanDerWaalsContact CD-CD 3.44Å; R330-E353 WeakPolarHBondContact CD-OE1 3.46Å; R330-E353 HydrophobicContact CG-CG 4Å; R330-E353 IonicContact CZ-OE2 3.17Å; R330-E353 IonicContact NE-OE1 2.65Å; R330-E353 IonicContact NE-OE2 3.3Å; R330-E353 PolarHBondContact NE-OE2 3.41Å; R330-E353 IonicContact NH1-OE2 2.79Å; R330-E353 PolarHBondContact NH1-OE2 3.15Å; R330-E353 IonicContact NH2-OE2 2.69Å; D351-E353 VanDerWaalsContact C-N 3.31Å; D351-E353 PolarHBondContact O-N 3.26Å; D351-E353 PolarHBondContact OD1-N 3.21Å; D351-E353 VanDerWaalsContact OD1-N 3.17Å
354	T	94	Very high	91.9	Very high	78 Å²	78	38.5 Å²	38.5	48%	0.479	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-16.1	-174.9	63.9	0	0	0	0	114.2	D351 V356	D351-T354 WeakPolarHBondContact CB-OG1 3.4Å; D351-T354 PolarHBondContact O-N 2.94Å; D351-T354 VanDerWaalsContact OD2-CG2 3.24Å; D351-T354 WeakPolarHBondContact OD2-CG2 3.27Å; D351-T354 PolarHBondContact OD2-OG1 3.22Å; T354-V356 PolarHBondContact O-N 2.61Å; T354-V356 WeakPolarHBondContact OG1-CB 3.34Å; T354-V356 PolarHBondContact OG1-N 2.85Å
355	G	92.7	Very high	91.2	Very high	47 Å²	47	37.3 Å²	37.3	49%	0.485	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	15.2	-172.1	0	0	0	0	0	113.9	D351	D351-G355 WeakPolarHBondContact O-CA 3.33Å; D351-G355 PolarHBondContact O-N 3.29Å
356	V	94.4	Very high	89.8	Confident	71 Å²	71	40.5 Å²	40.5	43%	0.43	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	135.1	-176.3	179.4	0	0	0	0	110.4	D351 T354	D351-V356 PolarHBondContact N-O 2.86Å; T354-V356 PolarHBondContact O-N 2.61Å; T354-V356 WeakPolarHBondContact OG1-CB 3.34Å; T354-V356 PolarHBondContact OG1-N 2.85Å
357	A	95.8	Very high	88.3	Confident	37 Å²	37	45.8 Å²	45.8	31%	0.306	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	135.1	174	0	0	0	0	0	110.8	G349 L416	G349-A357 CarbonylContact O-C 3.46Å; G349-A357 WeakPolarHBondContact O-CA 3.45Å; A357-L416 HydrophobicContact CB-CD2 3.69Å; A357-L416 WeakPolarHBondContact O-CB 3.4Å
358	V	96.2	Very high	86.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	161.8	-176.9	-64.9	0	0	0	0	110.5	F331 G349 D351 Y395 V413 T414	F331-V358 HydrophobicContact CD1-CG2 4.24Å; G349-V358 PolarHBondContact N-O 3.39Å; G349-V358 PolarHBondContact O-N 3.33Å; D351-V358 HydrophobicContact CB-CG1 4Å; V358-Y395 HydrophobicContact CG1-CD2 4.03Å; V358-Y395 HydrophobicContact CG1-CE2 3.7Å; V358-V413 HydrophobicContact CB-CG1 3.75Å; V358-V413 HydrophobicContact CG1-CG1 4.18Å; V358-V413 HydrophobicContact CG2-CG1 3.66Å; V358-T414 WeakPolarHBondContact CA-O 3.39Å; V358-T414 WeakPolarHBondContact CB-O 3.45Å
359	A	95.8	Very high	85.4	Confident	8 Å²	8	47.4 Å²	47.4	7%	0.066	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	122.9	167.9	0	0	0	0	0	108.9	V346 V413 T414 L416	V346-A359 HydrophobicContact CG1-CB 3.98Å; A359-V413 WeakPolarHBondContact O-CA 3.25Å; A359-T414 PolarHBondContact N-O 3.4Å; A359-T414 PolarHBondContact O-N 3.27Å; A359-L416 HydrophobicContact CB-CD1 4.19Å
360	W	94.9	Very high	84.4	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	108.3	177	176	-69.2	0	0	0	108	D324 F331 K333 V346 F347 E362 W398 V411	D324-W360 HydrophobicContact CB-CH2 4.12Å; D324-W360 HydrophobicContact CB-CZ2 3.92Å; D324-W360 WeakPolarHBondContact OD2-CZ2 3.26Å; F331-W360 HydrophobicContact CB-CE3 4.33Å; F331-W360 HydrophobicContact CB-CZ3 4.15Å; K333-W360 HydrophobicContact CB-CD2 3.76Å; K333-W360 HydrophobicContact CB-CE3 3.92Å; K333-W360 HydrophobicContact CB-CG 4.25Å; K333-W360 HydrophobicContact CB-CH2 4.08Å; K333-W360 HydrophobicContact CB-CZ2 3.97Å; K333-W360 HydrophobicContact CB-CZ3 4.08Å; K333-W360 HydrophobicContact CD-CD2 4.42Å; K333-W360 HydrophobicContact CD-CG 4.49Å; K333-W360 HydrophobicContact CD-CZ2 4.19Å; K333-W360 HydrophobicContact CG-CD2 4.02Å; K333-W360 HydrophobicContact CG-CG 4.02Å; K333-W360 HydrophobicContact CG-CZ2 4.46Å; V346-W360 WeakPolarHBondContact CA-O 3.34Å; F347-W360 HydrophobicContact CB-CB 4.35Å; F347-W360 PolarHBondContact N-O 3.42Å; F347-W360 PolarHBondContact O-N 2.81Å; W360-E362 PolarHBondContact NE1-OE1 3.34Å; W360-W398 HydrophobicContact CE3-CH2 4.34Å; W360-W398 HydrophobicContact CE3-CZ2 4.35Å; W360-W398 HydrophobicContact CH2-CH2 4.27Å; W360-W398 AromaticContact CH2-CZ2 3.57Å; W360-W398 HydrophobicContact CH2-CZ2 3.57Å; W360-W398 HydrophobicContact CZ2-CZ2 4.02Å; W360-W398 AromaticContact CZ3-CH2 3.95Å; W360-W398 HydrophobicContact CZ3-CH2 3.95Å; 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 4.34Å; W360-V411 HydrophobicContact CG-CG1 4.11Å; W360-V411 HydrophobicContact CZ2-CG1 3.99Å; W360-V411 HydrophobicContact CZ2-CG2 4.08Å
361	C	92.1	Very high	83.1	Confident	16 Å²	16	57.4 Å²	57.4	11%	0.108	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	120.8	-172.9	-57.6	0	0	0	0	110.5	V346 V411 L412	V346-C361 HydrophobicContact CG2-CB 4.5Å; C361-V411 CarbonylContact O-C 3.59Å; C361-V411 VanDerWaalsContact O-CA 3.32Å; C361-V411 WeakPolarHBondContact O-CA 3.34Å; C361-L412 HydrophobicContact CB-CB 4.32Å; C361-L412 PolarHBondContact N-O 2.85Å; C361-L412 PolarHBondContact O-N 3.03Å
362	E	89.2	Confident	81.7	Confident	27 Å²	27	59.5 Å²	59.5	13%	0.126	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	122.3	-179.9	-62.4	-176.9	157.1	0	0	110.8	K333 K344 T345 F347 W360 Y409 I410 V411	K333-E362 WeakPolarHBondContact CE-OE1 3.36Å; K333-E362 IonicContact NZ-OE1 2.61Å; K333-E362 PolarHBondContact NZ-OE1 2.85Å; K333-E362 IonicContact NZ-OE2 3.39Å; K333-E362 PolarHBondContact NZ-OE2 2.94Å; K344-E362 WeakPolarHBondContact CA-O 3.33Å; T345-E362 PolarHBondContact N-O 2.9Å; T345-E362 PolarHBondContact O-N 3.48Å; F347-E362 HydrophobicContact CD2-CG 4.4Å; F347-E362 HydrophobicContact CE2-CG 4.45Å; F347-E362 WeakPolarHBondContact CE2-OE2 3.45Å; W360-E362 PolarHBondContact NE1-OE1 3.34Å; E362-Y409 HydrophobicContact CB-CD2 4.21Å; E362-Y409 HydrophobicContact CG-CD2 4.06Å; E362-Y409 HydrophobicContact CG-CE2 4.15Å; E362-Y409 WeakPolarHBondContact OE1-CE2 3.48Å; E362-I410 CarbonylContact C-O 3.59Å; E362-I410 WeakPolarHBondContact CA-O 3.39Å; E362-V411 HydrophobicContact CG-CG2 4.47Å
363	L	80.5	Confident	80.6	Confident	7 Å²	7	57.7 Å²	57.7	4%	0.037	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	129.9	178.1	-51	-173.4	0	0	0	111.2	F343 K344 E365 F376 Y409 I410 L412 L484 L487	F343-L363 WeakPolarHBondContact O-CA 3.42Å; K344-L363 HydrophobicContact CB-CD2 3.42Å; K344-L363 VanDerWaalsContact CB-CD2 3.42Å; L363-E365 PolarHBondContact O-N 3.36Å; L363-F376 HydrophobicContact CD1-CE2 4.15Å; L363-F376 HydrophobicContact CD1-CZ 4.42Å; L363-Y409 VanDerWaalsContact O-CA 3.25Å; L363-Y409 WeakPolarHBondContact O-CA 3.45Å; L363-Y409 WeakPolarHBondContact O-CB 3.36Å; L363-I410 HydrophobicContact CB-CB 4.35Å; L363-I410 PolarHBondContact N-O 3.07Å; L363-I410 PolarHBondContact O-N 2.72Å; L363-L412 HydrophobicContact CD1-CD1 3.48Å; L363-L412 VanDerWaalsContact CD1-CD1 3.48Å; L363-L412 HydrophobicContact CD2-CD1 4.35Å; L363-L412 HydrophobicContact CG-CD1 3.53Å; L363-L484 HydrophobicContact CD1-CD2 3.56Å; L363-L484 HydrophobicContact CD2-CD2 3.75Å; L363-L484 HydrophobicContact CG-CD2 4.33Å; L363-L487 HydrophobicContact CD1-CD1 3.7Å
364	Q	73.6	Confident	79.6	Confident	83 Å²	83	55 Å²	55	39%	0.388	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	106.9	-177.3	-62.2	-172	11.5	0	0	111.4	F343 S366	F343-Q364 PolarHBondContact O-N 2.87Å; Q364-S366 PolarHBondContact O-N 3.49Å; Q364-S366 VanDerWaalsContact O-N 3.09Å
365	E	66.6	Low	78.5	Confident	18 Å²	18	57.8 Å²	57.8	8%	0.084	30%	0.304	C	S	.	.			trans	-68.2	-12.1	-172.1	-158	-166.1	91.9	0	0	114.4	L363 K367 L368 R373 K408	L363-E365 PolarHBondContact O-N 3.36Å; E365-K367 PolarHBondContact O-N 2.91Å; E365-L368 HydrophobicContact CG-CB 4.33Å; E365-L368 PolarHBondContact O-N 2.88Å; E365-R373 IonicContact OE1-CZ 3.19Å; E365-R373 VanDerWaalsContact OE1-CZ 3.22Å; E365-R373 IonicContact OE1-NH1 3.85Å; E365-R373 PolarHBondContact OE1-NH1 2.92Å; E365-R373 IonicContact OE1-NH2 3.56Å; E365-R373 PolarHBondContact OE1-NH2 2.97Å; E365-R373 IonicContact OE2-CZ 2.69Å; E365-R373 IonicContact OE2-NH1 3.73Å; E365-R373 PolarHBondContact OE2-NH1 3.47Å; E365-R373 IonicContact OE2-NH2 3.54Å; E365-K408 HydrophobicContact CB-CB 4.19Å; E365-K408 WeakPolarHBondContact CB-O 3.49Å; E365-K408 HydrophobicContact CG-CB 4.41Å; E365-K408 PolarHBondContact N-O 3.47Å; E365-K408 VanDerWaalsContact OE1-CB 3.29Å; E365-K408 WeakPolarHBondContact OE1-CB 3.49Å; E365-K408 VanDerWaalsContact OE1-CD 3.29Å; E365-K408 WeakPolarHBondContact OE1-CD 3.37Å; E365-K408 VanDerWaalsContact OE2-CB 3.22Å; E365-K408 WeakPolarHBondContact OE2-CB 3.28Å
366	S	59	Low	77.6	Confident	81 Å²	81	55.6 Å²	55.6	57%	0.566	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	5	-169.7	60.8	0	0	0	0	117.9	Q364	Q364-S366 PolarHBondContact O-N 3.49Å; Q364-S366 VanDerWaalsContact O-N 3.09Å
367	K	59.1	Low	76.8	Confident	132 Å²	132	55.9 Å²	55.9	57%	0.574	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.7	5.5	175.4	-64.1	-178.8	178.5	178.9	0	113.7	F343 E365	F343-K367 HydrophobicContact CE1-CD 4.17Å; E365-K367 PolarHBondContact O-N 2.91Å
368	L	63.3	Low	75.8	Confident	33 Å²	33	58.9 Å²	58.9	17%	0.173	28%	0.283	C	S	.	.			trans	-102.5	118.1	-171.5	-87.7	161.3	0	0	0	113.6	E365 E372 I410 L487	E365-L368 HydrophobicContact CG-CB 4.33Å; E365-L368 PolarHBondContact O-N 2.88Å; L368-E372 HydrophobicContact CD2-CB 3.51Å; L368-E372 HydrophobicContact CD2-CG 4.44Å; L368-I410 HydrophobicContact CD1-CD1 4.48Å; L368-L487 HydrophobicContact CD1-CD2 4.01Å; L368-L487 HydrophobicContact CD2-CD2 3.69Å; L368-L487 HydrophobicContact CG-CD2 4.46Å
369	N	67.4	Low	74.9	Confident	105 Å²	105	61 Å²	61	56%	0.561	29%	0.292	S	S	*	.			trans	-73.3	161.6	177.4	-162.9	-3.8	0	0	0	111.8	T371 E372 R373	N369-T371 VanDerWaalsContact C-N 3.27Å; N369-T371 PolarHBondContact O-N 3.2Å; N369-E372 HydrophobicContact CB-CG 4.38Å; N369-E372 VanDerWaalsContact CB-OE2 3.25Å; N369-E372 WeakPolarHBondContact CB-OE2 3.27Å; N369-E372 PolarHBondContact N-OE2 3.32Å; N369-E372 PolarHBondContact O-N 3.22Å; N369-R373 WeakPolarHBondContact O-CB 3.47Å; N369-R373 PolarHBondContact O-N 2.94Å
370	K	74.6	Confident	74.1	Confident	170 Å²	170	60.6 Å²	60.6	74%	0.739	29%	0.289	S	S	*	.	H	α-helix	trans	-55	-40	-178.2	-172.4	-179.4	177.9	-174.5	0	112.5	Q374	K370-Q374 PolarHBondContact O-N 3.4Å; K370-Q374 VanDerWaalsContact O-N 3.14Å
371	T	70.6	Confident	73.5	Confident	89 Å²	89	65.1 Å²	65.1	55%	0.546	31%	0.31	S	S	.	.	H	α-helix	trans	-72.7	-42	179.3	-46.4	0	0	0	0	112.5	N369 R373 Q374 R375	N369-T371 VanDerWaalsContact C-N 3.27Å; N369-T371 PolarHBondContact O-N 3.2Å; T371-R373 VanDerWaalsContact C-N 3.33Å; T371-R373 PolarHBondContact O-N 3.48Å; T371-Q374 PolarHBondContact O-N 3.19Å; T371-R375 PolarHBondContact O-N 2.76Å; T371-R375 VanDerWaalsContact O-N 3.08Å
372	E	66.3	Low	72.9	Confident	43 Å²	43	68.3 Å²	68.3	20%	0.201	33%	0.325	C	S	.	.	H	α-helix	trans	-64	-40.8	176.8	-64	170.5	126	0	0	110.8	L368 N369 Q374 R375 F376 S491	L368-E372 HydrophobicContact CD2-CB 3.51Å; L368-E372 HydrophobicContact CD2-CG 4.44Å; N369-E372 HydrophobicContact CB-CG 4.38Å; N369-E372 VanDerWaalsContact CB-OE2 3.25Å; N369-E372 WeakPolarHBondContact CB-OE2 3.27Å; N369-E372 PolarHBondContact N-OE2 3.32Å; N369-E372 PolarHBondContact O-N 3.22Å; E372-Q374 VanDerWaalsContact C-N 3.35Å; E372-Q374 PolarHBondContact O-N 3.33Å; E372-R375 PolarHBondContact O-N 2.72Å; E372-F376 WeakPolarHBondContact O-CB 3.23Å; E372-F376 PolarHBondContact O-N 3Å; E372-S491 WeakPolarHBondContact OE1-CB 3.46Å; E372-S491 PolarHBondContact OE1-OG 3.5Å
373	R	72.1	Confident	72.6	Confident	33 Å²	33	67.8 Å²	67.8	13%	0.125	32%	0.323	C	S	.	.	H	α-helix	trans	-61.5	-38.8	173	-173.1	-156.9	-55.5	-106.8	-13.6	112.7	E365 N369 T371 F376 R377 E399	E365-R373 IonicContact OE1-CZ 3.19Å; E365-R373 VanDerWaalsContact OE1-CZ 3.22Å; E365-R373 IonicContact OE1-NH1 3.85Å; E365-R373 PolarHBondContact OE1-NH1 2.92Å; E365-R373 IonicContact OE1-NH2 3.56Å; E365-R373 PolarHBondContact OE1-NH2 2.97Å; E365-R373 IonicContact OE2-CZ 2.69Å; E365-R373 IonicContact OE2-NH1 3.73Å; E365-R373 PolarHBondContact OE2-NH1 3.47Å; E365-R373 IonicContact OE2-NH2 3.54Å; N369-R373 WeakPolarHBondContact O-CB 3.47Å; N369-R373 PolarHBondContact O-N 2.94Å; T371-R373 VanDerWaalsContact C-N 3.33Å; T371-R373 PolarHBondContact O-N 3.48Å; R373-F376 PolarHBondContact O-N 2.85Å; R373-R377 VanDerWaalsContact CD-NH1 3.29Å; R373-R377 WeakPolarHBondContact O-CG 3.33Å; R373-R377 PolarHBondContact O-N 2.75Å; R373-E399 WeakPolarHBondContact CD-OE2 3.4Å; R373-E399 IonicContact CZ-OE2 2.84Å; R373-E399 IonicContact NH1-OE2 3.29Å; R373-E399 PolarHBondContact NH1-OE2 2.87Å
374	Q	74.6	Confident	72.9	Confident	77 Å²	77	69.5 Å²	69.5	36%	0.36	33%	0.33	S	S	.	.	H	α-helix	trans	-65.3	-47.1	177.3	178.3	57.5	28.5	0	0	111.2	K370 T371 E372 F376 R377 E378	K370-Q374 PolarHBondContact O-N 3.4Å; K370-Q374 VanDerWaalsContact O-N 3.14Å; T371-Q374 PolarHBondContact O-N 3.19Å; E372-Q374 VanDerWaalsContact C-N 3.35Å; E372-Q374 PolarHBondContact O-N 3.33Å; Q374-F376 VanDerWaalsContact C-N 3.34Å; Q374-F376 PolarHBondContact O-N 2.97Å; Q374-R377 WeakPolarHBondContact O-CB 3.13Å; Q374-R377 PolarHBondContact O-N 2.79Å; Q374-R377 VanDerWaalsContact O-N 3.13Å; Q374-E378 WeakPolarHBondContact CG-OE1 3.47Å; Q374-E378 PolarHBondContact NE2-OE1 2.88Å; Q374-E378 PolarHBondContact O-N 3.47Å; Q374-E378 VanDerWaalsContact O-N 3.14Å
375	R	69.2	Low	73.4	Confident	136 Å²	136	71.8 Å²	71.8	51%	0.513	35%	0.345	S	S	.	.	H	α-helix	trans	-57.4	-47.5	173.7	-69.5	-179.9	177	-169.2	-3.5	111.4	T371 E372 R377 E378 E379	T371-R375 PolarHBondContact O-N 2.76Å; T371-R375 VanDerWaalsContact O-N 3.08Å; E372-R375 PolarHBondContact O-N 2.72Å; R375-R377 VanDerWaalsContact C-N 3.25Å; R375-R377 PolarHBondContact O-N 2.78Å; R375-E378 WeakPolarHBondContact O-CB 3.39Å; R375-E378 PolarHBondContact O-N 3.31Å; R375-E378 VanDerWaalsContact O-N 3.11Å; R375-E379 VanDerWaalsContact C-OE2 3.29Å; R375-E379 WeakPolarHBondContact O-CB 3.39Å; R375-E379 VanDerWaalsContact O-CD 3.31Å; R375-E379 WeakPolarHBondContact O-CG 3.14Å; R375-E379 PolarHBondContact O-N 2.83Å
376	F	74	Confident	74.4	Confident	2 Å²	2	71.4 Å²	71.4	1%	0.009	34%	0.343	C	S	.	.	H	α-helix	trans	-55.6	-39.4	176.6	178.1	-82.7	0	0	0	112.5	L363 E372 R373 Q374 E379 A380 Y397 I410 L412 G483 L487	L363-F376 HydrophobicContact CD1-CE2 4.15Å; L363-F376 HydrophobicContact CD1-CZ 4.42Å; E372-F376 WeakPolarHBondContact O-CB 3.23Å; E372-F376 PolarHBondContact O-N 3Å; R373-F376 PolarHBondContact O-N 2.85Å; Q374-F376 VanDerWaalsContact C-N 3.34Å; Q374-F376 PolarHBondContact O-N 2.97Å; F376-E379 WeakPolarHBondContact CA-OE2 3.46Å; F376-E379 PolarHBondContact N-OE2 3.06Å; F376-E379 PolarHBondContact O-N 3.34Å; F376-A380 HydrophobicContact CD1-CB 4.27Å; F376-A380 HydrophobicContact CE1-CB 3.69Å; F376-A380 HydrophobicContact CZ-CB 3.94Å; F376-A380 WeakPolarHBondContact O-CB 3.5Å; F376-A380 PolarHBondContact O-N 2.7Å; F376-Y397 HydrophobicContact CE1-CD2 4.13Å; F376-I410 HydrophobicContact CD1-CD1 3.73Å; F376-I410 HydrophobicContact CD1-CG2 4.35Å; F376-I410 HydrophobicContact CE1-CD1 3.9Å; F376-I410 HydrophobicContact CE1-CG2 3.52Å; F376-I410 HydrophobicContact CG-CD1 4.22Å; F376-I410 HydrophobicContact CZ-CD1 4.43Å; F376-I410 HydrophobicContact CZ-CG2 3.89Å; F376-L412 HydrophobicContact CE2-CD2 4.26Å; F376-L412 HydrophobicContact CZ-CD1 4.12Å; F376-L412 HydrophobicContact CZ-CD2 3.8Å; F376-L412 HydrophobicContact CZ-CG 4.06Å; F376-G483 WeakPolarHBondContact CE2-O 3.43Å; F376-L487 HydrophobicContact CB-CD2 4.11Å; F376-L487 HydrophobicContact CD2-CD1 3.88Å; F376-L487 HydrophobicContact CD2-CD2 3.59Å; F376-L487 HydrophobicContact CD2-CG 3.75Å; F376-L487 HydrophobicContact CE2-CD1 3.98Å; F376-L487 HydrophobicContact CE2-CD2 4.49Å; F376-L487 HydrophobicContact CE2-CG 4.3Å; F376-L487 HydrophobicContact CG-CD2 4.17Å
377	R	77.2	Confident	75.9	Confident	76 Å²	76	72.7 Å²	72.7	29%	0.287	34%	0.34	S	S	.	.	H	α-helix	trans	-66.2	-43.4	176.9	-75.8	-169.6	-67.7	-117.2	4.8	112.9	R373 Q374 R375 E379 E381 Y397 E399	R373-R377 VanDerWaalsContact CD-NH1 3.29Å; R373-R377 WeakPolarHBondContact O-CG 3.33Å; R373-R377 PolarHBondContact O-N 2.75Å; Q374-R377 WeakPolarHBondContact O-CB 3.13Å; Q374-R377 PolarHBondContact O-N 2.79Å; Q374-R377 VanDerWaalsContact O-N 3.13Å; R375-R377 VanDerWaalsContact C-N 3.25Å; R375-R377 PolarHBondContact O-N 2.78Å; R377-E379 VanDerWaalsContact C-N 3.33Å; R377-E381 WeakPolarHBondContact O-CB 3.15Å; R377-E381 PolarHBondContact O-N 3.12Å; R377-Y397 WeakPolarHBondContact CA-OH 3.28Å; R377-Y397 WeakPolarHBondContact CB-OH 3.25Å; R377-Y397 HydrophobicContact CG-CE2 4.02Å; R377-Y397 PolarHBondContact O-OH 2.93Å; R377-Y397 VanDerWaalsContact O-OH 3.11Å; R377-E399 WeakPolarHBondContact CD-OE1 3.32Å; R377-E399 IonicContact CZ-OE1 3.02Å; R377-E399 IonicContact NE-OE1 3.38Å; R377-E399 IonicContact NH1-OE1 3.64Å; R377-E399 PolarHBondContact NH1-OE1 2.72Å; R377-E399 IonicContact NH1-OE2 2.79Å
378	E	76.7	Confident	77.6	Confident	101 Å²	101	68.4 Å²	68.4	47%	0.472	32%	0.322	S	S	.	.	H	α-helix	trans	-61.4	-44.5	176.1	-68	157.5	-174	0	0	110.5	Q374 R375 E381 M382	Q374-E378 WeakPolarHBondContact CG-OE1 3.47Å; Q374-E378 PolarHBondContact NE2-OE1 2.88Å; Q374-E378 PolarHBondContact O-N 3.47Å; Q374-E378 VanDerWaalsContact O-N 3.14Å; R375-E378 WeakPolarHBondContact O-CB 3.39Å; R375-E378 PolarHBondContact O-N 3.31Å; R375-E378 VanDerWaalsContact O-N 3.11Å; E378-E381 PolarHBondContact O-N 2.74Å; E378-M382 WeakPolarHBondContact O-CG 3.39Å; E378-M382 PolarHBondContact O-N 2.68Å; E378-M382 VanDerWaalsContact O-N 3.09Å
379	E	75.9	Confident	79.1	Confident	43 Å²	43	71 Å²	71	20%	0.201	34%	0.341	C	S	.	.	H	α-helix	trans	-69	-46	180	-65.7	159.7	152.7	0	0	112.1	R375 F376 R377 E381 M382 L383 T486	R375-E379 VanDerWaalsContact C-OE2 3.29Å; R375-E379 WeakPolarHBondContact O-CB 3.39Å; R375-E379 VanDerWaalsContact O-CD 3.31Å; R375-E379 WeakPolarHBondContact O-CG 3.14Å; R375-E379 PolarHBondContact O-N 2.83Å; F376-E379 WeakPolarHBondContact CA-OE2 3.46Å; F376-E379 PolarHBondContact N-OE2 3.06Å; F376-E379 PolarHBondContact O-N 3.34Å; R377-E379 VanDerWaalsContact C-N 3.33Å; E379-E381 VanDerWaalsContact C-N 3.26Å; E379-E381 PolarHBondContact O-N 2.73Å; E379-M382 HydrophobicContact CB-CE 4.42Å; E379-M382 HydrophobicContact CG-CE 4.07Å; E379-M382 WeakPolarHBondContact O-CB 3.42Å; E379-M382 PolarHBondContact O-N 3.49Å; E379-M382 VanDerWaalsContact O-N 3.16Å; E379-L383 WeakPolarHBondContact O-CG 3.43Å; E379-L383 PolarHBondContact O-N 2.95Å; E379-T486 HydrophobicContact CB-CG2 4.16Å; E379-T486 HydrophobicContact CG-CG2 3.87Å; E379-T486 WeakPolarHBondContact OE1-CB 3.49Å; E379-T486 WeakPolarHBondContact OE1-CG2 3.39Å; E379-T486 WeakPolarHBondContact OE2-CB 3.23Å; E379-T486 WeakPolarHBondContact OE2-CG2 3.48Å; E379-T486 PolarHBondContact OE2-OG1 3.31Å
380	A	79.8	Confident	80.5	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.008	32%	0.317	C	S	.	.	H	α-helix	trans	-68.9	-22.4	178.1	0	0	0	0	0	113	F376 F394 Y397	F376-A380 HydrophobicContact CD1-CB 4.27Å; F376-A380 HydrophobicContact CE1-CB 3.69Å; F376-A380 HydrophobicContact CZ-CB 3.94Å; F376-A380 WeakPolarHBondContact O-CB 3.5Å; F376-A380 PolarHBondContact O-N 2.7Å; A380-F394 HydrophobicContact CB-CZ 4.38Å; A380-F394 WeakPolarHBondContact O-CE1 3.44Å; A380-Y397 VanDerWaalsContact C-CE1 3.5Å; A380-Y397 HydrophobicContact CB-CD1 3.34Å; A380-Y397 HydrophobicContact CB-CD2 4.1Å; A380-Y397 HydrophobicContact CB-CE1 3.56Å; A380-Y397 HydrophobicContact CB-CE2 4.32Å; A380-Y397 HydrophobicContact CB-CG 3.64Å; A380-Y397 WeakPolarHBondContact O-CD1 3.37Å
381	E	82	Confident	81.5	Confident	94 Å²	94	58.6 Å²	58.6	44%	0.439	28%	0.283	S	S	.	.	H	α-helix	trans	-72.3	-48.1	167.1	-155.1	66.4	-151.4	0	0	110.6	R377 E378 E379 L383 K384 Y397	R377-E381 WeakPolarHBondContact O-CB 3.15Å; R377-E381 PolarHBondContact O-N 3.12Å; E378-E381 PolarHBondContact O-N 2.74Å; E379-E381 VanDerWaalsContact C-N 3.26Å; E379-E381 PolarHBondContact O-N 2.73Å; E381-L383 PolarHBondContact O-N 3.11Å; E381-L383 VanDerWaalsContact O-N 3.16Å; E381-K384 WeakPolarHBondContact O-CB 3.47Å; E381-K384 PolarHBondContact O-N 2.81Å; E381-K384 WeakPolarHBondContact OE1-CD 3.45Å; E381-K384 IonicContact OE1-NZ 3.43Å; E381-K384 PolarHBondContact OE1-NZ 3.35Å; E381-K384 IonicContact OE2-NZ 3.85Å; E381-K384 PolarHBondContact OE2-NZ 3.02Å; E381-Y397 HydrophobicContact CB-CE1 4.38Å; E381-Y397 VanDerWaalsContact OE2-CE1 3.23Å; E381-Y397 WeakPolarHBondContact OE2-CE1 3.48Å
382	M	79	Confident	82.6	Confident	84 Å²	84	55.1 Å²	55.1	41%	0.414	26%	0.262	S	S	.	.	H	α-helix	trans	-56.2	-31.6	174.3	-71.3	-170.2	-68.6	0	0	113.1	E378 E379 K384 P456	E378-M382 WeakPolarHBondContact O-CG 3.39Å; E378-M382 PolarHBondContact O-N 2.68Å; E378-M382 VanDerWaalsContact O-N 3.09Å; E379-M382 HydrophobicContact CB-CE 4.42Å; E379-M382 HydrophobicContact CG-CE 4.07Å; E379-M382 WeakPolarHBondContact O-CB 3.42Å; E379-M382 PolarHBondContact O-N 3.49Å; E379-M382 VanDerWaalsContact O-N 3.16Å; M382-K384 VanDerWaalsContact C-N 3.34Å; M382-K384 PolarHBondContact O-N 3.31Å; M382-P456 HydrophobicContact SD-CG 4.03Å
383	L	83.9	Confident	83.9	Confident	16 Å²	16	57.1 Å²	57.1	8%	0.084	27%	0.267	C	S	.	.	H	α-helix	trans	-68.3	-26.3	178.2	-69.9	177.8	0	0	0	113.8	E379 E381 D385 L386 F394 L482 G483	E379-L383 WeakPolarHBondContact O-CG 3.43Å; E379-L383 PolarHBondContact O-N 2.95Å; E381-L383 PolarHBondContact O-N 3.11Å; E381-L383 VanDerWaalsContact O-N 3.16Å; L383-D385 VanDerWaalsContact C-N 3.28Å; L383-D385 PolarHBondContact O-N 2.86Å; L383-L386 HydrophobicContact CD2-CD1 3.49Å; L383-L386 VanDerWaalsContact CD2-CD1 3.49Å; L383-L386 HydrophobicContact CD2-CG 4.41Å; L383-L386 WeakPolarHBondContact O-CB 3.42Å; L383-L386 PolarHBondContact O-N 3.11Å; L383-F394 HydrophobicContact CB-CB 4.34Å; L383-F394 HydrophobicContact CB-CD1 3.89Å; L383-F394 HydrophobicContact CB-CD2 4.25Å; L383-F394 HydrophobicContact CB-CE1 4.2Å; L383-F394 HydrophobicContact CB-CG 3.92Å; L383-F394 HydrophobicContact CD1-CE2 4.38Å; L383-F394 WeakPolarHBondContact O-CB 3.37Å; L383-L482 HydrophobicContact CD1-CB 4.43Å; L383-L482 HydrophobicContact CD2-CB 3.84Å; L383-L482 HydrophobicContact CD2-CD1 4.25Å; L383-G483 VanDerWaalsContact CD1-CA 3.42Å
384	K	86.4	Confident	84.9	Confident	42 Å²	42	56.2 Å²	56.2	18%	0.183	26%	0.264	C	S	.	.	H	α-helix	trans	-62.5	-34	179	-69.5	168.4	171.8	170.9	0	112.9	E381 M382 L386 F394 D396	E381-K384 WeakPolarHBondContact O-CB 3.47Å; E381-K384 PolarHBondContact O-N 2.81Å; E381-K384 WeakPolarHBondContact OE1-CD 3.45Å; E381-K384 IonicContact OE1-NZ 3.43Å; E381-K384 PolarHBondContact OE1-NZ 3.35Å; E381-K384 IonicContact OE2-NZ 3.85Å; E381-K384 PolarHBondContact OE2-NZ 3.02Å; M382-K384 VanDerWaalsContact C-N 3.34Å; M382-K384 PolarHBondContact O-N 3.31Å; K384-L386 VanDerWaalsContact C-N 3.3Å; K384-L386 PolarHBondContact O-N 3.36Å; K384-F394 HydrophobicContact CG-CD1 3.82Å; K384-F394 HydrophobicContact CG-CE1 4.13Å; K384-D396 WeakPolarHBondContact CE-OD1 3.43Å; K384-D396 IonicContact NZ-OD1 2.98Å; K384-D396 PolarHBondContact NZ-OD1 3.08Å
385	D	83.5	Confident	85.7	Confident	131 Å²	131	55.2 Å²	55.2	70%	0.701	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-7	-179.7	-72.9	-28.9	0	0	0	113.5	L383 Q387	L383-D385 VanDerWaalsContact C-N 3.28Å; L383-D385 PolarHBondContact O-N 2.86Å; D385-Q387 PolarHBondContact O-N 3.4Å
386	L	87.4	Confident	86.8	Confident	10 Å²	10	50.3 Å²	50.3	5%	0.052	24%	0.241	C	C	.	.			trans	-76.9	92.2	-179.9	-61.1	-168.3	0	0	0	112.3	L383 K384 F450 L451 R454 L482	L383-L386 HydrophobicContact CD2-CD1 3.49Å; L383-L386 VanDerWaalsContact CD2-CD1 3.49Å; L383-L386 HydrophobicContact CD2-CG 4.41Å; L383-L386 WeakPolarHBondContact O-CB 3.42Å; L383-L386 PolarHBondContact O-N 3.11Å; K384-L386 VanDerWaalsContact C-N 3.3Å; K384-L386 PolarHBondContact O-N 3.36Å; L386-F450 HydrophobicContact CB-CE1 4.13Å; L386-F450 HydrophobicContact CD2-CE1 3.96Å; L386-F450 HydrophobicContact CD2-CZ 4.33Å; L386-L451 HydrophobicContact CD1-CD2 3.74Å; L386-R454 HydrophobicContact CD2-CG 3.76Å; L386-L482 HydrophobicContact CD1-CD1 4.01Å
387	Q	91.7	Very high	87.5	Confident	109 Å²	109	51.8 Å²	51.8	51%	0.509	25%	0.247	S	C	.	.			trans	-116.4	102.7	179.1	-55.4	-171.8	42.2	0	0	111.1	D385 R393	D385-Q387 PolarHBondContact O-N 3.4Å; Q387-R393 VanDerWaalsContact NE2-NH2 3.17Å
388	H	94.5	Very high	88.1	Confident	41 Å²	41	48.9 Å²	48.9	19%	0.19	24%	0.236	C	C	.	.			trans	-148.3	139.8	178.2	-179.4	-101	0	0	0	110.7	N390 I391 K446 F450	H388-N390 PolarHBondContact ND1-N 2.94Å; H388-N390 PolarHBondContact O-N 3.23Å; H388-N390 VanDerWaalsContact O-N 3.07Å; H388-I391 HydrophobicContact CB-CB 4.26Å; H388-I391 HydrophobicContact CB-CG1 3.86Å; H388-I391 PolarHBondContact O-N 3.4Å; H388-K446 PolarHBondContact CE1-O 3.29Å; H388-F450 HydrophobicContact CB-CB 4.33Å; H388-F450 HydrophobicContact CB-CD1 3.58Å; H388-F450 HydrophobicContact CB-CD2 3.87Å; H388-F450 HydrophobicContact CB-CE1 3.73Å; H388-F450 HydrophobicContact CB-CE2 4Å; H388-F450 HydrophobicContact CB-CG 3.65Å; H388-F450 HydrophobicContact CB-CZ 3.94Å; H388-F450 AromaticContact CD2-CD2 3.83Å; H388-F450 AromaticContact CD2-CG 3.82Å; H388-F450 AromaticContact CG-CG 3.69Å
389	P	95.2	Very high	88.6	Confident	88 Å²	88	46.1 Å²	46.1	57%	0.571	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-24.3	-175.4	21.4	-35.5	0	0	0	115	K478	P389-K478 WeakPolarHBondContact O-CE 3.44Å; P389-K478 WeakPolarHBondContact O-CG 3.43Å
390	N	96.8	Very high	89	Confident	11 Å²	11	45.2 Å²	45.2	6%	0.059	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	18.5	177.6	-55.1	116.6	0	0	0	114	H388 Q443 V477 K478 I479	H388-N390 PolarHBondContact ND1-N 2.94Å; H388-N390 PolarHBondContact O-N 3.23Å; H388-N390 VanDerWaalsContact O-N 3.07Å; N390-Q443 VanDerWaalsContact CB-O 3.29Å; N390-Q443 WeakPolarHBondContact CB-O 3.35Å; N390-Q443 WeakPolarHBondContact ND2-CB 3.36Å; N390-Q443 WeakPolarHBondContact ND2-CG 3.44Å; N390-Q443 PolarHBondContact ND2-OE1 3.46Å; N390-V477 WeakPolarHBondContact CA-O 3.28Å; N390-V477 WeakPolarHBondContact CB-O 3.32Å; N390-V477 PolarHBondContact ND2-O 3.34Å; N390-K478 WeakPolarHBondContact O-CA 3.24Å; N390-I479 PolarHBondContact O-N 3.05Å
391	I	94.9	Very high	88.9	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.015	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-115.5	145.7	167.1	-57.8	-61	0	0	0	108	H388 F450 L451 K478 I479 L482	H388-I391 HydrophobicContact CB-CB 4.26Å; H388-I391 HydrophobicContact CB-CG1 3.86Å; H388-I391 PolarHBondContact O-N 3.4Å; I391-F450 HydrophobicContact CG1-CD1 4.06Å; I391-F450 HydrophobicContact CG1-CE1 4.49Å; I391-L451 HydrophobicContact CD1-CD1 3.81Å; I391-L451 HydrophobicContact CD1-CD2 4.06Å; I391-L451 HydrophobicContact CD1-CG 3.9Å; I391-L451 HydrophobicContact CG1-CD2 4.46Å; I391-K478 PolarHBondContact O-NZ 3.04Å; I391-I479 CarbonylContact C-O 3.58Å; I391-I479 WeakPolarHBondContact CA-O 3.3Å; I391-I479 HydrophobicContact CD1-CB 3.99Å; I391-I479 HydrophobicContact CD1-CD1 4.27Å; I391-I479 HydrophobicContact CD1-CG1 4.43Å; I391-L482 HydrophobicContact CG2-CD1 3.77Å
392	V	94.6	Very high	88.4	Confident	17 Å²	17	45.9 Å²	45.9	10%	0.103	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-72	122.3	169.6	177	0	0	0	0	107.7	F394 E415 M417 F469 K478 I479	V392-F394 PolarHBondContact O-N 2.85Å; V392-E415 HydrophobicContact CG1-CB 3.95Å; V392-M417 HydrophobicContact CG1-CG 4.23Å; V392-M417 HydrophobicContact CG2-CG 3.9Å; V392-M417 HydrophobicContact CG2-SD 4.22Å; V392-F469 HydrophobicContact CG2-CD2 3.79Å; V392-F469 HydrophobicContact CG2-CE2 4.43Å; V392-F469 HydrophobicContact CG2-CG 4.39Å; V392-K478 HydrophobicContact CG2-CB 3.75Å; V392-I479 PolarHBondContact N-O 2.69Å
393	R	93.4	Very high	87.7	Confident	84 Å²	84	51.3 Å²	51.3	32%	0.317	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-65.1	129.5	-175.1	176.6	173.7	-173.8	110.8	22	111.2	Q387 Y395 T414 E415	Q387-R393 VanDerWaalsContact NE2-NH2 3.17Å; R393-Y395 HydrophobicContact CG-CD1 4.35Å; R393-Y395 HydrophobicContact CG-CE1 4.18Å; R393-T414 CarbonylContact O-C 3.59Å; R393-T414 VanDerWaalsContact O-CA 3.26Å; R393-T414 WeakPolarHBondContact O-CA 3.26Å; R393-T414 WeakPolarHBondContact O-CB 3.38Å; R393-E415 HydrophobicContact CB-CB 4.09Å; R393-E415 PolarHBondContact N-OE2 3.32Å; R393-E415 PolarHBondContact O-N 2.84Å
394	F	91.7	Very high	86.8	Confident	15 Å²	15	54.6 Å²	54.6	7%	0.066	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	138.9	162.7	-153.7	-105.1	0	0	0	109.5	A380 L383 K384 V392 Y397 L412 T414	A380-F394 HydrophobicContact CB-CZ 4.38Å; A380-F394 WeakPolarHBondContact O-CE1 3.44Å; L383-F394 HydrophobicContact CB-CB 4.34Å; L383-F394 HydrophobicContact CB-CD1 3.89Å; L383-F394 HydrophobicContact CB-CD2 4.25Å; L383-F394 HydrophobicContact CB-CE1 4.2Å; L383-F394 HydrophobicContact CB-CG 3.92Å; L383-F394 HydrophobicContact CD1-CE2 4.38Å; L383-F394 WeakPolarHBondContact O-CB 3.37Å; K384-F394 HydrophobicContact CG-CD1 3.82Å; K384-F394 HydrophobicContact CG-CE1 4.13Å; V392-F394 PolarHBondContact O-N 2.85Å; F394-Y397 HydrophobicContact CE1-CD1 4.32Å; F394-L412 HydrophobicContact CE2-CB 3.93Å; F394-L412 HydrophobicContact CE2-CD2 3.75Å; F394-L412 HydrophobicContact CE2-CG 4.28Å; F394-L412 HydrophobicContact CZ-CB 4.06Å; F394-L412 HydrophobicContact CZ-CD2 3.95Å; F394-L412 HydrophobicContact CZ-CG 4.2Å; F394-T414 HydrophobicContact CD2-CG2 3.81Å; F394-T414 HydrophobicContact CE2-CG2 4.22Å
395	Y	92.6	Very high	85.9	Confident	56 Å²	56	55.1 Å²	55.1	22%	0.22	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	-55.3	177.3	-67.8	-74.8	0	0	0	112.1	F331 V358 R393 V413 E415	F331-Y395 HydrophobicContact CZ-CG 4.49Å; V358-Y395 HydrophobicContact CG1-CD2 4.03Å; V358-Y395 HydrophobicContact CG1-CE2 3.7Å; R393-Y395 HydrophobicContact CG-CD1 4.35Å; R393-Y395 HydrophobicContact CG-CE1 4.18Å; Y395-V413 HydrophobicContact CD2-CG1 4.16Å; Y395-V413 PolarHBondContact N-O 3.07Å; Y395-E415 HydrophobicContact CE2-CB 4.29Å
396	D	91.5	Very high	85.1	Confident	32 Å²	32	55.5 Å²	55.5	17%	0.171	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	167.6	-175.5	-157.8	5.2	0	0	0	111.2	F331 K384 W398 V413	F331-D396 HydrophobicContact CE2-CB 3.73Å; F331-D396 HydrophobicContact CZ-CB 4.39Å; K384-D396 WeakPolarHBondContact CE-OD1 3.43Å; K384-D396 IonicContact NZ-OD1 2.98Å; K384-D396 PolarHBondContact NZ-OD1 3.08Å; D396-W398 HydrophobicContact CB-CZ3 4.29Å; D396-V413 PolarHBondContact O-N 3.45Å
397	Y	89.5	Confident	84.3	Confident	33 Å²	33	60.9 Å²	60.9	13%	0.129	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	156.4	170.8	85.4	-90.1	0	0	0	111.5	F376 R377 A380 E381 F394 I410 V411	F376-Y397 HydrophobicContact CE1-CD2 4.13Å; R377-Y397 WeakPolarHBondContact CA-OH 3.28Å; R377-Y397 WeakPolarHBondContact CB-OH 3.25Å; R377-Y397 HydrophobicContact CG-CE2 4.02Å; R377-Y397 PolarHBondContact O-OH 2.93Å; R377-Y397 VanDerWaalsContact O-OH 3.11Å; A380-Y397 VanDerWaalsContact C-CE1 3.5Å; A380-Y397 HydrophobicContact CB-CD1 3.34Å; A380-Y397 HydrophobicContact CB-CD2 4.1Å; A380-Y397 HydrophobicContact CB-CE1 3.56Å; A380-Y397 HydrophobicContact CB-CE2 4.32Å; A380-Y397 HydrophobicContact CB-CG 3.64Å; A380-Y397 WeakPolarHBondContact O-CD1 3.37Å; E381-Y397 HydrophobicContact CB-CE1 4.38Å; E381-Y397 VanDerWaalsContact OE2-CE1 3.23Å; E381-Y397 WeakPolarHBondContact OE2-CE1 3.48Å; F394-Y397 HydrophobicContact CE1-CD1 4.32Å; Y397-I410 HydrophobicContact CD2-CG2 4.48Å; Y397-V411 CarbonylContact C-O 3.24Å; Y397-V411 WeakPolarHBondContact CA-O 3.3Å; Y397-V411 WeakPolarHBondContact CB-O 3.16Å
398	W	89.4	Confident	83.6	Confident	15 Å²	15	60.7 Å²	60.7	6%	0.057	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	153.9	167.6	58.3	86.9	0	0	0	112.9	K327 F331 W360 D396 S400 V411 V413	K327-W398 HydrophobicContact CD-CB 4.16Å; K327-W398 HydrophobicContact CD-CG 4.26Å; K327-W398 HydrophobicContact CG-CG 4.31Å; F331-W398 HydrophobicContact CB-CH2 4.41Å; F331-W398 HydrophobicContact CD2-CH2 4.1Å; F331-W398 AromaticContact CD2-CZ3 3.97Å; F331-W398 HydrophobicContact CD2-CZ3 3.97Å; W360-W398 HydrophobicContact CE3-CH2 4.34Å; W360-W398 HydrophobicContact CE3-CZ2 4.35Å; W360-W398 HydrophobicContact CH2-CH2 4.27Å; W360-W398 AromaticContact CH2-CZ2 3.57Å; W360-W398 HydrophobicContact CH2-CZ2 3.57Å; W360-W398 HydrophobicContact CZ2-CZ2 4.02Å; W360-W398 AromaticContact CZ3-CH2 3.95Å; W360-W398 HydrophobicContact CZ3-CH2 3.95Å; W360-W398 AromaticContact CZ3-CZ2 3.74Å; W360-W398 HydrophobicContact CZ3-CZ2 3.74Å; D396-W398 HydrophobicContact CB-CZ3 4.29Å; W398-S400 VanDerWaalsContact CD1-OG 3.27Å; W398-S400 PolarHBondContact NE1-OG 3.32Å; W398-S400 VanDerWaalsContact NE1-OG 3.15Å; W398-V411 HydrophobicContact CD2-CB 4.18Å; W398-V411 HydrophobicContact CH2-CB 4.35Å; W398-V411 HydrophobicContact CH2-CG1 3.79Å; W398-V411 HydrophobicContact CZ2-CB 3.72Å; W398-V411 HydrophobicContact CZ2-CG1 3.45Å; W398-V411 VanDerWaalsContact CZ2-CG1 3.45Å; W398-V411 HydrophobicContact CZ2-CG2 4.13Å; W398-V411 PolarHBondContact N-O 3.43Å; W398-V411 PolarHBondContact O-N 3.31Å; W398-V413 HydrophobicContact CH2-CG2 3.45Å; W398-V413 VanDerWaalsContact CH2-CG2 3.45Å; W398-V413 HydrophobicContact CZ3-CG2 3.66Å
399	E	86.1	Confident	83.1	Confident	44 Å²	44	60.1 Å²	60.1	21%	0.206	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	126.2	164.3	-72.4	171.4	-121.2	0	0	110.3	K327 R373 R377 I410	K327-E399 WeakPolarHBondContact CE-O 3.47Å; K327-E399 PolarHBondContact NZ-O 2.97Å; R373-E399 WeakPolarHBondContact CD-OE2 3.4Å; R373-E399 IonicContact CZ-OE2 2.84Å; R373-E399 IonicContact NH1-OE2 3.29Å; R373-E399 PolarHBondContact NH1-OE2 2.87Å; R377-E399 WeakPolarHBondContact CD-OE1 3.32Å; R377-E399 IonicContact CZ-OE1 3.02Å; R377-E399 IonicContact NE-OE1 3.38Å; R377-E399 IonicContact NH1-OE1 3.64Å; R377-E399 PolarHBondContact NH1-OE1 2.72Å; R377-E399 IonicContact NH1-OE2 2.79Å; E399-I410 HydrophobicContact CG-CG1 4.29Å
400	S	84.5	Confident	82.6	Confident	23 Å²	23	56 Å²	56	16%	0.161	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	170.2	170.7	-87.2	0	0	0	0	110.8	W398 K408 Y409	W398-S400 VanDerWaalsContact CD1-OG 3.27Å; W398-S400 PolarHBondContact NE1-OG 3.32Å; W398-S400 VanDerWaalsContact NE1-OG 3.15Å; S400-K408 WeakPolarHBondContact O-CA 3.39Å; S400-Y409 VanDerWaalsContact CB-CE2 3.49Å; S400-Y409 PolarHBondContact N-O 3.46Å; S400-Y409 PolarHBondContact O-N 3.02Å; S400-Y409 VanDerWaalsContact O-O 3.07Å
401	A	78.1	Confident	82.2	Confident	48 Å²	48	55.5 Å²	55.5	40%	0.397	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	146.9	168.4	0	0	0	0	0	109.8	R407 K408	A401-R407 WeakPolarHBondContact CA-O 3.48Å; A401-K408 HydrophobicContact CB-CG 4.19Å
402	D	72.6	Confident	82	Confident	62 Å²	62	55.8 Å²	55.8	33%	0.332	29%	0.286	S	S	.	.			trans	-56.1	156.1	176.6	-62.3	3.3	0	0	0	109.8	C404 G405 R407 Y409	D402-C404 PolarHBondContact O-N 2.89Å; D402-G405 PolarHBondContact O-N 3.14Å; D402-R407 PolarHBondContact N-O 2.8Å; D402-R407 WeakPolarHBondContact OD2-CB 3.36Å; D402-Y409 VanDerWaalsContact OD1-CD1 3.27Å; D402-Y409 WeakPolarHBondContact OD1-CD1 3.42Å; D402-Y409 WeakPolarHBondContact OD1-CE1 3.08Å
403	L	64.3	Low	82	Confident	198 Å²	198	55 Å²	55	100%	1.037	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-20.1	-179.7	-66.1	170.5	0	0	0	114.6
404	C	64	Low	82	Confident	85 Å²	85	52.3 Å²	52.3	57%	0.574	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	0.4	177.4	-158.3	0	0	0	0	113.8	D402 K406	D402-C404 PolarHBondContact O-N 2.89Å; C404-K406 PolarHBondContact O-N 2.84Å; C404-K406 WeakPolarHBondContact SG-CE 3.34Å; C404-K406 PolarHBondContact SG-NZ 2.72Å; C404-K406 VanDerWaalsContact SG-NZ 3.37Å
405	G	66.8	Low	82.1	Confident	52 Å²	52	53.8 Å²	53.8	54%	0.536	28%	0.281	S	S	.	.	S	Bend	trans	69.8	-15.7	179.8	0	0	0	0	0	116.7	D402 R407	D402-G405 PolarHBondContact O-N 3.14Å; G405-R407 PolarHBondContact O-N 3.15Å
406	K	68	Low	82.2	Confident	140 Å²	140	52.9 Å²	52.9	61%	0.609	28%	0.28	S	S	*	.	S	Bend	trans	-69.7	-27.5	-170.6	-68.5	169.4	-167.6	170.4	0	115.1	C404 Q1648	C404-K406 PolarHBondContact O-N 2.84Å; C404-K406 WeakPolarHBondContact SG-CE 3.34Å; C404-K406 PolarHBondContact SG-NZ 2.72Å; C404-K406 VanDerWaalsContact SG-NZ 3.37Å; K406-Q1648 VanDerWaalsContact CE-OE1 3.24Å
407	R	70.5	Confident	82.4	Confident	122 Å²	122	52.5 Å²	52.5	46%	0.46	28%	0.277	S	S	.	.			trans	-126.4	137.8	178	164.5	-179.6	-74.7	165.4	-4.6	108.8	A401 D402 G405	A401-R407 WeakPolarHBondContact CA-O 3.48Å; D402-R407 PolarHBondContact N-O 2.8Å; D402-R407 WeakPolarHBondContact OD2-CB 3.36Å; G405-R407 PolarHBondContact O-N 3.15Å
408	K	77.1	Confident	82.4	Confident	105 Å²	105	56.6 Å²	56.6	46%	0.457	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	154.1	170.7	-65.1	175.1	177.9	-178.8	0	109.8	E365 S400 A401	E365-K408 HydrophobicContact CB-CB 4.19Å; E365-K408 WeakPolarHBondContact CB-O 3.49Å; E365-K408 HydrophobicContact CG-CB 4.41Å; E365-K408 PolarHBondContact N-O 3.47Å; E365-K408 VanDerWaalsContact OE1-CB 3.29Å; E365-K408 WeakPolarHBondContact OE1-CB 3.49Å; E365-K408 VanDerWaalsContact OE1-CD 3.29Å; E365-K408 WeakPolarHBondContact OE1-CD 3.37Å; E365-K408 VanDerWaalsContact OE2-CB 3.22Å; E365-K408 WeakPolarHBondContact OE2-CB 3.28Å; S400-K408 WeakPolarHBondContact O-CA 3.39Å; A401-K408 HydrophobicContact CB-CG 4.19Å
409	Y	82.6	Confident	82.5	Confident	30 Å²	30	58.5 Å²	58.5	12%	0.118	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	155.8	175.2	59.7	-83.2	0	0	0	109.6	D324 E362 L363 S400 D402 V411	D324-Y409 PolarHBondContact OD2-OH 2.95Å; E362-Y409 HydrophobicContact CB-CD2 4.21Å; E362-Y409 HydrophobicContact CG-CD2 4.06Å; E362-Y409 HydrophobicContact CG-CE2 4.15Å; E362-Y409 WeakPolarHBondContact OE1-CE2 3.48Å; L363-Y409 VanDerWaalsContact O-CA 3.25Å; L363-Y409 WeakPolarHBondContact O-CA 3.45Å; L363-Y409 WeakPolarHBondContact O-CB 3.36Å; S400-Y409 VanDerWaalsContact CB-CE2 3.49Å; S400-Y409 PolarHBondContact N-O 3.46Å; S400-Y409 PolarHBondContact O-N 3.02Å; S400-Y409 VanDerWaalsContact O-O 3.07Å; D402-Y409 VanDerWaalsContact OD1-CD1 3.27Å; D402-Y409 WeakPolarHBondContact OD1-CD1 3.42Å; D402-Y409 WeakPolarHBondContact OD1-CE1 3.08Å; Y409-V411 HydrophobicContact CD2-CG2 3.75Å; Y409-V411 HydrophobicContact CE2-CG2 3.51Å
410	I	84.5	Confident	82.8	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	127.1	175.3	-49	-175.8	0	0	0	108.3	E362 L363 L368 F376 Y397 E399 L412	E362-I410 CarbonylContact C-O 3.59Å; E362-I410 WeakPolarHBondContact CA-O 3.39Å; L363-I410 HydrophobicContact CB-CB 4.35Å; L363-I410 PolarHBondContact N-O 3.07Å; L363-I410 PolarHBondContact O-N 2.72Å; L368-I410 HydrophobicContact CD1-CD1 4.48Å; F376-I410 HydrophobicContact CD1-CD1 3.73Å; F376-I410 HydrophobicContact CD1-CG2 4.35Å; F376-I410 HydrophobicContact CE1-CD1 3.9Å; F376-I410 HydrophobicContact CE1-CG2 3.52Å; F376-I410 HydrophobicContact CG-CD1 4.22Å; F376-I410 HydrophobicContact CZ-CD1 4.43Å; F376-I410 HydrophobicContact CZ-CG2 3.89Å; Y397-I410 HydrophobicContact CD2-CG2 4.48Å; E399-I410 HydrophobicContact CG-CG1 4.29Å; I410-L412 HydrophobicContact CG2-CD1 4.2Å
411	V	90.2	Very high	83.3	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	135.1	171.2	-172.4	0	0	0	0	109.3	W360 C361 E362 Y397 W398 Y409 V413	W360-V411 HydrophobicContact CD2-CG1 3.76Å; W360-V411 HydrophobicContact CE3-CG1 4.34Å; W360-V411 HydrophobicContact CG-CG1 4.11Å; W360-V411 HydrophobicContact CZ2-CG1 3.99Å; W360-V411 HydrophobicContact CZ2-CG2 4.08Å; C361-V411 CarbonylContact O-C 3.59Å; C361-V411 VanDerWaalsContact O-CA 3.32Å; C361-V411 WeakPolarHBondContact O-CA 3.34Å; E362-V411 HydrophobicContact CG-CG2 4.47Å; Y397-V411 CarbonylContact C-O 3.24Å; Y397-V411 WeakPolarHBondContact CA-O 3.3Å; Y397-V411 WeakPolarHBondContact CB-O 3.16Å; W398-V411 HydrophobicContact CD2-CB 4.18Å; W398-V411 HydrophobicContact CH2-CB 4.35Å; W398-V411 HydrophobicContact CH2-CG1 3.79Å; W398-V411 HydrophobicContact CZ2-CB 3.72Å; W398-V411 HydrophobicContact CZ2-CG1 3.45Å; W398-V411 VanDerWaalsContact CZ2-CG1 3.45Å; W398-V411 HydrophobicContact CZ2-CG2 4.13Å; W398-V411 PolarHBondContact N-O 3.43Å; W398-V411 PolarHBondContact O-N 3.31Å; Y409-V411 HydrophobicContact CD2-CG2 3.75Å; Y409-V411 HydrophobicContact CE2-CG2 3.51Å; V411-V413 HydrophobicContact CG1-CG2 4.32Å
412	L	90	Very high	84	Confident	9 Å²	9	54.9 Å²	54.9	5%	0.047	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	136.5	169.7	-54.2	80.4	0	0	0	107.8	C361 L363 F376 F394 I410	C361-L412 HydrophobicContact CB-CB 4.32Å; C361-L412 PolarHBondContact N-O 2.85Å; C361-L412 PolarHBondContact O-N 3.03Å; L363-L412 HydrophobicContact CD1-CD1 3.48Å; L363-L412 VanDerWaalsContact CD1-CD1 3.48Å; L363-L412 HydrophobicContact CD2-CD1 4.35Å; L363-L412 HydrophobicContact CG-CD1 3.53Å; F376-L412 HydrophobicContact CE2-CD2 4.26Å; F376-L412 HydrophobicContact CZ-CD1 4.12Å; F376-L412 HydrophobicContact CZ-CD2 3.8Å; F376-L412 HydrophobicContact CZ-CG 4.06Å; F394-L412 HydrophobicContact CE2-CB 3.93Å; F394-L412 HydrophobicContact CE2-CD2 3.75Å; F394-L412 HydrophobicContact CE2-CG 4.28Å; F394-L412 HydrophobicContact CZ-CB 4.06Å; F394-L412 HydrophobicContact CZ-CD2 3.95Å; F394-L412 HydrophobicContact CZ-CG 4.2Å; I410-L412 HydrophobicContact CG2-CD1 4.2Å
413	V	93.7	Very high	85	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	124.7	179.3	-174	0	0	0	0	110.3	F331 V358 A359 Y395 D396 W398 V411	F331-V413 HydrophobicContact CB-CG2 4.4Å; F331-V413 HydrophobicContact CD1-CG1 3.75Å; F331-V413 HydrophobicContact CD2-CB 4.49Å; F331-V413 HydrophobicContact CD2-CG1 4.42Å; F331-V413 HydrophobicContact CD2-CG2 4.05Å; F331-V413 HydrophobicContact CE1-CG1 3.9Å; F331-V413 HydrophobicContact CG-CG1 4.02Å; F331-V413 HydrophobicContact CG-CG2 4.12Å; F331-V413 HydrophobicContact CZ-CG1 4.31Å; V358-V413 HydrophobicContact CB-CG1 3.75Å; V358-V413 HydrophobicContact CG1-CG1 4.18Å; V358-V413 HydrophobicContact CG2-CG1 3.66Å; A359-V413 WeakPolarHBondContact O-CA 3.25Å; Y395-V413 HydrophobicContact CD2-CG1 4.16Å; Y395-V413 PolarHBondContact N-O 3.07Å; D396-V413 PolarHBondContact O-N 3.45Å; W398-V413 HydrophobicContact CH2-CG2 3.45Å; W398-V413 VanDerWaalsContact CH2-CG2 3.45Å; W398-V413 HydrophobicContact CZ3-CG2 3.66Å; V411-V413 HydrophobicContact CG1-CG2 4.32Å
414	T	94.1	Very high	86.3	Confident	28 Å²	28	50.8 Å²	50.8	17%	0.172	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	167.8	-178	72.8	0	0	0	0	113	V358 A359 R393 F394 L416	V358-T414 WeakPolarHBondContact CA-O 3.39Å; V358-T414 WeakPolarHBondContact CB-O 3.45Å; A359-T414 PolarHBondContact N-O 3.4Å; A359-T414 PolarHBondContact O-N 3.27Å; R393-T414 CarbonylContact O-C 3.59Å; R393-T414 VanDerWaalsContact O-CA 3.26Å; R393-T414 WeakPolarHBondContact O-CA 3.26Å; R393-T414 WeakPolarHBondContact O-CB 3.38Å; F394-T414 HydrophobicContact CD2-CG2 3.81Å; F394-T414 HydrophobicContact CE2-CG2 4.22Å; T414-L416 PolarHBondContact O-N 3.14Å
415	E	94.7	Very high	87.7	Confident	46 Å²	46	48 Å²	48	22%	0.215	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	131.4	170	177.4	-179.4	-170.6	0	0	111.6	V392 R393 Y395 M417 K478	V392-E415 HydrophobicContact CG1-CB 3.95Å; R393-E415 HydrophobicContact CB-CB 4.09Å; R393-E415 PolarHBondContact N-OE2 3.32Å; R393-E415 PolarHBondContact O-N 2.84Å; Y395-E415 HydrophobicContact CE2-CB 4.29Å; E415-M417 HydrophobicContact CG-SD 4.07Å; E415-M417 PolarHBondContact O-N 3.22Å; E415-K478 WeakPolarHBondContact OE1-CE 3.31Å; E415-K478 IonicContact OE1-NZ 3.49Å; E415-K478 PolarHBondContact OE1-NZ 3.06Å; E415-K478 IonicContact OE2-NZ 2.81Å; E415-K478 PolarHBondContact OE2-NZ 3.1Å
416	L	94.7	Very high	88.9	Confident	37 Å²	37	46.2 Å²	46.2	19%	0.194	23%	0.23	C	C	.	.			trans	-82.8	108.3	-177.8	179.9	57.5	0	0	0	111.5	L338 R348 A357 A359 T414 T418	L338-L416 HydrophobicContact CD1-CD1 3.42Å; L338-L416 VanDerWaalsContact CD1-CD1 3.42Å; R348-L416 HydrophobicContact CG-CD2 4.47Å; A357-L416 HydrophobicContact CB-CD2 3.69Å; A357-L416 WeakPolarHBondContact O-CB 3.4Å; A359-L416 HydrophobicContact CB-CD1 4.19Å; T414-L416 PolarHBondContact O-N 3.14Å; L416-T418 HydrophobicContact CD2-CG2 4.16Å; L416-T418 HydrophobicContact CG-CG2 3.92Å; L416-T418 PolarHBondContact O-N 3.13Å
417	M	94.1	Very high	90	Very high	25 Å²	25	46.8 Å²	46.8	12%	0.123	23%	0.233	C	C	.	.			trans	-88	81.6	-176.9	-64.4	-54.7	-57.6	0	0	112.8	V392 E415 S419 F469 I470 T471 K478	V392-M417 HydrophobicContact CG1-CG 4.23Å; V392-M417 HydrophobicContact CG2-CG 3.9Å; V392-M417 HydrophobicContact CG2-SD 4.22Å; E415-M417 HydrophobicContact CG-SD 4.07Å; E415-M417 PolarHBondContact O-N 3.22Å; M417-S419 PolarHBondContact O-N 3.03Å; M417-F469 HydrophobicContact CB-CB 3.78Å; M417-F469 HydrophobicContact CB-CD1 3.41Å; M417-F469 VanDerWaalsContact CB-CD1 3.41Å; M417-F469 HydrophobicContact CB-CE1 4.18Å; M417-F469 HydrophobicContact CB-CG 3.75Å; M417-F469 HydrophobicContact CE-CB 3.56Å; M417-F469 HydrophobicContact CG-CB 3.66Å; M417-F469 HydrophobicContact CG-CD1 3.89Å; M417-F469 HydrophobicContact CG-CD2 4.35Å; M417-F469 HydrophobicContact CG-CG 3.71Å; M417-F469 HydrophobicContact SD-CB 4.34Å; M417-I470 WeakPolarHBondContact CE-O 3.11Å; M417-T471 HydrophobicContact CE-CG2 3.91Å; M417-K478 HydrophobicContact CE-CB 4.19Å; M417-K478 HydrophobicContact CE-CD 3.82Å; M417-K478 HydrophobicContact SD-CD 3.79Å
418	T	91.1	Very high	90.9	Very high	119 Å²	119	50.3 Å²	50.3	73%	0.73	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-22.1	-171.5	57	0	0	0	0	116.3	L416 G420	L416-T418 HydrophobicContact CD2-CG2 4.16Å; L416-T418 HydrophobicContact CG-CG2 3.92Å; L416-T418 PolarHBondContact O-N 3.13Å; T418-G420 VanDerWaalsContact C-N 3.32Å
419	S	91.8	Very high	91.1	Very high	55 Å²	55	48.8 Å²	48.8	39%	0.385	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	3	-178.6	-68.7	0	0	0	0	114.3	M417 I470 T471	M417-S419 PolarHBondContact O-N 3.03Å; S419-I470 WeakPolarHBondContact CB-O 3.47Å; S419-I470 WeakPolarHBondContact O-CD1 3.38Å; S419-I470 WeakPolarHBondContact O-CG1 3.36Å; S419-T471 PolarHBondContact OG-O 2.96Å
420	G	91.9	Very high	90.8	Very high	22 Å²	22	56 Å²	56	23%	0.227	27%	0.271	C	S	.	.			trans	83.4	-165.5	174.9	0	0	0	0	0	115.1	T418 F469 I470	T418-G420 VanDerWaalsContact C-N 3.32Å; G420-F469 WeakPolarHBondContact O-CA 3.22Å; G420-I470 PolarHBondContact O-N 3.41Å
421	T	94	Very high	90.6	Very high	16 Å²	16	67 Å²	67	10%	0.098	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-103.8	160.9	-172	70.2	0	0	0	0	111.8	K423 M424 Y425 D466 I468 F469	T421-K423 VanDerWaalsContact C-N 3.26Å; T421-K423 PolarHBondContact O-N 3.14Å; T421-M424 CarbonylContact O-C 3.59Å; T421-M424 WeakPolarHBondContact O-CA 3.36Å; T421-M424 WeakPolarHBondContact O-CB 3.35Å; T421-M424 PolarHBondContact O-N 3Å; T421-M424 VanDerWaalsContact O-N 3.09Å; T421-M424 PolarHBondContact OG1-N 3.11Å; T421-Y425 PolarHBondContact O-N 3.21Å; T421-D466 WeakPolarHBondContact CB-O 3.5Å; T421-D466 WeakPolarHBondContact CG2-O 3.36Å; T421-D466 PolarHBondContact OG1-OD1 2.95Å; T421-I468 CarbonylContact C-O 3.58Å; T421-I468 WeakPolarHBondContact CA-O 3.33Å; T421-F469 HydrophobicContact CG2-CD1 3.93Å; T421-F469 HydrophobicContact CG2-CE1 3.84Å
422	L	94.1	Very high	90.4	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-61.1	-35.4	175.8	174.7	60.7	0	0	0	111.8	Y425 L426 I432 W440 C465 I468 M528	L422-Y425 WeakPolarHBondContact O-CB 3.11Å; L422-Y425 PolarHBondContact O-N 3.12Å; L422-L426 HydrophobicContact CG-CD1 4.49Å; L422-L426 WeakPolarHBondContact O-CG 3.5Å; L422-L426 PolarHBondContact O-N 3.4Å; L422-I432 HydrophobicContact CD1-CD1 4.16Å; L422-W440 HydrophobicContact CD1-CE3 3.72Å; L422-W440 HydrophobicContact CD1-CZ3 3.6Å; L422-C465 CarbonylContact C-O 3.58Å; L422-C465 HydrophobicContact CB-CB 4.11Å; L422-C465 WeakPolarHBondContact CB-O 3.21Å; L422-C465 HydrophobicContact CD2-CB 4.09Å; L422-C465 VanDerWaalsContact CD2-SG 3.6Å; L422-C465 HydrophobicContact CG-CB 3.97Å; L422-C465 PolarHBondContact N-O 3.41Å; L422-C465 VanDerWaalsContact N-O 3.13Å; L422-I468 HydrophobicContact CB-CB 4.23Å; L422-I468 HydrophobicContact CB-CG2 4.2Å; L422-I468 WeakPolarHBondContact CB-O 3.37Å; L422-I468 HydrophobicContact CD2-CB 4.32Å; L422-I468 HydrophobicContact CD2-CD1 4.28Å; L422-I468 HydrophobicContact CD2-CG2 4.06Å; L422-I468 PolarHBondContact N-O 3.29Å; L422-M528 HydrophobicContact CD1-CG 3.93Å; L422-M528 HydrophobicContact CD1-SD 3.83Å; L422-M528 HydrophobicContact CD2-CE 4.12Å; L422-M528 HydrophobicContact CD2-CG 3.81Å; L422-M528 HydrophobicContact CD2-SD 3.55Å; L422-M528 VanDerWaalsContact CD2-SD 3.55Å; L422-M528 HydrophobicContact CG-CG 4.11Å; L422-M528 HydrophobicContact CG-SD 4.21Å
423	K	92.9	Very high	90.3	Very high	82 Å²	82	72.5 Å²	72.5	36%	0.357	34%	0.342	S	S	.	.	H	α-helix	trans	-61.9	-43.5	170.4	-175.9	-172.2	-178	178.1	0	111.9	T421 Y425 L426 K427 C465 D466	T421-K423 VanDerWaalsContact C-N 3.26Å; T421-K423 PolarHBondContact O-N 3.14Å; K423-Y425 VanDerWaalsContact C-N 3.32Å; K423-Y425 PolarHBondContact O-N 3.5Å; K423-L426 PolarHBondContact O-N 2.87Å; K423-K427 WeakPolarHBondContact O-CB 2.99Å; K423-K427 PolarHBondContact O-N 3.43Å; K423-C465 HydrophobicContact CB-CB 4.02Å; K423-C465 PolarHBondContact N-O 3.28Å; K423-D466 HydrophobicContact CB-CB 4.49Å; K423-D466 HydrophobicContact CD-CB 3.89Å; K423-D466 WeakPolarHBondContact CD-OD1 3.43Å; K423-D466 WeakPolarHBondContact CD-OD2 3.32Å; K423-D466 WeakPolarHBondContact CE-OD2 3.5Å; K423-D466 IonicContact NZ-OD2 3.98Å; K423-D466 PolarHBondContact NZ-OD2 3.07Å
424	M	92.5	Very high	90	Very high	92 Å²	92	74.5 Å²	74.5	45%	0.453	35%	0.352	S	S	.	.	H	α-helix	trans	-64.8	-36.8	174	-166.6	68.5	73.4	0	0	111.7	T421 R428 L1585	T421-M424 CarbonylContact O-C 3.59Å; T421-M424 WeakPolarHBondContact O-CA 3.36Å; T421-M424 WeakPolarHBondContact O-CB 3.35Å; T421-M424 PolarHBondContact O-N 3Å; T421-M424 VanDerWaalsContact O-N 3.09Å; T421-M424 PolarHBondContact OG1-N 3.11Å; M424-R428 WeakPolarHBondContact O-CB 3.31Å; M424-R428 PolarHBondContact O-N 3.36Å; M424-L1585 HydrophobicContact CE-CD2 4.39Å
425	Y	93.1	Very high	89.6	Confident	28 Å²	28	77.8 Å²	77.8	11%	0.11	36%	0.364	C	S	.	.	H	α-helix	trans	-62.9	-49	173.6	-172.6	-84	0	0	0	111.4	T421 L422 K423 K427 R428 F429 I432 W440 I470 T473	T421-Y425 PolarHBondContact O-N 3.21Å; L422-Y425 WeakPolarHBondContact O-CB 3.11Å; L422-Y425 PolarHBondContact O-N 3.12Å; K423-Y425 VanDerWaalsContact C-N 3.32Å; K423-Y425 PolarHBondContact O-N 3.5Å; Y425-K427 PolarHBondContact O-N 2.87Å; Y425-R428 CarbonylContact O-C 3.57Å; Y425-R428 PolarHBondContact O-N 2.85Å; Y425-R428 VanDerWaalsContact O-N 3.08Å; Y425-F429 HydrophobicContact CD1-CB 4.14Å; Y425-F429 HydrophobicContact CD1-CD2 4.04Å; Y425-F429 AromaticContact CD2-CD2 3.55Å; Y425-F429 HydrophobicContact CD2-CD2 3.55Å; Y425-F429 AromaticContact CD2-CE2 3.87Å; Y425-F429 HydrophobicContact CD2-CE2 3.87Å; Y425-F429 HydrophobicContact CE1-CB 3.78Å; Y425-F429 AromaticContact CE1-CD2 3.94Å; Y425-F429 HydrophobicContact CE1-CD2 3.94Å; Y425-F429 HydrophobicContact CE1-CG 4.19Å; Y425-F429 AromaticContact CE2-CD2 3.46Å; Y425-F429 HydrophobicContact CE2-CD2 3.46Å; Y425-F429 VanDerWaalsContact CE2-CD2 3.46Å; Y425-F429 AromaticContact CE2-CE2 3.73Å; Y425-F429 HydrophobicContact CE2-CE2 3.73Å; Y425-F429 HydrophobicContact CE2-CG 4.3Å; Y425-F429 AromaticContact CG-CD2 3.87Å; Y425-F429 HydrophobicContact CG-CD2 3.87Å; Y425-F429 AromaticContact CZ-CD2 3.68Å; Y425-F429 WeakPolarHBondContact O-CB 3.33Å; Y425-F429 PolarHBondContact O-N 2.73Å; Y425-I432 HydrophobicContact CD1-CD1 4.43Å; Y425-I432 HydrophobicContact CD1-CG1 4.41Å; Y425-I432 HydrophobicContact CE1-CD1 4.47Å; Y425-I432 HydrophobicContact CE1-CG1 4.11Å; Y425-W440 AromaticContact CD1-CH2 3.94Å; Y425-W440 HydrophobicContact CD1-CH2 3.94Å; Y425-W440 AromaticContact CD1-CZ3 3.91Å; Y425-W440 HydrophobicContact CD1-CZ3 3.91Å; Y425-W440 AromaticContact CD2-CH2 3.83Å; Y425-W440 HydrophobicContact CD2-CH2 3.83Å; Y425-W440 AromaticContact CE1-CH2 3.84Å; Y425-W440 HydrophobicContact CE1-CH2 3.84Å; Y425-W440 AromaticContact CE1-CZ3 3.98Å; Y425-W440 HydrophobicContact CE1-CZ3 3.98Å; Y425-W440 AromaticContact CE2-CH2 3.7Å; Y425-W440 HydrophobicContact CE2-CH2 3.7Å; Y425-W440 AromaticContact CG-CH2 3.93Å; Y425-W440 HydrophobicContact CG-CH2 3.93Å; Y425-W440 HydrophobicContact CG-CZ3 4.21Å; Y425-W440 AromaticContact CZ-CH2 3.7Å; Y425-I470 HydrophobicContact CD2-CD1 3.71Å; Y425-I470 HydrophobicContact CG-CD1 4.44Å; Y425-T473 HydrophobicContact CE2-CG2 4.3Å
426	L	92	Very high	89.4	Confident	13 Å²	13	77.3 Å²	77.3	7%	0.068	36%	0.364	C	S	.	.	H	α-helix	trans	-60.9	-43.5	178.4	-75.5	165.8	0	0	0	112.4	L422 K423 R428 F429 I432 E527 M528	L422-L426 HydrophobicContact CG-CD1 4.49Å; L422-L426 WeakPolarHBondContact O-CG 3.5Å; L422-L426 PolarHBondContact O-N 3.4Å; K423-L426 PolarHBondContact O-N 2.87Å; L426-R428 PolarHBondContact O-N 3.43Å; L426-F429 CarbonylContact O-C 3.51Å; L426-F429 PolarHBondContact O-N 3.26Å; L426-I432 HydrophobicContact CD2-CD1 3.72Å; L426-I432 HydrophobicContact CD2-CG1 3.87Å; L426-I432 HydrophobicContact CG-CD1 4.34Å; L426-E527 HydrophobicContact CD1-CG 4.01Å; L426-M528 HydrophobicContact CD1-CG 4.21Å
427	K	90.7	Very high	89.2	Confident	153 Å²	153	75.9 Å²	75.9	67%	0.665	36%	0.357	S	S	*	.	H	α-helix	trans	-58.4	-31.3	174.3	-173.1	173.9	179.7	177.3	0	112.8	K423 Y425	K423-K427 WeakPolarHBondContact O-CB 2.99Å; K423-K427 PolarHBondContact O-N 3.43Å; Y425-K427 PolarHBondContact O-N 2.87Å
428	R	88.2	Confident	89	Confident	195 Å²	195	75.4 Å²	75.4	74%	0.736	35%	0.354	S	S	*	.	H	α-helix	trans	-90.5	-35.3	179.6	-174.2	174	-177.6	173.2	4.3	113.7	M424 Y425 L426	M424-R428 WeakPolarHBondContact O-CB 3.31Å; M424-R428 PolarHBondContact O-N 3.36Å; Y425-R428 CarbonylContact O-C 3.57Å; Y425-R428 PolarHBondContact O-N 2.85Å; Y425-R428 VanDerWaalsContact O-N 3.08Å; L426-R428 PolarHBondContact O-N 3.43Å
429	F	82.7	Confident	89	Confident	73 Å²	73	71.7 Å²	71.7	32%	0.32	33%	0.333	S	S	.	.			trans	-127.7	87	-172.7	-58.4	-73.7	0	0	0	109.3	Y425 L426 R431 T473	Y425-F429 HydrophobicContact CD1-CB 4.14Å; Y425-F429 HydrophobicContact CD1-CD2 4.04Å; Y425-F429 AromaticContact CD2-CD2 3.55Å; Y425-F429 HydrophobicContact CD2-CD2 3.55Å; Y425-F429 AromaticContact CD2-CE2 3.87Å; Y425-F429 HydrophobicContact CD2-CE2 3.87Å; Y425-F429 HydrophobicContact CE1-CB 3.78Å; Y425-F429 AromaticContact CE1-CD2 3.94Å; Y425-F429 HydrophobicContact CE1-CD2 3.94Å; Y425-F429 HydrophobicContact CE1-CG 4.19Å; Y425-F429 AromaticContact CE2-CD2 3.46Å; Y425-F429 HydrophobicContact CE2-CD2 3.46Å; Y425-F429 VanDerWaalsContact CE2-CD2 3.46Å; Y425-F429 AromaticContact CE2-CE2 3.73Å; Y425-F429 HydrophobicContact CE2-CE2 3.73Å; Y425-F429 HydrophobicContact CE2-CG 4.3Å; Y425-F429 AromaticContact CG-CD2 3.87Å; Y425-F429 HydrophobicContact CG-CD2 3.87Å; Y425-F429 AromaticContact CZ-CD2 3.68Å; Y425-F429 WeakPolarHBondContact O-CB 3.33Å; Y425-F429 PolarHBondContact O-N 2.73Å; L426-F429 CarbonylContact O-C 3.51Å; L426-F429 PolarHBondContact O-N 3.26Å; F429-R431 PolarHBondContact O-N 2.92Å; F429-T473 HydrophobicContact CE2-CG2 4.15Å; F429-T473 HydrophobicContact CZ-CG2 4.26Å
430	K	75.8	Confident	89.1	Confident	183 Å²	183	69.2 Å²	69.2	80%	0.796	32%	0.315	S	S	*	.	S	Bend	trans	-57.5	-3.6	-172.2	-61.2	-169.6	175.7	-168.8	0	116.8
431	R	80.7	Confident	89.3	Confident	230 Å²	230	68.2 Å²	68.2	87%	0.868	31%	0.305	S	S	*	.	S	Bend	trans	-147.6	125.9	176.2	-67.2	-170.8	175.3	-173.1	-3	109.8	F429	F429-R431 PolarHBondContact O-N 2.92Å
432	I	86.6	Confident	89.3	Confident	26 Å²	26	69.8 Å²	69.8	13%	0.133	31%	0.309	C	S	.	.			trans	-87	141.4	172.3	-53.9	-170.6	0	0	0	109.3	L422 Y425 L426 V436 L437 W440 M528	L422-I432 HydrophobicContact CD1-CD1 4.16Å; Y425-I432 HydrophobicContact CD1-CD1 4.43Å; Y425-I432 HydrophobicContact CD1-CG1 4.41Å; Y425-I432 HydrophobicContact CE1-CD1 4.47Å; Y425-I432 HydrophobicContact CE1-CG1 4.11Å; L426-I432 HydrophobicContact CD2-CD1 3.72Å; L426-I432 HydrophobicContact CD2-CG1 3.87Å; L426-I432 HydrophobicContact CG-CD1 4.34Å; I432-V436 HydrophobicContact CG2-CB 4.04Å; I432-V436 HydrophobicContact CG2-CG1 4.05Å; I432-L437 HydrophobicContact CG2-CB 4.07Å; I432-W440 HydrophobicContact CD1-CE3 4.29Å; I432-W440 HydrophobicContact CD1-CZ3 4.03Å; I432-M528 HydrophobicContact CD1-CB 4.02Å; I432-M528 HydrophobicContact CD1-CG 3.81Å; I432-M528 HydrophobicContact CD1-SD 4.16Å
433	N	86.7	Confident	89.4	Confident	99 Å²	99	71.1 Å²	71.1	53%	0.529	32%	0.315	S	S	.	.			trans	-70.7	132.3	171	179.8	-45.1	0	0	0	110	K435 V436 L437	N433-K435 PolarHBondContact O-N 2.87Å; N433-K435 VanDerWaalsContact O-N 3.1Å; N433-K435 PolarHBondContact OD1-N 3.03Å; N433-V436 HydrophobicContact CB-CB 4.43Å; N433-V436 HydrophobicContact CB-CG2 4.13Å; N433-V436 WeakPolarHBondContact O-CA 3.42Å; N433-V436 WeakPolarHBondContact O-CB 3.49Å; N433-V436 PolarHBondContact O-N 2.81Å; N433-L437 PolarHBondContact O-N 3.42Å
434	I	87.2	Confident	89.6	Confident	42 Å²	42	67.3 Å²	67.3	22%	0.215	30%	0.298	C	S	.	.	H	α-helix	trans	-49.5	-37.4	-179	-173.2	57.5	0	0	0	114.4	L437 K438 Y564 I567 F593	I434-L437 HydrophobicContact CD1-CD2 4.07Å; I434-L437 PolarHBondContact O-N 2.99Å; I434-K438 HydrophobicContact CD1-CG 4.46Å; I434-K438 WeakPolarHBondContact O-CB 3.5Å; I434-K438 WeakPolarHBondContact O-CG 3.4Å; I434-K438 PolarHBondContact O-N 2.59Å; I434-Y564 HydrophobicContact CD1-CD1 4.48Å; I434-Y564 HydrophobicContact CD1-CE1 4.34Å; I434-Y564 HydrophobicContact CG1-CE1 4.11Å; I434-I567 HydrophobicContact CD1-CD1 3.83Å; I434-F593 HydrophobicContact CD1-CE2 3.86Å; I434-F593 HydrophobicContact CD1-CZ 3.73Å
435	K	86.3	Confident	89.8	Confident	98 Å²	98	62.9 Å²	62.9	43%	0.426	28%	0.277	S	S	.	.	H	α-helix	trans	-69.2	-34.5	176.3	-72.1	-153.8	164.2	-151.8	0	112.6	N433 S439 E597 D598	N433-K435 PolarHBondContact O-N 2.87Å; N433-K435 VanDerWaalsContact O-N 3.1Å; N433-K435 PolarHBondContact OD1-N 3.03Å; K435-S439 WeakPolarHBondContact O-CB 3.17Å; K435-S439 PolarHBondContact O-N 3.37Å; K435-S439 VanDerWaalsContact O-N 3.16Å; K435-E597 WeakPolarHBondContact CE-OE2 3.36Å; K435-E597 IonicContact NZ-OE2 2.66Å; K435-D598 IonicContact NZ-OD1 3.73Å; K435-D598 PolarHBondContact NZ-OD1 2.71Å; K435-D598 IonicContact NZ-OD2 2.69Å; K435-D598 PolarHBondContact NZ-OD2 2.69Å; K435-D598 VanDerWaalsContact NZ-OD2 3.08Å
436	V	89.4	Confident	90	Very high	35 Å²	35	66.6 Å²	66.6	21%	0.212	29%	0.293	C	S	.	.	H	α-helix	trans	-70.9	-44.9	173.7	179.1	0	0	0	0	110	I432 N433 K438 S439 W440	I432-V436 HydrophobicContact CG2-CB 4.04Å; I432-V436 HydrophobicContact CG2-CG1 4.05Å; N433-V436 HydrophobicContact CB-CB 4.43Å; N433-V436 HydrophobicContact CB-CG2 4.13Å; N433-V436 WeakPolarHBondContact O-CA 3.42Å; N433-V436 WeakPolarHBondContact O-CB 3.49Å; N433-V436 PolarHBondContact O-N 2.81Å; V436-K438 PolarHBondContact O-N 3.1Å; V436-S439 WeakPolarHBondContact O-CB 3.43Å; V436-S439 PolarHBondContact O-N 3.24Å; V436-S439 VanDerWaalsContact O-N 3.1Å; V436-W440 HydrophobicContact CG1-CD2 3.65Å; V436-W440 VanDerWaalsContact CG1-CE2 3.45Å; V436-W440 HydrophobicContact CG1-CE3 3.99Å; V436-W440 HydrophobicContact CG1-CG 4.22Å; V436-W440 HydrophobicContact CG1-CH2 4.01Å; V436-W440 HydrophobicContact CG1-CZ2 3.66Å; V436-W440 HydrophobicContact CG1-CZ3 4.16Å; V436-W440 PolarHBondContact O-N 3.48Å
437	L	91.4	Very high	90.2	Very high	8 Å²	8	66 Å²	66	4%	0.042	29%	0.29	C	S	.	.	H	α-helix	trans	-54.4	-55.4	175.4	-177	71.2	0	0	0	111.4	I432 N433 I434 S439 W440 C441 L525 M528 V529 I567	I432-L437 HydrophobicContact CG2-CB 4.07Å; N433-L437 PolarHBondContact O-N 3.42Å; I434-L437 HydrophobicContact CD1-CD2 4.07Å; I434-L437 PolarHBondContact O-N 2.99Å; L437-S439 PolarHBondContact O-N 3.45Å; L437-W440 PolarHBondContact O-N 3.02Å; L437-C441 WeakPolarHBondContact O-CB 3.49Å; L437-C441 PolarHBondContact O-N 3.08Å; L437-C441 PolarHBondContact O-SG 2.87Å; L437-L525 HydrophobicContact CD1-CD1 4.14Å; L437-L525 HydrophobicContact CD2-CD1 4.31Å; L437-L525 HydrophobicContact CG-CD1 4.37Å; L437-M528 HydrophobicContact CD1-CB 3.56Å; L437-M528 HydrophobicContact CD1-CE 4.19Å; L437-M528 HydrophobicContact CD1-CG 4.24Å; L437-M528 HydrophobicContact CD1-SD 3.73Å; L437-V529 HydrophobicContact CD1-CG2 4.39Å; L437-V529 HydrophobicContact CD2-CG2 3.63Å; L437-I567 HydrophobicContact CD2-CD1 3.98Å
438	K	90.2	Very high	90.4	Very high	14 Å²	14	58.7 Å²	58.7	6%	0.061	26%	0.259	C	S	.	.	H	α-helix	trans	-54.4	-40.2	175.5	-77.1	-174.4	169.7	-161.7	0	112.3	I434 V436 R442 F593 E597	I434-K438 HydrophobicContact CD1-CG 4.46Å; I434-K438 WeakPolarHBondContact O-CB 3.5Å; I434-K438 WeakPolarHBondContact O-CG 3.4Å; I434-K438 PolarHBondContact O-N 2.59Å; V436-K438 PolarHBondContact O-N 3.1Å; K438-R442 WeakPolarHBondContact O-CB 3.41Å; K438-R442 PolarHBondContact O-N 2.92Å; K438-F593 HydrophobicContact CD-CD2 4.44Å; K438-F593 HydrophobicContact CD-CE2 4.23Å; K438-F593 HydrophobicContact CD-CZ 4.3Å; K438-F593 VanDerWaalsContact CD-O 3.23Å; K438-F593 WeakPolarHBondContact CD-O 3.43Å; K438-F593 WeakPolarHBondContact CE-O 3.41Å; K438-F593 HydrophobicContact CG-CD1 4.23Å; K438-F593 HydrophobicContact CG-CD2 4.48Å; K438-F593 HydrophobicContact CG-CE1 3.71Å; K438-F593 HydrophobicContact CG-CE2 4.02Å; K438-F593 HydrophobicContact CG-CZ 3.58Å; K438-F593 PolarHBondContact NZ-O 2.89Å; K438-E597 IonicContact NZ-OE1 3.39Å; K438-E597 PolarHBondContact NZ-OE1 3.44Å
439	S	90.7	Very high	90.8	Very high	42 Å²	42	50.8 Å²	50.8	29%	0.294	23%	0.233	S	C	.	.	H	α-helix	trans	-68.4	-45.6	179.2	-167.4	0	0	0	0	113	K435 V436 L437 Q443	K435-S439 WeakPolarHBondContact O-CB 3.17Å; K435-S439 PolarHBondContact O-N 3.37Å; K435-S439 VanDerWaalsContact O-N 3.16Å; V436-S439 WeakPolarHBondContact O-CB 3.43Å; V436-S439 PolarHBondContact O-N 3.24Å; V436-S439 VanDerWaalsContact O-N 3.1Å; L437-S439 PolarHBondContact O-N 3.45Å; S439-Q443 WeakPolarHBondContact O-CB 3.31Å; S439-Q443 VanDerWaalsContact O-CG 3.23Å; S439-Q443 WeakPolarHBondContact O-CG 3.31Å; S439-Q443 PolarHBondContact O-N 3.22Å; S439-Q443 VanDerWaalsContact O-N 3.16Å; S439-Q443 PolarHBondContact O-NE2 2.92Å; S439-Q443 PolarHBondContact OG-NE2 2.93Å; S439-Q443 VanDerWaalsContact OG-NE2 3.17Å
440	W	94.6	Very high	91.4	Very high	3 Å²	3	48.6 Å²	48.6	1%	0.011	22%	0.223	C	C	.	.	H	α-helix	trans	-71.2	-42.1	-179.1	-70.7	-7.3	0	0	0	112.3	L422 Y425 I432 V436 L437 R442 Q443 I444 I470 G475 V477	L422-W440 HydrophobicContact CD1-CE3 3.72Å; L422-W440 HydrophobicContact CD1-CZ3 3.6Å; Y425-W440 AromaticContact CD1-CH2 3.94Å; Y425-W440 HydrophobicContact CD1-CH2 3.94Å; Y425-W440 AromaticContact CD1-CZ3 3.91Å; Y425-W440 HydrophobicContact CD1-CZ3 3.91Å; Y425-W440 AromaticContact CD2-CH2 3.83Å; Y425-W440 HydrophobicContact CD2-CH2 3.83Å; Y425-W440 AromaticContact CE1-CH2 3.84Å; Y425-W440 HydrophobicContact CE1-CH2 3.84Å; Y425-W440 AromaticContact CE1-CZ3 3.98Å; Y425-W440 HydrophobicContact CE1-CZ3 3.98Å; Y425-W440 AromaticContact CE2-CH2 3.7Å; Y425-W440 HydrophobicContact CE2-CH2 3.7Å; Y425-W440 AromaticContact CG-CH2 3.93Å; Y425-W440 HydrophobicContact CG-CH2 3.93Å; Y425-W440 HydrophobicContact CG-CZ3 4.21Å; Y425-W440 AromaticContact CZ-CH2 3.7Å; I432-W440 HydrophobicContact CD1-CE3 4.29Å; I432-W440 HydrophobicContact CD1-CZ3 4.03Å; V436-W440 HydrophobicContact CG1-CD2 3.65Å; V436-W440 VanDerWaalsContact CG1-CE2 3.45Å; V436-W440 HydrophobicContact CG1-CE3 3.99Å; V436-W440 HydrophobicContact CG1-CG 4.22Å; V436-W440 HydrophobicContact CG1-CH2 4.01Å; V436-W440 HydrophobicContact CG1-CZ2 3.66Å; V436-W440 HydrophobicContact CG1-CZ3 4.16Å; V436-W440 PolarHBondContact O-N 3.48Å; L437-W440 PolarHBondContact O-N 3.02Å; W440-R442 PolarHBondContact O-N 2.57Å; W440-Q443 WeakPolarHBondContact O-CA 3.22Å; W440-Q443 WeakPolarHBondContact O-CB 3.31Å; W440-Q443 PolarHBondContact O-N 2.86Å; W440-Q443 VanDerWaalsContact O-N 3.07Å; W440-I444 WeakPolarHBondContact O-CG1 3.48Å; W440-I444 PolarHBondContact O-N 3.32Å; W440-I470 HydrophobicContact CH2-CG2 4.33Å; W440-I470 HydrophobicContact CZ2-CG2 4.48Å; W440-G475 PolarHBondContact NE1-O 3.24Å; W440-V477 HydrophobicContact CB-CG1 4.01Å; W440-V477 HydrophobicContact CB-CG2 4.1Å; W440-V477 HydrophobicContact CD2-CG1 3.77Å; W440-V477 HydrophobicContact CE3-CG1 4.42Å; W440-V477 HydrophobicContact CG-CG1 3.58Å; W440-V477 HydrophobicContact CG-CG2 4.35Å; W440-V477 WeakPolarHBondContact O-CG2 3.43Å
441	C	95.6	Very high	92.2	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61	-47.3	176.9	-64.1	0	0	0	0	111.9	L437 Q443 I444 L445 F521 M528 F594	L437-C441 WeakPolarHBondContact O-CB 3.49Å; L437-C441 PolarHBondContact O-N 3.08Å; L437-C441 PolarHBondContact O-SG 2.87Å; C441-Q443 PolarHBondContact O-N 3.46Å; C441-I444 PolarHBondContact O-N 3.19Å; C441-L445 WeakPolarHBondContact O-CG 3.39Å; C441-L445 PolarHBondContact O-N 3.37Å; C441-F521 HydrophobicContact CB-CE2 4.06Å; C441-F521 HydrophobicContact CB-CZ 4.07Å; C441-M528 WeakPolarHBondContact SG-CE 3.2Å; C441-F594 HydrophobicContact CB-CD1 4.13Å; C441-F594 HydrophobicContact CB-CE1 3.33Å; C441-F594 HydrophobicContact CB-CZ 4.03Å
442	R	94	Very high	92.7	Very high	49 Å²	49	30.2 Å²	30.2	19%	0.185	15%	0.15	C	C	.	.	H	α-helix	trans	-59.5	-29.9	173.2	174	167.3	52.3	-124.4	-4.2	113.3	K438 W440 K446 F594	K438-R442 WeakPolarHBondContact O-CB 3.41Å; K438-R442 PolarHBondContact O-N 2.92Å; W440-R442 PolarHBondContact O-N 2.57Å; R442-K446 VanDerWaalsContact O-CG 3.3Å; R442-K446 WeakPolarHBondContact O-CG 3.23Å; R442-K446 PolarHBondContact O-N 3.38Å; R442-K446 VanDerWaalsContact O-N 3.12Å; R442-F594 HydrophobicContact CB-CD1 4.41Å; R442-F594 VanDerWaalsContact CD-O 3.31Å; R442-F594 WeakPolarHBondContact CD-O 3.36Å; R442-F594 PolarHBondContact NH1-O 2.72Å
443	Q	95.5	Very high	92.8	Very high	29 Å²	29	31.9 Å²	31.9	14%	0.136	16%	0.161	C	C	.	.	H	α-helix	trans	-76.9	-39.5	175	-79.6	174.9	72.1	0	0	112.6	N390 S439 W440 C441 K446 G447 V477	N390-Q443 VanDerWaalsContact CB-O 3.29Å; N390-Q443 WeakPolarHBondContact CB-O 3.35Å; N390-Q443 WeakPolarHBondContact ND2-CB 3.36Å; N390-Q443 WeakPolarHBondContact ND2-CG 3.44Å; N390-Q443 PolarHBondContact ND2-OE1 3.46Å; S439-Q443 WeakPolarHBondContact O-CB 3.31Å; S439-Q443 VanDerWaalsContact O-CG 3.23Å; S439-Q443 WeakPolarHBondContact O-CG 3.31Å; S439-Q443 PolarHBondContact O-N 3.22Å; S439-Q443 VanDerWaalsContact O-N 3.16Å; S439-Q443 PolarHBondContact O-NE2 2.92Å; S439-Q443 PolarHBondContact OG-NE2 2.93Å; S439-Q443 VanDerWaalsContact OG-NE2 3.17Å; W440-Q443 WeakPolarHBondContact O-CA 3.22Å; W440-Q443 WeakPolarHBondContact O-CB 3.31Å; W440-Q443 PolarHBondContact O-N 2.86Å; W440-Q443 VanDerWaalsContact O-N 3.07Å; C441-Q443 PolarHBondContact O-N 3.46Å; Q443-K446 PolarHBondContact O-N 3.28Å; Q443-G447 PolarHBondContact O-N 3.14Å; Q443-V477 HydrophobicContact CB-CG2 3.5Å; Q443-V477 VanDerWaalsContact OE1-N 3.08Å
444	I	97.4	Very high	92.9	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-61.9	-48.5	172.2	-63.4	154.9	0	0	0	109.6	W440 C441 K446 G447 L448 L463 I468 V477 I479 F521 M528	W440-I444 WeakPolarHBondContact O-CG1 3.48Å; W440-I444 PolarHBondContact O-N 3.32Å; C441-I444 PolarHBondContact O-N 3.19Å; I444-K446 VanDerWaalsContact C-N 3.3Å; I444-K446 PolarHBondContact O-N 2.77Å; I444-G447 CarbonylContact O-C 3.45Å; I444-G447 WeakPolarHBondContact O-CA 3.39Å; I444-G447 PolarHBondContact O-N 2.83Å; I444-L448 HydrophobicContact CG2-CD1 4.39Å; I444-L448 HydrophobicContact CG2-CG 4.47Å; I444-L448 PolarHBondContact O-N 3.11Å; I444-L463 HydrophobicContact CG2-CD2 4.48Å; I444-I468 HydrophobicContact CD1-CD1 3.9Å; I444-I468 HydrophobicContact CD1-CG2 4.21Å; I444-I468 HydrophobicContact CG1-CD1 4.22Å; I444-I468 HydrophobicContact CG1-CG2 4.17Å; I444-I468 HydrophobicContact CG2-CD1 4.48Å; I444-V477 HydrophobicContact CG1-CG2 3.97Å; I444-I479 HydrophobicContact CG2-CD1 4.06Å; I444-F521 HydrophobicContact CB-CD2 4.31Å; I444-F521 HydrophobicContact CB-CE2 4.36Å; I444-F521 HydrophobicContact CG2-CD2 3.8Å; I444-F521 HydrophobicContact CG2-CE2 4.34Å; I444-M528 HydrophobicContact CD1-CE 4.21Å
445	L	97.2	Very high	92.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-59.5	-37.1	176.6	-70.1	169.9	0	0	0	112.8	C441 S449 F521 V585 L588 L589 F594	C441-L445 WeakPolarHBondContact O-CG 3.39Å; C441-L445 PolarHBondContact O-N 3.37Å; L445-S449 VanDerWaalsContact O-CB 3.26Å; L445-S449 WeakPolarHBondContact O-CB 3.5Å; L445-S449 PolarHBondContact O-N 2.92Å; L445-F521 HydrophobicContact CD1-CE1 4.18Å; L445-F521 HydrophobicContact CD1-CE2 4.26Å; L445-F521 HydrophobicContact CD1-CZ 3.71Å; L445-F521 HydrophobicContact CD2-CD1 3.95Å; L445-F521 HydrophobicContact CD2-CD2 4.17Å; L445-F521 HydrophobicContact CD2-CE1 3.8Å; L445-F521 HydrophobicContact CD2-CE2 4.02Å; L445-F521 HydrophobicContact CD2-CG 4.14Å; L445-F521 HydrophobicContact CD2-CZ 3.83Å; L445-F521 HydrophobicContact CG-CD2 4.31Å; L445-F521 HydrophobicContact CG-CE1 4.15Å; L445-F521 HydrophobicContact CG-CE2 3.75Å; L445-F521 HydrophobicContact CG-CZ 3.66Å; L445-V585 HydrophobicContact CB-CG1 4.31Å; L445-V585 HydrophobicContact CD2-CG1 4.05Å; L445-V585 WeakPolarHBondContact O-CG1 3.19Å; L445-L588 HydrophobicContact CD1-CB 3.88Å; L445-L588 HydrophobicContact CD2-CB 3.86Å; L445-L588 HydrophobicContact CD2-CD1 3.8Å; L445-L588 HydrophobicContact CD2-CG 4.5Å; L445-L589 HydrophobicContact CB-CD2 3.58Å; L445-L589 HydrophobicContact CB-CG 3.92Å; L445-L589 HydrophobicContact CD1-CD2 4.49Å; L445-F594 HydrophobicContact CD1-CD2 4.04Å; L445-F594 HydrophobicContact CD1-CE2 3.94Å; L445-F594 HydrophobicContact CD1-CG 4.35Å; L445-F594 HydrophobicContact CD1-CZ 4.21Å
446	K	96.4	Very high	92.3	Very high	106 Å²	106	36.1 Å²	36.1	46%	0.461	19%	0.187	S	C	.	.	H	α-helix	trans	-66.1	-39.6	171	-78.5	-179.3	177.9	-166.9	0	112.5	H388 R442 Q443 I444 S449 F450 L589	H388-K446 PolarHBondContact CE1-O 3.29Å; R442-K446 VanDerWaalsContact O-CG 3.3Å; R442-K446 WeakPolarHBondContact O-CG 3.23Å; R442-K446 PolarHBondContact O-N 3.38Å; R442-K446 VanDerWaalsContact O-N 3.12Å; Q443-K446 PolarHBondContact O-N 3.28Å; I444-K446 VanDerWaalsContact C-N 3.3Å; I444-K446 PolarHBondContact O-N 2.77Å; K446-S449 PolarHBondContact O-N 3.11Å; K446-F450 WeakPolarHBondContact O-CB 3.36Å; K446-F450 PolarHBondContact O-N 3.46Å; K446-L589 HydrophobicContact CG-CD2 3.99Å
447	G	96.3	Very high	92.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58.4	-52.7	172.7	0	0	0	0	0	112	Q443 I444 F450 L451	Q443-G447 PolarHBondContact O-N 3.14Å; I444-G447 CarbonylContact O-C 3.45Å; I444-G447 WeakPolarHBondContact O-CA 3.39Å; I444-G447 PolarHBondContact O-N 2.83Å; G447-F450 WeakPolarHBondContact O-CB 3.44Å; G447-F450 PolarHBondContact O-N 2.89Å; G447-L451 WeakPolarHBondContact O-CG 3.2Å; G447-L451 PolarHBondContact O-N 3.15Å; G447-L451 VanDerWaalsContact O-N 3.16Å
448	L	96.2	Very high	91.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.5	-47.9	175.9	-65.3	-178.8	0	0	0	111.8	I444 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 3.11Å; L448-F450 PolarHBondContact O-N 3.25Å; L448-F450 VanDerWaalsContact O-N 3.15Å; L448-L451 PolarHBondContact O-N 2.99Å; L448-H452 WeakPolarHBondContact O-CB 3.41Å; L448-H452 PolarHBondContact O-N 2.98Å; L448-H452 PolarHBondContact O-ND1 3.41Å; L448-L463 HydrophobicContact CD1-CD2 3.9Å; L448-L463 HydrophobicContact CD2-CD2 4.14Å; L448-L463 HydrophobicContact CG-CD2 4.48Å; L448-I479 HydrophobicContact CD2-CD1 4.02Å; L448-I479 HydrophobicContact CG-CD1 4.14Å; L448-D517 HydrophobicContact CD1-CB 4.18Å; L448-D517 HydrophobicContact CD2-CB 3.93Å; L448-F521 HydrophobicContact CD1-CB 4.25Å; L448-V585 HydrophobicContact CB-CG1 4.19Å; L448-V585 HydrophobicContact CB-CG2 4.2Å; L448-V585 HydrophobicContact CD1-CG2 4.49Å
449	S	95.6	Very high	91.6	Very high	28 Å²	28	38.9 Å²	38.9	20%	0.196	21%	0.206	C	C	.	.	H	α-helix	trans	-60.4	-27.5	177.7	-174	0	0	0	0	113.3	L445 K446 T453	L445-S449 VanDerWaalsContact O-CB 3.26Å; L445-S449 WeakPolarHBondContact O-CB 3.5Å; L445-S449 PolarHBondContact O-N 2.92Å; K446-S449 PolarHBondContact O-N 3.11Å; S449-T453 WeakPolarHBondContact O-CB 3.45Å; S449-T453 WeakPolarHBondContact O-CG2 3.21Å; S449-T453 PolarHBondContact O-N 2.86Å; S449-T453 PolarHBondContact O-OG1 3.1Å
450	F	94.9	Very high	91.4	Very high	28 Å²	28	36.9 Å²	36.9	12%	0.123	19%	0.192	C	C	.	.	H	α-helix	trans	-72.2	-44.4	172.4	169.5	-95.2	0	0	0	111.4	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 4.33Å; H388-F450 HydrophobicContact CB-CB 4.33Å; H388-F450 HydrophobicContact CB-CD1 3.58Å; H388-F450 HydrophobicContact CB-CD2 3.87Å; H388-F450 HydrophobicContact CB-CE1 3.73Å; H388-F450 HydrophobicContact CB-CE2 4Å; H388-F450 HydrophobicContact CB-CG 3.65Å; H388-F450 HydrophobicContact CB-CZ 3.94Å; H388-F450 AromaticContact CD2-CD2 3.83Å; H388-F450 AromaticContact CD2-CG 3.82Å; H388-F450 AromaticContact CG-CG 3.69Å; I391-F450 HydrophobicContact CG1-CD1 4.06Å; I391-F450 HydrophobicContact CG1-CE1 4.49Å; K446-F450 WeakPolarHBondContact O-CB 3.36Å; K446-F450 PolarHBondContact O-N 3.46Å; G447-F450 WeakPolarHBondContact O-CB 3.44Å; G447-F450 PolarHBondContact O-N 2.89Å; L448-F450 PolarHBondContact O-N 3.25Å; L448-F450 VanDerWaalsContact O-N 3.15Å; F450-T453 PolarHBondContact O-N 2.84Å; F450-T453 PolarHBondContact O-OG1 2.95Å; F450-R454 PolarHBondContact O-N 3.32Å; F450-R454 PolarHBondContact O-NE 2.83Å; F450-R454 PolarHBondContact O-NH2 3.28Å
451	L	92.2	Very high	90.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-65.7	-47.4	178.4	-61.7	172.5	0	0	0	112.1	L386 I391 G447 L448 T453 R454 V458 L482	L386-L451 HydrophobicContact CD1-CD2 3.74Å; I391-L451 HydrophobicContact CD1-CD1 3.81Å; I391-L451 HydrophobicContact CD1-CD2 4.06Å; I391-L451 HydrophobicContact CD1-CG 3.9Å; I391-L451 HydrophobicContact CG1-CD2 4.46Å; G447-L451 WeakPolarHBondContact O-CG 3.2Å; G447-L451 PolarHBondContact O-N 3.15Å; G447-L451 VanDerWaalsContact O-N 3.16Å; L448-L451 PolarHBondContact O-N 2.99Å; L451-T453 PolarHBondContact O-N 3.39Å; L451-T453 VanDerWaalsContact O-N 3.15Å; L451-R454 WeakPolarHBondContact O-CB 3.44Å; L451-R454 WeakPolarHBondContact O-CG 3.19Å; L451-R454 PolarHBondContact O-N 2.99Å; L451-R454 VanDerWaalsContact O-N 3.11Å; L451-V458 CarbonylContact C-O 3.58Å; L451-V458 HydrophobicContact CB-CB 4.12Å; L451-V458 HydrophobicContact CB-CG1 4.43Å; L451-V458 VanDerWaalsContact CB-O 3.32Å; L451-V458 WeakPolarHBondContact CB-O 3.43Å; L451-V458 HydrophobicContact CD2-CB 4.3Å; L451-V458 HydrophobicContact CD2-CG1 4.06Å; L451-V458 PolarHBondContact O-N 3.24Å; L451-L482 HydrophobicContact CD1-CD2 3.83Å; L451-L482 HydrophobicContact CD2-CD1 3.96Å; L451-L482 HydrophobicContact CD2-CD2 4.32Å
452	H	91.3	Very high	90.3	Very high	27 Å²	27	39.8 Å²	39.8	13%	0.125	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-6.8	176.9	-58.5	162	0	0	0	113.9	L448 V458 E514 D517	L448-H452 WeakPolarHBondContact O-CB 3.41Å; L448-H452 PolarHBondContact O-N 2.98Å; L448-H452 PolarHBondContact O-ND1 3.41Å; H452-V458 PolarHBondContact CD2-O 3.19Å; H452-E514 HydrophobicContact CB-CG 3.91Å; H452-E514 VanDerWaalsContact CD2-CG 3.47Å; H452-E514 WeakPolarHBondContact CD2-CG 3.42Å; H452-D517 IonicContact CD2-OD2 3.03Å; H452-D517 IonicContact CE1-OD2 3.59Å; H452-D517 IonicContact NE2-OD2 3.48Å; H452-D517 PolarHBondContact NE2-OD2 3.24Å
453	T	90.5	Very high	90.2	Very high	60 Å²	60	37.5 Å²	37.5	37%	0.368	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	20.2	173	58.9	0	0	0	0	112.9	S449 F450 L451	S449-T453 WeakPolarHBondContact O-CB 3.45Å; S449-T453 WeakPolarHBondContact O-CG2 3.21Å; S449-T453 PolarHBondContact O-N 2.86Å; S449-T453 PolarHBondContact O-OG1 3.1Å; F450-T453 PolarHBondContact O-N 2.84Å; F450-T453 PolarHBondContact O-OG1 2.95Å; L451-T453 PolarHBondContact O-N 3.39Å; L451-T453 VanDerWaalsContact O-N 3.15Å
454	R	87.1	Confident	90.1	Very high	85 Å²	85	37.7 Å²	37.7	32%	0.321	20%	0.196	S	C	.	.	S	Bend	trans	-77.9	166.9	163.6	-61.5	-51	86.1	-158.6	-7.3	110.1	L386 F450 L451 P456 P457 V458	L386-R454 HydrophobicContact CD2-CG 3.76Å; F450-R454 PolarHBondContact O-N 3.32Å; F450-R454 PolarHBondContact O-NE 2.83Å; F450-R454 PolarHBondContact O-NH2 3.28Å; L451-R454 WeakPolarHBondContact O-CB 3.44Å; L451-R454 WeakPolarHBondContact O-CG 3.19Å; L451-R454 PolarHBondContact O-N 2.99Å; L451-R454 VanDerWaalsContact O-N 3.11Å; R454-P456 VanDerWaalsContact C-C 3.41Å; R454-P456 CarbonylContact C-O 3.59Å; R454-P456 WeakPolarHBondContact CB-O 3.38Å; R454-P456 CarbonylContact O-C 3.53Å; R454-P456 VanDerWaalsContact O-C 3.24Å; R454-P457 WeakPolarHBondContact O-CA 3.44Å; R454-P457 VanDerWaalsContact O-N 3.17Å; R454-V458 HydrophobicContact CB-CG2 4.03Å; R454-V458 HydrophobicContact CG-CG2 3.99Å
455	N	78.3	Confident	89.9	Confident	162 Å²	162	37.7 Å²	37.7	87%	0.866	20%	0.197	S	C	*	.	S	Bend	trans	-127.3	105.1	172.8	-69.5	97.7	0	0	0	108.2
456	P	83	Confident	89.7	Confident	81 Å²	81	40.3 Å²	40.3	53%	0.526	21%	0.21	S	C	.	.	S	Bend	cis	-65.8	159.7	-4.5	30.8	-36.8	0	0	0	113.1	M382 R454	M382-P456 HydrophobicContact SD-CG 4.03Å; R454-P456 VanDerWaalsContact C-C 3.41Å; R454-P456 CarbonylContact C-O 3.59Å; R454-P456 WeakPolarHBondContact CB-O 3.38Å; R454-P456 CarbonylContact O-C 3.53Å; R454-P456 VanDerWaalsContact O-C 3.24Å
457	P	85.5	Confident	89.5	Confident	62 Å²	62	35.7 Å²	35.7	40%	0.403	19%	0.191	S	C	.	.			trans	-59.5	141.9	173.3	-24	34.8	0	0	0	112.2	R454 E514	R454-P457 WeakPolarHBondContact O-CA 3.44Å; R454-P457 VanDerWaalsContact O-N 3.17Å; P457-E514 WeakPolarHBondContact CB-OE1 3.47Å
458	V	84.4	Confident	89.5	Confident	27 Å²	27	35.7 Å²	35.7	16%	0.164	19%	0.191	C	C	.	.			trans	-104.7	115.7	179.3	176.6	0	0	0	0	109.5	L451 H452 R454	L451-V458 CarbonylContact C-O 3.58Å; L451-V458 HydrophobicContact CB-CB 4.12Å; L451-V458 HydrophobicContact CB-CG1 4.43Å; L451-V458 VanDerWaalsContact CB-O 3.32Å; L451-V458 WeakPolarHBondContact CB-O 3.43Å; L451-V458 HydrophobicContact CD2-CB 4.3Å; L451-V458 HydrophobicContact CD2-CG1 4.06Å; L451-V458 PolarHBondContact O-N 3.24Å; H452-V458 PolarHBondContact CD2-O 3.19Å; R454-V458 HydrophobicContact CB-CG2 4.03Å; R454-V458 HydrophobicContact CG-CG2 3.99Å
459	I	85.9	Confident	89.5	Confident	26 Å²	26	37.7 Å²	37.7	13%	0.133	20%	0.199	C	C	.	.			trans	-100.3	127.9	177.6	-50.9	165.2	0	0	0	109.6	R461 Y512 E514 V516	I459-R461 HydrophobicContact CG2-CG 4.06Å; I459-R461 PolarHBondContact O-NE 2.87Å; I459-R461 PolarHBondContact O-NH2 3.08Å; I459-Y512 HydrophobicContact CD1-CD2 4.11Å; I459-Y512 HydrophobicContact CD1-CE2 4.1Å; I459-Y512 HydrophobicContact CG2-CD2 4.38Å; I459-E514 HydrophobicContact CG1-CG 4.35Å; I459-V516 HydrophobicContact CG2-CG2 3.56Å
460	H	87.2	Confident	89.4	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.005	19%	0.191	C	C	.	.			trans	-75.9	-38	-171.5	-174.9	-65.8	0	0	0	113.4	D462 L463 I479 G480 L482 A485 D517	H460-D462 VanDerWaalsContact CE1-C 3.4Å; H460-D462 PolarHBondContact CE1-O 3.1Å; H460-D462 VanDerWaalsContact CE1-O 3.32Å; H460-D462 VanDerWaalsContact ND1-C 3.29Å; H460-D462 PolarHBondContact ND1-N 3.37Å; H460-D462 PolarHBondContact O-N 3.27Å; H460-L463 PolarHBondContact CE1-N 2.73Å; H460-L463 WeakPolarHBondContact ND1-CA 3.44Å; H460-L463 PolarHBondContact ND1-N 3.4Å; H460-I479 WeakPolarHBondContact CD2-CG2 3.42Å; H460-I479 WeakPolarHBondContact NE2-CG2 3.4Å; H460-G480 PolarHBondContact NE2-O 2.89Å; H460-L482 HydrophobicContact CB-CD2 4.33Å; H460-L482 VanDerWaalsContact CD2-CD2 3.4Å; H460-L482 WeakPolarHBondContact CD2-CD2 3.38Å; H460-A485 WeakPolarHBondContact O-CB 3.47Å; H460-D517 WeakPolarHBondContact CB-OD1 3.31Å; H460-D517 PolarHBondContact N-OD1 3Å; H460-D517 PolarHBondContact N-OD2 2.9Å
461	R	83.1	Confident	89.3	Confident	38 Å²	38	38 Å²	38	14%	0.143	20%	0.203	C	C	.	.	S	Bend	trans	62.2	-27.5	174.6	-66.6	162.1	-90.1	-166.7	-7.8	118.2	I459 A485 T486 N489 M507 Y512 D517	I459-R461 HydrophobicContact CG2-CG 4.06Å; I459-R461 PolarHBondContact O-NE 2.87Å; I459-R461 PolarHBondContact O-NH2 3.08Å; R461-A485 HydrophobicContact CB-CB 4.47Å; R461-A485 PolarHBondContact NE-O 2.85Å; R461-A485 PolarHBondContact NH1-O 3.45Å; R461-T486 VanDerWaalsContact NH2-CG2 3.34Å; R461-N489 PolarHBondContact NH1-OD1 2.79Å; R461-M507 HydrophobicContact CB-CE 4.05Å; R461-M507 HydrophobicContact CG-CE 4.15Å; R461-M507 HydrophobicContact CG-SD 4.43Å; R461-Y512 HydrophobicContact CG-CD2 4.28Å; R461-Y512 HydrophobicContact CG-CE2 3.83Å; R461-Y512 PolarHBondContact NH1-OH 3.38Å; R461-D517 PolarHBondContact N-OD1 3.38Å
462	D	84.3	Confident	88.9	Confident	25 Å²	25	38.9 Å²	38.9	13%	0.134	21%	0.211	C	C	.	.			trans	-118.7	35.8	177.8	-160.7	55.3	0	0	0	111.9	H460 K464 N467 K488	H460-D462 VanDerWaalsContact CE1-C 3.4Å; H460-D462 PolarHBondContact CE1-O 3.1Å; H460-D462 VanDerWaalsContact CE1-O 3.32Å; H460-D462 VanDerWaalsContact ND1-C 3.29Å; H460-D462 PolarHBondContact ND1-N 3.37Å; H460-D462 PolarHBondContact O-N 3.27Å; D462-K464 PolarHBondContact O-N 3.47Å; D462-K464 IonicContact OD1-NZ 2.71Å; D462-K464 PolarHBondContact OD1-NZ 2.64Å; D462-K464 VanDerWaalsContact OD2-CE 3.31Å; D462-K464 WeakPolarHBondContact OD2-CE 3.33Å; D462-K464 IonicContact OD2-NZ 3.56Å; D462-K464 PolarHBondContact OD2-NZ 3Å; D462-N467 PolarHBondContact O-ND2 3.5Å; D462-N467 PolarHBondContact OD2-ND2 3.15Å; D462-K488 IonicContact OD1-NZ 2.81Å; D462-K488 PolarHBondContact OD1-NZ 3.3Å
463	L	92.1	Very high	88.1	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.01	23%	0.228	C	C	.	.			trans	-72	124.3	-177.4	-173.2	75	0	0	0	109.6	I444 L448 H460 I468 I479 D517 A520 F521	I444-L463 HydrophobicContact CG2-CD2 4.48Å; L448-L463 HydrophobicContact CD1-CD2 3.9Å; L448-L463 HydrophobicContact CD2-CD2 4.14Å; L448-L463 HydrophobicContact CG-CD2 4.48Å; H460-L463 PolarHBondContact CE1-N 2.73Å; H460-L463 WeakPolarHBondContact ND1-CA 3.44Å; H460-L463 PolarHBondContact ND1-N 3.4Å; L463-I468 HydrophobicContact CD1-CD1 4.13Å; L463-I468 HydrophobicContact CD1-CG1 4.11Å; L463-I468 HydrophobicContact CG-CD1 4.49Å; L463-I479 HydrophobicContact CD1-CD1 4.32Å; L463-I479 HydrophobicContact CD1-CG2 3.73Å; L463-D517 WeakPolarHBondContact CD2-O 3.43Å; L463-A520 HydrophobicContact CB-CB 3.84Å; L463-A520 HydrophobicContact CD2-CB 4.29Å; L463-A520 HydrophobicContact CG-CB 4.48Å; L463-A520 WeakPolarHBondContact O-CB 3.34Å; L463-F521 HydrophobicContact CD2-CB 4.12Å
464	K	92.3	Very high	87.3	Confident	33 Å²	33	44.8 Å²	44.8	14%	0.143	25%	0.25	C	C	.	.	S	Bend	trans	-162	162.3	-179.5	62.5	-152.5	-175.1	-162.7	0	110.1	D462 D466 N467 I468 T499 F502 C524	D462-K464 PolarHBondContact O-N 3.47Å; D462-K464 IonicContact OD1-NZ 2.71Å; D462-K464 PolarHBondContact OD1-NZ 2.64Å; D462-K464 VanDerWaalsContact OD2-CE 3.31Å; D462-K464 WeakPolarHBondContact OD2-CE 3.33Å; D462-K464 IonicContact OD2-NZ 3.56Å; D462-K464 PolarHBondContact OD2-NZ 3Å; K464-D466 HydrophobicContact CG-CB 4.09Å; K464-D466 PolarHBondContact O-N 3.23Å; K464-N467 WeakPolarHBondContact CE-OD1 3.35Å; K464-N467 HydrophobicContact CG-CB 4.26Å; K464-N467 PolarHBondContact O-N 3.19Å; K464-I468 WeakPolarHBondContact O-CG1 3.37Å; K464-I468 PolarHBondContact O-N 2.9Å; K464-T499 PolarHBondContact NZ-OG1 3.22Å; K464-F502 HydrophobicContact CB-CD1 3.93Å; K464-F502 HydrophobicContact CB-CE1 4.14Å; K464-F502 HydrophobicContact CB-CG 4.28Å; K464-C524 VanDerWaalsContact CA-SG 3.5Å
465	C	94.6	Very high	87.2	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.007	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-14.9	179.1	-65.4	0	0	0	0	114.4	L422 K423 E527	L422-C465 CarbonylContact C-O 3.58Å; L422-C465 HydrophobicContact CB-CB 4.11Å; L422-C465 WeakPolarHBondContact CB-O 3.21Å; L422-C465 HydrophobicContact CD2-CB 4.09Å; L422-C465 VanDerWaalsContact CD2-SG 3.6Å; L422-C465 HydrophobicContact CG-CB 3.97Å; L422-C465 PolarHBondContact N-O 3.41Å; L422-C465 VanDerWaalsContact N-O 3.13Å; K423-C465 HydrophobicContact CB-CB 4.02Å; K423-C465 PolarHBondContact N-O 3.28Å; C465-E527 WeakPolarHBondContact CB-OE2 3.48Å; C465-E527 PolarHBondContact SG-OE2 3.23Å
466	D	91.6	Very high	87.9	Confident	54 Å²	54	36 Å²	36	29%	0.289	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-30	171.5	-126.3	-8.5	0	0	0	113.4	T421 K423 K464	T421-D466 WeakPolarHBondContact CB-O 3.5Å; T421-D466 WeakPolarHBondContact CG2-O 3.36Å; T421-D466 PolarHBondContact OG1-OD1 2.95Å; K423-D466 HydrophobicContact CB-CB 4.49Å; K423-D466 HydrophobicContact CD-CB 3.89Å; K423-D466 WeakPolarHBondContact CD-OD1 3.43Å; K423-D466 WeakPolarHBondContact CD-OD2 3.32Å; K423-D466 WeakPolarHBondContact CE-OD2 3.5Å; K423-D466 IonicContact NZ-OD2 3.98Å; K423-D466 PolarHBondContact NZ-OD2 3.07Å; K464-D466 HydrophobicContact CG-CB 4.09Å; K464-D466 PolarHBondContact O-N 3.23Å
467	N	93.3	Very high	88.5	Confident	10 Å²	10	32.3 Å²	32.3	5%	0.053	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	0.4	-179	-64.3	1.3	0	0	0	112.2	D462 K464 F469 G480 D481	D462-N467 PolarHBondContact O-ND2 3.5Å; D462-N467 PolarHBondContact OD2-ND2 3.15Å; K464-N467 WeakPolarHBondContact CE-OD1 3.35Å; K464-N467 HydrophobicContact CG-CB 4.26Å; K464-N467 PolarHBondContact O-N 3.19Å; N467-F469 WeakPolarHBondContact O-CD2 3.5Å; N467-G480 PolarHBondContact O-N 2.74Å; N467-D481 HydrophobicContact CB-CB 4.41Å
468	I	95.8	Very high	89.1	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	106.3	173.9	-62.2	163.6	0	0	0	107.6	T421 L422 I444 L463 K464 V477 C524	T421-I468 CarbonylContact C-O 3.58Å; T421-I468 WeakPolarHBondContact CA-O 3.33Å; L422-I468 HydrophobicContact CB-CB 4.23Å; L422-I468 HydrophobicContact CB-CG2 4.2Å; L422-I468 WeakPolarHBondContact CB-O 3.37Å; L422-I468 HydrophobicContact CD2-CB 4.32Å; L422-I468 HydrophobicContact CD2-CD1 4.28Å; L422-I468 HydrophobicContact CD2-CG2 4.06Å; L422-I468 PolarHBondContact N-O 3.29Å; I444-I468 HydrophobicContact CD1-CD1 3.9Å; I444-I468 HydrophobicContact CD1-CG2 4.21Å; I444-I468 HydrophobicContact CG1-CD1 4.22Å; I444-I468 HydrophobicContact CG1-CG2 4.17Å; I444-I468 HydrophobicContact CG2-CD1 4.48Å; L463-I468 HydrophobicContact CD1-CD1 4.13Å; L463-I468 HydrophobicContact CD1-CG1 4.11Å; L463-I468 HydrophobicContact CG-CD1 4.49Å; K464-I468 WeakPolarHBondContact O-CG1 3.37Å; K464-I468 PolarHBondContact O-N 2.9Å; I468-V477 HydrophobicContact CG2-CB 4.02Å; I468-V477 HydrophobicContact CG2-CG1 4.34Å; I468-C524 HydrophobicContact CD1-CB 4.39Å
469	F	95.9	Very high	89.7	Confident	41 Å²	41	29 Å²	29	18%	0.18	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	145.2	-178.1	-63	-92.5	0	0	0	111.2	V392 M417 G420 T421 N467 V477 K478	V392-F469 HydrophobicContact CG2-CD2 3.79Å; V392-F469 HydrophobicContact CG2-CE2 4.43Å; V392-F469 HydrophobicContact CG2-CG 4.39Å; M417-F469 HydrophobicContact CB-CB 3.78Å; M417-F469 HydrophobicContact CB-CD1 3.41Å; M417-F469 VanDerWaalsContact CB-CD1 3.41Å; M417-F469 HydrophobicContact CB-CE1 4.18Å; M417-F469 HydrophobicContact CB-CG 3.75Å; M417-F469 HydrophobicContact CE-CB 3.56Å; M417-F469 HydrophobicContact CG-CB 3.66Å; M417-F469 HydrophobicContact CG-CD1 3.89Å; M417-F469 HydrophobicContact CG-CD2 4.35Å; M417-F469 HydrophobicContact CG-CG 3.71Å; M417-F469 HydrophobicContact SD-CB 4.34Å; G420-F469 WeakPolarHBondContact O-CA 3.22Å; T421-F469 HydrophobicContact CG2-CD1 3.93Å; T421-F469 HydrophobicContact CG2-CE1 3.84Å; N467-F469 WeakPolarHBondContact O-CD2 3.5Å; F469-V477 CarbonylContact O-C 3.48Å; F469-V477 VanDerWaalsContact O-CA 3.29Å; F469-V477 WeakPolarHBondContact O-CA 3.49Å; F469-K478 PolarHBondContact N-O 2.95Å; F469-K478 PolarHBondContact O-N 3.18Å
470	I	95	Very high	89.9	Confident	5 Å²	5	28 Å²	28	3%	0.026	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	144.8	174.2	77.4	180	0	0	0	109.6	M417 S419 G420 Y425 W440 V477	M417-I470 WeakPolarHBondContact CE-O 3.11Å; S419-I470 WeakPolarHBondContact CB-O 3.47Å; S419-I470 WeakPolarHBondContact O-CD1 3.38Å; S419-I470 WeakPolarHBondContact O-CG1 3.36Å; G420-I470 PolarHBondContact O-N 3.41Å; Y425-I470 HydrophobicContact CD2-CD1 3.71Å; Y425-I470 HydrophobicContact CG-CD1 4.44Å; W440-I470 HydrophobicContact CH2-CG2 4.33Å; W440-I470 HydrophobicContact CZ2-CG2 4.48Å; I470-V477 HydrophobicContact CG2-CG1 4.17Å
471	T	92.8	Very high	89.8	Confident	59 Å²	59	30.1 Å²	30.1	36%	0.362	18%	0.177	S	C	.	.	S	Bend	trans	-84.9	-15.8	170.5	54.3	0	0	0	0	113	M417 S419 S476 K478	M417-T471 HydrophobicContact CE-CG2 3.91Å; S419-T471 PolarHBondContact OG-O 2.96Å; T471-S476 VanDerWaalsContact CG2-OG 3.3Å; T471-S476 WeakPolarHBondContact CG2-OG 3.35Å; T471-S476 PolarHBondContact N-O 3.37Å; T471-S476 PolarHBondContact OG1-N 3.11Å; T471-S476 PolarHBondContact OG1-O 3.06Å; T471-S476 VanDerWaalsContact OG1-O 3.09Å; T471-S476 PolarHBondContact OG1-OG 3.36Å; T471-K478 HydrophobicContact CG2-CD 4.04Å
472	G	83.4	Confident	89.4	Confident	17 Å²	17	29.2 Å²	29.2	18%	0.175	18%	0.175	C	C	.	.	S	Bend	trans	174.7	172.4	176.4	0	0	0	0	0	111.5	T474 G475	G472-T474 PolarHBondContact O-N 3.41Å; G472-G475 PolarHBondContact O-N 3.19Å
473	T	75.1	Confident	88.1	Confident	79 Å²	79	28.4 Å²	28.4	49%	0.485	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-21.9	-175.4	49.6	0	0	0	0	114.9	Y425 F429	Y425-T473 HydrophobicContact CE2-CG2 4.3Å; F429-T473 HydrophobicContact CE2-CG2 4.15Å; F429-T473 HydrophobicContact CZ-CG2 4.26Å
474	T	73.3	Confident	86.4	Confident	133 Å²	133	30.2 Å²	30.2	82%	0.816	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.1	19.8	170.7	60.7	0	0	0	0	111.5	G472	G472-T474 PolarHBondContact O-N 3.41Å
475	G	83.8	Confident	84.5	Confident	23 Å²	23	28.8 Å²	28.8	24%	0.237	18%	0.177	C	C	.	.	S	Bend	trans	-89.4	-170.2	-170.7	0	0	0	0	0	114.4	W440 G472	W440-G475 PolarHBondContact NE1-O 3.24Å; G472-G475 PolarHBondContact O-N 3.19Å
476	S	93.7	Very high	82.2	Confident	40 Å²	40	29.7 Å²	29.7	28%	0.28	18%	0.182	S	C	.	.			trans	-78.3	165	167.5	56.8	0	0	0	0	112.5	T471	T471-S476 VanDerWaalsContact CG2-OG 3.3Å; T471-S476 WeakPolarHBondContact CG2-OG 3.35Å; T471-S476 PolarHBondContact N-O 3.37Å; T471-S476 PolarHBondContact OG1-N 3.11Å; T471-S476 PolarHBondContact OG1-O 3.06Å; T471-S476 VanDerWaalsContact OG1-O 3.09Å; T471-S476 PolarHBondContact OG1-OG 3.36Å
477	V	96.7	Very high	80	Confident	2 Å²	2	29.2 Å²	29.2	1%	0.012	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	147.5	169.2	-67.5	0	0	0	0	111.3	N390 W440 Q443 I444 I468 F469 I470	N390-V477 WeakPolarHBondContact CA-O 3.28Å; N390-V477 WeakPolarHBondContact CB-O 3.32Å; N390-V477 PolarHBondContact ND2-O 3.34Å; W440-V477 HydrophobicContact CB-CG1 4.01Å; W440-V477 HydrophobicContact CB-CG2 4.1Å; W440-V477 HydrophobicContact CD2-CG1 3.77Å; W440-V477 HydrophobicContact CE3-CG1 4.42Å; W440-V477 HydrophobicContact CG-CG1 3.58Å; W440-V477 HydrophobicContact CG-CG2 4.35Å; W440-V477 WeakPolarHBondContact O-CG2 3.43Å; Q443-V477 HydrophobicContact CB-CG2 3.5Å; Q443-V477 VanDerWaalsContact OE1-N 3.08Å; I444-V477 HydrophobicContact CG1-CG2 3.97Å; I468-V477 HydrophobicContact CG2-CB 4.02Å; I468-V477 HydrophobicContact CG2-CG1 4.34Å; F469-V477 CarbonylContact O-C 3.48Å; F469-V477 VanDerWaalsContact O-CA 3.29Å; F469-V477 WeakPolarHBondContact O-CA 3.49Å; I470-V477 HydrophobicContact CG2-CG1 4.17Å
478	K	97.3	Very high	77.9	Confident	20 Å²	20	31.5 Å²	31.5	9%	0.087	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	128.7	-178.7	-80	169.1	162.6	-89.2	0	110.3	P389 N390 I391 V392 E415 M417 F469 T471	P389-K478 WeakPolarHBondContact O-CE 3.44Å; P389-K478 WeakPolarHBondContact O-CG 3.43Å; N390-K478 WeakPolarHBondContact O-CA 3.24Å; I391-K478 PolarHBondContact O-NZ 3.04Å; V392-K478 HydrophobicContact CG2-CB 3.75Å; E415-K478 WeakPolarHBondContact OE1-CE 3.31Å; E415-K478 IonicContact OE1-NZ 3.49Å; E415-K478 PolarHBondContact OE1-NZ 3.06Å; E415-K478 IonicContact OE2-NZ 2.81Å; E415-K478 PolarHBondContact OE2-NZ 3.1Å; M417-K478 HydrophobicContact CE-CB 4.19Å; M417-K478 HydrophobicContact CE-CD 3.82Å; M417-K478 HydrophobicContact SD-CD 3.79Å; F469-K478 PolarHBondContact N-O 2.95Å; F469-K478 PolarHBondContact O-N 3.18Å; T471-K478 HydrophobicContact CG2-CD 4.04Å
479	I	95.8	Very high	75.7	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	128.5	175.8	-48.9	175	0	0	0	109	N390 I391 V392 I444 L448 H460 L463	N390-I479 PolarHBondContact O-N 3.05Å; I391-I479 CarbonylContact C-O 3.58Å; I391-I479 WeakPolarHBondContact CA-O 3.3Å; I391-I479 HydrophobicContact CD1-CB 3.99Å; I391-I479 HydrophobicContact CD1-CD1 4.27Å; I391-I479 HydrophobicContact CD1-CG1 4.43Å; V392-I479 PolarHBondContact N-O 2.69Å; I444-I479 HydrophobicContact CG2-CD1 4.06Å; L448-I479 HydrophobicContact CD2-CD1 4.02Å; L448-I479 HydrophobicContact CG-CD1 4.14Å; H460-I479 WeakPolarHBondContact CD2-CG2 3.42Å; H460-I479 WeakPolarHBondContact NE2-CG2 3.4Å; L463-I479 HydrophobicContact CD1-CD1 4.32Å; L463-I479 HydrophobicContact CD1-CG2 3.73Å
480	G	91.7	Very high	73.1	Confident	4 Å²	4	38.9 Å²	38.9	4%	0.041	22%	0.224	C	C	.	.			trans	-122.7	-162.5	-178.2	0	0	0	0	0	113.9	H460 N467 L482	H460-G480 PolarHBondContact NE2-O 2.89Å; N467-G480 PolarHBondContact O-N 2.74Å; G480-L482 PolarHBondContact O-N 3.18Å
481	D	83.7	Confident	70.1	Confident	45 Å²	45	41.6 Å²	41.6	24%	0.241	24%	0.244	C	C	.	.			trans	57.8	7.9	177.8	-93	26.9	0	0	0	117.8	K344 N467 G483 L484	K344-D481 IonicContact NZ-OD1 3.56Å; K344-D481 PolarHBondContact NZ-OD1 2.94Å; K344-D481 IonicContact NZ-OD2 3.57Å; K344-D481 PolarHBondContact NZ-OD2 2.68Å; N467-D481 HydrophobicContact CB-CB 4.41Å; D481-G483 PolarHBondContact O-N 3.06Å; D481-L484 PolarHBondContact O-N 2.77Å
482	L	75.7	Confident	67.1	Low	19 Å²	19	43.4 Å²	43.4	10%	0.099	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-45.9	-40.6	178.6	-69.6	171.1	0	0	0	114.7	L383 L386 I391 L451 H460 G480 L484 A485	L383-L482 HydrophobicContact CD1-CB 4.43Å; L383-L482 HydrophobicContact CD2-CB 3.84Å; L383-L482 HydrophobicContact CD2-CD1 4.25Å; L386-L482 HydrophobicContact CD1-CD1 4.01Å; I391-L482 HydrophobicContact CG2-CD1 3.77Å; L451-L482 HydrophobicContact CD1-CD2 3.83Å; L451-L482 HydrophobicContact CD2-CD1 3.96Å; L451-L482 HydrophobicContact CD2-CD2 4.32Å; H460-L482 HydrophobicContact CB-CD2 4.33Å; H460-L482 VanDerWaalsContact CD2-CD2 3.4Å; H460-L482 WeakPolarHBondContact CD2-CD2 3.38Å; G480-L482 PolarHBondContact O-N 3.18Å; L482-L484 PolarHBondContact O-N 2.81Å; L482-L484 VanDerWaalsContact O-N 3.08Å; L482-A485 VanDerWaalsContact O-CB 3.25Å; L482-A485 WeakPolarHBondContact O-CB 3.31Å; L482-A485 PolarHBondContact O-N 3.38Å; L482-A485 VanDerWaalsContact O-N 3.1Å
483	G	56.6	Low	64.7	Low	8 Å²	8	48 Å²	48	8%	0.082	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-67.1	-3.9	-180	0	0	0	0	0	115.8	F376 L383 D481	F376-G483 WeakPolarHBondContact CE2-O 3.43Å; L383-G483 VanDerWaalsContact CD1-CA 3.42Å; D481-G483 PolarHBondContact O-N 3.06Å
484	L	57.2	Low	62.9	Low	41 Å²	41	53.8 Å²	53.8	22%	0.215	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-106.5	-11.1	175	-56.1	179	0	0	0	112.7	K344 L363 D481 L482 T486 L487	K344-L484 HydrophobicContact CD-CD1 3.59Å; L363-L484 HydrophobicContact CD1-CD2 3.56Å; L363-L484 HydrophobicContact CD2-CD2 3.75Å; L363-L484 HydrophobicContact CG-CD2 4.33Å; D481-L484 PolarHBondContact O-N 2.77Å; L482-L484 PolarHBondContact O-N 2.81Å; L482-L484 VanDerWaalsContact O-N 3.08Å; L484-T486 PolarHBondContact O-N 2.87Å; L484-L487 HydrophobicContact CD2-CD1 3.99Å
485	A	51.3	Low	61.1	Low	3 Å²	3	50.7 Å²	50.7	3%	0.025	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-32.1	179.8	0	0	0	0	0	112.4	H460 R461 L482	H460-A485 WeakPolarHBondContact O-CB 3.47Å; R461-A485 HydrophobicContact CB-CB 4.47Å; R461-A485 PolarHBondContact NE-O 2.85Å; R461-A485 PolarHBondContact NH1-O 3.45Å; L482-A485 VanDerWaalsContact O-CB 3.25Å; L482-A485 WeakPolarHBondContact O-CB 3.31Å; L482-A485 PolarHBondContact O-N 3.38Å; L482-A485 VanDerWaalsContact O-N 3.1Å
486	T	46.9	Very low	58.8	Low	19 Å²	19	54.9 Å²	54.9	12%	0.117	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-35.6	-173.4	64.1	0	0	0	0	113.3	E379 R461 L484 K488 N489	E379-T486 HydrophobicContact CB-CG2 4.16Å; E379-T486 HydrophobicContact CG-CG2 3.87Å; E379-T486 WeakPolarHBondContact OE1-CB 3.49Å; E379-T486 WeakPolarHBondContact OE1-CG2 3.39Å; E379-T486 WeakPolarHBondContact OE2-CB 3.23Å; E379-T486 WeakPolarHBondContact OE2-CG2 3.48Å; E379-T486 PolarHBondContact OE2-OG1 3.31Å; R461-T486 VanDerWaalsContact NH2-CG2 3.34Å; L484-T486 PolarHBondContact O-N 2.87Å; T486-K488 PolarHBondContact O-N 3.15Å; T486-K488 VanDerWaalsContact O-N 3.08Å; T486-N489 WeakPolarHBondContact O-CB 3.36Å; T486-N489 PolarHBondContact O-N 3.2Å; T486-N489 VanDerWaalsContact O-N 3.12Å; T486-N489 PolarHBondContact O-OD1 2.77Å
487	L	45.8	Very low	56.7	Low	44 Å²	44	56.2 Å²	56.2	23%	0.23	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-17.2	175.4	-66.8	176.3	0	0	0	113.5	L363 L368 F376 L484 N489	L363-L487 HydrophobicContact CD1-CD1 3.7Å; L368-L487 HydrophobicContact CD1-CD2 4.01Å; L368-L487 HydrophobicContact CD2-CD2 3.69Å; L368-L487 HydrophobicContact CG-CD2 4.46Å; F376-L487 HydrophobicContact CB-CD2 4.11Å; F376-L487 HydrophobicContact CD2-CD1 3.88Å; F376-L487 HydrophobicContact CD2-CD2 3.59Å; F376-L487 HydrophobicContact CD2-CG 3.75Å; F376-L487 HydrophobicContact CE2-CD1 3.98Å; F376-L487 HydrophobicContact CE2-CD2 4.49Å; F376-L487 HydrophobicContact CE2-CG 4.3Å; F376-L487 HydrophobicContact CG-CD2 4.17Å; L484-L487 HydrophobicContact CD2-CD1 3.99Å; L487-N489 PolarHBondContact O-N 3.48Å
488	K	48.9	Very low	54.4	Low	59 Å²	59	57 Å²	57	26%	0.257	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-17.4	175.1	-73.1	-172.8	174.5	-171.6	0	114.2	D462 T486 K490 I497	D462-K488 IonicContact OD1-NZ 2.81Å; D462-K488 PolarHBondContact OD1-NZ 3.3Å; T486-K488 PolarHBondContact O-N 3.15Å; T486-K488 VanDerWaalsContact O-N 3.08Å; K488-K490 PolarHBondContact O-N 3.01Å; K488-I497 HydrophobicContact CD-CG2 4.46Å; K488-I497 HydrophobicContact CG-CG2 4.46Å
489	N	48.4	Very low	52.2	Low	60 Å²	60	57.2 Å²	57.2	32%	0.321	32%	0.321	S	S	.	.	S	Bend	trans	-73.3	-9.8	-152.7	-93.6	61.7	0	0	0	118.5	R461 T486 L487 Y512	R461-N489 PolarHBondContact NH1-OD1 2.79Å; T486-N489 WeakPolarHBondContact O-CB 3.36Å; T486-N489 PolarHBondContact O-N 3.2Å; T486-N489 VanDerWaalsContact O-N 3.12Å; T486-N489 PolarHBondContact O-OD1 2.77Å; L487-N489 PolarHBondContact O-N 3.48Å; N489-Y512 PolarHBondContact ND2-OH 3.31Å; N489-Y512 PolarHBondContact OD1-OH 2.84Å
490	K	42	Very low	50.5	Low	135 Å²	135	57.7 Å²	57.7	59%	0.587	32%	0.324	S	S	*	.	S	Bend	trans	-153.9	-3.5	-175.2	-137.7	94.4	-158.2	172.7	0	121.1	K488 E510	K488-K490 PolarHBondContact O-N 3.01Å; K490-E510 WeakPolarHBondContact CE-OE1 3.36Å; K490-E510 IonicContact NZ-OE1 2.76Å; K490-E510 PolarHBondContact NZ-OE1 3.09Å; K490-E510 IonicContact NZ-OE2 2.74Å; K490-E510 PolarHBondContact NZ-OE2 2.87Å
491	S	32.8	Very low	49	Very low	63 Å²	63	59 Å²	59	44%	0.441	33%	0.328	S	S	.	.	S	Bend	trans	-124.1	11	-159	37.3	0	0	0	0	119.6	E372	E372-S491 WeakPolarHBondContact OE1-CB 3.46Å; E372-S491 PolarHBondContact OE1-OG 3.5Å
492	F	29.4	Very low	48	Very low	96 Å²	96	57.3 Å²	57.3	42%	0.421	32%	0.319	S	S	.	.			trans	-150.1	50.5	173.6	-114.9	-77.3	0	0	0	116.1	K494 S495 I497	F492-K494 PolarHBondContact O-N 3.29Å; F492-S495 WeakPolarHBondContact CD1-OG 3.48Å; F492-S495 PolarHBondContact O-N 2.95Å; F492-I497 HydrophobicContact CB-CD1 3.41Å; F492-I497 VanDerWaalsContact CB-CD1 3.41Å; F492-I497 HydrophobicContact CB-CG1 4.41Å
493	A	32.4	Very low	47.6	Very low	114 Å²	114	57.4 Å²	57.4	94%	0.942	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	41.7	179	0	0	0	0	0	115.8
494	K	38.6	Very low	47.6	Very low	200 Å²	200	57.1 Å²	57.1	87%	0.87	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-159.7	13.1	172.9	-122.7	158.4	-172.3	158.5	0	113.8	F492	F492-K494 PolarHBondContact O-N 3.29Å
495	S	35.3	Very low	47.8	Very low	68 Å²	68	55.9 Å²	55.9	48%	0.476	31%	0.311	S	S	.	.	S	Bend	trans	-142	151.3	176.4	-57.3	0	0	0	0	109.4	F492 I497	F492-S495 WeakPolarHBondContact CD1-OG 3.48Å; F492-S495 PolarHBondContact O-N 2.95Å; S495-I497 PolarHBondContact O-N 2.96Å
496	V	33.9	Very low	48.5	Very low	111 Å²	111	56.5 Å²	56.5	67%	0.673	31%	0.313	S	S	*	.			trans	-57.5	104.4	-169.8	-174.9	0	0	0	0	111	P541	V496-P541 HydrophobicContact CG2-CG 4.25Å
497	I	49.7	Very low	48.9	Very low	68 Å²	68	57.3 Å²	57.3	35%	0.349	32%	0.316	S	S	.	.			trans	-117.5	131.8	174.9	-80.8	-176.7	0	0	0	108.3	K488 F492 S495	K488-I497 HydrophobicContact CD-CG2 4.46Å; K488-I497 HydrophobicContact CG-CG2 4.46Å; F492-I497 HydrophobicContact CB-CD1 3.41Å; F492-I497 VanDerWaalsContact CB-CD1 3.41Å; F492-I497 HydrophobicContact CB-CG1 4.41Å; S495-I497 PolarHBondContact O-N 2.96Å
498	G	49.9	Very low	49.2	Very low	18 Å²	18	59.3 Å²	59.3	19%	0.186	32%	0.321	C	S	.	.	S	Bend	trans	78.6	178.2	-167.4	0	0	0	0	0	112.5
499	T	51.3	Low	49.6	Very low	26 Å²	26	62.2 Å²	62.2	16%	0.16	34%	0.336	C	S	.	.			trans	-113.5	95.2	-178.8	-58.9	0	0	0	0	104.5	K464 E501 F502 M503 Y533	K464-T499 PolarHBondContact NZ-OG1 3.22Å; T499-E501 WeakPolarHBondContact CG2-OE2 3.32Å; T499-E501 PolarHBondContact O-N 3.14Å; T499-F502 HydrophobicContact CG2-CD2 3.78Å; T499-F502 HydrophobicContact CG2-CE2 4.39Å; T499-F502 PolarHBondContact O-N 2.86Å; T499-M503 PolarHBondContact O-N 2.78Å; T499-Y533 WeakPolarHBondContact CG2-OH 3.32Å
500	P	58.3	Low	49.9	Very low	10 Å²	10	65.9 Å²	65.9	7%	0.065	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-21.3	-159.8	23.8	-35.3	0	0	0	114.1	F502 Y508 P541 I544	P500-F502 VanDerWaalsContact C-N 3.28Å; P500-F502 PolarHBondContact O-N 3.2Å; P500-Y508 WeakPolarHBondContact CB-OH 3.27Å; P500-P541 HydrophobicContact CB-CB 4.26Å; P500-P541 HydrophobicContact CG-CB 3.86Å; P500-P541 HydrophobicContact CG-CG 4.06Å; P500-I544 HydrophobicContact CB-CG2 4.35Å; P500-I544 HydrophobicContact CG-CD1 4.09Å; P500-I544 WeakPolarHBondContact O-CG2 3.42Å
501	E	61.8	Low	50.5	Low	31 Å²	31	66.4 Å²	66.4	15%	0.145	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-23.8	175.6	-50.1	76.4	-171.5	0	0	113	T499 Y533 P534 Y535 I544	T499-E501 WeakPolarHBondContact CG2-OE2 3.32Å; T499-E501 PolarHBondContact O-N 3.14Å; E501-Y533 HydrophobicContact CB-CE1 4.36Å; E501-Y533 HydrophobicContact CG-CD1 4.39Å; E501-Y533 HydrophobicContact CG-CE1 3.86Å; E501-P534 WeakPolarHBondContact CG-O 3.42Å; E501-Y535 HydrophobicContact CB-CD2 4.15Å; E501-I544 HydrophobicContact CG-CD1 3.74Å; E501-I544 VanDerWaalsContact OE1-CD1 3.27Å; E501-I544 WeakPolarHBondContact OE1-CD1 3.48Å
502	F	62.9	Low	52.2	Low	11 Å²	11	65.9 Å²	65.9	5%	0.048	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-4.9	-178.1	-69.6	-105.8	0	0	0	112.7	K464 T499 P500 M523 E527 Y533 P534	K464-F502 HydrophobicContact CB-CD1 3.93Å; K464-F502 HydrophobicContact CB-CE1 4.14Å; K464-F502 HydrophobicContact CB-CG 4.28Å; T499-F502 HydrophobicContact CG2-CD2 3.78Å; T499-F502 HydrophobicContact CG2-CE2 4.39Å; T499-F502 PolarHBondContact O-N 2.86Å; P500-F502 VanDerWaalsContact C-N 3.28Å; P500-F502 PolarHBondContact O-N 3.2Å; F502-M523 HydrophobicContact CD1-CB 3.66Å; F502-M523 HydrophobicContact CE1-CB 3.85Å; F502-M523 HydrophobicContact CG-CB 4.26Å; F502-E527 WeakPolarHBondContact CZ-OE2 3.15Å; F502-Y533 HydrophobicContact CE2-CD2 4.25Å; F502-Y533 HydrophobicContact CE2-CE1 4.43Å; F502-Y533 AromaticContact CE2-CE2 3.53Å; F502-Y533 HydrophobicContact CE2-CE2 3.53Å; F502-Y533 AromaticContact CE2-CZ 3.67Å; F502-Y533 HydrophobicContact CZ-CD2 4.47Å; F502-Y533 AromaticContact CZ-CE2 3.99Å; F502-Y533 HydrophobicContact CZ-CE2 3.99Å; F502-P534 HydrophobicContact CE2-CG 4.31Å; F502-P534 HydrophobicContact CZ-CG 4.04Å
503	M	66.5	Low	54.7	Low	21 Å²	21	63.1 Å²	63.1	10%	0.103	34%	0.335	C	S	.	.			trans	-84.7	126.2	-179.7	-70.2	170.4	67.7	0	0	110.6	T499 M507 Y508 Y519	T499-M503 PolarHBondContact O-N 2.78Å; M503-M507 HydrophobicContact CB-CB 4.25Å; M503-M507 HydrophobicContact CB-CG 4.29Å; M503-M507 HydrophobicContact CE-CB 4.25Å; M503-M507 HydrophobicContact CE-CG 3.63Å; M503-M507 HydrophobicContact CG-CG 4.17Å; M503-Y508 HydrophobicContact CB-CE2 3.88Å; M503-Y508 HydrophobicContact CE-CD1 4.26Å; M503-Y508 HydrophobicContact CE-CD2 4.46Å; M503-Y508 HydrophobicContact CE-CE1 3.83Å; M503-Y508 HydrophobicContact CE-CE2 4.05Å; M503-Y519 WeakPolarHBondContact O-CE1 3.39Å
504	A	57.3	Low	57.3	Low	1 Å²	1	60.9 Å²	60.9	1%	0.008	31%	0.305	C	S	.	.			trans	-63	153.2	169.4	0	0	0	0	0	111	E506 M507 V516 Y519	A504-E506 VanDerWaalsContact C-N 3.27Å; A504-E506 WeakPolarHBondContact CB-OE1 3.49Å; A504-E506 WeakPolarHBondContact CB-OE2 3.26Å; A504-E506 PolarHBondContact O-N 2.94Å; A504-M507 WeakPolarHBondContact O-CB 3.31Å; A504-M507 PolarHBondContact O-N 3.29Å; A504-V516 HydrophobicContact CB-CB 4.48Å; A504-V516 HydrophobicContact CB-CG1 4.21Å; A504-Y519 HydrophobicContact CB-CD1 3.94Å; A504-Y519 HydrophobicContact CB-CD2 4.12Å; A504-Y519 HydrophobicContact CB-CG 3.7Å
505	P	61.3	Low	59.8	Low	16 Å²	16	52 Å²	52	10%	0.104	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-57.5	-36.7	-178.4	20.7	-31.5	0	0	0	113.4	M507 Y508 V548 I549 V577	P505-M507 VanDerWaalsContact C-N 3.31Å; P505-M507 PolarHBondContact O-N 3.46Å; P505-Y508 WeakPolarHBondContact O-CD2 3.35Å; P505-Y508 PolarHBondContact O-N 3.34Å; P505-V548 HydrophobicContact CB-CG1 4.04Å; P505-V548 HydrophobicContact CG-CG1 4.3Å; P505-I549 HydrophobicContact CB-CG1 4.14Å; P505-V577 HydrophobicContact CG-CG1 4.08Å; P505-V577 VanDerWaalsContact CG-O 3.28Å; P505-V577 WeakPolarHBondContact CG-O 3.31Å
506	E	66.1	Low	62.3	Low	16 Å²	16	48.9 Å²	48.9	8%	0.075	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-77.5	-8.1	177.2	77.2	-68.4	169.3	0	0	114.1	A504 Y508 E509 V516 R582	A504-E506 VanDerWaalsContact C-N 3.27Å; A504-E506 WeakPolarHBondContact CB-OE1 3.49Å; A504-E506 WeakPolarHBondContact CB-OE2 3.26Å; A504-E506 PolarHBondContact O-N 2.94Å; E506-Y508 PolarHBondContact O-N 3.41Å; E506-E509 CarbonylContact O-C 3.56Å; E506-E509 WeakPolarHBondContact O-CB 3.23Å; E506-E509 PolarHBondContact O-N 3.17Å; E506-V516 HydrophobicContact CG-CG1 4.45Å; E506-V516 VanDerWaalsContact OE1-CG1 3.3Å; E506-V516 WeakPolarHBondContact OE1-CG1 3.44Å; E506-R582 IonicContact OE1-CZ 2.75Å; E506-R582 IonicContact OE1-NH1 2.9Å; E506-R582 PolarHBondContact OE1-NH1 2.86Å; E506-R582 IonicContact OE1-NH2 3.08Å; E506-R582 PolarHBondContact OE1-NH2 3.3Å; E506-R582 IonicContact OE2-CZ 2.67Å; E506-R582 IonicContact OE2-NH1 2.78Å; E506-R582 IonicContact OE2-NH2 2.71Å; E506-R582 PolarHBondContact OE2-NH2 3.48Å
507	M	54.3	Low	65.1	Low	35 Å²	35	43.6 Å²	43.6	17%	0.172	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-66.8	-14.8	170.5	-173.1	67.1	77.9	0	0	112.1	R461 M503 A504 P505 Y512 V516	R461-M507 HydrophobicContact CB-CE 4.05Å; R461-M507 HydrophobicContact CG-CE 4.15Å; R461-M507 HydrophobicContact CG-SD 4.43Å; M503-M507 HydrophobicContact CB-CB 4.25Å; M503-M507 HydrophobicContact CB-CG 4.29Å; M503-M507 HydrophobicContact CE-CB 4.25Å; M503-M507 HydrophobicContact CE-CG 3.63Å; M503-M507 HydrophobicContact CG-CG 4.17Å; A504-M507 WeakPolarHBondContact O-CB 3.31Å; A504-M507 PolarHBondContact O-N 3.29Å; P505-M507 VanDerWaalsContact C-N 3.31Å; P505-M507 PolarHBondContact O-N 3.46Å; M507-Y512 HydrophobicContact SD-CD1 4.28Å; M507-Y512 HydrophobicContact SD-CG 4.43Å; M507-V516 HydrophobicContact CE-CB 3.53Å; M507-V516 HydrophobicContact CE-CG1 3.72Å; M507-V516 HydrophobicContact CE-CG2 3.62Å
508	Y	53.2	Low	67.3	Low	87 Å²	87	40.6 Å²	40.6	34%	0.341	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-88.8	-7.1	173.5	-60.2	-94.6	0	0	0	112.4	P500 M503 P505 E506 Y545	P500-Y508 WeakPolarHBondContact CB-OH 3.27Å; M503-Y508 HydrophobicContact CB-CE2 3.88Å; M503-Y508 HydrophobicContact CE-CD1 4.26Å; M503-Y508 HydrophobicContact CE-CD2 4.46Å; M503-Y508 HydrophobicContact CE-CE1 3.83Å; M503-Y508 HydrophobicContact CE-CE2 4.05Å; P505-Y508 WeakPolarHBondContact O-CD2 3.35Å; P505-Y508 PolarHBondContact O-N 3.34Å; E506-Y508 PolarHBondContact O-N 3.41Å; Y508-Y545 AromaticContact CD1-CD2 3.74Å; Y508-Y545 HydrophobicContact CD1-CD2 3.74Å; Y508-Y545 AromaticContact CD1-CE2 3.59Å; Y508-Y545 HydrophobicContact CD1-CE2 3.59Å; Y508-Y545 AromaticContact CD2-CD2 3.85Å; Y508-Y545 HydrophobicContact CD2-CD2 3.85Å; Y508-Y545 AromaticContact CD2-CE2 3.78Å; Y508-Y545 HydrophobicContact CD2-CE2 3.78Å; Y508-Y545 AromaticContact CE1-CD2 3.65Å; Y508-Y545 HydrophobicContact CE1-CD2 3.65Å; Y508-Y545 HydrophobicContact CE1-CE2 4.02Å; Y508-Y545 AromaticContact CE2-CD2 3.77Å; Y508-Y545 HydrophobicContact CE2-CD2 3.77Å; Y508-Y545 HydrophobicContact CE2-CE2 4.2Å; Y508-Y545 AromaticContact CG-CD2 3.84Å; Y508-Y545 HydrophobicContact CG-CD2 3.84Å; Y508-Y545 AromaticContact CG-CE2 3.45Å; Y508-Y545 HydrophobicContact CG-CE2 3.45Å; Y508-Y545 VanDerWaalsContact CG-CE2 3.45Å; Y508-Y545 AromaticContact CZ-CD2 3.66Å
509	E	56.5	Low	69.4	Low	120 Å²	120	39.9 Å²	39.9	56%	0.561	19%	0.191	S	C	*	.	S	Bend	trans	-100	145.8	167.2	-61	174.7	-161	0	0	108.1	E506 M511	E506-E509 CarbonylContact O-C 3.56Å; E506-E509 WeakPolarHBondContact O-CB 3.23Å; E506-E509 PolarHBondContact O-N 3.17Å; E509-M511 PolarHBondContact O-N 3.15Å
510	E	53.7	Low	71.5	Confident	136 Å²	136	38.9 Å²	38.9	64%	0.636	19%	0.186	S	C	*	.	S	Bend	trans	-76	8.4	-175.4	-61.5	-165.7	133.5	0	0	114.1	K490	K490-E510 WeakPolarHBondContact CE-OE1 3.36Å; K490-E510 IonicContact NZ-OE1 2.76Å; K490-E510 PolarHBondContact NZ-OE1 3.09Å; K490-E510 IonicContact NZ-OE2 2.74Å; K490-E510 PolarHBondContact NZ-OE2 2.87Å
511	M	56.3	Low	73.3	Confident	147 Å²	147	38.4 Å²	38.4	72%	0.724	18%	0.183	S	C	*	.			trans	-122.4	75	-173.9	-62.8	-170.7	-62.4	0	0	111.5	E509	E509-M511 PolarHBondContact O-N 3.15Å
512	Y	67.6	Low	75	Confident	51 Å²	51	37 Å²	37	20%	0.2	18%	0.176	C	C	.	.			trans	-107.2	158.3	177.2	58.8	-95.9	0	0	0	112.3	I459 R461 N489 M507 V516	I459-Y512 HydrophobicContact CD1-CD2 4.11Å; I459-Y512 HydrophobicContact CD1-CE2 4.1Å; I459-Y512 HydrophobicContact CG2-CD2 4.38Å; R461-Y512 HydrophobicContact CG-CD2 4.28Å; R461-Y512 HydrophobicContact CG-CE2 3.83Å; R461-Y512 PolarHBondContact NH1-OH 3.38Å; N489-Y512 PolarHBondContact ND2-OH 3.31Å; N489-Y512 PolarHBondContact OD1-OH 2.84Å; M507-Y512 HydrophobicContact SD-CD1 4.28Å; M507-Y512 HydrophobicContact SD-CG 4.43Å; Y512-V516 HydrophobicContact CG-CG1 4.47Å
513	D	81.4	Confident	76.6	Confident	38 Å²	38	36.4 Å²	36.4	20%	0.203	17%	0.173	C	C	.	.			trans	-128.7	-164.8	179.4	57.1	46.6	0	0	0	111.5	S515 V516 R579	D513-S515 PolarHBondContact O-N 3.5Å; D513-S515 VanDerWaalsContact O-N 3.15Å; D513-S515 WeakPolarHBondContact OD1-CB 3.19Å; D513-S515 PolarHBondContact OD1-N 3.27Å; D513-S515 PolarHBondContact OD1-OG 3.38Å; D513-V516 WeakPolarHBondContact O-CG2 3.36Å; D513-V516 PolarHBondContact O-N 2.9Å; D513-R579 WeakPolarHBondContact OD2-CD 3.19Å; D513-R579 IonicContact OD2-CZ 3.88Å; D513-R579 IonicContact OD2-NE 3.96Å; D513-R579 IonicContact OD2-NH1 3.7Å; D513-R579 PolarHBondContact OD2-NH1 3.14Å
514	E	87.6	Confident	78	Confident	67 Å²	67	35.4 Å²	35.4	31%	0.313	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-18.8	-179.8	-61.6	88.1	170.6	0	0	114.4	H452 P457 I459 V516 D517	H452-E514 HydrophobicContact CB-CG 3.91Å; H452-E514 VanDerWaalsContact CD2-CG 3.47Å; H452-E514 WeakPolarHBondContact CD2-CG 3.42Å; P457-E514 WeakPolarHBondContact CB-OE1 3.47Å; I459-E514 HydrophobicContact CG1-CG 4.35Å; E514-V516 PolarHBondContact O-N 3.01Å; E514-D517 PolarHBondContact O-N 3.38Å
515	S	90.2	Very high	79.9	Confident	14 Å²	14	35.4 Å²	35.4	10%	0.098	17%	0.168	C	C	.	.	H	α-helix	trans	-71	-14.9	-176.4	73.4	0	0	0	0	114.2	D513 D517 V518 Y519 R579 R582	D513-S515 PolarHBondContact O-N 3.5Å; D513-S515 VanDerWaalsContact O-N 3.15Å; D513-S515 WeakPolarHBondContact OD1-CB 3.19Å; D513-S515 PolarHBondContact OD1-N 3.27Å; D513-S515 PolarHBondContact OD1-OG 3.38Å; S515-D517 VanDerWaalsContact C-N 3.31Å; S515-V518 WeakPolarHBondContact O-CB 3.45Å; S515-V518 PolarHBondContact O-N 3.07Å; S515-Y519 PolarHBondContact O-N 2.87Å; S515-R579 VanDerWaalsContact OG-CB 3.25Å; S515-R579 WeakPolarHBondContact OG-CB 3.36Å; S515-R582 PolarHBondContact O-NH1 3.35Å; S515-R582 VanDerWaalsContact O-NH1 3.11Å; S515-R582 PolarHBondContact OG-NH1 3.41Å
516	V	89.2	Confident	81.5	Confident	3 Å²	3	34.6 Å²	34.6	2%	0.018	16%	0.163	C	C	.	.	H	α-helix	trans	-66.1	-37.1	170.7	-61	0	0	0	0	111.6	I459 A504 E506 M507 Y512 D513 E514 V518 Y519 A520	I459-V516 HydrophobicContact CG2-CG2 3.56Å; A504-V516 HydrophobicContact CB-CB 4.48Å; A504-V516 HydrophobicContact CB-CG1 4.21Å; E506-V516 HydrophobicContact CG-CG1 4.45Å; E506-V516 VanDerWaalsContact OE1-CG1 3.3Å; E506-V516 WeakPolarHBondContact OE1-CG1 3.44Å; M507-V516 HydrophobicContact CE-CB 3.53Å; M507-V516 HydrophobicContact CE-CG1 3.72Å; M507-V516 HydrophobicContact CE-CG2 3.62Å; Y512-V516 HydrophobicContact CG-CG1 4.47Å; D513-V516 WeakPolarHBondContact O-CG2 3.36Å; D513-V516 PolarHBondContact O-N 2.9Å; E514-V516 PolarHBondContact O-N 3.01Å; V516-V518 VanDerWaalsContact C-N 3.28Å; V516-V518 PolarHBondContact O-N 3.41Å; V516-Y519 PolarHBondContact O-N 3.44Å; V516-A520 WeakPolarHBondContact O-CB 3.49Å; V516-A520 PolarHBondContact O-N 3.31Å
517	D	92.6	Very high	82.9	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-73	-26.5	178.6	-63.9	-23.1	0	0	0	110.7	L448 H452 H460 R461 L463 E514 S515 F521	L448-D517 HydrophobicContact CD1-CB 4.18Å; L448-D517 HydrophobicContact CD2-CB 3.93Å; H452-D517 IonicContact CD2-OD2 3.03Å; H452-D517 IonicContact CE1-OD2 3.59Å; H452-D517 IonicContact NE2-OD2 3.48Å; H452-D517 PolarHBondContact NE2-OD2 3.24Å; H460-D517 WeakPolarHBondContact CB-OD1 3.31Å; H460-D517 PolarHBondContact N-OD1 3Å; H460-D517 PolarHBondContact N-OD2 2.9Å; R461-D517 PolarHBondContact N-OD1 3.38Å; L463-D517 WeakPolarHBondContact CD2-O 3.43Å; E514-D517 PolarHBondContact O-N 3.38Å; S515-D517 VanDerWaalsContact C-N 3.31Å; D517-F521 VanDerWaalsContact O-CB 3.23Å; D517-F521 WeakPolarHBondContact O-CB 3.46Å; D517-F521 PolarHBondContact O-N 3.27Å
518	V	95.1	Very high	84.7	Confident	5 Å²	5	33.1 Å²	33.1	3%	0.03	16%	0.156	C	C	.	.	H	α-helix	trans	-67.7	-48.1	170.2	171.2	0	0	0	0	111.1	S515 V516 A520 F521 G522 C574 R582 S583 V585 L588	S515-V518 WeakPolarHBondContact O-CB 3.45Å; S515-V518 PolarHBondContact O-N 3.07Å; V516-V518 VanDerWaalsContact C-N 3.28Å; V516-V518 PolarHBondContact O-N 3.41Å; V518-A520 VanDerWaalsContact C-N 3.34Å; V518-A520 PolarHBondContact O-N 2.84Å; V518-F521 WeakPolarHBondContact O-CB 3.46Å; V518-F521 PolarHBondContact O-N 3.23Å; V518-G522 PolarHBondContact O-N 2.87Å; V518-C574 HydrophobicContact CG1-CB 4.19Å; V518-R582 HydrophobicContact CG1-CB 4.21Å; V518-S583 WeakPolarHBondContact CG1-O 3.44Å; V518-V585 HydrophobicContact CG2-CG2 3.72Å; V518-L588 HydrophobicContact CG1-CD1 4.23Å
519	Y	94.9	Very high	86.7	Confident	3 Å²	3	30.3 Å²	30.3	1%	0.012	15%	0.147	C	C	.	.	H	α-helix	trans	-58.3	-48.6	176.2	-176.9	-83.8	0	0	0	111	M503 A504 S515 V516 F521 G522 M523 C574 I575	M503-Y519 WeakPolarHBondContact O-CE1 3.39Å; A504-Y519 HydrophobicContact CB-CD1 3.94Å; A504-Y519 HydrophobicContact CB-CD2 4.12Å; A504-Y519 HydrophobicContact CB-CG 3.7Å; S515-Y519 PolarHBondContact O-N 2.87Å; V516-Y519 PolarHBondContact O-N 3.44Å; Y519-F521 VanDerWaalsContact C-N 3.34Å; Y519-F521 PolarHBondContact O-N 3.28Å; Y519-G522 WeakPolarHBondContact O-CA 3.39Å; Y519-G522 PolarHBondContact O-N 2.78Å; Y519-G522 VanDerWaalsContact O-N 3.09Å; Y519-M523 HydrophobicContact CD1-CG 4.32Å; Y519-M523 HydrophobicContact CE1-CE 3.71Å; Y519-M523 HydrophobicContact CE1-CG 4Å; Y519-M523 HydrophobicContact CE2-CE 4.31Å; Y519-M523 VanDerWaalsContact CZ-CE 3.5Å; Y519-M523 PolarHBondContact O-N 2.69Å; Y519-M523 WeakPolarHBondContact OH-CE 3.41Å; Y519-C574 WeakPolarHBondContact CA-O 3.33Å; Y519-I575 HydrophobicContact CD2-CB 4.31Å; Y519-I575 HydrophobicContact CE2-CB 4.08Å
520	A	94.5	Very high	88.3	Confident	5 Å²	5	26 Å²	26	4%	0.041	13%	0.129	C	C	.	.	H	α-helix	trans	-63.8	-35.7	177.7	0	0	0	0	0	112.8	L463 V516 V518 M523 C524	L463-A520 HydrophobicContact CB-CB 3.84Å; L463-A520 HydrophobicContact CD2-CB 4.29Å; L463-A520 HydrophobicContact CG-CB 4.48Å; L463-A520 WeakPolarHBondContact O-CB 3.34Å; V516-A520 WeakPolarHBondContact O-CB 3.49Å; V516-A520 PolarHBondContact O-N 3.31Å; V518-A520 VanDerWaalsContact C-N 3.34Å; V518-A520 PolarHBondContact O-N 2.84Å; A520-M523 PolarHBondContact O-N 2.79Å; A520-C524 PolarHBondContact O-N 3.48Å; A520-C524 PolarHBondContact O-SG 2.87Å
521	F	97.2	Very high	90.1	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.6	-41.9	170.3	166.7	-97.4	0	0	0	111.8	C441 I444 L445 L448 L463 D517 V518 Y519 M523 C524 L525 L588 F594	C441-F521 HydrophobicContact CB-CE2 4.06Å; C441-F521 HydrophobicContact CB-CZ 4.07Å; I444-F521 HydrophobicContact CB-CD2 4.31Å; I444-F521 HydrophobicContact CB-CE2 4.36Å; I444-F521 HydrophobicContact CG2-CD2 3.8Å; I444-F521 HydrophobicContact CG2-CE2 4.34Å; L445-F521 HydrophobicContact CD1-CE1 4.18Å; L445-F521 HydrophobicContact CD1-CE2 4.26Å; L445-F521 HydrophobicContact CD1-CZ 3.71Å; L445-F521 HydrophobicContact CD2-CD1 3.95Å; L445-F521 HydrophobicContact CD2-CD2 4.17Å; L445-F521 HydrophobicContact CD2-CE1 3.8Å; L445-F521 HydrophobicContact CD2-CE2 4.02Å; L445-F521 HydrophobicContact CD2-CG 4.14Å; L445-F521 HydrophobicContact CD2-CZ 3.83Å; L445-F521 HydrophobicContact CG-CD2 4.31Å; L445-F521 HydrophobicContact CG-CE1 4.15Å; L445-F521 HydrophobicContact CG-CE2 3.75Å; L445-F521 HydrophobicContact CG-CZ 3.66Å; L448-F521 HydrophobicContact CD1-CB 4.25Å; L463-F521 HydrophobicContact CD2-CB 4.12Å; D517-F521 VanDerWaalsContact O-CB 3.23Å; D517-F521 WeakPolarHBondContact O-CB 3.46Å; D517-F521 PolarHBondContact O-N 3.27Å; V518-F521 WeakPolarHBondContact O-CB 3.46Å; V518-F521 PolarHBondContact O-N 3.23Å; Y519-F521 VanDerWaalsContact C-N 3.34Å; Y519-F521 PolarHBondContact O-N 3.28Å; F521-M523 VanDerWaalsContact C-N 3.33Å; F521-M523 PolarHBondContact O-N 3.3Å; F521-C524 WeakPolarHBondContact O-CB 3.49Å; F521-C524 PolarHBondContact O-N 3.12Å; F521-L525 HydrophobicContact CE1-CD2 4.44Å; F521-L525 WeakPolarHBondContact O-CB 3.23Å; F521-L525 PolarHBondContact O-N 3.25Å; F521-L588 HydrophobicContact CD1-CD1 4.16Å; F521-L588 HydrophobicContact CE1-CD1 4.18Å; F521-F594 HydrophobicContact CZ-CZ 4.05Å
522	G	96.6	Very high	91.8	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-57.4	-43.5	173.4	0	0	0	0	0	112.7	V518 Y519 L525 L526	V518-G522 PolarHBondContact O-N 2.87Å; Y519-G522 WeakPolarHBondContact O-CA 3.39Å; Y519-G522 PolarHBondContact O-N 2.78Å; Y519-G522 VanDerWaalsContact O-N 3.09Å; G522-L525 PolarHBondContact O-N 3.44Å; G522-L526 PolarHBondContact O-N 3.17Å
523	M	95.6	Very high	92.8	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-68.4	-37.3	175.3	-66.1	-57.5	-177.5	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 3.85Å; F502-M523 HydrophobicContact CG-CB 4.26Å; Y519-M523 HydrophobicContact CD1-CG 4.32Å; Y519-M523 HydrophobicContact CE1-CE 3.71Å; Y519-M523 HydrophobicContact CE1-CG 4Å; Y519-M523 HydrophobicContact CE2-CE 4.31Å; Y519-M523 VanDerWaalsContact CZ-CE 3.5Å; Y519-M523 PolarHBondContact O-N 2.69Å; Y519-M523 WeakPolarHBondContact OH-CE 3.41Å; A520-M523 PolarHBondContact O-N 2.79Å; F521-M523 VanDerWaalsContact C-N 3.33Å; F521-M523 PolarHBondContact O-N 3.3Å; M523-L526 PolarHBondContact O-N 3.34Å; M523-L526 HydrophobicContact SD-CD2 4.2Å; M523-E527 PolarHBondContact O-N 2.86Å; M523-P534 HydrophobicContact CB-CG 4.29Å; M523-P534 HydrophobicContact SD-CB 3.97Å; M523-P534 HydrophobicContact SD-CG 4.27Å; M523-Y535 HydrophobicContact CE-CE2 3.75Å; M523-P554 HydrophobicContact SD-CG 4.44Å; M523-I575 HydrophobicContact CE-CB 4.11Å; M523-I575 HydrophobicContact CE-CD1 4.37Å; M523-I575 HydrophobicContact CE-CG2 3.85Å; M523-I575 HydrophobicContact CG-CG2 4.34Å; M523-I575 HydrophobicContact SD-CG2 4.06Å
524	C	96.7	Very high	93.4	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-63.2	-40.2	172	-65.1	0	0	0	0	112.2	K464 I468 A520 F521 M528	K464-C524 VanDerWaalsContact CA-SG 3.5Å; I468-C524 HydrophobicContact CD1-CB 4.39Å; A520-C524 PolarHBondContact O-N 3.48Å; A520-C524 PolarHBondContact O-SG 2.87Å; F521-C524 WeakPolarHBondContact O-CB 3.49Å; F521-C524 PolarHBondContact O-N 3.12Å; C524-M528 WeakPolarHBondContact O-CB 3.33Å; C524-M528 WeakPolarHBondContact O-CG 3.21Å; C524-M528 PolarHBondContact O-N 3.37Å
525	L	96.3	Very high	93.6	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-65.6	-40.9	175.8	176.4	56.6	0	0	0	111.2	L437 F521 G522 M528 V529 I567 I570 I571	L437-L525 HydrophobicContact CD1-CD1 4.14Å; L437-L525 HydrophobicContact CD2-CD1 4.31Å; L437-L525 HydrophobicContact CG-CD1 4.37Å; F521-L525 HydrophobicContact CE1-CD2 4.44Å; F521-L525 WeakPolarHBondContact O-CB 3.23Å; F521-L525 PolarHBondContact O-N 3.25Å; G522-L525 PolarHBondContact O-N 3.44Å; L525-M528 PolarHBondContact O-N 2.91Å; L525-V529 HydrophobicContact CD1-CG2 3.85Å; L525-V529 HydrophobicContact CG-CG2 4.49Å; L525-V529 WeakPolarHBondContact O-CB 3.25Å; L525-V529 WeakPolarHBondContact O-CG2 2.95Å; L525-V529 PolarHBondContact O-N 3.17Å; L525-I567 HydrophobicContact CD1-CG2 4.37Å; L525-I567 HydrophobicContact CG-CG2 4.45Å; L525-I570 HydrophobicContact CD2-CG2 3.76Å; L525-I571 HydrophobicContact CB-CG1 4.19Å; L525-I571 HydrophobicContact CD2-CD1 4.43Å; L525-I571 HydrophobicContact CD2-CG1 3.68Å; L525-I571 HydrophobicContact CG-CD1 4Å; L525-I571 HydrophobicContact CG-CG1 3.68Å
526	L	95.5	Very high	93.7	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61.7	-47.5	174.3	-179	62.2	0	0	0	112.4	G522 M523 M528 V529 T530 P534 P554 I560 I571	G522-L526 PolarHBondContact O-N 3.17Å; M523-L526 PolarHBondContact O-N 3.34Å; M523-L526 HydrophobicContact SD-CD2 4.2Å; L526-M528 VanDerWaalsContact C-N 3.33Å; L526-M528 PolarHBondContact O-N 2.65Å; L526-V529 PolarHBondContact O-N 3.35Å; L526-T530 HydrophobicContact CD1-CG2 3.79Å; L526-T530 WeakPolarHBondContact O-CB 3.11Å; L526-T530 WeakPolarHBondContact O-CG2 3.37Å; L526-T530 PolarHBondContact O-N 2.94Å; L526-T530 PolarHBondContact O-OG1 2.66Å; L526-P534 HydrophobicContact CD2-CB 4.47Å; L526-P534 HydrophobicContact CD2-CG 4.4Å; L526-P554 HydrophobicContact CD2-CG 3.46Å; L526-P554 VanDerWaalsContact CD2-CG 3.46Å; L526-I560 HydrophobicContact CD1-CD1 3.94Å; L526-I560 HydrophobicContact CD1-CG1 3.9Å; L526-I571 HydrophobicContact CB-CD1 4.14Å; L526-I571 HydrophobicContact CB-CG2 4.36Å; L526-I571 HydrophobicContact CD1-CD1 4.2Å
527	E	95	Very high	93.7	Very high	14 Å²	14	20.2 Å²	20.2	7%	0.065	12%	0.116	C	C	.	.	H	α-helix	trans	-60.3	-41.9	175.8	-164.7	-169.8	167.5	0	0	111.1	L426 C465 F502 M523 V529 G531 P534	L426-E527 HydrophobicContact CD1-CG 4.01Å; C465-E527 WeakPolarHBondContact CB-OE2 3.48Å; C465-E527 PolarHBondContact SG-OE2 3.23Å; F502-E527 WeakPolarHBondContact CZ-OE2 3.15Å; M523-E527 PolarHBondContact O-N 2.86Å; E527-V529 VanDerWaalsContact C-N 3.34Å; E527-V529 PolarHBondContact O-N 3.14Å; E527-G531 VanDerWaalsContact O-CA 3.31Å; E527-G531 WeakPolarHBondContact O-CA 3.49Å; E527-G531 PolarHBondContact O-N 2.99Å; E527-P534 HydrophobicContact CB-CG 4.47Å
528	M	93.7	Very high	93.5	Very high	5 Å²	5	21 Å²	21	3%	0.025	12%	0.121	C	C	.	.	H	α-helix	trans	-65.3	-31.6	177.7	-82.9	-168.1	-76	0	0	114.8	L422 L426 I432 L437 C441 I444 C524 L525 L526	L422-M528 HydrophobicContact CD1-CG 3.93Å; L422-M528 HydrophobicContact CD1-SD 3.83Å; L422-M528 HydrophobicContact CD2-CE 4.12Å; L422-M528 HydrophobicContact CD2-CG 3.81Å; L422-M528 HydrophobicContact CD2-SD 3.55Å; L422-M528 VanDerWaalsContact CD2-SD 3.55Å; L422-M528 HydrophobicContact CG-CG 4.11Å; L422-M528 HydrophobicContact CG-SD 4.21Å; L426-M528 HydrophobicContact CD1-CG 4.21Å; I432-M528 HydrophobicContact CD1-CB 4.02Å; I432-M528 HydrophobicContact CD1-CG 3.81Å; I432-M528 HydrophobicContact CD1-SD 4.16Å; L437-M528 HydrophobicContact CD1-CB 3.56Å; L437-M528 HydrophobicContact CD1-CE 4.19Å; L437-M528 HydrophobicContact CD1-CG 4.24Å; L437-M528 HydrophobicContact CD1-SD 3.73Å; C441-M528 WeakPolarHBondContact SG-CE 3.2Å; I444-M528 HydrophobicContact CD1-CE 4.21Å; C524-M528 WeakPolarHBondContact O-CB 3.33Å; C524-M528 WeakPolarHBondContact O-CG 3.21Å; C524-M528 PolarHBondContact O-N 3.37Å; L525-M528 PolarHBondContact O-N 2.91Å; L526-M528 VanDerWaalsContact C-N 3.33Å; L526-M528 PolarHBondContact O-N 2.65Å
529	V	93.6	Very high	93	Very high	28 Å²	28	29.8 Å²	29.8	17%	0.17	16%	0.164	C	C	.	.	H	α-helix	trans	-87.8	-39	-174.6	168.9	0	0	0	0	111.7	L437 L525 L526 E527 I560 I567	L437-V529 HydrophobicContact CD1-CG2 4.39Å; L437-V529 HydrophobicContact CD2-CG2 3.63Å; L525-V529 HydrophobicContact CD1-CG2 3.85Å; L525-V529 HydrophobicContact CG-CG2 4.49Å; L525-V529 WeakPolarHBondContact O-CB 3.25Å; L525-V529 WeakPolarHBondContact O-CG2 2.95Å; L525-V529 PolarHBondContact O-N 3.17Å; L526-V529 PolarHBondContact O-N 3.35Å; E527-V529 VanDerWaalsContact C-N 3.34Å; E527-V529 PolarHBondContact O-N 3.14Å; V529-I560 HydrophobicContact CG1-CG2 4.14Å; V529-I567 HydrophobicContact CB-CG2 4.48Å; V529-I567 HydrophobicContact CG1-CG2 4.21Å; V529-I567 HydrophobicContact CG2-CD1 4.35Å; V529-I567 HydrophobicContact CG2-CG2 3.65Å
530	T	91.5	Very high	92.3	Very high	30 Å²	30	32.9 Å²	32.9	18%	0.184	18%	0.181	C	C	.	.	H	α-helix	trans	-86.5	-32	-179.7	58.9	0	0	0	0	112.3	L526 E532 C556	L526-T530 HydrophobicContact CD1-CG2 3.79Å; L526-T530 WeakPolarHBondContact O-CB 3.11Å; L526-T530 WeakPolarHBondContact O-CG2 3.37Å; L526-T530 PolarHBondContact O-N 2.94Å; L526-T530 PolarHBondContact O-OG1 2.66Å; T530-E532 PolarHBondContact OG1-N 3.36Å; T530-E532 VanDerWaalsContact OG1-N 3.09Å; T530-E532 PolarHBondContact OG1-O 3.12Å; T530-C556 HydrophobicContact CG2-CB 4.08Å; T530-C556 WeakPolarHBondContact CG2-O 3.47Å
531	G	91	Very high	91.6	Very high	40 Å²	40	35.4 Å²	35.4	41%	0.412	20%	0.196	S	C	.	.	S	Bend	trans	72.8	9.6	-165.2	0	0	0	0	0	113.3	E527	E527-G531 VanDerWaalsContact O-CA 3.31Å; E527-G531 WeakPolarHBondContact O-CA 3.49Å; E527-G531 PolarHBondContact O-N 2.99Å
532	E	91	Very high	90.6	Very high	70 Å²	70	37.7 Å²	37.7	33%	0.327	22%	0.215	S	C	.	.	S	Bend	trans	-117.2	146.3	-176.7	-61.1	-174	143.5	0	0	110.5	T530 C556 R559	T530-E532 PolarHBondContact OG1-N 3.36Å; T530-E532 VanDerWaalsContact OG1-N 3.09Å; T530-E532 PolarHBondContact OG1-O 3.12Å; E532-C556 HydrophobicContact CB-CB 4.3Å; E532-R559 IonicContact OE1-NH1 2.87Å; E532-R559 PolarHBondContact OE1-NH1 2.66Å; E532-R559 WeakPolarHBondContact OE2-CD 3.49Å; E532-R559 IonicContact OE2-CZ 3.66Å; E532-R559 IonicContact OE2-NE 3.53Å; E532-R559 IonicContact OE2-NH1 2.59Å; E532-R559 PolarHBondContact OE2-NH1 2.89Å
533	Y	90.4	Very high	90.2	Very high	79 Å²	79	39.4 Å²	39.4	31%	0.31	23%	0.226	S	C	.	.			trans	-75.1	130.5	-178.5	-160.7	-115.1	0	0	0	110.4	T499 E501 F502 S536	T499-Y533 WeakPolarHBondContact CG2-OH 3.32Å; E501-Y533 HydrophobicContact CB-CE1 4.36Å; E501-Y533 HydrophobicContact CG-CD1 4.39Å; E501-Y533 HydrophobicContact CG-CE1 3.86Å; F502-Y533 HydrophobicContact CE2-CD2 4.25Å; F502-Y533 HydrophobicContact CE2-CE1 4.43Å; F502-Y533 AromaticContact CE2-CE2 3.53Å; F502-Y533 HydrophobicContact CE2-CE2 3.53Å; F502-Y533 AromaticContact CE2-CZ 3.67Å; F502-Y533 HydrophobicContact CZ-CD2 4.47Å; F502-Y533 AromaticContact CZ-CE2 3.99Å; F502-Y533 HydrophobicContact CZ-CE2 3.99Å; Y533-S536 VanDerWaalsContact O-CB 3.26Å; Y533-S536 WeakPolarHBondContact O-CB 3.08Å; Y533-S536 PolarHBondContact O-N 3.23Å; Y533-S536 PolarHBondContact O-OG 3.01Å
534	P	92.7	Very high	89.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	140.9	176.3	-26.5	35.4	0	0	0	112	E501 F502 M523 L526 E527 S536	E501-P534 WeakPolarHBondContact CG-O 3.42Å; F502-P534 HydrophobicContact CE2-CG 4.31Å; F502-P534 HydrophobicContact CZ-CG 4.04Å; M523-P534 HydrophobicContact CB-CG 4.29Å; M523-P534 HydrophobicContact SD-CB 3.97Å; M523-P534 HydrophobicContact SD-CG 4.27Å; L526-P534 HydrophobicContact CD2-CB 4.47Å; L526-P534 HydrophobicContact CD2-CG 4.4Å; E527-P534 HydrophobicContact CB-CG 4.47Å; P534-S536 PolarHBondContact O-N 2.92Å; P534-S536 VanDerWaalsContact O-N 3.12Å
535	Y	92.8	Very high	89	Confident	6 Å²	6	44.1 Å²	44.1	2%	0.024	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	22.1	-177.2	-59.2	-73.7	0	0	0	116	E501 M523 E537 C538 I544 K547 V548 V552 P554	E501-Y535 HydrophobicContact CB-CD2 4.15Å; M523-Y535 HydrophobicContact CE-CE2 3.75Å; Y535-E537 WeakPolarHBondContact CA-OE2 3.07Å; Y535-E537 PolarHBondContact O-N 3.47Å; Y535-C538 VanDerWaalsContact O-CB 3.23Å; Y535-C538 WeakPolarHBondContact O-CB 3.44Å; Y535-C538 PolarHBondContact O-N 3.4Å; Y535-I544 HydrophobicContact CD2-CG2 3.91Å; Y535-I544 HydrophobicContact CE2-CG2 4.39Å; Y535-I544 HydrophobicContact CG-CG2 4.05Å; Y535-K547 HydrophobicContact CD1-CD 3.96Å; Y535-K547 HydrophobicContact CE1-CB 4.06Å; Y535-K547 HydrophobicContact CE1-CD 4.07Å; Y535-V548 HydrophobicContact CE1-CG2 4.46Å; Y535-V548 HydrophobicContact CE2-CG2 3.7Å; Y535-V548 WeakPolarHBondContact OH-CG2 3.41Å; Y535-V552 WeakPolarHBondContact CE1-O 3.22Å; Y535-V552 PolarHBondContact OH-O 2.96Å; Y535-P554 HydrophobicContact CD1-CB 3.64Å; Y535-P554 HydrophobicContact CD2-CB 4.1Å; Y535-P554 HydrophobicContact CE1-CB 3.74Å; Y535-P554 HydrophobicContact CE1-CG 4.35Å; Y535-P554 HydrophobicContact CE2-CB 4.22Å; Y535-P554 HydrophobicContact CE2-CG 4.36Å; Y535-P554 HydrophobicContact CG-CB 3.83Å
536	S	91	Very high	88.5	Confident	76 Å²	76	50.9 Å²	50.9	53%	0.531	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-14.3	178.1	43.7	0	0	0	0	114.7	Y533 P534 C538	Y533-S536 VanDerWaalsContact O-CB 3.26Å; Y533-S536 WeakPolarHBondContact O-CB 3.08Å; Y533-S536 PolarHBondContact O-N 3.23Å; Y533-S536 PolarHBondContact O-OG 3.01Å; P534-S536 PolarHBondContact O-N 2.92Å; P534-S536 VanDerWaalsContact O-N 3.12Å; S536-C538 PolarHBondContact O-N 2.89Å
537	E	90.7	Very high	88.3	Confident	64 Å²	64	53.1 Å²	53.1	30%	0.299	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-3	168.3	76.9	-77.2	-178	0	0	114.2	Y535 K547 E555	Y535-E537 WeakPolarHBondContact CA-OE2 3.07Å; Y535-E537 PolarHBondContact O-N 3.47Å; E537-K547 IonicContact OE1-NZ 3.99Å; E537-K547 PolarHBondContact OE1-NZ 3.47Å; E537-E555 HydrophobicContact CG-CB 4.2Å; E537-E555 PolarHBondContact OE1-N 3.26Å
538	C	88.3	Confident	87.9	Confident	16 Å²	16	52.7 Å²	52.7	11%	0.108	28%	0.278	C	S	.	.			trans	-108	113.6	-175	-55.9	0	0	0	0	112.4	Y535 S536 N540 T543 I544 K547	Y535-C538 VanDerWaalsContact O-CB 3.23Å; Y535-C538 WeakPolarHBondContact O-CB 3.44Å; Y535-C538 PolarHBondContact O-N 3.4Å; S536-C538 PolarHBondContact O-N 2.89Å; C538-N540 VanDerWaalsContact C-N 3.25Å; C538-N540 PolarHBondContact O-N 3.44Å; C538-T543 HydrophobicContact CB-CG2 4.11Å; C538-I544 HydrophobicContact CB-CD1 4.18Å; C538-I544 HydrophobicContact CB-CG1 3.47Å; C538-I544 VanDerWaalsContact CB-CG1 3.47Å; C538-K547 PolarHBondContact SG-NZ 3.09Å
539	M	84.6	Confident	87.4	Confident	190 Å²	190	56.3 Å²	56.3	94%	0.936	30%	0.297	S	S	*	.	S	Bend	trans	-69.8	-9.8	-177.9	-60.6	-178.8	74.6	0	0	115.8
540	N	79.2	Confident	87.1	Confident	67 Å²	67	58.7 Å²	58.7	36%	0.358	32%	0.315	S	S	.	.	S	Bend	trans	-154.7	153.1	-178.3	68.6	78.3	0	0	0	113.9	C538 A542 T543 I544	C538-N540 VanDerWaalsContact C-N 3.25Å; C538-N540 PolarHBondContact O-N 3.44Å; N540-A542 VanDerWaalsContact C-N 3.27Å; N540-A542 PolarHBondContact O-N 3.35Å; N540-A542 WeakPolarHBondContact OD1-CB 3.36Å; N540-A542 PolarHBondContact OD1-N 3.35Å; N540-A542 VanDerWaalsContact OD1-N 3.1Å; N540-T543 PolarHBondContact ND2-OG1 3.35Å; N540-T543 PolarHBondContact O-N 3.03Å; N540-T543 VanDerWaalsContact O-N 3.15Å; N540-T543 PolarHBondContact OD1-N 3.05Å; N540-T543 PolarHBondContact OD1-OG1 2.95Å; N540-I544 PolarHBondContact O-N 2.94Å
541	P	79.3	Confident	86.9	Confident	58 Å²	58	59 Å²	59	38%	0.377	32%	0.323	S	S	.	.	H	α-helix	trans	-52.1	-36.1	177.6	-31.7	37.5	0	0	0	115.6	V496 P500 T543 I544 Y545	V496-P541 HydrophobicContact CG2-CG 4.25Å; P500-P541 HydrophobicContact CB-CB 4.26Å; P500-P541 HydrophobicContact CG-CB 3.86Å; P500-P541 HydrophobicContact CG-CG 4.06Å; P541-T543 PolarHBondContact O-N 3.44Å; P541-I544 WeakPolarHBondContact O-CB 3.34Å; P541-I544 PolarHBondContact O-N 3.32Å; P541-Y545 WeakPolarHBondContact O-CB 3.12Å; P541-Y545 PolarHBondContact O-N 3.12Å
542	A	77.9	Confident	86.9	Confident	48 Å²	48	60.3 Å²	60.3	40%	0.397	32%	0.323	S	S	.	.	H	α-helix	trans	-72	-30.5	-177.2	0	0	0	0	0	112.4	N540 R546	N540-A542 VanDerWaalsContact C-N 3.27Å; N540-A542 PolarHBondContact O-N 3.35Å; N540-A542 WeakPolarHBondContact OD1-CB 3.36Å; N540-A542 PolarHBondContact OD1-N 3.35Å; N540-A542 VanDerWaalsContact OD1-N 3.1Å; A542-R546 WeakPolarHBondContact O-CG 3.18Å; A542-R546 PolarHBondContact O-N 2.76Å; A542-R546 VanDerWaalsContact O-N 3.1Å; A542-R546 PolarHBondContact O-NH1 2.89Å
543	T	87.9	Confident	87	Confident	37 Å²	37	60.7 Å²	60.7	23%	0.227	32%	0.324	C	S	.	.	H	α-helix	trans	-68.3	-39.1	170.9	-61.9	0	0	0	0	111.6	C538 N540 P541 R546 K547	C538-T543 HydrophobicContact CB-CG2 4.11Å; N540-T543 PolarHBondContact ND2-OG1 3.35Å; N540-T543 PolarHBondContact O-N 3.03Å; N540-T543 VanDerWaalsContact O-N 3.15Å; N540-T543 PolarHBondContact OD1-N 3.05Å; N540-T543 PolarHBondContact OD1-OG1 2.95Å; P541-T543 PolarHBondContact O-N 3.44Å; T543-R546 PolarHBondContact OG1-NH2 3.24Å; T543-K547 PolarHBondContact O-N 3.12Å; T543-K547 VanDerWaalsContact O-N 3.1Å
544	I	85.9	Confident	87.2	Confident	2 Å²	2	57 Å²	57	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-63.9	-51.8	175.7	-60.6	158.5	0	0	0	109.7	P500 E501 Y535 C538 N540 P541 R546 K547 V548	P500-I544 HydrophobicContact CB-CG2 4.35Å; P500-I544 HydrophobicContact CG-CD1 4.09Å; P500-I544 WeakPolarHBondContact O-CG2 3.42Å; E501-I544 HydrophobicContact CG-CD1 3.74Å; E501-I544 VanDerWaalsContact OE1-CD1 3.27Å; E501-I544 WeakPolarHBondContact OE1-CD1 3.48Å; Y535-I544 HydrophobicContact CD2-CG2 3.91Å; Y535-I544 HydrophobicContact CE2-CG2 4.39Å; Y535-I544 HydrophobicContact CG-CG2 4.05Å; C538-I544 HydrophobicContact CB-CD1 4.18Å; C538-I544 HydrophobicContact CB-CG1 3.47Å; C538-I544 VanDerWaalsContact CB-CG1 3.47Å; N540-I544 PolarHBondContact O-N 2.94Å; P541-I544 WeakPolarHBondContact O-CB 3.34Å; P541-I544 PolarHBondContact O-N 3.32Å; I544-R546 VanDerWaalsContact C-N 3.34Å; I544-R546 PolarHBondContact O-N 3.38Å; I544-K547 WeakPolarHBondContact O-CB 3.44Å; I544-K547 PolarHBondContact O-N 2.82Å; I544-K547 VanDerWaalsContact O-N 3.08Å; I544-V548 HydrophobicContact CG2-CG2 4.07Å; I544-V548 VanDerWaalsContact O-CG2 3.31Å; I544-V548 WeakPolarHBondContact O-CG2 3.42Å; I544-V548 PolarHBondContact O-N 3.37Å
545	Y	81.4	Confident	87.2	Confident	96 Å²	96	61.3 Å²	61.3	38%	0.376	33%	0.33	S	S	.	.	H	α-helix	trans	-51.6	-47.9	175.9	177.4	-111.4	0	0	0	112.8	Y508 P541 V548 I549	Y508-Y545 AromaticContact CD1-CD2 3.74Å; Y508-Y545 HydrophobicContact CD1-CD2 3.74Å; Y508-Y545 AromaticContact CD1-CE2 3.59Å; Y508-Y545 HydrophobicContact CD1-CE2 3.59Å; Y508-Y545 AromaticContact CD2-CD2 3.85Å; Y508-Y545 HydrophobicContact CD2-CD2 3.85Å; Y508-Y545 AromaticContact CD2-CE2 3.78Å; Y508-Y545 HydrophobicContact CD2-CE2 3.78Å; Y508-Y545 AromaticContact CE1-CD2 3.65Å; Y508-Y545 HydrophobicContact CE1-CD2 3.65Å; Y508-Y545 HydrophobicContact CE1-CE2 4.02Å; Y508-Y545 AromaticContact CE2-CD2 3.77Å; Y508-Y545 HydrophobicContact CE2-CD2 3.77Å; Y508-Y545 HydrophobicContact CE2-CE2 4.2Å; Y508-Y545 AromaticContact CG-CD2 3.84Å; Y508-Y545 HydrophobicContact CG-CD2 3.84Å; Y508-Y545 AromaticContact CG-CE2 3.45Å; Y508-Y545 HydrophobicContact CG-CE2 3.45Å; Y508-Y545 VanDerWaalsContact CG-CE2 3.45Å; Y508-Y545 AromaticContact CZ-CD2 3.66Å; P541-Y545 WeakPolarHBondContact O-CB 3.12Å; P541-Y545 PolarHBondContact O-N 3.12Å; Y545-V548 PolarHBondContact O-N 3.08Å; Y545-I549 HydrophobicContact CD1-CD1 4.16Å; Y545-I549 HydrophobicContact CD2-CD1 3.83Å; Y545-I549 HydrophobicContact CE1-CD1 3.72Å; Y545-I549 HydrophobicContact CE2-CD1 3.36Å; Y545-I549 HydrophobicContact CE2-CG1 4.35Å; Y545-I549 HydrophobicContact CG-CD1 4.22Å; Y545-I549 WeakPolarHBondContact O-CG1 3.18Å; Y545-I549 PolarHBondContact O-N 2.68Å; Y545-I549 VanDerWaalsContact O-N 3.11Å
546	R	85.4	Confident	87.2	Confident	143 Å²	143	61.1 Å²	61.1	54%	0.54	33%	0.329	S	S	.	.	H	α-helix	trans	-59.9	-46.8	175.6	-74.7	-170.7	-55.9	-79.5	-1.5	112.5	A542 T543 I544 S550	A542-R546 WeakPolarHBondContact O-CG 3.18Å; A542-R546 PolarHBondContact O-N 2.76Å; A542-R546 VanDerWaalsContact O-N 3.1Å; A542-R546 PolarHBondContact O-NH1 2.89Å; T543-R546 PolarHBondContact OG1-NH2 3.24Å; I544-R546 VanDerWaalsContact C-N 3.34Å; I544-R546 PolarHBondContact O-N 3.38Å; R546-S550 WeakPolarHBondContact O-CB 3.32Å; R546-S550 PolarHBondContact O-N 3.43Å; R546-S550 PolarHBondContact O-OG 3.04Å; R546-S550 VanDerWaalsContact O-OG 3.14Å
547	K	90.1	Very high	87.3	Confident	47 Å²	47	58.4 Å²	58.4	20%	0.204	31%	0.308	C	S	.	.	H	α-helix	trans	-60.7	-46.7	177.3	-83.7	-173.5	169.1	174.4	0	112.5	Y535 E537 C538 T543 I544 I549 S550 G551 V552	Y535-K547 HydrophobicContact CD1-CD 3.96Å; Y535-K547 HydrophobicContact CE1-CB 4.06Å; Y535-K547 HydrophobicContact CE1-CD 4.07Å; E537-K547 IonicContact OE1-NZ 3.99Å; E537-K547 PolarHBondContact OE1-NZ 3.47Å; C538-K547 PolarHBondContact SG-NZ 3.09Å; T543-K547 PolarHBondContact O-N 3.12Å; T543-K547 VanDerWaalsContact O-N 3.1Å; I544-K547 WeakPolarHBondContact O-CB 3.44Å; I544-K547 PolarHBondContact O-N 2.82Å; I544-K547 VanDerWaalsContact O-N 3.08Å; K547-I549 PolarHBondContact O-N 3.48Å; K547-S550 CarbonylContact O-C 3.54Å; K547-S550 PolarHBondContact O-N 3.11Å; K547-S550 PolarHBondContact O-OG 2.68Å; K547-G551 PolarHBondContact O-N 3.24Å; K547-G551 VanDerWaalsContact O-N 3.14Å; K547-V552 HydrophobicContact CB-CB 4.06Å; K547-V552 HydrophobicContact CB-CG1 4.34Å; K547-V552 HydrophobicContact CD-CG1 3.98Å; K547-V552 HydrophobicContact CG-CB 4Å; K547-V552 HydrophobicContact CG-CG1 3.84Å; K547-V552 PolarHBondContact O-N 2.98Å
548	V	87	Confident	87.4	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.024	32%	0.323	C	S	.	.	H	α-helix	trans	-61.3	-45.2	-177.1	169.3	0	0	0	0	111	P505 Y535 I544 Y545 G551	P505-V548 HydrophobicContact CB-CG1 4.04Å; P505-V548 HydrophobicContact CG-CG1 4.3Å; Y535-V548 HydrophobicContact CE1-CG2 4.46Å; Y535-V548 HydrophobicContact CE2-CG2 3.7Å; Y535-V548 WeakPolarHBondContact OH-CG2 3.41Å; I544-V548 HydrophobicContact CG2-CG2 4.07Å; I544-V548 VanDerWaalsContact O-CG2 3.31Å; I544-V548 WeakPolarHBondContact O-CG2 3.42Å; I544-V548 PolarHBondContact O-N 3.37Å; Y545-V548 PolarHBondContact O-N 3.08Å; V548-G551 PolarHBondContact O-N 2.79Å
549	I	84.9	Confident	87.5	Confident	82 Å²	82	64.6 Å²	64.6	42%	0.421	34%	0.34	S	S	.	.	H	α-helix	trans	-68.1	-41.9	176.5	-66.1	168.8	0	0	0	111.2	P505 Y545 K547 G551	P505-I549 HydrophobicContact CB-CG1 4.14Å; Y545-I549 HydrophobicContact CD1-CD1 4.16Å; Y545-I549 HydrophobicContact CD2-CD1 3.83Å; Y545-I549 HydrophobicContact CE1-CD1 3.72Å; Y545-I549 HydrophobicContact CE2-CD1 3.36Å; Y545-I549 HydrophobicContact CE2-CG1 4.35Å; Y545-I549 HydrophobicContact CG-CD1 4.22Å; Y545-I549 WeakPolarHBondContact O-CG1 3.18Å; Y545-I549 PolarHBondContact O-N 2.68Å; Y545-I549 VanDerWaalsContact O-N 3.11Å; K547-I549 PolarHBondContact O-N 3.48Å; I549-G551 PolarHBondContact O-N 2.8Å; I549-G551 VanDerWaalsContact O-N 3.12Å
550	S	86	Confident	87.8	Confident	78 Å²	78	56.2 Å²	56.2	55%	0.545	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	10.4	179	77.8	0	0	0	0	114.2	R546 K547 V552	R546-S550 WeakPolarHBondContact O-CB 3.32Å; R546-S550 PolarHBondContact O-N 3.43Å; R546-S550 PolarHBondContact O-OG 3.04Å; R546-S550 VanDerWaalsContact O-OG 3.14Å; K547-S550 CarbonylContact O-C 3.54Å; K547-S550 PolarHBondContact O-N 3.11Å; K547-S550 PolarHBondContact O-OG 2.68Å; S550-V552 PolarHBondContact O-N 2.94Å; S550-V552 VanDerWaalsContact O-N 3.13Å; S550-V552 WeakPolarHBondContact OG-CG2 3.4Å
551	G	86.6	Confident	88.3	Confident	35 Å²	35	55 Å²	55	36%	0.361	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	11.5	-179.8	0	0	0	0	0	115.9	K547 V548 I549 K553	K547-G551 PolarHBondContact O-N 3.24Å; K547-G551 VanDerWaalsContact O-N 3.14Å; V548-G551 PolarHBondContact O-N 2.79Å; I549-G551 PolarHBondContact O-N 2.8Å; I549-G551 VanDerWaalsContact O-N 3.12Å; G551-K553 PolarHBondContact O-N 3.21Å; G551-K553 VanDerWaalsContact O-N 3.07Å
552	V	91.7	Very high	88.5	Confident	68 Å²	68	56.7 Å²	56.7	41%	0.412	31%	0.313	S	S	.	.			trans	-77.2	98.6	178.7	173.7	0	0	0	0	108.5	Y535 K547 S550	Y535-V552 WeakPolarHBondContact CE1-O 3.22Å; Y535-V552 PolarHBondContact OH-O 2.96Å; K547-V552 HydrophobicContact CB-CB 4.06Å; K547-V552 HydrophobicContact CB-CG1 4.34Å; K547-V552 HydrophobicContact CD-CG1 3.98Å; K547-V552 HydrophobicContact CG-CB 4Å; K547-V552 HydrophobicContact CG-CG1 3.84Å; K547-V552 PolarHBondContact O-N 2.98Å; S550-V552 PolarHBondContact O-N 2.94Å; S550-V552 VanDerWaalsContact O-N 3.13Å; S550-V552 WeakPolarHBondContact OG-CG2 3.4Å
553	K	94.1	Very high	88.7	Confident	79 Å²	79	60.3 Å²	60.3	34%	0.343	32%	0.322	S	S	.	.			trans	-58.7	150.1	177.7	-67.7	166.2	-175	167.8	0	110.9	G551 F557 D572 I575	G551-K553 PolarHBondContact O-N 3.21Å; G551-K553 VanDerWaalsContact O-N 3.07Å; K553-F557 HydrophobicContact CB-CB 4.39Å; K553-F557 HydrophobicContact CB-CD1 4.25Å; K553-F557 HydrophobicContact CB-CG 4.35Å; K553-F557 HydrophobicContact CD-CD1 4.07Å; K553-F557 HydrophobicContact CD-CE1 3.87Å; K553-F557 HydrophobicContact CD-CZ 4.21Å; K553-D572 IonicContact NZ-OD1 3.21Å; K553-D572 PolarHBondContact NZ-OD1 3.24Å; K553-D572 IonicContact NZ-OD2 2.75Å; K553-D572 PolarHBondContact NZ-OD2 2.69Å; K553-I575 HydrophobicContact CB-CD1 4.45Å; K553-I575 HydrophobicContact CD-CD1 4.36Å; K553-I575 HydrophobicContact CG-CD1 3.98Å
554	P	93.5	Very high	88.4	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.013	33%	0.325	C	S	.	.			trans	-64.1	149.2	-178.2	27.8	-36	0	0	0	111.4	M523 L526 Y535 C556 F557	M523-P554 HydrophobicContact SD-CG 4.44Å; L526-P554 HydrophobicContact CD2-CG 3.46Å; L526-P554 VanDerWaalsContact CD2-CG 3.46Å; Y535-P554 HydrophobicContact CD1-CB 3.64Å; Y535-P554 HydrophobicContact CD2-CB 4.1Å; Y535-P554 HydrophobicContact CE1-CB 3.74Å; Y535-P554 HydrophobicContact CE1-CG 4.35Å; Y535-P554 HydrophobicContact CE2-CB 4.22Å; Y535-P554 HydrophobicContact CE2-CG 4.36Å; Y535-P554 HydrophobicContact CG-CB 3.83Å; P554-C556 PolarHBondContact O-N 3.06Å; P554-C556 VanDerWaalsContact O-N 3.14Å; P554-F557 HydrophobicContact CG-CB 4.38Å; P554-F557 WeakPolarHBondContact O-CB 3.35Å; P554-F557 PolarHBondContact O-N 3.29Å
555	E	92.9	Very high	88.3	Confident	90 Å²	90	65.8 Å²	65.8	42%	0.421	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-57.2	-37.9	-173.2	-160.6	-160.5	128.1	0	0	112.8	E537 F557 S558 R559	E537-E555 HydrophobicContact CG-CB 4.2Å; E537-E555 PolarHBondContact OE1-N 3.26Å; E555-F557 PolarHBondContact O-N 3.4Å; E555-F557 VanDerWaalsContact O-N 3.12Å; E555-S558 WeakPolarHBondContact O-CB 3.46Å; E555-S558 PolarHBondContact O-N 2.83Å; E555-S558 PolarHBondContact O-OG 2.88Å; E555-R559 IonicContact OE1-CZ 2.72Å; E555-R559 IonicContact OE1-NE 2.81Å; E555-R559 PolarHBondContact OE1-NE 3.21Å; E555-R559 IonicContact OE1-NH2 3.46Å; E555-R559 PolarHBondContact OE1-NH2 2.81Å; E555-R559 IonicContact OE2-NH2 2.78Å
556	C	92.8	Very high	88.5	Confident	2 Å²	2	63 Å²	63	1%	0.014	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-64.3	-14.2	178.6	63.5	0	0	0	0	114.4	T530 E532 P554 S558 R559	T530-C556 HydrophobicContact CG2-CB 4.08Å; T530-C556 WeakPolarHBondContact CG2-O 3.47Å; E532-C556 HydrophobicContact CB-CB 4.3Å; P554-C556 PolarHBondContact O-N 3.06Å; P554-C556 VanDerWaalsContact O-N 3.14Å; C556-S558 PolarHBondContact O-N 2.84Å; C556-R559 WeakPolarHBondContact O-CB 3.38Å; C556-R559 PolarHBondContact O-N 3.26Å
557	F	93.8	Very high	88.8	Confident	19 Å²	19	56.2 Å²	56.2	8%	0.083	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-61.7	-31.3	168.6	-177.7	-100.1	0	0	0	112.3	K553 P554 E555 R559 I560 R568 I571 D572 I575	K553-F557 HydrophobicContact CB-CB 4.39Å; K553-F557 HydrophobicContact CB-CD1 4.25Å; K553-F557 HydrophobicContact CB-CG 4.35Å; K553-F557 HydrophobicContact CD-CD1 4.07Å; K553-F557 HydrophobicContact CD-CE1 3.87Å; K553-F557 HydrophobicContact CD-CZ 4.21Å; P554-F557 HydrophobicContact CG-CB 4.38Å; P554-F557 WeakPolarHBondContact O-CB 3.35Å; P554-F557 PolarHBondContact O-N 3.29Å; E555-F557 PolarHBondContact O-N 3.4Å; E555-F557 VanDerWaalsContact O-N 3.12Å; F557-R559 VanDerWaalsContact C-N 3.25Å; F557-R559 PolarHBondContact O-N 2.85Å; F557-I560 HydrophobicContact CD2-CD1 3.67Å; F557-I560 HydrophobicContact CE2-CD1 4Å; F557-I560 HydrophobicContact CG-CD1 4.27Å; F557-I560 WeakPolarHBondContact O-CD1 3.45Å; F557-I560 WeakPolarHBondContact O-CG1 3.46Å; F557-R568 HydrophobicContact CE1-CG 4.44Å; F557-R568 HydrophobicContact CE2-CG 4.19Å; F557-R568 HydrophobicContact CZ-CG 3.88Å; F557-I571 HydrophobicContact CD2-CG2 3.85Å; F557-I571 HydrophobicContact CE2-CB 4.21Å; F557-I571 HydrophobicContact CE2-CG2 3.81Å; F557-D572 HydrophobicContact CE2-CB 4.37Å; F557-D572 HydrophobicContact CZ-CB 4.06Å; F557-D572 WeakPolarHBondContact CZ-OD1 3.4Å; F557-I575 HydrophobicContact CD2-CD1 4.06Å; F557-I575 HydrophobicContact CE2-CD1 4.29Å
558	S	92.1	Very high	88.9	Confident	89 Å²	89	60.7 Å²	60.7	62%	0.622	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-71.9	-19.6	172.8	71.5	0	0	0	0	113.4	E555 C556	E555-S558 WeakPolarHBondContact O-CB 3.46Å; E555-S558 PolarHBondContact O-N 2.83Å; E555-S558 PolarHBondContact O-OG 2.88Å; C556-S558 PolarHBondContact O-N 2.84Å
559	R	91	Very high	89.1	Confident	120 Å²	120	63 Å²	63	45%	0.453	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-93.5	3	-174.8	-54.3	178	-176.3	-174.6	-2	113.1	E532 E555 C556 F557	E532-R559 IonicContact OE1-NH1 2.87Å; E532-R559 PolarHBondContact OE1-NH1 2.66Å; E532-R559 WeakPolarHBondContact OE2-CD 3.49Å; E532-R559 IonicContact OE2-CZ 3.66Å; E532-R559 IonicContact OE2-NE 3.53Å; E532-R559 IonicContact OE2-NH1 2.59Å; E532-R559 PolarHBondContact OE2-NH1 2.89Å; E555-R559 IonicContact OE1-CZ 2.72Å; E555-R559 IonicContact OE1-NE 2.81Å; E555-R559 PolarHBondContact OE1-NE 3.21Å; E555-R559 IonicContact OE1-NH2 3.46Å; E555-R559 PolarHBondContact OE1-NH2 2.81Å; E555-R559 IonicContact OE2-NH2 2.78Å; C556-R559 WeakPolarHBondContact O-CB 3.38Å; C556-R559 PolarHBondContact O-N 3.26Å; F557-R559 VanDerWaalsContact C-N 3.25Å; F557-R559 PolarHBondContact O-N 2.85Å
560	I	91.3	Very high	89.5	Confident	14 Å²	14	59.1 Å²	59.1	7%	0.072	32%	0.32	C	S	.	.	S	Bend	trans	-59.5	127	174.2	-64.4	166.9	0	0	0	108.9	L526 V529 F557 A562 R568 I571	L526-I560 HydrophobicContact CD1-CD1 3.94Å; L526-I560 HydrophobicContact CD1-CG1 3.9Å; V529-I560 HydrophobicContact CG1-CG2 4.14Å; F557-I560 HydrophobicContact CD2-CD1 3.67Å; F557-I560 HydrophobicContact CE2-CD1 4Å; F557-I560 HydrophobicContact CG-CD1 4.27Å; F557-I560 WeakPolarHBondContact O-CD1 3.45Å; F557-I560 WeakPolarHBondContact O-CG1 3.46Å; I560-A562 PolarHBondContact O-N 3.11Å; I560-R568 HydrophobicContact CD1-CB 4.08Å; I560-R568 HydrophobicContact CD1-CG 4.03Å; I560-R568 HydrophobicContact CG2-CB 4.06Å; I560-I571 HydrophobicContact CD1-CD1 3.69Å; I560-I571 HydrophobicContact CG1-CD1 4.42Å
561	P	87.8	Confident	90	Very high	41 Å²	41	55.4 Å²	55.4	27%	0.266	29%	0.294	S	S	.	.			trans	-62.1	126.4	-173.6	-24.2	33.9	0	0	0	113.1	Q563 Y564	P561-Q563 VanDerWaalsContact CB-CD 3.47Å; P561-Q563 VanDerWaalsContact CB-NE2 3.31Å; P561-Q563 VanDerWaalsContact CB-OE1 3.23Å; P561-Q563 PolarHBondContact O-N 3.4Å; P561-Y564 HydrophobicContact CB-CD2 4.43Å; P561-Y564 PolarHBondContact O-N 2.98Å
562	A	84.9	Confident	90.3	Very high	94 Å²	94	55.6 Å²	55.6	78%	0.777	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-16	-173.5	0	0	0	0	0	114.9	I560 Y564	I560-A562 PolarHBondContact O-N 3.11Å; A562-Y564 PolarHBondContact O-N 3.14Å
563	Q	80.9	Confident	90.4	Very high	125 Å²	125	52.9 Å²	52.9	58%	0.584	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-4.3	172.2	74.3	-86.2	9.7	0	0	114.9	P561	P561-Q563 VanDerWaalsContact CB-CD 3.47Å; P561-Q563 VanDerWaalsContact CB-NE2 3.31Å; P561-Q563 VanDerWaalsContact CB-OE1 3.23Å; P561-Q563 PolarHBondContact O-N 3.4Å
564	Y	83.1	Confident	90.5	Very high	74 Å²	74	49.1 Å²	49.1	29%	0.29	25%	0.253	S	S	.	.			trans	-129.7	60.5	178.3	-55.9	-54	0	0	0	112.2	I434 P561 A562 E566 I567	I434-Y564 HydrophobicContact CD1-CD1 4.48Å; I434-Y564 HydrophobicContact CD1-CE1 4.34Å; I434-Y564 HydrophobicContact CG1-CE1 4.11Å; P561-Y564 HydrophobicContact CB-CD2 4.43Å; P561-Y564 PolarHBondContact O-N 2.98Å; A562-Y564 PolarHBondContact O-N 3.14Å; Y564-E566 VanDerWaalsContact C-OE2 3.28Å; Y564-E566 WeakPolarHBondContact CA-OE2 3.18Å; Y564-E566 PolarHBondContact O-N 3.08Å; Y564-I567 HydrophobicContact CD2-CD1 4.17Å; Y564-I567 HydrophobicContact CG-CD1 3.91Å; Y564-I567 WeakPolarHBondContact O-CB 3.42Å; Y564-I567 PolarHBondContact O-N 3.47Å; Y564-I567 VanDerWaalsContact O-N 3.11Å
565	P	84	Confident	90.5	Very high	80 Å²	80	49.5 Å²	49.5	52%	0.519	26%	0.255	S	S	.	.	H	α-helix	trans	-58.8	-31.5	-179	26.7	-35.3	0	0	0	112.6	I567 R568 E569	P565-I567 VanDerWaalsContact C-N 3.26Å; P565-I567 PolarHBondContact O-N 3.22Å; P565-R568 WeakPolarHBondContact O-CB 3.45Å; P565-R568 PolarHBondContact O-N 3.42Å; P565-R568 VanDerWaalsContact O-N 3.12Å; P565-E569 PolarHBondContact O-N 3.46Å
566	E	85.5	Confident	90.4	Very high	37 Å²	37	46.8 Å²	46.8	17%	0.173	24%	0.241	C	C	.	.	H	α-helix	trans	-66.2	-27.7	179.4	76.7	-79	-163.9	0	0	112.8	Y564 I570 F593	Y564-E566 VanDerWaalsContact C-OE2 3.28Å; Y564-E566 WeakPolarHBondContact CA-OE2 3.18Å; Y564-E566 PolarHBondContact O-N 3.08Å; E566-I570 WeakPolarHBondContact O-CB 3.18Å; E566-I570 WeakPolarHBondContact O-CD1 3.31Å; E566-I570 WeakPolarHBondContact O-CG1 3.37Å; E566-I570 PolarHBondContact O-N 3.11Å; E566-F593 HydrophobicContact CG-CB 4.23Å; E566-F593 HydrophobicContact CG-CD2 3.35Å; E566-F593 HydrophobicContact CG-CE2 4.03Å; E566-F593 HydrophobicContact CG-CG 4.09Å; E566-F593 WeakPolarHBondContact OE1-CD2 3.46Å
567	I	91.8	Very high	90.1	Very high	1 Å²	1	49 Å²	49	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-69	-42.4	173	-64.2	-178.8	0	0	0	110.4	I434 L437 L525 V529 Y564 P565 E569 I570 I571 F593	I434-I567 HydrophobicContact CD1-CD1 3.83Å; L437-I567 HydrophobicContact CD2-CD1 3.98Å; L525-I567 HydrophobicContact CD1-CG2 4.37Å; L525-I567 HydrophobicContact CG-CG2 4.45Å; V529-I567 HydrophobicContact CB-CG2 4.48Å; V529-I567 HydrophobicContact CG1-CG2 4.21Å; V529-I567 HydrophobicContact CG2-CD1 4.35Å; V529-I567 HydrophobicContact CG2-CG2 3.65Å; Y564-I567 HydrophobicContact CD2-CD1 4.17Å; Y564-I567 HydrophobicContact CG-CD1 3.91Å; Y564-I567 WeakPolarHBondContact O-CB 3.42Å; Y564-I567 PolarHBondContact O-N 3.47Å; Y564-I567 VanDerWaalsContact O-N 3.11Å; P565-I567 VanDerWaalsContact C-N 3.26Å; P565-I567 PolarHBondContact O-N 3.22Å; I567-E569 VanDerWaalsContact C-N 3.33Å; I567-I570 PolarHBondContact O-N 3.5Å; I567-I571 HydrophobicContact CG2-CD1 3.81Å; I567-I571 HydrophobicContact CG2-CG1 4.43Å; I567-I571 VanDerWaalsContact O-CG1 3.31Å; I567-I571 WeakPolarHBondContact O-CG1 3.33Å; I567-I571 PolarHBondContact O-N 2.91Å; I567-F593 HydrophobicContact CD1-CE2 3.76Å; I567-F593 HydrophobicContact CD1-CZ 3.54Å; I567-F593 HydrophobicContact CG1-CD2 4.19Å; I567-F593 HydrophobicContact CG1-CE1 4.12Å; I567-F593 HydrophobicContact CG1-CE2 3.38Å; I567-F593 HydrophobicContact CG1-CZ 3.36Å
568	R	91.8	Very high	89.6	Confident	141 Å²	141	53.2 Å²	53.2	53%	0.532	27%	0.27	S	S	.	.	H	α-helix	trans	-61.9	-44	177.9	-177	178.8	177.3	-152.5	-2	110.8	F557 I560 P565 I571 D572	F557-R568 HydrophobicContact CE1-CG 4.44Å; F557-R568 HydrophobicContact CE2-CG 4.19Å; F557-R568 HydrophobicContact CZ-CG 3.88Å; I560-R568 HydrophobicContact CD1-CB 4.08Å; I560-R568 HydrophobicContact CD1-CG 4.03Å; I560-R568 HydrophobicContact CG2-CB 4.06Å; P565-R568 WeakPolarHBondContact O-CB 3.45Å; P565-R568 PolarHBondContact O-N 3.42Å; P565-R568 VanDerWaalsContact O-N 3.12Å; R568-I571 PolarHBondContact O-N 3.47Å; R568-D572 WeakPolarHBondContact O-CB 3.38Å; R568-D572 PolarHBondContact O-N 3.5Å
569	E	90.7	Very high	89.3	Confident	51 Å²	51	53.7 Å²	53.7	24%	0.238	26%	0.258	C	S	.	.	H	α-helix	trans	-59.7	-46.9	175	-169.8	-164.9	111.5	0	0	112.3	P565 I567 D572 R573 R609	P565-E569 PolarHBondContact O-N 3.46Å; I567-E569 VanDerWaalsContact C-N 3.33Å; E569-D572 WeakPolarHBondContact O-CB 3.48Å; E569-D572 PolarHBondContact O-N 2.86Å; E569-R573 PolarHBondContact O-N 3.15Å; E569-R573 IonicContact OE1-CZ 3.47Å; E569-R573 IonicContact OE1-NH1 2.77Å; E569-R573 PolarHBondContact OE1-NH1 3.22Å; E569-R573 IonicContact OE1-NH2 2.75Å; E569-R609 IonicContact OE1-CZ 3.7Å; E569-R609 IonicContact OE1-NE 2.69Å; E569-R609 IonicContact OE1-NH2 3.88Å; E569-R609 PolarHBondContact OE1-NH2 2.89Å; E569-R609 IonicContact OE2-CZ 2.76Å; E569-R609 IonicContact OE2-NE 2.73Å; E569-R609 PolarHBondContact OE2-NE 3.03Å; E569-R609 IonicContact OE2-NH2 3.79Å; E569-R609 PolarHBondContact OE2-NH2 2.78Å
570	I	93.6	Very high	89.1	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-63.7	-44.8	177.8	-71.2	162.5	0	0	0	111.5	L525 E566 I567 D572 C574 L588 F593 F594	L525-I570 HydrophobicContact CD2-CG2 3.76Å; E566-I570 WeakPolarHBondContact O-CB 3.18Å; E566-I570 WeakPolarHBondContact O-CD1 3.31Å; E566-I570 WeakPolarHBondContact O-CG1 3.37Å; E566-I570 PolarHBondContact O-N 3.11Å; I567-I570 PolarHBondContact O-N 3.5Å; I570-D572 VanDerWaalsContact C-N 3.33Å; I570-C574 PolarHBondContact O-N 3.5Å; I570-C574 PolarHBondContact O-SG 3.43Å; I570-L588 HydrophobicContact CG2-CD2 4.16Å; I570-F593 HydrophobicContact CD1-CB 3.38Å; I570-F593 HydrophobicContact CD1-CD1 3.74Å; I570-F593 HydrophobicContact CD1-CG 3.69Å; I570-F594 HydrophobicContact CD1-CE2 3.95Å; I570-F594 HydrophobicContact CD1-CZ 4.38Å; I570-F594 HydrophobicContact CG2-CE2 3.95Å; I570-F594 HydrophobicContact CG2-CZ 4.17Å
571	I	95.6	Very high	88.9	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-60.5	-46.1	175.4	-67	164.7	0	0	0	109.6	L525 L526 F557 I560 I567 R568 R573 C574 I575	L525-I571 HydrophobicContact CB-CG1 4.19Å; L525-I571 HydrophobicContact CD2-CD1 4.43Å; L525-I571 HydrophobicContact CD2-CG1 3.68Å; L525-I571 HydrophobicContact CG-CD1 4Å; L525-I571 HydrophobicContact CG-CG1 3.68Å; L526-I571 HydrophobicContact CB-CD1 4.14Å; L526-I571 HydrophobicContact CB-CG2 4.36Å; L526-I571 HydrophobicContact CD1-CD1 4.2Å; F557-I571 HydrophobicContact CD2-CG2 3.85Å; F557-I571 HydrophobicContact CE2-CB 4.21Å; F557-I571 HydrophobicContact CE2-CG2 3.81Å; I560-I571 HydrophobicContact CD1-CD1 3.69Å; I560-I571 HydrophobicContact CG1-CD1 4.42Å; I567-I571 HydrophobicContact CG2-CD1 3.81Å; I567-I571 HydrophobicContact CG2-CG1 4.43Å; I567-I571 VanDerWaalsContact O-CG1 3.31Å; I567-I571 WeakPolarHBondContact O-CG1 3.33Å; I567-I571 PolarHBondContact O-N 2.91Å; R568-I571 PolarHBondContact O-N 3.47Å; I571-R573 PolarHBondContact O-N 3.42Å; I571-C574 WeakPolarHBondContact O-CA 3.44Å; I571-C574 WeakPolarHBondContact O-CB 3.1Å; I571-C574 PolarHBondContact O-N 3.45Å; I571-I575 HydrophobicContact CG2-CD1 3.95Å; I571-I575 HydrophobicContact CG2-CG1 4.33Å; I571-I575 HydrophobicContact CG2-CG2 4.21Å; I571-I575 WeakPolarHBondContact O-CG1 3.35Å; I571-I575 PolarHBondContact O-N 3.09Å
572	D	93.5	Very high	89.1	Confident	40 Å²	40	53.6 Å²	53.6	21%	0.214	26%	0.258	C	S	.	.	H	α-helix	trans	-54.2	-52.1	180	-160.8	96.2	0	0	0	111.8	K553 F557 R568 E569 I570 C574 I575 R576	K553-D572 IonicContact NZ-OD1 3.21Å; K553-D572 PolarHBondContact NZ-OD1 3.24Å; K553-D572 IonicContact NZ-OD2 2.75Å; K553-D572 PolarHBondContact NZ-OD2 2.69Å; F557-D572 HydrophobicContact CE2-CB 4.37Å; F557-D572 HydrophobicContact CZ-CB 4.06Å; F557-D572 WeakPolarHBondContact CZ-OD1 3.4Å; R568-D572 WeakPolarHBondContact O-CB 3.38Å; R568-D572 PolarHBondContact O-N 3.5Å; E569-D572 WeakPolarHBondContact O-CB 3.48Å; E569-D572 PolarHBondContact O-N 2.86Å; I570-D572 VanDerWaalsContact C-N 3.33Å; D572-C574 PolarHBondContact O-N 3Å; D572-I575 PolarHBondContact O-N 3.36Å; D572-R576 WeakPolarHBondContact O-CG 3.42Å; D572-R576 PolarHBondContact O-N 3.39Å; D572-R576 IonicContact OD2-NE 3.53Å
573	R	93.1	Very high	89.4	Confident	11 Å²	11	49.4 Å²	49.4	4%	0.042	22%	0.223	C	C	.	.	H	α-helix	trans	-67.3	-12.2	176.7	-61.8	-166.4	-55.7	-118.1	-14.1	114.5	E569 I571 R582 S583 D591 D689	E569-R573 PolarHBondContact O-N 3.15Å; E569-R573 IonicContact OE1-CZ 3.47Å; E569-R573 IonicContact OE1-NH1 2.77Å; E569-R573 PolarHBondContact OE1-NH1 3.22Å; E569-R573 IonicContact OE1-NH2 2.75Å; I571-R573 PolarHBondContact O-N 3.42Å; R573-R582 CarbonylContact O-C 3.15Å; R573-R582 VanDerWaalsContact O-CA 3.26Å; R573-R582 WeakPolarHBondContact O-CA 3.42Å; R573-S583 WeakPolarHBondContact CB-OG 3.22Å; R573-S583 PolarHBondContact NE-OG 3.49Å; R573-S583 PolarHBondContact O-N 2.83Å; R573-D591 IonicContact CZ-OD2 3.62Å; R573-D591 IonicContact NH2-OD2 3.7Å; R573-D591 PolarHBondContact NH2-OD2 2.98Å; R573-D689 WeakPolarHBondContact CD-OD1 3.41Å; R573-D689 IonicContact NH1-OD1 2.82Å; R573-D689 PolarHBondContact NH1-OD1 2.96Å; R573-D689 IonicContact NH1-OD2 2.73Å
574	C	95.9	Very high	90	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-89.9	-38.7	171.7	-65.2	0	0	0	0	112	V518 Y519 I570 I571 D572 R582	V518-C574 HydrophobicContact CG1-CB 4.19Å; Y519-C574 WeakPolarHBondContact CA-O 3.33Å; I570-C574 PolarHBondContact O-N 3.5Å; I570-C574 PolarHBondContact O-SG 3.43Å; I571-C574 WeakPolarHBondContact O-CA 3.44Å; I571-C574 WeakPolarHBondContact O-CB 3.1Å; I571-C574 PolarHBondContact O-N 3.45Å; D572-C574 PolarHBondContact O-N 3Å; C574-R582 WeakPolarHBondContact O-CD 3.27Å
575	I	94.3	Very high	90.5	Very high	9 Å²	9	43.8 Å²	43.8	5%	0.046	21%	0.205	C	C	.	.	S	Bend	trans	-96.8	17.1	-170.9	73.1	174.5	0	0	0	114.6	Y519 M523 K553 F557 I571 D572	Y519-I575 HydrophobicContact CD2-CB 4.31Å; Y519-I575 HydrophobicContact CE2-CB 4.08Å; M523-I575 HydrophobicContact CE-CB 4.11Å; M523-I575 HydrophobicContact CE-CD1 4.37Å; M523-I575 HydrophobicContact CE-CG2 3.85Å; M523-I575 HydrophobicContact CG-CG2 4.34Å; M523-I575 HydrophobicContact SD-CG2 4.06Å; K553-I575 HydrophobicContact CB-CD1 4.45Å; K553-I575 HydrophobicContact CD-CD1 4.36Å; K553-I575 HydrophobicContact CG-CD1 3.98Å; F557-I575 HydrophobicContact CD2-CD1 4.06Å; F557-I575 HydrophobicContact CE2-CD1 4.29Å; I571-I575 HydrophobicContact CG2-CD1 3.95Å; I571-I575 HydrophobicContact CG2-CG1 4.33Å; I571-I575 HydrophobicContact CG2-CG2 4.21Å; I571-I575 WeakPolarHBondContact O-CG1 3.35Å; I571-I575 PolarHBondContact O-N 3.09Å; D572-I575 PolarHBondContact O-N 3.36Å
576	R	91.6	Very high	90.9	Very high	34 Å²	34	47 Å²	47	13%	0.128	21%	0.211	C	C	.	.			trans	-62.2	144.5	176.1	-59.6	-170	174.4	164.6	-18.6	111.5	D572 E581 R582 H692	D572-R576 WeakPolarHBondContact O-CG 3.42Å; D572-R576 PolarHBondContact O-N 3.39Å; D572-R576 IonicContact OD2-NE 3.53Å; R576-E581 HydrophobicContact CB-CB 4.33Å; R576-E581 WeakPolarHBondContact CD-O 3.4Å; R576-E581 PolarHBondContact NH1-O 3.5Å; R576-R582 HydrophobicContact CB-CG 4.19Å; R576-R582 PolarHBondContact O-NE 3.19Å; R576-R582 PolarHBondContact O-NH2 3.09Å; R576-H692 VanDerWaalsContact CZ-ND1 3.31Å; R576-H692 PolarHBondContact NH1-CD2 3.24Å; R576-H692 VanDerWaalsContact NH1-CG 3.3Å; R576-H692 PolarHBondContact NH1-ND1 2.86Å; R576-H692 PolarHBondContact NH2-CE1 3.1Å; R576-H692 VanDerWaalsContact NH2-CE1 3.35Å; R576-H692 PolarHBondContact NH2-ND1 3.26Å
577	V	86.2	Confident	91.1	Very high	49 Å²	49	48.6 Å²	48.6	30%	0.297	22%	0.218	S	C	.	.	S	Bend	trans	-60.2	-57.5	-176.5	-175.6	0	0	0	0	110.5	P505 R582	P505-V577 HydrophobicContact CG-CG1 4.08Å; P505-V577 VanDerWaalsContact CG-O 3.28Å; P505-V577 WeakPolarHBondContact CG-O 3.31Å; V577-R582 PolarHBondContact O-NH2 3.46Å
578	R	83	Confident	91.2	Very high	107 Å²	107	48.5 Å²	48.5	40%	0.404	22%	0.218	S	C	.	.	S	Bend	trans	-73.3	131.5	176.9	-64.6	-177.1	-169.2	75.9	9.5	110.4	E580 E581	R578-E580 VanDerWaalsContact C-N 3.31Å; R578-E580 PolarHBondContact O-N 2.72Å; R578-E581 HydrophobicContact CB-CG 4.11Å; R578-E581 WeakPolarHBondContact CD-OE1 3.33Å; R578-E581 IonicContact NH1-OE1 3.22Å; R578-E581 PolarHBondContact O-N 2.94Å
579	R	86.8	Confident	91.1	Very high	99 Å²	99	44.1 Å²	44.1	37%	0.374	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-64.2	-35.3	-179.3	56.2	171.8	-173.1	176.2	-10	112.8	D513 S515 E581 R582	D513-R579 WeakPolarHBondContact OD2-CD 3.19Å; D513-R579 IonicContact OD2-CZ 3.88Å; D513-R579 IonicContact OD2-NE 3.96Å; D513-R579 IonicContact OD2-NH1 3.7Å; D513-R579 PolarHBondContact OD2-NH1 3.14Å; S515-R579 VanDerWaalsContact OG-CB 3.25Å; S515-R579 WeakPolarHBondContact OG-CB 3.36Å; R579-E581 PolarHBondContact O-N 3.11Å; R579-R582 WeakPolarHBondContact O-CB 3.35Å; R579-R582 PolarHBondContact O-N 3.16Å; R579-R582 VanDerWaalsContact O-N 3.1Å
580	E	86.2	Confident	90.9	Very high	128 Å²	128	45.3 Å²	45.3	60%	0.598	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-66.2	-23.1	-177.5	-58.9	76.7	-167.2	0	0	112.1	R578	R578-E580 VanDerWaalsContact C-N 3.31Å; R578-E580 PolarHBondContact O-N 2.72Å
581	E	86.4	Confident	90.4	Very high	31 Å²	31	46.6 Å²	46.6	15%	0.145	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-88.3	-7.3	178.9	-61	180	-164.2	0	0	113.1	R576 R578 R579 H692 R699	R576-E581 HydrophobicContact CB-CB 4.33Å; R576-E581 WeakPolarHBondContact CD-O 3.4Å; R576-E581 PolarHBondContact NH1-O 3.5Å; R578-E581 HydrophobicContact CB-CG 4.11Å; R578-E581 WeakPolarHBondContact CD-OE1 3.33Å; R578-E581 IonicContact NH1-OE1 3.22Å; R578-E581 PolarHBondContact O-N 2.94Å; R579-E581 PolarHBondContact O-N 3.11Å; E581-H692 IonicContact OE2-CD2 2.69Å; E581-H692 IonicContact OE2-CE1 3.75Å; E581-H692 IonicContact OE2-NE2 2.71Å; E581-H692 PolarHBondContact OE2-NE2 3.15Å; E581-R699 IonicContact OE1-CZ 4Å; E581-R699 IonicContact OE1-NH1 4Å; E581-R699 PolarHBondContact OE1-NH1 3.05Å; E581-R699 IonicContact OE1-NH2 3.78Å; E581-R699 PolarHBondContact OE1-NH2 3.19Å
582	R	93	Very high	89.5	Confident	13 Å²	13	47.4 Å²	47.4	5%	0.049	23%	0.227	C	C	.	.	S	Bend	trans	-81.3	146.8	-175.7	-60.3	178.8	-164.7	146	13.1	111.9	E506 S515 V518 R573 C574 R576 V577 R579 T584	E506-R582 IonicContact OE1-CZ 2.75Å; E506-R582 IonicContact OE1-NH1 2.9Å; E506-R582 PolarHBondContact OE1-NH1 2.86Å; E506-R582 IonicContact OE1-NH2 3.08Å; E506-R582 PolarHBondContact OE1-NH2 3.3Å; E506-R582 IonicContact OE2-CZ 2.67Å; E506-R582 IonicContact OE2-NH1 2.78Å; E506-R582 IonicContact OE2-NH2 2.71Å; E506-R582 PolarHBondContact OE2-NH2 3.48Å; S515-R582 PolarHBondContact O-NH1 3.35Å; S515-R582 VanDerWaalsContact O-NH1 3.11Å; S515-R582 PolarHBondContact OG-NH1 3.41Å; V518-R582 HydrophobicContact CG1-CB 4.21Å; R573-R582 CarbonylContact O-C 3.15Å; R573-R582 VanDerWaalsContact O-CA 3.26Å; R573-R582 WeakPolarHBondContact O-CA 3.42Å; C574-R582 WeakPolarHBondContact O-CD 3.27Å; R576-R582 HydrophobicContact CB-CG 4.19Å; R576-R582 PolarHBondContact O-NE 3.19Å; R576-R582 PolarHBondContact O-NH2 3.09Å; V577-R582 PolarHBondContact O-NH2 3.46Å; R579-R582 WeakPolarHBondContact O-CB 3.35Å; R579-R582 PolarHBondContact O-N 3.16Å; R579-R582 VanDerWaalsContact O-N 3.1Å; R582-T584 PolarHBondContact O-N 2.67Å
583	S	90.9	Very high	89	Confident	6 Å²	6	45.7 Å²	45.7	4%	0.042	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-68.6	120.5	174	-69.8	0	0	0	0	111.7	V518 R573	V518-S583 WeakPolarHBondContact CG1-O 3.44Å; R573-S583 WeakPolarHBondContact CB-OG 3.22Å; R573-S583 PolarHBondContact NE-OG 3.49Å; R573-S583 PolarHBondContact O-N 2.83Å
584	T	92.9	Very high	88.5	Confident	71 Å²	71	45.3 Å²	45.3	44%	0.436	22%	0.216	S	C	.	.	P	Polyproline II helix	trans	-60.4	152.6	173.5	63.3	0	0	0	0	111.4	R582 K586 Q587 L588	R582-T584 PolarHBondContact O-N 2.67Å; T584-K586 PolarHBondContact O-N 3.06Å; T584-K586 VanDerWaalsContact O-N 3.09Å; T584-Q587 PolarHBondContact O-N 2.8Å; T584-Q587 VanDerWaalsContact OG1-CD 3.28Å; T584-Q587 WeakPolarHBondContact OG1-CG 3.49Å; T584-Q587 PolarHBondContact OG1-N 3.09Å; T584-Q587 PolarHBondContact OG1-OE1 2.99Å; T584-L588 PolarHBondContact O-N 2.57Å
585	V	94.4	Very high	87.3	Confident	10 Å²	10	47 Å²	47	6%	0.061	23%	0.226	C	C	.	.	H	α-helix	trans	-55.4	-31.6	176.5	-177.8	0	0	0	0	112.2	L445 L448 V518 L588 L589	L445-V585 HydrophobicContact CB-CG1 4.31Å; L445-V585 HydrophobicContact CD2-CG1 4.05Å; L445-V585 WeakPolarHBondContact O-CG1 3.19Å; L448-V585 HydrophobicContact CB-CG1 4.19Å; L448-V585 HydrophobicContact CB-CG2 4.2Å; L448-V585 HydrophobicContact CD1-CG2 4.49Å; V518-V585 HydrophobicContact CG2-CG2 3.72Å; V585-L588 PolarHBondContact O-N 2.88Å; V585-L589 HydrophobicContact CG1-CD1 4.23Å; V585-L589 WeakPolarHBondContact O-CB 3.46Å; V585-L589 WeakPolarHBondContact O-CG 3.26Å; V585-L589 PolarHBondContact O-N 3.03Å
586	K	91.7	Very high	85.8	Confident	149 Å²	149	49 Å²	49	65%	0.648	24%	0.24	S	C	*	.	H	α-helix	trans	-64.9	-45.6	174.1	-67.7	175.9	-177	168.6	0	112.2	T584 L589 V590	T584-K586 PolarHBondContact O-N 3.06Å; T584-K586 VanDerWaalsContact O-N 3.09Å; K586-L589 PolarHBondContact O-N 2.88Å; K586-V590 WeakPolarHBondContact O-CG2 3.44Å
587	Q	90.8	Very high	84.1	Confident	69 Å²	69	51.8 Å²	51.8	32%	0.322	25%	0.254	S	S	.	.	H	α-helix	trans	-65.2	-42.7	175.5	-72	158.1	-33.5	0	0	111.2	T584 L589 V590 D591	T584-Q587 PolarHBondContact O-N 2.8Å; T584-Q587 VanDerWaalsContact OG1-CD 3.28Å; T584-Q587 WeakPolarHBondContact OG1-CG 3.49Å; T584-Q587 PolarHBondContact OG1-N 3.09Å; T584-Q587 PolarHBondContact OG1-OE1 2.99Å; Q587-L589 VanDerWaalsContact C-N 3.29Å; Q587-L589 PolarHBondContact O-N 3.19Å; Q587-V590 PolarHBondContact O-N 3.44Å; Q587-V590 VanDerWaalsContact O-N 3.09Å; Q587-D591 PolarHBondContact O-N 3.36Å
588	L	93.1	Very high	82.5	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.1	-31.5	176.7	-66.7	173.6	0	0	0	112.9	L445 V518 F521 I570 T584 V585 V590 F594	L445-L588 HydrophobicContact CD1-CB 3.88Å; L445-L588 HydrophobicContact CD2-CB 3.86Å; L445-L588 HydrophobicContact CD2-CD1 3.8Å; L445-L588 HydrophobicContact CD2-CG 4.5Å; V518-L588 HydrophobicContact CG1-CD1 4.23Å; F521-L588 HydrophobicContact CD1-CD1 4.16Å; F521-L588 HydrophobicContact CE1-CD1 4.18Å; I570-L588 HydrophobicContact CG2-CD2 4.16Å; T584-L588 PolarHBondContact O-N 2.57Å; V585-L588 PolarHBondContact O-N 2.88Å; L588-V590 VanDerWaalsContact C-N 3.27Å; L588-V590 PolarHBondContact O-N 3.03Å; L588-F594 WeakPolarHBondContact O-CD2 3.38Å
589	L	90.5	Very high	81	Confident	48 Å²	48	57.2 Å²	57.2	25%	0.251	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-13.2	175	-78.9	171.4	0	0	0	114.4	L445 K446 V585 K586 Q587	L445-L589 HydrophobicContact CB-CD2 3.58Å; L445-L589 HydrophobicContact CB-CG 3.92Å; L445-L589 HydrophobicContact CD1-CD2 4.49Å; K446-L589 HydrophobicContact CG-CD2 3.99Å; V585-L589 HydrophobicContact CG1-CD1 4.23Å; V585-L589 WeakPolarHBondContact O-CB 3.46Å; V585-L589 WeakPolarHBondContact O-CG 3.26Å; V585-L589 PolarHBondContact O-N 3.03Å; K586-L589 PolarHBondContact O-N 2.88Å; Q587-L589 VanDerWaalsContact C-N 3.29Å; Q587-L589 PolarHBondContact O-N 3.19Å
590	V	85	Confident	79.6	Confident	77 Å²	77	54 Å²	54	47%	0.467	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-21.3	179.6	176	0	0	0	0	112.3	K586 Q587 L588	K586-V590 WeakPolarHBondContact O-CG2 3.44Å; Q587-V590 PolarHBondContact O-N 3.44Å; Q587-V590 VanDerWaalsContact O-N 3.09Å; L588-V590 VanDerWaalsContact C-N 3.27Å; L588-V590 PolarHBondContact O-N 3.03Å
591	D	83.6	Confident	78.6	Confident	27 Å²	27	48.6 Å²	48.6	14%	0.144	26%	0.257	C	S	.	.	S	Bend	trans	-53.9	135.4	179	-173.3	-64.9	0	0	0	113.2	R573 Q587 F593 F594 T595	R573-D591 IonicContact CZ-OD2 3.62Å; R573-D591 IonicContact NH2-OD2 3.7Å; R573-D591 PolarHBondContact NH2-OD2 2.98Å; Q587-D591 PolarHBondContact O-N 3.36Å; D591-F593 PolarHBondContact O-N 3.4Å; D591-F593 VanDerWaalsContact O-N 3.11Å; D591-F593 VanDerWaalsContact OD1-CB 3.32Å; D591-F593 WeakPolarHBondContact OD1-CB 3.18Å; D591-F593 PolarHBondContact OD1-N 3.29Å; D591-F594 HydrophobicContact CB-CD2 4.26Å; D591-F594 CarbonylContact O-C 3.6Å; D591-F594 WeakPolarHBondContact O-CA 3.02Å; D591-F594 PolarHBondContact O-N 3.27Å; D591-T595 PolarHBondContact O-N 2.94Å; D591-T595 VanDerWaalsContact O-N 3.09Å
592	D	77.6	Confident	78.2	Confident	18 Å²	18	47.7 Å²	47.7	10%	0.096	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-22.7	-176.5	-59.3	-86	0	0	0	115.1	F594 T595 K682	D592-F594 PolarHBondContact O-N 2.68Å; D592-T595 PolarHBondContact O-OG1 2.66Å; D592-T595 VanDerWaalsContact O-OG1 3.12Å; D592-K682 WeakPolarHBondContact OD2-CD 3.48Å; D592-K682 WeakPolarHBondContact OD2-CE 3.16Å; D592-K682 IonicContact OD2-NZ 3.83Å; D592-K682 PolarHBondContact OD2-NZ 2.9Å
593	F	81.3	Confident	77.5	Confident	3 Å²	3	50.9 Å²	50.9	1%	0.013	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-31	172.1	-176.7	-102.6	0	0	0	111.4	I434 K438 E566 I567 I570 D591	I434-F593 HydrophobicContact CD1-CE2 3.86Å; I434-F593 HydrophobicContact CD1-CZ 3.73Å; K438-F593 HydrophobicContact CD-CD2 4.44Å; K438-F593 HydrophobicContact CD-CE2 4.23Å; K438-F593 HydrophobicContact CD-CZ 4.3Å; K438-F593 VanDerWaalsContact CD-O 3.23Å; K438-F593 WeakPolarHBondContact CD-O 3.43Å; K438-F593 WeakPolarHBondContact CE-O 3.41Å; K438-F593 HydrophobicContact CG-CD1 4.23Å; K438-F593 HydrophobicContact CG-CD2 4.48Å; K438-F593 HydrophobicContact CG-CE1 3.71Å; K438-F593 HydrophobicContact CG-CE2 4.02Å; K438-F593 HydrophobicContact CG-CZ 3.58Å; K438-F593 PolarHBondContact NZ-O 2.89Å; E566-F593 HydrophobicContact CG-CB 4.23Å; E566-F593 HydrophobicContact CG-CD2 3.35Å; E566-F593 HydrophobicContact CG-CE2 4.03Å; E566-F593 HydrophobicContact CG-CG 4.09Å; E566-F593 WeakPolarHBondContact OE1-CD2 3.46Å; I567-F593 HydrophobicContact CD1-CE2 3.76Å; I567-F593 HydrophobicContact CD1-CZ 3.54Å; I567-F593 HydrophobicContact CG1-CD2 4.19Å; I567-F593 HydrophobicContact CG1-CE1 4.12Å; I567-F593 HydrophobicContact CG1-CE2 3.38Å; I567-F593 HydrophobicContact CG1-CZ 3.36Å; I570-F593 HydrophobicContact CD1-CB 3.38Å; I570-F593 HydrophobicContact CD1-CD1 3.74Å; I570-F593 HydrophobicContact CD1-CG 3.69Å; D591-F593 PolarHBondContact O-N 3.4Å; D591-F593 VanDerWaalsContact O-N 3.11Å; D591-F593 VanDerWaalsContact OD1-CB 3.32Å; D591-F593 WeakPolarHBondContact OD1-CB 3.18Å; D591-F593 PolarHBondContact OD1-N 3.29Å
594	F	82.5	Confident	77.3	Confident	3 Å²	3	50.6 Å²	50.6	1%	0.013	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-0.1	178.5	-55.8	-62.8	0	0	0	114	C441 R442 L445 F521 I570 L588 D591 D592	C441-F594 HydrophobicContact CB-CD1 4.13Å; C441-F594 HydrophobicContact CB-CE1 3.33Å; C441-F594 HydrophobicContact CB-CZ 4.03Å; R442-F594 HydrophobicContact CB-CD1 4.41Å; R442-F594 VanDerWaalsContact CD-O 3.31Å; R442-F594 WeakPolarHBondContact CD-O 3.36Å; R442-F594 PolarHBondContact NH1-O 2.72Å; L445-F594 HydrophobicContact CD1-CD2 4.04Å; L445-F594 HydrophobicContact CD1-CE2 3.94Å; L445-F594 HydrophobicContact CD1-CG 4.35Å; L445-F594 HydrophobicContact CD1-CZ 4.21Å; F521-F594 HydrophobicContact CZ-CZ 4.05Å; I570-F594 HydrophobicContact CD1-CE2 3.95Å; I570-F594 HydrophobicContact CD1-CZ 4.38Å; I570-F594 HydrophobicContact CG2-CE2 3.95Å; I570-F594 HydrophobicContact CG2-CZ 4.17Å; L588-F594 WeakPolarHBondContact O-CD2 3.38Å; D591-F594 HydrophobicContact CB-CD2 4.26Å; D591-F594 CarbonylContact O-C 3.6Å; D591-F594 WeakPolarHBondContact O-CA 3.02Å; D591-F594 PolarHBondContact O-N 3.27Å; D592-F594 PolarHBondContact O-N 2.68Å
595	T	70.8	Confident	76.9	Confident	35 Å²	35	48.8 Å²	48.8	22%	0.215	25%	0.25	C	S	.	.	S	Bend	trans	-71.3	146	162	65	0	0	0	0	110	D591 D592 E597	D591-T595 PolarHBondContact O-N 2.94Å; D591-T595 VanDerWaalsContact O-N 3.09Å; D592-T595 PolarHBondContact O-OG1 2.66Å; D592-T595 VanDerWaalsContact O-OG1 3.12Å; T595-E597 PolarHBondContact O-N 2.99Å
596	P	62.6	Low	76.6	Confident	53 Å²	53	49.3 Å²	49.3	34%	0.344	25%	0.252	S	S	.	.			trans	-77.7	110.1	177.7	-15.3	31.2	0	0	0	111.4	D598 L599	P596-D598 PolarHBondContact O-N 3.25Å; P596-D598 VanDerWaalsContact O-N 3.12Å; P596-L599 HydrophobicContact CB-CB 4.4Å; P596-L599 HydrophobicContact CB-CD1 4.13Å; P596-L599 PolarHBondContact O-N 2.85Å
597	E	57.4	Low	76.4	Confident	91 Å²	91	46.4 Å²	46.4	43%	0.425	24%	0.24	S	C	.	.	H	α-helix	trans	-44.1	-44.4	173.1	-63.3	159.3	177.8	0	0	112.2	K435 K438 T595 L599 I600 G601	K435-E597 WeakPolarHBondContact CE-OE2 3.36Å; K435-E597 IonicContact NZ-OE2 2.66Å; K438-E597 IonicContact NZ-OE1 3.39Å; K438-E597 PolarHBondContact NZ-OE1 3.44Å; T595-E597 PolarHBondContact O-N 2.99Å; E597-L599 PolarHBondContact O-N 3.27Å; E597-I600 PolarHBondContact O-N 3.43Å; E597-G601 PolarHBondContact O-N 2.92Å
598	D	51.7	Low	76.1	Confident	131 Å²	131	46.8 Å²	46.8	70%	0.701	24%	0.244	S	C	*	.	H	α-helix	trans	-70.2	-7	-174.9	-53.2	-54.7	0	0	0	114	K435 P596	K435-D598 IonicContact NZ-OD1 3.73Å; K435-D598 PolarHBondContact NZ-OD1 2.71Å; K435-D598 IonicContact NZ-OD2 2.69Å; K435-D598 PolarHBondContact NZ-OD2 2.69Å; K435-D598 VanDerWaalsContact NZ-OD2 3.08Å; P596-D598 PolarHBondContact O-N 3.25Å; P596-D598 VanDerWaalsContact O-N 3.12Å
599	L	51.6	Low	75.7	Confident	139 Å²	139	48.7 Å²	48.7	73%	0.728	25%	0.251	S	S	*	.	H	α-helix	trans	-94.1	-20.9	176.7	-106.6	74.7	0	0	0	114.4	P596 E597	P596-L599 HydrophobicContact CB-CB 4.4Å; P596-L599 HydrophobicContact CB-CD1 4.13Å; P596-L599 PolarHBondContact O-N 2.85Å; E597-L599 PolarHBondContact O-N 3.27Å
600	I	58.3	Low	75.2	Confident	33 Å²	33	52.1 Å²	52.1	17%	0.169	27%	0.27	C	S	.	.	H	α-helix	trans	-116.9	-43.3	-167.3	-57.6	-178.6	0	0	0	110.5	E597 I602 K631 M674 L678	E597-I600 PolarHBondContact O-N 3.43Å; I600-I602 HydrophobicContact CG2-CB 3.87Å; I600-I602 WeakPolarHBondContact CG2-O 3.11Å; I600-I602 PolarHBondContact O-N 3.42Å; I600-K631 PolarHBondContact O-NZ 2.88Å; I600-M674 HydrophobicContact CB-SD 4.22Å; I600-M674 HydrophobicContact CG1-SD 4.16Å; I600-M674 HydrophobicContact CG2-CE 3.76Å; I600-M674 HydrophobicContact CG2-CG 4.18Å; I600-M674 HydrophobicContact CG2-SD 3.66Å; I600-L678 HydrophobicContact CD1-CD2 4.34Å; I600-L678 HydrophobicContact CG2-CD1 4Å
601	G	65.3	Low	75.2	Confident	13 Å²	13	50.7 Å²	50.7	13%	0.134	27%	0.266	C	S	.	.	S	Bend	trans	70	5.4	-174.9	0	0	0	0	0	114.5	E597 Y627 D628	E597-G601 PolarHBondContact O-N 2.92Å; G601-Y627 PolarHBondContact O-N 3.36Å; G601-D628 PolarHBondContact O-N 3.11Å; G601-D628 VanDerWaalsContact O-N 3.16Å
602	I	76.9	Confident	75.3	Confident	12 Å²	12	49.8 Å²	49.8	6%	0.062	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	147.3	-174.5	-60.8	144.6	0	0	0	108.3	I600 L624 R625 V626 K631 Y635 D671 M674 I675 L678	I600-I602 HydrophobicContact CG2-CB 3.87Å; I600-I602 WeakPolarHBondContact CG2-O 3.11Å; I600-I602 PolarHBondContact O-N 3.42Å; I602-L624 HydrophobicContact CG2-CD1 3.39Å; I602-L624 HydrophobicContact CG2-CG 4.3Å; I602-R625 CarbonylContact C-O 3.44Å; I602-R625 VanDerWaalsContact CA-O 3.29Å; I602-R625 WeakPolarHBondContact CA-O 3.12Å; I602-V626 HydrophobicContact CG1-CG2 4.07Å; I602-K631 HydrophobicContact CD1-CD 4Å; I602-K631 HydrophobicContact CG1-CD 4.45Å; I602-Y635 HydrophobicContact CD1-CE2 4.48Å; I602-Y635 VanDerWaalsContact CD1-OH 3.24Å; I602-Y635 WeakPolarHBondContact CD1-OH 3.37Å; I602-D671 WeakPolarHBondContact CD1-OD2 3.39Å; I602-M674 HydrophobicContact CD1-CE 3.61Å; I602-I675 HydrophobicContact CG2-CD1 4.43Å; I602-I675 HydrophobicContact CG2-CG1 4.36Å; I602-L678 HydrophobicContact CG2-CD1 4.3Å
603	R	79	Confident	75.6	Confident	80 Å²	80	50.5 Å²	50.5	30%	0.302	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	144.9	176.3	-169	-179.2	-174.8	-154	12	110.1	E605 L624 R625 Y627	R603-E605 WeakPolarHBondContact CD-OE1 3.47Å; R603-E605 HydrophobicContact CG-CG 4.19Å; R603-E605 IonicContact CZ-OE1 3.62Å; R603-E605 IonicContact NE-OE1 2.85Å; R603-E605 IonicContact NH1-OE1 2.69Å; R603-E605 PolarHBondContact NH1-OE1 2.99Å; R603-E605 IonicContact NH1-OE2 2.71Å; R603-L624 WeakPolarHBondContact O-CA 3.4Å; R603-R625 PolarHBondContact N-O 3.14Å; R603-R625 PolarHBondContact O-N 3.45Å; R603-Y627 HydrophobicContact CB-CD2 4.28Å; R603-Y627 HydrophobicContact CB-CE2 3.88Å
604	V	86.5	Confident	75.7	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	134.8	165.6	-177.9	0	0	0	0	108.7	M622 Q623 L624 F645 L678 I679 K682	V604-M622 HydrophobicContact CG1-CE 3.79Å; V604-Q623 WeakPolarHBondContact CA-O 3.21Å; V604-L624 HydrophobicContact CG2-CD1 3.72Å; V604-F645 HydrophobicContact CG1-CZ 4.45Å; V604-L678 HydrophobicContact CB-CB 4.4Å; V604-L678 HydrophobicContact CG2-CB 3.74Å; V604-I679 HydrophobicContact CG1-CG1 4.41Å; V604-I679 HydrophobicContact CG2-CG1 4.18Å; V604-K682 HydrophobicContact CB-CG 4.23Å; V604-K682 HydrophobicContact CG1-CG 4.13Å; V604-K682 WeakPolarHBondContact O-CE 3.22Å
605	E	84.8	Confident	75.9	Confident	34 Å²	34	59.7 Å²	59.7	16%	0.159	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	154.1	177.7	-66.7	174.3	-148.2	0	0	109.5	R603 M622 Q623 R625	R603-E605 WeakPolarHBondContact CD-OE1 3.47Å; R603-E605 HydrophobicContact CG-CG 4.19Å; R603-E605 IonicContact CZ-OE1 3.62Å; R603-E605 IonicContact NE-OE1 2.85Å; R603-E605 IonicContact NH1-OE1 2.69Å; R603-E605 PolarHBondContact NH1-OE1 2.99Å; R603-E605 IonicContact NH1-OE2 2.71Å; E605-M622 CarbonylContact O-C 3.6Å; E605-M622 WeakPolarHBondContact O-CA 3.25Å; E605-Q623 PolarHBondContact N-O 3.45Å; E605-Q623 PolarHBondContact O-N 3.22Å; E605-R625 IonicContact OE1-CZ 3.5Å; E605-R625 IonicContact OE1-NE 3.48Å; E605-R625 IonicContact OE1-NH1 3.42Å; E605-R625 PolarHBondContact OE1-NH1 3.05Å; E605-R625 IonicContact OE2-CZ 2.94Å; E605-R625 IonicContact OE2-NH1 3.55Å; E605-R625 PolarHBondContact OE2-NH1 3.37Å; E605-R625 IonicContact OE2-NH2 2.76Å; E605-R625 PolarHBondContact OE2-NH2 3.16Å
606	I	88.6	Confident	76.6	Confident	20 Å²	20	60.5 Å²	60.5	10%	0.103	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	122.6	168.9	-59.5	170	0	0	0	106.1	R609 I620 M622 F686	I606-R609 HydrophobicContact CB-CB 4.15Å; I606-R609 HydrophobicContact CG2-CB 4.02Å; I606-I620 HydrophobicContact CD1-CD1 3.88Å; I606-I620 HydrophobicContact CG1-CD1 4.3Å; I606-I620 HydrophobicContact CG2-CB 4.3Å; I606-M622 HydrophobicContact CG1-CE 4.11Å; I606-M622 HydrophobicContact CG1-CG 4.46Å; I606-F686 HydrophobicContact CD1-CB 3.91Å; I606-F686 HydrophobicContact CD1-CD2 3.7Å; I606-F686 HydrophobicContact CD1-CG 4.14Å
607	K	85.8	Confident	77.7	Confident	88 Å²	88	60.8 Å²	60.8	38%	0.383	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-49.3	-168	-79.2	-163.6	170.3	-168.6	0	113.3	Q621 Q623	K607-Q621 HydrophobicContact CB-CB 4.42Å; K607-Q621 PolarHBondContact N-O 2.95Å; K607-Q623 VanDerWaalsContact CE-CD 3.4Å; K607-Q623 HydrophobicContact CG-CB 4.2Å
608	N	85	Confident	79.2	Confident	77 Å²	77	58.9 Å²	58.9	41%	0.412	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	26.9	-172.3	-60.8	-13.9	0	0	0	111.6	D610 A611 D612	N608-D610 VanDerWaalsContact C-N 3.25Å; N608-D610 PolarHBondContact O-N 3.42Å; N608-A611 HydrophobicContact CB-CB 4.5Å; N608-A611 WeakPolarHBondContact O-CA 3.46Å; N608-A611 WeakPolarHBondContact O-CB 3.49Å; N608-A611 PolarHBondContact O-N 3.45Å; N608-D612 VanDerWaalsContact C-OD2 3.3Å; N608-D612 WeakPolarHBondContact CB-OD2 3.4Å; N608-D612 PolarHBondContact O-N 3.23Å
609	R	84	Confident	81.1	Confident	41 Å²	41	58.3 Å²	58.3	16%	0.155	30%	0.303	C	S	.	.	H	α-helix	trans	-42.9	-45.1	-169.2	178.8	166.4	167.6	70.7	-18.1	114.4	E569 I606 L613 F686 D689	E569-R609 IonicContact OE1-CZ 3.7Å; E569-R609 IonicContact OE1-NE 2.69Å; E569-R609 IonicContact OE1-NH2 3.88Å; E569-R609 PolarHBondContact OE1-NH2 2.89Å; E569-R609 IonicContact OE2-CZ 2.76Å; E569-R609 IonicContact OE2-NE 2.73Å; E569-R609 PolarHBondContact OE2-NE 3.03Å; E569-R609 IonicContact OE2-NH2 3.79Å; E569-R609 PolarHBondContact OE2-NH2 2.78Å; I606-R609 HydrophobicContact CB-CB 4.15Å; I606-R609 HydrophobicContact CG2-CB 4.02Å; R609-L613 WeakPolarHBondContact O-CB 3.47Å; R609-L613 PolarHBondContact O-N 3.12Å; R609-F686 HydrophobicContact CG-CD2 4.4Å; R609-F686 HydrophobicContact CG-CE2 4.36Å; R609-D689 IonicContact CZ-OD2 2.72Å; R609-D689 IonicContact NH1-OD2 2.97Å; R609-D689 PolarHBondContact NH1-OD2 2.66Å; R609-D689 IonicContact NH2-OD2 3.8Å; R609-D689 PolarHBondContact NH2-OD2 2.87Å
610	D	81.5	Confident	83	Confident	119 Å²	119	51.7 Å²	51.7	64%	0.636	27%	0.268	S	S	*	.	H	α-helix	trans	-69.6	-35.7	-179.7	-65.5	-23.6	0	0	0	113	N608 N614	N608-D610 VanDerWaalsContact C-N 3.25Å; N608-D610 PolarHBondContact O-N 3.42Å; D610-N614 WeakPolarHBondContact O-CB 3.47Å; D610-N614 PolarHBondContact O-N 3Å; D610-N614 PolarHBondContact O-ND2 2.99Å
611	A	83.7	Confident	84.6	Confident	47 Å²	47	53.8 Å²	53.8	39%	0.388	28%	0.277	S	S	.	.	H	α-helix	trans	-73.9	-50.8	175.2	0	0	0	0	0	110.2	N608 L613 N614 D615	N608-A611 HydrophobicContact CB-CB 4.5Å; N608-A611 WeakPolarHBondContact O-CA 3.46Å; N608-A611 WeakPolarHBondContact O-CB 3.49Å; N608-A611 PolarHBondContact O-N 3.45Å; A611-L613 PolarHBondContact O-N 2.73Å; A611-L613 VanDerWaalsContact O-N 3.11Å; A611-N614 PolarHBondContact O-N 3.45Å; A611-D615 PolarHBondContact O-N 3.36Å
612	D	87	Confident	85.8	Confident	9 Å²	9	53.1 Å²	53.1	5%	0.048	27%	0.271	C	S	.	.	H	α-helix	trans	-55.1	-35.4	179.3	-61.3	-33.9	0	0	0	112.2	N608 L616 N617 I620 F686	N608-D612 VanDerWaalsContact C-OD2 3.3Å; N608-D612 WeakPolarHBondContact CB-OD2 3.4Å; N608-D612 PolarHBondContact O-N 3.23Å; D612-L616 CarbonylContact O-C 3.52Å; D612-L616 WeakPolarHBondContact O-CA 2.93Å; D612-L616 PolarHBondContact O-N 3.3Å; D612-L616 VanDerWaalsContact O-N 3.11Å; D612-N617 HydrophobicContact CB-CB 4.18Å; D612-N617 PolarHBondContact O-N 2.7Å; D612-N617 PolarHBondContact OD1-ND2 3.06Å; D612-I620 HydrophobicContact CB-CG2 3.93Å; D612-F686 HydrophobicContact CB-CE2 3.98Å; D612-F686 HydrophobicContact CB-CZ 3.71Å
613	L	84.3	Confident	86.4	Confident	33 Å²	33	53.4 Å²	53.4	17%	0.173	27%	0.272	C	S	.	.	H	α-helix	trans	-78.8	-28.5	178.3	-163.8	73.2	0	0	0	113.8	R609 A611 F686 D689 R690	R609-L613 WeakPolarHBondContact O-CB 3.47Å; R609-L613 PolarHBondContact O-N 3.12Å; A611-L613 PolarHBondContact O-N 2.73Å; A611-L613 VanDerWaalsContact O-N 3.11Å; L613-F686 HydrophobicContact CB-CE2 4.24Å; L613-F686 HydrophobicContact CB-CZ 4.23Å; L613-F686 HydrophobicContact CD1-CE1 4.32Å; L613-F686 HydrophobicContact CD1-CE2 4.13Å; L613-F686 HydrophobicContact CD1-CZ 3.99Å; L613-D689 HydrophobicContact CD1-CB 3.78Å; L613-D689 HydrophobicContact CD2-CB 4.12Å; L613-R690 HydrophobicContact CD1-CB 4.16Å
614	N	83.3	Confident	86.8	Confident	84 Å²	84	49.6 Å²	49.6	45%	0.449	26%	0.257	S	S	.	.	H	α-helix	trans	-81	-41.4	176.5	-85	-62.9	0	0	0	112.1	D610 A611 L616 R693	D610-N614 WeakPolarHBondContact O-CB 3.47Å; D610-N614 PolarHBondContact O-N 3Å; D610-N614 PolarHBondContact O-ND2 2.99Å; A611-N614 PolarHBondContact O-N 3.45Å; N614-L616 PolarHBondContact O-N 3.29Å; N614-R693 PolarHBondContact OD1-NH2 2.69Å
615	D	86.2	Confident	86.7	Confident	115 Å²	115	53.1 Å²	53.1	62%	0.615	27%	0.271	S	S	*	.	H	α-helix	trans	-80.3	-9.2	178.3	-60.6	-29.3	0	0	0	112.2	A611 N617	A611-D615 PolarHBondContact O-N 3.36Å; D615-N617 VanDerWaalsContact C-N 3.31Å; D615-N617 PolarHBondContact O-N 2.96Å
616	L	85.5	Confident	86.4	Confident	51 Å²	51	52.1 Å²	52.1	27%	0.267	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	34.9	-179.1	-58.4	164.5	0	0	0	113.2	D612 N614 R690 R693 L694 I697	D612-L616 CarbonylContact O-C 3.52Å; D612-L616 WeakPolarHBondContact O-CA 2.93Å; D612-L616 PolarHBondContact O-N 3.3Å; D612-L616 VanDerWaalsContact O-N 3.11Å; N614-L616 PolarHBondContact O-N 3.29Å; L616-R690 HydrophobicContact CD2-CG 3.83Å; L616-R693 HydrophobicContact CD2-CB 4.46Å; L616-R693 HydrophobicContact CD2-CG 4.31Å; L616-L694 HydrophobicContact CD1-CD2 3.67Å; L616-L694 HydrophobicContact CD1-CG 4.45Å; L616-L694 HydrophobicContact CD2-CD2 4.13Å; L616-L694 HydrophobicContact CD2-CG 4Å; L616-I697 HydrophobicContact CD1-CD1 4.22Å
617	N	85.8	Confident	85.6	Confident	59 Å²	59	57.4 Å²	57.4	32%	0.316	29%	0.287	S	S	.	.			trans	-56.5	139.4	-178.5	-70.1	-20.1	0	0	0	111.8	D612 D615	D612-N617 HydrophobicContact CB-CB 4.18Å; D612-N617 PolarHBondContact O-N 2.7Å; D612-N617 PolarHBondContact OD1-ND2 3.06Å; D615-N617 VanDerWaalsContact C-N 3.31Å; D615-N617 PolarHBondContact O-N 2.96Å
618	V	88.9	Confident	84.8	Confident	51 Å²	51	55.7 Å²	55.7	31%	0.309	28%	0.282	S	S	.	.	S	Bend	trans	-89.4	-37.8	175.1	-175.4	0	0	0	0	111.1	D648 I649 E650	V618-D648 WeakPolarHBondContact CG1-OD1 3.29Å; V618-I649 HydrophobicContact CG1-CB 4.49Å; V618-I649 WeakPolarHBondContact O-CB 3.31Å; V618-I649 WeakPolarHBondContact O-CD1 3.29Å; V618-I649 VanDerWaalsContact O-CG1 3.28Å; V618-I649 WeakPolarHBondContact O-CG1 3.4Å; V618-I649 PolarHBondContact O-N 2.95Å; V618-E650 HydrophobicContact CG1-CB 4.01Å; V618-E650 HydrophobicContact CG1-CG 3.96Å
619	E	91.2	Very high	84	Confident	119 Å²	119	58 Å²	58	56%	0.556	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	123.9	170.1	-171.5	-170	161.4	0	0	109.8	A646	E619-A646 HydrophobicContact CG-CB 4.04Å; E619-A646 VanDerWaalsContact OE1-CB 3.24Å; E619-A646 WeakPolarHBondContact OE1-CB 3.29Å
620	I	91.7	Very high	83.3	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	142.1	177.2	53.3	167.6	0	0	0	112.4	I606 D612 M622 A646 F647 I649 F686	I606-I620 HydrophobicContact CD1-CD1 3.88Å; I606-I620 HydrophobicContact CG1-CD1 4.3Å; I606-I620 HydrophobicContact CG2-CB 4.3Å; D612-I620 HydrophobicContact CB-CG2 3.93Å; I620-M622 HydrophobicContact CD1-CG 4.28Å; I620-M622 HydrophobicContact CD1-SD 4.46Å; I620-M622 HydrophobicContact CG1-CG 4.35Å; I620-M622 PolarHBondContact O-N 3.35Å; I620-A646 CarbonylContact O-C 3.59Å; I620-A646 WeakPolarHBondContact O-CA 3.48Å; I620-F647 HydrophobicContact CG1-CB 4.22Å; I620-F647 WeakPolarHBondContact CG1-O 3.37Å; I620-F647 PolarHBondContact N-O 3.44Å; I620-F647 PolarHBondContact O-N 2.83Å; I620-I649 HydrophobicContact CB-CD1 4.49Å; I620-I649 HydrophobicContact CD1-CD1 4.16Å; I620-I649 HydrophobicContact CD1-CG1 4.02Å; I620-I649 HydrophobicContact CG1-CD1 4.13Å; I620-I649 HydrophobicContact CG1-CG1 4.01Å; I620-I649 HydrophobicContact CG2-CD1 3.62Å; I620-I649 HydrophobicContact CG2-CG1 4.42Å; I620-F686 HydrophobicContact CD1-CG 4.39Å; I620-F686 HydrophobicContact CG2-CD1 4.42Å; I620-F686 HydrophobicContact CG2-CE1 3.96Å; I620-F686 HydrophobicContact CG2-CE2 4.15Å; I620-F686 HydrophobicContact CG2-CZ 3.81Å
621	Q	91.4	Very high	82.8	Confident	77 Å²	77	60.8 Å²	60.8	36%	0.36	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	107.1	178.1	-65.5	-170.6	5.7	0	0	111.2	K607	K607-Q621 HydrophobicContact CB-CB 4.42Å; K607-Q621 PolarHBondContact N-O 2.95Å
622	M	90.8	Very high	82.1	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	154.9	178.9	-55.8	-168.2	94.2	0	0	111.8	V604 E605 I606 I620 Q644 F645 F647 I679 K682 V683	V604-M622 HydrophobicContact CG1-CE 3.79Å; E605-M622 CarbonylContact O-C 3.6Å; E605-M622 WeakPolarHBondContact O-CA 3.25Å; I606-M622 HydrophobicContact CG1-CE 4.11Å; I606-M622 HydrophobicContact CG1-CG 4.46Å; I620-M622 HydrophobicContact CD1-CG 4.28Å; I620-M622 HydrophobicContact CD1-SD 4.46Å; I620-M622 HydrophobicContact CG1-CG 4.35Å; I620-M622 PolarHBondContact O-N 3.35Å; M622-Q644 WeakPolarHBondContact O-CA 3.41Å; M622-Q644 WeakPolarHBondContact O-CG 3.44Å; M622-F645 HydrophobicContact CB-CD1 4.13Å; M622-F645 HydrophobicContact CB-CD2 3.96Å; M622-F645 HydrophobicContact CB-CE1 3.68Å; M622-F645 HydrophobicContact CB-CE2 3.5Å; M622-F645 HydrophobicContact CB-CG 4.26Å; M622-F645 HydrophobicContact CB-CZ 3.34Å; M622-F645 HydrophobicContact CG-CE2 3.95Å; M622-F645 HydrophobicContact CG-CZ 4.15Å; M622-F645 PolarHBondContact N-O 2.97Å; M622-F645 PolarHBondContact O-N 2.9Å; M622-F645 HydrophobicContact SD-CD2 4.49Å; M622-F645 HydrophobicContact SD-CE2 3.53Å; M622-F645 VanDerWaalsContact SD-CE2 3.53Å; M622-F645 HydrophobicContact SD-CZ 3.84Å; M622-F647 HydrophobicContact CG-CB 4.05Å; M622-F647 HydrophobicContact SD-CB 3.63Å; M622-F647 HydrophobicContact SD-CD2 4.22Å; M622-F647 HydrophobicContact SD-CG 3.97Å; M622-I679 HydrophobicContact CE-CG2 4.38Å; M622-I679 HydrophobicContact SD-CG2 4.11Å; M622-K682 HydrophobicContact CE-CB 3.58Å; M622-K682 HydrophobicContact CE-CG 4.35Å; M622-V683 HydrophobicContact CE-CG2 4.22Å; M622-V683 HydrophobicContact SD-CG2 4.4Å
623	Q	89	Confident	81.2	Confident	17 Å²	17	70 Å²	70	8%	0.079	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	123.3	174.2	-164.3	179.5	30.9	0	0	112.1	V604 E605 K607 R625 G642 L643	V604-Q623 WeakPolarHBondContact CA-O 3.21Å; E605-Q623 PolarHBondContact N-O 3.45Å; E605-Q623 PolarHBondContact O-N 3.22Å; K607-Q623 VanDerWaalsContact CE-CD 3.4Å; K607-Q623 HydrophobicContact CG-CB 4.2Å; Q623-R625 HydrophobicContact CG-CG 4.43Å; Q623-R625 VanDerWaalsContact OE1-NE 3.14Å; Q623-G642 WeakPolarHBondContact CG-O 3.32Å; Q623-G642 PolarHBondContact NE2-O 2.93Å; Q623-L643 CarbonylContact C-O 3.53Å; Q623-L643 WeakPolarHBondContact CA-O 3.15Å
624	L	88.4	Confident	80.5	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	126.3	173.5	179.6	75	0	0	0	110.2	I602 R603 V604 Y635 F637 G642 L643 F645 I667 I675	I602-L624 HydrophobicContact CG2-CD1 3.39Å; I602-L624 HydrophobicContact CG2-CG 4.3Å; R603-L624 WeakPolarHBondContact O-CA 3.4Å; V604-L624 HydrophobicContact CG2-CD1 3.72Å; L624-Y635 HydrophobicContact CD2-CE1 4.49Å; L624-F637 HydrophobicContact CD2-CE1 4.41Å; L624-G642 CarbonylContact O-C 3.57Å; L624-G642 VanDerWaalsContact O-C 3.26Å; L624-G642 WeakPolarHBondContact O-CA 3.38Å; L624-L643 HydrophobicContact CB-CB 4.28Å; L624-L643 HydrophobicContact CD2-CD2 4.09Å; L624-L643 PolarHBondContact N-O 3.28Å; L624-L643 PolarHBondContact O-N 3.17Å; L624-F645 HydrophobicContact CB-CE1 4.22Å; L624-I667 HydrophobicContact CD2-CD1 3.63Å; L624-I667 HydrophobicContact CD2-CG1 3.97Å; L624-I675 HydrophobicContact CD1-CD1 4.17Å; L624-I675 HydrophobicContact CD1-CG1 4.3Å; L624-I675 HydrophobicContact CD1-CG2 4.03Å; L624-I675 HydrophobicContact CD2-CD1 4.14Å
625	R	83	Confident	80.1	Confident	74 Å²	74	69.1 Å²	69.1	28%	0.279	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134.4	178.7	-66.3	-178.6	-174.9	154.3	8.5	111.2	I602 R603 E605 Q623 Y627	I602-R625 CarbonylContact C-O 3.44Å; I602-R625 VanDerWaalsContact CA-O 3.29Å; I602-R625 WeakPolarHBondContact CA-O 3.12Å; R603-R625 PolarHBondContact N-O 3.14Å; R603-R625 PolarHBondContact O-N 3.45Å; E605-R625 IonicContact OE1-CZ 3.5Å; E605-R625 IonicContact OE1-NE 3.48Å; E605-R625 IonicContact OE1-NH1 3.42Å; E605-R625 PolarHBondContact OE1-NH1 3.05Å; E605-R625 IonicContact OE2-CZ 2.94Å; E605-R625 IonicContact OE2-NH1 3.55Å; E605-R625 PolarHBondContact OE2-NH1 3.37Å; E605-R625 IonicContact OE2-NH2 2.76Å; E605-R625 PolarHBondContact OE2-NH2 3.16Å; Q623-R625 HydrophobicContact CG-CG 4.43Å; Q623-R625 VanDerWaalsContact OE1-NE 3.14Å; R625-Y627 HydrophobicContact CB-CD2 4.3Å; R625-Y627 HydrophobicContact CB-CE2 3.68Å; R625-Y627 WeakPolarHBondContact CD-OH 3.38Å
626	V	78.7	Confident	79.2	Confident	14 Å²	14	72.6 Å²	72.6	9%	0.085	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	111.9	175.9	177.2	0	0	0	0	109	I602 K631 R632 Y635 F637	I602-V626 HydrophobicContact CG1-CG2 4.07Å; V626-K631 HydrophobicContact CG1-CB 3.92Å; V626-R632 HydrophobicContact CG1-CB 4.25Å; V626-R632 HydrophobicContact CG1-CG 4.25Å; V626-Y635 HydrophobicContact CG1-CD2 4.23Å; V626-Y635 HydrophobicContact CG1-CE2 4.47Å; V626-Y635 HydrophobicContact CG2-CD1 3.8Å; V626-Y635 HydrophobicContact CG2-CD2 3.66Å; V626-Y635 HydrophobicContact CG2-CE1 3.93Å; V626-Y635 HydrophobicContact CG2-CE2 3.85Å; V626-Y635 HydrophobicContact CG2-CG 3.66Å; V626-F637 HydrophobicContact CB-CZ 4.24Å; V626-F637 HydrophobicContact CG2-CE1 4.22Å; V626-F637 HydrophobicContact CG2-CZ 3.66Å
627	Y	71.9	Confident	78.4	Confident	130 Å²	130	72.1 Å²	72.1	51%	0.51	32%	0.319	S	S	.	.			trans	-91.3	-32.8	-179.3	-72.5	-86.5	0	0	0	112.7	G601 R603 R625 E629 R632	G601-Y627 PolarHBondContact O-N 3.36Å; R603-Y627 HydrophobicContact CB-CD2 4.28Å; R603-Y627 HydrophobicContact CB-CE2 3.88Å; R625-Y627 HydrophobicContact CB-CD2 4.3Å; R625-Y627 HydrophobicContact CB-CE2 3.68Å; R625-Y627 WeakPolarHBondContact CD-OH 3.38Å; Y627-E629 PolarHBondContact O-N 3.36Å; Y627-R632 PolarHBondContact O-NH2 2.72Å
628	D	70	Confident	77.2	Confident	52 Å²	52	76.2 Å²	76.2	28%	0.278	33%	0.334	S	S	.	.			trans	-69.2	114.3	179.7	178.2	15.2	0	0	0	112.2	G601 K630 K631 R632	G601-D628 PolarHBondContact O-N 3.11Å; G601-D628 VanDerWaalsContact O-N 3.16Å; D628-K630 PolarHBondContact O-N 3.22Å; D628-K630 VanDerWaalsContact O-N 3.07Å; D628-K630 WeakPolarHBondContact OD1-CB 3.14Å; D628-K630 PolarHBondContact OD1-N 2.79Å; D628-K631 HydrophobicContact CB-CB 4.21Å; D628-K631 HydrophobicContact CB-CG 4.43Å; D628-K631 PolarHBondContact O-N 2.73Å; D628-K631 VanDerWaalsContact O-N 3.09Å; D628-R632 PolarHBondContact O-N 2.91Å
629	E	68.4	Low	75.5	Confident	127 Å²	127	79.6 Å²	79.6	59%	0.593	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.4	-32.9	172.4	-153.3	72.6	-134.9	0	0	113.9	Y627 R632	Y627-E629 PolarHBondContact O-N 3.36Å; E629-R632 VanDerWaalsContact CD-NH1 3.31Å; E629-R632 IonicContact OE1-CZ 3.18Å; E629-R632 IonicContact OE1-NH1 3.37Å; E629-R632 PolarHBondContact OE1-NH1 2.78Å; E629-R632 IonicContact OE1-NH2 3.88Å; E629-R632 IonicContact OE2-CZ 2.68Å; E629-R632 IonicContact OE2-NH1 3.32Å; E629-R632 PolarHBondContact OE2-NH1 3.13Å; E629-R632 IonicContact OE2-NH2 2.74Å; E629-R632 PolarHBondContact OE2-NH2 2.79Å
630	K	68.7	Low	73.7	Confident	175 Å²	175	81.8 Å²	81.8	76%	0.761	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-47.2	-179.9	-59.5	168.6	-174.7	166.3	0	111.2	D628	D628-K630 PolarHBondContact O-N 3.22Å; D628-K630 VanDerWaalsContact O-N 3.07Å; D628-K630 WeakPolarHBondContact OD1-CB 3.14Å; D628-K630 PolarHBondContact OD1-N 2.79Å
631	K	70.3	Confident	72.3	Confident	42 Å²	42	87.2 Å²	87.2	18%	0.183	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-68	-31.6	177	-76	-167.7	166.7	-160.7	0	113	I600 I602 V626 D628 K633 Q634 Y635 D671	I600-K631 PolarHBondContact O-NZ 2.88Å; I602-K631 HydrophobicContact CD1-CD 4Å; I602-K631 HydrophobicContact CG1-CD 4.45Å; V626-K631 HydrophobicContact CG1-CB 3.92Å; D628-K631 HydrophobicContact CB-CB 4.21Å; D628-K631 HydrophobicContact CB-CG 4.43Å; D628-K631 PolarHBondContact O-N 2.73Å; D628-K631 VanDerWaalsContact O-N 3.09Å; K631-K633 PolarHBondContact O-N 3.46Å; K631-Q634 WeakPolarHBondContact O-CB 3.23Å; K631-Q634 PolarHBondContact O-N 3.5Å; K631-Y635 HydrophobicContact CB-CE2 4.34Å; K631-Y635 WeakPolarHBondContact O-CD2 3.46Å; K631-D671 IonicContact NZ-OD1 2.64Å; K631-D671 PolarHBondContact NZ-OD1 3.08Å; K631-D671 IonicContact NZ-OD2 3.47Å; K631-D671 PolarHBondContact NZ-OD2 3.32Å
632	R	68.7	Low	71.5	Confident	59 Å²	59	84 Å²	84	22%	0.223	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-55.1	-20.1	-174	-141.8	-171.6	-62.6	128.6	7.3	114.9	V626 Y627 D628 E629 E639	V626-R632 HydrophobicContact CG1-CB 4.25Å; V626-R632 HydrophobicContact CG1-CG 4.25Å; Y627-R632 PolarHBondContact O-NH2 2.72Å; D628-R632 PolarHBondContact O-N 2.91Å; E629-R632 VanDerWaalsContact CD-NH1 3.31Å; E629-R632 IonicContact OE1-CZ 3.18Å; E629-R632 IonicContact OE1-NH1 3.37Å; E629-R632 PolarHBondContact OE1-NH1 2.78Å; E629-R632 IonicContact OE1-NH2 3.88Å; E629-R632 IonicContact OE2-CZ 2.68Å; E629-R632 IonicContact OE2-NH1 3.32Å; E629-R632 PolarHBondContact OE2-NH1 3.13Å; E629-R632 IonicContact OE2-NH2 2.74Å; E629-R632 PolarHBondContact OE2-NH2 2.79Å; R632-E639 VanDerWaalsContact CD-OE1 3.27Å; R632-E639 WeakPolarHBondContact CD-OE1 3.45Å; R632-E639 IonicContact CZ-OE1 2.64Å; R632-E639 IonicContact NE-OE1 3.06Å; R632-E639 IonicContact NH1-OE1 3.06Å; R632-E639 PolarHBondContact NH1-OE1 2.88Å
633	K	68.6	Low	71.2	Confident	190 Å²	190	85 Å²	85	83%	0.826	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-83.2	-14.3	175.9	-61.3	-175.5	-179.1	-177.7	0	115.2	K631	K631-K633 PolarHBondContact O-N 3.46Å
634	Q	70.5	Confident	71.2	Confident	89 Å²	89	88.1 Å²	88.1	42%	0.416	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-25.9	-178.8	-163.8	176.6	-9.7	0	0	111.7	K631 P668 E670	K631-Q634 WeakPolarHBondContact O-CB 3.23Å; K631-Q634 PolarHBondContact O-N 3.5Å; Q634-P668 HydrophobicContact CG-CB 3.79Å; Q634-P668 HydrophobicContact CG-CG 3.85Å; Q634-E670 PolarHBondContact NE2-OE2 2.91Å
635	Y	74.7	Confident	71.3	Confident	10 Å²	10	89.4 Å²	89.4	4%	0.039	40%	0.4	C	S	.	.	S	Bend	trans	-83.9	148.9	173.7	-69	-99.5	0	0	0	110.8	I602 L624 V626 K631 F637 H666 I667 P668 D671 I675	I602-Y635 HydrophobicContact CD1-CE2 4.48Å; I602-Y635 VanDerWaalsContact CD1-OH 3.24Å; I602-Y635 WeakPolarHBondContact CD1-OH 3.37Å; L624-Y635 HydrophobicContact CD2-CE1 4.49Å; V626-Y635 HydrophobicContact CG1-CD2 4.23Å; V626-Y635 HydrophobicContact CG1-CE2 4.47Å; V626-Y635 HydrophobicContact CG2-CD1 3.8Å; V626-Y635 HydrophobicContact CG2-CD2 3.66Å; V626-Y635 HydrophobicContact CG2-CE1 3.93Å; V626-Y635 HydrophobicContact CG2-CE2 3.85Å; V626-Y635 HydrophobicContact CG2-CG 3.66Å; K631-Y635 HydrophobicContact CB-CE2 4.34Å; K631-Y635 WeakPolarHBondContact O-CD2 3.46Å; Y635-F637 HydrophobicContact CD1-CD1 4.42Å; Y635-F637 AromaticContact CD1-CE1 3.7Å; Y635-F637 HydrophobicContact CD1-CE1 3.7Å; Y635-F637 HydrophobicContact CD1-CZ 4.46Å; Y635-F637 HydrophobicContact CG-CE1 4.16Å; Y635-H666 WeakPolarHBondContact CD1-O 3.35Å; Y635-I667 HydrophobicContact CD1-CG1 4.5Å; Y635-I667 HydrophobicContact CE1-CB 4.46Å; Y635-I667 HydrophobicContact CE1-CG1 4.18Å; Y635-I667 HydrophobicContact CE1-CG2 4.37Å; Y635-P668 HydrophobicContact CE1-CG 4.44Å; Y635-P668 HydrophobicContact CE2-CG 4.01Å; Y635-D671 VanDerWaalsContact OH-CB 3.27Å; Y635-D671 WeakPolarHBondContact OH-CB 3.44Å; Y635-D671 PolarHBondContact OH-OD2 2.65Å; Y635-I675 HydrophobicContact CE1-CD1 4.06Å; Y635-I675 WeakPolarHBondContact OH-CD1 3.19Å
636	R	66.4	Low	71.8	Confident	188 Å²	188	88 Å²	88	71%	0.709	41%	0.405	S	S	*	.			trans	-102.2	-5.3	-173.1	-64.7	-60.5	-168.6	165	2.9	115.7	Q665	R636-Q665 WeakPolarHBondContact CB-O 3.23Å; R636-Q665 WeakPolarHBondContact CG-O 3.23Å
637	F	70	Confident	72.5	Confident	42 Å²	42	87.4 Å²	87.4	18%	0.184	40%	0.401	C	S	.	.	S	Bend	trans	-79.8	160.4	175.2	62	-100.6	0	0	0	112	L624 V626 Y635 E641 L643	L624-F637 HydrophobicContact CD2-CE1 4.41Å; V626-F637 HydrophobicContact CB-CZ 4.24Å; V626-F637 HydrophobicContact CG2-CE1 4.22Å; V626-F637 HydrophobicContact CG2-CZ 3.66Å; Y635-F637 HydrophobicContact CD1-CD1 4.42Å; Y635-F637 AromaticContact CD1-CE1 3.7Å; Y635-F637 HydrophobicContact CD1-CE1 3.7Å; Y635-F637 HydrophobicContact CD1-CZ 4.46Å; Y635-F637 HydrophobicContact CG-CE1 4.16Å; F637-E641 WeakPolarHBondContact CD2-O 3.46Å; F637-L643 HydrophobicContact CD1-CB 3.71Å; F637-L643 HydrophobicContact CE1-CB 3.94Å; F637-L643 HydrophobicContact CG-CB 4.12Å
638	K	59.5	Low	73.5	Confident	145 Å²	145	83 Å²	83	63%	0.63	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-66	149	-174.6	-77.5	169	169.1	175.4	0	112.7	N640 E641	K638-N640 PolarHBondContact O-N 3.04Å; K638-E641 HydrophobicContact CB-CB 4.26Å; K638-E641 WeakPolarHBondContact CD-OE2 3.14Å; K638-E641 IonicContact NZ-OE2 2.99Å; K638-E641 PolarHBondContact NZ-OE2 3.03Å; K638-E641 PolarHBondContact O-N 2.96Å
639	E	52.8	Low	74.4	Confident	121 Å²	121	80.6 Å²	80.6	57%	0.565	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	135.4	170.1	-72.5	-167.3	115	0	0	111.6	R632 E641	R632-E639 VanDerWaalsContact CD-OE1 3.27Å; R632-E639 WeakPolarHBondContact CD-OE1 3.45Å; R632-E639 IonicContact CZ-OE1 2.64Å; R632-E639 IonicContact NE-OE1 3.06Å; R632-E639 IonicContact NH1-OE1 3.06Å; R632-E639 PolarHBondContact NH1-OE1 2.88Å; E639-E641 PolarHBondContact O-N 3.08Å
640	N	53.6	Low	75.4	Confident	166 Å²	166	80 Å²	80	89%	0.888	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	-20.5	-176.5	-42.2	-69.8	0	0	0	116.2	K638 G642	K638-N640 PolarHBondContact O-N 3.04Å; N640-G642 PolarHBondContact O-N 3.1Å
641	E	62.5	Low	76.4	Confident	114 Å²	114	77.8 Å²	77.8	53%	0.533	37%	0.367	S	S	.	.	S	Bend	trans	-97.2	82.3	173.9	-64.3	-175.6	143.1	0	0	110.3	F637 K638 E639	F637-E641 WeakPolarHBondContact CD2-O 3.46Å; K638-E641 HydrophobicContact CB-CB 4.26Å; K638-E641 WeakPolarHBondContact CD-OE2 3.14Å; K638-E641 IonicContact NZ-OE2 2.99Å; K638-E641 PolarHBondContact NZ-OE2 3.03Å; K638-E641 PolarHBondContact O-N 2.96Å; E639-E641 PolarHBondContact O-N 3.08Å
642	G	74.8	Confident	77.4	Confident	9 Å²	9	78.5 Å²	78.5	9%	0.093	37%	0.373	C	S	.	.			trans	-56.6	139.5	177.5	0	0	0	0	0	112.9	Q623 L624 N640 Q644	Q623-G642 WeakPolarHBondContact CG-O 3.32Å; Q623-G642 PolarHBondContact NE2-O 2.93Å; L624-G642 CarbonylContact O-C 3.57Å; L624-G642 VanDerWaalsContact O-C 3.26Å; L624-G642 WeakPolarHBondContact O-CA 3.38Å; N640-G642 PolarHBondContact O-N 3.1Å; G642-Q644 PolarHBondContact O-N 3.26Å; G642-Q644 VanDerWaalsContact O-N 3.11Å
643	L	85.2	Confident	78.5	Confident	20 Å²	20	77.4 Å²	77.4	11%	0.105	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53	114.3	180	176.1	72.1	0	0	0	110.8	Q623 L624 F637 M661 H666	Q623-L643 CarbonylContact C-O 3.53Å; Q623-L643 WeakPolarHBondContact CA-O 3.15Å; L624-L643 HydrophobicContact CB-CB 4.28Å; L624-L643 HydrophobicContact CD2-CD2 4.09Å; L624-L643 PolarHBondContact N-O 3.28Å; L624-L643 PolarHBondContact O-N 3.17Å; F637-L643 HydrophobicContact CD1-CB 3.71Å; F637-L643 HydrophobicContact CE1-CB 3.94Å; F637-L643 HydrophobicContact CG-CB 4.12Å; L643-M661 HydrophobicContact CD2-CE 4.49Å; L643-M661 HydrophobicContact CD2-CG 4.2Å; L643-M661 HydrophobicContact CD2-SD 4.13Å; L643-H666 HydrophobicContact CD1-CB 4.27Å; L643-H666 HydrophobicContact CD2-CB 3.87Å
644	Q	88.3	Confident	79.6	Confident	84 Å²	84	69.5 Å²	69.5	39%	0.393	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	140.1	173.8	175.7	174.5	-6.9	0	0	110	M622 G642	M622-Q644 WeakPolarHBondContact O-CA 3.41Å; M622-Q644 WeakPolarHBondContact O-CG 3.44Å; G642-Q644 PolarHBondContact O-N 3.26Å; G642-Q644 VanDerWaalsContact O-N 3.11Å
645	F	91.5	Very high	80.6	Confident	26 Å²	26	70.1 Å²	70.1	11%	0.114	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	156.3	177.1	57.5	-77.7	0	0	0	109.8	V604 M622 L624 V657 M661 I679	V604-F645 HydrophobicContact CG1-CZ 4.45Å; M622-F645 HydrophobicContact CB-CD1 4.13Å; M622-F645 HydrophobicContact CB-CD2 3.96Å; M622-F645 HydrophobicContact CB-CE1 3.68Å; M622-F645 HydrophobicContact CB-CE2 3.5Å; M622-F645 HydrophobicContact CB-CG 4.26Å; M622-F645 HydrophobicContact CB-CZ 3.34Å; M622-F645 HydrophobicContact CG-CE2 3.95Å; M622-F645 HydrophobicContact CG-CZ 4.15Å; M622-F645 PolarHBondContact N-O 2.97Å; M622-F645 PolarHBondContact O-N 2.9Å; M622-F645 HydrophobicContact SD-CD2 4.49Å; M622-F645 HydrophobicContact SD-CE2 3.53Å; M622-F645 VanDerWaalsContact SD-CE2 3.53Å; M622-F645 HydrophobicContact SD-CZ 3.84Å; L624-F645 HydrophobicContact CB-CE1 4.22Å; F645-V657 HydrophobicContact CD2-CG1 3.91Å; F645-V657 HydrophobicContact CE2-CG1 4.04Å; F645-M661 HydrophobicContact CB-CE 3.78Å; F645-M661 HydrophobicContact CD1-CE 3.37Å; F645-M661 HydrophobicContact CD2-CE 3.33Å; F645-M661 HydrophobicContact CE1-CE 3.66Å; F645-M661 HydrophobicContact CE2-CE 3.62Å; F645-M661 HydrophobicContact CG-CE 3.21Å; F645-M661 HydrophobicContact CZ-CE 3.78Å; F645-I679 HydrophobicContact CE2-CD1 3.83Å; F645-I679 HydrophobicContact CE2-CG1 4.36Å; F645-I679 HydrophobicContact CZ-CD1 3.58Å; F645-I679 HydrophobicContact CZ-CG1 3.92Å
646	A	92	Very high	81.4	Confident	46 Å²	46	75.4 Å²	75.4	38%	0.38	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	155.7	165.2	0	0	0	0	0	109.7	E619 I620	E619-A646 HydrophobicContact CG-CB 4.04Å; E619-A646 VanDerWaalsContact OE1-CB 3.24Å; E619-A646 WeakPolarHBondContact OE1-CB 3.29Å; I620-A646 CarbonylContact O-C 3.59Å; I620-A646 WeakPolarHBondContact O-CA 3.48Å
647	F	94	Very high	82.7	Confident	1 Å²	1	66.9 Å²	66.9	0%	0.004	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	121.9	169.8	-170	-76.5	0	0	0	108.7	I620 M622 D652 P654 V657 I679 V683	I620-F647 HydrophobicContact CG1-CB 4.22Å; I620-F647 WeakPolarHBondContact CG1-O 3.37Å; I620-F647 PolarHBondContact N-O 3.44Å; I620-F647 PolarHBondContact O-N 2.83Å; M622-F647 HydrophobicContact CG-CB 4.05Å; M622-F647 HydrophobicContact SD-CB 3.63Å; M622-F647 HydrophobicContact SD-CD2 4.22Å; M622-F647 HydrophobicContact SD-CG 3.97Å; F647-D652 WeakPolarHBondContact CA-OD2 3.38Å; F647-D652 HydrophobicContact CD1-CB 4.19Å; F647-D652 HydrophobicContact CD2-CB 4.13Å; F647-D652 HydrophobicContact CE1-CB 3.86Å; F647-D652 HydrophobicContact CE2-CB 3.82Å; F647-D652 HydrophobicContact CG-CB 4.3Å; F647-D652 HydrophobicContact CZ-CB 3.67Å; F647-D652 VanDerWaalsContact CZ-O 3.31Å; F647-D652 WeakPolarHBondContact CZ-O 3.26Å; F647-P654 HydrophobicContact CE2-CB 4.41Å; F647-V657 HydrophobicContact CD2-CB 4.33Å; F647-V657 HydrophobicContact CD2-CG1 4.27Å; F647-V657 HydrophobicContact CD2-CG2 3.87Å; F647-V657 HydrophobicContact CE2-CB 4.28Å; F647-V657 HydrophobicContact CE2-CG2 3.85Å; F647-I679 HydrophobicContact CD2-CG2 3.9Å; F647-I679 HydrophobicContact CE2-CG2 3.77Å; F647-V683 HydrophobicContact CD1-CG2 3.65Å; F647-V683 HydrophobicContact CD2-CG2 4.45Å; F647-V683 HydrophobicContact CE1-CB 4.32Å; F647-V683 HydrophobicContact CE1-CG1 3.87Å; F647-V683 HydrophobicContact CE1-CG2 3.5Å; F647-V683 HydrophobicContact CE2-CG2 4.32Å; F647-V683 HydrophobicContact CG-CG2 4.16Å; F647-V683 HydrophobicContact CZ-CG1 4.48Å; F647-V683 HydrophobicContact CZ-CG2 3.87Å
648	D	92.4	Very high	83.7	Confident	37 Å²	37	64.9 Å²	64.9	20%	0.198	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	116.3	172.5	-174.4	-46.2	0	0	0	110	V618 E650 N651 D652	V618-D648 WeakPolarHBondContact CG1-OD1 3.29Å; D648-E650 PolarHBondContact O-N 3.12Å; D648-E650 VanDerWaalsContact O-N 3.15Å; D648-E650 PolarHBondContact OD1-N 3.11Å; D648-N651 HydrophobicContact CB-CB 4.15Å; D648-N651 VanDerWaalsContact CG-ND2 3.3Å; D648-N651 PolarHBondContact OD1-N 3.33Å; D648-N651 PolarHBondContact OD1-ND2 3.18Å; D648-N651 PolarHBondContact OD2-ND2 3.42Å; D648-D652 HydrophobicContact CB-CB 4.34Å; D648-D652 PolarHBondContact N-OD2 2.76Å; D648-D652 WeakPolarHBondContact O-CB 3.3Å; D648-D652 PolarHBondContact O-N 3.37Å
649	I	90.3	Very high	85.2	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.2	-175.2	-69.4	161.4	0	0	0	113	V618 I620 F686 R687	V618-I649 HydrophobicContact CG1-CB 4.49Å; V618-I649 WeakPolarHBondContact O-CB 3.31Å; V618-I649 WeakPolarHBondContact O-CD1 3.29Å; V618-I649 VanDerWaalsContact O-CG1 3.28Å; V618-I649 WeakPolarHBondContact O-CG1 3.4Å; V618-I649 PolarHBondContact O-N 2.95Å; I620-I649 HydrophobicContact CB-CD1 4.49Å; I620-I649 HydrophobicContact CD1-CD1 4.16Å; I620-I649 HydrophobicContact CD1-CG1 4.02Å; I620-I649 HydrophobicContact CG1-CD1 4.13Å; I620-I649 HydrophobicContact CG1-CG1 4.01Å; I620-I649 HydrophobicContact CG2-CD1 3.62Å; I620-I649 HydrophobicContact CG2-CG1 4.42Å; I649-F686 HydrophobicContact CD1-CD1 3.36Å; I649-F686 HydrophobicContact CD1-CE1 3.38Å; I649-F686 HydrophobicContact CD1-CG 4.41Å; I649-F686 HydrophobicContact CD1-CZ 4.44Å; I649-F686 HydrophobicContact CG1-CD1 4.38Å; I649-R687 HydrophobicContact CG2-CG 3.52Å; I649-R687 PolarHBondContact O-NE 3.13Å; I649-R687 VanDerWaalsContact O-NE 3.14Å; I649-R687 PolarHBondContact O-NH2 3.42Å
650	E	89.1	Confident	86.9	Confident	115 Å²	115	62 Å²	62	54%	0.537	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-31.3	-174	-68.4	177.7	-170.7	0	0	112.5	V618 D648 R690	V618-E650 HydrophobicContact CG1-CB 4.01Å; V618-E650 HydrophobicContact CG1-CG 3.96Å; D648-E650 PolarHBondContact O-N 3.12Å; D648-E650 VanDerWaalsContact O-N 3.15Å; D648-E650 PolarHBondContact OD1-N 3.11Å; E650-R690 IonicContact OE1-CZ 2.67Å; E650-R690 IonicContact OE1-NH1 3.38Å; E650-R690 PolarHBondContact OE1-NH1 2.89Å; E650-R690 IonicContact OE1-NH2 3.85Å; E650-R690 PolarHBondContact OE1-NH2 3.07Å
651	N	89.2	Confident	88.5	Confident	129 Å²	129	54.5 Å²	54.5	69%	0.69	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-31.6	-177.6	-60.2	-62.2	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 3.33Å; D648-N651 PolarHBondContact OD1-ND2 3.18Å; D648-N651 PolarHBondContact OD2-ND2 3.42Å
652	D	92.2	Very high	89.7	Confident	56 Å²	56	50.1 Å²	50.1	30%	0.299	26%	0.262	S	S	.	.			trans	-85	141.6	-172.5	-76.1	-25.7	0	0	0	113.9	F647 D648 V657	F647-D652 WeakPolarHBondContact CA-OD2 3.38Å; F647-D652 HydrophobicContact CD1-CB 4.19Å; F647-D652 HydrophobicContact CD2-CB 4.13Å; F647-D652 HydrophobicContact CE1-CB 3.86Å; F647-D652 HydrophobicContact CE2-CB 3.82Å; F647-D652 HydrophobicContact CG-CB 4.3Å; F647-D652 HydrophobicContact CZ-CB 3.67Å; F647-D652 VanDerWaalsContact CZ-O 3.31Å; F647-D652 WeakPolarHBondContact CZ-O 3.26Å; D648-D652 HydrophobicContact CB-CB 4.34Å; D648-D652 PolarHBondContact N-OD2 2.76Å; D648-D652 WeakPolarHBondContact O-CB 3.3Å; D648-D652 PolarHBondContact O-N 3.37Å; D652-V657 HydrophobicContact CB-CG2 3.96Å
653	S	91.5	Very high	90.4	Very high	37 Å²	37	57.2 Å²	57.2	26%	0.259	29%	0.293	S	S	.	.			trans	-96.6	131.7	169	175.8	0	0	0	0	111	D655 E656 V657	S653-D655 PolarHBondContact O-N 2.68Å; S653-E656 PolarHBondContact O-N 3.05Å; S653-E656 VanDerWaalsContact O-N 3.11Å; S653-V657 PolarHBondContact O-N 3.13Å
654	P	91.7	Very high	90.3	Very high	23 Å²	23	61.5 Å²	61.5	15%	0.149	31%	0.313	C	S	.	.	H	α-helix	trans	-65.1	-24.1	178.7	28.7	-35.7	0	0	0	113.1	F647 V658 T676 I679 K680	F647-P654 HydrophobicContact CE2-CB 4.41Å; P654-V658 VanDerWaalsContact O-CG2 3.3Å; P654-V658 WeakPolarHBondContact O-CG2 3.49Å; P654-V658 PolarHBondContact O-N 3.49Å; P654-T676 HydrophobicContact CB-CG2 4.35Å; P654-I679 HydrophobicContact CB-CB 4.39Å; P654-I679 HydrophobicContact CB-CG2 3.98Å; P654-K680 HydrophobicContact CB-CB 4.19Å; P654-K680 HydrophobicContact CG-CB 4.05Å
655	D	91.7	Very high	89.8	Confident	102 Å²	102	64.2 Å²	64.2	55%	0.545	33%	0.325	S	S	.	.	H	α-helix	trans	-72.4	-40.7	173.3	-68.9	-98.5	0	0	0	111.1	S653 Q659 T676	S653-D655 PolarHBondContact O-N 2.68Å; D655-Q659 WeakPolarHBondContact O-CB 3.42Å; D655-Q659 PolarHBondContact O-N 2.8Å; D655-T676 HydrophobicContact CB-CG2 4.34Å; D655-T676 WeakPolarHBondContact OD1-CG2 3.45Å
656	E	91.7	Very high	89.2	Confident	122 Å²	122	65.7 Å²	65.7	57%	0.57	33%	0.333	S	S	*	.	H	α-helix	trans	-73.1	-42.7	-178.9	-65.9	177.4	-170.6	0	0	112.1	S653 V658 Q659 Q660	S653-E656 PolarHBondContact O-N 3.05Å; S653-E656 VanDerWaalsContact O-N 3.11Å; E656-V658 VanDerWaalsContact C-N 3.3Å; E656-V658 PolarHBondContact O-N 2.99Å; E656-Q659 WeakPolarHBondContact O-CB 3.28Å; E656-Q659 PolarHBondContact O-N 2.86Å; E656-Q659 VanDerWaalsContact O-N 3.11Å; E656-Q660 WeakPolarHBondContact O-CG 3.24Å; E656-Q660 PolarHBondContact O-N 3.16Å
657	V	92.3	Very high	88.8	Confident	9 Å²	9	63.9 Å²	63.9	6%	0.055	32%	0.316	C	S	.	.	H	α-helix	trans	-60.5	-39.6	175.9	170.4	0	0	0	0	111.2	F645 F647 D652 S653 Q660 M661	F645-V657 HydrophobicContact CD2-CG1 3.91Å; F645-V657 HydrophobicContact CE2-CG1 4.04Å; F647-V657 HydrophobicContact CD2-CB 4.33Å; F647-V657 HydrophobicContact CD2-CG1 4.27Å; F647-V657 HydrophobicContact CD2-CG2 3.87Å; F647-V657 HydrophobicContact CE2-CB 4.28Å; F647-V657 HydrophobicContact CE2-CG2 3.85Å; D652-V657 HydrophobicContact CB-CG2 3.96Å; S653-V657 PolarHBondContact O-N 3.13Å; V657-Q660 PolarHBondContact O-N 3.18Å; V657-M661 HydrophobicContact CG1-CE 3.56Å; V657-M661 HydrophobicContact CG1-SD 4.5Å; V657-M661 VanDerWaalsContact O-CG 3.31Å; V657-M661 WeakPolarHBondContact O-CG 3.36Å; V657-M661 PolarHBondContact O-N 3.29Å; V657-M661 VanDerWaalsContact O-N 3.17Å
658	V	91.6	Very high	88.2	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-70.8	-37	173.9	175.2	0	0	0	0	111.8	P654 E656 Q660 M661 I662 T672 I675 I679	P654-V658 VanDerWaalsContact O-CG2 3.3Å; P654-V658 WeakPolarHBondContact O-CG2 3.49Å; P654-V658 PolarHBondContact O-N 3.49Å; E656-V658 VanDerWaalsContact C-N 3.3Å; E656-V658 PolarHBondContact O-N 2.99Å; V658-Q660 VanDerWaalsContact C-N 3.3Å; V658-Q660 PolarHBondContact O-N 3.33Å; V658-M661 WeakPolarHBondContact O-CB 3.27Å; V658-M661 PolarHBondContact O-N 2.86Å; V658-M661 VanDerWaalsContact O-N 3.15Å; V658-I662 HydrophobicContact CG1-CD1 3.95Å; V658-I662 WeakPolarHBondContact O-CG1 3.46Å; V658-I662 PolarHBondContact O-N 3.11Å; V658-T672 HydrophobicContact CG1-CG2 3.94Å; V658-I675 HydrophobicContact CG2-CG2 4.01Å; V658-I679 HydrophobicContact CG2-CD1 3.69Å
659	Q	90	Very high	87.8	Confident	112 Å²	112	68.1 Å²	68.1	52%	0.523	34%	0.34	S	S	.	.	H	α-helix	trans	-62.3	-37.4	175.8	-172.7	56.4	82.8	0	0	112.2	D655 E656 I662 E663	D655-Q659 WeakPolarHBondContact O-CB 3.42Å; D655-Q659 PolarHBondContact O-N 2.8Å; E656-Q659 WeakPolarHBondContact O-CB 3.28Å; E656-Q659 PolarHBondContact O-N 2.86Å; E656-Q659 VanDerWaalsContact O-N 3.11Å; Q659-I662 PolarHBondContact O-N 3.03Å; Q659-E663 PolarHBondContact O-N 2.95Å
660	Q	89.3	Confident	87.4	Confident	94 Å²	94	74.7 Å²	74.7	44%	0.439	37%	0.37	S	S	.	.	H	α-helix	trans	-65.5	-40.4	171.9	-67.8	176.8	35.3	0	0	112.2	E656 V657 V658 I662 E663 Q664	E656-Q660 WeakPolarHBondContact O-CG 3.24Å; E656-Q660 PolarHBondContact O-N 3.16Å; V657-Q660 PolarHBondContact O-N 3.18Å; V658-Q660 VanDerWaalsContact C-N 3.3Å; V658-Q660 PolarHBondContact O-N 3.33Å; Q660-I662 VanDerWaalsContact C-N 3.27Å; Q660-I662 PolarHBondContact O-N 3.12Å; Q660-E663 PolarHBondContact O-N 3.35Å; Q660-Q664 WeakPolarHBondContact O-CB 3.39Å; Q660-Q664 VanDerWaalsContact O-CG 3.23Å; Q660-Q664 WeakPolarHBondContact O-CG 3.29Å; Q660-Q664 PolarHBondContact O-N 2.72Å
661	M	88.1	Confident	87.1	Confident	7 Å²	7	70 Å²	70	3%	0.034	35%	0.349	C	S	.	.	H	α-helix	trans	-65.6	-28.9	176.1	-67.7	168.7	-176.9	0	0	113.3	L643 F645 V657 V658 Q665 H666 I667 I679	L643-M661 HydrophobicContact CD2-CE 4.49Å; L643-M661 HydrophobicContact CD2-CG 4.2Å; L643-M661 HydrophobicContact CD2-SD 4.13Å; F645-M661 HydrophobicContact CB-CE 3.78Å; F645-M661 HydrophobicContact CD1-CE 3.37Å; F645-M661 HydrophobicContact CD2-CE 3.33Å; F645-M661 HydrophobicContact CE1-CE 3.66Å; F645-M661 HydrophobicContact CE2-CE 3.62Å; F645-M661 HydrophobicContact CG-CE 3.21Å; F645-M661 HydrophobicContact CZ-CE 3.78Å; V657-M661 HydrophobicContact CG1-CE 3.56Å; V657-M661 HydrophobicContact CG1-SD 4.5Å; V657-M661 VanDerWaalsContact O-CG 3.31Å; V657-M661 WeakPolarHBondContact O-CG 3.36Å; V657-M661 PolarHBondContact O-N 3.29Å; V657-M661 VanDerWaalsContact O-N 3.17Å; V658-M661 WeakPolarHBondContact O-CB 3.27Å; V658-M661 PolarHBondContact O-N 2.86Å; V658-M661 VanDerWaalsContact O-N 3.15Å; M661-Q665 PolarHBondContact O-N 2.84Å; M661-H666 PolarHBondContact O-N 3.09Å; M661-I667 HydrophobicContact CB-CB 4.39Å; M661-I667 HydrophobicContact CB-CD1 3.57Å; M661-I667 HydrophobicContact CB-CG1 3.95Å; M661-I667 HydrophobicContact CG-CD1 4.08Å; M661-I667 PolarHBondContact O-N 3.46Å; M661-I667 HydrophobicContact SD-CD1 3.43Å; M661-I667 WeakPolarHBondContact SD-CD1 3.45Å; M661-I679 HydrophobicContact CE-CD1 4.39Å; M661-I679 HydrophobicContact SD-CD1 4.5Å
662	I	87.9	Confident	86.9	Confident	23 Å²	23	65.6 Å²	65.6	12%	0.118	33%	0.327	C	S	.	.	H	α-helix	trans	-73.6	-45.2	172.7	-69	162.1	0	0	0	110.3	V658 Q659 Q660 Q664 Q665 I667 D669 T672	V658-I662 HydrophobicContact CG1-CD1 3.95Å; V658-I662 WeakPolarHBondContact O-CG1 3.46Å; V658-I662 PolarHBondContact O-N 3.11Å; Q659-I662 PolarHBondContact O-N 3.03Å; Q660-I662 VanDerWaalsContact C-N 3.27Å; Q660-I662 PolarHBondContact O-N 3.12Å; I662-Q664 VanDerWaalsContact C-N 3.29Å; I662-Q664 PolarHBondContact O-N 3.16Å; I662-Q665 WeakPolarHBondContact O-CA 3.14Å; I662-Q665 PolarHBondContact O-N 3.16Å; I662-I667 HydrophobicContact CG1-CB 4.34Å; I662-I667 HydrophobicContact CG1-CG2 4.32Å; I662-D669 VanDerWaalsContact CG2-OD1 3.31Å; I662-D669 WeakPolarHBondContact CG2-OD1 3.45Å; I662-T672 HydrophobicContact CD1-CG2 3.78Å; I662-T672 WeakPolarHBondContact CD1-OG1 3.47Å
663	E	88	Confident	86.6	Confident	158 Å²	158	73.2 Å²	73.2	74%	0.738	35%	0.351	S	S	*	.	H	α-helix	trans	-60	-39	175.9	-174	172.6	-161.5	0	0	112.1	Q659 Q660 Q665	Q659-E663 PolarHBondContact O-N 2.95Å; Q660-E663 PolarHBondContact O-N 3.35Å; E663-Q665 PolarHBondContact O-N 2.95Å
664	Q	84.8	Confident	86.2	Confident	110 Å²	110	74 Å²	74	51%	0.514	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	1.3	172.6	-65.9	168.1	13.5	0	0	113.9	Q660 I662 H666	Q660-Q664 WeakPolarHBondContact O-CB 3.39Å; Q660-Q664 VanDerWaalsContact O-CG 3.23Å; Q660-Q664 WeakPolarHBondContact O-CG 3.29Å; Q660-Q664 PolarHBondContact O-N 2.72Å; I662-Q664 VanDerWaalsContact C-N 3.29Å; I662-Q664 PolarHBondContact O-N 3.16Å; Q664-H666 PolarHBondContact O-N 3.35Å; Q664-H666 PolarHBondContact OE1-CD2 3.46Å
665	Q	77.2	Confident	86	Confident	140 Å²	140	72.9 Å²	72.9	65%	0.654	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	26.6	-177.4	-55	-171.8	4.2	0	0	114.7	R636 M661 I662 E663	R636-Q665 WeakPolarHBondContact CB-O 3.23Å; R636-Q665 WeakPolarHBondContact CG-O 3.23Å; M661-Q665 PolarHBondContact O-N 2.84Å; I662-Q665 WeakPolarHBondContact O-CA 3.14Å; I662-Q665 PolarHBondContact O-N 3.16Å; E663-Q665 PolarHBondContact O-N 2.95Å
666	H	79.2	Confident	85.9	Confident	58 Å²	58	68.7 Å²	68.7	27%	0.269	32%	0.323	S	S	.	.	S	Bend	trans	-81.1	-29	176.7	-68.7	-26.1	0	0	0	112.8	Y635 L643 M661 Q664	Y635-H666 WeakPolarHBondContact CD1-O 3.35Å; L643-H666 HydrophobicContact CD1-CB 4.27Å; L643-H666 HydrophobicContact CD2-CB 3.87Å; M661-H666 PolarHBondContact O-N 3.09Å; Q664-H666 PolarHBondContact O-N 3.35Å; Q664-H666 PolarHBondContact OE1-CD2 3.46Å
667	I	82.4	Confident	85.6	Confident	7 Å²	7	68.1 Å²	68.1	4%	0.036	32%	0.318	C	S	.	.	S	Bend	trans	-125.9	141.6	-174.9	-64.9	-178.1	0	0	0	110.2	L624 Y635 M661 I662 I675	L624-I667 HydrophobicContact CD2-CD1 3.63Å; L624-I667 HydrophobicContact CD2-CG1 3.97Å; Y635-I667 HydrophobicContact CD1-CG1 4.5Å; Y635-I667 HydrophobicContact CE1-CB 4.46Å; Y635-I667 HydrophobicContact CE1-CG1 4.18Å; Y635-I667 HydrophobicContact CE1-CG2 4.37Å; M661-I667 HydrophobicContact CB-CB 4.39Å; M661-I667 HydrophobicContact CB-CD1 3.57Å; M661-I667 HydrophobicContact CB-CG1 3.95Å; M661-I667 HydrophobicContact CG-CD1 4.08Å; M661-I667 PolarHBondContact O-N 3.46Å; M661-I667 HydrophobicContact SD-CD1 3.43Å; M661-I667 WeakPolarHBondContact SD-CD1 3.45Å; I662-I667 HydrophobicContact CG1-CB 4.34Å; I662-I667 HydrophobicContact CG1-CG2 4.32Å; I667-I675 HydrophobicContact CD1-CD1 3.92Å; I667-I675 HydrophobicContact CD1-CG2 4.07Å; I667-I675 HydrophobicContact CG1-CD1 4.37Å; I667-I675 HydrophobicContact CG2-CD1 3.81Å
668	P	81.9	Confident	85.4	Confident	15 Å²	15	68.1 Å²	68.1	10%	0.097	32%	0.318	C	S	.	.			trans	-84.5	142.4	172.7	34	-35	0	0	0	113.7	Q634 Y635 E670 D671	Q634-P668 HydrophobicContact CG-CB 3.79Å; Q634-P668 HydrophobicContact CG-CG 3.85Å; Y635-P668 HydrophobicContact CE1-CG 4.44Å; Y635-P668 HydrophobicContact CE2-CG 4.01Å; P668-E670 PolarHBondContact O-N 3.01Å; P668-D671 HydrophobicContact CG-CB 4.43Å; P668-D671 PolarHBondContact O-N 3.44Å; P668-D671 VanDerWaalsContact O-N 3.09Å
669	D	82.9	Confident	85.3	Confident	113 Å²	113	68.1 Å²	68.1	60%	0.604	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-50.2	-34.1	-177.4	-57.9	-8.2	0	0	0	114.3	I662 D671 T672	I662-D669 VanDerWaalsContact CG2-OD1 3.31Å; I662-D669 WeakPolarHBondContact CG2-OD1 3.45Å; D669-D671 VanDerWaalsContact C-N 3.32Å; D669-D671 PolarHBondContact O-N 2.63Å; D669-T672 VanDerWaalsContact C-OG1 3.31Å; D669-T672 WeakPolarHBondContact CA-OG1 3.5Å; D669-T672 WeakPolarHBondContact O-CB 3.39Å; D669-T672 PolarHBondContact O-N 3.4Å; D669-T672 PolarHBondContact O-OG1 3.09Å
670	E	82	Confident	85.2	Confident	138 Å²	138	67.8 Å²	67.8	65%	0.645	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-67.2	-31.2	-177.1	-59.3	91.4	166.8	0	0	113.5	Q634 P668	Q634-E670 PolarHBondContact NE2-OE2 2.91Å; P668-E670 PolarHBondContact O-N 3.01Å
671	D	82.6	Confident	85	Confident	18 Å²	18	65 Å²	65	10%	0.096	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-89.9	-8.4	-178.2	-82.9	-25	0	0	0	113.3	I602 K631 Y635 P668 D669 R673 M674 I675	I602-D671 WeakPolarHBondContact CD1-OD2 3.39Å; K631-D671 IonicContact NZ-OD1 2.64Å; K631-D671 PolarHBondContact NZ-OD1 3.08Å; K631-D671 IonicContact NZ-OD2 3.47Å; K631-D671 PolarHBondContact NZ-OD2 3.32Å; Y635-D671 VanDerWaalsContact OH-CB 3.27Å; Y635-D671 WeakPolarHBondContact OH-CB 3.44Å; Y635-D671 PolarHBondContact OH-OD2 2.65Å; P668-D671 HydrophobicContact CG-CB 4.43Å; P668-D671 PolarHBondContact O-N 3.44Å; P668-D671 VanDerWaalsContact O-N 3.09Å; D669-D671 VanDerWaalsContact C-N 3.32Å; D669-D671 PolarHBondContact O-N 2.63Å; D671-R673 PolarHBondContact O-N 3.06Å; D671-M674 HydrophobicContact CB-CE 4.39Å; D671-M674 WeakPolarHBondContact O-CA 3.31Å; D671-M674 WeakPolarHBondContact O-CB 3.49Å; D671-M674 PolarHBondContact O-N 3.38Å; D671-M674 VanDerWaalsContact OD1-CE 3.28Å; D671-M674 WeakPolarHBondContact OD1-CE 3.49Å; D671-I675 HydrophobicContact CB-CD1 4.2Å; D671-I675 PolarHBondContact O-N 3.35Å
672	T	86.8	Confident	84.9	Confident	36 Å²	36	66.5 Å²	66.5	22%	0.221	31%	0.309	C	S	.	.	H	α-helix	trans	-36.8	-66.8	-179.7	-56.1	0	0	0	0	113.3	V658 I662 D669 M674 I675 T676	V658-T672 HydrophobicContact CG1-CG2 3.94Å; I662-T672 HydrophobicContact CD1-CG2 3.78Å; I662-T672 WeakPolarHBondContact CD1-OG1 3.47Å; D669-T672 VanDerWaalsContact C-OG1 3.31Å; D669-T672 WeakPolarHBondContact CA-OG1 3.5Å; D669-T672 WeakPolarHBondContact O-CB 3.39Å; D669-T672 PolarHBondContact O-N 3.4Å; D669-T672 PolarHBondContact O-OG1 3.09Å; T672-M674 PolarHBondContact O-N 3.02Å; T672-I675 PolarHBondContact O-N 3.38Å; T672-T676 PolarHBondContact O-N 2.79Å; T672-T676 PolarHBondContact O-OG1 3.07Å; T672-T676 VanDerWaalsContact O-OG1 3.07Å
673	R	85	Confident	85.1	Confident	215 Å²	215	65.6 Å²	65.6	81%	0.811	30%	0.304	S	S	*	.	H	α-helix	trans	-58	-26.2	-175.6	-68.8	-179.9	-67.3	-134.1	-6.6	113.6	D671 K677	D671-R673 PolarHBondContact O-N 3.06Å; R673-K677 WeakPolarHBondContact O-CB 3.42Å; R673-K677 PolarHBondContact O-N 3.47Å
674	M	83	Confident	85.1	Confident	54 Å²	54	60.7 Å²	60.7	27%	0.266	28%	0.283	S	S	.	.	H	α-helix	trans	-83.2	-37.5	-179.8	-169	171.1	62	0	0	111.1	I600 I602 D671 T672 K677 L678	I600-M674 HydrophobicContact CB-SD 4.22Å; I600-M674 HydrophobicContact CG1-SD 4.16Å; I600-M674 HydrophobicContact CG2-CE 3.76Å; I600-M674 HydrophobicContact CG2-CG 4.18Å; I600-M674 HydrophobicContact CG2-SD 3.66Å; I602-M674 HydrophobicContact CD1-CE 3.61Å; D671-M674 HydrophobicContact CB-CE 4.39Å; D671-M674 WeakPolarHBondContact O-CA 3.31Å; D671-M674 WeakPolarHBondContact O-CB 3.49Å; D671-M674 PolarHBondContact O-N 3.38Å; D671-M674 VanDerWaalsContact OD1-CE 3.28Å; D671-M674 WeakPolarHBondContact OD1-CE 3.49Å; T672-M674 PolarHBondContact O-N 3.02Å; M674-K677 PolarHBondContact O-N 2.95Å; M674-L678 VanDerWaalsContact O-CG 3.31Å; M674-L678 WeakPolarHBondContact O-CG 3.31Å; M674-L678 PolarHBondContact O-N 3.44Å
675	I	87.2	Confident	85	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-76.4	-40.2	176.9	-63.5	174.2	0	0	0	111.1	I602 L624 Y635 V658 I667 D671 T672 K677 L678 I679	I602-I675 HydrophobicContact CG2-CD1 4.43Å; I602-I675 HydrophobicContact CG2-CG1 4.36Å; L624-I675 HydrophobicContact CD1-CD1 4.17Å; L624-I675 HydrophobicContact CD1-CG1 4.3Å; L624-I675 HydrophobicContact CD1-CG2 4.03Å; L624-I675 HydrophobicContact CD2-CD1 4.14Å; Y635-I675 HydrophobicContact CE1-CD1 4.06Å; Y635-I675 WeakPolarHBondContact OH-CD1 3.19Å; V658-I675 HydrophobicContact CG2-CG2 4.01Å; I667-I675 HydrophobicContact CD1-CD1 3.92Å; I667-I675 HydrophobicContact CD1-CG2 4.07Å; I667-I675 HydrophobicContact CG1-CD1 4.37Å; I667-I675 HydrophobicContact CG2-CD1 3.81Å; D671-I675 HydrophobicContact CB-CD1 4.2Å; D671-I675 PolarHBondContact O-N 3.35Å; T672-I675 PolarHBondContact O-N 3.38Å; I675-K677 PolarHBondContact O-N 3.41Å; I675-L678 PolarHBondContact O-N 2.94Å; I675-L678 VanDerWaalsContact O-N 3.09Å; I675-I679 HydrophobicContact CG2-CD1 3.95Å; I675-I679 HydrophobicContact CG2-CG1 4.28Å; I675-I679 WeakPolarHBondContact O-CG1 3.2Å; I675-I679 PolarHBondContact O-N 2.99Å
676	T	90	Very high	85.5	Confident	14 Å²	14	49.4 Å²	49.4	9%	0.086	23%	0.233	C	C	.	.	H	α-helix	trans	-53.3	-44.1	169.3	-56.7	0	0	0	0	110.8	P654 D655 T672 K680	P654-T676 HydrophobicContact CB-CG2 4.35Å; D655-T676 HydrophobicContact CB-CG2 4.34Å; D655-T676 WeakPolarHBondContact OD1-CG2 3.45Å; T672-T676 PolarHBondContact O-N 2.79Å; T672-T676 PolarHBondContact O-OG1 3.07Å; T672-T676 VanDerWaalsContact O-OG1 3.07Å; T676-K680 VanDerWaalsContact O-CB 3.31Å; T676-K680 WeakPolarHBondContact O-CB 3.4Å; T676-K680 PolarHBondContact O-N 3.19Å
677	K	86.3	Confident	86	Confident	110 Å²	110	50.9 Å²	50.9	48%	0.478	24%	0.236	S	C	.	.	H	α-helix	trans	-63.3	-47.5	174.9	-166.3	-164.5	-177.1	-53.6	0	112.1	R673 M674 I675 I679 K680 D681	R673-K677 WeakPolarHBondContact O-CB 3.42Å; R673-K677 PolarHBondContact O-N 3.47Å; M674-K677 PolarHBondContact O-N 2.95Å; I675-K677 PolarHBondContact O-N 3.41Å; K677-I679 PolarHBondContact O-N 3.42Å; K677-K680 PolarHBondContact O-N 3.33Å; K677-D681 IonicContact NZ-OD1 3.54Å; K677-D681 PolarHBondContact NZ-OD1 3.45Å; K677-D681 IonicContact NZ-OD2 3.58Å; K677-D681 PolarHBondContact NZ-OD2 2.68Å; K677-D681 WeakPolarHBondContact O-CB 3.48Å; K677-D681 PolarHBondContact O-N 3.02Å
678	L	86.4	Confident	86.1	Confident	8 Å²	8	55.1 Å²	55.1	4%	0.042	25%	0.252	C	S	.	.	H	α-helix	trans	-63.1	-39	179.8	-72.9	167.5	0	0	0	112.8	I600 I602 V604 M674 I675 K682	I600-L678 HydrophobicContact CD1-CD2 4.34Å; I600-L678 HydrophobicContact CG2-CD1 4Å; I602-L678 HydrophobicContact CG2-CD1 4.3Å; V604-L678 HydrophobicContact CB-CB 4.4Å; V604-L678 HydrophobicContact CG2-CB 3.74Å; M674-L678 VanDerWaalsContact O-CG 3.31Å; M674-L678 WeakPolarHBondContact O-CG 3.31Å; M674-L678 PolarHBondContact O-N 3.44Å; I675-L678 PolarHBondContact O-N 2.94Å; I675-L678 VanDerWaalsContact O-N 3.09Å; L678-K682 WeakPolarHBondContact O-CB 3.38Å; L678-K682 WeakPolarHBondContact O-CG 3.43Å; L678-K682 PolarHBondContact O-N 3.25Å; L678-K682 VanDerWaalsContact O-N 3.14Å
679	I	89.4	Confident	86.3	Confident	0 Å²	0	55 Å²	55	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-66.2	-47.6	174.7	-66.7	176.4	0	0	0	109.5	V604 M622 F645 F647 P654 V658 M661 I675 K677 K682 V683	V604-I679 HydrophobicContact CG1-CG1 4.41Å; V604-I679 HydrophobicContact CG2-CG1 4.18Å; M622-I679 HydrophobicContact CE-CG2 4.38Å; M622-I679 HydrophobicContact SD-CG2 4.11Å; F645-I679 HydrophobicContact CE2-CD1 3.83Å; F645-I679 HydrophobicContact CE2-CG1 4.36Å; F645-I679 HydrophobicContact CZ-CD1 3.58Å; F645-I679 HydrophobicContact CZ-CG1 3.92Å; F647-I679 HydrophobicContact CD2-CG2 3.9Å; F647-I679 HydrophobicContact CE2-CG2 3.77Å; P654-I679 HydrophobicContact CB-CB 4.39Å; P654-I679 HydrophobicContact CB-CG2 3.98Å; V658-I679 HydrophobicContact CG2-CD1 3.69Å; M661-I679 HydrophobicContact CE-CD1 4.39Å; M661-I679 HydrophobicContact SD-CD1 4.5Å; I675-I679 HydrophobicContact CG2-CD1 3.95Å; I675-I679 HydrophobicContact CG2-CG1 4.28Å; I675-I679 WeakPolarHBondContact O-CG1 3.2Å; I675-I679 PolarHBondContact O-N 2.99Å; K677-I679 PolarHBondContact O-N 3.42Å; I679-K682 WeakPolarHBondContact O-CB 3.44Å; I679-K682 PolarHBondContact O-N 3.09Å; I679-V683 HydrophobicContact CG2-CG2 4.3Å; I679-V683 WeakPolarHBondContact O-CG2 3.36Å; I679-V683 PolarHBondContact O-N 3.02Å
680	K	89.2	Confident	86.5	Confident	106 Å²	106	51.2 Å²	51.2	46%	0.461	23%	0.227	S	C	.	.	H	α-helix	trans	-58.9	-50.4	176.4	-179.4	167.5	-179.3	166.5	0	112.7	P654 T676 K677 K682 V683 D684	P654-K680 HydrophobicContact CB-CB 4.19Å; P654-K680 HydrophobicContact CG-CB 4.05Å; T676-K680 VanDerWaalsContact O-CB 3.31Å; T676-K680 WeakPolarHBondContact O-CB 3.4Å; T676-K680 PolarHBondContact O-N 3.19Å; K677-K680 PolarHBondContact O-N 3.33Å; K680-K682 PolarHBondContact O-N 2.75Å; K680-V683 PolarHBondContact O-N 3.28Å; K680-V683 VanDerWaalsContact O-N 3.15Å; K680-D684 WeakPolarHBondContact CE-OD2 3.47Å; K680-D684 WeakPolarHBondContact CG-OD2 3.33Å; K680-D684 WeakPolarHBondContact O-CB 3.25Å; K680-D684 PolarHBondContact O-N 3Å
681	D	84.5	Confident	86.8	Confident	34 Å²	34	48 Å²	48	18%	0.182	22%	0.215	C	C	.	.	H	α-helix	trans	-56.9	-35.6	178.7	-66.1	-24.7	0	0	0	110.9	K677 A685	K677-D681 IonicContact NZ-OD1 3.54Å; K677-D681 PolarHBondContact NZ-OD1 3.45Å; K677-D681 IonicContact NZ-OD2 3.58Å; K677-D681 PolarHBondContact NZ-OD2 2.68Å; K677-D681 WeakPolarHBondContact O-CB 3.48Å; K677-D681 PolarHBondContact O-N 3.02Å; D681-A685 WeakPolarHBondContact O-CB 3.47Å; D681-A685 PolarHBondContact O-N 3.41Å; D681-A685 VanDerWaalsContact O-N 3.14Å
682	K	87.1	Confident	86.8	Confident	39 Å²	39	48.4 Å²	48.4	17%	0.17	22%	0.216	C	C	.	.	H	α-helix	trans	-72.2	-43.1	174.3	-78.3	-54.6	-168.3	-161.7	0	114.2	D592 V604 M622 L678 I679 K680 A685 F686	D592-K682 WeakPolarHBondContact OD2-CD 3.48Å; D592-K682 WeakPolarHBondContact OD2-CE 3.16Å; D592-K682 IonicContact OD2-NZ 3.83Å; D592-K682 PolarHBondContact OD2-NZ 2.9Å; V604-K682 HydrophobicContact CB-CG 4.23Å; V604-K682 HydrophobicContact CG1-CG 4.13Å; V604-K682 WeakPolarHBondContact O-CE 3.22Å; M622-K682 HydrophobicContact CE-CB 3.58Å; M622-K682 HydrophobicContact CE-CG 4.35Å; L678-K682 WeakPolarHBondContact O-CB 3.38Å; L678-K682 WeakPolarHBondContact O-CG 3.43Å; L678-K682 PolarHBondContact O-N 3.25Å; L678-K682 VanDerWaalsContact O-N 3.14Å; I679-K682 WeakPolarHBondContact O-CB 3.44Å; I679-K682 PolarHBondContact O-N 3.09Å; K680-K682 PolarHBondContact O-N 2.75Å; K682-A685 WeakPolarHBondContact O-CB 3.37Å; K682-A685 PolarHBondContact O-N 3.09Å; K682-F686 PolarHBondContact O-N 3.47Å
683	V	90.3	Very high	86.7	Confident	4 Å²	4	50.4 Å²	50.4	2%	0.024	22%	0.219	C	C	.	.	H	α-helix	trans	-67.8	-44.1	178.1	172.4	0	0	0	0	110.4	M622 F647 I679 K680 A685 F686 R687	M622-V683 HydrophobicContact CE-CG2 4.22Å; M622-V683 HydrophobicContact SD-CG2 4.4Å; F647-V683 HydrophobicContact CD1-CG2 3.65Å; F647-V683 HydrophobicContact CD2-CG2 4.45Å; F647-V683 HydrophobicContact CE1-CB 4.32Å; F647-V683 HydrophobicContact CE1-CG1 3.87Å; F647-V683 HydrophobicContact CE1-CG2 3.5Å; F647-V683 HydrophobicContact CE2-CG2 4.32Å; F647-V683 HydrophobicContact CG-CG2 4.16Å; F647-V683 HydrophobicContact CZ-CG1 4.48Å; F647-V683 HydrophobicContact CZ-CG2 3.87Å; I679-V683 HydrophobicContact CG2-CG2 4.3Å; I679-V683 WeakPolarHBondContact O-CG2 3.36Å; I679-V683 PolarHBondContact O-N 3.02Å; K680-V683 PolarHBondContact O-N 3.28Å; K680-V683 VanDerWaalsContact O-N 3.15Å; V683-A685 PolarHBondContact O-N 3.23Å; V683-F686 PolarHBondContact O-N 3.18Å; V683-R687 HydrophobicContact CG1-CG 4.37Å; V683-R687 WeakPolarHBondContact O-CB 3.37Å; V683-R687 WeakPolarHBondContact O-CG 3.49Å; V683-R687 PolarHBondContact O-N 2.65Å
684	D	87.8	Confident	86.9	Confident	55 Å²	55	43.7 Å²	43.7	29%	0.294	20%	0.199	S	C	.	.	H	α-helix	trans	-68.7	-17	175.4	-70.4	-19	0	0	0	112.6	K680 R687 R688	K680-D684 WeakPolarHBondContact CE-OD2 3.47Å; K680-D684 WeakPolarHBondContact CG-OD2 3.33Å; K680-D684 WeakPolarHBondContact O-CB 3.25Å; K680-D684 PolarHBondContact O-N 3Å; D684-R687 IonicContact OD1-NH1 3.22Å; D684-R687 PolarHBondContact OD1-NH1 3.11Å; D684-R688 WeakPolarHBondContact O-CG 3.21Å; D684-R688 PolarHBondContact O-NE 2.71Å; D684-R688 PolarHBondContact O-NH2 3.05Å
685	A	83.7	Confident	87	Confident	14 Å²	14	45.8 Å²	45.8	12%	0.116	21%	0.211	C	C	.	.	H	α-helix	trans	-79.1	-53	165.2	0	0	0	0	0	111.9	D681 K682 V683 R687 R688 D689	D681-A685 WeakPolarHBondContact O-CB 3.47Å; D681-A685 PolarHBondContact O-N 3.41Å; D681-A685 VanDerWaalsContact O-N 3.14Å; K682-A685 WeakPolarHBondContact O-CB 3.37Å; K682-A685 PolarHBondContact O-N 3.09Å; V683-A685 PolarHBondContact O-N 3.23Å; A685-R687 VanDerWaalsContact C-N 3.35Å; A685-R687 PolarHBondContact O-N 3.3Å; A685-R688 PolarHBondContact O-N 2.94Å; A685-D689 PolarHBondContact O-N 3.03Å; A685-D689 VanDerWaalsContact O-N 3.08Å
686	F	88.7	Confident	86.8	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.1	-41.6	-178.1	-169.5	-80.7	0	0	0	112.6	I606 R609 D612 L613 I620 I649 K682 V683 R688 D689 R690	I606-F686 HydrophobicContact CD1-CB 3.91Å; I606-F686 HydrophobicContact CD1-CD2 3.7Å; I606-F686 HydrophobicContact CD1-CG 4.14Å; R609-F686 HydrophobicContact CG-CD2 4.4Å; R609-F686 HydrophobicContact CG-CE2 4.36Å; D612-F686 HydrophobicContact CB-CE2 3.98Å; D612-F686 HydrophobicContact CB-CZ 3.71Å; L613-F686 HydrophobicContact CB-CE2 4.24Å; L613-F686 HydrophobicContact CB-CZ 4.23Å; L613-F686 HydrophobicContact CD1-CE1 4.32Å; L613-F686 HydrophobicContact CD1-CE2 4.13Å; L613-F686 HydrophobicContact CD1-CZ 3.99Å; I620-F686 HydrophobicContact CD1-CG 4.39Å; I620-F686 HydrophobicContact CG2-CD1 4.42Å; I620-F686 HydrophobicContact CG2-CE1 3.96Å; I620-F686 HydrophobicContact CG2-CE2 4.15Å; I620-F686 HydrophobicContact CG2-CZ 3.81Å; I649-F686 HydrophobicContact CD1-CD1 3.36Å; I649-F686 HydrophobicContact CD1-CE1 3.38Å; I649-F686 HydrophobicContact CD1-CG 4.41Å; I649-F686 HydrophobicContact CD1-CZ 4.44Å; I649-F686 HydrophobicContact CG1-CD1 4.38Å; K682-F686 PolarHBondContact O-N 3.47Å; V683-F686 PolarHBondContact O-N 3.18Å; F686-R688 PolarHBondContact O-N 2.97Å; F686-D689 PolarHBondContact O-N 2.8Å; F686-R690 HydrophobicContact CE1-CB 4.35Å; F686-R690 WeakPolarHBondContact O-CB 3.48Å; F686-R690 PolarHBondContact O-N 3.06Å
687	R	88.8	Confident	86.7	Confident	88 Å²	88	51.4 Å²	51.4	33%	0.332	24%	0.237	S	C	.	.	H	α-helix	trans	-52.5	-53.7	173.1	-76.4	173.4	173.1	170	-7.7	111.6	I649 V683 D684 A685 D689 R690 D691	I649-R687 HydrophobicContact CG2-CG 3.52Å; I649-R687 PolarHBondContact O-NE 3.13Å; I649-R687 VanDerWaalsContact O-NE 3.14Å; I649-R687 PolarHBondContact O-NH2 3.42Å; V683-R687 HydrophobicContact CG1-CG 4.37Å; V683-R687 WeakPolarHBondContact O-CB 3.37Å; V683-R687 WeakPolarHBondContact O-CG 3.49Å; V683-R687 PolarHBondContact O-N 2.65Å; D684-R687 IonicContact OD1-NH1 3.22Å; D684-R687 PolarHBondContact OD1-NH1 3.11Å; A685-R687 VanDerWaalsContact C-N 3.35Å; A685-R687 PolarHBondContact O-N 3.3Å; R687-D689 VanDerWaalsContact C-N 3.32Å; R687-D689 PolarHBondContact O-N 2.91Å; R687-R690 WeakPolarHBondContact O-CB 3.39Å; R687-R690 PolarHBondContact O-N 2.92Å; R687-R690 VanDerWaalsContact O-N 3.08Å; R687-D691 PolarHBondContact O-N 3.48Å
688	R	85	Confident	86.8	Confident	97 Å²	97	52.3 Å²	52.3	37%	0.366	24%	0.241	S	C	.	.	H	α-helix	trans	-60.9	-36.8	179.3	-73.8	-178.7	-70.3	126.2	-0.9	113.5	D684 A685 F686 H692	D684-R688 WeakPolarHBondContact O-CG 3.21Å; D684-R688 PolarHBondContact O-NE 2.71Å; D684-R688 PolarHBondContact O-NH2 3.05Å; A685-R688 PolarHBondContact O-N 2.94Å; F686-R688 PolarHBondContact O-N 2.97Å; R688-H692 WeakPolarHBondContact O-CB 3.47Å; R688-H692 PolarHBondContact O-N 3.25Å
689	D	84.7	Confident	86.6	Confident	11 Å²	11	54.7 Å²	54.7	6%	0.059	25%	0.25	C	C	.	.	H	α-helix	trans	-71.1	-38.1	175.8	-61.7	-48.3	0	0	0	111	R573 R609 L613 A685 F686 R687 H692 R693	R573-D689 WeakPolarHBondContact CD-OD1 3.41Å; R573-D689 IonicContact NH1-OD1 2.82Å; R573-D689 PolarHBondContact NH1-OD1 2.96Å; R573-D689 IonicContact NH1-OD2 2.73Å; R609-D689 IonicContact CZ-OD2 2.72Å; R609-D689 IonicContact NH1-OD2 2.97Å; R609-D689 PolarHBondContact NH1-OD2 2.66Å; R609-D689 IonicContact NH2-OD2 3.8Å; R609-D689 PolarHBondContact NH2-OD2 2.87Å; L613-D689 HydrophobicContact CD1-CB 3.78Å; L613-D689 HydrophobicContact CD2-CB 4.12Å; A685-D689 PolarHBondContact O-N 3.03Å; A685-D689 VanDerWaalsContact O-N 3.08Å; F686-D689 PolarHBondContact O-N 2.8Å; R687-D689 VanDerWaalsContact C-N 3.32Å; R687-D689 PolarHBondContact O-N 2.91Å; D689-H692 PolarHBondContact O-N 2.92Å; D689-R693 WeakPolarHBondContact O-CB 3.29Å; D689-R693 PolarHBondContact O-N 3.16Å
690	R	88.6	Confident	86.4	Confident	34 Å²	34	57.5 Å²	57.5	13%	0.128	27%	0.273	C	S	.	.	H	α-helix	trans	-62.9	-45.6	175.6	-171.8	-173.8	77.6	159.3	2.2	110.6	L613 L616 E650 F686 R687 R693 L694	L613-R690 HydrophobicContact CD1-CB 4.16Å; L616-R690 HydrophobicContact CD2-CG 3.83Å; E650-R690 IonicContact OE1-CZ 2.67Å; E650-R690 IonicContact OE1-NH1 3.38Å; E650-R690 PolarHBondContact OE1-NH1 2.89Å; E650-R690 IonicContact OE1-NH2 3.85Å; E650-R690 PolarHBondContact OE1-NH2 3.07Å; F686-R690 HydrophobicContact CE1-CB 4.35Å; F686-R690 WeakPolarHBondContact O-CB 3.48Å; F686-R690 PolarHBondContact O-N 3.06Å; R687-R690 WeakPolarHBondContact O-CB 3.39Å; R687-R690 PolarHBondContact O-N 2.92Å; R687-R690 VanDerWaalsContact O-N 3.08Å; R690-R693 PolarHBondContact O-N 3.5Å; R690-L694 HydrophobicContact CG-CD1 4.42Å; R690-L694 WeakPolarHBondContact O-CG 3.48Å; R690-L694 PolarHBondContact O-N 3.35Å
691	D	87.4	Confident	86.3	Confident	70 Å²	70	58.8 Å²	58.8	37%	0.374	28%	0.279	S	S	.	.	H	α-helix	trans	-64.8	-41	178.2	-57.9	-24.8	0	0	0	110.9	R687 L694 L695	R687-D691 PolarHBondContact O-N 3.48Å; D691-L694 WeakPolarHBondContact O-CB 3.39Å; D691-L694 PolarHBondContact O-N 2.84Å; D691-L695 WeakPolarHBondContact O-CD1 3.23Å; D691-L695 PolarHBondContact O-N 3Å
692	H	82.3	Confident	86.3	Confident	27 Å²	27	61.1 Å²	61.1	13%	0.125	29%	0.288	C	S	.	.	H	α-helix	trans	-61.9	-43	172.3	175.7	-97.7	0	0	0	112.3	R576 E581 R688 D689 L694 L695 E696	R576-H692 VanDerWaalsContact CZ-ND1 3.31Å; R576-H692 PolarHBondContact NH1-CD2 3.24Å; R576-H692 VanDerWaalsContact NH1-CG 3.3Å; R576-H692 PolarHBondContact NH1-ND1 2.86Å; R576-H692 PolarHBondContact NH2-CE1 3.1Å; R576-H692 VanDerWaalsContact NH2-CE1 3.35Å; R576-H692 PolarHBondContact NH2-ND1 3.26Å; E581-H692 IonicContact OE2-CD2 2.69Å; E581-H692 IonicContact OE2-CE1 3.75Å; E581-H692 IonicContact OE2-NE2 2.71Å; E581-H692 PolarHBondContact OE2-NE2 3.15Å; R688-H692 WeakPolarHBondContact O-CB 3.47Å; R688-H692 PolarHBondContact O-N 3.25Å; D689-H692 PolarHBondContact O-N 2.92Å; H692-L694 VanDerWaalsContact C-N 3.33Å; H692-L694 PolarHBondContact O-N 2.91Å; H692-L695 PolarHBondContact O-N 3.16Å; H692-E696 PolarHBondContact O-N 3.12Å
693	R	85.6	Confident	85.9	Confident	78 Å²	78	63.2 Å²	63.2	29%	0.294	30%	0.299	S	S	.	.	H	α-helix	trans	-64.2	-37	176.7	-171.5	56.5	163.8	166	0.5	112.1	N614 L616 D689 R690 E696 I697	N614-R693 PolarHBondContact OD1-NH2 2.69Å; L616-R693 HydrophobicContact CD2-CB 4.46Å; L616-R693 HydrophobicContact CD2-CG 4.31Å; D689-R693 WeakPolarHBondContact O-CB 3.29Å; D689-R693 PolarHBondContact O-N 3.16Å; R690-R693 PolarHBondContact O-N 3.5Å; R693-E696 WeakPolarHBondContact CD-OE2 3.43Å; R693-E696 IonicContact CZ-OE2 2.68Å; R693-E696 IonicContact NE-OE2 3.41Å; R693-E696 IonicContact NH1-OE2 2.65Å; R693-E696 PolarHBondContact NH1-OE2 3.26Å; R693-E696 PolarHBondContact O-N 3Å; R693-I697 HydrophobicContact CG-CD1 4.06Å; R693-I697 WeakPolarHBondContact O-CB 3.47Å; R693-I697 VanDerWaalsContact O-CG1 3.27Å; R693-I697 WeakPolarHBondContact O-CG1 3.23Å; R693-I697 PolarHBondContact O-N 3.21Å
694	L	88.1	Confident	85.6	Confident	74 Å²	74	68.2 Å²	68.2	39%	0.387	32%	0.322	S	S	.	.	H	α-helix	trans	-62.5	-43.9	171.2	-75.8	166.8	0	0	0	112	L616 R690 D691 H692 I697 K698	L616-L694 HydrophobicContact CD1-CD2 3.67Å; L616-L694 HydrophobicContact CD1-CG 4.45Å; L616-L694 HydrophobicContact CD2-CD2 4.13Å; L616-L694 HydrophobicContact CD2-CG 4Å; R690-L694 HydrophobicContact CG-CD1 4.42Å; R690-L694 WeakPolarHBondContact O-CG 3.48Å; R690-L694 PolarHBondContact O-N 3.35Å; D691-L694 WeakPolarHBondContact O-CB 3.39Å; D691-L694 PolarHBondContact O-N 2.84Å; H692-L694 VanDerWaalsContact C-N 3.33Å; H692-L694 PolarHBondContact O-N 2.91Å; L694-I697 PolarHBondContact O-N 3.36Å; L694-K698 WeakPolarHBondContact O-CB 3.48Å; L694-K698 PolarHBondContact O-N 3.19Å
695	L	86.8	Confident	85.4	Confident	98 Å²	98	70.9 Å²	70.9	51%	0.513	33%	0.333	S	S	.	.	H	α-helix	trans	-64.8	-38.2	174.3	-91.9	80.5	0	0	0	112.4	D691 H692 K698 R699	D691-L695 WeakPolarHBondContact O-CD1 3.23Å; D691-L695 PolarHBondContact O-N 3Å; H692-L695 PolarHBondContact O-N 3.16Å; L695-K698 PolarHBondContact O-N 3.05Å; L695-R699 WeakPolarHBondContact O-CB 3.34Å; L695-R699 PolarHBondContact O-N 3.16Å
696	E	82.6	Confident	85.4	Confident	80 Å²	80	75.8 Å²	75.8	37%	0.374	35%	0.348	S	S	.	.	H	α-helix	trans	-65	-45.9	176.1	-171.7	178.7	-133.7	0	0	111.3	H692 R693 R699 A700	H692-E696 PolarHBondContact O-N 3.12Å; R693-E696 WeakPolarHBondContact CD-OE2 3.43Å; R693-E696 IonicContact CZ-OE2 2.68Å; R693-E696 IonicContact NE-OE2 3.41Å; R693-E696 IonicContact NH1-OE2 2.65Å; R693-E696 PolarHBondContact NH1-OE2 3.26Å; R693-E696 PolarHBondContact O-N 3Å; E696-R699 PolarHBondContact O-N 2.79Å; E696-A700 WeakPolarHBondContact O-CB 3.33Å; E696-A700 PolarHBondContact O-N 3.36Å
697	I	87.5	Confident	85.3	Confident	52 Å²	52	80.3 Å²	80.3	27%	0.267	37%	0.371	S	S	.	.	H	α-helix	trans	-64.7	-39.8	175.8	-68.8	165	0	0	0	111.4	L616 R693 L694 K701	L616-I697 HydrophobicContact CD1-CD1 4.22Å; R693-I697 HydrophobicContact CG-CD1 4.06Å; R693-I697 WeakPolarHBondContact O-CB 3.47Å; R693-I697 VanDerWaalsContact O-CG1 3.27Å; R693-I697 WeakPolarHBondContact O-CG1 3.23Å; R693-I697 PolarHBondContact O-N 3.21Å; L694-I697 PolarHBondContact O-N 3.36Å; I697-K701 WeakPolarHBondContact O-CG 3.38Å; I697-K701 PolarHBondContact O-N 3.26Å
698	K	88.3	Confident	85.1	Confident	129 Å²	129	83 Å²	83	56%	0.561	38%	0.382	S	S	*	.	H	α-helix	trans	-60.7	-48.5	174.5	-175.2	175.3	-172.4	-75.9	0	110.7	L694 L695 K701 E702	L694-K698 WeakPolarHBondContact O-CB 3.48Å; L694-K698 PolarHBondContact O-N 3.19Å; L695-K698 PolarHBondContact O-N 3.05Å; K698-K701 WeakPolarHBondContact O-CB 3.46Å; K698-K701 PolarHBondContact O-N 3.07Å; K698-E702 IonicContact NZ-OE1 3.91Å; K698-E702 PolarHBondContact NZ-OE1 2.89Å; K698-E702 WeakPolarHBondContact O-CG 3.32Å; K698-E702 PolarHBondContact O-N 2.78Å
699	R	82.2	Confident	85	Confident	58 Å²	58	83.6 Å²	83.6	22%	0.219	39%	0.389	C	S	.	.	H	α-helix	trans	-69.5	-34.6	-179.2	-163	-174.2	-60.8	123.3	-14.9	113.4	E581 L695 E696 K701 E702 E703	E581-R699 IonicContact OE1-CZ 4Å; E581-R699 IonicContact OE1-NH1 4Å; E581-R699 PolarHBondContact OE1-NH1 3.05Å; E581-R699 IonicContact OE1-NH2 3.78Å; E581-R699 PolarHBondContact OE1-NH2 3.19Å; L695-R699 WeakPolarHBondContact O-CB 3.34Å; L695-R699 PolarHBondContact O-N 3.16Å; E696-R699 PolarHBondContact O-N 2.79Å; R699-K701 PolarHBondContact O-N 3.43Å; R699-E702 WeakPolarHBondContact CA-OE2 3.42Å; R699-E702 PolarHBondContact O-N 2.67Å; R699-E703 WeakPolarHBondContact O-CB 3.49Å; R699-E703 PolarHBondContact O-N 2.85Å
700	A	84.4	Confident	84.9	Confident	59 Å²	59	89 Å²	89	49%	0.488	41%	0.413	S	S	.	.	H	α-helix	trans	-61.1	-37	173.4	0	0	0	0	0	111.4	E696 E704	E696-A700 WeakPolarHBondContact O-CB 3.33Å; E696-A700 PolarHBondContact O-N 3.36Å; A700-E704 WeakPolarHBondContact O-CB 3.4Å; A700-E704 PolarHBondContact O-N 3.49Å
701	K	87.2	Confident	84.7	Confident	134 Å²	134	90.1 Å²	90.1	58%	0.583	43%	0.43	S	S	*	.	H	α-helix	trans	-69.3	-45.3	172.8	-68.4	171.8	-179.3	-179.3	0	112.2	I697 K698 R699 E703 E704 E705	I697-K701 WeakPolarHBondContact O-CG 3.38Å; I697-K701 PolarHBondContact O-N 3.26Å; K698-K701 WeakPolarHBondContact O-CB 3.46Å; K698-K701 PolarHBondContact O-N 3.07Å; R699-K701 PolarHBondContact O-N 3.43Å; K701-E703 PolarHBondContact O-N 2.71Å; K701-E704 PolarHBondContact O-N 2.99Å; K701-E705 WeakPolarHBondContact O-CB 3.35Å; K701-E705 PolarHBondContact O-N 3.14Å
702	E	84.5	Confident	84.8	Confident	82 Å²	82	93.7 Å²	93.7	38%	0.383	44%	0.444	S	S	.	.	H	α-helix	trans	-59.3	-34.6	174.7	-67.7	164.6	171.7	0	0	112.4	K698 R699 R706	K698-E702 IonicContact NZ-OE1 3.91Å; K698-E702 PolarHBondContact NZ-OE1 2.89Å; K698-E702 WeakPolarHBondContact O-CG 3.32Å; K698-E702 PolarHBondContact O-N 2.78Å; R699-E702 WeakPolarHBondContact CA-OE2 3.42Å; R699-E702 PolarHBondContact O-N 2.67Å; E702-R706 WeakPolarHBondContact O-CB 3.41Å; E702-R706 PolarHBondContact O-N 2.87Å
703	E	80.4	Confident	84.9	Confident	83 Å²	83	97.5 Å²	97.5	39%	0.388	46%	0.464	S	S	.	.	H	α-helix	trans	-76.7	-39.9	176.2	-177.8	134.1	-108.8	0	0	112.5	R699 K701 E705 R706 I707	R699-E703 WeakPolarHBondContact O-CB 3.49Å; R699-E703 PolarHBondContact O-N 2.85Å; K701-E703 PolarHBondContact O-N 2.71Å; E703-E705 VanDerWaalsContact C-N 3.33Å; E703-R706 PolarHBondContact O-N 2.9Å; E703-R706 IonicContact OE1-CZ 3.85Å; E703-R706 VanDerWaalsContact OE1-CZ 3.22Å; E703-R706 IonicContact OE1-NH1 2.74Å; E703-R706 PolarHBondContact OE1-NH1 3.29Å; E703-R706 IonicContact OE1-NH2 3.22Å; E703-R706 PolarHBondContact OE1-NH2 3.34Å; E703-I707 HydrophobicContact CG-CD1 3.97Å; E703-I707 WeakPolarHBondContact O-CB 3.39Å; E703-I707 WeakPolarHBondContact O-CD1 3.35Å; E703-I707 WeakPolarHBondContact O-CG1 3.45Å; E703-I707 PolarHBondContact O-N 2.91Å
704	E	82.1	Confident	84.9	Confident	109 Å²	109	101 Å²	101	51%	0.509	48%	0.482	S	S	.	.	H	α-helix	trans	-62.9	-40.7	171.8	-163.4	-159.9	135.5	0	0	111.4	A700 K701 I707 R708	A700-E704 WeakPolarHBondContact O-CB 3.4Å; A700-E704 PolarHBondContact O-N 3.49Å; K701-E704 PolarHBondContact O-N 2.99Å; E704-I707 PolarHBondContact O-N 2.94Å; E704-R708 VanDerWaalsContact O-CB 3.31Å; E704-R708 WeakPolarHBondContact O-CB 3.34Å; E704-R708 PolarHBondContact O-N 3.22Å; E704-R708 IonicContact OE1-CZ 3.74Å; E704-R708 IonicContact OE1-NH2 2.74Å; E704-R708 PolarHBondContact OE1-NH2 2.74Å
705	E	85.3	Confident	84.8	Confident	111 Å²	111	102.1 Å²	102.1	52%	0.519	49%	0.485	S	S	.	.	H	α-helix	trans	-62.7	-50.6	175.5	-172.4	159.1	-129.4	0	0	110.9	K701 E703 I707 R708 E709	K701-E705 WeakPolarHBondContact O-CB 3.35Å; K701-E705 PolarHBondContact O-N 3.14Å; E703-E705 VanDerWaalsContact C-N 3.33Å; E705-I707 VanDerWaalsContact C-N 3.33Å; E705-I707 PolarHBondContact O-N 2.9Å; E705-R708 CarbonylContact O-C 3.55Å; E705-R708 WeakPolarHBondContact O-CA 3.42Å; E705-R708 WeakPolarHBondContact O-CB 3.35Å; E705-R708 PolarHBondContact O-N 3.23Å; E705-E709 WeakPolarHBondContact O-CG 3.26Å; E705-E709 PolarHBondContact O-N 3.24Å
706	R	83.1	Confident	84.8	Confident	117 Å²	117	102.4 Å²	102.4	44%	0.442	48%	0.484	S	S	.	.	H	α-helix	trans	-59.2	-39.3	174.6	-167.6	-165.7	74.1	-120.3	1	113.2	E702 E703 R708 E709 E710	E702-R706 WeakPolarHBondContact O-CB 3.41Å; E702-R706 PolarHBondContact O-N 2.87Å; E703-R706 PolarHBondContact O-N 2.9Å; E703-R706 IonicContact OE1-CZ 3.85Å; E703-R706 VanDerWaalsContact OE1-CZ 3.22Å; E703-R706 IonicContact OE1-NH1 2.74Å; E703-R706 PolarHBondContact OE1-NH1 3.29Å; E703-R706 IonicContact OE1-NH2 3.22Å; E703-R706 PolarHBondContact OE1-NH2 3.34Å; R706-R708 VanDerWaalsContact C-N 3.32Å; R706-E709 PolarHBondContact O-N 2.94Å; R706-E710 WeakPolarHBondContact O-CB 3.02Å; R706-E710 PolarHBondContact O-N 3.44Å
707	I	85.7	Confident	84.8	Confident	95 Å²	95	104.2 Å²	104.2	49%	0.487	50%	0.496	S	S	.	.	H	α-helix	trans	-68.6	-34	176.5	-71.5	165.9	0	0	0	110.8	E703 E704 E705 A711	E703-I707 HydrophobicContact CG-CD1 3.97Å; E703-I707 WeakPolarHBondContact O-CB 3.39Å; E703-I707 WeakPolarHBondContact O-CD1 3.35Å; E703-I707 WeakPolarHBondContact O-CG1 3.45Å; E703-I707 PolarHBondContact O-N 2.91Å; E704-I707 PolarHBondContact O-N 2.94Å; E705-I707 VanDerWaalsContact C-N 3.33Å; E705-I707 PolarHBondContact O-N 2.9Å; I707-A711 WeakPolarHBondContact O-CB 3.42Å; I707-A711 PolarHBondContact O-N 3.06Å
708	R	85.4	Confident	84.8	Confident	146 Å²	146	107.7 Å²	107.7	55%	0.551	51%	0.505	S	S	*	.	H	α-helix	trans	-69.1	-43.5	174.7	-166.1	-174.6	-61.2	168	-0.1	111.5	E704 E705 R706 A711 E712	E704-R708 VanDerWaalsContact O-CB 3.31Å; E704-R708 WeakPolarHBondContact O-CB 3.34Å; E704-R708 PolarHBondContact O-N 3.22Å; E704-R708 IonicContact OE1-CZ 3.74Å; E704-R708 IonicContact OE1-NH2 2.74Å; E704-R708 PolarHBondContact OE1-NH2 2.74Å; E705-R708 CarbonylContact O-C 3.55Å; E705-R708 WeakPolarHBondContact O-CA 3.42Å; E705-R708 WeakPolarHBondContact O-CB 3.35Å; E705-R708 PolarHBondContact O-N 3.23Å; R706-R708 VanDerWaalsContact C-N 3.32Å; R708-A711 PolarHBondContact O-N 2.95Å; R708-E712 WeakPolarHBondContact O-CB 3.5Å; R708-E712 PolarHBondContact O-N 3.47Å
709	E	83.8	Confident	84.8	Confident	109 Å²	109	106 Å²	106	51%	0.509	50%	0.502	S	S	.	.	H	α-helix	trans	-60.6	-46	172.2	-69.8	178	155.7	0	0	111.7	E705 R706 A711 E712 I713	E705-E709 WeakPolarHBondContact O-CG 3.26Å; E705-E709 PolarHBondContact O-N 3.24Å; R706-E709 PolarHBondContact O-N 2.94Å; E709-A711 VanDerWaalsContact C-N 3.3Å; E709-A711 PolarHBondContact O-N 3Å; E709-E712 PolarHBondContact O-N 3.23Å; E709-I713 WeakPolarHBondContact O-CB 3.44Å; E709-I713 VanDerWaalsContact O-CG1 3.28Å; E709-I713 WeakPolarHBondContact O-CG1 3.38Å; E709-I713 PolarHBondContact O-N 3.38Å
710	E	81.1	Confident	84.8	Confident	124 Å²	124	110.5 Å²	110.5	58%	0.579	52%	0.519	S	S	*	.	H	α-helix	trans	-62.2	-38.6	176.6	-167.6	-173.3	150.2	0	0	111.5	R706 K714	R706-E710 WeakPolarHBondContact O-CB 3.02Å; R706-E710 PolarHBondContact O-N 3.44Å; E710-K714 WeakPolarHBondContact O-CB 3.39Å; E710-K714 PolarHBondContact O-N 2.81Å
711	A	85.9	Confident	84.9	Confident	58 Å²	58	110.4 Å²	110.4	48%	0.479	52%	0.518	S	S	.	.	H	α-helix	trans	-66.7	-41	174.6	0	0	0	0	0	112.6	I707 R708 E709 K714 E715	I707-A711 WeakPolarHBondContact O-CB 3.42Å; I707-A711 PolarHBondContact O-N 3.06Å; R708-A711 PolarHBondContact O-N 2.95Å; E709-A711 VanDerWaalsContact C-N 3.3Å; E709-A711 PolarHBondContact O-N 3Å; A711-K714 PolarHBondContact O-N 2.81Å; A711-E715 PolarHBondContact O-N 3.18Å
712	E	88	Confident	84.8	Confident	144 Å²	144	106.8 Å²	106.8	67%	0.673	50%	0.503	S	S	*	.	H	α-helix	trans	-66.8	-45.8	177.4	-174.6	167.2	-175	0	0	111.6	R708 E709 K714 E715 E716	R708-E712 WeakPolarHBondContact O-CB 3.5Å; R708-E712 PolarHBondContact O-N 3.47Å; E709-E712 PolarHBondContact O-N 3.23Å; E712-K714 VanDerWaalsContact C-N 3.27Å; E712-K714 PolarHBondContact O-N 3.19Å; E712-E715 PolarHBondContact O-N 3.09Å; E712-E715 VanDerWaalsContact O-N 3.14Å; E712-E716 PolarHBondContact O-N 3.49Å
713	I	85.2	Confident	85	Confident	107 Å²	107	105.5 Å²	105.5	55%	0.549	51%	0.507	S	S	.	.	H	α-helix	trans	-59.4	-39.9	173.7	-68.8	165.5	0	0	0	110.9	E709 E716 L717	E709-I713 WeakPolarHBondContact O-CB 3.44Å; E709-I713 VanDerWaalsContact O-CG1 3.28Å; E709-I713 WeakPolarHBondContact O-CG1 3.38Å; E709-I713 PolarHBondContact O-N 3.38Å; I713-E716 PolarHBondContact O-N 3.38Å; I713-L717 WeakPolarHBondContact O-CB 3.36Å; I713-L717 PolarHBondContact O-N 2.87Å
714	K	84.9	Confident	85.2	Confident	151 Å²	151	108 Å²	108	66%	0.657	52%	0.516	S	S	*	.	H	α-helix	trans	-68.7	-34.4	177.2	-174.9	175.7	-177.2	175.2	0	112.5	E710 A711 E712 R718	E710-K714 WeakPolarHBondContact O-CB 3.39Å; E710-K714 PolarHBondContact O-N 2.81Å; A711-K714 PolarHBondContact O-N 2.81Å; E712-K714 VanDerWaalsContact C-N 3.27Å; E712-K714 PolarHBondContact O-N 3.19Å; K714-R718 PolarHBondContact O-N 3.37Å; K714-R718 VanDerWaalsContact O-N 3.09Å
715	E	87.1	Confident	85.3	Confident	99 Å²	99	109.5 Å²	109.5	46%	0.463	52%	0.523	S	S	.	.	H	α-helix	trans	-71.2	-41	171.4	-180	139.8	-124	0	0	112	A711 E712 L717 R718 L719	A711-E715 PolarHBondContact O-N 3.18Å; E712-E715 PolarHBondContact O-N 3.09Å; E712-E715 VanDerWaalsContact O-N 3.14Å; E715-L717 VanDerWaalsContact C-N 3.32Å; E715-L717 PolarHBondContact O-N 3.24Å; E715-R718 WeakPolarHBondContact O-CB 3.27Å; E715-R718 PolarHBondContact O-N 3.43Å; E715-R718 VanDerWaalsContact O-N 3.15Å; E715-R718 IonicContact OE1-CZ 2.83Å; E715-R718 IonicContact OE1-NE 3.97Å; E715-R718 IonicContact OE1-NH2 3.25Å; E715-R718 PolarHBondContact OE1-NH2 2.75Å; E715-L719 HydrophobicContact CG-CD1 3.99Å; E715-L719 HydrophobicContact CG-CG 4.3Å; E715-L719 WeakPolarHBondContact O-CG 3.34Å; E715-L719 PolarHBondContact O-N 2.82Å
716	E	85.7	Confident	85.3	Confident	104 Å²	104	110.2 Å²	110.2	49%	0.486	53%	0.525	S	S	.	.	H	α-helix	trans	-58.7	-45.6	172.6	-162	-144.5	131.6	0	0	110.6	E712 I713 R718 L719 R720	E712-E716 PolarHBondContact O-N 3.49Å; I713-E716 PolarHBondContact O-N 3.38Å; E716-R718 VanDerWaalsContact C-N 3.3Å; E716-R718 PolarHBondContact O-N 3.39Å; E716-L719 PolarHBondContact O-N 2.9Å; E716-R720 WeakPolarHBondContact O-CB 3.5Å; E716-R720 PolarHBondContact O-N 2.94Å; E716-R720 IonicContact OE1-NH1 3.15Å; E716-R720 PolarHBondContact OE1-NH1 3.1Å; E716-R720 VanDerWaalsContact OE1-NH1 3.15Å
717	L	84	Confident	85.3	Confident	118 Å²	118	110.5 Å²	110.5	62%	0.618	53%	0.531	S	S	*	.	H	α-helix	trans	-58.9	-40.7	176.2	-120.1	76	0	0	0	112.2	I713 E715 R720 A721	I713-L717 WeakPolarHBondContact O-CB 3.36Å; I713-L717 PolarHBondContact O-N 2.87Å; E715-L717 VanDerWaalsContact C-N 3.32Å; E715-L717 PolarHBondContact O-N 3.24Å; L717-R720 PolarHBondContact O-N 2.89Å; L717-A721 WeakPolarHBondContact O-CB 3.44Å; L717-A721 PolarHBondContact O-N 2.85Å
718	R	87.1	Confident	85.2	Confident	124 Å²	124	112.9 Å²	112.9	47%	0.468	54%	0.538	S	S	.	.	H	α-helix	trans	-65.2	-50.6	176.4	-175.1	-179.9	69.9	99.7	-10.6	111.5	K714 E715 E716 R720 A721 E722	K714-R718 PolarHBondContact O-N 3.37Å; K714-R718 VanDerWaalsContact O-N 3.09Å; E715-R718 WeakPolarHBondContact O-CB 3.27Å; E715-R718 PolarHBondContact O-N 3.43Å; E715-R718 VanDerWaalsContact O-N 3.15Å; E715-R718 IonicContact OE1-CZ 2.83Å; E715-R718 IonicContact OE1-NE 3.97Å; E715-R718 IonicContact OE1-NH2 3.25Å; E715-R718 PolarHBondContact OE1-NH2 2.75Å; E716-R718 VanDerWaalsContact C-N 3.3Å; E716-R718 PolarHBondContact O-N 3.39Å; R718-R720 PolarHBondContact O-N 2.97Å; R718-A721 WeakPolarHBondContact O-CB 3.32Å; R718-A721 PolarHBondContact O-N 2.82Å; R718-A721 VanDerWaalsContact O-N 3.09Å; R718-E722 IonicContact CZ-OE1 3.51Å; R718-E722 IonicContact NH1-OE1 2.72Å; R718-E722 PolarHBondContact NH1-OE1 2.91Å; R718-E722 PolarHBondContact O-N 2.95Å
719	L	87.4	Confident	85	Confident	94 Å²	94	112.6 Å²	112.6	49%	0.492	54%	0.543	S	S	.	.	H	α-helix	trans	-59.5	-37.5	177.8	-70	170.6	0	0	0	111.4	E715 E716 E722 A723	E715-L719 HydrophobicContact CG-CD1 3.99Å; E715-L719 HydrophobicContact CG-CG 4.3Å; E715-L719 WeakPolarHBondContact O-CG 3.34Å; E715-L719 PolarHBondContact O-N 2.82Å; E716-L719 PolarHBondContact O-N 2.9Å; L719-E722 PolarHBondContact O-N 2.78Å; L719-A723 WeakPolarHBondContact O-CB 3.29Å; L719-A723 PolarHBondContact O-N 2.83Å
720	R	83	Confident	85.1	Confident	152 Å²	152	116.7 Å²	116.7	57%	0.574	55%	0.553	S	S	*	*	H	α-helix	trans	-73.3	-27.5	177	-163.1	168.7	-171.9	162.2	-3.4	113.4	E716 L717 R718 K724	E716-R720 WeakPolarHBondContact O-CB 3.5Å; E716-R720 PolarHBondContact O-N 2.94Å; E716-R720 IonicContact OE1-NH1 3.15Å; E716-R720 PolarHBondContact OE1-NH1 3.1Å; E716-R720 VanDerWaalsContact OE1-NH1 3.15Å; L717-R720 PolarHBondContact O-N 2.89Å; R718-R720 PolarHBondContact O-N 2.97Å; R720-K724 WeakPolarHBondContact O-CG 3.42Å; R720-K724 PolarHBondContact O-N 2.83Å
721	A	85.1	Confident	85.2	Confident	57 Å²	57	115.7 Å²	115.7	47%	0.471	55%	0.552	S	S	.	*	H	α-helix	trans	-71.8	-48.9	169.2	0	0	0	0	0	111.3	L717 R718 A723 K724 E725	L717-A721 WeakPolarHBondContact O-CB 3.44Å; L717-A721 PolarHBondContact O-N 2.85Å; R718-A721 WeakPolarHBondContact O-CB 3.32Å; R718-A721 PolarHBondContact O-N 2.82Å; R718-A721 VanDerWaalsContact O-N 3.09Å; A721-A723 VanDerWaalsContact C-N 3.27Å; A721-A723 PolarHBondContact O-N 2.89Å; A721-K724 PolarHBondContact O-N 2.8Å; A721-K724 VanDerWaalsContact O-N 3.12Å; A721-E725 PolarHBondContact O-N 2.81Å
722	E	87.2	Confident	85	Confident	58 Å²	58	118.6 Å²	118.6	27%	0.271	56%	0.555	S	S	.	*	H	α-helix	trans	-60.3	-34.8	176.3	-70.9	-179.3	-150.2	0	0	112.6	R718 L719 E725 K726	R718-E722 IonicContact CZ-OE1 3.51Å; R718-E722 IonicContact NH1-OE1 2.72Å; R718-E722 PolarHBondContact NH1-OE1 2.91Å; R718-E722 PolarHBondContact O-N 2.95Å; L719-E722 PolarHBondContact O-N 2.78Å; E722-E725 PolarHBondContact O-N 3.09Å; E722-K726 WeakPolarHBondContact O-CD 3.27Å; E722-K726 WeakPolarHBondContact O-CG 3.37Å; E722-K726 PolarHBondContact O-N 2.92Å; E722-K726 VanDerWaalsContact O-N 3.08Å; E722-K726 IonicContact OE2-NZ 3.56Å
723	A	88.1	Confident	84.7	Confident	55 Å²	55	119 Å²	119	46%	0.455	56%	0.555	S	S	.	*	H	α-helix	trans	-64.8	-44.5	173.9	0	0	0	0	0	112.1	L719 A721 E725 K726 E727	L719-A723 WeakPolarHBondContact O-CB 3.29Å; L719-A723 PolarHBondContact O-N 2.83Å; A721-A723 VanDerWaalsContact C-N 3.27Å; A721-A723 PolarHBondContact O-N 2.89Å; A723-E725 VanDerWaalsContact C-N 3.33Å; A723-E725 PolarHBondContact O-N 2.89Å; A723-K726 PolarHBondContact O-N 3.08Å; A723-E727 WeakPolarHBondContact O-CB 3.12Å; A723-E727 PolarHBondContact O-N 2.82Å
724	K	84.8	Confident	84.6	Confident	137 Å²	137	117.7 Å²	117.7	60%	0.596	55%	0.547	S	S	*	.	H	α-helix	trans	-65	-35	175.8	-76.2	177.1	175.9	-178	0	112.5	R720 A721 E727 K728	R720-K724 WeakPolarHBondContact O-CG 3.42Å; R720-K724 PolarHBondContact O-N 2.83Å; A721-K724 PolarHBondContact O-N 2.8Å; A721-K724 VanDerWaalsContact O-N 3.12Å; K724-E727 PolarHBondContact O-N 2.73Å; K724-K728 WeakPolarHBondContact O-CB 3.37Å; K724-K728 PolarHBondContact O-N 3.47Å
725	E	82.9	Confident	84.4	Confident	140 Å²	140	120.1 Å²	120.1	65%	0.654	55%	0.551	S	S	*	*	H	α-helix	trans	-66.1	-47.2	175.5	-173.9	165.1	-141.5	0	0	111.5	A721 E722 A723 E727 K728 E729	A721-E725 PolarHBondContact O-N 2.81Å; E722-E725 PolarHBondContact O-N 3.09Å; A723-E725 VanDerWaalsContact C-N 3.33Å; A723-E725 PolarHBondContact O-N 2.89Å; E725-E727 VanDerWaalsContact C-N 3.31Å; E725-E727 PolarHBondContact O-N 3.39Å; E725-K728 WeakPolarHBondContact O-CB 3.19Å; E725-K728 PolarHBondContact O-N 2.75Å; E725-E729 PolarHBondContact O-N 2.77Å
726	K	85.2	Confident	84.1	Confident	125 Å²	125	120.7 Å²	120.7	54%	0.543	56%	0.557	S	S	.	*	H	α-helix	trans	-62.3	-35.1	174.8	-71.2	161.8	-174.9	152.5	0	112.6	E722 A723 R730	E722-K726 WeakPolarHBondContact O-CD 3.27Å; E722-K726 WeakPolarHBondContact O-CG 3.37Å; E722-K726 PolarHBondContact O-N 2.92Å; E722-K726 VanDerWaalsContact O-N 3.08Å; E722-K726 IonicContact OE2-NZ 3.56Å; A723-K726 PolarHBondContact O-N 3.08Å; K726-R730 WeakPolarHBondContact O-CB 3.42Å; K726-R730 PolarHBondContact O-N 2.7Å; K726-R730 VanDerWaalsContact O-N 3.09Å
727	E	84	Confident	83.8	Confident	123 Å²	123	122.2 Å²	122.2	58%	0.575	56%	0.564	S	S	*	*	H	α-helix	trans	-66.5	-44.3	173.2	-177.4	171.7	-142.9	0	0	112.1	A723 K724 E725 R730 L731	A723-E727 WeakPolarHBondContact O-CB 3.12Å; A723-E727 PolarHBondContact O-N 2.82Å; K724-E727 PolarHBondContact O-N 2.73Å; E725-E727 VanDerWaalsContact C-N 3.31Å; E725-E727 PolarHBondContact O-N 3.39Å; E727-R730 PolarHBondContact O-N 2.85Å; E727-L731 HydrophobicContact CG-CD1 4.48Å; E727-L731 PolarHBondContact O-N 2.95Å
728	K	83.1	Confident	83.5	Confident	146 Å²	146	123 Å²	123	64%	0.635	56%	0.563	S	S	*	*	H	α-helix	trans	-61.9	-45.8	175.7	-177.4	-169.4	170.4	-162.5	0	111.9	K724 E725 R730 L731 E732	K724-K728 WeakPolarHBondContact O-CB 3.37Å; K724-K728 PolarHBondContact O-N 3.47Å; E725-K728 WeakPolarHBondContact O-CB 3.19Å; E725-K728 PolarHBondContact O-N 2.75Å; K728-R730 VanDerWaalsContact C-N 3.32Å; K728-R730 PolarHBondContact O-N 3.15Å; K728-L731 PolarHBondContact O-N 2.99Å; K728-E732 PolarHBondContact O-N 2.86Å
729	E	82.4	Confident	82.9	Confident	139 Å²	139	124.7 Å²	124.7	65%	0.65	57%	0.573	S	S	*	*	H	α-helix	trans	-59.9	-42.5	176.7	-170.4	-170.9	-176.3	0	0	111.2	E725 E732 K733	E725-E729 PolarHBondContact O-N 2.77Å; E729-E732 PolarHBondContact O-N 2.88Å; E729-K733 WeakPolarHBondContact O-CB 3.42Å; E729-K733 PolarHBondContact O-N 2.84Å
730	R	85.6	Confident	82.3	Confident	195 Å²	195	123.1 Å²	123.1	74%	0.736	57%	0.574	S	S	*	*	H	α-helix	trans	-62.3	-43.1	175.9	-174.9	179.9	176.4	-162.8	-2.2	112.4	K726 E727 K728 K733 E734	K726-R730 WeakPolarHBondContact O-CB 3.42Å; K726-R730 PolarHBondContact O-N 2.7Å; K726-R730 VanDerWaalsContact O-N 3.09Å; E727-R730 PolarHBondContact O-N 2.85Å; K728-R730 VanDerWaalsContact C-N 3.32Å; K728-R730 PolarHBondContact O-N 3.15Å; R730-K733 PolarHBondContact O-N 2.69Å; R730-E734 PolarHBondContact O-N 2.82Å
731	L	82.5	Confident	81.8	Confident	104 Å²	104	118.8 Å²	118.8	55%	0.545	57%	0.571	S	S	.	*	H	α-helix	trans	-65	-38.2	175.5	-89	165.3	0	0	0	112.6	E727 K728 E734 R735	E727-L731 HydrophobicContact CG-CD1 4.48Å; E727-L731 PolarHBondContact O-N 2.95Å; K728-L731 PolarHBondContact O-N 2.99Å; L731-E734 PolarHBondContact O-N 3.01Å; L731-R735 WeakPolarHBondContact O-CB 3.37Å; L731-R735 PolarHBondContact O-N 3.17Å
732	E	81.8	Confident	81.2	Confident	118 Å²	118	119.3 Å²	119.3	55%	0.551	58%	0.575	S	S	*	*	H	α-helix	trans	-67.3	-41.1	175.8	-177	155.7	-160.9	0	0	111.7	K728 E729 R735 L736	K728-E732 PolarHBondContact O-N 2.86Å; E729-E732 PolarHBondContact O-N 2.88Å; E732-R735 PolarHBondContact O-N 3.2Å; E732-L736 PolarHBondContact O-N 3.09Å
733	K	82.7	Confident	80.2	Confident	152 Å²	152	119.9 Å²	119.9	66%	0.661	59%	0.59	S	S	*	*	H	α-helix	trans	-60.8	-45.8	173.2	-173	174.2	-179.3	176.1	0	112.2	E729 R730 R735 L736 E737	E729-K733 WeakPolarHBondContact O-CB 3.42Å; E729-K733 PolarHBondContact O-N 2.84Å; R730-K733 PolarHBondContact O-N 2.69Å; K733-R735 VanDerWaalsContact C-N 3.31Å; K733-R735 PolarHBondContact O-N 2.83Å; K733-L736 WeakPolarHBondContact O-CB 3.26Å; K733-L736 PolarHBondContact O-N 3.07Å; K733-E737 WeakPolarHBondContact O-CB 3.05Å; K733-E737 PolarHBondContact O-N 2.91Å
734	E	81.6	Confident	78.9	Confident	81 Å²	81	121 Å²	121	38%	0.379	60%	0.599	S	S	.	*	H	α-helix	trans	-64.2	-36	176.4	-163.1	-166.4	126.6	0	0	111.9	R730 L731 E737 K738	R730-E734 PolarHBondContact O-N 2.82Å; L731-E734 PolarHBondContact O-N 3.01Å; E734-E737 PolarHBondContact O-N 3.24Å; E734-K738 HydrophobicContact CG-CD 4.48Å; E734-K738 WeakPolarHBondContact O-CB 3.37Å; E734-K738 WeakPolarHBondContact O-CG 3.11Å; E734-K738 PolarHBondContact O-N 2.87Å; E734-K738 VanDerWaalsContact OE1-CE 3.31Å; E734-K738 WeakPolarHBondContact OE1-CE 3.45Å; E734-K738 IonicContact OE1-NZ 2.61Å; E734-K738 PolarHBondContact OE1-NZ 2.9Å
735	R	81.8	Confident	77.8	Confident	201 Å²	201	118.7 Å²	118.7	76%	0.758	61%	0.605	S	S	*	*	H	α-helix	trans	-67.2	-38.4	174.9	-174.4	174.4	-179.2	153.1	0.8	112.3	L731 E732 K733 K739	L731-R735 WeakPolarHBondContact O-CB 3.37Å; L731-R735 PolarHBondContact O-N 3.17Å; E732-R735 PolarHBondContact O-N 3.2Å; K733-R735 VanDerWaalsContact C-N 3.31Å; K733-R735 PolarHBondContact O-N 2.83Å; R735-K739 WeakPolarHBondContact O-CB 3.35Å; R735-K739 PolarHBondContact O-N 3.39Å
736	L	79.3	Confident	76.5	Confident	112 Å²	112	115.9 Å²	115.9	59%	0.586	61%	0.606	S	S	*	*	H	α-helix	trans	-64.2	-45	172.2	-90.8	160.5	0	0	0	111.5	E732 K733 K739 A740	E732-L736 PolarHBondContact O-N 3.09Å; K733-L736 WeakPolarHBondContact O-CB 3.26Å; K733-L736 PolarHBondContact O-N 3.07Å; L736-K739 PolarHBondContact O-N 3.43Å; L736-K739 VanDerWaalsContact O-N 3.17Å; L736-A740 PolarHBondContact O-N 3.21Å
737	E	80	Confident	74.7	Confident	136 Å²	136	116.9 Å²	116.9	64%	0.636	62%	0.618	S	S	*	*	H	α-helix	trans	-63.8	-44.6	178.2	-171.9	165	-155.7	0	0	112.1	K733 E734 K739 A740 A741	K733-E737 WeakPolarHBondContact O-CB 3.05Å; K733-E737 PolarHBondContact O-N 2.91Å; E734-E737 PolarHBondContact O-N 3.24Å; E737-K739 VanDerWaalsContact C-N 3.29Å; E737-K739 PolarHBondContact O-N 2.91Å; E737-A740 PolarHBondContact O-N 3.48Å; E737-A741 WeakPolarHBondContact O-CB 3.4Å; E737-A741 PolarHBondContact O-N 2.85Å
738	K	77.9	Confident	72.6	Confident	133 Å²	133	116.7 Å²	116.7	58%	0.578	63%	0.627	S	S	*	*	H	α-helix	trans	-60.3	-35.7	171.5	-80.2	171.4	170.3	167.9	0	112.7	E734 A742	E734-K738 HydrophobicContact CG-CD 4.48Å; E734-K738 WeakPolarHBondContact O-CB 3.37Å; E734-K738 WeakPolarHBondContact O-CG 3.11Å; E734-K738 PolarHBondContact O-N 2.87Å; E734-K738 VanDerWaalsContact OE1-CE 3.31Å; E734-K738 WeakPolarHBondContact OE1-CE 3.45Å; E734-K738 IonicContact OE1-NZ 2.61Å; E734-K738 PolarHBondContact OE1-NZ 2.9Å; K738-A742 WeakPolarHBondContact O-CB 3.22Å; K738-A742 PolarHBondContact O-N 3.38Å
739	K	75.4	Confident	70.6	Confident	160 Å²	160	117.5 Å²	117.5	70%	0.696	64%	0.638	S	S	*	*	H	α-helix	trans	-72.4	-35	176.3	-161.7	177.7	-176.5	-173.8	0	112.2	R735 L736 E737 A743	R735-K739 WeakPolarHBondContact O-CB 3.35Å; R735-K739 PolarHBondContact O-N 3.39Å; L736-K739 PolarHBondContact O-N 3.43Å; L736-K739 VanDerWaalsContact O-N 3.17Å; E737-K739 VanDerWaalsContact C-N 3.29Å; E737-K739 PolarHBondContact O-N 2.91Å; K739-A743 PolarHBondContact O-N 2.93Å; K739-A743 VanDerWaalsContact O-N 3.11Å
740	A	74.9	Confident	68.6	Low	62 Å²	62	116 Å²	116	51%	0.512	64%	0.641	S	S	.	*	H	α-helix	trans	-67.8	-42.9	172.2	0	0	0	0	0	111.9	L736 E737 A742 A743 A744	L736-A740 PolarHBondContact O-N 3.21Å; E737-A740 PolarHBondContact O-N 3.48Å; A740-A742 PolarHBondContact O-N 2.92Å; A740-A743 PolarHBondContact O-N 3.08Å; A740-A744 PolarHBondContact O-N 2.75Å
741	A	72.4	Confident	66.6	Low	60 Å²	60	113.5 Å²	113.5	50%	0.496	65%	0.647	S	S	.	*	H	α-helix	trans	-61.6	-41.2	174.3	0	0	0	0	0	112.2	E737 A743 A744 A745	E737-A741 WeakPolarHBondContact O-CB 3.4Å; E737-A741 PolarHBondContact O-N 2.85Å; A741-A743 VanDerWaalsContact C-N 3.33Å; A741-A743 PolarHBondContact O-N 3.2Å; A741-A744 PolarHBondContact O-N 3.35Å; A741-A745 PolarHBondContact O-N 2.77Å
742	A	71.4	Confident	64.8	Low	68 Å²	68	113.8 Å²	113.8	56%	0.562	66%	0.655	S	S	*	*	H	α-helix	trans	-63.6	-35.6	174.3	0	0	0	0	0	112.9	K738 A740	K738-A742 WeakPolarHBondContact O-CB 3.22Å; K738-A742 PolarHBondContact O-N 3.38Å; A740-A742 PolarHBondContact O-N 2.92Å
743	A	65.7	Low	63	Low	71 Å²	71	115.5 Å²	115.5	59%	0.587	67%	0.666	S	S	*	*	H	α-helix	trans	-70.5	-37.8	173.4	0	0	0	0	0	112.4	K739 A740 A741 A745 A746	K739-A743 PolarHBondContact O-N 2.93Å; K739-A743 VanDerWaalsContact O-N 3.11Å; A740-A743 PolarHBondContact O-N 3.08Å; A741-A743 VanDerWaalsContact C-N 3.33Å; A741-A743 PolarHBondContact O-N 3.2Å; A743-A745 VanDerWaalsContact C-N 3.3Å; A743-A745 PolarHBondContact O-N 2.87Å; A743-A746 PolarHBondContact O-N 2.8Å
744	A	62.5	Low	61.3	Low	78 Å²	78	113.8 Å²	113.8	65%	0.645	67%	0.671	S	S	*	*	H	α-helix	trans	-66.4	-30.2	176.5	0	0	0	0	0	113	A740 A741 A746	A740-A744 PolarHBondContact O-N 2.75Å; A741-A744 PolarHBondContact O-N 3.35Å; A744-A746 PolarHBondContact O-N 2.92Å
745	A	60.6	Low	59.8	Low	88 Å²	88	114.6 Å²	114.6	73%	0.727	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-9	178.7	0	0	0	0	0	114.7	A741 A743 N747	A741-A745 PolarHBondContact O-N 2.77Å; A743-A745 VanDerWaalsContact C-N 3.3Å; A743-A745 PolarHBondContact O-N 2.87Å; A745-N747 PolarHBondContact O-N 2.87Å
746	A	55.5	Low	57.5	Low	82 Å²	82	111 Å²	111	68%	0.678	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	5.2	-172	0	0	0	0	0	115.5	A743 A744	A743-A746 PolarHBondContact O-N 2.8Å; A744-A746 PolarHBondContact O-N 2.92Å
747	N	46.9	Very low	55.7	Low	146 Å²	146	111 Å²	111	78%	0.781	69%	0.691	S	S	*	*			trans	-134.9	104.6	-172.5	-156.8	7.1	0	0	0	112.7	A745	A745-N747 PolarHBondContact O-N 2.87Å
748	P	40.1	Very low	53.1	Low	119 Å²	119	109 Å²	109	77%	0.773	70%	0.697	S	S	*	*			trans	-95.6	115.4	-171.1	34.2	-31.9	0	0	0	113.6
749	N	41.8	Very low	50.8	Low	163 Å²	163	108.9 Å²	108.9	87%	0.872	71%	0.708	S	S	*	*			trans	-152.1	136.9	154.6	-146.6	14.7	0	0	0	110.2
750	P	39.5	Very low	48.9	Very low	108 Å²	108	105.6 Å²	105.6	70%	0.701	70%	0.703	S	S	*	*			trans	-102.9	150.7	-164.2	37.4	-32.9	0	0	0	114.6
751	T	44.8	Very low	46.9	Very low	142 Å²	142	110.7 Å²	110.7	87%	0.871	72%	0.715	S	S	*	*			trans	-157.1	141.1	133.8	-4.5	0	0	0	0	110
752	P	43.8	Very low	45	Very low	109 Å²	109	113.3 Å²	113.3	71%	0.708	73%	0.73	S	S	*	*			trans	-109.4	-154	-175.1	38.1	-24.6	0	0	0	111.8
753	I	43.5	Very low	42.9	Very low	154 Å²	154	114.2 Å²	114.2	79%	0.79	73%	0.733	S	S	*	*			trans	92	122.9	173	-55.6	168	0	0	0	112
754	P	46.9	Very low	41.3	Very low	117 Å²	117	113.7 Å²	113.7	76%	0.76	73%	0.728	S	S	*	*				-136.5	-129.1	-103.7	43.8	-22.6	0	0	0	112.6
755	P	50.5	Low	40.4	Very low	98 Å²	98	118.6 Å²	118.6	64%	0.636	74%	0.738	S	S	*	*			trans	-115.1	-154.8	-150.6	28.4	-1.5	0	0	0	111.5
756	T	33.7	Very low	39.3	Very low	126 Å²	126	123.6 Å²	123.6	77%	0.773	75%	0.746	S	S	*	*			trans	72	168.4	165	77.5	0	0	0	0	114.5
757	P	42.7	Very low	38.6	Very low	112 Å²	112	125.2 Å²	125.2	73%	0.727	74%	0.74	S	S	*	*				-130.9	176.6	-77.6	37.8	-22.2	0	0	0	112
758	A	25.3	Very low	38.8	Very low	92 Å²	92	124.3 Å²	124.3	76%	0.76	74%	0.741	S	S	*	*			trans	60.8	-166.9	-175.9	0	0	0	0	0	109.7
759	T	29.3	Very low	38.4	Very low	132 Å²	132	125.2 Å²	125.2	81%	0.81	74%	0.739	S	S	*	*			cis	-106.1	152	-4.9	26.7	0	0	0	0	112.1
760	P	34.8	Very low	37.8	Very low	90 Å²	90	123 Å²	123	58%	0.584	73%	0.733	S	S	*	*			trans	-82.7	158.7	-175.8	35.7	-36.6	0	0	0	112.4
761	H	32.6	Very low	37.8	Very low	169 Å²	169	123.5 Å²	123.5	78%	0.782	74%	0.736	S	S	*	*			trans	66.5	167.9	174.4	-39.3	-69.5	0	0	0	115.2
762	S	32.9	Very low	36.9	Very low	115 Å²	115	121 Å²	121	80%	0.804	72%	0.722	S	S	*	*			trans	70.4	142.8	-174.1	-41.9	0	0	0	0	113.4
763	S	26.8	Very low	36	Very low	88 Å²	88	123.7 Å²	123.7	62%	0.615	73%	0.73	S	S	*	*			cis	-167.5	153.7	-10.1	37.1	0	0	0	0	110.1	Q767	S763-Q767 PolarHBondContact O-NE2 2.94Å
764	A	33	Very low	35.1	Very low	60 Å²	60	120 Å²	120	50%	0.496	72%	0.718	S	S	.	*			trans	61.5	152.3	156.5	0	0	0	0	0	120.2	Q767	A764-Q767 VanDerWaalsContact O-CD 3.26Å; A764-Q767 VanDerWaalsContact O-CG 3.27Å; A764-Q767 WeakPolarHBondContact O-CG 3.32Å; A764-Q767 PolarHBondContact O-NE2 2.71Å
765	Q	44.1	Very low	33.9	Very low	180 Å²	180	118.6 Å²	118.6	84%	0.841	71%	0.707	S	S	*	*	S	Bend	trans	47.1	112.4	150.8	-66.3	166.8	-36.6	0	0	119
766	Q	37.4	Very low	32.5	Very low	194 Å²	194	117.5 Å²	117.5	91%	0.907	69%	0.694	S	S	*	*	S	Bend	cis	-113.3	80.8	-24.5	-71.5	177.1	-16.8	0	0	104.8
767	Q	41	Very low	32.1	Very low	116 Å²	116	115 Å²	115	54%	0.542	68%	0.678	S	S	.	*			trans	-79.7	141.4	-151.7	-64.1	-174	-10.8	0	0	113.3	S763 A764 I769	S763-Q767 PolarHBondContact O-NE2 2.94Å; A764-Q767 VanDerWaalsContact O-CD 3.26Å; A764-Q767 VanDerWaalsContact O-CG 3.27Å; A764-Q767 WeakPolarHBondContact O-CG 3.32Å; A764-Q767 PolarHBondContact O-NE2 2.71Å; Q767-I769 PolarHBondContact O-N 2.78Å
768	P	49.4	Very low	31.4	Very low	126 Å²	126	110.8 Å²	110.8	82%	0.818	65%	0.652	S	S	*	*			trans	-94.3	88.3	-161.1	4.5	17.6	0	0	0	110.4
769	I	32.2	Very low	32	Very low	139 Å²	139	110 Å²	110	71%	0.713	65%	0.645	S	S	*	*			trans	-139	101.8	177.3	-54.4	179	0	0	0	109.7	Q767	Q767-I769 PolarHBondContact O-N 2.78Å
770	P	30	Very low	32.2	Very low	115 Å²	115	112.6 Å²	112.6	75%	0.747	65%	0.648	S	S	*	*				-140.3	175.5	122.9	39.6	-28.5	0	0	0	112.3
771	P	39.8	Very low	32	Very low	120 Å²	120	115 Å²	115	78%	0.779	65%	0.654	S	S	*	*			cis	-110.5	136.9	-8.2	35.9	-24.7	0	0	0	112.9
772	P	25.5	Very low	32	Very low	89 Å²	89	110.8 Å²	110.8	58%	0.578	64%	0.635	S	S	*	*			trans	-87.9	155.8	171.7	36	-34.6	0	0	0	112.4
773	L	24.1	Very low	31.9	Very low	165 Å²	165	109.7 Å²	109.7	86%	0.864	62%	0.617	S	S	*	*	S	Bend	trans	57.3	-155.3	168	-83.6	52.6	0	0	0	112
774	S	24.3	Very low	32.3	Very low	77 Å²	77	109.1 Å²	109.1	54%	0.538	61%	0.613	S	S	.	*			trans	61.2	122.3	143.2	-72.4	0	0	0	0	119.4
775	T	21.9	Very low	32.3	Very low	88 Å²	88	109 Å²	109	54%	0.54	61%	0.612	S	S	.	*			cis	49.6	127.4	16.3	42.1	0	0	0	0	115.7	M1750	T775-M1750 WeakPolarHBondContact CB-SD 3.49Å; T775-M1750 HydrophobicContact CG2-CG 3.88Å; T775-M1750 HydrophobicContact CG2-SD 4.13Å; T775-M1750 VanDerWaalsContact OG1-CE 3.23Å; T775-M1750 WeakPolarHBondContact OG1-CE 3.47Å; T775-M1750 PolarHBondContact OG1-SD 2.78Å
776	Q	22.7	Very low	31.7	Very low	75 Å²	75	106.1 Å²	106.1	35%	0.35	60%	0.599	S	S	.	*			trans	74.9	154.9	-165.6	-45.4	172.5	-20.5	0	0	112.9	R1749 M1750	Q776-R1749 HydrophobicContact CB-CG 4.23Å; Q776-R1749 VanDerWaalsContact CD-CZ 3.44Å; Q776-R1749 VanDerWaalsContact CD-NH1 3.27Å; Q776-R1749 HydrophobicContact CG-CG 3.95Å; Q776-R1749 VanDerWaalsContact CG-O 3.25Å; Q776-R1749 WeakPolarHBondContact CG-O 3.45Å; Q776-R1749 PolarHBondContact NE2-O 2.79Å; Q776-R1749 VanDerWaalsContact OE1-NH2 3.1Å; Q776-M1750 HydrophobicContact CG-CB 3.82Å; Q776-M1750 HydrophobicContact CG-CE 3.68Å
777	T	24.1	Very low	31.4	Very low	72 Å²	72	105.1 Å²	105.1	44%	0.442	59%	0.594	S	S	.	*			cis	-110.3	-139.3	-0.8	-48.5	0	0	0	0	107.2	R1749	T777-R1749 HydrophobicContact CG2-CG 4.28Å; T777-R1749 VanDerWaalsContact CG2-NE 3.29Å; T777-R1749 PolarHBondContact OG1-NH2 3.4Å
778	S	27.8	Very low	31	Very low	25 Å²	25	105.3 Å²	105.3	18%	0.175	61%	0.605	C	S	.	*			cis	67.4	160.8	-7.6	18	0	0	0	0	119.5	Q783 T1748	S778-Q783 VanDerWaalsContact CB-OE1 3.31Å; S778-T1748 WeakPolarHBondContact CB-OG1 3.41Å; S778-T1748 PolarHBondContact OG-OG1 2.86Å
779	A	37.7	Very low	30	Very low	74 Å²	74	104.9 Å²	104.9	61%	0.612	61%	0.605	S	S	*	*			trans	50.3	111	-173.9	0	0	0	0	0	115.6
780	E	34.3	Very low	29.9	Very low	187 Å²	187	104.6 Å²	104.6	87%	0.874	61%	0.61	S	S	*	*	S	Bend	cis	-133.9	140.1	9.1	-58.6	175.1	96	0	0	107.7
781	I	30.8	Very low	29.9	Very low	141 Å²	141	104.2 Å²	104.2	72%	0.723	61%	0.607	S	S	*	*	S	Bend	cis	-136	126.5	6.8	-58.7	171.9	0	0	0	104.8
782	Q	31.7	Very low	29.4	Very low	81 Å²	81	104.5 Å²	104.5	38%	0.379	61%	0.606	S	S	.	*			cis	-139	-124.4	17.2	-165.5	135.6	-102.2	0	0	112.9	D1744 V1745 L1746	Q782-D1744 PolarHBondContact NE2-OD2 3.18Å; Q782-V1745 HydrophobicContact CB-CB 4.02Å; Q782-V1745 HydrophobicContact CB-CG1 3.93Å; Q782-V1745 HydrophobicContact CB-CG2 3.71Å; Q782-V1745 HydrophobicContact CG-CG1 4.1Å; Q782-L1746 CarbonylContact C-O 3.36Å
783	Q	32.3	Very low	29.6	Very low	92 Å²	92	105.7 Å²	105.7	43%	0.43	61%	0.612	S	S	.	*			trans	-146.5	114.1	-169.1	-86.2	73.9	-131.8	0	0	116.6	S778 V1745 L1746	S778-Q783 VanDerWaalsContact CB-OE1 3.31Å; Q783-V1745 VanDerWaalsContact O-CG1 3.28Å; Q783-V1745 WeakPolarHBondContact O-CG1 3.34Å; Q783-L1746 CarbonylContact C-O 3.54Å; Q783-L1746 WeakPolarHBondContact CA-O 3.22Å; Q783-L1746 PolarHBondContact N-O 3.31Å
784	S	34.1	Very low	29.8	Very low	75 Å²	75	105.5 Å²	105.5	52%	0.524	61%	0.609	S	S	.	*	B	Isolated β-bridge	trans	169.4	133.9	163.3	146.4	0	0	0	0	114.6	V1745 L1746 A1747	S784-V1745 WeakPolarHBondContact CB-O 3.47Å; S784-V1745 CarbonylContact O-C 3.2Å; S784-V1745 PolarHBondContact OG-O 3.4Å; S784-L1746 VanDerWaalsContact N-N 3.18Å; S784-L1746 PolarHBondContact N-O 3.17Å; S784-L1746 CarbonylContact O-C 3.43Å; S784-L1746 WeakPolarHBondContact O-CA 3.48Å; S784-L1746 PolarHBondContact O-N 3.18Å; S784-A1747 VanDerWaalsContact C-N 3.25Å; S784-A1747 CarbonylContact C-O 3.22Å; S784-A1747 WeakPolarHBondContact CA-O 3.36Å; S784-A1747 PolarHBondContact N-O 2.71Å; S784-A1747 PolarHBondContact O-N 2.93Å
785	A	33.7	Very low	30.1	Very low	58 Å²	58	108.4 Å²	108.4	48%	0.479	62%	0.617	S	S	.	*			trans	-112.4	151.2	-139.8	0	0	0	0	0	123.2	A1747 T1748	A785-A1747 VanDerWaalsContact CB-C 3.47Å; A785-T1748 WeakPolarHBondContact CB-O 3.36Å
786	Q	31.4	Very low	30.5	Very low	120 Å²	120	106.6 Å²	106.6	56%	0.561	61%	0.611	S	S	*	*			trans	50.6	125.8	133.4	-70.3	-173.6	-90.3	0	0	126.1
787	Q	31.6	Very low	30.9	Very low	173 Å²	173	106.4 Å²	106.4	81%	0.808	61%	0.612	S	S	*	*			trans	58.7	154.7	133.9	-82.7	-177.4	-60.9	0	0	123.9
788	P	32.5	Very low	31.3	Very low	119 Å²	119	109.3 Å²	109.3	77%	0.773	62%	0.624	S	S	*	*			trans	-104.2	138	-179.1	38.2	-30.8	0	0	0	115.1
789	S	27.7	Very low	31.5	Very low	118 Å²	118	113.5 Å²	113.5	83%	0.825	65%	0.65	S	S	*	*			trans	-167.4	150.2	150.5	59.1	0	0	0	0	112.1
790	V	30.5	Very low	31	Very low	132 Å²	132	114.2 Å²	114.2	80%	0.8	66%	0.657	S	S	*	*			trans	-58.6	165.4	162.3	-63.8	0	0	0	0	111.1
791	P	30.3	Very low	30.9	Very low	108 Å²	108	114.1 Å²	114.1	70%	0.701	66%	0.658	S	S	*	*			cis	-147.8	176.3	22.5	45.3	-25.6	0	0	0	119.1
792	V	27.6	Very low	31	Very low	125 Å²	125	112.5 Å²	112.5	76%	0.758	66%	0.66	S	S	*	*			trans	58.8	100.9	137.9	168.9	0	0	0	0	120.5
793	T	29.8	Very low	31.4	Very low	115 Å²	115	113.9 Å²	113.9	71%	0.706	68%	0.676	S	S	*	*				67.1	115.3	119.4	-45.4	0	0	0	0	121.3
794	M	29.8	Very low	31.4	Very low	160 Å²	160	115.4 Å²	115.4	79%	0.788	69%	0.691	S	S	*	*				174.4	128.8	109.8	-90.8	-157.4	174.6	0	0	117
795	I	30.1	Very low	31.4	Very low	139 Å²	139	117.3 Å²	117.3	71%	0.713	71%	0.705	S	S	*	*			trans	77.3	124	132.2	-64.5	178	0	0	0	123.3
796	A	30.7	Very low	31.6	Very low	50 Å²	50	119.4 Å²	119.4	41%	0.413	72%	0.722	S	S	.	*			trans	83	122.1	143.6	0	0	0	0	0	125.7
797	N	29.5	Very low	31.6	Very low	70 Å²	70	122.7 Å²	122.7	37%	0.374	74%	0.737	S	S	.	*			trans	67.9	121.5	132.5	-69.7	20.4	0	0	0	121.8	G1378 Q1379	N797-G1378 VanDerWaalsContact ND2-C 3.31Å; N797-G1378 PolarHBondContact ND2-O 3.4Å; N797-Q1379 PolarHBondContact ND2-O 3.02Å
798	I	32.5	Very low	31.9	Very low	134 Å²	134	119.8 Å²	119.8	69%	0.687	73%	0.733	S	S	*	*				70.1	128.1	70.4	-66.4	166.8	0	0	0	112.8
799	P	33.7	Very low	31.9	Very low	112 Å²	112	122.8 Å²	122.8	73%	0.727	74%	0.737	S	S	*	*			cis	-149.4	-178	-23.4	43.4	-23.3	0	0	0	117.3
800	A	26.8	Very low	32.4	Very low	90 Å²	90	122.1 Å²	122.1	74%	0.744	73%	0.73	S	S	*	*			trans	72.8	156.3	139	0	0	0	0	0	125.3
801	M	31.2	Very low	32.4	Very low	185 Å²	185	121.8 Å²	121.8	91%	0.911	73%	0.727	S	S	*	*			trans	95.9	151.2	161	-51.1	-155.8	74.5	0	0	119.9
802	S	32.9	Very low	32.8	Very low	107 Å²	107	124.6 Å²	124.6	75%	0.748	74%	0.736	S	S	*	*			trans	-158.7	-168.6	-163.2	65.9	0	0	0	0	109.5
803	P	40.3	Very low	33.1	Very low	110 Å²	110	123.6 Å²	123.6	71%	0.714	74%	0.735	S	S	*	*			cis	-134	-155	-19.4	35.1	-13	0	0	0	113.8
804	T	32.9	Very low	33.6	Very low	124 Å²	124	123.6 Å²	123.6	76%	0.761	74%	0.736	S	S	*	*			trans	109.4	118.1	139.9	-3.5	0	0	0	0	124.1
805	S	33.6	Very low	33.9	Very low	115 Å²	115	121.5 Å²	121.5	80%	0.804	73%	0.733	S	S	*	*			trans	65.5	125	133.6	170.1	0	0	0	0	125.6
806	A	37.2	Very low	34.1	Very low	101 Å²	101	120.5 Å²	120.5	84%	0.835	74%	0.738	S	S	*	*				-168.8	167.3	124.6	0	0	0	0	0	114.5
807	Q	33.4	Very low	34.3	Very low	190 Å²	190	122.6 Å²	122.6	89%	0.888	76%	0.755	S	S	*	*			trans	-128.7	-169.4	-173.7	-122.9	-172.5	-8.7	0	0	110.2
808	P	36.5	Very low	34.5	Very low	111 Å²	111	124.2 Å²	124.2	72%	0.721	78%	0.778	S	S	*	*			cis	-137	-149.6	-0.9	40.2	-16.4	0	0	0	115.6
809	Q	33.5	Very low	34.7	Very low	182 Å²	182	124.1 Å²	124.1	85%	0.85	78%	0.784	S	S	*	*			trans	-129.7	-153.5	-177.5	-59.1	-178	-13.7	0	0	110.6
810	P	36.7	Very low	34.8	Very low	105 Å²	105	124.7 Å²	124.7	68%	0.682	79%	0.787	S	S	*	*			cis	-147.1	-156.1	-1.4	38.9	-12.4	0	0	0	117.7
811	V	31.4	Very low	35.2	Very low	124 Å²	124	126.5 Å²	126.5	75%	0.752	79%	0.789	S	S	*	*			trans	77.2	128.4	155	-65.1	0	0	0	0	126.1
812	L	38.1	Very low	35.4	Very low	167 Å²	167	123 Å²	123	87%	0.874	78%	0.78	S	S	*	*				163.2	173.5	113.9	-82.6	-176.9	0	0	0	115.1
813	S	33.8	Very low	35.1	Very low	105 Å²	105	123.5 Å²	123.5	73%	0.734	78%	0.779	S	S	*	*			trans	-126.6	-159.8	-161.4	-34.3	0	0	0	0	113.4
814	P	40.1	Very low	34.5	Very low	114 Å²	114	123.8 Å²	123.8	74%	0.74	78%	0.779	S	S	*	*			cis	-142.8	-166.8	-16.5	30.9	-4.8	0	0	0	116.5
815	T	36	Very low	34.3	Very low	117 Å²	117	125.3 Å²	125.3	72%	0.718	78%	0.779	S	S	*	*			trans	101.3	113.9	139.7	-56.9	0	0	0	0	123.9
816	S	34.6	Very low	33.9	Very low	117 Å²	117	126.8 Å²	126.8	82%	0.818	78%	0.777	S	S	*	*			trans	53.8	163.2	142.1	-54.2	0	0	0	0	122.2
817	A	36	Very low	33.3	Very low	94 Å²	94	129.7 Å²	129.7	78%	0.777	77%	0.773	S	S	*	*			cis	-155	170.1	16.4	0	0	0	0	0	116.2
818	A	34.4	Very low	33.2	Very low	104 Å²	104	125.5 Å²	125.5	86%	0.86	76%	0.759	S	S	*	*			trans	82.2	124.4	151.5	0	0	0	0	0	121.8
819	V	35.2	Very low	33.1	Very low	132 Å²	132	126.2 Å²	126.2	80%	0.8	76%	0.764	S	S	*	*			trans	-117.4	164.3	167.1	-147.6	0	0	0	0	107.3
820	P	36.2	Very low	33.3	Very low	124 Å²	124	126.7 Å²	126.7	81%	0.805	76%	0.764	S	S	*	*				-154.9	163.6	92.5	41.4	-22.7	0	0	0	117.9
821	V	35.7	Very low	33	Very low	128 Å²	128	126.4 Å²	126.4	78%	0.776	76%	0.762	S	S	*	*			trans	-73.1	166.4	157.5	-75.9	0	0	0	0	110.3
822	P	34.1	Very low	32.7	Very low	112 Å²	112	125.4 Å²	125.4	73%	0.727	76%	0.76	S	S	*	*			cis	-159.8	-173.1	46.8	46.7	-23.1	0	0	0	120
823	T	28.1	Very low	32.2	Very low	118 Å²	118	125.6 Å²	125.6	72%	0.724	76%	0.756	S	S	*	*			trans	16.4	148.4	150.4	-34.4	0	0	0	0	123
824	T	28	Very low	31.9	Very low	115 Å²	115	127.7 Å²	127.7	71%	0.706	76%	0.758	S	S	*	*			trans	83.2	137	148.2	15.8	0	0	0	0	120.7
825	M	26.7	Very low	31.3	Very low	157 Å²	157	127.2 Å²	127.2	77%	0.773	76%	0.755	S	S	*	*			trans	65.1	141.4	140.1	-74.9	-73.1	-173.4	0	0	121.4
826	I	25.6	Very low	30.8	Very low	146 Å²	146	127.6 Å²	127.6	75%	0.749	76%	0.757	S	S	*	*			trans	71.4	112.8	137.8	-70.1	169.1	0	0	0	118.8
827	H	25.8	Very low	30.4	Very low	162 Å²	162	130 Å²	130	75%	0.75	76%	0.755	S	S	*	*			trans	75.5	105.9	136.2	-152.1	76.9	0	0	0	120.6
828	V	30.6	Very low	30	Very low	101 Å²	101	132.2 Å²	132.2	61%	0.612	75%	0.754	S	S	*	*				13.5	121.8	122	178.5	0	0	0	0	116.9	K830	V828-K830 HydrophobicContact CG1-CB 4.19Å
829	P	34.2	Very low	29.7	Very low	127 Å²	127	132.9 Å²	132.9	83%	0.825	75%	0.747	S	S	*	*			trans	-112.7	87.7	148.3	34.4	-26.7	0	0	0	111.2
830	K	38	Very low	29.4	Very low	192 Å²	192	130.5 Å²	130.5	84%	0.835	74%	0.741	S	S	*	*			trans	-97.9	118.7	149.8	173.5	-178.7	177.5	179.8	0	106.5	V828	V828-K830 HydrophobicContact CG1-CB 4.19Å
831	P	29.7	Very low	29	Very low	99 Å²	99	130 Å²	130	64%	0.643	74%	0.736	S	S	*	*				-144.9	178.3	129.9	39.5	-26.1	0	0	0	113.1
832	S	26.8	Very low	28.8	Very low	102 Å²	102	130 Å²	130	71%	0.713	74%	0.737	S	S	*	*			trans	64	108.1	158.2	-51.9	0	0	0	0	116.7
833	E	26	Very low	28.6	Very low	171 Å²	171	128.8 Å²	128.8	80%	0.799	74%	0.736	S	S	*	*			cis	63.8	137.2	25.1	-145.9	-178.4	-150.9	0	0	113.9
834	I	27.9	Very low	28.8	Very low	150 Å²	150	127.5 Å²	127.5	77%	0.769	74%	0.737	S	S	*	*			trans	73.7	142	175	-47.5	159.7	0	0	0	114.7
835	P	27.5	Very low	29	Very low	104 Å²	104	127.2 Å²	127.2	68%	0.675	74%	0.737	S	S	*	*			cis	-110.1	163	-21.7	41.7	-29.8	0	0	0	110.7
836	V	25.3	Very low	29.1	Very low	125 Å²	125	126.5 Å²	126.5	76%	0.758	74%	0.741	S	S	*	*				53.6	88.9	57.5	-166.8	0	0	0	0	114.9
837	Q	27.2	Very low	29.3	Very low	168 Å²	168	123.7 Å²	123.7	79%	0.785	74%	0.74	S	S	*	*			trans	-176.1	124.6	142	-102.2	156.9	26.3	0	0	108.7
838	N	26.6	Very low	29.5	Very low	139 Å²	139	120 Å²	120	74%	0.743	74%	0.738	S	S	*	*				76	140	86.1	-70.5	17	0	0	0	112.4
839	V	27.8	Very low	29.6	Very low	118 Å²	118	121.8 Å²	121.8	72%	0.715	74%	0.744	S	S	*	*			cis	-150.5	134.5	10.1	97.2	0	0	0	0	112.7
840	A	29	Very low	29.6	Very low	82 Å²	82	122.2 Å²	122.2	68%	0.678	74%	0.739	S	S	*	*			trans	59.9	177.5	144	0	0	0	0	0	118.4
841	T	29.5	Very low	29.3	Very low	114 Å²	114	119.1 Å²	119.1	70%	0.699	74%	0.736	S	S	*	*			cis	-149.2	144	9.8	-24	0	0	0	0	111.5
842	T	29.7	Very low	29.6	Very low	129 Å²	129	119.8 Å²	119.8	79%	0.791	74%	0.74	S	S	*	*			trans	37.6	140	144.6	50.2	0	0	0	0	121.1
843	A	31.5	Very low	30.2	Very low	86 Å²	86	120.2 Å²	120.2	71%	0.711	74%	0.741	S	S	*	*			cis	-166	161.9	-2.4	0	0	0	0	0	106.3
844	A	30.7	Very low	30.6	Very low	90 Å²	90	117 Å²	117	74%	0.744	74%	0.737	S	S	*	*				47.2	143.6	61.2	0	0	0	0	0	113.5
845	P	32.7	Very low	31.1	Very low	110 Å²	110	115.7 Å²	115.7	71%	0.714	74%	0.738	S	S	*	*			cis	-124.7	154.5	21.1	46.4	-32.7	0	0	0	113.5
846	V	28.3	Very low	31.5	Very low	141 Å²	141	114.7 Å²	114.7	86%	0.855	74%	0.739	S	S	*	*				69.4	159.7	91.4	-170.9	0	0	0	0	114.5
847	A	29.7	Very low	32	Very low	88 Å²	88	113.5 Å²	113.5	73%	0.727	73%	0.734	S	S	*	*			trans	89.3	111.7	-177	0	0	0	0	0	112.8
848	A	30.8	Very low	32.3	Very low	85 Å²	85	114.4 Å²	114.4	70%	0.702	74%	0.735	S	S	*	*				81.8	147.7	64.2	0	0	0	0	0	111.4
849	N	32.1	Very low	32.6	Very low	137 Å²	137	116.1 Å²	116.1	73%	0.733	74%	0.736	S	S	*	*			cis	-160.7	169.4	-3.6	-118	-1	0	0	0	109.3
850	N	35.5	Very low	32.9	Very low	136 Å²	136	115 Å²	115	73%	0.727	73%	0.729	S	S	*	*			trans	71	145.2	161.6	-54.7	-17.3	0	0	0	116.9
851	V	31.2	Very low	33.2	Very low	128 Å²	128	119.6 Å²	119.6	78%	0.776	74%	0.737	S	S	*	*			cis	82.1	133.1	20.1	-177.4	0	0	0	0	113.4
852	P	36	Very low	33.4	Very low	112 Å²	112	118.6 Å²	118.6	73%	0.727	73%	0.728	S	S	*	*			cis	-130.5	-123.1	-31.5	39.6	-18.8	0	0	0	109.2
853	P	38.9	Very low	33.6	Very low	112 Å²	112	119.8 Å²	119.8	73%	0.727	73%	0.727	S	S	*	*				-117.2	-174.5	-58.6	38.5	-23.4	0	0	0	113.4
854	S	34.2	Very low	33.6	Very low	102 Å²	102	122.6 Å²	122.6	71%	0.713	73%	0.726	S	S	*	*			trans	-74.5	163.8	159.4	-170.4	0	0	0	0	111.7
855	P	38.1	Very low	33.8	Very low	123 Å²	123	123.3 Å²	123.3	80%	0.799	72%	0.721	S	S	*	*				-145.4	172.4	96.7	39.9	-24.9	0	0	0	115.8
856	A	36.1	Very low	34.1	Very low	84 Å²	84	123.2 Å²	123.2	69%	0.694	72%	0.721	S	S	*	*			trans	-89	-155.5	162.7	0	0	0	0	0	110.4
857	P	36.6	Very low	34.5	Very low	99 Å²	99	122 Å²	122	64%	0.643	71%	0.713	S	S	*	*				-151.7	-168.9	58.3	39.2	-15.6	0	0	0	117
858	F	33	Very low	34.7	Very low	187 Å²	187	125.6 Å²	125.6	82%	0.82	72%	0.72	S	S	*	*			trans	79.4	145.2	177.5	-56.8	-55.5	0	0	0	115.7
859	K	33.7	Very low	34.9	Very low	176 Å²	176	125 Å²	125	77%	0.765	71%	0.714	S	S	*	*			cis	-140.5	161.2	-11.5	-110.3	-159.1	174.1	-176.8	0	107
860	T	34.7	Very low	34.9	Very low	93 Å²	93	127.4 Å²	127.4	57%	0.571	72%	0.721	S	S	*	*			cis	79.8	114	39.4	-40.3	0	0	0	0	112.5
861	E	33.4	Very low	34.7	Very low	179 Å²	179	127.5 Å²	127.5	84%	0.836	72%	0.722	S	S	*	*			cis	-113.7	127.6	17.6	-65.9	175.8	148.3	0	0	110.7
862	D	33.9	Very low	34.8	Very low	94 Å²	94	126.8 Å²	126.8	50%	0.503	72%	0.718	S	S	.	*				82.6	135	73.2	-73.3	-49.6	0	0	0	113.7	Q864	D862-Q864 PolarHBondContact OD1-NE2 3.39Å; D862-Q864 VanDerWaalsContact OD1-NE2 3.07Å
863	I	34.8	Very low	34.6	Very low	153 Å²	153	126.3 Å²	126.3	79%	0.785	71%	0.712	S	S	*	*			cis	-133	127.4	13.6	-79	102	0	0	0	108.3
864	Q	31.4	Very low	34.4	Very low	146 Å²	146	125.8 Å²	125.8	68%	0.682	71%	0.709	S	S	*	*				71.1	142.7	63.8	-77.4	-163.2	50.8	0	0	116	D862	D862-Q864 PolarHBondContact OD1-NE2 3.39Å; D862-Q864 VanDerWaalsContact OD1-NE2 3.07Å
865	T	35.8	Very low	34.4	Very low	105 Å²	105	131.4 Å²	131.4	64%	0.644	72%	0.715	S	S	*	*			cis	-179	-172.1	-30.2	12.6	0	0	0	0	107.2
866	P	39	Very low	34	Very low	108 Å²	108	129.3 Å²	129.3	70%	0.701	70%	0.7	S	S	*	*			cis	-108.8	-166.7	-21.9	42.6	-29.6	0	0	0	110.9
867	T	35	Very low	33.9	Very low	114 Å²	114	132 Å²	132	70%	0.699	70%	0.701	S	S	*	*			cis	93	151.7	-1	70.9	0	0	0	0	121.5
868	L	35	Very low	33.7	Very low	165 Å²	165	129.3 Å²	129.3	86%	0.864	69%	0.685	S	S	*	*			trans	90.8	145.5	171.9	-78.3	64	0	0	0	120.8
869	A	34.8	Very low	33.6	Very low	71 Å²	71	124.4 Å²	124.4	59%	0.587	67%	0.67	S	S	*	*			cis	-177.2	143.6	-29.5	0	0	0	0	0	114.6
870	Q	32.4	Very low	33.5	Very low	189 Å²	189	120.9 Å²	120.9	88%	0.883	66%	0.66	S	S	*	*			trans	61	161.3	147.3	-62.4	168.4	-3.5	0	0	118.2
871	N	30.1	Very low	33.4	Very low	138 Å²	138	120.4 Å²	120.4	74%	0.738	67%	0.665	S	S	*	*			cis	-154.3	-174.8	-2.4	-147.3	-2.2	0	0	0	107.9
872	T	34.1	Very low	33.3	Very low	112 Å²	112	117.8 Å²	117.8	69%	0.687	67%	0.667	S	S	*	*			cis	-158.5	-179.1	4.8	-24.5	0	0	0	0	109.9
873	V	32.4	Very low	33.1	Very low	102 Å²	102	116.9 Å²	116.9	62%	0.618	68%	0.679	S	S	*	*			trans	-144.4	-172.7	175.5	-62.4	0	0	0	0	110.1	T1569	V873-T1569 WeakPolarHBondContact CG1-OG1 3.34Å
874	P	34.2	Very low	32.8	Very low	102 Å²	102	117.6 Å²	117.6	66%	0.662	68%	0.684	S	S	*	*			cis	-142.5	-156.5	-1	40.7	-17	0	0	0	116.4
875	R	34.6	Very low	32.6	Very low	219 Å²	219	116.3 Å²	116.3	83%	0.826	69%	0.686	S	S	*	*			trans	94.5	99.7	153.5	-82.3	176.5	-180	-179.8	0.3	123.8
876	T	29.7	Very low	32.1	Very low	79 Å²	79	118.2 Å²	118.2	49%	0.485	69%	0.691	S	S	.	*				46.6	130.5	115.6	-26.9	0	0	0	0	120.5	T1566	T876-T1566 HydrophobicContact CG2-CG2 4.16Å
877	I	33.1	Very low	31.6	Very low	140 Å²	140	120 Å²	120	72%	0.718	69%	0.694	S	S	*	*				-167	154.4	79.7	-79.3	166.6	0	0	0	112.7	T1566	I877-T1566 VanDerWaalsContact CA-CG2 3.44Å
878	S	31.9	Very low	31.5	Very low	43 Å²	43	120.9 Å²	120.9	30%	0.301	70%	0.7	S	S	.	*			trans	-21.1	163.2	161.9	-73.6	0	0	0	0	121.7	R1564 N1565	S878-R1564 PolarHBondContact OG-O 2.95Å; S878-N1565 WeakPolarHBondContact OG-CB 3.25Å; S878-N1565 PolarHBondContact OG-O 3.19Å
879	T	31.4	Very low	31.3	Very low	85 Å²	85	118.8 Å²	118.8	52%	0.521	70%	0.696	S	S	.	*			cis	-165.4	168.5	3.1	13.5	0	0	0	0	113.6	R1564	T879-R1564 HydrophobicContact CG2-CB 4.17Å; T879-R1564 HydrophobicContact CG2-CG 4.35Å
880	D	31.6	Very low	31.1	Very low	102 Å²	102	120 Å²	120	55%	0.545	71%	0.706	S	S	.	*			trans	66.7	115.6	150.7	-85.8	-9.2	0	0	0	125	R1564	D880-R1564 IonicContact OD1-CZ 3.71Å; D880-R1564 IonicContact OD1-NH1 2.68Å; D880-R1564 PolarHBondContact OD1-NH1 3.24Å; D880-R1564 IonicContact OD1-NH2 3.53Å; D880-R1564 PolarHBondContact OD1-NH2 2.67Å; D880-R1564 IonicContact OD2-CZ 3.77Å; D880-R1564 IonicContact OD2-NH1 2.81Å; D880-R1564 PolarHBondContact OD2-NH1 2.85Å; D880-R1564 IonicContact OD2-NH2 2.75Å; D880-R1564 PolarHBondContact OD2-NH2 3.48Å
881	A	32.5	Very low	31	Very low	83 Å²	83	114 Å²	114	69%	0.686	69%	0.685	S	S	*	*				47.2	121.7	121.8	0	0	0	0	0	124.2
882	S	30.7	Very low	31.1	Very low	124 Å²	124	112.9 Å²	112.9	87%	0.867	68%	0.678	S	S	*	*			trans	74.9	74.5	132.1	-58.8	0	0	0	0	121.8
883	G	29.9	Very low	31	Very low	74 Å²	74	110 Å²	110	76%	0.763	67%	0.665	S	S	*	*				83.2	126.3	111.6	0	0	0	0	0	121.5
884	L	28.7	Very low	31	Very low	169 Å²	169	110.1 Å²	110.1	89%	0.885	67%	0.671	S	S	*	*				-153.5	150.6	123.6	-142.7	71	0	0	0	113.7
885	V	26.9	Very low	31.1	Very low	119 Å²	119	111.6 Å²	111.6	72%	0.721	68%	0.68	S	S	*	*			trans	-56.3	150.4	174.7	-169.7	0	0	0	0	113.3
886	I	26.5	Very low	31.1	Very low	145 Å²	145	106.2 Å²	106.2	74%	0.744	68%	0.676	S	S	*	*				175.9	122.5	127.5	-90.4	159.4	0	0	0	114.4
887	N	28.8	Very low	31.6	Very low	146 Å²	146	108.5 Å²	108.5	78%	0.781	69%	0.692	S	S	*	*			trans	60.3	118	150.4	-60.7	5.6	0	0	0	124.7
888	T	31.4	Very low	31.6	Very low	132 Å²	132	106 Å²	106	81%	0.81	69%	0.693	S	S	*	*			trans	-70.1	175	145.5	41.5	0	0	0	0	111.3
889	P	32	Very low	31.9	Very low	121 Å²	121	109.7 Å²	109.7	79%	0.786	72%	0.716	S	S	*	*			cis	-154	160.3	35.2	43.5	-20.8	0	0	0	122.7
890	A	31.3	Very low	31.9	Very low	96 Å²	96	111.4 Å²	111.4	79%	0.793	73%	0.731	S	S	*	*			trans	28.2	138.9	139.4	0	0	0	0	0	125.9
891	S	30.1	Very low	32	Very low	64 Å²	64	110.7 Å²	110.7	45%	0.448	74%	0.739	S	S	.	*				130.3	159.4	115.2	-157.3	0	0	0	0	118.4	K192 A193	K192-S891 VanDerWaalsContact CB-OG 3.26Å; K192-S891 WeakPolarHBondContact CB-OG 3.19Å; K192-S891 PolarHBondContact O-OG 2.84Å; A193-S891 CarbonylContact O-C 3.53Å; A193-S891 VanDerWaalsContact O-CA 3.32Å; A193-S891 WeakPolarHBondContact O-CA 3.46Å; A193-S891 PolarHBondContact O-OG 2.91Å
892	I	31.1	Very low	31.9	Very low	114 Å²	114	112.7 Å²	112.7	59%	0.585	74%	0.743	S	S	*	*			trans	87.3	137.6	171.5	-54.2	164.6	0	0	0	115.7	K192 A193 G194	K192-I892 HydrophobicContact CD-CG1 3.92Å; A193-I892 PolarHBondContact O-N 2.89Å; G194-I892 WeakPolarHBondContact CA-O 3.38Å
893	A	32.7	Very low	32	Very low	52 Å²	52	113.4 Å²	113.4	43%	0.43	74%	0.737	S	S	.	*			cis	-166.7	170.4	-27.2	0	0	0	0	0	111.2	K192	K192-A893 HydrophobicContact CD-CB 4.34Å
894	S	32	Very low	32.1	Very low	104 Å²	104	116 Å²	116	73%	0.727	74%	0.738	S	S	*	*			trans	-84.7	171.6	-179.6	-35.8	0	0	0	0	114.5
895	P	36.8	Very low	32.3	Very low	132 Å²	132	112.2 Å²	112.2	86%	0.857	73%	0.731	S	S	*	*				-148.7	-176.2	88.1	40.6	-22.4	0	0	0	116.6
896	S	34.6	Very low	32.5	Very low	106 Å²	106	111.1 Å²	111.1	74%	0.741	73%	0.728	S	S	*	*			trans	-113.4	167.4	177.9	176.5	0	0	0	0	111.3
897	P	40	Very low	32.6	Very low	127 Å²	127	110.1 Å²	110.1	83%	0.825	73%	0.729	S	S	*	*				-142.5	162.2	126	39	-26.7	0	0	0	116.1
898	A	33.8	Very low	32.8	Very low	89 Å²	89	109 Å²	109	74%	0.736	73%	0.728	S	S	*	*			trans	-123	157.2	166.5	0	0	0	0	0	110.7
899	P	36.7	Very low	32.7	Very low	120 Å²	120	107.1 Å²	107.1	78%	0.779	73%	0.726	S	S	*	*				-135.1	151.8	124.8	12.2	10.3	0	0	0	111.9
900	S	31.2	Very low	32.8	Very low	120 Å²	120	107.1 Å²	107.1	84%	0.839	73%	0.726	S	S	*	*			cis	96.7	107.8	40.5	-60.5	0	0	0	0	114.1
901	A	35.2	Very low	32.8	Very low	87 Å²	87	109.2 Å²	109.2	72%	0.719	73%	0.728	S	S	*	*			trans	171.3	101.1	155	0	0	0	0	0	108
902	T	29.6	Very low	32.9	Very low	125 Å²	125	112.6 Å²	112.6	77%	0.767	75%	0.746	S	S	*	*				91.4	153.9	69.2	52.7	0	0	0	0	114.6
903	D	32.6	Very low	33	Very low	140 Å²	140	112.3 Å²	112.3	75%	0.749	75%	0.752	S	S	*	*			trans	75.6	130.9	163.8	-62.9	-12.7	0	0	0	120.2
904	V	32	Very low	32.8	Very low	128 Å²	128	114.3 Å²	114.3	78%	0.776	77%	0.768	S	S	*	*			cis	-156.7	159.8	-31	-123.4	0	0	0	0	109.8
905	A	33.5	Very low	33.1	Very low	90 Å²	90	115 Å²	115	74%	0.744	77%	0.771	S	S	*	*			trans	67.1	146.1	150.7	0	0	0	0	0	119.4
906	S	30.8	Very low	32.8	Very low	95 Å²	95	115.6 Å²	115.6	66%	0.664	77%	0.772	S	S	*	*			cis	-171.3	146.6	-14.7	47	0	0	0	0	111.4
907	T	29.1	Very low	32.9	Very low	124 Å²	124	116.1 Å²	116.1	76%	0.761	77%	0.773	S	S	*	*			trans	58.2	142.9	150.6	52.9	0	0	0	0	119.2
908	T	33.3	Very low	32.4	Very low	124 Å²	124	116.7 Å²	116.7	76%	0.761	77%	0.774	S	S	*	*			cis	-159.4	128.6	-2.2	11	0	0	0	0	105.9
909	A	28.7	Very low	32	Very low	91 Å²	91	118.6 Å²	118.6	75%	0.752	78%	0.777	S	S	*	*				84.1	146.4	80.6	0	0	0	0	0	114.6
910	P	33.3	Very low	31.7	Very low	121 Å²	121	118.5 Å²	118.5	79%	0.786	77%	0.774	S	S	*	*			trans	-117	159.3	-157.3	40.8	-29.9	0	0	0	115.5
911	V	32.1	Very low	31.6	Very low	141 Å²	141	118.2 Å²	118.2	86%	0.855	77%	0.767	S	S	*	*			trans	-143.3	111.5	169.3	-169.4	0	0	0	0	112.9
912	T	31.7	Very low	31.3	Very low	134 Å²	134	121.5 Å²	121.5	82%	0.822	77%	0.773	S	S	*	*			trans	-89.6	145.7	145.9	17.6	0	0	0	0	107.6
913	P	33	Very low	31.3	Very low	108 Å²	108	119 Å²	119	70%	0.701	77%	0.773	S	S	*	*				-156.2	168.1	69.4	43.1	-24	0	0	0	118.6
914	A	28.8	Very low	31	Very low	94 Å²	94	116.4 Å²	116.4	78%	0.777	78%	0.778	S	S	*	*			trans	51	156.5	135.4	0	0	0	0	0	123.3
915	P	38.5	Very low	30.9	Very low	120 Å²	120	115.3 Å²	115.3	78%	0.779	78%	0.783	S	S	*	*			trans	-112.3	157.9	-166.3	41	-32.2	0	0	0	116.2
916	T	29.5	Very low	30.6	Very low	144 Å²	144	114.6 Å²	114.6	88%	0.883	78%	0.777	S	S	*	*			trans	-151.3	137.5	156.7	12.8	0	0	0	0	111.3
917	P	37	Very low	30.4	Very low	117 Å²	117	115.1 Å²	115.1	76%	0.76	79%	0.787	S	S	*	*			trans	-104.8	143	176	36.7	-30.4	0	0	0	113.3
918	T	29.2	Very low	30.3	Very low	138 Å²	138	113.2 Å²	113.2	85%	0.847	78%	0.784	S	S	*	*			trans	-163.8	115.2	145.2	23.4	0	0	0	0	112.1
919	T	27.1	Very low	30	Very low	129 Å²	129	111.5 Å²	111.5	79%	0.791	78%	0.777	S	S	*	*			trans	19	126	134.8	-26.6	0	0	0	0	120
920	T	28.6	Very low	30	Very low	118 Å²	118	113.8 Å²	113.8	72%	0.724	78%	0.782	S	S	*	*				158.3	111.3	115.9	-63.9	0	0	0	0	112.1
921	T	29.5	Very low	29.7	Very low	114 Å²	114	114 Å²	114	70%	0.699	78%	0.781	S	S	*	*			trans	41.7	131.3	131.2	-36.1	0	0	0	0	119.1
922	D	29.4	Very low	29.5	Very low	156 Å²	156	112.4 Å²	112.4	83%	0.834	77%	0.772	S	S	*	*			cis	-161.1	165.4	30.1	-144.2	-21.8	0	0	0	114.9
923	G	28.6	Very low	29.5	Very low	74 Å²	74	115.7 Å²	115.7	76%	0.763	78%	0.778	S	S	*	*			trans	73.3	123.8	147.4	0	0	0	0	0	122.5
924	G	28.1	Very low	29.3	Very low	84 Å²	84	117 Å²	117	87%	0.866	78%	0.779	S	S	*	*			trans	149	100.7	158.4	0	0	0	0	0	116.5
925	A	28.2	Very low	29.4	Very low	105 Å²	105	120.9 Å²	120.9	87%	0.868	78%	0.778	S	S	*	*			trans	-85.4	152.9	-171.7	0	0	0	0	0	116.3
926	A	27.7	Very low	28.9	Very low	76 Å²	76	122.7 Å²	122.7	63%	0.628	78%	0.776	S	S	*	*				169.5	128	120.8	0	0	0	0	0	116.2
927	A	27.6	Very low	29	Very low	105 Å²	105	125 Å²	125	87%	0.868	78%	0.777	S	S	*	*			trans	63.3	151.8	163.2	0	0	0	0	0	117.9
928	A	27.4	Very low	28.8	Very low	84 Å²	84	128.5 Å²	128.5	69%	0.694	78%	0.78	S	S	*	*			cis	-147.1	-176.8	13.7	0	0	0	0	0	113.7
929	S	26.8	Very low	28.9	Very low	89 Å²	89	133.3 Å²	133.3	62%	0.622	78%	0.783	S	S	*	*			trans	22.6	140.3	152.4	49.1	0	0	0	0	121.4
930	T	27.3	Very low	29.2	Very low	138 Å²	138	137.5 Å²	137.5	85%	0.847	79%	0.79	S	S	*	*			cis	-151.1	144	13.2	-33.9	0	0	0	0	110.7
931	T	27.1	Very low	29.2	Very low	127 Å²	127	136.8 Å²	136.8	78%	0.779	79%	0.79	S	S	*	*			trans	-109.9	117.4	-179.1	28.9	0	0	0	0	114.6
932	T	27.6	Very low	29.5	Very low	107 Å²	107	138.9 Å²	138.9	66%	0.656	80%	0.797	S	S	*	*			trans	25	130.6	135.4	58.5	0	0	0	0	120.7
933	E	32	Very low	30.2	Very low	202 Å²	202	137.3 Å²	137.3	94%	0.944	78%	0.783	S	S	*	*				-132.1	158.5	113.7	-82	-134.6	117	0	0	109.9
934	N	29.3	Very low	31.8	Very low	135 Å²	135	141 Å²	141	72%	0.722	77%	0.774	S	S	*	*			trans	-125.2	151.9	-173.2	-70	-83.9	0	0	0	110.9
935	K	31	Very low	34.4	Very low	177 Å²	177	142.6 Å²	142.6	77%	0.77	76%	0.757	S	S	*	*				-167.6	113.9	119.1	-109.9	168.8	174.9	-89.2	0	116.6
936	E	28.6	Very low	37.2	Very low	158 Å²	158	137.6 Å²	137.6	74%	0.738	72%	0.716	S	S	*	*				68.2	74	119.1	-162.9	168.3	-169.6	0	0	118.6
937	E	30.1	Very low	40.3	Very low	193 Å²	193	134.7 Å²	134.7	90%	0.902	69%	0.69	S	S	*	*			trans	-105.9	145.5	162.5	-166	174.5	-134.8	0	0	112.3
938	K	33.2	Very low	43.4	Very low	189 Å²	189	129.7 Å²	129.7	82%	0.822	65%	0.649	S	S	*	*			trans	-127.6	85.5	-161.2	-164.9	173.9	-177.8	173.8	0	115.1
939	R	31.3	Very low	46.6	Very low	240 Å²	240	127.4 Å²	127.4	91%	0.906	62%	0.623	S	S	*	*			trans	59.9	100.5	151	-61.7	-179.9	169	-167.9	-4.8	118.9
940	K	33	Very low	49.7	Very low	216 Å²	216	123.3 Å²	123.3	94%	0.939	60%	0.595	S	S	*	*			trans	-152.1	132.6	133.5	-144.2	158.8	-173.1	168.9	0	111
941	S	29	Very low	52.7	Low	104 Å²	104	120.4 Å²	120.4	73%	0.727	57%	0.573	S	S	*	*			trans	-96.8	120	-167.1	43.2	0	0	0	0	113.9
942	N	37.2	Very low	55.7	Low	158 Å²	158	115.2 Å²	115.2	85%	0.845	55%	0.545	S	S	*	.			trans	-102.6	104.2	163.2	-83.6	-10.9	0	0	0	109.2
943	K	42.5	Very low	58.3	Low	123 Å²	123	111.9 Å²	111.9	54%	0.535	53%	0.526	S	S	.	.			trans	-67.5	130.1	174.8	-65.7	-174	-177	-82.1	0	109.9	V1031 D1033	K943-V1031 HydrophobicContact CB-CG1 3.87Å; K943-V1031 HydrophobicContact CD-CG1 3.82Å; K943-V1031 HydrophobicContact CG-CG1 4.34Å; K943-D1033 IonicContact NZ-OD1 2.73Å; K943-D1033 PolarHBondContact NZ-OD1 3.31Å; K943-D1033 IonicContact NZ-OD2 2.67Å; K943-D1033 PolarHBondContact NZ-OD2 3.26Å
944	R	63	Low	60.6	Low	150 Å²	150	104.3 Å²	104.3	57%	0.566	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88	128.4	178.6	-58.4	-179.6	-173.7	-174.1	1.7	108.9	L1032	R944-L1032 HydrophobicContact CB-CB 4.26Å; R944-L1032 HydrophobicContact CB-CD1 4.13Å; R944-L1032 PolarHBondContact O-N 2.94Å
945	K	81.6	Confident	62.6	Low	119 Å²	119	103.1 Å²	103.1	52%	0.517	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	135.2	-177.2	-166.5	-177.3	-176.5	-178.6	0	110.1	V947 T1030 V1031	K945-V947 HydrophobicContact CD-CG2 3.83Å; K945-V947 HydrophobicContact CG-CG2 3.78Å; K945-T1030 WeakPolarHBondContact CA-O 3.25Å; K945-V1031 HydrophobicContact CG-CG2 4.24Å
946	V	88.2	Confident	63.9	Low	0 Å²	0	99.4 Å²	99.4	0%	0	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	133.3	171.1	179.9	0	0	0	0	107.8	L966 I1004 V1005 Q1008 T1030 L1032	V946-L966 HydrophobicContact CG1-CD1 3.95Å; V946-I1004 HydrophobicContact CB-CG2 4.09Å; V946-I1004 HydrophobicContact CG1-CG2 4.1Å; V946-V1005 HydrophobicContact CG1-CG2 4.2Å; V946-Q1008 PolarHBondContact O-NE2 3.44Å; V946-T1030 PolarHBondContact N-O 3.06Å; V946-T1030 PolarHBondContact O-N 3.18Å; V946-L1032 HydrophobicContact CG2-CD1 4.22Å
947	V	91.9	Very high	65.5	Low	14 Å²	14	98.7 Å²	98.7	9%	0.085	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	134.9	-171	-178.5	0	0	0	0	110.2	K945 L966 D967 K1027 L1028 A1029	K945-V947 HydrophobicContact CD-CG2 3.83Å; K945-V947 HydrophobicContact CG-CG2 3.78Å; V947-L966 CarbonylContact O-C 3.58Å; V947-L966 WeakPolarHBondContact O-CA 3.3Å; V947-D967 HydrophobicContact CB-CB 4.32Å; V947-D967 PolarHBondContact N-O 3.11Å; V947-D967 PolarHBondContact O-N 2.87Å; V947-K1027 HydrophobicContact CG1-CD 4.19Å; V947-K1027 HydrophobicContact CG1-CG 3.78Å; V947-L1028 CarbonylContact C-O 3.56Å; V947-L1028 VanDerWaalsContact CA-O 3.32Å; V947-L1028 WeakPolarHBondContact CA-O 3.36Å; V947-A1029 HydrophobicContact CG2-CB 4.27Å
948	M	93.2	Very high	67.1	Low	1 Å²	1	97.1 Å²	97.1	1%	0.005	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	141.7	172.1	-176	157.4	49.9	0	0	111	C964 R965 L966 F975 Q1008 L1009 V1012 K1027 L1028	M948-C964 HydrophobicContact CG-CB 4.24Å; M948-C964 HydrophobicContact SD-CB 4.15Å; M948-R965 CarbonylContact C-O 3.51Å; M948-R965 VanDerWaalsContact CA-O 3.28Å; M948-R965 WeakPolarHBondContact CA-O 3.33Å; M948-L966 HydrophobicContact CB-CD1 4.5Å; M948-F975 HydrophobicContact SD-CE1 4.36Å; M948-F975 HydrophobicContact SD-CZ 3.85Å; M948-Q1008 VanDerWaalsContact CE-C 3.47Å; M948-Q1008 HydrophobicContact CE-CB 3.39Å; M948-L1009 HydrophobicContact CE-CD2 4Å; M948-L1009 HydrophobicContact CE-CG 3.93Å; M948-L1009 HydrophobicContact SD-CD2 4.08Å; M948-L1009 HydrophobicContact SD-CG 4.47Å; M948-V1012 HydrophobicContact CE-CG2 4.06Å; M948-K1027 CarbonylContact O-C 3.6Å; M948-K1027 WeakPolarHBondContact O-CA 3.5Å; M948-L1028 PolarHBondContact N-O 3.36Å; M948-L1028 PolarHBondContact O-N 2.84Å
949	E	93.8	Very high	68.8	Low	35 Å²	35	94.8 Å²	94.8	16%	0.164	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	126.1	-171.7	-173.7	176.7	107.7	0	0	109.7	L951 C964 R965 T1026 K1027	E949-L951 PolarHBondContact O-N 2.86Å; E949-C964 CarbonylContact O-C 3.37Å; E949-C964 WeakPolarHBondContact O-CA 3.44Å; E949-R965 PolarHBondContact N-O 2.91Å; E949-R965 PolarHBondContact O-N 2.94Å; E949-R965 IonicContact OE1-CZ 3.82Å; E949-R965 IonicContact OE1-NH1 3.89Å; E949-R965 PolarHBondContact OE1-NH1 3.04Å; E949-R965 IonicContact OE1-NH2 3.24Å; E949-R965 PolarHBondContact OE1-NH2 3.47Å; E949-R965 IonicContact OE2-CZ 3.12Å; E949-R965 IonicContact OE2-NH2 2.84Å; E949-R965 PolarHBondContact OE2-NH2 3.44Å; E949-T1026 WeakPolarHBondContact CA-O 3.49Å; E949-K1027 HydrophobicContact CB-CG 4.43Å; E949-K1027 WeakPolarHBondContact OE2-CD 3.13Å; E949-K1027 WeakPolarHBondContact OE2-CE 3.47Å; E949-K1027 IonicContact OE2-NZ 2.67Å; E949-K1027 PolarHBondContact OE2-NZ 2.84Å
950	I	93.2	Very high	70.8	Confident	4 Å²	4	85.4 Å²	85.4	2%	0.021	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	118.1	179.3	-57.4	170.7	0	0	0	108.8	V1012 L1015 I1016 G1023 G1025 T1026	I950-V1012 HydrophobicContact CD1-CB 4.4Å; I950-V1012 HydrophobicContact CD1-CG1 3.91Å; I950-V1012 HydrophobicContact CD1-CG2 4.06Å; I950-V1012 HydrophobicContact CG1-CG1 4.04Å; I950-V1012 HydrophobicContact CG1-CG2 4.03Å; I950-L1015 HydrophobicContact CD1-CD2 3.94Å; I950-I1016 HydrophobicContact CD1-CD1 4.22Å; I950-I1016 HydrophobicContact CD1-CG1 4.48Å; I950-I1016 HydrophobicContact CG2-CD1 4.23Å; I950-G1023 WeakPolarHBondContact CD1-O 3.41Å; I950-G1025 WeakPolarHBondContact O-CA 3.49Å; I950-G1025 PolarHBondContact O-N 2.76Å; I950-T1026 PolarHBondContact N-O 3.17Å; I950-T1026 VanDerWaalsContact N-O 3.1Å
951	L	91	Very high	73.4	Confident	76 Å²	76	76.7 Å²	76.7	40%	0.398	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-29	-176.3	-59.1	178.9	0	0	0	113.4	E949 S963 R965 T974	E949-L951 PolarHBondContact O-N 2.86Å; L951-S963 PolarHBondContact N-O 3.45Å; L951-R965 HydrophobicContact CD1-CB 4.15Å; L951-R965 HydrophobicContact CD2-CB 4.11Å; L951-R965 HydrophobicContact CG-CB 4.26Å; L951-T974 HydrophobicContact CD1-CG2 3.92Å
952	G	88	Confident	76.3	Confident	18 Å²	18	71.7 Å²	71.7	19%	0.186	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170	165.7	-177.4	0	0	0	0	0	113.4	S963	G952-S963 PolarHBondContact O-N 3.43Å
953	C	84.3	Confident	78.9	Confident	38 Å²	38	65.2 Å²	65.2	26%	0.257	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	123.8	173.8	-167.8	0	0	0	0	108.9	L961	C953-L961 CarbonylContact C-O 3.14Å; C953-L961 WeakPolarHBondContact CA-O 3.4Å
954	D	80	Confident	81.4	Confident	42 Å²	42	59.4 Å²	59.4	23%	0.225	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	103.8	177.2	179.1	10.6	0	0	0	109.5	S956 R957 A960 L961	D954-S956 VanDerWaalsContact C-N 3.34Å; D954-S956 VanDerWaalsContact OD1-CB 3.24Å; D954-S956 WeakPolarHBondContact OD1-CB 3.45Å; D954-S956 PolarHBondContact OD1-N 3.25Å; D954-S956 PolarHBondContact OD1-OG 2.76Å; D954-R957 IonicContact OD2-CZ 3.88Å; D954-R957 IonicContact OD2-NE 2.68Å; D954-R957 PolarHBondContact OD2-NE 2.69Å; D954-R957 IonicContact OD2-NH2 3.86Å; D954-R957 PolarHBondContact OD2-NH2 2.59Å; D954-A960 WeakPolarHBondContact O-CA 3.33Å; D954-L961 HydrophobicContact CB-CB 4.33Å; D954-L961 PolarHBondContact N-O 2.91Å; D954-L961 PolarHBondContact O-N 3.08Å
955	E	71.3	Confident	82.9	Confident	111 Å²	111	55.3 Å²	55.3	52%	0.519	29%	0.286	S	S	.	.			trans	-85.5	-0.7	176.5	-63.2	178.7	150.3	0	0	113	R957 K1021	E955-R957 VanDerWaalsContact C-N 3.25Å; E955-R957 PolarHBondContact O-N 3.48Å; E955-K1021 VanDerWaalsContact CD-CE 3.48Å; E955-K1021 WeakPolarHBondContact OE1-CE 3.49Å; E955-K1021 IonicContact OE1-NZ 3.63Å; E955-K1021 PolarHBondContact OE1-NZ 3.48Å; E955-K1021 WeakPolarHBondContact OE2-CE 3.38Å; E955-K1021 IonicContact OE2-NZ 2.84Å; E955-K1021 PolarHBondContact OE2-NZ 3.22Å
956	S	58.4	Low	83.5	Confident	99 Å²	99	49.7 Å²	49.7	69%	0.692	26%	0.261	S	S	*	.	S	Bend	trans	-79.4	1	-170.5	72.5	0	0	0	0	115.3	D954	D954-S956 VanDerWaalsContact C-N 3.34Å; D954-S956 VanDerWaalsContact OD1-CB 3.24Å; D954-S956 WeakPolarHBondContact OD1-CB 3.45Å; D954-S956 PolarHBondContact OD1-N 3.25Å; D954-S956 PolarHBondContact OD1-OG 2.76Å
957	R	61.8	Low	83.7	Confident	143 Å²	143	51.2 Å²	51.2	54%	0.54	27%	0.269	S	S	.	.	S	Bend	trans	-123.9	163.6	-174.9	-48	-173.8	-155.3	-155.8	2.1	110.7	D954 E955 F959	D954-R957 IonicContact OD2-CZ 3.88Å; D954-R957 IonicContact OD2-NE 2.68Å; D954-R957 PolarHBondContact OD2-NE 2.69Å; D954-R957 IonicContact OD2-NH2 3.86Å; D954-R957 PolarHBondContact OD2-NH2 2.59Å; E955-R957 VanDerWaalsContact C-N 3.25Å; E955-R957 PolarHBondContact O-N 3.48Å; R957-F959 PolarHBondContact O-N 2.75Å
958	N	63.6	Low	83.5	Confident	160 Å²	160	51.4 Å²	51.4	86%	0.856	27%	0.271	S	S	*	.	S	Bend	trans	-57.1	-14.9	-178.1	-65.6	15	0	0	0	114.9
959	F	67.5	Low	82.8	Confident	139 Å²	139	55 Å²	55	61%	0.61	30%	0.296	S	S	*	.	S	Bend	trans	-133.4	135	168.6	-53.1	-81.2	0	0	0	108	R957 L961 A978	R957-F959 PolarHBondContact O-N 2.75Å; F959-L961 PolarHBondContact O-N 2.81Å; F959-A978 HydrophobicContact CB-CB 4.39Å
960	A	75	Confident	82.1	Confident	43 Å²	43	57.8 Å²	57.8	36%	0.355	31%	0.309	S	S	.	.			trans	-64.7	130.4	175	0	0	0	0	0	110.3	D954 P979	D954-A960 WeakPolarHBondContact O-CA 3.33Å; A960-P979 WeakPolarHBondContact O-CD 3.44Å
961	L	86.7	Confident	81.6	Confident	33 Å²	33	58.9 Å²	58.9	17%	0.173	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	121.6	-179.9	-71.4	173.2	0	0	0	111.2	C953 D954 F959 A978	C953-L961 CarbonylContact C-O 3.14Å; C953-L961 WeakPolarHBondContact CA-O 3.4Å; D954-L961 HydrophobicContact CB-CB 4.33Å; D954-L961 PolarHBondContact N-O 2.91Å; D954-L961 PolarHBondContact O-N 3.08Å; F959-L961 PolarHBondContact O-N 2.81Å; L961-A978 HydrophobicContact CD2-CB 4.16Å
962	V	90.6	Very high	81.5	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	125.3	178.7	176.5	0	0	0	0	109.4	Q976 F977 P979 V1012 I1016	V962-Q976 VanDerWaalsContact O-CA 3.25Å; V962-Q976 WeakPolarHBondContact O-CA 3.24Å; V962-F977 HydrophobicContact CB-CD1 4.32Å; V962-F977 HydrophobicContact CB-CE1 4Å; V962-F977 HydrophobicContact CB-CE2 4.49Å; V962-F977 HydrophobicContact CB-CZ 4.1Å; V962-F977 HydrophobicContact CG1-CD1 4.45Å; V962-F977 HydrophobicContact CG1-CE1 3.73Å; V962-F977 HydrophobicContact CG1-CZ 3.89Å; V962-F977 PolarHBondContact N-O 3.29Å; V962-F977 PolarHBondContact O-N 2.89Å; V962-P979 HydrophobicContact CG2-CG 3.8Å; V962-V1012 HydrophobicContact CG1-CG1 4.08Å; V962-I1016 HydrophobicContact CB-CD1 4.08Å; V962-I1016 HydrophobicContact CG1-CD1 3.37Å; V962-I1016 HydrophobicContact CG2-CD1 3.49Å; V962-I1016 VanDerWaalsContact CG2-CD1 3.49Å; V962-I1016 HydrophobicContact CG2-CG2 4.01Å
963	S	92.3	Very high	81.7	Confident	22 Å²	22	59.4 Å²	59.4	15%	0.154	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	127.4	173.9	-59.6	0	0	0	0	110.6	L951 G952 Q976	L951-S963 PolarHBondContact N-O 3.45Å; G952-S963 PolarHBondContact O-N 3.43Å; S963-Q976 WeakPolarHBondContact OG-CG 3.4Å; S963-Q976 PolarHBondContact OG-NE2 2.81Å
964	C	94.4	Very high	82.2	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	146.3	177	-75	0	0	0	0	111.9	M948 E949 T974 F975	M948-C964 HydrophobicContact CG-CB 4.24Å; M948-C964 HydrophobicContact SD-CB 4.15Å; E949-C964 CarbonylContact O-C 3.37Å; E949-C964 WeakPolarHBondContact O-CA 3.44Å; C964-T974 VanDerWaalsContact O-CA 3.29Å; C964-T974 WeakPolarHBondContact O-CA 3.4Å; C964-F975 HydrophobicContact CB-CE1 4.23Å; C964-F975 HydrophobicContact CB-CE2 4.22Å; C964-F975 HydrophobicContact CB-CZ 3.93Å; C964-F975 PolarHBondContact N-O 3.45Å; C964-F975 PolarHBondContact O-N 3.44Å
965	R	94.9	Very high	82.8	Confident	65 Å²	65	61.3 Å²	61.3	25%	0.245	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	132.7	161.7	-169.5	172.9	75	-107.6	-10.3	109.6	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 3.33Å; E949-R965 PolarHBondContact N-O 2.91Å; E949-R965 PolarHBondContact O-N 2.94Å; E949-R965 IonicContact OE1-CZ 3.82Å; E949-R965 IonicContact OE1-NH1 3.89Å; E949-R965 PolarHBondContact OE1-NH1 3.04Å; E949-R965 IonicContact OE1-NH2 3.24Å; E949-R965 PolarHBondContact OE1-NH2 3.47Å; E949-R965 IonicContact OE2-CZ 3.12Å; E949-R965 IonicContact OE2-NH2 2.84Å; E949-R965 PolarHBondContact OE2-NH2 3.44Å; L951-R965 HydrophobicContact CD1-CB 4.15Å; L951-R965 HydrophobicContact CD2-CB 4.11Å; L951-R965 HydrophobicContact CG-CB 4.26Å; R965-D967 IonicContact CZ-OD2 2.68Å; R965-D967 IonicContact NE-OD1 2.57Å; R965-D967 PolarHBondContact NE-OD1 3.15Å; R965-D967 IonicContact NE-OD2 2.66Å; R965-D967 PolarHBondContact NE-OD2 3.47Å; R965-D967 IonicContact NH2-OD2 3.71Å; R965-D967 PolarHBondContact NH2-OD2 3.33Å; R965-V973 CarbonylContact C-O 3.57Å; R965-V973 WeakPolarHBondContact CA-O 3.49Å; R965-T974 HydrophobicContact CB-CG2 3.97Å; R965-T974 HydrophobicContact CG-CG2 3.85Å
966	L	94.4	Very high	83.8	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	116.4	175.3	165.5	64.5	0	0	0	108.6	V946 V947 M948 T968 S972 V973 F975 L991 L997 V1005	V946-L966 HydrophobicContact CG1-CD1 3.95Å; V947-L966 CarbonylContact O-C 3.58Å; V947-L966 WeakPolarHBondContact O-CA 3.3Å; M948-L966 HydrophobicContact CB-CD1 4.5Å; L966-T968 HydrophobicContact CD1-CG2 4.21Å; L966-T968 HydrophobicContact CG-CG2 4.18Å; L966-S972 CarbonylContact O-C 3.6Å; L966-S972 WeakPolarHBondContact O-CA 3.45Å; L966-V973 HydrophobicContact CB-CG1 3.88Å; L966-V973 HydrophobicContact CD2-CG1 4.01Å; L966-V973 HydrophobicContact CG-CG1 4.18Å; L966-V973 PolarHBondContact N-O 2.82Å; L966-V973 PolarHBondContact O-N 2.71Å; L966-F975 HydrophobicContact CB-CE1 3.89Å; L966-F975 HydrophobicContact CD2-CE1 4.27Å; L966-L991 HydrophobicContact CD2-CD1 3.88Å; L966-L997 HydrophobicContact CD2-CD1 4.42Å; L966-L997 HydrophobicContact CD2-CD2 4.15Å; L966-L997 HydrophobicContact CD2-CG 4.33Å; L966-V1005 HydrophobicContact CD1-CG2 3.79Å; L966-V1005 HydrophobicContact CD2-CG1 4.16Å; L966-V1005 HydrophobicContact CD2-CG2 4.05Å
967	D	91.3	Very high	85.5	Confident	33 Å²	33	57.1 Å²	57.1	18%	0.176	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	117.2	-179.7	-63.7	-46.8	0	0	0	109.1	V947 R965 S972	V947-D967 HydrophobicContact CB-CB 4.32Å; V947-D967 PolarHBondContact N-O 3.11Å; V947-D967 PolarHBondContact O-N 2.87Å; R965-D967 IonicContact CZ-OD2 2.68Å; R965-D967 IonicContact NE-OD1 2.57Å; R965-D967 PolarHBondContact NE-OD1 3.15Å; R965-D967 IonicContact NE-OD2 2.66Å; R965-D967 PolarHBondContact NE-OD2 3.47Å; R965-D967 IonicContact NH2-OD2 3.71Å; R965-D967 PolarHBondContact NH2-OD2 3.33Å; D967-S972 WeakPolarHBondContact OD1-CB 3.28Å; D967-S972 PolarHBondContact OD1-OG 2.94Å
968	T	88	Confident	86.8	Confident	18 Å²	18	50.6 Å²	50.6	11%	0.11	28%	0.276	C	S	.	.			trans	-115.5	179.7	178.2	74.9	0	0	0	0	111.5	L966 H970 K971 L997	L966-T968 HydrophobicContact CD1-CG2 4.21Å; L966-T968 HydrophobicContact CG-CG2 4.18Å; T968-H970 PolarHBondContact O-N 2.92Å; T968-H970 VanDerWaalsContact O-N 3.15Å; T968-H970 PolarHBondContact OG1-CE1 2.94Å; T968-H970 PolarHBondContact OG1-N 3.24Å; T968-H970 PolarHBondContact OG1-ND1 2.93Å; T968-K971 PolarHBondContact N-O 2.86Å; T968-K971 PolarHBondContact OG1-N 3.2Å; T968-K971 PolarHBondContact OG1-O 2.96Å; T968-L997 HydrophobicContact CG2-CD2 3.94Å
969	S	79	Confident	87.9	Confident	77 Å²	77	44 Å²	44	54%	0.538	24%	0.241	S	C	.	.	S	Bend	trans	-65.5	-10.5	177.5	68.8	0	0	0	0	115.7
970	H	78.2	Confident	88.5	Confident	92 Å²	92	41 Å²	41	43%	0.426	25%	0.25	S	C	.	.	S	Bend	trans	-141.2	-19.2	-169.4	55.2	-75.6	0	0	0	114	T968 H1001	T968-H970 PolarHBondContact O-N 2.92Å; T968-H970 VanDerWaalsContact O-N 3.15Å; T968-H970 PolarHBondContact OG1-CE1 2.94Å; T968-H970 PolarHBondContact OG1-N 3.24Å; T968-H970 PolarHBondContact OG1-ND1 2.93Å; H970-H1001 AromaticContact CE1-CE1 3.83Å; H970-H1001 AromaticContact CE1-ND1 3.85Å
971	K	83.5	Confident	89	Confident	27 Å²	27	43.2 Å²	43.2	12%	0.117	26%	0.259	C	S	.	.			trans	-149.5	146.2	177.8	-160.3	-168.2	-160.6	159.1	0	111.2	T968 E994 D995 C996 H1588	T968-K971 PolarHBondContact N-O 2.86Å; T968-K971 PolarHBondContact OG1-N 3.2Å; T968-K971 PolarHBondContact OG1-O 2.96Å; K971-E994 PolarHBondContact NZ-O 2.79Å; K971-D995 VanDerWaalsContact CD-O 3.3Å; K971-D995 WeakPolarHBondContact CD-O 3.36Å; K971-D995 VanDerWaalsContact NZ-C 3.32Å; K971-D995 PolarHBondContact NZ-O 2.82Å; K971-C996 HydrophobicContact CD-CB 4.08Å; K971-C996 VanDerWaalsContact CE-SG 3.58Å; K971-C996 PolarHBondContact NZ-SG 2.69Å; K971-H1588 WeakPolarHBondContact CE-CD2 3.25Å; K971-H1588 WeakPolarHBondContact CE-NE2 3.23Å; K971-H1588 PolarHBondContact NZ-ND1 2.9Å
972	S	89.3	Confident	89.2	Confident	80 Å²	80	43.7 Å²	43.7	56%	0.559	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.5	133.3	161.5	-69	0	0	0	0	108.8	L966 D967	L966-S972 CarbonylContact O-C 3.6Å; L966-S972 WeakPolarHBondContact O-CA 3.45Å; D967-S972 WeakPolarHBondContact OD1-CB 3.28Å; D967-S972 PolarHBondContact OD1-OG 2.94Å
973	V	91.8	Very high	89.2	Confident	25 Å²	25	50.4 Å²	50.4	15%	0.152	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	142.2	178.3	61.8	0	0	0	0	110.4	R965 L966 F975 L991 C996	R965-V973 CarbonylContact C-O 3.57Å; R965-V973 WeakPolarHBondContact CA-O 3.49Å; L966-V973 HydrophobicContact CB-CG1 3.88Å; L966-V973 HydrophobicContact CD2-CG1 4.01Å; L966-V973 HydrophobicContact CG-CG1 4.18Å; L966-V973 PolarHBondContact N-O 2.82Å; L966-V973 PolarHBondContact O-N 2.71Å; V973-F975 HydrophobicContact CG1-CD1 4.31Å; V973-L991 HydrophobicContact CG1-CD2 4.19Å; V973-L991 HydrophobicContact CG2-CD2 4.35Å; V973-C996 HydrophobicContact CB-CB 4.39Å; V973-C996 HydrophobicContact CG1-CB 4.01Å
974	T	94	Very high	89.2	Confident	95 Å²	95	51 Å²	51	58%	0.583	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.3	125.6	169.1	51.1	0	0	0	0	109.3	L951 C964 R965	L951-T974 HydrophobicContact CD1-CG2 3.92Å; C964-T974 VanDerWaalsContact O-CA 3.29Å; C964-T974 WeakPolarHBondContact O-CA 3.4Å; R965-T974 HydrophobicContact CB-CG2 3.97Å; R965-T974 HydrophobicContact CG-CG2 3.85Å
975	F	93.6	Very high	89	Confident	26 Å²	26	53.6 Å²	53.6	11%	0.114	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	159.7	-179.1	62.3	-87.2	0	0	0	111.2	M948 C964 L966 V973 F977 I987 L991 L1009	M948-F975 HydrophobicContact SD-CE1 4.36Å; M948-F975 HydrophobicContact SD-CZ 3.85Å; C964-F975 HydrophobicContact CB-CE1 4.23Å; C964-F975 HydrophobicContact CB-CE2 4.22Å; C964-F975 HydrophobicContact CB-CZ 3.93Å; C964-F975 PolarHBondContact N-O 3.45Å; C964-F975 PolarHBondContact O-N 3.44Å; L966-F975 HydrophobicContact CB-CE1 3.89Å; L966-F975 HydrophobicContact CD2-CE1 4.27Å; V973-F975 HydrophobicContact CG1-CD1 4.31Å; F975-F977 AromaticContact CD2-CD1 3.99Å; F975-F977 HydrophobicContact CD2-CD1 3.99Å; F975-F977 AromaticContact CE2-CD1 3.67Å; F975-F977 HydrophobicContact CE2-CD1 3.67Å; F975-F977 AromaticContact CE2-CE1 3.99Å; F975-F977 HydrophobicContact CE2-CE1 3.99Å; F975-I987 HydrophobicContact CD2-CG2 4.09Å; F975-I987 HydrophobicContact CE2-CG2 3.71Å; F975-I987 HydrophobicContact CZ-CG2 4.31Å; F975-L991 HydrophobicContact CD1-CD1 4.14Å; F975-L991 HydrophobicContact CD1-CD2 4.27Å; F975-L991 HydrophobicContact CE1-CD1 3.86Å; F975-L991 HydrophobicContact CZ-CD1 4.13Å; F975-L1009 HydrophobicContact CE2-CD2 4.02Å; F975-L1009 HydrophobicContact CZ-CD2 4.01Å
976	Q	92.7	Very high	88.9	Confident	115 Å²	115	53.5 Å²	53.5	54%	0.537	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	145	173.6	-65.4	-171.5	-18.9	0	0	110.2	V962 S963	V962-Q976 VanDerWaalsContact O-CA 3.25Å; V962-Q976 WeakPolarHBondContact O-CA 3.24Å; S963-Q976 WeakPolarHBondContact OG-CG 3.4Å; S963-Q976 PolarHBondContact OG-NE2 2.81Å
977	F	93.3	Very high	88.7	Confident	6 Å²	6	54 Å²	54	3%	0.026	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	156.2	174.3	70.1	-82.3	0	0	0	110.8	V962 F975 P979 D982 I987 L1009 V1012 I1013	V962-F977 HydrophobicContact CB-CD1 4.32Å; V962-F977 HydrophobicContact CB-CE1 4Å; V962-F977 HydrophobicContact CB-CE2 4.49Å; V962-F977 HydrophobicContact CB-CZ 4.1Å; V962-F977 HydrophobicContact CG1-CD1 4.45Å; V962-F977 HydrophobicContact CG1-CE1 3.73Å; V962-F977 HydrophobicContact CG1-CZ 3.89Å; V962-F977 PolarHBondContact N-O 3.29Å; V962-F977 PolarHBondContact O-N 2.89Å; F975-F977 AromaticContact CD2-CD1 3.99Å; F975-F977 HydrophobicContact CD2-CD1 3.99Å; F975-F977 AromaticContact CE2-CD1 3.67Å; F975-F977 HydrophobicContact CE2-CD1 3.67Å; F975-F977 AromaticContact CE2-CE1 3.99Å; F975-F977 HydrophobicContact CE2-CE1 3.99Å; F977-P979 HydrophobicContact CE2-CB 4.14Å; F977-D982 HydrophobicContact CB-CB 4.01Å; F977-D982 HydrophobicContact CD2-CB 4.38Å; F977-I987 HydrophobicContact CB-CD1 3.78Å; F977-I987 HydrophobicContact CB-CG1 4.35Å; F977-I987 HydrophobicContact CD1-CD1 4.24Å; F977-I987 HydrophobicContact CD2-CD1 3.57Å; F977-I987 HydrophobicContact CE2-CD1 4.15Å; F977-I987 HydrophobicContact CG-CD1 3.61Å; F977-L1009 HydrophobicContact CE1-CD2 3.91Å; F977-L1009 HydrophobicContact CZ-CD2 3.95Å; F977-V1012 HydrophobicContact CE1-CG1 4.41Å; F977-V1012 HydrophobicContact CZ-CG1 3.83Å; F977-I1013 HydrophobicContact CE2-CD1 4.13Å; F977-I1013 HydrophobicContact CE2-CG1 3.76Å; F977-I1013 HydrophobicContact CZ-CG1 4.33Å
978	A	89.8	Confident	88.8	Confident	7 Å²	7	52.5 Å²	52.5	6%	0.058	31%	0.313	C	S	.	.			trans	-99.9	111.5	174.2	0	0	0	0	0	109.4	F959 L961 G980 T981 D982	F959-A978 HydrophobicContact CB-CB 4.39Å; L961-A978 HydrophobicContact CD2-CB 4.16Å; A978-G980 PolarHBondContact O-N 3.41Å; A978-T981 WeakPolarHBondContact CB-OG1 3.38Å; A978-T981 PolarHBondContact O-N 2.91Å; A978-T981 PolarHBondContact O-OG1 2.95Å; A978-D982 PolarHBondContact N-OD2 3.09Å; A978-D982 PolarHBondContact O-N 3.42Å
979	P	86.3	Confident	88.9	Confident	20 Å²	20	55.6 Å²	55.6	13%	0.13	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-12	-173	26.5	-36.1	0	0	0	114.2	A960 V962 F977 I1013	A960-P979 WeakPolarHBondContact O-CD 3.44Å; V962-P979 HydrophobicContact CG2-CG 3.8Å; F977-P979 HydrophobicContact CE2-CB 4.14Å; P979-I1013 HydrophobicContact CB-CG1 3.99Å; P979-I1013 HydrophobicContact CB-CG2 4.32Å
980	G	80.4	Confident	89.4	Confident	77 Å²	77	57.2 Å²	57.2	79%	0.794	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-12.1	172.1	0	0	0	0	0	115.4	A978	A978-G980 PolarHBondContact O-N 3.41Å
981	T	85.2	Confident	90.1	Very high	89 Å²	89	53.1 Å²	53.1	55%	0.546	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.4	-36.2	-176.5	54.8	0	0	0	0	113.9	A978	A978-T981 WeakPolarHBondContact CB-OG1 3.38Å; A978-T981 PolarHBondContact O-N 2.91Å; A978-T981 PolarHBondContact O-OG1 2.95Å
982	D	89.8	Confident	90.5	Very high	44 Å²	44	54.2 Å²	54.2	24%	0.235	32%	0.318	C	S	.	.			trans	-89.5	119.9	-178.2	-67.2	-64.5	0	0	0	111.5	F977 A978 I987	F977-D982 HydrophobicContact CB-CB 4.01Å; F977-D982 HydrophobicContact CD2-CB 4.38Å; A978-D982 PolarHBondContact N-OD2 3.09Å; A978-D982 PolarHBondContact O-N 3.42Å; D982-I987 HydrophobicContact CB-CD1 3.89Å; D982-I987 HydrophobicContact CB-CG1 4Å
983	K	90.6	Very high	90.5	Very high	140 Å²	140	52.9 Å²	52.9	61%	0.609	31%	0.312	S	S	*	.			trans	-82.1	143	177.2	-63	179.5	-178.9	177.9	0	111	C985 T986 I987	K983-C985 VanDerWaalsContact C-N 3.3Å; K983-C985 PolarHBondContact O-N 3.17Å; K983-T986 WeakPolarHBondContact O-CB 3.44Å; K983-T986 PolarHBondContact O-N 3.46Å; K983-I987 PolarHBondContact O-N 2.57Å; K983-I987 VanDerWaalsContact O-N 3.07Å
984	P	92	Very high	90.3	Very high	34 Å²	34	55.3 Å²	55.3	22%	0.221	32%	0.321	C	S	.	.	H	α-helix	trans	-47.5	-45.9	176.5	-34.2	38.4	0	0	0	114.9	T986 I987 A988 L1009 I1013	P984-T986 PolarHBondContact O-N 3.25Å; P984-I987 PolarHBondContact O-N 2.95Å; P984-A988 WeakPolarHBondContact O-CB 3.39Å; P984-A988 PolarHBondContact O-N 2.99Å; P984-L1009 HydrophobicContact CB-CB 3.8Å; P984-L1009 HydrophobicContact CB-CD1 4.41Å; P984-L1009 HydrophobicContact CG-CB 4.13Å; P984-I1013 HydrophobicContact CG-CD1 3.7Å
985	C	91.8	Very high	89.9	Confident	56 Å²	56	52.7 Å²	52.7	38%	0.378	30%	0.304	S	S	.	.	H	α-helix	trans	-65.1	-35.9	178.4	56.7	0	0	0	0	113.1	K983 T989 E1006	K983-C985 VanDerWaalsContact C-N 3.3Å; K983-C985 PolarHBondContact O-N 3.17Å; C985-T989 WeakPolarHBondContact O-CB 3.35Å; C985-T989 PolarHBondContact O-N 2.87Å; C985-T989 PolarHBondContact O-OG1 3.3Å; C985-E1006 VanDerWaalsContact CA-OE1 3.24Å; C985-E1006 WeakPolarHBondContact CA-OE1 3.47Å; C985-E1006 WeakPolarHBondContact CB-OE1 3.32Å
986	T	91.3	Very high	89.5	Confident	63 Å²	63	51.6 Å²	51.6	39%	0.387	30%	0.299	S	S	.	.	H	α-helix	trans	-67.4	-41.8	175.7	-52.7	0	0	0	0	111.1	K983 P984 K990	K983-T986 WeakPolarHBondContact O-CB 3.44Å; K983-T986 PolarHBondContact O-N 3.46Å; P984-T986 PolarHBondContact O-N 3.25Å; T986-K990 WeakPolarHBondContact O-CG 3.47Å; T986-K990 PolarHBondContact O-N 2.81Å
987	I	91.8	Very high	89.3	Confident	11 Å²	11	46.3 Å²	46.3	6%	0.056	28%	0.275	C	S	.	.	H	α-helix	trans	-66	-49.6	176.2	-58.3	162.1	0	0	0	110.1	F975 F977 D982 K983 P984 T989 K990 L991 L1009	F975-I987 HydrophobicContact CD2-CG2 4.09Å; F975-I987 HydrophobicContact CE2-CG2 3.71Å; F975-I987 HydrophobicContact CZ-CG2 4.31Å; F977-I987 HydrophobicContact CB-CD1 3.78Å; F977-I987 HydrophobicContact CB-CG1 4.35Å; F977-I987 HydrophobicContact CD1-CD1 4.24Å; F977-I987 HydrophobicContact CD2-CD1 3.57Å; F977-I987 HydrophobicContact CE2-CD1 4.15Å; F977-I987 HydrophobicContact CG-CD1 3.61Å; D982-I987 HydrophobicContact CB-CD1 3.89Å; D982-I987 HydrophobicContact CB-CG1 4Å; K983-I987 PolarHBondContact O-N 2.57Å; K983-I987 VanDerWaalsContact O-N 3.07Å; P984-I987 PolarHBondContact O-N 2.95Å; I987-T989 VanDerWaalsContact C-N 3.3Å; I987-T989 PolarHBondContact O-N 2.95Å; I987-K990 PolarHBondContact O-N 2.94Å; I987-L991 HydrophobicContact CG2-CD1 3.93Å; I987-L991 HydrophobicContact CG2-CG 4.42Å; I987-L991 WeakPolarHBondContact O-CB 3.47Å; I987-L991 WeakPolarHBondContact O-CG 3.21Å; I987-L991 PolarHBondContact O-N 2.85Å; I987-L1009 HydrophobicContact CB-CD1 3.69Å; I987-L1009 HydrophobicContact CD1-CD1 4.12Å; I987-L1009 HydrophobicContact CD1-CD2 4.29Å; I987-L1009 HydrophobicContact CG2-CD1 3.66Å
988	A	92.7	Very high	89	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.7	-34.7	178.9	0	0	0	0	0	112.7	P984 L992 V1002 V1005 E1006	P984-A988 WeakPolarHBondContact O-CB 3.39Å; P984-A988 PolarHBondContact O-N 2.99Å; A988-L992 WeakPolarHBondContact O-CB 2.94Å; A988-L992 PolarHBondContact O-N 3.29Å; A988-V1002 HydrophobicContact CB-CG1 4.22Å; A988-V1005 HydrophobicContact CB-CG1 4.48Å; A988-E1006 HydrophobicContact CB-CG 3.57Å
989	T	89.8	Confident	88.8	Confident	83 Å²	83	58 Å²	58	51%	0.509	33%	0.327	S	S	.	.	H	α-helix	trans	-69.7	-42.2	174.4	-58.6	0	0	0	0	112	C985 I987 L992 A993	C985-T989 WeakPolarHBondContact O-CB 3.35Å; C985-T989 PolarHBondContact O-N 2.87Å; C985-T989 PolarHBondContact O-OG1 3.3Å; I987-T989 VanDerWaalsContact C-N 3.3Å; I987-T989 PolarHBondContact O-N 2.95Å; T989-L992 PolarHBondContact O-N 3.41Å; T989-A993 PolarHBondContact O-N 3.37Å
990	K	89.8	Confident	88.8	Confident	112 Å²	112	61.1 Å²	61.1	49%	0.487	35%	0.346	S	S	.	.	H	α-helix	trans	-58.7	-50.1	171.7	-76.6	176.5	177.5	178.5	0	110.7	T986 I987 L992 A993 E994	T986-K990 WeakPolarHBondContact O-CG 3.47Å; T986-K990 PolarHBondContact O-N 2.81Å; I987-K990 PolarHBondContact O-N 2.94Å; K990-L992 PolarHBondContact O-N 3.12Å; K990-A993 PolarHBondContact O-N 2.8Å; K990-A993 VanDerWaalsContact O-N 3.08Å; K990-E994 WeakPolarHBondContact O-CB 3.33Å; K990-E994 WeakPolarHBondContact O-CG 3.26Å; K990-E994 PolarHBondContact O-N 2.97Å
991	L	92.4	Very high	89.2	Confident	5 Å²	5	57.5 Å²	57.5	3%	0.026	31%	0.309	C	S	.	.	H	α-helix	trans	-62.3	-26.4	177.4	-68.5	173.2	0	0	0	113.5	L966 V973 F975 I987 C996 L997	L966-L991 HydrophobicContact CD2-CD1 3.88Å; V973-L991 HydrophobicContact CG1-CD2 4.19Å; V973-L991 HydrophobicContact CG2-CD2 4.35Å; F975-L991 HydrophobicContact CD1-CD1 4.14Å; F975-L991 HydrophobicContact CD1-CD2 4.27Å; F975-L991 HydrophobicContact CE1-CD1 3.86Å; F975-L991 HydrophobicContact CZ-CD1 4.13Å; I987-L991 HydrophobicContact CG2-CD1 3.93Å; I987-L991 HydrophobicContact CG2-CG 4.42Å; I987-L991 WeakPolarHBondContact O-CB 3.47Å; I987-L991 WeakPolarHBondContact O-CG 3.21Å; I987-L991 PolarHBondContact O-N 2.85Å; L991-C996 HydrophobicContact CB-CB 4.02Å; L991-C996 HydrophobicContact CD2-CB 3.81Å; L991-C996 WeakPolarHBondContact O-CA 3.35Å; L991-C996 VanDerWaalsContact O-CB 3.24Å; L991-C996 WeakPolarHBondContact O-CB 3.41Å; L991-C996 PolarHBondContact O-N 2.84Å; L991-L997 HydrophobicContact CB-CD1 3.75Å; L991-L997 HydrophobicContact CB-CG 4.29Å; L991-L997 HydrophobicContact CD1-CD1 4.39Å; L991-L997 PolarHBondContact O-N 2.84Å
992	L	91.6	Very high	89.4	Confident	50 Å²	50	54.1 Å²	54.1	26%	0.262	29%	0.288	S	S	.	.	H	α-helix	trans	-74.9	-41.6	171.4	178.1	66.2	0	0	0	112.3	A988 T989 K990 E994 D995 L997 K999 V1002	A988-L992 WeakPolarHBondContact O-CB 2.94Å; A988-L992 PolarHBondContact O-N 3.29Å; T989-L992 PolarHBondContact O-N 3.41Å; K990-L992 PolarHBondContact O-N 3.12Å; L992-E994 VanDerWaalsContact C-N 3.3Å; L992-D995 PolarHBondContact O-N 3.38Å; L992-L997 WeakPolarHBondContact CD1-O 3.38Å; L992-K999 HydrophobicContact CD1-CG 3.91Å; L992-K999 HydrophobicContact CD2-CG 4.33Å; L992-V1002 HydrophobicContact CB-CG2 4.45Å; L992-V1002 HydrophobicContact CD1-CG2 4.31Å; L992-V1002 HydrophobicContact CD2-CG2 3.98Å; L992-V1002 HydrophobicContact CG-CG2 4.48Å
993	A	88.7	Confident	89.3	Confident	53 Å²	53	59 Å²	59	44%	0.438	31%	0.309	S	S	.	.	H	α-helix	trans	-65.5	-36.2	174	0	0	0	0	0	111.5	T989 K990 D995 R1590	T989-A993 PolarHBondContact O-N 3.37Å; K990-A993 PolarHBondContact O-N 2.8Å; K990-A993 VanDerWaalsContact O-N 3.08Å; A993-D995 PolarHBondContact O-N 2.96Å; A993-R1590 WeakPolarHBondContact O-CB 3.34Å
994	E	88.3	Confident	89.2	Confident	76 Å²	76	52.8 Å²	52.8	36%	0.355	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	17.5	178.7	-70.4	176.2	-158	0	0	114.4	K971 K990 L992 C996 I1589	K971-E994 PolarHBondContact NZ-O 2.79Å; K990-E994 WeakPolarHBondContact O-CB 3.33Å; K990-E994 WeakPolarHBondContact O-CG 3.26Å; K990-E994 PolarHBondContact O-N 2.97Å; L992-E994 VanDerWaalsContact C-N 3.3Å; E994-C996 PolarHBondContact O-N 3.02Å; E994-C996 PolarHBondContact O-SG 2.85Å; E994-C996 VanDerWaalsContact O-SG 3.36Å; E994-I1589 HydrophobicContact CB-CD1 3.73Å; E994-I1589 HydrophobicContact CB-CG1 3.89Å; E994-I1589 HydrophobicContact CB-CG2 4.46Å; E994-I1589 HydrophobicContact CG-CD1 3.99Å; E994-I1589 HydrophobicContact CG-CG1 4.34Å; E994-I1589 HydrophobicContact CG-CG2 4.23Å; E994-I1589 WeakPolarHBondContact O-CG1 3.23Å
995	D	86.5	Confident	89.2	Confident	40 Å²	40	51.2 Å²	51.2	21%	0.214	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	47	34.8	-179.2	-77.7	-25.7	0	0	0	113.5	K971 L992 A993 R1590	K971-D995 VanDerWaalsContact CD-O 3.3Å; K971-D995 WeakPolarHBondContact CD-O 3.36Å; K971-D995 VanDerWaalsContact NZ-C 3.32Å; K971-D995 PolarHBondContact NZ-O 2.82Å; L992-D995 PolarHBondContact O-N 3.38Å; A993-D995 PolarHBondContact O-N 2.96Å; D995-R1590 WeakPolarHBondContact OD1-CD 3.41Å; D995-R1590 IonicContact OD1-CZ 3.44Å; D995-R1590 VanDerWaalsContact OD1-CZ 3.31Å; D995-R1590 IonicContact OD1-NE 3.88Å; D995-R1590 IonicContact OD1-NH1 3.64Å; D995-R1590 PolarHBondContact OD1-NH1 3.43Å; D995-R1590 WeakPolarHBondContact OD2-CB 3.49Å; D995-R1590 VanDerWaalsContact OD2-CD 3.22Å; D995-R1590 WeakPolarHBondContact OD2-CD 3.3Å; D995-R1590 WeakPolarHBondContact OD2-CG 3.42Å; D995-R1590 IonicContact OD2-CZ 2.92Å; D995-R1590 IonicContact OD2-NE 2.72Å; D995-R1590 PolarHBondContact OD2-NE 3.16Å; D995-R1590 IonicContact OD2-NH1 3.42Å
996	C	84.9	Confident	89.3	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.014	26%	0.264	C	S	.	.	S	Bend	trans	-94.6	-15.3	173.3	-64.4	0	0	0	0	112.3	K971 V973 L991 E994	K971-C996 HydrophobicContact CD-CB 4.08Å; K971-C996 VanDerWaalsContact CE-SG 3.58Å; K971-C996 PolarHBondContact NZ-SG 2.69Å; V973-C996 HydrophobicContact CB-CB 4.39Å; V973-C996 HydrophobicContact CG1-CB 4.01Å; L991-C996 HydrophobicContact CB-CB 4.02Å; L991-C996 HydrophobicContact CD2-CB 3.81Å; L991-C996 WeakPolarHBondContact O-CA 3.35Å; L991-C996 VanDerWaalsContact O-CB 3.24Å; L991-C996 WeakPolarHBondContact O-CB 3.41Å; L991-C996 PolarHBondContact O-N 2.84Å; E994-C996 PolarHBondContact O-N 3.02Å; E994-C996 PolarHBondContact O-SG 2.85Å; E994-C996 VanDerWaalsContact O-SG 3.36Å
997	L	88.1	Confident	89.2	Confident	5 Å²	5	50 Å²	50	3%	0.026	26%	0.264	C	S	.	.	S	Bend	trans	-137.6	147.5	179.8	-73	166.8	0	0	0	111.4	L966 T968 L991 L992 H1001 V1005	L966-L997 HydrophobicContact CD2-CD1 4.42Å; L966-L997 HydrophobicContact CD2-CD2 4.15Å; L966-L997 HydrophobicContact CD2-CG 4.33Å; T968-L997 HydrophobicContact CG2-CD2 3.94Å; L991-L997 HydrophobicContact CB-CD1 3.75Å; L991-L997 HydrophobicContact CB-CG 4.29Å; L991-L997 HydrophobicContact CD1-CD1 4.39Å; L991-L997 PolarHBondContact O-N 2.84Å; L992-L997 WeakPolarHBondContact CD1-O 3.38Å; L997-H1001 HydrophobicContact CD2-CB 3.5Å; L997-V1005 HydrophobicContact CD1-CB 3.99Å; L997-V1005 HydrophobicContact CD1-CG1 4.13Å; L997-V1005 HydrophobicContact CD1-CG2 3.9Å; L997-V1005 HydrophobicContact CD2-CG2 3.59Å; L997-V1005 HydrophobicContact CG-CG2 4.39Å
998	L	87.4	Confident	89.3	Confident	80 Å²	80	49.5 Å²	49.5	42%	0.419	26%	0.262	S	S	.	.			trans	-82.9	152.2	159.9	-68.8	167.8	0	0	0	108.8	V1000 H1001	L998-V1000 HydrophobicContact CB-CG1 4.07Å; L998-V1000 PolarHBondContact O-N 3.31Å; L998-H1001 PolarHBondContact O-N 3.49Å
999	K	85.5	Confident	89.3	Confident	177 Å²	177	49.5 Å²	49.5	77%	0.77	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-50.3	-34.9	178.3	-67.6	-177.4	177.7	-179.9	0	113.4	L992 H1001 V1002	L992-K999 HydrophobicContact CD1-CG 3.91Å; L992-K999 HydrophobicContact CD2-CG 4.33Å; K999-H1001 VanDerWaalsContact C-N 3.27Å; K999-H1001 PolarHBondContact O-N 2.83Å; K999-V1002 WeakPolarHBondContact O-CG2 3.32Å; K999-V1002 PolarHBondContact O-N 2.82Å
1000	V	85.9	Confident	89.4	Confident	86 Å²	86	46.9 Å²	46.9	52%	0.521	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-69.6	-15	177.9	69.4	0	0	0	0	114.6	L998	L998-V1000 HydrophobicContact CB-CG1 4.07Å; L998-V1000 PolarHBondContact O-N 3.31Å
1001	H	88.2	Confident	89.4	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.009	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-95.7	-9.9	178.6	-59.5	162.4	0	0	0	113.7	H970 L997 L998 K999 I1004 V1005	H970-H1001 AromaticContact CE1-CE1 3.83Å; H970-H1001 AromaticContact CE1-ND1 3.85Å; L997-H1001 HydrophobicContact CD2-CB 3.5Å; L998-H1001 PolarHBondContact O-N 3.49Å; K999-H1001 VanDerWaalsContact C-N 3.27Å; K999-H1001 PolarHBondContact O-N 2.83Å; H1001-I1004 PolarHBondContact O-N 3.49Å; H1001-V1005 PolarHBondContact O-N 3.17Å
1002	V	89.3	Confident	89.2	Confident	18 Å²	18	45.6 Å²	45.6	11%	0.109	25%	0.247	C	C	.	.	H	α-helix	trans	-56.4	-58.9	-170.9	176	0	0	0	0	111.4	A988 L992 K999 I1004 V1005 E1006	A988-V1002 HydrophobicContact CB-CG1 4.22Å; L992-V1002 HydrophobicContact CB-CG2 4.45Å; L992-V1002 HydrophobicContact CD1-CG2 4.31Å; L992-V1002 HydrophobicContact CD2-CG2 3.98Å; L992-V1002 HydrophobicContact CG-CG2 4.48Å; K999-V1002 WeakPolarHBondContact O-CG2 3.32Å; K999-V1002 PolarHBondContact O-N 2.82Å; V1002-I1004 PolarHBondContact O-N 2.96Å; V1002-I1004 VanDerWaalsContact O-N 3.16Å; V1002-V1005 PolarHBondContact O-N 3.11Å; V1002-E1006 HydrophobicContact CG1-CG 4.27Å; V1002-E1006 WeakPolarHBondContact O-CG 3.45Å; V1002-E1006 PolarHBondContact O-N 3.1Å
1003	H	87.7	Confident	89.1	Confident	147 Å²	147	44.4 Å²	44.4	68%	0.681	24%	0.241	S	C	*	.	H	α-helix	trans	-61.8	-26.1	-179.1	-60.5	-39.6	0	0	0	114.1	E1006 A1007	H1003-E1006 WeakPolarHBondContact CA-OE2 2.91Å; H1003-E1006 IonicContact CE1-OE2 3.14Å; H1003-E1006 IonicContact CG-OE2 2.78Å; H1003-E1006 IonicContact ND1-OE2 2.66Å; H1003-E1006 PolarHBondContact ND1-OE2 2.61Å; H1003-A1007 WeakPolarHBondContact O-CB 3.23Å; H1003-A1007 PolarHBondContact O-N 2.82Å; H1003-A1007 VanDerWaalsContact O-N 3.09Å
1004	I	90.1	Very high	88.9	Confident	9 Å²	9	48 Å²	48	5%	0.046	25%	0.249	C	C	.	.	H	α-helix	trans	-71.1	-43.8	174.6	-67.3	171.9	0	0	0	110.2	V946 H1001 V1002 A1007 Q1008 T1030 L1032 P1040	V946-I1004 HydrophobicContact CB-CG2 4.09Å; V946-I1004 HydrophobicContact CG1-CG2 4.1Å; H1001-I1004 PolarHBondContact O-N 3.49Å; V1002-I1004 PolarHBondContact O-N 2.96Å; V1002-I1004 VanDerWaalsContact O-N 3.16Å; I1004-A1007 PolarHBondContact O-N 3.13Å; I1004-Q1008 WeakPolarHBondContact O-CB 3.24Å; I1004-Q1008 VanDerWaalsContact O-CG 3.3Å; I1004-Q1008 WeakPolarHBondContact O-CG 3.41Å; I1004-Q1008 PolarHBondContact O-N 3.34Å; I1004-T1030 HydrophobicContact CD1-CG2 4.03Å; I1004-T1030 HydrophobicContact CG1-CG2 4.21Å; I1004-T1030 HydrophobicContact CG2-CG2 3.84Å; I1004-L1032 HydrophobicContact CD1-CD1 3.82Å; I1004-L1032 HydrophobicContact CD1-CD2 3.7Å; I1004-L1032 HydrophobicContact CD1-CG 3.74Å; I1004-P1040 HydrophobicContact CG1-CB 4.37Å; I1004-P1040 HydrophobicContact CG1-CG 4.24Å
1005	V	92.3	Very high	88.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-72.6	-35	177.3	176.2	0	0	0	0	111.6	V946 L966 A988 L997 H1001 V1002 Q1008 L1009	V946-V1005 HydrophobicContact CG1-CG2 4.2Å; L966-V1005 HydrophobicContact CD1-CG2 3.79Å; L966-V1005 HydrophobicContact CD2-CG1 4.16Å; L966-V1005 HydrophobicContact CD2-CG2 4.05Å; A988-V1005 HydrophobicContact CB-CG1 4.48Å; L997-V1005 HydrophobicContact CD1-CB 3.99Å; L997-V1005 HydrophobicContact CD1-CG1 4.13Å; L997-V1005 HydrophobicContact CD1-CG2 3.9Å; L997-V1005 HydrophobicContact CD2-CG2 3.59Å; L997-V1005 HydrophobicContact CG-CG2 4.39Å; H1001-V1005 PolarHBondContact O-N 3.17Å; V1002-V1005 PolarHBondContact O-N 3.11Å; V1005-Q1008 PolarHBondContact O-N 2.9Å; V1005-L1009 HydrophobicContact CG1-CD1 3.88Å; V1005-L1009 HydrophobicContact CG1-CG 4.14Å; V1005-L1009 VanDerWaalsContact O-CB 3.23Å; V1005-L1009 WeakPolarHBondContact O-CB 3.47Å; V1005-L1009 VanDerWaalsContact O-CG 3.25Å; V1005-L1009 WeakPolarHBondContact O-CG 3.33Å; V1005-L1009 PolarHBondContact O-N 3.03Å
1006	E	92.6	Very high	88.6	Confident	47 Å²	47	45.2 Å²	45.2	22%	0.22	24%	0.236	C	C	.	.	H	α-helix	trans	-58.6	-47	171.4	-70.1	179.3	128.8	0	0	111.8	C985 A988 V1002 H1003 L1009 G1010	C985-E1006 VanDerWaalsContact CA-OE1 3.24Å; C985-E1006 WeakPolarHBondContact CA-OE1 3.47Å; C985-E1006 WeakPolarHBondContact CB-OE1 3.32Å; A988-E1006 HydrophobicContact CB-CG 3.57Å; V1002-E1006 HydrophobicContact CG1-CG 4.27Å; V1002-E1006 WeakPolarHBondContact O-CG 3.45Å; V1002-E1006 PolarHBondContact O-N 3.1Å; H1003-E1006 WeakPolarHBondContact CA-OE2 2.91Å; H1003-E1006 IonicContact CE1-OE2 3.14Å; H1003-E1006 IonicContact CG-OE2 2.78Å; H1003-E1006 IonicContact ND1-OE2 2.66Å; H1003-E1006 PolarHBondContact ND1-OE2 2.61Å; E1006-L1009 PolarHBondContact O-N 2.66Å; E1006-G1010 PolarHBondContact O-N 3.08Å
1007	A	90.7	Very high	88.4	Confident	47 Å²	47	50.4 Å²	50.4	39%	0.388	26%	0.263	S	S	.	.	H	α-helix	trans	-67.9	-43.7	178.5	0	0	0	0	0	112.4	H1003 I1004 L1009 G1010 E1011 I1042	H1003-A1007 WeakPolarHBondContact O-CB 3.23Å; H1003-A1007 PolarHBondContact O-N 2.82Å; H1003-A1007 VanDerWaalsContact O-N 3.09Å; I1004-A1007 PolarHBondContact O-N 3.13Å; A1007-L1009 VanDerWaalsContact C-N 3.32Å; A1007-L1009 PolarHBondContact O-N 3.39Å; A1007-G1010 PolarHBondContact O-N 2.98Å; A1007-E1011 PolarHBondContact O-N 3.09Å; A1007-E1011 VanDerWaalsContact O-N 3.09Å; A1007-I1042 HydrophobicContact CB-CD1 3.84Å
1008	Q	92.3	Very high	87.9	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.7	-33.6	174.6	-70.6	-179.2	2.1	0	0	112.3	V946 M948 I1004 V1005 E1011 V1012 L1028 T1030 I1042	V946-Q1008 PolarHBondContact O-NE2 3.44Å; M948-Q1008 VanDerWaalsContact CE-C 3.47Å; M948-Q1008 HydrophobicContact CE-CB 3.39Å; I1004-Q1008 WeakPolarHBondContact O-CB 3.24Å; I1004-Q1008 VanDerWaalsContact O-CG 3.3Å; I1004-Q1008 WeakPolarHBondContact O-CG 3.41Å; I1004-Q1008 PolarHBondContact O-N 3.34Å; V1005-Q1008 PolarHBondContact O-N 2.9Å; Q1008-E1011 WeakPolarHBondContact O-CB 3.48Å; Q1008-E1011 PolarHBondContact O-N 3.04Å; Q1008-V1012 WeakPolarHBondContact O-CG2 3.01Å; Q1008-V1012 PolarHBondContact O-N 2.79Å; Q1008-L1028 HydrophobicContact CB-CD1 3.89Å; Q1008-L1028 HydrophobicContact CG-CB 4.15Å; Q1008-L1028 HydrophobicContact CG-CD1 4.28Å; Q1008-L1028 VanDerWaalsContact O-CD1 3.23Å; Q1008-L1028 WeakPolarHBondContact O-CD1 3.39Å; Q1008-T1030 PolarHBondContact NE2-OG1 2.81Å; Q1008-I1042 HydrophobicContact CG-CD1 4.02Å; Q1008-I1042 HydrophobicContact CG-CG1 4.35Å; Q1008-I1042 HydrophobicContact CG-CG2 4.35Å
1009	L	93.7	Very high	87	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-69.1	-35.4	173	-80.4	171.5	0	0	0	111.9	M948 F975 F977 P984 I987 V1005 E1006 A1007 V1012 I1013	M948-L1009 HydrophobicContact CE-CD2 4Å; M948-L1009 HydrophobicContact CE-CG 3.93Å; M948-L1009 HydrophobicContact SD-CD2 4.08Å; M948-L1009 HydrophobicContact SD-CG 4.47Å; F975-L1009 HydrophobicContact CE2-CD2 4.02Å; F975-L1009 HydrophobicContact CZ-CD2 4.01Å; F977-L1009 HydrophobicContact CE1-CD2 3.91Å; F977-L1009 HydrophobicContact CZ-CD2 3.95Å; P984-L1009 HydrophobicContact CB-CB 3.8Å; P984-L1009 HydrophobicContact CB-CD1 4.41Å; P984-L1009 HydrophobicContact CG-CB 4.13Å; I987-L1009 HydrophobicContact CB-CD1 3.69Å; I987-L1009 HydrophobicContact CD1-CD1 4.12Å; I987-L1009 HydrophobicContact CD1-CD2 4.29Å; I987-L1009 HydrophobicContact CG2-CD1 3.66Å; V1005-L1009 HydrophobicContact CG1-CD1 3.88Å; V1005-L1009 HydrophobicContact CG1-CG 4.14Å; V1005-L1009 VanDerWaalsContact O-CB 3.23Å; V1005-L1009 WeakPolarHBondContact O-CB 3.47Å; V1005-L1009 VanDerWaalsContact O-CG 3.25Å; V1005-L1009 WeakPolarHBondContact O-CG 3.33Å; V1005-L1009 PolarHBondContact O-N 3.03Å; E1006-L1009 PolarHBondContact O-N 2.66Å; A1007-L1009 VanDerWaalsContact C-N 3.32Å; A1007-L1009 PolarHBondContact O-N 3.39Å; L1009-V1012 PolarHBondContact O-N 2.88Å; L1009-I1013 WeakPolarHBondContact O-CG1 3.4Å; L1009-I1013 PolarHBondContact O-N 3.29Å
1010	G	91.4	Very high	86	Confident	29 Å²	29	46 Å²	46	30%	0.299	26%	0.261	S	S	.	.	H	α-helix	trans	-57.9	-48.9	171	0	0	0	0	0	112.1	E1006 A1007 I1013 Q1014	E1006-G1010 PolarHBondContact O-N 3.08Å; A1007-G1010 PolarHBondContact O-N 2.98Å; G1010-I1013 PolarHBondContact O-N 3.49Å; G1010-Q1014 WeakPolarHBondContact O-CB 3.44Å; G1010-Q1014 PolarHBondContact O-N 2.88Å
1011	E	89.3	Confident	84.8	Confident	87 Å²	87	48.9 Å²	48.9	41%	0.407	27%	0.266	S	S	.	.	H	α-helix	trans	-56.8	-46.7	172.7	-76.8	-79.2	163.4	0	0	112.2	A1007 Q1008 I1013 Q1014 L1015 L1028 I1042	A1007-E1011 PolarHBondContact O-N 3.09Å; A1007-E1011 VanDerWaalsContact O-N 3.09Å; Q1008-E1011 WeakPolarHBondContact O-CB 3.48Å; Q1008-E1011 PolarHBondContact O-N 3.04Å; E1011-I1013 PolarHBondContact O-N 2.81Å; E1011-Q1014 PolarHBondContact O-N 3.08Å; E1011-L1015 VanDerWaalsContact O-CB 3.29Å; E1011-L1015 WeakPolarHBondContact O-CB 3.33Å; E1011-L1015 PolarHBondContact O-N 2.96Å; E1011-L1028 HydrophobicContact CB-CD1 3.63Å; E1011-I1042 HydrophobicContact CG-CD1 4.15Å
1012	V	89.7	Confident	83.6	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.012	30%	0.297	C	S	.	.	H	α-helix	trans	-60.4	-45.4	177.3	172.9	0	0	0	0	111.7	M948 I950 V962 F977 Q1008 L1009 L1015 I1016 L1028	M948-V1012 HydrophobicContact CE-CG2 4.06Å; I950-V1012 HydrophobicContact CD1-CB 4.4Å; I950-V1012 HydrophobicContact CD1-CG1 3.91Å; I950-V1012 HydrophobicContact CD1-CG2 4.06Å; I950-V1012 HydrophobicContact CG1-CG1 4.04Å; I950-V1012 HydrophobicContact CG1-CG2 4.03Å; V962-V1012 HydrophobicContact CG1-CG1 4.08Å; F977-V1012 HydrophobicContact CE1-CG1 4.41Å; F977-V1012 HydrophobicContact CZ-CG1 3.83Å; Q1008-V1012 WeakPolarHBondContact O-CG2 3.01Å; Q1008-V1012 PolarHBondContact O-N 2.79Å; L1009-V1012 PolarHBondContact O-N 2.88Å; V1012-L1015 PolarHBondContact O-N 2.89Å; V1012-I1016 HydrophobicContact CG1-CD1 3.76Å; V1012-I1016 WeakPolarHBondContact O-CB 3.49Å; V1012-I1016 WeakPolarHBondContact O-CG1 3.28Å; V1012-I1016 PolarHBondContact O-N 2.98Å; V1012-L1028 HydrophobicContact CG2-CD1 3.89Å
1013	I	88.7	Confident	82.7	Confident	25 Å²	25	55 Å²	55	13%	0.128	29%	0.292	C	S	.	.	H	α-helix	trans	-63.3	-44.9	177.7	-70.3	176	0	0	0	110.6	F977 P979 P984 L1009 G1010 E1011 L1015 I1016 N1017	F977-I1013 HydrophobicContact CE2-CD1 4.13Å; F977-I1013 HydrophobicContact CE2-CG1 3.76Å; F977-I1013 HydrophobicContact CZ-CG1 4.33Å; P979-I1013 HydrophobicContact CB-CG1 3.99Å; P979-I1013 HydrophobicContact CB-CG2 4.32Å; P984-I1013 HydrophobicContact CG-CD1 3.7Å; L1009-I1013 WeakPolarHBondContact O-CG1 3.4Å; L1009-I1013 PolarHBondContact O-N 3.29Å; G1010-I1013 PolarHBondContact O-N 3.49Å; E1011-I1013 PolarHBondContact O-N 2.81Å; I1013-L1015 PolarHBondContact O-N 3.43Å; I1013-I1016 PolarHBondContact O-N 2.86Å; I1013-N1017 WeakPolarHBondContact CG2-ND2 3.32Å; I1013-N1017 VanDerWaalsContact O-CB 3.23Å; I1013-N1017 WeakPolarHBondContact O-CB 3.11Å; I1013-N1017 PolarHBondContact O-N 3.1Å; I1013-N1017 PolarHBondContact O-ND2 2.83Å
1014	Q	85.4	Confident	82.3	Confident	129 Å²	129	51 Å²	51	60%	0.603	28%	0.278	S	S	*	.	H	α-helix	trans	-63.5	-41.1	178.9	-176	169.4	-8.8	0	0	111.9	G1010 E1011 S1018	G1010-Q1014 WeakPolarHBondContact O-CB 3.44Å; G1010-Q1014 PolarHBondContact O-N 2.88Å; E1011-Q1014 PolarHBondContact O-N 3.08Å; Q1014-S1018 WeakPolarHBondContact O-CB 3.14Å; Q1014-S1018 PolarHBondContact O-N 3.44Å; Q1014-S1018 VanDerWaalsContact O-N 3.11Å; Q1014-S1018 PolarHBondContact O-OG 3.39Å
1015	L	85.8	Confident	81.9	Confident	42 Å²	42	52 Å²	52	22%	0.22	29%	0.29	C	S	.	.	H	α-helix	trans	-64.8	-45.4	178.9	-173	63.6	0	0	0	111.8	I950 E1011 V1012 I1013 S1018 D1019 T1026 M1046	I950-L1015 HydrophobicContact CD1-CD2 3.94Å; E1011-L1015 VanDerWaalsContact O-CB 3.29Å; E1011-L1015 WeakPolarHBondContact O-CB 3.33Å; E1011-L1015 PolarHBondContact O-N 2.96Å; V1012-L1015 PolarHBondContact O-N 2.89Å; I1013-L1015 PolarHBondContact O-N 3.43Å; L1015-S1018 WeakPolarHBondContact O-CB 3.12Å; L1015-S1018 PolarHBondContact O-N 3.49Å; L1015-D1019 PolarHBondContact O-N 3.36Å; L1015-T1026 HydrophobicContact CD2-CG2 3.89Å; L1015-M1046 HydrophobicContact CD1-CE 3.67Å; L1015-M1046 HydrophobicContact CD2-CE 4.28Å
1016	I	82.4	Confident	81.6	Confident	15 Å²	15	52 Å²	52	8%	0.077	29%	0.291	C	S	.	.	H	α-helix	trans	-76.1	-33.4	-177	-66.2	175.2	0	0	0	111.9	I950 V962 V1012 I1013 S1018 D1019 G1020	I950-I1016 HydrophobicContact CD1-CD1 4.22Å; I950-I1016 HydrophobicContact CD1-CG1 4.48Å; I950-I1016 HydrophobicContact CG2-CD1 4.23Å; V962-I1016 HydrophobicContact CB-CD1 4.08Å; V962-I1016 HydrophobicContact CG1-CD1 3.37Å; V962-I1016 HydrophobicContact CG2-CD1 3.49Å; V962-I1016 VanDerWaalsContact CG2-CD1 3.49Å; V962-I1016 HydrophobicContact CG2-CG2 4.01Å; V1012-I1016 HydrophobicContact CG1-CD1 3.76Å; V1012-I1016 WeakPolarHBondContact O-CB 3.49Å; V1012-I1016 WeakPolarHBondContact O-CG1 3.28Å; V1012-I1016 PolarHBondContact O-N 2.98Å; I1013-I1016 PolarHBondContact O-N 2.86Å; I1016-S1018 PolarHBondContact O-N 3.48Å; I1016-D1019 CarbonylContact O-C 2.92Å; I1016-G1020 WeakPolarHBondContact O-CA 3.28Å; I1016-G1020 PolarHBondContact O-N 3.11Å
1017	N	80.9	Confident	81.5	Confident	111 Å²	111	53.4 Å²	53.4	59%	0.594	30%	0.296	S	S	*	.	H	α-helix	trans	-69.8	-17.1	169.8	-70.3	-12.7	0	0	0	113	I1013	I1013-N1017 WeakPolarHBondContact CG2-ND2 3.32Å; I1013-N1017 VanDerWaalsContact O-CB 3.23Å; I1013-N1017 WeakPolarHBondContact O-CB 3.11Å; I1013-N1017 PolarHBondContact O-N 3.1Å; I1013-N1017 PolarHBondContact O-ND2 2.83Å
1018	S	76.8	Confident	81.4	Confident	94 Å²	94	51.4 Å²	51.4	66%	0.657	28%	0.279	S	S	*	.	H	α-helix	trans	-89.2	-44.3	175.9	-59.3	0	0	0	0	112.3	Q1014 L1015 I1016	Q1014-S1018 WeakPolarHBondContact O-CB 3.14Å; Q1014-S1018 PolarHBondContact O-N 3.44Å; Q1014-S1018 VanDerWaalsContact O-N 3.11Å; Q1014-S1018 PolarHBondContact O-OG 3.39Å; L1015-S1018 WeakPolarHBondContact O-CB 3.12Å; L1015-S1018 PolarHBondContact O-N 3.49Å; I1016-S1018 PolarHBondContact O-N 3.48Å
1019	D	68.7	Low	81.2	Confident	56 Å²	56	52 Å²	52	30%	0.299	28%	0.284	S	S	.	.			trans	-154.6	101.6	174.3	-170.9	-44.5	0	0	0	110.4	L1015 I1016 K1021 K1022	L1015-D1019 PolarHBondContact O-N 3.36Å; I1016-D1019 CarbonylContact O-C 2.92Å; D1019-K1021 PolarHBondContact O-N 2.86Å; D1019-K1021 PolarHBondContact OD1-N 2.95Å; D1019-K1021 VanDerWaalsContact OD1-N 3.09Å; D1019-K1022 HydrophobicContact CB-CB 4.11Å; D1019-K1022 HydrophobicContact CB-CD 4.48Å; D1019-K1022 HydrophobicContact CB-CG 4.33Å; D1019-K1022 PolarHBondContact O-N 2.9Å; D1019-K1022 PolarHBondContact OD1-N 3.33Å; D1019-K1022 VanDerWaalsContact OD1-N 3.08Å; D1019-K1022 WeakPolarHBondContact OD2-CD 3.32Å; D1019-K1022 WeakPolarHBondContact OD2-CE 3.46Å; D1019-K1022 WeakPolarHBondContact OD2-CG 3.02Å; D1019-K1022 IonicContact OD2-NZ 3.37Å; D1019-K1022 PolarHBondContact OD2-NZ 2.83Å
1020	G	63.4	Low	80.8	Confident	21 Å²	21	52.1 Å²	52.1	22%	0.216	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-10.7	-173.5	0	0	0	0	0	115.7	I1016	I1016-G1020 WeakPolarHBondContact O-CA 3.28Å; I1016-G1020 PolarHBondContact O-N 3.11Å
1021	K	61.8	Low	80	Confident	145 Å²	145	54 Å²	54	63%	0.63	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.2	-21.5	-178.7	-74.8	167.5	-177.9	158.1	0	113.6	E955 D1019	E955-K1021 VanDerWaalsContact CD-CE 3.48Å; E955-K1021 WeakPolarHBondContact OE1-CE 3.49Å; E955-K1021 IonicContact OE1-NZ 3.63Å; E955-K1021 PolarHBondContact OE1-NZ 3.48Å; E955-K1021 WeakPolarHBondContact OE2-CE 3.38Å; E955-K1021 IonicContact OE2-NZ 2.84Å; E955-K1021 PolarHBondContact OE2-NZ 3.22Å; D1019-K1021 PolarHBondContact O-N 2.86Å; D1019-K1021 PolarHBondContact OD1-N 2.95Å; D1019-K1021 VanDerWaalsContact OD1-N 3.09Å
1022	K	62.4	Low	78.9	Confident	148 Å²	148	51.7 Å²	51.7	64%	0.643	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-13.1	174.3	-67.5	-170.5	-175.2	97.2	0	115.1	D1019	D1019-K1022 HydrophobicContact CB-CB 4.11Å; D1019-K1022 HydrophobicContact CB-CD 4.48Å; D1019-K1022 HydrophobicContact CB-CG 4.33Å; D1019-K1022 PolarHBondContact O-N 2.9Å; D1019-K1022 PolarHBondContact OD1-N 3.33Å; D1019-K1022 VanDerWaalsContact OD1-N 3.08Å; D1019-K1022 WeakPolarHBondContact OD2-CD 3.32Å; D1019-K1022 WeakPolarHBondContact OD2-CE 3.46Å; D1019-K1022 WeakPolarHBondContact OD2-CG 3.02Å; D1019-K1022 IonicContact OD2-NZ 3.37Å; D1019-K1022 PolarHBondContact OD2-NZ 2.83Å
1023	G	70.3	Confident	77.5	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.01	30%	0.3	C	S	.	.			trans	-69.8	-30.2	-179.9	0	0	0	0	0	114.8	I950 G1025 T1026	I950-G1023 WeakPolarHBondContact CD1-O 3.41Å; G1023-G1025 PolarHBondContact O-N 2.93Å; G1023-T1026 WeakPolarHBondContact O-CB 3.04Å; G1023-T1026 PolarHBondContact O-N 2.91Å; G1023-T1026 VanDerWaalsContact O-N 3.08Å; G1023-T1026 PolarHBondContact O-OG1 2.8Å
1024	V	79.8	Confident	75.7	Confident	63 Å²	63	59.8 Å²	59.8	38%	0.382	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	134.4	-170.1	-174.8	0	0	0	0	111.8	T1026	V1024-T1026 VanDerWaalsContact C-N 3.27Å; V1024-T1026 PolarHBondContact O-N 2.64Å
1025	G	81.8	Confident	73.8	Confident	30 Å²	30	61.4 Å²	61.4	31%	0.309	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	-7.4	-174.6	0	0	0	0	0	115	I950 G1023 K1027	I950-G1025 WeakPolarHBondContact O-CA 3.49Å; I950-G1025 PolarHBondContact O-N 2.76Å; G1023-G1025 PolarHBondContact O-N 2.93Å; G1025-K1027 PolarHBondContact O-N 3.07Å
1026	T	86.4	Confident	71.9	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.006	35%	0.353	C	S	.	.			trans	-65.1	132.4	175.7	-57.4	0	0	0	0	110.7	E949 I950 L1015 G1023 V1024 L1028 M1046	E949-T1026 WeakPolarHBondContact CA-O 3.49Å; I950-T1026 PolarHBondContact N-O 3.17Å; I950-T1026 VanDerWaalsContact N-O 3.1Å; L1015-T1026 HydrophobicContact CD2-CG2 3.89Å; G1023-T1026 WeakPolarHBondContact O-CB 3.04Å; G1023-T1026 PolarHBondContact O-N 2.91Å; G1023-T1026 VanDerWaalsContact O-N 3.08Å; G1023-T1026 PolarHBondContact O-OG1 2.8Å; V1024-T1026 VanDerWaalsContact C-N 3.27Å; V1024-T1026 PolarHBondContact O-N 2.64Å; T1026-L1028 HydrophobicContact CG2-CD2 4.43Å; T1026-M1046 HydrophobicContact CG2-CG 3.99Å
1027	K	89.5	Confident	70.3	Confident	75 Å²	75	69 Å²	69	33%	0.326	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	107.5	-175	-165.1	162.3	-167.6	151	0	110.9	V947 M948 E949 G1025 V1045	V947-K1027 HydrophobicContact CG1-CD 4.19Å; V947-K1027 HydrophobicContact CG1-CG 3.78Å; M948-K1027 CarbonylContact O-C 3.6Å; M948-K1027 WeakPolarHBondContact O-CA 3.5Å; E949-K1027 HydrophobicContact CB-CG 4.43Å; E949-K1027 WeakPolarHBondContact OE2-CD 3.13Å; E949-K1027 WeakPolarHBondContact OE2-CE 3.47Å; E949-K1027 IonicContact OE2-NZ 2.67Å; E949-K1027 PolarHBondContact OE2-NZ 2.84Å; G1025-K1027 PolarHBondContact O-N 3.07Å; K1027-V1045 PolarHBondContact N-O 2.6Å; K1027-V1045 PolarHBondContact O-N 3.15Å
1028	L	89.9	Confident	68.5	Low	6 Å²	6	71.2 Å²	71.2	3%	0.031	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	133.7	173.6	-56.4	-178.5	0	0	0	109.3	V947 M948 Q1008 E1011 V1012 T1026 I1042 A1044	V947-L1028 CarbonylContact C-O 3.56Å; V947-L1028 VanDerWaalsContact CA-O 3.32Å; V947-L1028 WeakPolarHBondContact CA-O 3.36Å; M948-L1028 PolarHBondContact N-O 3.36Å; M948-L1028 PolarHBondContact O-N 2.84Å; Q1008-L1028 HydrophobicContact CB-CD1 3.89Å; Q1008-L1028 HydrophobicContact CG-CB 4.15Å; Q1008-L1028 HydrophobicContact CG-CD1 4.28Å; Q1008-L1028 VanDerWaalsContact O-CD1 3.23Å; Q1008-L1028 WeakPolarHBondContact O-CD1 3.39Å; E1011-L1028 HydrophobicContact CB-CD1 3.63Å; V1012-L1028 HydrophobicContact CG2-CD1 3.89Å; T1026-L1028 HydrophobicContact CG2-CD2 4.43Å; L1028-I1042 HydrophobicContact CB-CG2 4.22Å; L1028-I1042 HydrophobicContact CD2-CG2 4.21Å; L1028-A1044 HydrophobicContact CD2-CB 3.64Å
1029	A	87.6	Confident	67	Low	13 Å²	13	72 Å²	72	11%	0.107	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	135.3	178	0	0	0	0	0	111.6	V947 T1043	V947-A1029 HydrophobicContact CG2-CB 4.27Å; A1029-T1043 PolarHBondContact N-O 3.47Å; A1029-T1043 PolarHBondContact O-N 2.84Å
1030	T	84.9	Confident	66.4	Low	1 Å²	1	72.8 Å²	72.8	1%	0.006	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	139.6	176.2	-59	0	0	0	0	109.1	K945 V946 I1004 Q1008 P1040	K945-T1030 WeakPolarHBondContact CA-O 3.25Å; V946-T1030 PolarHBondContact N-O 3.06Å; V946-T1030 PolarHBondContact O-N 3.18Å; I1004-T1030 HydrophobicContact CD1-CG2 4.03Å; I1004-T1030 HydrophobicContact CG1-CG2 4.21Å; I1004-T1030 HydrophobicContact CG2-CG2 3.84Å; Q1008-T1030 PolarHBondContact NE2-OG1 2.81Å; T1030-P1040 HydrophobicContact CG2-CB 3.74Å
1031	V	75.4	Confident	66.3	Low	69 Å²	69	77.2 Å²	77.2	42%	0.418	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	121	-179.2	-178.4	0	0	0	0	108.8	K943 K945	K943-V1031 HydrophobicContact CB-CG1 3.87Å; K943-V1031 HydrophobicContact CD-CG1 3.82Å; K943-V1031 HydrophobicContact CG-CG1 4.34Å; K945-V1031 HydrophobicContact CG-CG2 4.24Å
1032	L	66.1	Low	66.6	Low	39 Å²	39	72.4 Å²	72.4	20%	0.204	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	117.6	174.6	-70.7	130.9	0	0	0	109.9	R944 V946 I1004	R944-L1032 HydrophobicContact CB-CB 4.26Å; R944-L1032 HydrophobicContact CB-CD1 4.13Å; R944-L1032 PolarHBondContact O-N 2.94Å; V946-L1032 HydrophobicContact CG2-CD1 4.22Å; I1004-L1032 HydrophobicContact CD1-CD1 3.82Å; I1004-L1032 HydrophobicContact CD1-CD2 3.7Å; I1004-L1032 HydrophobicContact CD1-CG 3.74Å
1033	D	60.5	Low	67.2	Low	80 Å²	80	69.2 Å²	69.2	43%	0.428	41%	0.409	S	S	.	.			trans	-96	118	156.1	-86.9	-61.3	0	0	0	108.6	K943 N1035 S1036	K943-D1033 IonicContact NZ-OD1 2.73Å; K943-D1033 PolarHBondContact NZ-OD1 3.31Å; K943-D1033 IonicContact NZ-OD2 2.67Å; K943-D1033 PolarHBondContact NZ-OD2 3.26Å; D1033-N1035 PolarHBondContact O-N 2.98Å; D1033-S1036 PolarHBondContact O-N 3.04Å
1034	P	50.2	Low	67.1	Low	117 Å²	117	71.9 Å²	71.9	76%	0.76	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	13.8	-169.3	32.2	-38.3	0	0	0	114.7
1035	N	45.6	Very low	66.3	Low	162 Å²	162	73 Å²	73	87%	0.866	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135	7.2	-169.6	-108.8	94.6	0	0	0	113.4	D1033	D1033-N1035 PolarHBondContact O-N 2.98Å
1036	S	45.3	Very low	64.7	Low	64 Å²	64	76.7 Å²	76.7	45%	0.448	45%	0.448	S	S	.	.			trans	-106.9	143.4	174.8	-171.3	0	0	0	0	111.4	D1033 E1038	D1033-S1036 PolarHBondContact O-N 3.04Å; S1036-E1038 WeakPolarHBondContact OG-CB 3.19Å; S1036-E1038 PolarHBondContact OG-N 2.81Å
1037	T	48	Very low	62.6	Low	153 Å²	153	79.8 Å²	79.8	94%	0.939	47%	0.468	S	S	*	.			trans	-94	4.5	173.3	-26.9	0	0	0	0	112.2
1038	E	43.6	Very low	60.1	Low	157 Å²	157	85.4 Å²	85.4	73%	0.734	49%	0.493	S	S	*	.	S	Bend	trans	-81	150.1	-179.7	-65.2	178.5	142.8	0	0	112.2	S1036	S1036-E1038 WeakPolarHBondContact OG-CB 3.19Å; S1036-E1038 PolarHBondContact OG-N 2.81Å
1039	P	45.9	Very low	57.5	Low	112 Å²	112	92 Å²	92	73%	0.727	53%	0.528	S	S	*	.			trans	-64.9	147	176.9	27.6	-35.1	0	0	0	111.9	T1041	P1039-T1041 PolarHBondContact O-N 3.38Å
1040	P	56.4	Low	54.9	Low	71 Å²	71	97.2 Å²	97.2	46%	0.461	56%	0.564	S	S	.	*			trans	-73.7	110.1	-171.4	28.3	-35.1	0	0	0	113.1	I1004 T1030 I1042	I1004-P1040 HydrophobicContact CG1-CB 4.37Å; I1004-P1040 HydrophobicContact CG1-CG 4.24Å; T1030-P1040 HydrophobicContact CG2-CB 3.74Å; P1040-I1042 PolarHBondContact O-N 3.24Å
1041	T	60.2	Low	52.5	Low	114 Å²	114	102.6 Å²	102.6	70%	0.699	60%	0.601	S	S	*	*			trans	-61.2	118.8	174.8	-50.6	0	0	0	0	111.9	P1039	P1039-T1041 PolarHBondContact O-N 3.38Å
1042	I	69.1	Low	50.3	Low	45 Å²	45	104.3 Å²	104.3	23%	0.231	62%	0.623	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.8	130	169.1	-57.1	176.5	0	0	0	108.3	A1007 Q1008 E1011 L1028 P1040	A1007-I1042 HydrophobicContact CB-CD1 3.84Å; Q1008-I1042 HydrophobicContact CG-CD1 4.02Å; Q1008-I1042 HydrophobicContact CG-CG1 4.35Å; Q1008-I1042 HydrophobicContact CG-CG2 4.35Å; E1011-I1042 HydrophobicContact CG-CD1 4.15Å; L1028-I1042 HydrophobicContact CB-CG2 4.22Å; L1028-I1042 HydrophobicContact CD2-CG2 4.21Å; P1040-I1042 PolarHBondContact O-N 3.24Å
1043	T	75.3	Confident	48.6	Very low	80 Å²	80	107 Å²	107	49%	0.491	65%	0.651	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.4	113.9	170.5	-52.7	0	0	0	0	109.1	A1029 V1045	A1029-T1043 PolarHBondContact N-O 3.47Å; A1029-T1043 PolarHBondContact O-N 2.84Å; T1043-V1045 HydrophobicContact CG2-CG2 4.4Å
1044	A	66.6	Low	47.1	Very low	57 Å²	57	110 Å²	110	47%	0.471	67%	0.672	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.9	130.8	171	0	0	0	0	0	110.6	L1028	L1028-A1044 HydrophobicContact CD2-CB 3.64Å
1045	V	64	Low	46.2	Very low	88 Å²	88	108.9 Å²	108.9	53%	0.533	67%	0.672	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.7	110.5	170.8	-176.3	0	0	0	0	108	K1027 T1043	K1027-V1045 PolarHBondContact N-O 2.6Å; K1027-V1045 PolarHBondContact O-N 3.15Å; T1043-V1045 HydrophobicContact CG2-CG2 4.4Å
1046	M	47.7	Very low	45.6	Very low	107 Å²	107	106.4 Å²	106.4	53%	0.527	67%	0.668	S	S	.	*			trans	-84	152.3	173	-72.4	179.3	167.9	0	0	111	L1015 T1026 K1048	L1015-M1046 HydrophobicContact CD1-CE 3.67Å; L1015-M1046 HydrophobicContact CD2-CE 4.28Å; T1026-M1046 HydrophobicContact CG2-CG 3.99Å; M1046-K1048 PolarHBondContact O-N 2.89Å
1047	P	42.2	Very low	44.7	Very low	66 Å²	66	110.5 Å²	110.5	43%	0.429	69%	0.685	S	S	.	*			trans	-56.5	136	164.7	-20.4	33	0	0	0	110.3	D1049	P1047-D1049 PolarHBondContact O-N 2.91Å
1048	K	37.2	Very low	43.9	Very low	193 Å²	193	109.7 Å²	109.7	84%	0.839	68%	0.68	S	S	*	*			trans	-95.1	86.4	176.8	-170.6	178.5	-179.8	-179.7	0	110	M1046 S1050	M1046-K1048 PolarHBondContact O-N 2.89Å; K1048-S1050 PolarHBondContact O-N 3.47Å; K1048-S1050 PolarHBondContact O-OG 3.35Å
1049	D	34.7	Very low	43.3	Very low	144 Å²	144	111.2 Å²	111.2	77%	0.77	68%	0.684	S	S	*	*			trans	-54.3	131.7	175.8	-73.8	-34.7	0	0	0	111.3	P1047	P1047-D1049 PolarHBondContact O-N 2.91Å
1050	S	33.5	Very low	42.5	Very low	123 Å²	123	111.5 Å²	111.5	86%	0.86	69%	0.686	S	S	*	*			trans	-110.5	66.8	-172.7	-66.5	0	0	0	0	111.2	K1048	K1048-S1050 PolarHBondContact O-N 3.47Å; K1048-S1050 PolarHBondContact O-OG 3.35Å
1051	S	34.1	Very low	41.4	Very low	113 Å²	113	114.4 Å²	114.4	79%	0.79	69%	0.691	S	S	*	*			trans	-120.5	119.1	161.2	60.4	0	0	0	0	108.8
1052	A	29.6	Very low	40.1	Very low	106 Å²	106	117.1 Å²	117.1	88%	0.876	70%	0.7	S	S	*	*			trans	-123.2	115.3	-170.9	0	0	0	0	0	112.3
1053	A	30.5	Very low	38.4	Very low	95 Å²	95	121.2 Å²	121.2	79%	0.785	72%	0.718	S	S	*	*			trans	-162.1	136.4	159.2	0	0	0	0	0	112.7
1054	T	28.9	Very low	36.5	Very low	144 Å²	144	124.9 Å²	124.9	88%	0.883	73%	0.733	S	S	*	*			trans	62.7	90.7	146.7	-43.3	0	0	0	0	121.2
1055	A	32.8	Very low	34.8	Very low	92 Å²	92	128.5 Å²	128.5	76%	0.76	74%	0.74	S	S	*	*			trans	-174.5	94.4	139.3	0	0	0	0	0	109.4
1056	S	31.1	Very low	33.6	Very low	111 Å²	111	131.1 Å²	131.1	78%	0.776	74%	0.744	S	S	*	*				88.5	83.6	92.3	71.9	0	0	0	0	116
1057	N	26.9	Very low	32.9	Very low	149 Å²	149	132 Å²	132	80%	0.797	76%	0.756	S	S	*	*			trans	48.2	105.9	133.5	-167.4	22	0	0	0	120.6
1058	T	31.2	Very low	32.8	Very low	137 Å²	137	133.4 Å²	133.4	84%	0.84	77%	0.765	S	S	*	*				178.9	151.7	121.9	26.4	0	0	0	0	112
1059	K	30.5	Very low	32.9	Very low	188 Å²	188	129.7 Å²	129.7	82%	0.817	76%	0.761	S	S	*	*			trans	-159.8	131.4	176.1	-173.7	179	-177.6	179.3	0	111.5
1060	P	30.8	Very low	32.9	Very low	118 Å²	118	128.3 Å²	128.3	77%	0.766	76%	0.757	S	S	*	*				-132.8	148.1	125.3	35.9	-25.4	0	0	0	110
1061	K	32.5	Very low	33.1	Very low	132 Å²	132	133.2 Å²	133.2	57%	0.574	76%	0.757	S	S	*	*			cis	75.6	115.7	33.3	-156.4	-142.7	-178.5	-168	0	114.5	E1063	K1061-E1063 WeakPolarHBondContact CE-OE1 3.38Å; K1061-E1063 WeakPolarHBondContact CE-OE2 3.29Å; K1061-E1063 IonicContact NZ-OE1 2.7Å; K1061-E1063 PolarHBondContact NZ-OE1 2.84Å; K1061-E1063 IonicContact NZ-OE2 3.81Å; K1061-E1063 PolarHBondContact NZ-OE2 3.04Å
1062	I	33.7	Very low	33.1	Very low	171 Å²	171	132.9 Å²	132.9	88%	0.877	75%	0.747	S	S	*	*			trans	-137.4	-177.9	149.3	-117.9	164	0	0	0	108.6
1063	E	32.1	Very low	33.2	Very low	132 Å²	132	131.8 Å²	131.8	62%	0.617	74%	0.737	S	S	*	*			trans	-137.7	-169.8	-145.2	-156.4	111.9	-126.4	0	0	115	K1061	K1061-E1063 WeakPolarHBondContact CE-OE1 3.38Å; K1061-E1063 WeakPolarHBondContact CE-OE2 3.29Å; K1061-E1063 IonicContact NZ-OE1 2.7Å; K1061-E1063 PolarHBondContact NZ-OE1 2.84Å; K1061-E1063 IonicContact NZ-OE2 3.81Å; K1061-E1063 PolarHBondContact NZ-OE2 3.04Å
1064	I	35.1	Very low	33.2	Very low	157 Å²	157	132.1 Å²	132.1	81%	0.805	73%	0.734	S	S	*	*			trans	89.3	127.1	168.9	-53.5	172.1	0	0	0	115
1065	E	32.6	Very low	33.1	Very low	133 Å²	133	132.9 Å²	132.9	62%	0.621	73%	0.728	S	S	*	*			cis	-171.7	-174.8	-28.6	-122.9	-160.8	146.8	0	0	107.7
1066	K	37	Very low	32.9	Very low	142 Å²	142	135.8 Å²	135.8	62%	0.617	73%	0.725	S	S	*	*			cis	-153.2	152.3	9.2	-159.5	159.7	-169.4	72.8	0	111.9
1067	T	32.9	Very low	33.1	Very low	125 Å²	125	134.8 Å²	134.8	77%	0.767	72%	0.716	S	S	*	*			trans	-135.7	150.3	147	51.3	0	0	0	0	108.7
1068	P	41.1	Very low	33.1	Very low	96 Å²	96	134.6 Å²	134.6	62%	0.623	72%	0.715	S	S	*	*				-153.8	-169.3	117.8	39.9	-22.5	0	0	0	112.5
1069	P	40.1	Very low	32.9	Very low	115 Å²	115	134.7 Å²	134.7	75%	0.747	71%	0.711	S	S	*	*			cis	-110.8	167.6	-19.6	12.6	11.6	0	0	0	111.8
1070	T	34.9	Very low	32.7	Very low	115 Å²	115	130.3 Å²	130.3	71%	0.706	70%	0.699	S	S	*	*			cis	94.4	126.1	25.1	-51	0	0	0	0	115
1071	R	37.2	Very low	32.5	Very low	226 Å²	226	132 Å²	132	85%	0.853	70%	0.697	S	S	*	*			trans	161.6	147.3	140.8	-88.8	-155.5	134.9	127.9	5.7	110.6
1072	D	33.2	Very low	32.3	Very low	107 Å²	107	131.3 Å²	131.3	57%	0.572	70%	0.704	S	S	*	*			cis	-161.9	137.1	-22.8	-105.6	-8.8	0	0	0	105.6
1073	A	32.8	Very low	32.1	Very low	82 Å²	82	127.9 Å²	127.9	68%	0.678	69%	0.691	S	S	*	*				65.5	142.3	87.3	0	0	0	0	0	114.7
1074	S	29.4	Very low	31.8	Very low	103 Å²	103	127.9 Å²	127.9	72%	0.72	70%	0.695	S	S	*	*			cis	-173.2	175	-7.1	-104.8	0	0	0	0	111.7
1075	Q	26.7	Very low	31.5	Very low	160 Å²	160	124.8 Å²	124.8	75%	0.748	68%	0.684	S	S	*	*			trans	70.5	124.8	146.5	-92.2	177.6	-76.6	0	0	123.4
1076	E	28.5	Very low	31.3	Very low	152 Å²	152	128.2 Å²	128.2	71%	0.71	69%	0.691	S	S	*	*				59.6	170.5	128	-83.8	-170	106.1	0	0	122.1
1077	P	36	Very low	30.8	Very low	90 Å²	90	130 Å²	130	58%	0.584	70%	0.699	S	S	*	*			cis	-136.4	-166.1	-30.9	33.2	-12.1	0	0	0	113.2
1078	N	27.9	Very low	30.4	Very low	145 Å²	145	129.6 Å²	129.6	78%	0.775	70%	0.696	S	S	*	*			trans	60.3	119.8	137.3	-78.7	-29	0	0	0	123.5
1079	N	25.9	Very low	29.8	Very low	139 Å²	139	129.1 Å²	129.1	74%	0.743	70%	0.695	S	S	*	*				80.6	157.6	115.6	-162.8	28.9	0	0	0	120.5
1080	V	26.2	Very low	29	Very low	96 Å²	96	130.2 Å²	130.2	58%	0.582	69%	0.69	S	S	*	*			trans	65.4	108.6	166.3	153.6	0	0	0	0	114.8
1081	Q	27	Very low	28.6	Very low	153 Å²	153	132.3 Å²	132.3	72%	0.715	69%	0.691	S	S	*	*				54	128.7	88.6	-57	167.7	21.9	0	0	111.9
1082	V	27.6	Very low	28	Very low	119 Å²	119	125.6 Å²	125.6	72%	0.721	68%	0.679	S	S	*	*				-160.9	120	68.1	148.6	0	0	0	0	105.3
1083	T	29.8	Very low	27.6	Very low	98 Å²	98	128 Å²	128	60%	0.601	69%	0.692	S	S	*	*				56.3	154.3	73.9	80.6	0	0	0	0	112.6
1084	N	26.2	Very low	27.3	Very low	132 Å²	132	127.3 Å²	127.3	71%	0.706	69%	0.686	S	S	*	*			cis	-166.8	177.5	22.1	-144.8	-26.2	0	0	0	111
1085	V	28	Very low	27.2	Very low	93 Å²	93	131 Å²	131	56%	0.564	69%	0.692	S	S	*	*			trans	66.2	110.1	148.9	161	0	0	0	0	117
1086	R	28.9	Very low	27.1	Very low	205 Å²	205	128.2 Å²	128.2	77%	0.774	69%	0.69	S	S	*	*				71	106.3	71	-173	-154.7	-69.1	146.5	-9.2	114.1
1087	K	26.4	Very low	27	Very low	180 Å²	180	126.2 Å²	126.2	78%	0.783	69%	0.688	S	S	*	*				-174.2	144.6	108.8	-101.6	-164.8	171	-174.6	0	110
1088	V	26	Very low	26.6	Very low	116 Å²	116	129.8 Å²	129.8	70%	0.703	70%	0.697	S	S	*	*				50.8	116.3	82.4	-178.8	0	0	0	0	110.1
1089	S	26.4	Very low	26.6	Very low	86 Å²	86	128 Å²	128	60%	0.601	70%	0.696	S	S	*	*			cis	-154.8	148.9	43.5	-117	0	0	0	0	110.2
1090	Q	24.9	Very low	26.8	Very low	138 Å²	138	128.9 Å²	128.9	65%	0.645	70%	0.699	S	S	*	*				84	128.7	72.2	-176.2	-164.8	-5.8	0	0	113.4
1091	E	24.9	Very low	27	Very low	159 Å²	159	129.5 Å²	129.5	74%	0.743	71%	0.705	S	S	*	*			trans	61.7	159	162.6	-76.6	148.6	-143.6	0	0	117.4
1092	S	26	Very low	27.4	Very low	85 Å²	85	133.1 Å²	133.1	59%	0.594	71%	0.712	S	S	*	*			cis	-171.2	155.9	-21.7	53.8	0	0	0	0	109
1093	N	24	Very low	27.8	Very low	158 Å²	158	133.1 Å²	133.1	85%	0.845	72%	0.715	S	S	*	*			trans	62.1	170.4	155.5	-71.9	-10.8	0	0	0	116.5
1094	A	26.5	Very low	27.7	Very low	66 Å²	66	132.4 Å²	132.4	55%	0.545	73%	0.726	S	S	.	*			cis	-161.8	170.2	-36	0	0	0	0	0	107.8
1095	E	27.2	Very low	27.8	Very low	181 Å²	181	129.2 Å²	129.2	85%	0.846	73%	0.725	S	S	*	*			trans	67.2	128.7	158.1	-74.4	163	103.7	0	0	116.6
1096	S	26.1	Very low	27.8	Very low	101 Å²	101	132.9 Å²	132.9	71%	0.706	74%	0.74	S	S	*	*				67.6	130.1	89.4	-143.4	0	0	0	0	111.3
1097	V	26.3	Very low	27.7	Very low	111 Å²	111	130 Å²	130	67%	0.673	74%	0.738	S	S	*	*				-155.8	162.6	56.6	163	0	0	0	0	111.3
1098	Q	26.8	Very low	27.7	Very low	164 Å²	164	127.1 Å²	127.1	77%	0.766	74%	0.735	S	S	*	*			trans	-21.4	151.4	158	-51.9	133.6	8.1	0	0	115.3
1099	S	27.5	Very low	28	Very low	108 Å²	108	130.5 Å²	130.5	76%	0.755	75%	0.745	S	S	*	*				-171.2	149.8	61.7	-58.7	0	0	0	0	115.3
1100	I	30.6	Very low	28.4	Very low	158 Å²	158	131.3 Å²	131.3	81%	0.81	75%	0.751	S	S	*	*			trans	-74.6	140.7	157.9	-65.7	158.9	0	0	0	107.2
1101	P	30	Very low	28.9	Very low	109 Å²	109	130.6 Å²	130.6	71%	0.708	76%	0.759	S	S	*	*				-141.9	-177.7	61.2	38.3	-15	0	0	0	113.6
1102	R	36.4	Very low	29.1	Very low	229 Å²	229	128.2 Å²	128.2	86%	0.864	76%	0.755	S	S	*	*			cis	59.6	160	39.4	-91.3	-170	-174.7	-153.4	3.5	113.8
1103	P	34.1	Very low	29.1	Very low	119 Å²	119	130.3 Å²	130.3	77%	0.773	76%	0.76	S	S	*	*			cis	-129.2	179.9	-22.6	40.5	-25.3	0	0	0	113.5
1104	G	28.8	Very low	29.2	Very low	82 Å²	82	129.6 Å²	129.6	85%	0.845	75%	0.751	S	S	*	*			trans	81.6	154.3	164	0	0	0	0	0	115.3
1105	G	29	Very low	29.3	Very low	66 Å²	66	132.4 Å²	132.4	68%	0.68	76%	0.762	S	S	*	*			cis	136.9	173.3	4.1	0	0	0	0	0	110.3
1106	I	27.3	Very low	29.5	Very low	170 Å²	170	130 Å²	130	87%	0.872	76%	0.755	S	S	*	*			trans	70.2	129.4	168.7	-59.8	170.5	0	0	0	113.4
1107	I	26.7	Very low	29.8	Very low	143 Å²	143	130.5 Å²	130.5	73%	0.733	76%	0.758	S	S	*	*			cis	-147.8	154	-4.4	-130	173.3	0	0	0	112.4
1108	V	25.5	Very low	30.1	Very low	120 Å²	120	129.5 Å²	129.5	73%	0.727	76%	0.762	S	S	*	*			trans	-15.2	133.5	154.5	178.1	0	0	0	0	117.7
1109	M	32.9	Very low	30.6	Very low	187 Å²	187	127.2 Å²	127.2	92%	0.921	76%	0.761	S	S	*	*			trans	-163.7	113.6	131.8	-115.4	173.7	169	0	0	113.7
1110	S	34.4	Very low	31.5	Very low	104 Å²	104	127.4 Å²	127.4	73%	0.727	76%	0.76	S	S	*	*			trans	-80.5	161.3	153.5	-47.2	0	0	0	0	109
1111	P	36.6	Very low	32.1	Very low	123 Å²	123	124.8 Å²	124.8	80%	0.799	75%	0.753	S	S	*	*				-149.5	161.6	100.4	36.7	-18.9	0	0	0	117.8
1112	T	27.5	Very low	32.3	Very low	109 Å²	109	126.2 Å²	126.2	67%	0.669	76%	0.76	S	S	*	*			trans	-48.5	172	169.2	53.6	0	0	0	0	119.7
1113	N	26.5	Very low	32.2	Very low	128 Å²	128	119 Å²	119	68%	0.684	76%	0.757	S	S	*	*			trans	80.9	153.9	150.8	-63	-26.7	0	0	0	117.7
1114	Q	27.3	Very low	32.3	Very low	144 Å²	144	118 Å²	118	67%	0.673	76%	0.758	S	S	*	*			cis	-166.4	159.1	-15.8	-110.7	167.3	34.8	0	0	109.1
1115	T	27.3	Very low	32.6	Very low	124 Å²	124	119 Å²	119	76%	0.761	76%	0.758	S	S	*	*			trans	60.4	164.5	163.1	40.3	0	0	0	0	116.3
1116	D	31.8	Very low	32.9	Very low	132 Å²	132	120.1 Å²	120.1	71%	0.706	76%	0.761	S	S	*	*			cis	-150.3	123.5	15.9	-135.7	-33.2	0	0	0	109.3
1117	S	32.8	Very low	33.2	Very low	111 Å²	111	121.7 Å²	121.7	78%	0.776	76%	0.762	S	S	*	*				83.3	173.1	112.2	64.4	0	0	0	0	119.2
1118	A	32.2	Very low	34	Very low	90 Å²	90	120.5 Å²	120.5	74%	0.744	76%	0.764	S	S	*	*			trans	-106.1	-165.6	-156.7	0	0	0	0	0	112.2
1119	P	37.6	Very low	34.4	Very low	115 Å²	115	119.9 Å²	119.9	75%	0.747	77%	0.765	S	S	*	*			cis	-140.3	177.6	19.2	39.1	-16.3	0	0	0	118.4
1120	P	46.7	Very low	34.3	Very low	113 Å²	113	120.3 Å²	120.3	73%	0.734	76%	0.756	S	S	*	*			trans	-87.8	-160	169.3	41.1	-40	0	0	0	111.5
1121	P	43.3	Very low	34.1	Very low	102 Å²	102	122.3 Å²	122.3	66%	0.662	75%	0.752	S	S	*	*			cis	-151.2	-164.1	9.5	44.9	-21.7	0	0	0	119
1122	T	33.9	Very low	33.7	Very low	139 Å²	139	123.9 Å²	123.9	85%	0.853	75%	0.749	S	S	*	*			trans	75.1	140.5	150.6	48	0	0	0	0	123.3
1123	G	34.3	Very low	33.7	Very low	79 Å²	79	124.2 Å²	124.2	81%	0.814	75%	0.75	S	S	*	*			trans	124.6	119.8	154.6	0	0	0	0	0	116.5
1124	A	36	Very low	33.9	Very low	96 Å²	96	123.7 Å²	123.7	79%	0.793	75%	0.752	S	S	*	*			cis	169.4	127.5	-33.9	0	0	0	0	0	108
1125	A	35.1	Very low	34.1	Very low	103 Å²	103	123.2 Å²	123.2	85%	0.851	75%	0.747	S	S	*	*			trans	64	163.2	160.2	0	0	0	0	0	118.6
1126	A	34.9	Very low	34.3	Very low	90 Å²	90	122.7 Å²	122.7	74%	0.744	75%	0.749	S	S	*	*			cis	-138.1	128.3	0.8	0	0	0	0	0	108.7
1127	K	33.1	Very low	34.2	Very low	204 Å²	204	121 Å²	121	89%	0.887	75%	0.753	S	S	*	*				76.7	149.9	80.3	-81.5	-166.6	173.9	-176.9	0	115.8
1128	P	43.6	Very low	34.2	Very low	118 Å²	118	123.1 Å²	123.1	77%	0.766	76%	0.756	S	S	*	*			trans	-131.5	-148.8	-148.9	43.7	-25.1	0	0	0	113.6
1129	S	34.9	Very low	34.5	Very low	107 Å²	107	123.9 Å²	123.9	75%	0.748	75%	0.753	S	S	*	*			trans	90.2	151.3	161.9	-152.8	0	0	0	0	116
1130	R	31.4	Very low	34	Very low	196 Å²	196	125.7 Å²	125.7	74%	0.74	76%	0.755	S	S	*	*			cis	-178.4	170.9	-28.6	-176.6	174.7	170.4	174.2	-0.1	107.4
1131	F	29.3	Very low	33.1	Very low	146 Å²	146	124.3 Å²	124.3	64%	0.64	75%	0.753	S	S	*	*			trans	73.9	150.7	169.5	-63.1	-86.7	0	0	0	117.3
1132	Q	28.4	Very low	32.5	Very low	156 Å²	156	125.7 Å²	125.7	73%	0.729	76%	0.76	S	S	*	*			cis	-166.2	153.6	-35.5	-119.7	-171.6	-0.5	0	0	110.6
1133	V	28.4	Very low	32.6	Very low	116 Å²	116	124.4 Å²	124.4	70%	0.703	75%	0.754	S	S	*	*			trans	45.6	121.4	148.8	-178.4	0	0	0	0	121.3
1134	T	30.5	Very low	32.5	Very low	117 Å²	117	128.5 Å²	128.5	72%	0.718	76%	0.756	S	S	*	*				-165.8	-177.9	128.2	9.2	0	0	0	0	112.3
1135	K	29.9	Very low	32.3	Very low	133 Å²	133	127 Å²	127	58%	0.578	74%	0.739	S	S	*	*			trans	-119.6	148.5	-159.4	-62	-177.4	177	-176.9	0	115.9
1136	S	31.4	Very low	32.2	Very low	113 Å²	113	125.9 Å²	125.9	79%	0.79	73%	0.725	S	S	*	*			trans	73.7	155.4	141.8	-64.2	0	0	0	0	122.5
1137	A	31.6	Very low	32.1	Very low	96 Å²	96	125 Å²	125	79%	0.793	71%	0.713	S	S	*	*			trans	92.6	130	165.5	0	0	0	0	0	119.2
1138	D	32.7	Very low	32	Very low	156 Å²	156	118.3 Å²	118.3	83%	0.834	69%	0.687	S	S	*	*			trans	-74.2	-176.3	166.4	-42.8	-99.5	0	0	0	111.3
1139	P	37.3	Very low	31.5	Very low	106 Å²	106	117.6 Å²	117.6	69%	0.688	69%	0.685	S	S	*	*			cis	-141.3	-166.9	0.7	42.9	-23.4	0	0	0	115.7
1140	I	26.6	Very low	31.3	Very low	153 Å²	153	116.9 Å²	116.9	79%	0.785	68%	0.676	S	S	*	*			trans	77.4	132.3	150.3	-77.9	169.1	0	0	0	120
1141	A	28.2	Very low	31.2	Very low	85 Å²	85	111.5 Å²	111.5	70%	0.702	67%	0.673	S	S	*	*			trans	60.5	149.3	153.3	0	0	0	0	0	120.9
1142	T	31.2	Very low	31.2	Very low	130 Å²	130	110.6 Å²	110.6	80%	0.798	68%	0.68	S	S	*	*			cis	-166.2	161.5	-28.8	20	0	0	0	0	106.7
1143	P	35.4	Very low	31.2	Very low	112 Å²	112	109.4 Å²	109.4	73%	0.727	68%	0.683	S	S	*	*			trans	-86.7	161.9	-173.6	35.7	-37	0	0	0	114.9
1144	I	32.6	Very low	31.3	Very low	166 Å²	166	110.9 Å²	110.9	85%	0.851	69%	0.685	S	S	*	*			trans	-136.4	145.5	162.4	-57.8	-179.1	0	0	0	107.8
1145	S	32.2	Very low	31.9	Very low	64 Å²	64	110.5 Å²	110.5	45%	0.448	69%	0.685	S	S	.	*			trans	-135.6	163.1	-171	-47.8	0	0	0	0	113.2
1146	S	32.5	Very low	31.9	Very low	80 Å²	80	111.1 Å²	111.1	56%	0.559	69%	0.693	S	S	*	*			trans	75.3	162.3	155.7	83.4	0	0	0	0	117.8	A48	A48-S1146 VanDerWaalsContact O-CA 3.23Å; A48-S1146 WeakPolarHBondContact O-CA 3.4Å; A48-S1146 WeakPolarHBondContact O-CB 3.23Å
1147	S	32.1	Very low	31.8	Very low	70 Å²	70	112.4 Å²	112.4	49%	0.49	70%	0.695	S	S	.	*			cis	-164.6	139.8	17.2	49.1	0	0	0	0	118.6	H46	H46-S1147 PolarHBondContact O-OG 2.17Å
1148	I	32	Very low	31.7	Very low	65 Å²	65	111.6 Å²	111.6	33%	0.333	69%	0.689	S	S	.	*			trans	58	148	141.3	-125.5	-178.3	0	0	0	124.3	H46 P47 A48 V1222	H46-I1148 HydrophobicContact CB-CD1 3.93Å; H46-I1148 HydrophobicContact CB-CG2 4.06Å; H46-I1148 WeakPolarHBondContact O-CG2 3.4Å; P47-I1148 WeakPolarHBondContact O-CD1 3.48Å; A48-I1148 HydrophobicContact CB-CB 4.14Å; A48-I1148 HydrophobicContact CB-CG1 4.18Å; I1148-V1222 HydrophobicContact CD1-CB 3.96Å; I1148-V1222 HydrophobicContact CD1-CG1 4.43Å; I1148-V1222 HydrophobicContact CD1-CG2 3.3Å; I1148-V1222 HydrophobicContact CG1-CG2 4.21Å
1149	S	32.3	Very low	31.6	Very low	103 Å²	103	108.5 Å²	108.5	72%	0.72	69%	0.685	S	S	*	*				-179.7	-170.8	108.9	-153.9	0	0	0	0	114
1150	T	30.5	Very low	31.7	Very low	92 Å²	92	110.1 Å²	110.1	56%	0.564	69%	0.693	S	S	*	*			trans	-129.3	164.9	-158.5	-16.1	0	0	0	0	114.7	V1222	T1150-V1222 HydrophobicContact CG2-CG2 4.48Å; T1150-V1222 WeakPolarHBondContact OG1-CG2 3.45Å
1151	A	30.5	Very low	32.1	Very low	83 Å²	83	108.4 Å²	108.4	69%	0.686	69%	0.692	S	S	*	*			trans	125.7	103.8	135.2	0	0	0	0	0	120.5
1152	T	28.3	Very low	32.5	Very low	126 Å²	126	110.9 Å²	110.9	77%	0.773	70%	0.698	S	S	*	*				67.4	148.7	123	-26.7	0	0	0	0	123.7
1153	V	28.2	Very low	32.3	Very low	132 Å²	132	111.2 Å²	111.2	80%	0.8	70%	0.695	S	S	*	*			trans	64.9	149.5	163.9	-101.6	0	0	0	0	118.2
1154	I	31.4	Very low	32.3	Very low	147 Å²	147	113.1 Å²	113.1	75%	0.754	70%	0.698	S	S	*	*			cis	-137	151.3	7.4	-53.7	176.6	0	0	0	109.6
1155	P	43.3	Very low	32.1	Very low	108 Å²	108	110 Å²	110	70%	0.701	69%	0.687	S	S	*	*			trans	-89.5	-166.3	173	35.3	-35.7	0	0	0	115.2
1156	I	29.1	Very low	32.1	Very low	146 Å²	146	112 Å²	112	75%	0.749	70%	0.701	S	S	*	*			trans	114	110	155.1	-68.2	161.7	0	0	0	119.3
1157	V	29.5	Very low	31.9	Very low	140 Å²	140	116.6 Å²	116.6	85%	0.848	71%	0.713	S	S	*	*			trans	67.3	149.5	141.2	169.3	0	0	0	0	118.5
1158	A	30.9	Very low	32.2	Very low	80 Å²	80	118 Å²	118	66%	0.661	72%	0.72	S	S	*	*			cis	-136.2	152.7	13.5	0	0	0	0	0	112.7
1159	A	30.5	Very low	32	Very low	90 Å²	90	120.2 Å²	120.2	74%	0.744	74%	0.737	S	S	*	*				65.7	138	94.4	0	0	0	0	0	115.6
1160	T	38.5	Very low	31.6	Very low	140 Å²	140	122.7 Å²	122.7	86%	0.859	74%	0.74	S	S	*	*			cis	-150.2	170	48.3	40.9	0	0	0	0	115.3
1161	P	36	Very low	31.5	Very low	117 Å²	117	124.4 Å²	124.4	76%	0.76	75%	0.751	S	S	*	*			trans	-130.3	163.9	-168.8	42.4	-27.4	0	0	0	117.8
1162	T	36.5	Very low	31.5	Very low	137 Å²	137	128.7 Å²	128.7	84%	0.84	76%	0.756	S	S	*	*			trans	-166.4	131.9	154	17.8	0	0	0	0	106.8
1163	N	26.6	Very low	31.9	Very low	137 Å²	137	126.9 Å²	126.9	73%	0.733	75%	0.747	S	S	*	*			cis	75.1	105	32	-154.4	20	0	0	0	112.8
1164	I	34.8	Very low	31.8	Very low	153 Å²	153	127.5 Å²	127.5	79%	0.785	74%	0.744	S	S	*	*				176.6	155.7	99.8	-91	162.9	0	0	0	108.1
1165	T	28	Very low	31.7	Very low	100 Å²	100	126.1 Å²	126.1	61%	0.613	74%	0.743	S	S	*	*			cis	-172.5	163.2	-25.7	-70.4	0	0	0	0	108
1166	S	33.2	Very low	31.1	Very low	106 Å²	106	125.4 Å²	125.4	74%	0.741	75%	0.746	S	S	*	*			trans	68.1	123	165.3	35.9	0	0	0	0	117.9
1167	E	28.4	Very low	31.1	Very low	177 Å²	177	126.1 Å²	126.1	83%	0.827	75%	0.747	S	S	*	*			cis	61.2	146.7	33.8	-73	-93.5	118.1	0	0	115.4
1168	P	38.5	Very low	31	Very low	98 Å²	98	124.2 Å²	124.2	64%	0.636	74%	0.735	S	S	*	*			cis	-138.7	-145.9	-40.5	38.3	-19.7	0	0	0	112
1169	V	26.7	Very low	30.8	Very low	112 Å²	112	128 Å²	128	68%	0.679	74%	0.743	S	S	*	*			trans	114.6	107.2	153.4	-177.3	0	0	0	0	119.8
1170	I	25	Very low	30.7	Very low	155 Å²	155	127.8 Å²	127.8	80%	0.795	73%	0.732	S	S	*	*				35.4	154	126.4	-34.6	169.9	0	0	0	121.4
1171	V	27.8	Very low	30.3	Very low	129 Å²	129	128.6 Å²	128.6	78%	0.782	73%	0.725	S	S	*	*			trans	110.5	70.5	155.7	-165.6	0	0	0	0	116.6
1172	Q	30.8	Very low	30	Very low	172 Å²	172	130.2 Å²	130.2	80%	0.804	73%	0.727	S	S	*	*			trans	-47.4	171.7	134.4	-118.9	-172.5	55.5	0	0	112.3
1173	P	36.5	Very low	29.7	Very low	89 Å²	89	127 Å²	127	58%	0.578	72%	0.715	S	S	*	*			cis	-146.9	-153.7	4.5	34.9	-8.9	0	0	0	114.6
1174	I	26.9	Very low	30.3	Very low	144 Å²	144	126.4 Å²	126.4	74%	0.738	72%	0.716	S	S	*	*			trans	75.3	103.1	155.5	-68.9	165.9	0	0	0	114.9
1175	T	29.2	Very low	30.1	Very low	118 Å²	118	125.1 Å²	125.1	72%	0.724	72%	0.718	S	S	*	*				73.2	113.5	54.1	-57	0	0	0	0	113.5
1176	A	29.6	Very low	30.7	Very low	94 Å²	94	125.3 Å²	125.3	78%	0.777	72%	0.723	S	S	*	*			trans	174.7	144.9	138.7	0	0	0	0	0	112
1177	Q	29.7	Very low	30.7	Very low	161 Å²	161	126.3 Å²	126.3	75%	0.752	73%	0.727	S	S	*	*			cis	-171.1	144.5	-23.4	-121.8	-166.2	-8.1	0	0	108.4
1178	V	28.1	Very low	30.9	Very low	99 Å²	99	124.2 Å²	124.2	60%	0.6	73%	0.726	S	S	*	*			trans	69.6	155.7	140.5	172.5	0	0	0	0	114.3
1179	I	26.6	Very low	30.5	Very low	161 Å²	161	124.1 Å²	124.1	83%	0.826	73%	0.728	S	S	*	*			cis	-113.6	142	16	-31.5	-127.2	0	0	0	112.5
1180	T	28.3	Very low	30.7	Very low	84 Å²	84	127.6 Å²	127.6	52%	0.515	74%	0.736	S	S	.	*			trans	-123.3	-179.6	-175.2	33.7	0	0	0	0	110.6
1181	H	29	Very low	30.9	Very low	157 Å²	157	126 Å²	126	73%	0.727	74%	0.739	S	S	*	*			trans	91.5	151.2	153.2	-56.5	-50.6	0	0	0	120.2
1182	L	30.3	Very low	30.9	Very low	151 Å²	151	127.8 Å²	127.8	79%	0.791	74%	0.743	S	S	*	*			cis	-172	169.4	-35	-150.1	64.7	0	0	0	110.1
1183	A	29.8	Very low	30.7	Very low	71 Å²	71	125.4 Å²	125.4	59%	0.587	75%	0.745	S	S	*	*			trans	81	112.5	135	0	0	0	0	0	121
1184	T	39.9	Very low	30.3	Very low	123 Å²	123	125.9 Å²	125.9	76%	0.755	75%	0.751	S	S	*	*				-6.4	164.9	113.2	52.5	0	0	0	0	118.7
1185	P	29.9	Very low	30.4	Very low	127 Å²	127	126 Å²	126	83%	0.825	75%	0.753	S	S	*	*			trans	-128.4	135.5	133.6	36.2	-27.2	0	0	0	114.1
1186	S	40.7	Very low	30.4	Very low	103 Å²	103	125.6 Å²	125.6	72%	0.72	76%	0.755	S	S	*	*			trans	-79.6	-173.8	151.7	-52.2	0	0	0	0	109.5
1187	P	32.8	Very low	30.6	Very low	128 Å²	128	126.3 Å²	126.3	83%	0.831	75%	0.754	S	S	*	*				-147.5	162.7	99.1	37.6	-22.5	0	0	0	115.9
1188	V	32.9	Very low	30.8	Very low	133 Å²	133	124.6 Å²	124.6	81%	0.806	76%	0.757	S	S	*	*			trans	-124.8	140.5	158.8	-78.2	0	0	0	0	108.4
1189	S	31	Very low	31.1	Very low	96 Å²	96	125.4 Å²	125.4	67%	0.671	77%	0.767	S	S	*	*			trans	168	170.8	149.2	-84.5	0	0	0	0	113.3
1190	H	30.3	Very low	31.2	Very low	184 Å²	184	122.3 Å²	122.3	85%	0.852	77%	0.766	S	S	*	*			trans	76	133.9	171.2	-38.4	-68.3	0	0	0	114.9
1191	S	28.8	Very low	31.3	Very low	123 Å²	123	124.5 Å²	124.5	86%	0.86	78%	0.779	S	S	*	*			cis	-154.1	177.5	-2.5	40.7	0	0	0	0	112.3
1192	L	27.8	Very low	31.2	Very low	166 Å²	166	123.6 Å²	123.6	87%	0.869	79%	0.785	S	S	*	*			trans	-90.2	167.8	-163.4	-68.6	155.6	0	0	0	115.6
1193	S	27.1	Very low	31.2	Very low	121 Å²	121	124.8 Å²	124.8	85%	0.846	79%	0.786	S	S	*	*			trans	93.8	142.6	164.4	-37.2	0	0	0	0	115.8
1194	S	28.7	Very low	31.2	Very low	99 Å²	99	127 Å²	127	69%	0.692	80%	0.797	S	S	*	*			cis	-147.2	154	11.1	58.1	0	0	0	0	115.5
1195	N	27.1	Very low	30.6	Very low	146 Å²	146	128.1 Å²	128.1	78%	0.781	80%	0.799	S	S	*	*			trans	64.2	104.4	144.4	-66.4	9.1	0	0	0	122.9
1196	S	30.6	Very low	30.6	Very low	110 Å²	110	130.3 Å²	130.3	77%	0.769	80%	0.8	S	S	*	*				107.6	92.4	118.7	-60.7	0	0	0	0	120.9
1197	S	32.7	Very low	30.2	Very low	110 Å²	110	129.5 Å²	129.5	77%	0.769	79%	0.794	S	S	*	*			trans	-36.1	170.4	131.5	-39	0	0	0	0	114.2
1198	P	35.5	Very low	30.2	Very low	124 Å²	124	127.2 Å²	127.2	81%	0.805	78%	0.781	S	S	*	*			cis	-148.2	-176.7	28.2	44	-22.8	0	0	0	118.8
1199	S	33.6	Very low	30.2	Very low	117 Å²	117	128.2 Å²	128.2	82%	0.818	78%	0.78	S	S	*	*			trans	-69.9	156.8	168	-38.3	0	0	0	0	113.4
1200	A	28.3	Very low	30.3	Very low	96 Å²	96	130.4 Å²	130.4	79%	0.793	78%	0.78	S	S	*	*			trans	155.7	125.6	134	0	0	0	0	0	114.4
1201	T	31.4	Very low	30.5	Very low	129 Å²	129	126.7 Å²	126.7	79%	0.791	77%	0.774	S	S	*	*			trans	0.2	126.4	145.2	-42.4	0	0	0	0	120.2
1202	T	27	Very low	30.5	Very low	139 Å²	139	126.2 Å²	126.2	85%	0.853	77%	0.767	S	S	*	*				-177.5	171	124.6	22.1	0	0	0	0	113.5
1203	H	30.3	Very low	30.6	Very low	176 Å²	176	124.5 Å²	124.5	82%	0.815	76%	0.763	S	S	*	*			trans	-92.4	154.4	-176.3	-50.9	-109.5	0	0	0	113.5
1204	S	28.5	Very low	31	Very low	116 Å²	116	123.9 Å²	123.9	81%	0.811	76%	0.759	S	S	*	*			trans	-178.5	161	130.7	32.5	0	0	0	0	113.9
1205	N	27.5	Very low	31.1	Very low	148 Å²	148	125.7 Å²	125.7	79%	0.791	77%	0.766	S	S	*	*			trans	-76.9	161.2	174.1	-64.7	-49.4	0	0	0	110.5
1206	M	30.1	Very low	31.5	Very low	173 Å²	173	124.4 Å²	124.4	85%	0.852	77%	0.765	S	S	*	*				-144.8	141.7	56.8	-71.9	-172.4	73.1	0	0	111.4
1207	S	32.4	Very low	31.6	Very low	86 Å²	86	123 Å²	123	60%	0.601	77%	0.768	S	S	*	*				65.5	133.7	61.7	-50.3	0	0	0	0	112.3
1208	S	32.7	Very low	31.7	Very low	79 Å²	79	129.9 Å²	129.9	55%	0.552	78%	0.777	S	S	*	*			cis	-154.4	170.7	-2.2	-95	0	0	0	0	107
1209	I	33.2	Very low	31.4	Very low	155 Å²	155	134.7 Å²	134.7	80%	0.795	78%	0.779	S	S	*	*				-143.4	111.3	52.3	-60.9	173.3	0	0	0	106.2
1210	Q	31.7	Very low	31.3	Very low	142 Å²	142	138.7 Å²	138.7	66%	0.664	78%	0.782	S	S	*	*				59.9	129.2	87.2	-64	174.6	-15.9	0	0	112.5
1211	S	34.9	Very low	31.4	Very low	105 Å²	105	138.4 Å²	138.4	73%	0.734	77%	0.771	S	S	*	*			cis	-138.2	119	27.3	-68.7	0	0	0	0	110.6
1212	T	29.3	Very low	31.2	Very low	113 Å²	113	134.1 Å²	134.1	69%	0.693	74%	0.744	S	S	*	*				63.3	135	88.3	65.6	0	0	0	0	114.7
1213	T	29.4	Very low	31.1	Very low	131 Å²	131	130.2 Å²	130.2	80%	0.804	72%	0.716	S	S	*	*			cis	-158.8	163.5	8.4	-3.6	0	0	0	0	112.8
1214	S	35.5	Very low	31.4	Very low	107 Å²	107	124.9 Å²	124.9	75%	0.748	70%	0.697	S	S	*	*			trans	-130.4	142.3	170.6	55.9	0	0	0	0	110.8
1215	V	32.2	Very low	31.3	Very low	138 Å²	138	122.6 Å²	122.6	84%	0.836	68%	0.678	S	S	*	*			trans	-146.7	132.4	168.7	-171.8	0	0	0	0	111.3
1216	P	35.2	Very low	31.4	Very low	118 Å²	118	119.2 Å²	119.2	77%	0.766	67%	0.666	S	S	*	*			trans	-107	148	171.6	37.6	-30.6	0	0	0	114.3
1217	G	32	Very low	31.2	Very low	80 Å²	80	116.2 Å²	116.2	83%	0.825	65%	0.65	S	S	*	*			trans	57	107.1	144	0	0	0	0	0	121.8
1218	R	36.1	Very low	31	Very low	255 Å²	255	114.3 Å²	114.3	96%	0.962	64%	0.639	S	S	*	*			trans	-154.7	156.2	135.3	-120.7	-178.7	-173.7	-157.7	1.2	112.8
1219	R	27.8	Very low	30.8	Very low	226 Å²	226	113.6 Å²	113.6	85%	0.853	63%	0.627	S	S	*	*			trans	-96.5	119.7	-177.8	178.7	-168.7	-164.7	178.4	6.4	110.2
1220	F	32.6	Very low	30.6	Very low	201 Å²	201	112 Å²	112	88%	0.882	63%	0.63	S	S	*	*			trans	-147.4	164.5	151.6	-103	-73.6	0	0	0	109.7
1221	T	29.2	Very low	30.5	Very low	90 Å²	90	107.6 Å²	107.6	55%	0.552	62%	0.622	S	S	*	*			trans	-112.8	177.2	-156.6	54	0	0	0	0	112.5
1222	V	27	Very low	30.4	Very low	39 Å²	39	110.2 Å²	110.2	24%	0.236	63%	0.626	C	S	.	*			trans	51.1	0	152.7	-176.7	0	0	0	0	115	H46 I1148 T1150	H46-V1222 VanDerWaalsContact CB-C 3.48Å; H46-V1222 VanDerWaalsContact CB-CA 3.43Å; H46-V1222 HydrophobicContact CB-CB 4Å; H46-V1222 HydrophobicContact CB-CG1 3.55Å; H46-V1222 VanDerWaalsContact CD2-CA 3.46Å; H46-V1222 WeakPolarHBondContact CD2-CA 3.37Å; H46-V1222 PolarHBondContact CD2-O 2.18Å; H46-V1222 WeakPolarHBondContact CE1-CA 3.48Å; H46-V1222 PolarHBondContact CE1-O 2.39Å; H46-V1222 VanDerWaalsContact CG-O 3.27Å; H46-V1222 WeakPolarHBondContact ND1-CA 3.36Å; H46-V1222 PolarHBondContact ND1-N 2.19Å; H46-V1222 VanDerWaalsContact ND1-N 3.13Å; H46-V1222 PolarHBondContact ND1-O 2.16Å; H46-V1222 PolarHBondContact NE2-O 2.9Å; I1148-V1222 HydrophobicContact CD1-CB 3.96Å; I1148-V1222 HydrophobicContact CD1-CG1 4.43Å; I1148-V1222 HydrophobicContact CD1-CG2 3.3Å; I1148-V1222 HydrophobicContact CG1-CG2 4.21Å; T1150-V1222 HydrophobicContact CG2-CG2 4.48Å; T1150-V1222 WeakPolarHBondContact OG1-CG2 3.45Å
1223	Q	26.6	Very low	30.4	Very low	57 Å²	57	109.9 Å²	109.9	27%	0.266	63%	0.629	S	S	.	*				0	151.9	0	-127	93.4	101.5	0	0	115.5	E44 L45 H46	E44-Q1223 HydrophobicContact CB-CG 3.74Å; E44-Q1223 HydrophobicContact CG-CG 3.73Å; E44-Q1223 WeakPolarHBondContact OE1-CB 3.34Å; E44-Q1223 VanDerWaalsContact OE1-CG 3.27Å; E44-Q1223 WeakPolarHBondContact OE1-CG 3.46Å; E44-Q1223 PolarHBondContact OE1-OE1 3.36Å; L45-Q1223 VanDerWaalsContact CA-CD 3.48Å; L45-Q1223 VanDerWaalsContact CA-NE2 3.31Å; H46-Q1223 WeakPolarHBondContact CD2-CA 3.17Å; H46-Q1223 WeakPolarHBondContact CD2-CB 3.48Å; H46-Q1223 PolarHBondContact CD2-N 3.4Å; H46-Q1223 PolarHBondContact CD2-NE2 2.71Å; H46-Q1223 PolarHBondContact CE1-N 3.5Å; H46-Q1223 VanDerWaalsContact CG-NE2 3.32Å; H46-Q1223 WeakPolarHBondContact ND1-CA 3.31Å; H46-Q1223 PolarHBondContact ND1-N 2.64Å; H46-Q1223 PolarHBondContact NE2-N 2.88Å
1224	P	36.3	Very low	30.7	Very low	64 Å²	64	108.8 Å²	108.8	42%	0.416	63%	0.626	S	S	.	*			trans	-86.3	143.8	135.5	36.8	-29.6	0	0	0	111.3	L45 H46	L45-P1224 WeakPolarHBondContact O-CD 3.17Å; L45-P1224 VanDerWaalsContact O-CG 3.26Å; L45-P1224 WeakPolarHBondContact O-CG 3.28Å; H46-P1224 VanDerWaalsContact CA-CD 3.4Å
1225	V	26.5	Very low	30.6	Very low	67 Å²	67	109 Å²	109	41%	0.406	63%	0.628	S	S	.	*				-154.7	161.9	127.2	115.6	0	0	0	0	112.7	D43 E44	D43-V1225 HydrophobicContact CB-CG1 4.4Å; D43-V1225 WeakPolarHBondContact OD1-CG1 3.35Å; E44-V1225 HydrophobicContact CG-CB 3.97Å; E44-V1225 HydrophobicContact CG-CG1 4.31Å
1226	S	28.8	Very low	30.6	Very low	77 Å²	77	110.4 Å²	110.4	54%	0.538	63%	0.629	S	S	.	*			trans	-46.3	162.7	169.1	-40	0	0	0	0	118.2
1227	Q	25.9	Very low	30.5	Very low	111 Å²	111	109.4 Å²	109.4	52%	0.519	63%	0.625	S	S	.	*			trans	71.8	152.5	147.5	-70.9	161.6	-22.2	0	0	119.4
1228	A	27.7	Very low	30.7	Very low	46 Å²	46	111.7 Å²	111.7	38%	0.38	62%	0.623	S	S	.	*			cis	-173.1	145.9	-22.4	0	0	0	0	0	111.9	K40	K40-A1228 WeakPolarHBondContact CE-O 3.37Å; K40-A1228 HydrophobicContact CG-CB 3.73Å; K40-A1228 PolarHBondContact NZ-O 2.8Å
1229	E	28.5	Very low	30.7	Very low	63 Å²	63	105.7 Å²	105.7	29%	0.294	62%	0.617	S	S	.	*			trans	46.9	130.2	161.5	-30.8	139.6	122.1	0	0	121.9	R38 I39 K40	R38-E1229 WeakPolarHBondContact CB-OE1 3.3Å; R38-E1229 WeakPolarHBondContact CD-OE1 3.36Å; R38-E1229 WeakPolarHBondContact CG-OE1 3.22Å; R38-E1229 IonicContact NE-OE1 3.2Å; I39-E1229 WeakPolarHBondContact CA-OE2 3.41Å; I39-E1229 PolarHBondContact N-OE1 3.02Å; K40-E1229 WeakPolarHBondContact CG-OE2 3.25Å; K40-E1229 PolarHBondContact NZ-O 3.31Å; K40-E1229 IonicContact NZ-OE2 2.66Å; K40-E1229 PolarHBondContact NZ-OE2 3.42Å
1230	S	29.5	Very low	31.4	Very low	123 Å²	123	102.5 Å²	102.5	86%	0.86	61%	0.611	S	S	*	*				-178.1	160.9	100.9	49.5	0	0	0	0	111.1
1231	G	29.7	Very low	31.6	Very low	48 Å²	48	98.6 Å²	98.6	50%	0.495	61%	0.606	S	S	.	*			cis	148.4	78.3	-17.3	0	0	0	0	0	117.2
1232	I	32.2	Very low	32	Very low	160 Å²	160	100.2 Å²	100.2	82%	0.821	61%	0.607	S	S	*	*			trans	-147.1	121	161.1	39.8	176	0	0	0	108.1
1233	S	30.1	Very low	32.6	Very low	106 Å²	106	103.9 Å²	103.9	74%	0.741	63%	0.632	S	S	*	*				76.7	130.9	70.4	-59.5	0	0	0	0	112
1234	S	35.9	Very low	33	Very low	108 Å²	108	105.8 Å²	105.8	76%	0.755	65%	0.648	S	S	*	*			cis	-146.4	140.6	18.3	-61.6	0	0	0	0	110
1235	S	32.8	Very low	33.1	Very low	111 Å²	111	108.9 Å²	108.9	78%	0.776	67%	0.668	S	S	*	*				78	113.6	62.8	-50.7	0	0	0	0	116
1236	I	33.3	Very low	33.3	Very low	169 Å²	169	110.2 Å²	110.2	87%	0.867	69%	0.686	S	S	*	*				177	174.4	119.6	-155.4	157.3	0	0	0	111.1
1237	S	31.8	Very low	34	Very low	96 Å²	96	114.8 Å²	114.8	67%	0.671	70%	0.702	S	S	*	*				-149.1	158.3	-96.7	-75.2	0	0	0	0	114
1238	T	36.8	Very low	34.3	Very low	129 Å²	129	115.6 Å²	115.6	79%	0.791	72%	0.715	S	S	*	*			trans	-0.3	152.6	150.9	48.6	0	0	0	0	120.8
1239	P	35.9	Very low	35	Very low	129 Å²	129	119.1 Å²	119.1	84%	0.838	74%	0.737	S	S	*	*			cis	-150.1	177.7	48	42.2	-21.3	0	0	0	120.3
1240	H	41.6	Very low	35	Very low	159 Å²	159	122.1 Å²	122.1	74%	0.736	76%	0.763	S	S	*	*			trans	-131.4	155.7	173.2	177.4	-2	0	0	0	107
1241	P	37.4	Very low	35.7	Very low	118 Å²	118	121.6 Å²	121.6	77%	0.766	76%	0.757	S	S	*	*			trans	-127.4	141.9	148.6	35.2	-25	0	0	0	114.2
1242	E	38.2	Very low	36	Very low	124 Å²	124	124.9 Å²	124.9	58%	0.579	77%	0.77	S	S	*	*			trans	-84.6	169.5	163.5	-137.6	-178	120.4	0	0	108.2
1243	P	38.3	Very low	36	Very low	116 Å²	116	123 Å²	123	75%	0.753	77%	0.768	S	S	*	*				-156.4	156.1	77.9	39.4	-18.2	0	0	0	119.8
1244	T	36.3	Very low	36.4	Very low	98 Å²	98	123.7 Å²	123.7	60%	0.601	77%	0.767	S	S	*	*			trans	-19	161.5	139.8	55.3	0	0	0	0	118.6
1245	P	37.6	Very low	36.1	Very low	129 Å²	129	124.7 Å²	124.7	84%	0.838	77%	0.772	S	S	*	*			cis	-150.4	-175.2	42.8	42.9	-20.5	0	0	0	120.3
1246	A	31.8	Very low	36	Very low	95 Å²	95	123.6 Å²	123.6	79%	0.785	76%	0.764	S	S	*	*			trans	-87.6	174.3	-169.7	0	0	0	0	0	115.9
1247	I	42.1	Very low	36	Very low	172 Å²	172	121.8 Å²	121.8	88%	0.882	76%	0.76	S	S	*	*			trans	-147.4	150.7	152.7	-101.4	151.4	0	0	0	111.5
1248	T	33.7	Very low	36	Very low	129 Å²	129	122.5 Å²	122.5	79%	0.791	76%	0.763	S	S	*	*			trans	-72	146.2	-172.9	-45.3	0	0	0	0	115.8
1249	S	40.6	Very low	35.9	Very low	119 Å²	119	121.4 Å²	121.4	83%	0.832	76%	0.758	S	S	*	*			trans	-165.2	165.2	143	39.2	0	0	0	0	111.9
1250	C	28.9	Very low	35.4	Very low	126 Å²	126	121.4 Å²	121.4	85%	0.851	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-102.8	169.2	-171.9	-97.7	0	0	0	0	113.5
1251	P	44.3	Very low	34.7	Very low	112 Å²	112	119.8 Å²	119.8	73%	0.727	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-97.1	163.5	-159.2	38.2	-37.8	0	0	0	115.6
1252	P	36.7	Very low	34.1	Very low	117 Å²	117	119.7 Å²	119.7	76%	0.76	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-94.6	159.7	147.5	36	-29.4	0	0	0	112
1253	P	32	Very low	33.7	Very low	122 Å²	122	122.1 Å²	122.1	79%	0.792	78%	0.775	S	S	*	*			trans	-97.2	178.8	-168.9	39	-37.7	0	0	0	115.2
1254	V	38.3	Very low	33.4	Very low	119 Å²	119	119.8 Å²	119.8	72%	0.721	77%	0.773	S	S	*	*			trans	-54.6	162.6	163.4	-66.9	0	0	0	0	113
1255	P	29.7	Very low	33	Very low	130 Å²	130	120.8 Å²	120.8	84%	0.844	78%	0.778	S	S	*	*				-123.8	151.8	106.8	36.1	-34.1	0	0	0	114
1256	S	30.8	Very low	32.3	Very low	87 Å²	87	120.3 Å²	120.3	61%	0.608	77%	0.768	S	S	*	*			trans	-109.8	168.9	170.1	-55.4	0	0	0	0	109.8
1257	V	33.7	Very low	32	Very low	131 Å²	131	120 Å²	120	79%	0.794	75%	0.754	S	S	*	*			trans	71.1	152.4	169.6	-145	0	0	0	0	111.4
1258	P	31.7	Very low	31.5	Very low	112 Å²	112	117.8 Å²	117.8	73%	0.727	74%	0.743	S	S	*	*			cis	-131.6	176.1	14	45.1	-29	0	0	0	117.6
1259	P	34.6	Very low	31.2	Very low	105 Å²	105	116.4 Å²	116.4	68%	0.682	73%	0.728	S	S	*	*			trans	-80	179.2	157.7	36.1	-36.6	0	0	0	112.7
1260	V	26	Very low	30.7	Very low	129 Å²	129	115.9 Å²	115.9	78%	0.782	72%	0.719	S	S	*	*			trans	84	103.8	167.1	-175	0	0	0	0	118.2
1261	V	26.1	Very low	30.8	Very low	126 Å²	126	113.3 Å²	113.3	76%	0.764	71%	0.707	S	S	*	*			trans	31.7	127.7	135.7	-159.2	0	0	0	0	121
1262	S	25.4	Very low	30.5	Very low	116 Å²	116	113 Å²	113	81%	0.811	71%	0.705	S	S	*	*				158.3	160.7	124.4	-72.2	0	0	0	0	115.6
1263	N	28.8	Very low	30.4	Very low	174 Å²	174	116 Å²	116	93%	0.93	71%	0.706	S	S	*	*			trans	-81.7	164.8	176.3	-69.4	-18.2	0	0	0	114
1264	G	32.2	Very low	30.4	Very low	68 Å²	68	118.4 Å²	118.4	70%	0.701	71%	0.707	S	S	*	*			trans	138.8	156.9	164	0	0	0	0	0	114.2
1265	T	29	Very low	30	Very low	118 Å²	118	119 Å²	119	72%	0.724	71%	0.71	S	S	*	*			cis	-162.4	154.2	3.5	-52	0	0	0	0	111	N1267	T1265-N1267 VanDerWaalsContact CG2-O 3.29Å; T1265-N1267 WeakPolarHBondContact CG2-O 3.49Å
1266	L	22.5	Very low	30.3	Very low	119 Å²	119	118.6 Å²	118.6	62%	0.623	71%	0.708	S	S	*	*	S	Bend	trans	-122.8	140.5	146.3	-82.2	174.4	0	0	0	107.9
1267	N	25.2	Very low	30.3	Very low	89 Å²	89	120.2 Å²	120.2	48%	0.476	72%	0.719	S	S	.	*			trans	65.5	167.6	174.9	-59.2	34.8	0	0	0	116.5	I5 T6 N7 T1265	I5-N1267 PolarHBondContact O-OD1 2.9Å; T6-N1267 VanDerWaalsContact O-CA 3.23Å; T6-N1267 WeakPolarHBondContact O-CA 3.48Å; T6-N1267 PolarHBondContact O-N 3.27Å; N7-N1267 CarbonylContact O-C 3.59Å; N7-N1267 VanDerWaalsContact O-O 3.13Å; T1265-N1267 VanDerWaalsContact CG2-O 3.29Å; T1265-N1267 WeakPolarHBondContact CG2-O 3.49Å
1268	L	30.4	Very low	30.1	Very low	126 Å²	126	118.9 Å²	118.9	66%	0.66	72%	0.722	S	S	*	*			cis	-170.6	142.8	-45.7	-170.4	76.3	0	0	0	108.1	N7	N7-L1268 WeakPolarHBondContact O-CA 3.3Å; N7-L1268 PolarHBondContact O-N 2.89Å
1269	E	27.5	Very low	29.8	Very low	100 Å²	100	119.2 Å²	119.2	47%	0.467	72%	0.722	S	S	.	*			cis	-163.6	160.2	-38	165.1	161.2	-146.5	0	0	109.2	N7 G8	N7-E1269 HydrophobicContact CB-CB 4.04Å; N7-E1269 HydrophobicContact CB-CG 3.98Å; N7-E1269 WeakPolarHBondContact CB-OE1 3.35Å; N7-E1269 VanDerWaalsContact CB-OE2 3.23Å; N7-E1269 WeakPolarHBondContact CB-OE2 3.46Å; N7-E1269 VanDerWaalsContact ND2-CD 3.26Å; N7-E1269 PolarHBondContact ND2-OE1 3.38Å; N7-E1269 VanDerWaalsContact ND2-OE1 3.14Å; N7-E1269 PolarHBondContact ND2-OE2 3.47Å; G8-E1269 WeakPolarHBondContact O-CA 3.21Å
1270	V	30.1	Very low	29.3	Very low	107 Å²	107	120.1 Å²	120.1	65%	0.648	72%	0.721	S	S	*	*			trans	75.1	105.5	159.9	151	0	0	0	0	121.3	G8	G8-V1270 PolarHBondContact O-N 3.06Å
1271	A	32	Very low	29.3	Very low	73 Å²	73	121.7 Å²	121.7	60%	0.603	72%	0.72	S	S	*	*				43.7	164.9	106	0	0	0	0	0	123.2
1272	P	37.3	Very low	29.3	Very low	106 Å²	106	121.6 Å²	121.6	69%	0.688	72%	0.715	S	S	*	*			cis	-149.2	171.2	-27.7	39.5	-19.9	0	0	0	119.5
1273	K	34.4	Very low	29.3	Very low	180 Å²	180	121.7 Å²	121.7	78%	0.783	71%	0.711	S	S	*	*			trans	86.3	134.6	135.7	-92.3	174.2	-179.2	177.6	0	126.1
1274	Q	33	Very low	29.2	Very low	172 Å²	172	117 Å²	117	80%	0.804	69%	0.686	S	S	*	*			trans	112.2	158.6	133.9	-86.5	171.2	-15.3	0	0	122.8
1275	T	30.4	Very low	29	Very low	130 Å²	130	117.2 Å²	117.2	80%	0.798	67%	0.673	S	S	*	*			trans	-122.6	-176.4	-151.4	47.6	0	0	0	0	111.8
1276	P	35	Very low	28.9	Very low	122 Å²	122	115.9 Å²	115.9	79%	0.792	66%	0.659	S	S	*	*			cis	-144.7	-159.5	18.7	45.5	-22.7	0	0	0	117.6
1277	S	30.9	Very low	29.2	Very low	121 Å²	121	115.1 Å²	115.1	85%	0.846	65%	0.652	S	S	*	*			trans	-87.5	161	-171.3	-18.9	0	0	0	0	116.7
1278	A	29.1	Very low	29.5	Very low	103 Å²	103	114.3 Å²	114.3	85%	0.851	65%	0.653	S	S	*	*			trans	-165.6	145.9	141	0	0	0	0	0	115.9
1279	T	26	Very low	29.5	Very low	120 Å²	120	113.7 Å²	113.7	74%	0.736	66%	0.66	S	S	*	*			trans	-55.2	146.8	175.2	-33.1	0	0	0	0	117.8
1280	N	25	Very low	29.8	Very low	124 Å²	124	113.4 Å²	113.4	66%	0.663	67%	0.669	S	S	*	*				159.6	139.9	115.9	-90.8	-59	0	0	0	117.3
1281	Q	25.6	Very low	29.8	Very low	161 Å²	161	114.4 Å²	114.4	75%	0.752	68%	0.675	S	S	*	*			trans	56.9	118.8	138.8	-67.4	168.8	52.2	0	0	120
1282	N	25	Very low	29.7	Very low	124 Å²	124	114.8 Å²	114.8	66%	0.663	68%	0.679	S	S	*	*				95.2	161.9	59	-171.9	45.6	0	0	0	111.6
1283	V	26.8	Very low	29.4	Very low	119 Å²	119	114.3 Å²	114.3	72%	0.721	68%	0.678	S	S	*	*			trans	82.7	128.2	170.4	-176.4	0	0	0	0	115.5
1284	D	26.4	Very low	29	Very low	74 Å²	74	109.2 Å²	109.2	40%	0.396	66%	0.662	S	S	.	*			cis	-175.8	165.7	-23.6	-141.1	-56	0	0	0	110.8	P1839 Q1840	D1284-P1839 WeakPolarHBondContact OD1-CB 3.18Å; D1284-Q1840 VanDerWaalsContact C-OE1 3.31Å
1285	T	27.2	Very low	28.9	Very low	73 Å²	73	103.7 Å²	103.7	45%	0.448	65%	0.645	S	S	.	*			trans	64.5	144.8	137.3	-81.1	0	0	0	0	121.2
1286	Q	27.7	Very low	28.8	Very low	90 Å²	90	99.9 Å²	99.9	42%	0.421	62%	0.622	S	S	.	*			cis	-173.7	165.4	-8.7	-111.8	170.2	29	0	0	112.4	P1838	Q1286-P1838 HydrophobicContact CG-CG 3.71Å
1287	H	29.1	Very low	28.5	Very low	103 Å²	103	101 Å²	101	48%	0.477	62%	0.621	S	S	.	*			trans	70.4	154.8	145.2	-68.7	167.6	0	0	0	122	I1837	H1287-I1837 VanDerWaalsContact CD2-CG2 3.46Å; H1287-I1837 WeakPolarHBondContact CD2-CG2 3.43Å; H1287-I1837 WeakPolarHBondContact NE2-CB 3.16Å; H1287-I1837 WeakPolarHBondContact NE2-CG2 3.35Å
1288	S	30.4	Very low	28.3	Very low	72 Å²	72	100.8 Å²	100.8	50%	0.503	61%	0.614	S	S	.	*			cis	-177.8	153.8	-22.7	-92.6	0	0	0	0	110.8
1289	S	31.6	Very low	28.3	Very low	113 Å²	113	100.6 Å²	100.6	79%	0.79	61%	0.606	S	S	*	*			trans	61	152	144	58.3	0	0	0	0	122.1
1290	S	32.9	Very low	28.4	Very low	95 Å²	95	103.1 Å²	103.1	66%	0.664	61%	0.61	S	S	*	*			cis	-175.5	179.6	-19.9	57.1	0	0	0	0	112.5
1291	T	29.7	Very low	28.6	Very low	128 Å²	128	102.8 Å²	102.8	79%	0.785	61%	0.612	S	S	*	*			trans	74.6	109.2	143.6	39.5	0	0	0	0	123.3
1292	A	30.2	Very low	28.9	Very low	81 Å²	81	101.2 Å²	101.2	67%	0.669	62%	0.616	S	S	*	*				110	101.5	102.6	0	0	0	0	0	123
1293	S	30.6	Very low	29.2	Very low	95 Å²	95	100.2 Å²	100.2	66%	0.664	63%	0.625	S	S	*	*				63.3	118.7	109.3	-44.6	0	0	0	0	124.2	A1396	S1293-A1396 CarbonylContact C-O 3.54Å
1294	T	27.3	Very low	29.2	Very low	74 Å²	74	100.2 Å²	100.2	45%	0.454	63%	0.625	S	S	.	*				152	87.9	98.9	-52.9	0	0	0	0	115	P1394 N1395 A1396	T1294-P1394 HydrophobicContact CG2-CG 3.91Å; T1294-P1394 CarbonylContact O-C 3.56Å; T1294-P1394 WeakPolarHBondContact O-CD 3.33Å; T1294-P1394 WeakPolarHBondContact O-CG 3.23Å; T1294-N1395 CarbonylContact C-O 3.6Å; T1294-N1395 PolarHBondContact N-O 3.42Å; T1294-N1395 VanDerWaalsContact N-O 3.08Å; T1294-N1395 CarbonylContact O-C 3.6Å; T1294-N1395 VanDerWaalsContact O-CA 3.27Å; T1294-N1395 WeakPolarHBondContact O-CA 3.37Å; T1294-N1395 PolarHBondContact O-N 3.26Å; T1294-N1395 VanDerWaalsContact O-O 3.11Å; T1294-A1396 PolarHBondContact N-O 3.21Å
1295	A	30	Very low	29.4	Very low	55 Å²	55	103.3 Å²	103.3	46%	0.455	65%	0.647	S	S	.	*			trans	40.8	156.6	144.8	0	0	0	0	0	124.7	P1394 N1395	A1295-P1394 VanDerWaalsContact O-CD 3.25Å; A1295-P1394 WeakPolarHBondContact O-CD 3.45Å; A1295-N1395 WeakPolarHBondContact O-CA 3.45Å; A1295-N1395 PolarHBondContact O-N 3.46Å
1296	T	28	Very low	29.4	Very low	50 Å²	50	107 Å²	107	31%	0.307	66%	0.659	S	S	.	*			trans	122.7	114.7	135.1	-44.2	0	0	0	0	117.2	I1393	T1296-I1393 HydrophobicContact CG2-CG1 3.81Å; T1296-I1393 WeakPolarHBondContact O-CG2 3.36Å
1297	L	29.3	Very low	29.5	Very low	147 Å²	147	109.7 Å²	109.7	77%	0.77	68%	0.681	S	S	*	*			trans	45.8	155.4	147.8	-52.9	171.3	0	0	0	119.8
1298	V	27.6	Very low	29.5	Very low	116 Å²	116	108.7 Å²	108.7	70%	0.703	68%	0.682	S	S	*	*			cis	-150.7	146.7	36.7	175.9	0	0	0	0	111.8	I1393	V1298-I1393 HydrophobicContact CG2-CD1 4.06Å
1299	S	28.2	Very low	29.3	Very low	99 Å²	99	111.7 Å²	111.7	69%	0.692	70%	0.7	S	S	*	*			trans	7.4	135.3	155	-172.4	0	0	0	0	121.3
1300	E	28.4	Very low	29.2	Very low	173 Å²	173	112.7 Å²	112.7	81%	0.808	70%	0.695	S	S	*	*				-163.3	143.8	108.3	-107.4	177.4	178.3	0	0	116.5
1301	T	28.4	Very low	29	Very low	117 Å²	117	113.8 Å²	113.8	72%	0.718	70%	0.703	S	S	*	*			trans	37.8	117.3	157.6	59.3	0	0	0	0	122.7
1302	P	31.6	Very low	29	Very low	127 Å²	127	113.2 Å²	113.2	83%	0.825	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-89.6	133.2	139.5	33.9	-28	0	0	0	110.7
1303	A	31.8	Very low	29.1	Very low	103 Å²	103	114.6 Å²	114.6	85%	0.851	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-86.7	136.7	-179.2	0	0	0	0	0	112.7
1304	T	26.2	Very low	29	Very low	119 Å²	119	114.6 Å²	114.6	73%	0.73	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-72.9	136	-176.8	-51.4	0	0	0	0	113.5
1305	V	30.6	Very low	29.3	Very low	140 Å²	140	117 Å²	117	85%	0.848	72%	0.723	S	S	*	*			trans	-127.8	131.6	150.7	-179.1	0	0	0	0	108.6
1306	H	27.3	Very low	29.3	Very low	151 Å²	151	120.4 Å²	120.4	70%	0.699	74%	0.738	S	S	*	*			trans	-75.2	138.2	-179.9	-83.6	-93.7	0	0	0	112.4
1307	V	30.3	Very low	29.4	Very low	146 Å²	146	126 Å²	126	89%	0.885	76%	0.76	S	S	*	*			trans	-122.6	124.2	134.5	-178.6	0	0	0	0	106.9
1308	T	28.3	Very low	29.3	Very low	82 Å²	82	127.8 Å²	127.8	50%	0.503	77%	0.765	S	S	.	*			trans	-86.4	134.1	-173.3	45.9	0	0	0	0	112	I1310	T1308-I1310 PolarHBondContact O-N 2.98Å
1309	P	27.9	Very low	29.8	Very low	134 Å²	134	127.1 Å²	127.1	87%	0.87	76%	0.763	S	S	*	*			trans	-69.9	115	164.1	29.8	-31.9	0	0	0	108.9
1310	I	29.1	Very low	29.6	Very low	135 Å²	135	130.1 Å²	130.1	69%	0.692	77%	0.771	S	S	*	*			trans	-104.1	102.1	176.1	-71.1	178.8	0	0	0	108.6	T1308 V1312	T1308-I1310 PolarHBondContact O-N 2.98Å; I1310-V1312 HydrophobicContact CG2-CG2 3.79Å
1311	S	28.5	Very low	29.5	Very low	118 Å²	118	127.7 Å²	127.7	83%	0.825	77%	0.768	S	S	*	*			trans	-80.6	129.6	167.1	-178.8	0	0	0	0	109.5
1312	V	30.1	Very low	29.4	Very low	116 Å²	116	129.2 Å²	129.2	70%	0.703	77%	0.77	S	S	*	*			trans	-134.1	132.5	170.5	-176.5	0	0	0	0	107	I1310	I1310-V1312 HydrophobicContact CG2-CG2 3.79Å
1313	P	31.7	Very low	29.4	Very low	110 Å²	110	129.1 Å²	129.1	71%	0.714	76%	0.762	S	S	*	*			trans	-85.1	163.2	-165.9	34	-37.3	0	0	0	113.7
1314	A	28.4	Very low	29.6	Very low	94 Å²	94	130.3 Å²	130.3	78%	0.777	75%	0.75	S	S	*	*			trans	-61.9	154.3	166.5	0	0	0	0	0	112.3
1315	P	33.3	Very low	29.9	Very low	125 Å²	125	133.1 Å²	133.1	81%	0.812	75%	0.754	S	S	*	*			trans	-120.2	161.8	135.3	36.1	-31.3	0	0	0	112.8
1316	V	31.5	Very low	30	Very low	126 Å²	126	129.6 Å²	129.6	76%	0.764	74%	0.736	S	S	*	*			trans	-88.4	122.8	-173.6	164.7	0	0	0	0	110.8
1317	Q	28.6	Very low	30	Very low	167 Å²	167	124.7 Å²	124.7	78%	0.78	72%	0.715	S	S	*	*			trans	45.6	117.6	133.5	-165.5	179.1	11.4	0	0	119.5
1318	E	28.7	Very low	30.2	Very low	185 Å²	185	122.8 Å²	122.8	86%	0.864	70%	0.703	S	S	*	*				-167.8	162.5	108.2	-100.7	-158.4	148.4	0	0	112.8
1319	P	36.2	Very low	30.5	Very low	103 Å²	103	125.8 Å²	125.8	67%	0.669	72%	0.715	S	S	*	*			trans	-118.6	151.4	-170.5	39.9	-28.8	0	0	0	115.6
1320	L	25.1	Very low	31.1	Very low	162 Å²	162	124.2 Å²	124.2	85%	0.848	70%	0.703	S	S	*	*			trans	-170.5	113.5	148.4	-109.9	138	0	0	0	113.8
1321	V	25.6	Very low	31.3	Very low	122 Å²	122	122.1 Å²	122.1	74%	0.739	69%	0.691	S	S	*	*			trans	33.8	155	137.2	-154.6	0	0	0	0	121.3
1322	I	27.1	Very low	31.7	Very low	149 Å²	149	121.3 Å²	121.3	76%	0.764	68%	0.677	S	S	*	*			trans	88	124.5	165.7	-54	-176.6	0	0	0	113.9
1323	D	31.2	Very low	32.1	Very low	124 Å²	124	119.6 Å²	119.6	66%	0.663	66%	0.663	S	S	*	*			cis	-156.8	170.1	-4.8	-130.8	-22.5	0	0	0	117.3
1324	H	36.4	Very low	32.4	Very low	129 Å²	129	116.7 Å²	116.7	60%	0.597	65%	0.646	S	S	*	*			trans	47.2	106.8	148.3	-78.6	35.4	0	0	0	121.6
1325	H	32.8	Very low	32.9	Very low	177 Å²	177	117.1 Å²	117.1	82%	0.819	63%	0.632	S	S	*	*				-146.7	80.3	111.9	-125.9	-72.5	0	0	0	109.9
1326	S	31.3	Very low	33.1	Very low	66 Å²	66	116.6 Å²	116.6	46%	0.462	62%	0.622	S	S	.	*			trans	-123.3	103.8	-169.1	56.4	0	0	0	0	112.6
1327	D	28.9	Very low	33.4	Very low	48 Å²	48	119 Å²	119	26%	0.257	62%	0.617	S	S	.	*			trans	-153.7	176	166.3	-99.9	-71.1	0	0	0	111	L1329 T1559 S1560	D1327-L1329 VanDerWaalsContact C-N 3.3Å; D1327-L1329 PolarHBondContact O-N 2.61Å; D1327-T1559 HydrophobicContact CB-CG2 4.23Å; D1327-T1559 VanDerWaalsContact OD2-CA 3.25Å; D1327-T1559 WeakPolarHBondContact OD2-CA 3.29Å; D1327-T1559 WeakPolarHBondContact OD2-CB 3.4Å; D1327-S1560 WeakPolarHBondContact OD1-CA 3.2Å; D1327-S1560 PolarHBondContact OD1-N 2.78Å; D1327-S1560 WeakPolarHBondContact OD2-CA 2.65Å; D1327-S1560 PolarHBondContact OD2-N 2.85Å; D1327-S1560 PolarHBondContact OD2-OG 2.81Å
1328	V	33.7	Very low	33.7	Very low	106 Å²	106	118.4 Å²	118.4	64%	0.642	61%	0.612	S	S	*	*	S	Bend	trans	70.6	-53.9	-179	-171.7	0	0	0	0	115.6	L1332	V1328-L1332 WeakPolarHBondContact O-CD1 3.03Å
1329	L	35.1	Very low	33.8	Very low	145 Å²	145	113.9 Å²	113.9	76%	0.759	60%	0.6	S	S	*	*	H	α-helix	trans	-88.5	-24.9	-170.2	-82.7	170.6	0	0	0	116.3	D1327	D1327-L1329 VanDerWaalsContact C-N 3.3Å; D1327-L1329 PolarHBondContact O-N 2.61Å
1330	T	39.5	Very low	33.5	Very low	101 Å²	101	118.3 Å²	118.3	62%	0.62	61%	0.609	S	S	*	*	H	α-helix	trans	-82.9	-17.1	173.5	46.1	0	0	0	0	113.2	S1334	T1330-S1334 PolarHBondContact O-N 2.9Å; T1330-S1334 PolarHBondContact O-OG 2.9Å
1331	Q	34.6	Very low	33.5	Very low	91 Å²	91	118.2 Å²	118.2	43%	0.425	60%	0.604	S	S	.	*	H	α-helix	trans	-70.3	-32.8	173.6	-164.6	71.9	44.7	0	0	111.6	S1334 E1335	Q1331-S1334 PolarHBondContact O-OG 2.8Å; Q1331-E1335 PolarHBondContact O-N 3.23Å
1332	L	36.2	Very low	33.7	Very low	101 Å²	101	119.4 Å²	119.4	53%	0.529	61%	0.611	S	S	.	*	H	α-helix	trans	-75.1	-45.2	177.9	-89.1	93.4	0	0	0	113.4	V1328 S1334 E1335 L1336	V1328-L1332 WeakPolarHBondContact O-CD1 3.03Å; L1332-S1334 PolarHBondContact O-N 3.08Å; L1332-E1335 PolarHBondContact O-N 2.83Å; L1332-L1336 WeakPolarHBondContact O-CB 3.46Å; L1332-L1336 WeakPolarHBondContact O-CG 3.23Å; L1332-L1336 PolarHBondContact O-N 2.87Å
1333	D	37.6	Very low	33.8	Very low	80 Å²	80	117.9 Å²	117.9	43%	0.428	61%	0.614	S	S	.	*	H	α-helix	trans	-72.5	-10.2	-179.7	-166.7	33.3	0	0	0	113.2	R1337	D1333-R1337 VanDerWaalsContact CG-NE 3.26Å; D1333-R1337 WeakPolarHBondContact O-CB 3.26Å; D1333-R1337 VanDerWaalsContact O-CD 3.31Å; D1333-R1337 WeakPolarHBondContact O-CD 2.95Å; D1333-R1337 WeakPolarHBondContact O-CG 3.27Å; D1333-R1337 IonicContact OD1-CZ 2.87Å; D1333-R1337 IonicContact OD1-NE 3.7Å; D1333-R1337 PolarHBondContact OD1-NE 3.24Å; D1333-R1337 IonicContact OD1-NH2 3.95Å; D1333-R1337 PolarHBondContact OD1-NH2 3.46Å; D1333-R1337 IonicContact OD2-CZ 3.24Å; D1333-R1337 VanDerWaalsContact OD2-CZ 3.28Å; D1333-R1337 IonicContact OD2-NE 3.53Å; D1333-R1337 PolarHBondContact OD2-NE 2.83Å; D1333-R1337 IonicContact OD2-NH2 3.74Å; D1333-R1337 PolarHBondContact OD2-NH2 3.21Å
1334	S	38.8	Very low	33.7	Very low	49 Å²	49	115 Å²	115	34%	0.343	61%	0.613	S	S	.	*	H	α-helix	trans	-97.5	-19.5	172.2	56.7	0	0	0	0	114.5	T1330 Q1331 L1332 K1338	T1330-S1334 PolarHBondContact O-N 2.9Å; T1330-S1334 PolarHBondContact O-OG 2.9Å; Q1331-S1334 PolarHBondContact O-OG 2.8Å; L1332-S1334 PolarHBondContact O-N 3.08Å; S1334-K1338 WeakPolarHBondContact O-CD 3.16Å; S1334-K1338 WeakPolarHBondContact O-CG 3.15Å
1335	E	39.7	Very low	33.4	Very low	103 Å²	103	115.5 Å²	115.5	48%	0.481	63%	0.625	S	S	.	*	H	α-helix	trans	-84.3	-43.2	165.7	-75	-69	118.9	0	0	111.6	Q1331 L1332 R1337 K1338 C1339	Q1331-E1335 PolarHBondContact O-N 3.23Å; L1332-E1335 PolarHBondContact O-N 2.83Å; E1335-R1337 PolarHBondContact O-N 2.87Å; E1335-K1338 CarbonylContact O-C 3.59Å; E1335-K1338 WeakPolarHBondContact O-CA 3.26Å; E1335-K1338 PolarHBondContact O-N 3.49Å; E1335-C1339 PolarHBondContact O-N 3.38Å
1336	L	37.3	Very low	33.3	Very low	115 Å²	115	111.5 Å²	111.5	60%	0.602	62%	0.617	S	S	*	*	H	α-helix	trans	-62	-31.7	176.7	-75.9	166.2	0	0	0	112.4	L1332 K1338	L1332-L1336 WeakPolarHBondContact O-CB 3.46Å; L1332-L1336 WeakPolarHBondContact O-CG 3.23Å; L1332-L1336 PolarHBondContact O-N 2.87Å; L1336-K1338 VanDerWaalsContact C-N 3.26Å; L1336-K1338 PolarHBondContact O-N 2.63Å
1337	R	37.2	Very low	33.4	Very low	177 Å²	177	116.8 Å²	116.8	67%	0.668	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	3.3	171.3	-65.3	-179.4	-162.1	-141.9	12.6	114.5	D1333 E1335	D1333-R1337 VanDerWaalsContact CG-NE 3.26Å; D1333-R1337 WeakPolarHBondContact O-CB 3.26Å; D1333-R1337 VanDerWaalsContact O-CD 3.31Å; D1333-R1337 WeakPolarHBondContact O-CD 2.95Å; D1333-R1337 WeakPolarHBondContact O-CG 3.27Å; D1333-R1337 IonicContact OD1-CZ 2.87Å; D1333-R1337 IonicContact OD1-NE 3.7Å; D1333-R1337 PolarHBondContact OD1-NE 3.24Å; D1333-R1337 IonicContact OD1-NH2 3.95Å; D1333-R1337 PolarHBondContact OD1-NH2 3.46Å; D1333-R1337 IonicContact OD2-CZ 3.24Å; D1333-R1337 VanDerWaalsContact OD2-CZ 3.28Å; D1333-R1337 IonicContact OD2-NE 3.53Å; D1333-R1337 PolarHBondContact OD2-NE 2.83Å; D1333-R1337 IonicContact OD2-NH2 3.74Å; D1333-R1337 PolarHBondContact OD2-NH2 3.21Å; E1335-R1337 PolarHBondContact O-N 2.87Å
1338	K	35.3	Very low	33.4	Very low	153 Å²	153	119.4 Å²	119.4	67%	0.665	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.7	-19.9	169.2	-74.5	174.7	-176.7	163.7	0	113.6	S1334 E1335 L1336 F1340	S1334-K1338 WeakPolarHBondContact O-CD 3.16Å; S1334-K1338 WeakPolarHBondContact O-CG 3.15Å; E1335-K1338 CarbonylContact O-C 3.59Å; E1335-K1338 WeakPolarHBondContact O-CA 3.26Å; E1335-K1338 PolarHBondContact O-N 3.49Å; L1336-K1338 VanDerWaalsContact C-N 3.26Å; L1336-K1338 PolarHBondContact O-N 2.63Å; K1338-F1340 VanDerWaalsContact C-N 3.33Å; K1338-F1340 PolarHBondContact O-N 3.36Å
1339	C	30.3	Very low	33.3	Very low	91 Å²	91	118.6 Å²	118.6	62%	0.615	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-2.4	174.2	-71.8	0	0	0	0	115.3	E1335	E1335-C1339 PolarHBondContact O-N 3.38Å
1340	F	29.4	Very low	33	Very low	196 Å²	196	117.4 Å²	117.4	86%	0.86	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.6	40.9	175.6	-104.8	-79.5	0	0	0	114.7	K1338	K1338-F1340 VanDerWaalsContact C-N 3.33Å; K1338-F1340 PolarHBondContact O-N 3.36Å
1341	Q	26.7	Very low	33	Very low	160 Å²	160	118 Å²	118	75%	0.748	67%	0.67	S	S	*	*			trans	-128.3	82.5	159.5	-74.4	-163.5	1.7	0	0	112.1
1342	V	29.8	Very low	32.8	Very low	147 Å²	147	118.2 Å²	118.2	89%	0.891	68%	0.681	S	S	*	*			trans	-112.9	74.1	159	-174.4	0	0	0	0	108.4
1343	S	29	Very low	32.5	Very low	117 Å²	117	119.5 Å²	119.5	82%	0.818	69%	0.693	S	S	*	*			trans	-79	141.8	165.2	-57	0	0	0	0	109.5
1344	G	28.5	Very low	32.1	Very low	62 Å²	62	122 Å²	122	64%	0.639	71%	0.712	S	S	*	*			trans	-143.6	-24.4	-164.7	0	0	0	0	0	120.2
1345	V	29.7	Very low	31.7	Very low	140 Å²	140	124.9 Å²	124.9	85%	0.848	73%	0.727	S	S	*	*			trans	-144.9	105	172.5	-169.4	0	0	0	0	107.8
1346	S	30.2	Very low	31.1	Very low	93 Å²	93	128 Å²	128	65%	0.65	74%	0.741	S	S	*	*			cis	90.2	96.5	29.7	-52.4	0	0	0	0	114.3
1347	H	33.6	Very low	30.8	Very low	178 Å²	178	126.4 Å²	126.4	82%	0.824	74%	0.74	S	S	*	*			trans	-173	111.7	144.7	-84.2	-52.9	0	0	0	106.9
1348	S	29	Very low	30.4	Very low	103 Å²	103	125.3 Å²	125.3	72%	0.72	75%	0.746	S	S	*	*				61.9	127.4	70.8	75.1	0	0	0	0	113.2
1349	A	32	Very low	30.2	Very low	89 Å²	89	124 Å²	124	74%	0.736	75%	0.751	S	S	*	*			cis	-158.6	142	11	0	0	0	0	0	110.6
1350	S	29.2	Very low	30.1	Very low	119 Å²	119	124.3 Å²	124.3	83%	0.832	75%	0.754	S	S	*	*				103.9	156.3	97.7	-82.2	0	0	0	0	115.7
1351	P	39.4	Very low	30.1	Very low	114 Å²	114	122.7 Å²	122.7	74%	0.74	75%	0.751	S	S	*	*			trans	-131	-171.7	-160	39.7	-20.7	0	0	0	115.2
1352	S	30.7	Very low	30.2	Very low	95 Å²	95	120.9 Å²	120.9	66%	0.664	75%	0.751	S	S	*	*				151.2	142	123.4	-66.6	0	0	0	0	116.8
1353	T	30.2	Very low	30.5	Very low	128 Å²	128	118.8 Å²	118.8	79%	0.785	74%	0.741	S	S	*	*			trans	55.7	133.4	147.4	54.5	0	0	0	0	120.4
1354	V	29.2	Very low	30.5	Very low	134 Å²	134	121.7 Å²	121.7	81%	0.812	74%	0.742	S	S	*	*				176.8	156.2	87.2	147.5	0	0	0	0	109
1355	V	28.9	Very low	30.5	Very low	109 Å²	109	124.1 Å²	124.1	66%	0.661	74%	0.744	S	S	*	*			cis	-171.5	161	-37.1	85.9	0	0	0	0	109.1
1356	E	28.4	Very low	30.5	Very low	169 Å²	169	124.7 Å²	124.7	79%	0.79	74%	0.741	S	S	*	*			trans	65.7	154.4	163.6	-78.1	174.7	-154.4	0	0	119.9
1357	S	30	Very low	30.7	Very low	81 Å²	81	125.2 Å²	125.2	57%	0.566	74%	0.742	S	S	*	*			cis	-157.5	145.2	1.8	-122.1	0	0	0	0	114.3
1358	L	29.1	Very low	30.6	Very low	154 Å²	154	123.9 Å²	123.9	81%	0.806	74%	0.74	S	S	*	*			trans	53.1	130	143	-57.9	166.8	0	0	0	120.7
1359	T	30.1	Very low	30.6	Very low	126 Å²	126	122.5 Å²	122.5	77%	0.773	74%	0.735	S	S	*	*			cis	-146.1	-130.6	-8.9	36.8	0	0	0	0	108.3
1360	S	29.4	Very low	30.4	Very low	97 Å²	97	123.3 Å²	123.3	68%	0.678	73%	0.734	S	S	*	*			cis	-174.1	153.1	-6.3	131.3	0	0	0	0	106.7
1361	M	29.7	Very low	30.3	Very low	161 Å²	161	125.3 Å²	125.3	79%	0.793	73%	0.73	S	S	*	*			cis	-157.3	-170	-5.6	-112.7	-59.9	178.8	0	0	110.3
1362	T	29.1	Very low	29.7	Very low	122 Å²	122	125.2 Å²	125.2	75%	0.748	73%	0.728	S	S	*	*			trans	-145.6	-162.8	-161.4	52.3	0	0	0	0	113.8
1363	P	34.5	Very low	29.8	Very low	104 Å²	104	127 Å²	127	68%	0.675	73%	0.734	S	S	*	*				-139.9	180	-70.4	41.9	-24.7	0	0	0	117.9
1364	Q	30.5	Very low	30	Very low	178 Å²	178	126.2 Å²	126.2	83%	0.832	73%	0.732	S	S	*	*			trans	77.7	141.8	135.6	-102.6	-179.1	15.1	0	0	127
1365	T	27.9	Very low	30	Very low	112 Å²	112	124.5 Å²	124.5	69%	0.687	73%	0.732	S	S	*	*			trans	108	105.1	137.6	-63	0	0	0	0	123.1
1366	I	30.3	Very low	30	Very low	153 Å²	153	123.8 Å²	123.8	79%	0.785	73%	0.731	S	S	*	*			trans	-7.6	174.6	137.5	14.5	169.8	0	0	0	121.2
1367	P	34.5	Very low	29.9	Very low	103 Å²	103	122.6 Å²	122.6	67%	0.669	73%	0.729	S	S	*	*			cis	-144.1	-173.6	-7.5	39	-17.1	0	0	0	119
1368	L	31.3	Very low	29.9	Very low	150 Å²	150	120 Å²	120	79%	0.785	72%	0.715	S	S	*	*			trans	70.6	153	153.5	-101.3	72	0	0	0	119.9
1369	A	28.7	Very low	30	Very low	74 Å²	74	121.4 Å²	121.4	61%	0.612	72%	0.717	S	S	*	*			cis	-161	161.5	-3.3	0	0	0	0	0	115.1
1370	C	27.6	Very low	30.1	Very low	107 Å²	107	119.8 Å²	119.8	72%	0.723	72%	0.717	S	S	*	*			trans	64.9	132.4	142.9	-71.3	0	0	0	0	126.4
1371	Q	27.7	Very low	30.4	Very low	160 Å²	160	121.3 Å²	121.3	75%	0.748	72%	0.724	S	S	*	*			trans	66.9	152.5	142.3	-70.4	-153.2	37.5	0	0	120.8
1372	T	27	Very low	30.3	Very low	112 Å²	112	118.1 Å²	118.1	69%	0.687	72%	0.724	S	S	*	*			cis	-159.5	162.9	-9.1	-98.3	0	0	0	0	111.1
1373	V	31.6	Very low	30.4	Very low	132 Å²	132	118.4 Å²	118.4	80%	0.8	73%	0.725	S	S	*	*			trans	-74.9	-176.8	177.6	-107.2	0	0	0	0	113.6
1374	P	35.3	Very low	30	Very low	113 Å²	113	120.6 Å²	120.6	73%	0.734	73%	0.729	S	S	*	*			cis	-144.5	-173.5	19	45.3	-25.2	0	0	0	118.9
1375	A	27.9	Very low	29.8	Very low	98 Å²	98	116.8 Å²	116.8	81%	0.81	73%	0.728	S	S	*	*			trans	69.6	156.5	149.6	0	0	0	0	0	120.3
1376	S	29.2	Very low	29.9	Very low	93 Å²	93	116.2 Å²	116.2	65%	0.65	74%	0.735	S	S	*	*			cis	-173.5	171.3	-24.8	-175.7	0	0	0	0	109.3
1377	I	27.5	Very low	29.7	Very low	145 Å²	145	112.7 Å²	112.7	74%	0.744	73%	0.729	S	S	*	*			trans	75.2	131.3	170	-48.2	169	0	0	0	114.6
1378	G	29	Very low	29.4	Very low	26 Å²	26	116.9 Å²	116.9	27%	0.268	74%	0.739	S	S	.	*			cis	166.4	-157.2	1.2	0	0	0	0	0	113.8	N797	N797-G1378 VanDerWaalsContact ND2-C 3.31Å; N797-G1378 PolarHBondContact ND2-O 3.4Å
1379	Q	31.4	Very low	29.3	Very low	183 Å²	183	114 Å²	114	86%	0.855	74%	0.737	S	S	*	*			trans	68	133.2	170.6	-62.6	-170.5	-4.5	0	0	120.5	N797	N797-Q1379 PolarHBondContact ND2-O 3.02Å
1380	A	31.2	Very low	29.4	Very low	93 Å²	93	115 Å²	115	77%	0.769	75%	0.745	S	S	*	*			trans	-136	165.1	164.5	0	0	0	0	0	108.6
1381	P	35.8	Very low	29.5	Very low	128 Å²	128	114.9 Å²	114.9	83%	0.831	75%	0.746	S	S	*	*			trans	-109.6	139.6	166	35.5	-26.7	0	0	0	112.4
1382	A	28	Very low	29.7	Very low	95 Å²	95	114.4 Å²	114.4	79%	0.785	75%	0.747	S	S	*	*			trans	-132.9	130.1	170.4	0	0	0	0	0	110.3
1383	V	30.7	Very low	29.9	Very low	127 Å²	127	113.3 Å²	113.3	77%	0.77	74%	0.736	S	S	*	*			trans	-148.5	102.5	179.5	-177.8	0	0	0	0	106.3
1384	I	27.5	Very low	30.1	Very low	150 Å²	150	111.4 Å²	111.4	77%	0.769	73%	0.727	S	S	*	*				58.4	101	95.4	-57.4	162	0	0	0	110.8
1385	A	25.7	Very low	29.9	Very low	98 Å²	98	111.3 Å²	111.3	81%	0.81	72%	0.72	S	S	*	*			cis	92.6	113.5	49	0	0	0	0	0	115
1386	A	30.1	Very low	30	Very low	101 Å²	101	109.1 Å²	109.1	84%	0.835	70%	0.702	S	S	*	*			trans	-166	137.9	159.9	0	0	0	0	0	107.7
1387	A	26.8	Very low	30.2	Very low	79 Å²	79	110.1 Å²	110.1	65%	0.653	71%	0.709	S	S	*	*			cis	111.4	136.9	7.9	0	0	0	0	0	114.7
1388	H	28.1	Very low	30.6	Very low	190 Å²	190	109.6 Å²	109.6	88%	0.88	71%	0.712	S	S	*	*			trans	71.7	152.2	175.2	-54.4	-78.1	0	0	0	117.1
1389	A	29.2	Very low	30.8	Very low	90 Å²	90	113.6 Å²	113.6	74%	0.744	73%	0.733	S	S	*	*			cis	-176.7	168.1	-19.6	0	0	0	0	0	109.4
1390	A	31.2	Very low	30.8	Very low	94 Å²	94	113.8 Å²	113.8	78%	0.777	73%	0.734	S	S	*	*			cis	-175.7	171	-32.3	0	0	0	0	0	110.3
1391	S	28.6	Very low	30.6	Very low	106 Å²	106	114.6 Å²	114.6	74%	0.741	73%	0.734	S	S	*	*			trans	75.1	121.9	154.5	-172.6	0	0	0	0	122.3
1392	L	31.6	Very low	30.5	Very low	149 Å²	149	114.7 Å²	114.7	78%	0.78	74%	0.735	S	S	*	*				178	151.6	116.1	-93.6	166.7	0	0	0	112.9
1393	I	32.7	Very low	30.6	Very low	89 Å²	89	115.2 Å²	115.2	46%	0.456	73%	0.733	S	S	.	*			trans	-147.9	140.5	-166.3	-64.8	165.6	0	0	0	113.5	T1296 V1298	T1296-I1393 HydrophobicContact CG2-CG1 3.81Å; T1296-I1393 WeakPolarHBondContact O-CG2 3.36Å; V1298-I1393 HydrophobicContact CG2-CD1 4.06Å
1394	P	34.9	Very low	30.7	Very low	93 Å²	93	119.3 Å²	119.3	60%	0.604	74%	0.735	S	S	*	*			trans	-128.6	-22.5	157.5	26.5	-11.9	0	0	0	121.9	T1294 A1295	T1294-P1394 HydrophobicContact CG2-CG 3.91Å; T1294-P1394 CarbonylContact O-C 3.56Å; T1294-P1394 WeakPolarHBondContact O-CD 3.33Å; T1294-P1394 WeakPolarHBondContact O-CG 3.23Å; A1295-P1394 VanDerWaalsContact O-CD 3.25Å; A1295-P1394 WeakPolarHBondContact O-CD 3.45Å
1395	N	31	Very low	30.8	Very low	110 Å²	110	120.5 Å²	120.5	59%	0.588	74%	0.742	S	S	*	*			trans	81.2	165.9	175.6	-130	-15.2	0	0	0	122.3	T1294 A1295	T1294-N1395 CarbonylContact C-O 3.6Å; T1294-N1395 PolarHBondContact N-O 3.42Å; T1294-N1395 VanDerWaalsContact N-O 3.08Å; T1294-N1395 CarbonylContact O-C 3.6Å; T1294-N1395 VanDerWaalsContact O-CA 3.27Å; T1294-N1395 WeakPolarHBondContact O-CA 3.37Å; T1294-N1395 PolarHBondContact O-N 3.26Å; T1294-N1395 VanDerWaalsContact O-O 3.11Å; A1295-N1395 WeakPolarHBondContact O-CA 3.45Å; A1295-N1395 PolarHBondContact O-N 3.46Å
1396	A	30.7	Very low	31.2	Very low	53 Å²	53	121.5 Å²	121.5	44%	0.438	73%	0.734	S	S	.	*			trans	77	155.2	169.1	0	0	0	0	0	120.1	S1293 T1294	S1293-A1396 CarbonylContact C-O 3.54Å; T1294-A1396 PolarHBondContact N-O 3.21Å
1397	S	33.1	Very low	31.3	Very low	114 Å²	114	121.7 Å²	121.7	80%	0.797	74%	0.735	S	S	*	*			cis	-158.5	165.9	-21.3	-98.4	0	0	0	0	111.4
1398	V	35.3	Very low	31.7	Very low	133 Å²	133	126.7 Å²	126.7	81%	0.806	75%	0.745	S	S	*	*			trans	-94.7	168.5	-179.4	-142.7	0	0	0	0	111.8
1399	P	34.2	Very low	32.2	Very low	110 Å²	110	124.9 Å²	124.9	71%	0.714	75%	0.747	S	S	*	*				-148	157.7	84.8	39	-21.1	0	0	0	117.4
1400	Q	30.1	Very low	32.6	Very low	187 Å²	187	123.5 Å²	123.5	87%	0.874	74%	0.742	S	S	*	*			trans	30.9	147.1	139.4	-57.3	171.5	-0.8	0	0	121
1401	S	28.2	Very low	33.3	Very low	110 Å²	110	126.8 Å²	126.8	77%	0.769	75%	0.746	S	S	*	*			cis	-142.2	165.6	19.8	59.9	0	0	0	0	111.8
1402	P	33.1	Very low	34	Very low	131 Å²	131	126 Å²	126	85%	0.851	75%	0.746	S	S	*	*			trans	-87.7	166.1	-155.2	34.5	-36.7	0	0	0	116.1
1403	S	30.5	Very low	34.6	Very low	106 Å²	106	120.6 Å²	120.6	74%	0.741	73%	0.726	S	S	*	*			trans	-118.4	160.5	173.3	62.4	0	0	0	0	111.2
1404	R	32.1	Very low	35.4	Very low	212 Å²	212	121.1 Å²	121.1	80%	0.8	73%	0.729	S	S	*	*			trans	70.1	131.7	176	-57.1	177.7	80.5	133	3.8	116.9	D1406	R1404-D1406 IonicContact CZ-OD2 3.68Å; R1404-D1406 IonicContact NE-OD2 2.68Å; R1404-D1406 PolarHBondContact NE-OD2 2.97Å; R1404-D1406 IonicContact NH2-OD2 3.95Å
1405	L	29.7	Very low	36.2	Very low	175 Å²	175	123 Å²	123	92%	0.916	73%	0.729	S	S	*	*			trans	-95.4	99.3	163.4	-71.5	161.7	0	0	0	107.2
1406	D	33.7	Very low	37.7	Very low	120 Å²	120	124.6 Å²	124.6	64%	0.642	73%	0.733	S	S	*	*			trans	-130.5	110.2	171.3	-75.2	-62.9	0	0	0	105.8	R1404	R1404-D1406 IonicContact CZ-OD2 3.68Å; R1404-D1406 IonicContact NE-OD2 2.68Å; R1404-D1406 PolarHBondContact NE-OD2 2.97Å; R1404-D1406 IonicContact NH2-OD2 3.95Å
1407	A	33.2	Very low	39.3	Very low	104 Å²	104	129.1 Å²	129.1	86%	0.86	74%	0.743	S	S	*	*			trans	-126.6	74.5	-158.3	0	0	0	0	0	113.5
1408	E	35.2	Very low	40.7	Very low	184 Å²	184	129.3 Å²	129.3	86%	0.86	73%	0.734	S	S	*	*			trans	-129.7	113.2	166.4	-70.7	-165.7	143.2	0	0	110.6
1409	T	38.8	Very low	42	Very low	152 Å²	152	127.5 Å²	127.5	93%	0.933	72%	0.717	S	S	*	*			trans	-164.2	121.8	158.6	-8.1	0	0	0	0	111.8
1410	G	37.1	Very low	43.6	Very low	62 Å²	62	125 Å²	125	64%	0.639	71%	0.705	S	S	*	*			trans	71.5	80	150.8	0	0	0	0	0	119	A1412	G1410-A1412 PolarHBondContact O-N 3.26Å
1411	L	45.9	Very low	45.2	Very low	163 Å²	163	121.7 Å²	121.7	85%	0.853	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	12.3	156.2	-85.6	168.7	0	0	0	113.9	L1414	L1411-L1414 HydrophobicContact CD2-CD1 4.08Å
1412	A	42.7	Very low	47.2	Very low	89 Å²	89	123 Å²	123	74%	0.736	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-26.3	-177.4	0	0	0	0	0	114	G1410 L1414	G1410-A1412 PolarHBondContact O-N 3.26Å; A1412-L1414 PolarHBondContact O-N 3.37Å
1413	G	44.3	Very low	48.7	Very low	35 Å²	35	123.1 Å²	123.1	36%	0.361	68%	0.676	S	S	.	*	H	α-helix	trans	-86.5	3.6	-177.9	0	0	0	0	0	115.4	K1417	G1413-K1417 WeakPolarHBondContact O-CB 3.49Å; G1413-K1417 WeakPolarHBondContact O-CG 3.48Å; G1413-K1417 PolarHBondContact O-N 3.02Å
1414	L	49	Very low	50.5	Low	100 Å²	100	120.6 Å²	120.6	52%	0.524	65%	0.653	S	S	.	*	H	α-helix	trans	-84.6	-31.7	-175.3	-120.2	170.9	0	0	0	112.9	L1411 A1412 K1417 L1418	L1411-L1414 HydrophobicContact CD2-CD1 4.08Å; A1412-L1414 PolarHBondContact O-N 3.37Å; L1414-K1417 PolarHBondContact O-N 2.84Å; L1414-L1418 WeakPolarHBondContact O-CB 3.48Å; L1414-L1418 PolarHBondContact O-N 3.05Å
1415	H	53.1	Low	51.7	Low	132 Å²	132	114.7 Å²	114.7	61%	0.611	63%	0.634	S	S	*	*	H	α-helix	trans	-65.8	-50.1	172.4	-164.6	-80.4	0	0	0	110.6	K1417 L1418 E1419	H1415-K1417 VanDerWaalsContact C-N 3.26Å; H1415-K1417 PolarHBondContact O-N 2.71Å; H1415-L1418 WeakPolarHBondContact O-CA 3.42Å; H1415-L1418 PolarHBondContact O-N 2.86Å; H1415-E1419 IonicContact CE1-OE1 2.79Å; H1415-E1419 IonicContact CE1-OE2 3.94Å; H1415-E1419 PolarHBondContact CE1-OE2 2.89Å; H1415-E1419 VanDerWaalsContact CE1-OE2 3.22Å; H1415-E1419 IonicContact CG-OE2 2.65Å; H1415-E1419 VanDerWaalsContact ND1-CD 3.29Å; H1415-E1419 IonicContact ND1-OE1 3.92Å; H1415-E1419 IonicContact ND1-OE2 2.91Å; H1415-E1419 PolarHBondContact ND1-OE2 3.01Å; H1415-E1419 PolarHBondContact O-N 2.8Å
1416	E	62.6	Low	53	Low	145 Å²	145	110.7 Å²	110.7	68%	0.678	61%	0.613	S	S	*	*	H	α-helix	trans	-58	-36.5	176.5	-172	176.8	-154.8	0	0	112.1	A1420	E1416-A1420 WeakPolarHBondContact O-CB 3.38Å; E1416-A1420 PolarHBondContact O-N 3.4Å
1417	K	62.4	Low	53.8	Low	148 Å²	148	110.8 Å²	110.8	64%	0.643	61%	0.605	S	S	*	*	H	α-helix	trans	-73.4	-31	172	-81.4	-173.7	173.7	-175.8	0	114.5	G1413 L1414 H1415 L1421	G1413-K1417 WeakPolarHBondContact O-CB 3.49Å; G1413-K1417 WeakPolarHBondContact O-CG 3.48Å; G1413-K1417 PolarHBondContact O-N 3.02Å; L1414-K1417 PolarHBondContact O-N 2.84Å; H1415-K1417 VanDerWaalsContact C-N 3.26Å; H1415-K1417 PolarHBondContact O-N 2.71Å; K1417-L1421 WeakPolarHBondContact O-CB 3.35Å; K1417-L1421 WeakPolarHBondContact O-CG 3.33Å; K1417-L1421 PolarHBondContact O-N 2.93Å
1418	L	62.9	Low	54.7	Low	117 Å²	117	114.3 Å²	114.3	61%	0.613	60%	0.596	S	S	*	*	H	α-helix	trans	-72.8	-39.4	174.6	-136.8	80.3	0	0	0	111.1	L1414 H1415 L1421 K1422	L1414-L1418 WeakPolarHBondContact O-CB 3.48Å; L1414-L1418 PolarHBondContact O-N 3.05Å; H1415-L1418 WeakPolarHBondContact O-CA 3.42Å; H1415-L1418 PolarHBondContact O-N 2.86Å; L1418-L1421 PolarHBondContact O-N 2.84Å; L1418-K1422 WeakPolarHBondContact O-CB 3.34Å; L1418-K1422 PolarHBondContact O-N 3.48Å
1419	E	63.5	Low	55.3	Low	96 Å²	96	112.3 Å²	112.3	45%	0.449	59%	0.586	S	S	.	*	H	α-helix	trans	-66.8	-40.7	171.5	-73.6	179.6	118.9	0	0	111.7	H1415 K1422 M1423	H1415-E1419 IonicContact CE1-OE1 2.79Å; H1415-E1419 IonicContact CE1-OE2 3.94Å; H1415-E1419 PolarHBondContact CE1-OE2 2.89Å; H1415-E1419 VanDerWaalsContact CE1-OE2 3.22Å; H1415-E1419 IonicContact CG-OE2 2.65Å; H1415-E1419 VanDerWaalsContact ND1-CD 3.29Å; H1415-E1419 IonicContact ND1-OE1 3.92Å; H1415-E1419 IonicContact ND1-OE2 2.91Å; H1415-E1419 PolarHBondContact ND1-OE2 3.01Å; H1415-E1419 PolarHBondContact O-N 2.8Å; E1419-K1422 PolarHBondContact O-N 2.94Å; E1419-M1423 WeakPolarHBondContact O-CB 3.33Å; E1419-M1423 WeakPolarHBondContact O-CG 3.24Å; E1419-M1423 PolarHBondContact O-N 3.2Å
1420	A	68.5	Low	55.8	Low	56 Å²	56	112 Å²	112	46%	0.463	58%	0.579	S	S	.	*	H	α-helix	trans	-65.4	-36.7	174.1	0	0	0	0	0	112.6	E1416 E1424	E1416-A1420 WeakPolarHBondContact O-CB 3.38Å; E1416-A1420 PolarHBondContact O-N 3.4Å; A1420-E1424 VanDerWaalsContact O-CB 3.24Å; A1420-E1424 WeakPolarHBondContact O-CB 3.34Å; A1420-E1424 PolarHBondContact O-N 3.32Å
1421	L	63.5	Low	56	Low	118 Å²	118	115.7 Å²	115.7	62%	0.618	58%	0.581	S	S	*	*	H	α-helix	trans	-69	-39.3	172.3	-85.6	165.7	0	0	0	112.1	K1417 L1418 E1424 Q1425	K1417-L1421 WeakPolarHBondContact O-CB 3.35Å; K1417-L1421 WeakPolarHBondContact O-CG 3.33Å; K1417-L1421 PolarHBondContact O-N 2.93Å; L1418-L1421 PolarHBondContact O-N 2.84Å; L1421-E1424 PolarHBondContact O-N 3.07Å; L1421-Q1425 WeakPolarHBondContact O-CB 3.32Å; L1421-Q1425 PolarHBondContact O-N 2.98Å
1422	K	70.2	Confident	55.5	Low	138 Å²	138	111.6 Å²	111.6	60%	0.6	58%	0.578	S	S	*	*	H	α-helix	trans	-66.3	-43.3	175.2	-170	175.4	179.4	-175.9	0	111.6	L1418 E1419 Q1425 D1426	L1418-K1422 WeakPolarHBondContact O-CB 3.34Å; L1418-K1422 PolarHBondContact O-N 3.48Å; E1419-K1422 PolarHBondContact O-N 2.94Å; K1422-Q1425 PolarHBondContact O-N 2.68Å; K1422-D1426 PolarHBondContact O-N 3.46Å
1423	M	63.1	Low	55.1	Low	133 Å²	133	115.4 Å²	115.4	66%	0.655	59%	0.587	S	S	*	*	H	α-helix	trans	-64.3	-38.3	172.3	-73.9	-170	-172.2	0	0	112.2	E1419 Q1425 R1427	E1419-M1423 WeakPolarHBondContact O-CB 3.33Å; E1419-M1423 WeakPolarHBondContact O-CG 3.24Å; E1419-M1423 PolarHBondContact O-N 3.2Å; M1423-Q1425 VanDerWaalsContact C-N 3.3Å; M1423-Q1425 PolarHBondContact O-N 3.11Å; M1423-R1427 WeakPolarHBondContact O-CB 3.44Å; M1423-R1427 PolarHBondContact O-N 2.95Å
1424	E	68.4	Low	54.5	Low	54 Å²	54	121.6 Å²	121.6	25%	0.252	61%	0.611	S	S	.	*	H	α-helix	trans	-71.2	-24.9	175.5	177.8	60.2	-167.1	0	0	112.3	A1420 L1421 R1427 R1428	A1420-E1424 VanDerWaalsContact O-CB 3.24Å; A1420-E1424 WeakPolarHBondContact O-CB 3.34Å; A1420-E1424 PolarHBondContact O-N 3.32Å; L1421-E1424 PolarHBondContact O-N 3.07Å; E1424-R1427 VanDerWaalsContact CD-NH2 3.26Å; E1424-R1427 IonicContact OE1-CZ 3.98Å; E1424-R1427 IonicContact OE1-NH2 2.96Å; E1424-R1427 PolarHBondContact OE1-NH2 3.19Å; E1424-R1427 IonicContact OE2-CZ 3.2Å; E1424-R1427 IonicContact OE2-NE 2.78Å; E1424-R1427 PolarHBondContact OE2-NE 2.99Å; E1424-R1427 IonicContact OE2-NH2 2.79Å; E1424-R1427 PolarHBondContact OE2-NH2 2.94Å; E1424-R1428 WeakPolarHBondContact O-CD 3.22Å; E1424-R1428 VanDerWaalsContact O-CG 3.22Å; E1424-R1428 WeakPolarHBondContact O-CG 3.37Å; E1424-R1428 PolarHBondContact O-N 3.33Å; E1424-R1428 IonicContact OE1-CZ 3.61Å; E1424-R1428 VanDerWaalsContact OE1-CZ 3.25Å; E1424-R1428 IonicContact OE1-NE 2.69Å; E1424-R1428 PolarHBondContact OE1-NE 3.47Å; E1424-R1428 IonicContact OE1-NH2 3.64Å; E1424-R1428 PolarHBondContact OE1-NH2 3.32Å
1425	Q	58.1	Low	53.8	Low	88 Å²	88	121.6 Å²	121.6	41%	0.411	63%	0.626	S	S	.	*	H	α-helix	trans	-74.9	-51.3	169	-175.6	169.9	-9.1	0	0	111.4	L1421 K1422 M1423 R1427 R1428 E1429	L1421-Q1425 WeakPolarHBondContact O-CB 3.32Å; L1421-Q1425 PolarHBondContact O-N 2.98Å; K1422-Q1425 PolarHBondContact O-N 2.68Å; M1423-Q1425 VanDerWaalsContact C-N 3.3Å; M1423-Q1425 PolarHBondContact O-N 3.11Å; Q1425-R1427 PolarHBondContact O-N 3.19Å; Q1425-R1428 WeakPolarHBondContact O-CA 3.39Å; Q1425-R1428 WeakPolarHBondContact O-CB 3.22Å; Q1425-R1428 PolarHBondContact O-N 3.31Å; Q1425-E1429 WeakPolarHBondContact CG-OE1 3.37Å; Q1425-E1429 PolarHBondContact NE2-OE1 2.87Å; Q1425-E1429 PolarHBondContact O-N 3.43Å
1426	D	56.1	Low	52.9	Low	90 Å²	90	123.4 Å²	123.4	48%	0.481	64%	0.638	S	S	.	*	H	α-helix	trans	-56.9	-39.2	175.5	-68.2	-22	0	0	0	110.8	K1422 R1428 E1429 D1430	K1422-D1426 PolarHBondContact O-N 3.46Å; D1426-R1428 VanDerWaalsContact C-N 3.26Å; D1426-R1428 PolarHBondContact O-N 2.9Å; D1426-E1429 PolarHBondContact O-N 3.03Å; D1426-D1430 WeakPolarHBondContact O-CB 3.38Å; D1426-D1430 PolarHBondContact O-N 3.09Å
1427	R	51.6	Low	51.6	Low	123 Å²	123	119.1 Å²	119.1	46%	0.464	63%	0.634	S	S	.	*	H	α-helix	trans	-70.8	-13.5	175.5	-162.2	-167.3	70.6	71.3	0.9	114	M1423 E1424 Q1425	M1423-R1427 WeakPolarHBondContact O-CB 3.44Å; M1423-R1427 PolarHBondContact O-N 2.95Å; E1424-R1427 VanDerWaalsContact CD-NH2 3.26Å; E1424-R1427 IonicContact OE1-CZ 3.98Å; E1424-R1427 IonicContact OE1-NH2 2.96Å; E1424-R1427 PolarHBondContact OE1-NH2 3.19Å; E1424-R1427 IonicContact OE2-CZ 3.2Å; E1424-R1427 IonicContact OE2-NE 2.78Å; E1424-R1427 PolarHBondContact OE2-NE 2.99Å; E1424-R1427 IonicContact OE2-NH2 2.79Å; E1424-R1427 PolarHBondContact OE2-NH2 2.94Å; Q1425-R1427 PolarHBondContact O-N 3.19Å
1428	R	51	Low	50.1	Low	178 Å²	178	116.9 Å²	116.9	67%	0.672	63%	0.632	S	S	*	*	H	α-helix	trans	-93.8	-23.8	170.1	-76	171.9	-171.1	-161.6	2.2	112.7	E1424 Q1425 D1426	E1424-R1428 WeakPolarHBondContact O-CD 3.22Å; E1424-R1428 VanDerWaalsContact O-CG 3.22Å; E1424-R1428 WeakPolarHBondContact O-CG 3.37Å; E1424-R1428 PolarHBondContact O-N 3.33Å; E1424-R1428 IonicContact OE1-CZ 3.61Å; E1424-R1428 VanDerWaalsContact OE1-CZ 3.25Å; E1424-R1428 IonicContact OE1-NE 2.69Å; E1424-R1428 PolarHBondContact OE1-NE 3.47Å; E1424-R1428 IonicContact OE1-NH2 3.64Å; E1424-R1428 PolarHBondContact OE1-NH2 3.32Å; Q1425-R1428 WeakPolarHBondContact O-CA 3.39Å; Q1425-R1428 WeakPolarHBondContact O-CB 3.22Å; Q1425-R1428 PolarHBondContact O-N 3.31Å; D1426-R1428 VanDerWaalsContact C-N 3.26Å; D1426-R1428 PolarHBondContact O-N 2.9Å
1429	E	47.9	Very low	48.8	Very low	141 Å²	141	115.9 Å²	115.9	66%	0.659	63%	0.631	S	S	*	*	H	α-helix	trans	-86.2	-17.9	175.5	-64.9	-176.5	-151.6	0	0	112.1	Q1425 D1426	Q1425-E1429 WeakPolarHBondContact CG-OE1 3.37Å; Q1425-E1429 PolarHBondContact NE2-OE1 2.87Å; Q1425-E1429 PolarHBondContact O-N 3.43Å; D1426-E1429 PolarHBondContact O-N 3.03Å
1430	D	49.6	Very low	47.3	Very low	147 Å²	147	117.4 Å²	117.4	79%	0.786	65%	0.647	S	S	*	*	S	Bend	trans	-113.2	22.7	179.7	-154.1	32	0	0	0	114.8	D1426	D1426-D1430 WeakPolarHBondContact O-CB 3.38Å; D1426-D1430 PolarHBondContact O-N 3.09Å
1431	M	41.5	Very low	45.6	Very low	138 Å²	138	120.9 Å²	120.9	68%	0.68	66%	0.663	S	S	*	*			trans	-130.3	84.8	169	-82.5	-167.4	170.2	0	0	111.7
1432	G	34.6	Very low	44.2	Very low	77 Å²	77	123.5 Å²	123.5	79%	0.794	68%	0.678	S	S	*	*			trans	-91.7	140.9	161.7	0	0	0	0	0	111.3
1433	D	34.6	Very low	42.4	Very low	169 Å²	169	120.2 Å²	120.2	90%	0.904	68%	0.682	S	S	*	*			trans	-151.2	143.5	162.8	-130.7	-24.8	0	0	0	110.1
1434	D	32.8	Very low	41.1	Very low	165 Å²	165	123.5 Å²	123.5	88%	0.882	69%	0.693	S	S	*	*			trans	-86.5	121.8	-164.1	-80.1	-66	0	0	0	114.5
1435	A	34.2	Very low	39.7	Very low	101 Å²	101	128.4 Å²	128.4	84%	0.835	72%	0.721	S	S	*	*			trans	-150.6	82.7	169.8	0	0	0	0	0	115.4
1436	I	34.1	Very low	39.1	Very low	169 Å²	169	133.4 Å²	133.4	87%	0.867	74%	0.744	S	S	*	*			trans	-27.7	140	160.2	-55.4	155.8	0	0	0	114.4
1437	G	34.2	Very low	38.8	Very low	56 Å²	56	132.2 Å²	132.2	58%	0.577	74%	0.738	S	S	*	*			cis	151.5	166.6	-1.7	0	0	0	0	0	113
1438	T	32.6	Very low	38.6	Very low	101 Å²	101	130.9 Å²	130.9	62%	0.62	75%	0.745	S	S	*	*			trans	65.5	136.4	173	68.5	0	0	0	0	116.6	Q1782	T1438-Q1782 PolarHBondContact OG1-NE2 3.24Å
1439	T	33.9	Very low	38.8	Very low	95 Å²	95	128.1 Å²	128.1	58%	0.583	74%	0.742	S	S	*	*			cis	-151.5	151	32.3	47.4	0	0	0	0	114.1
1440	T	32.6	Very low	39.3	Very low	128 Å²	128	129 Å²	129	79%	0.785	75%	0.751	S	S	*	*			trans	-3.1	145.9	150.2	56.6	0	0	0	0	119.8
1441	T	33.4	Very low	40	Very low	130 Å²	130	124.4 Å²	124.4	80%	0.798	73%	0.729	S	S	*	*			cis	-146.2	162.4	29.5	48.5	0	0	0	0	114.5
1442	D	34	Very low	40.8	Very low	173 Å²	173	125.2 Å²	125.2	93%	0.925	74%	0.735	S	S	*	*			trans	68.4	118.7	161.1	-130.6	10.3	0	0	0	116.4
1443	G	31.8	Very low	42.5	Very low	68 Å²	68	128.6 Å²	128.6	70%	0.701	73%	0.728	S	S	*	*			trans	-144.4	157.9	-173.1	0	0	0	0	0	112.3
1444	K	35.6	Very low	44.1	Very low	202 Å²	202	120.8 Å²	120.8	88%	0.878	69%	0.687	S	S	*	*			trans	-151.2	113.2	171.6	-136.4	167.8	-171.2	167.7	0	108.2	E1446	K1444-E1446 PolarHBondContact O-N 3.47Å
1445	D	39.9	Very low	45.6	Very low	157 Å²	157	117.1 Å²	117.1	84%	0.84	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-72.4	120.1	-162.4	-47.6	-81.4	0	0	0	112.5
1446	E	45.2	Very low	47.2	Very low	193 Å²	193	115 Å²	115	90%	0.902	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-76	120.1	162.5	-69.4	-168.6	123.4	0	0	109.1	K1444 P1448	K1444-E1446 PolarHBondContact O-N 3.47Å; E1446-P1448 WeakPolarHBondContact O-CD 3.47Å
1447	I	49.1	Very low	48.9	Very low	66 Å²	66	111 Å²	111	34%	0.338	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-80.8	124.5	177.5	-57	170	0	0	0	108.3	I1449 K1461	I1447-I1449 WeakPolarHBondContact O-CG1 3.4Å; I1447-I1449 PolarHBondContact O-N 3.24Å; I1447-I1449 VanDerWaalsContact O-N 3.12Å; I1447-K1461 HydrophobicContact CD1-CD 3.92Å
1448	P	48.3	Very low	50.3	Low	94 Å²	94	110 Å²	110	61%	0.61	61%	0.614	S	S	*	*			trans	-63.7	113.3	172.7	-21.8	34.2	0	0	0	111	E1446 D1450	E1446-P1448 WeakPolarHBondContact O-CD 3.47Å; P1448-D1450 VanDerWaalsContact C-N 3.27Å; P1448-D1450 PolarHBondContact O-N 3.23Å
1449	I	54.5	Low	51.5	Low	120 Å²	120	109.7 Å²	109.7	62%	0.615	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-19.9	-170.9	-62.2	179.6	0	0	0	112.2	I1447 T1451	I1447-I1449 WeakPolarHBondContact O-CG1 3.4Å; I1447-I1449 PolarHBondContact O-N 3.24Å; I1447-I1449 VanDerWaalsContact O-N 3.12Å; I1449-T1451 VanDerWaalsContact C-N 3.34Å; I1449-T1451 PolarHBondContact O-N 2.99Å
1450	D	57.9	Low	52.9	Low	159 Å²	159	106.7 Å²	106.7	85%	0.85	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-9.8	-169	-57.8	-52.2	0	0	0	115.6	P1448	P1448-D1450 VanDerWaalsContact C-N 3.27Å; P1448-D1450 PolarHBondContact O-N 3.23Å
1451	T	65.3	Low	54.3	Low	52 Å²	52	106.3 Å²	106.3	32%	0.319	58%	0.583	S	S	.	*	S	Bend	trans	-89	139.5	173.6	58.8	0	0	0	0	111.4	I1449 K1453 G1454 L1455	I1449-T1451 VanDerWaalsContact C-N 3.34Å; I1449-T1451 PolarHBondContact O-N 2.99Å; T1451-K1453 PolarHBondContact O-N 2.89Å; T1451-K1453 VanDerWaalsContact O-N 3.15Å; T1451-G1454 CarbonylContact O-C 3.48Å; T1451-G1454 WeakPolarHBondContact O-CA 3.29Å; T1451-G1454 PolarHBondContact O-N 3.44Å; T1451-G1454 WeakPolarHBondContact OG1-CA 3.16Å; T1451-G1454 PolarHBondContact OG1-N 3.47Å; T1451-L1455 PolarHBondContact O-N 3.35Å
1452	L	58.5	Low	55.2	Low	154 Å²	154	105.9 Å²	105.9	81%	0.806	58%	0.58	S	S	*	*	H	α-helix	trans	-58.7	-29.6	175.3	-139.5	161.6	0	0	0	111.5	A1456	L1452-A1456 WeakPolarHBondContact O-CB 3.33Å; L1452-A1456 PolarHBondContact O-N 2.95Å
1453	K	69.8	Low	55.9	Low	149 Å²	149	103.3 Å²	103.3	65%	0.648	57%	0.565	S	S	*	*	H	α-helix	trans	-68.8	-48.2	168.8	-176.6	-177.1	169	-170	0	112.5	T1451 L1455 A1456 E1457	T1451-K1453 PolarHBondContact O-N 2.89Å; T1451-K1453 VanDerWaalsContact O-N 3.15Å; K1453-L1455 VanDerWaalsContact C-N 3.3Å; K1453-L1455 PolarHBondContact O-N 2.88Å; K1453-A1456 CarbonylContact O-C 3.33Å; K1453-A1456 PolarHBondContact O-N 2.81Å; K1453-E1457 WeakPolarHBondContact CE-OE1 3.41Å; K1453-E1457 IonicContact NZ-OE1 2.82Å; K1453-E1457 PolarHBondContact O-N 3.41Å
1454	G	69	Low	56.5	Low	5 Å²	5	107.7 Å²	107.7	5%	0.052	57%	0.567	C	S	.	*	H	α-helix	trans	-59.6	-38.7	176.1	0	0	0	0	0	112.7	T1451 E1457 A1458	T1451-G1454 CarbonylContact O-C 3.48Å; T1451-G1454 WeakPolarHBondContact O-CA 3.29Å; T1451-G1454 PolarHBondContact O-N 3.44Å; T1451-G1454 WeakPolarHBondContact OG1-CA 3.16Å; T1451-G1454 PolarHBondContact OG1-N 3.47Å; G1454-E1457 PolarHBondContact O-N 3.06Å; G1454-A1458 VanDerWaalsContact O-CB 3.26Å; G1454-A1458 WeakPolarHBondContact O-CB 3.37Å; G1454-A1458 PolarHBondContact O-N 3.49Å
1455	L	63.8	Low	56.7	Low	87 Å²	87	101.9 Å²	101.9	46%	0.455	56%	0.557	S	S	.	*	H	α-helix	trans	-68.2	-40.7	173.9	-162.3	154.9	0	0	0	111.6	T1451 K1453 A1458 L1459	T1451-L1455 PolarHBondContact O-N 3.35Å; K1453-L1455 VanDerWaalsContact C-N 3.3Å; K1453-L1455 PolarHBondContact O-N 2.88Å; L1455-A1458 PolarHBondContact O-N 2.89Å; L1455-L1459 HydrophobicContact CD2-CD1 3.65Å; L1455-L1459 HydrophobicContact CD2-CG 4.14Å; L1455-L1459 WeakPolarHBondContact O-CB 3.33Å; L1455-L1459 WeakPolarHBondContact O-CG 3.46Å; L1455-L1459 PolarHBondContact O-N 2.95Å
1456	A	67.6	Low	56.4	Low	58 Å²	58	102.8 Å²	102.8	48%	0.479	56%	0.562	S	S	.	*	H	α-helix	trans	-65.3	-38.1	172.9	0	0	0	0	0	112.9	L1452 K1453 G1460	L1452-A1456 WeakPolarHBondContact O-CB 3.33Å; L1452-A1456 PolarHBondContact O-N 2.95Å; K1453-A1456 CarbonylContact O-C 3.33Å; K1453-A1456 PolarHBondContact O-N 2.81Å; A1456-G1460 PolarHBondContact O-N 3.19Å
1457	E	69	Low	55.9	Low	84 Å²	84	96.9 Å²	96.9	39%	0.393	55%	0.553	S	S	.	*	H	α-helix	trans	-71.8	-35.3	174.2	-75.4	-173.2	-159.8	0	0	112.5	K1453 G1454 G1460 K1461	K1453-E1457 WeakPolarHBondContact CE-OE1 3.41Å; K1453-E1457 IonicContact NZ-OE1 2.82Å; K1453-E1457 PolarHBondContact O-N 3.41Å; G1454-E1457 PolarHBondContact O-N 3.06Å; E1457-G1460 PolarHBondContact O-N 3.03Å; E1457-K1461 WeakPolarHBondContact O-CB 3.47Å; E1457-K1461 VanDerWaalsContact O-CG 3.27Å; E1457-K1461 WeakPolarHBondContact O-CG 3.36Å; E1457-K1461 PolarHBondContact O-N 2.89Å; E1457-K1461 IonicContact OE2-NZ 3.63Å
1458	A	63.7	Low	55.2	Low	36 Å²	36	102.9 Å²	102.9	30%	0.298	57%	0.571	S	S	.	*	H	α-helix	trans	-65.7	-46.6	173.2	0	0	0	0	0	111.2	G1454 L1455 G1460 K1461 V1462	G1454-A1458 VanDerWaalsContact O-CB 3.26Å; G1454-A1458 WeakPolarHBondContact O-CB 3.37Å; G1454-A1458 PolarHBondContact O-N 3.49Å; L1455-A1458 PolarHBondContact O-N 2.89Å; A1458-G1460 VanDerWaalsContact C-N 3.33Å; A1458-G1460 PolarHBondContact O-N 2.85Å; A1458-K1461 PolarHBondContact O-N 2.85Å; A1458-V1462 WeakPolarHBondContact O-CG2 3.39Å; A1458-V1462 PolarHBondContact O-N 2.97Å
1459	L	59.3	Low	54.6	Low	93 Å²	93	103.6 Å²	103.6	49%	0.487	57%	0.566	S	S	.	*	H	α-helix	trans	-61.9	-40.7	172	-72.2	177.3	0	0	0	111.5	L1455 K1461 V1462 I1463	L1455-L1459 HydrophobicContact CD2-CD1 3.65Å; L1455-L1459 HydrophobicContact CD2-CG 4.14Å; L1455-L1459 WeakPolarHBondContact O-CB 3.33Å; L1455-L1459 WeakPolarHBondContact O-CG 3.46Å; L1455-L1459 PolarHBondContact O-N 2.95Å; L1459-K1461 PolarHBondContact O-N 3.03Å; L1459-V1462 PolarHBondContact O-N 2.92Å; L1459-I1463 WeakPolarHBondContact O-CB 3.4Å; L1459-I1463 WeakPolarHBondContact O-CD1 3.35Å; L1459-I1463 VanDerWaalsContact O-CG1 3.23Å; L1459-I1463 WeakPolarHBondContact O-CG1 3.23Å; L1459-I1463 PolarHBondContact O-N 3.39Å
1460	G	62	Low	53.7	Low	32 Å²	32	102.6 Å²	102.6	33%	0.33	57%	0.566	S	S	.	*	H	α-helix	trans	-58.1	-47.4	173.9	0	0	0	0	0	112.7	A1456 E1457 A1458 V1462 I1463 H1464	A1456-G1460 PolarHBondContact O-N 3.19Å; E1457-G1460 PolarHBondContact O-N 3.03Å; A1458-G1460 VanDerWaalsContact C-N 3.33Å; A1458-G1460 PolarHBondContact O-N 2.85Å; G1460-V1462 VanDerWaalsContact C-N 3.29Å; G1460-V1462 PolarHBondContact O-N 2.85Å; G1460-I1463 PolarHBondContact O-N 3.01Å; G1460-H1464 PolarHBondContact O-N 3.42Å
1461	K	63.3	Low	52.7	Low	120 Å²	120	100.8 Å²	100.8	52%	0.522	56%	0.561	S	S	.	*	H	α-helix	trans	-66.8	-25.3	177	-74.2	164.5	179.1	164	0	113.3	I1447 E1457 A1458 L1459	I1447-K1461 HydrophobicContact CD1-CD 3.92Å; E1457-K1461 WeakPolarHBondContact O-CB 3.47Å; E1457-K1461 VanDerWaalsContact O-CG 3.27Å; E1457-K1461 WeakPolarHBondContact O-CG 3.36Å; E1457-K1461 PolarHBondContact O-N 2.89Å; E1457-K1461 IonicContact OE2-NZ 3.63Å; A1458-K1461 PolarHBondContact O-N 2.85Å; L1459-K1461 PolarHBondContact O-N 3.03Å
1462	V	51.2	Low	51.3	Low	122 Å²	122	104.3 Å²	104.3	74%	0.739	59%	0.585	S	S	*	*	H	α-helix	trans	-83.8	-23.8	173.6	170.8	0	0	0	0	112.8	A1458 L1459 G1460	A1458-V1462 WeakPolarHBondContact O-CG2 3.39Å; A1458-V1462 PolarHBondContact O-N 2.97Å; L1459-V1462 PolarHBondContact O-N 2.92Å; G1460-V1462 VanDerWaalsContact C-N 3.29Å; G1460-V1462 PolarHBondContact O-N 2.85Å
1463	I	49.5	Very low	50.3	Low	118 Å²	118	104.5 Å²	104.5	61%	0.605	58%	0.583	S	S	*	*	H	α-helix	trans	-97.8	-23.4	-177.1	-67.1	168	0	0	0	112.6	L1459 G1460	L1459-I1463 WeakPolarHBondContact O-CB 3.4Å; L1459-I1463 WeakPolarHBondContact O-CD1 3.35Å; L1459-I1463 VanDerWaalsContact O-CG1 3.23Å; L1459-I1463 WeakPolarHBondContact O-CG1 3.23Å; L1459-I1463 PolarHBondContact O-N 3.39Å; G1460-I1463 PolarHBondContact O-N 3.01Å
1464	H	43.9	Very low	48.9	Very low	161 Å²	161	102.9 Å²	102.9	75%	0.745	59%	0.588	S	S	*	*			trans	-127.2	85.1	-179.8	-73.2	-70.8	0	0	0	113	G1460	G1460-H1464 PolarHBondContact O-N 3.42Å
1465	A	39.8	Very low	47.5	Very low	80 Å²	80	106.8 Å²	106.8	66%	0.661	61%	0.612	S	S	*	*			trans	-130.5	74.7	171.3	0	0	0	0	0	111.2
1466	D	33.3	Very low	46.3	Very low	176 Å²	176	109 Å²	109	94%	0.941	62%	0.624	S	S	*	*			trans	-176.5	111.6	149.8	-103.2	-24.6	0	0	0	110.6
1467	G	35.6	Very low	44.8	Very low	69 Å²	69	114.4 Å²	114.4	71%	0.711	64%	0.639	S	S	*	*			trans	153.7	111.2	166.3	0	0	0	0	0	118.3
1468	R	34.2	Very low	43.6	Very low	191 Å²	191	115.6 Å²	115.6	72%	0.721	65%	0.654	S	S	*	*			trans	74.3	147.3	151.5	-44.8	179.2	84.8	134.7	9.8	116
1469	E	36	Very low	42.2	Very low	109 Å²	109	121.1 Å²	121.1	51%	0.509	68%	0.679	S	S	.	*			cis	-153.2	-173.1	-13.9	-122	169.3	122.6	0	0	111.2	H1633	E1469-H1633 VanDerWaalsContact CD-NE2 3.26Å; E1469-H1633 VanDerWaalsContact CG-NE2 3.33Å; E1469-H1633 WeakPolarHBondContact CG-NE2 3.37Å; E1469-H1633 IonicContact OE1-CD2 3.5Å; E1469-H1633 PolarHBondContact OE1-CD2 3.5Å; E1469-H1633 IonicContact OE1-CE1 3.04Å; E1469-H1633 IonicContact OE1-CG 3.68Å; E1469-H1633 IonicContact OE1-NE2 3.22Å; E1469-H1633 PolarHBondContact OE1-NE2 3.02Å; E1469-H1633 IonicContact OE2-CE1 2.76Å; E1469-H1633 IonicContact OE2-NE2 3.76Å
1470	T	34.2	Very low	41.1	Very low	100 Å²	100	123.3 Å²	123.3	61%	0.613	69%	0.691	S	S	*	*			trans	-47.2	172.7	-174.9	58.2	0	0	0	0	118
1471	T	37.6	Very low	39.9	Very low	121 Å²	121	128.2 Å²	128.2	74%	0.742	71%	0.714	S	S	*	*			cis	-167.6	-167	49	-28.9	0	0	0	0	112.5
1472	P	36.3	Very low	38.5	Very low	126 Å²	126	129.6 Å²	129.6	82%	0.818	73%	0.728	S	S	*	*				-106.2	-171.3	-103.2	42	-26.7	0	0	0	118.4
1473	M	36.8	Very low	37.7	Very low	158 Å²	158	127.8 Å²	127.8	78%	0.778	73%	0.725	S	S	*	*			trans	-129.8	161.9	-171.7	-159.4	-165.9	105.9	0	0	113.7	P1475	M1473-P1475 HydrophobicContact CE-CB 4.26Å
1474	P	40.3	Very low	36.9	Very low	115 Å²	115	127.1 Å²	127.1	75%	0.747	73%	0.731	S	S	*	*			trans	-126.5	168.7	154.3	16.1	7.1	0	0	0	114.8
1475	P	40.9	Very low	36.4	Very low	87 Å²	87	124.9 Å²	124.9	57%	0.565	73%	0.729	S	S	*	*			trans	-134.1	-169	-136.4	46.4	-32.8	0	0	0	119.4	M1473	M1473-P1475 HydrophobicContact CE-CB 4.26Å
1476	D	37.6	Very low	36.1	Very low	132 Å²	132	128.6 Å²	128.6	71%	0.706	73%	0.732	S	S	*	*			trans	72.2	150.3	156	-58	-21.3	0	0	0	120.2
1477	H	36.9	Very low	36.1	Very low	172 Å²	172	127.2 Å²	127.2	80%	0.796	72%	0.72	S	S	*	*			cis	-160.5	-179	-16.9	-116.3	-39.7	0	0	0	109.2
1478	P	43.8	Very low	36	Very low	109 Å²	109	130.7 Å²	130.7	71%	0.708	72%	0.722	S	S	*	*			trans	-122	-179.6	-157	45.6	-37.8	0	0	0	117
1479	D	34.8	Very low	36	Very low	152 Å²	152	129.1 Å²	129.1	81%	0.813	73%	0.726	S	S	*	*			trans	-162.3	-177.7	149	-128	-18.3	0	0	0	114.9
1480	L	34.3	Very low	36	Very low	140 Å²	140	129 Å²	129	73%	0.733	74%	0.737	S	S	*	*			trans	-131.6	-173.3	-136.9	-88.9	158.5	0	0	0	116.6
1481	T	36.8	Very low	36.3	Very low	134 Å²	134	129.7 Å²	129.7	82%	0.822	74%	0.744	S	S	*	*			trans	77.2	155.6	163.6	81.4	0	0	0	0	117.2
1482	D	34.9	Very low	36.2	Very low	150 Å²	150	128.5 Å²	128.5	80%	0.802	74%	0.74	S	S	*	*			cis	-156.8	173.5	-11.6	-146.7	-17.6	0	0	0	112.7
1483	A	34.7	Very low	36.1	Very low	83 Å²	83	130 Å²	130	69%	0.686	74%	0.741	S	S	*	*			trans	23.2	166.4	144.2	0	0	0	0	0	125.1
1484	S	32.1	Very low	35.9	Very low	105 Å²	105	128 Å²	128	73%	0.734	74%	0.74	S	S	*	*			cis	178.6	160.9	-30.5	-172.8	0	0	0	0	112.2
1485	T	33.5	Very low	35.4	Very low	113 Å²	113	129.7 Å²	129.7	69%	0.693	74%	0.743	S	S	*	*			trans	78.8	144.6	151.3	-20.9	0	0	0	0	123.3
1486	Q	34.8	Very low	34.9	Very low	158 Å²	158	131.6 Å²	131.6	74%	0.738	75%	0.753	S	S	*	*			trans	78.9	148	159.3	-51.2	-166.6	56.4	0	0	119.1
1487	Q	33.3	Very low	34.5	Very low	147 Å²	147	132.7 Å²	132.7	69%	0.687	76%	0.758	S	S	*	*			cis	-163.6	165.8	-20.1	-112.1	-170.3	14	0	0	110.8
1488	L	32.1	Very low	34.1	Very low	142 Å²	142	129.5 Å²	129.5	74%	0.743	75%	0.751	S	S	*	*			trans	52.7	104.2	151.7	-77.7	165.6	0	0	0	119
1489	I	33.8	Very low	33.3	Very low	158 Å²	158	130 Å²	130	81%	0.81	75%	0.751	S	S	*	*				-174.6	147.2	75	-92.5	150.2	0	0	0	110.4
1490	S	36.3	Very low	33.1	Very low	106 Å²	106	130.9 Å²	130.9	74%	0.741	75%	0.753	S	S	*	*			trans	-96.3	-178.1	-178.2	-15.7	0	0	0	0	113.1
1491	P	42	Very low	32.8	Very low	116 Å²	116	129.8 Å²	129.8	75%	0.753	76%	0.757	S	S	*	*			cis	-126.6	-169.7	-15.1	35.2	-13.2	0	0	0	111
1492	S	35.4	Very low	32.4	Very low	96 Å²	96	129.3 Å²	129.3	67%	0.671	76%	0.759	S	S	*	*			cis	-156.3	135.8	16.8	-27.6	0	0	0	0	114
1493	N	32.7	Very low	31.9	Very low	157 Å²	157	126.8 Å²	126.8	84%	0.84	76%	0.759	S	S	*	*			trans	65.1	147.9	143.2	-70.6	0.5	0	0	0	122.3
1494	P	33.2	Very low	31.6	Very low	115 Å²	115	129.6 Å²	129.6	75%	0.747	77%	0.767	S	S	*	*			trans	-141	176.4	-133	41.3	-21.5	0	0	0	117.4
1495	D	30	Very low	31.3	Very low	152 Å²	152	134.2 Å²	134.2	81%	0.813	78%	0.777	S	S	*	*			trans	-67.9	162.1	170.5	-52.4	-92.2	0	0	0	115.3
1496	V	30.3	Very low	31.1	Very low	127 Å²	127	131.8 Å²	131.8	77%	0.77	77%	0.774	S	S	*	*			trans	-142.4	98.7	148.1	-177.7	0	0	0	0	110.2
1497	L	29.6	Very low	30.9	Very low	155 Å²	155	130.1 Å²	130.1	81%	0.812	78%	0.78	S	S	*	*			trans	68	140.5	159.8	-52.7	168.5	0	0	0	117.7
1498	T	28.4	Very low	30.7	Very low	105 Å²	105	127.7 Å²	127.7	64%	0.644	79%	0.786	S	S	*	*			cis	-168.6	125.3	-5.5	-96.4	0	0	0	0	111.2
1499	T	27.5	Very low	30.6	Very low	118 Å²	118	126.1 Å²	126.1	72%	0.724	79%	0.786	S	S	*	*			trans	51	118.2	132.6	-49.2	0	0	0	0	119.1
1500	M	29.9	Very low	30.4	Very low	172 Å²	172	122.9 Å²	122.9	85%	0.847	78%	0.778	S	S	*	*			cis	-146.8	173.7	7.4	-54	-166.1	85.1	0	0	112.7
1501	S	27.8	Very low	30	Very low	117 Å²	117	123.3 Å²	123.3	82%	0.818	78%	0.776	S	S	*	*			trans	-158.9	174.1	163.1	-82.1	0	0	0	0	112.7
1502	S	27.7	Very low	29.3	Very low	124 Å²	124	125.2 Å²	125.2	87%	0.867	78%	0.777	S	S	*	*			trans	66.8	79	165.3	65.9	0	0	0	0	120.4
1503	A	25.7	Very low	28.9	Very low	97 Å²	97	127.1 Å²	127.1	80%	0.802	78%	0.778	S	S	*	*			trans	-157.4	146.2	134.7	0	0	0	0	0	106.4
1504	V	27.1	Very low	28.6	Very low	142 Å²	142	127.8 Å²	127.8	86%	0.861	78%	0.776	S	S	*	*			cis	-136.1	138.7	7.1	-177.1	0	0	0	0	108.4
1505	E	25.8	Very low	28.3	Very low	202 Å²	202	128.5 Å²	128.5	94%	0.944	77%	0.773	S	S	*	*			trans	-152.1	147.8	160.2	-160.9	179	-115.1	0	0	108.9
1506	G	30.7	Very low	28.3	Very low	61 Å²	61	127.7 Å²	127.7	63%	0.629	77%	0.768	S	S	*	*			trans	119.5	101.9	167.7	0	0	0	0	0	117.2
1507	S	30.3	Very low	28.2	Very low	124 Å²	124	128.3 Å²	128.3	87%	0.867	77%	0.767	S	S	*	*			trans	66.1	118.7	131	-52.2	0	0	0	0	121.6
1508	A	29.3	Very low	28.1	Very low	96 Å²	96	125 Å²	125	79%	0.793	76%	0.761	S	S	*	*				176.4	149.5	106	0	0	0	0	0	110.1
1509	S	29.4	Very low	28.2	Very low	109 Å²	109	124.8 Å²	124.8	76%	0.762	76%	0.764	S	S	*	*			cis	-165.8	128.1	-17.1	-102	0	0	0	0	106.4
1510	S	29.7	Very low	28.2	Very low	90 Å²	90	125.3 Å²	125.3	63%	0.629	77%	0.767	S	S	*	*				91.1	143.9	90.6	-177.2	0	0	0	0	113.3
1511	T	27.1	Very low	28.2	Very low	114 Å²	114	121.9 Å²	121.9	70%	0.699	76%	0.761	S	S	*	*			trans	60.5	145.4	155	38.1	0	0	0	0	118
1512	M	27.2	Very low	28.4	Very low	156 Å²	156	120.6 Å²	120.6	77%	0.768	76%	0.757	S	S	*	*			cis	-178.1	-178.3	-15.9	-120.8	-178.7	-168.5	0	0	105.3
1513	I	28	Very low	28.5	Very low	136 Å²	136	120.4 Å²	120.4	70%	0.697	75%	0.75	S	S	*	*			trans	69.3	107.3	170.3	-54.1	125.1	0	0	0	111.1
1514	E	26	Very low	28.7	Very low	172 Å²	172	123 Å²	123	80%	0.804	75%	0.751	S	S	*	*				65.8	153.1	73.9	-66	-178.4	126.7	0	0	114.2
1515	D	28	Very low	28.8	Very low	129 Å²	129	119.5 Å²	119.5	69%	0.69	74%	0.737	S	S	*	*			trans	80.5	109.6	159.7	-68.5	-13.6	0	0	0	123.5
1516	I	28.9	Very low	29.1	Very low	135 Å²	135	115.1 Å²	115.1	69%	0.692	73%	0.729	S	S	*	*				89.7	118	116.5	-68.6	170.8	0	0	0	120.5
1517	D	27.4	Very low	29.1	Very low	141 Å²	141	119.7 Å²	119.7	75%	0.754	74%	0.736	S	S	*	*			trans	49.4	100.9	144.2	-64	-20	0	0	0	123.7
1518	A	28.8	Very low	29.3	Very low	84 Å²	84	121 Å²	121	69%	0.694	73%	0.73	S	S	*	*				66.4	179.6	99.6	0	0	0	0	0	121.9
1519	S	29.9	Very low	29.3	Very low	101 Å²	101	123.5 Å²	123.5	71%	0.706	73%	0.73	S	S	*	*			trans	76.9	107.2	171.1	81	0	0	0	0	115.4
1520	T	28.8	Very low	29.5	Very low	129 Å²	129	123.1 Å²	123.1	79%	0.791	73%	0.727	S	S	*	*				60.6	135.5	95.2	62.1	0	0	0	0	114.1
1521	S	29.9	Very low	29.7	Very low	101 Å²	101	127.2 Å²	127.2	71%	0.706	74%	0.739	S	S	*	*			cis	-148.6	159.1	32.8	-46	0	0	0	0	109.5
1522	A	30.1	Very low	30.4	Very low	90 Å²	90	126.8 Å²	126.8	74%	0.744	74%	0.738	S	S	*	*				52.4	142	69.8	0	0	0	0	0	113.4
1523	V	30.3	Very low	31.1	Very low	119 Å²	119	125.3 Å²	125.3	72%	0.721	74%	0.74	S	S	*	*			cis	-152.3	162.7	25.3	-86.1	0	0	0	0	112.3
1524	D	29.9	Very low	31.2	Very low	151 Å²	151	122.6 Å²	122.6	81%	0.807	75%	0.745	S	S	*	*			trans	61	157	144	-70	-5.4	0	0	0	122.2
1525	A	30	Very low	31.4	Very low	70 Å²	70	119 Å²	119	58%	0.579	74%	0.744	S	S	*	*			cis	-173.9	158.7	-28.5	0	0	0	0	0	110
1526	S	31.2	Very low	31.5	Very low	110 Å²	110	121.1 Å²	121.1	77%	0.769	75%	0.75	S	S	*	*			trans	70	154.3	156.9	85.7	0	0	0	0	117.1
1527	M	32.2	Very low	31.6	Very low	157 Å²	157	121.4 Å²	121.4	77%	0.773	75%	0.754	S	S	*	*			cis	-159.4	142.5	-10.3	-126.8	169.8	179.4	0	0	112.3
1528	M	33	Very low	31.7	Very low	152 Å²	152	118.8 Å²	118.8	75%	0.749	75%	0.746	S	S	*	*			trans	54.1	106.2	142.8	-74.7	173.8	164.7	0	0	122.9
1529	N	30.9	Very low	31.8	Very low	147 Å²	147	121.1 Å²	121.1	79%	0.786	75%	0.752	S	S	*	*				74.8	135	115.3	-75.5	21.2	0	0	0	125
1530	S	32.4	Very low	31.9	Very low	102 Å²	102	121.7 Å²	121.7	71%	0.713	75%	0.747	S	S	*	*			trans	84.1	79.6	137.1	-63.1	0	0	0	0	121.9
1531	M	34.6	Very low	32	Very low	176 Å²	176	122.8 Å²	122.8	87%	0.867	74%	0.743	S	S	*	*				33.8	156.8	93.5	-131.7	-158.7	-178.9	0	0	119.5
1532	P	42	Very low	32.2	Very low	104 Å²	104	124.6 Å²	124.6	68%	0.675	74%	0.743	S	S	*	*				-124	-132.7	-67.1	42	-25.6	0	0	0	109.2
1533	P	40.5	Very low	32.5	Very low	126 Å²	126	125.5 Å²	125.5	82%	0.818	74%	0.742	S	S	*	*			cis	-124.2	-174	-39.2	39.5	-24.2	0	0	0	113.2
1534	G	30.9	Very low	32.7	Very low	78 Å²	78	124.8 Å²	124.8	80%	0.804	75%	0.748	S	S	*	*			trans	149.6	88	151	0	0	0	0	0	120.5
1535	A	29.4	Very low	32.8	Very low	96 Å²	96	120.2 Å²	120.2	79%	0.793	73%	0.732	S	S	*	*			trans	2.5	145.7	156.2	0	0	0	0	0	123.6
1536	Q	30.6	Very low	32.8	Very low	174 Å²	174	123.1 Å²	123.1	81%	0.813	74%	0.735	S	S	*	*				179.5	140.7	114.8	-98.9	175.2	25.5	0	0	114.6
1537	N	30.6	Very low	32.8	Very low	142 Å²	142	123.7 Å²	123.7	76%	0.759	73%	0.734	S	S	*	*			trans	45.6	150.7	141.1	-67	1.6	0	0	0	122.5
1538	S	30.6	Very low	32.9	Very low	86 Å²	86	123.5 Å²	123.5	60%	0.601	74%	0.735	S	S	*	*			cis	-174	162.5	-8.7	-91.2	0	0	0	0	110.1
1539	T	30.1	Very low	32.8	Very low	133 Å²	133	120.2 Å²	120.2	82%	0.816	73%	0.727	S	S	*	*			trans	64.1	142.8	163.1	32.6	0	0	0	0	117.5
1540	D	31.9	Very low	32.9	Very low	113 Å²	113	121.4 Å²	121.4	60%	0.604	73%	0.73	S	S	*	*			cis	-153.4	-154.6	-7.8	-144.9	-7.6	0	0	0	107.4
1541	Q	31.8	Very low	32.9	Very low	151 Å²	151	122 Å²	122	71%	0.706	73%	0.725	S	S	*	*			cis	-156	136.2	2.6	-133.6	137.5	67.6	0	0	106
1542	I	33.8	Very low	32.7	Very low	139 Å²	139	122.6 Å²	122.6	71%	0.713	73%	0.726	S	S	*	*				56.7	135.8	97.9	-58	-177.4	0	0	0	115.2
1543	P	36.8	Very low	32.1	Very low	110 Å²	110	126.9 Å²	126.9	71%	0.714	74%	0.737	S	S	*	*			cis	-134.2	150.8	11.8	29.7	-7.7	0	0	0	119.4
1544	A	32.6	Very low	31.6	Very low	103 Å²	103	125.8 Å²	125.8	85%	0.851	73%	0.731	S	S	*	*			trans	62.4	167.2	135.4	0	0	0	0	0	120.9
1545	A	32.6	Very low	31.4	Very low	56 Å²	56	126.6 Å²	126.6	46%	0.463	73%	0.73	S	S	.	*			cis	-149.9	150.1	6.9	0	0	0	0	0	115.2
1546	M	31	Very low	31.4	Very low	130 Å²	130	129.9 Å²	129.9	64%	0.64	73%	0.729	S	S	*	*			trans	59.3	111.4	162.2	-47.5	-175.4	-176.2	0	0	117.5	R1691 T1693	M1546-R1691 VanDerWaalsContact CB-NH2 3.26Å; M1546-R1691 PolarHBondContact O-NE 3.08Å; M1546-R1691 VanDerWaalsContact O-NE 3.17Å; M1546-R1691 PolarHBondContact O-NH2 3.29Å; M1546-T1693 HydrophobicContact SD-CG2 4.45Å
1547	T	31.5	Very low	31.4	Very low	122 Å²	122	126.6 Å²	126.6	75%	0.748	73%	0.725	S	S	*	*			cis	75.2	106.6	39.6	-42	0	0	0	0	116.2	R1691	T1547-R1691 PolarHBondContact O-NH1 3.35Å; T1547-R1691 PolarHBondContact O-NH2 2.96Å
1548	L	32.3	Very low	31.4	Very low	153 Å²	153	127.7 Å²	127.7	80%	0.801	73%	0.728	S	S	*	*				-161.8	132	129.9	-106.2	177.4	0	0	0	109
1549	S	31.2	Very low	31.2	Very low	84 Å²	84	126.7 Å²	126.7	59%	0.587	72%	0.718	S	S	*	*			trans	-120	145	170.8	-178.8	0	0	0	0	108.5	D1551	S1549-D1551 PolarHBondContact OG-OD1 2.84Å
1550	M	34	Very low	31.2	Very low	171 Å²	171	123.7 Å²	123.7	84%	0.842	70%	0.703	S	S	*	*			trans	-140.4	102.6	141.3	-69.6	-169.1	74	0	0	105
1551	D	32.3	Very low	31	Very low	115 Å²	115	122.7 Å²	122.7	62%	0.615	70%	0.704	S	S	*	*				70.2	109.3	85.7	-52.6	-17.2	0	0	0	109.8	S1549	S1549-D1551 PolarHBondContact OG-OD1 2.84Å
1552	Q	29.3	Very low	31.1	Very low	188 Å²	188	122.7 Å²	122.7	88%	0.879	71%	0.708	S	S	*	*				73.5	64.4	58.4	-161.6	-173.5	-32.7	0	0	114
1553	E	31.1	Very low	30.9	Very low	195 Å²	195	121.1 Å²	121.1	91%	0.911	71%	0.705	S	S	*	*			trans	-162.2	148.6	152.4	-108.3	173.6	167.6	0	0	107.7
1554	C	28.9	Very low	30.6	Very low	103 Å²	103	122.7 Å²	122.7	70%	0.696	70%	0.696	S	S	*	*			cis	-139.8	140.7	-3.8	177.5	0	0	0	0	109.8
1555	A	27.8	Very low	30.5	Very low	95 Å²	95	122.8 Å²	122.8	79%	0.785	68%	0.683	S	S	*	*			trans	-136	75.8	168.7	0	0	0	0	0	109
1556	Q	28.2	Very low	30.6	Very low	165 Å²	165	122.8 Å²	122.8	77%	0.771	68%	0.677	S	S	*	*			trans	-169.6	139.3	177.3	-111.6	150.7	88.7	0	0	110.5
1557	S	29.9	Very low	30.6	Very low	104 Å²	104	121.8 Å²	121.8	73%	0.727	68%	0.679	S	S	*	*			trans	61.7	145	160.4	-63.7	0	0	0	0	117.9
1558	M	31	Very low	30.6	Very low	166 Å²	166	119.1 Å²	119.1	82%	0.818	68%	0.675	S	S	*	*			cis	-154.3	169.3	7.8	-133.9	175.3	-68.1	0	0	110.8
1559	T	27.1	Very low	30.6	Very low	65 Å²	65	117.3 Å²	117.3	40%	0.399	67%	0.671	S	S	.	*			trans	-83.5	146.7	172.6	45.9	0	0	0	0	112.3	D1327	D1327-T1559 HydrophobicContact CB-CG2 4.23Å; D1327-T1559 VanDerWaalsContact OD2-CA 3.25Å; D1327-T1559 WeakPolarHBondContact OD2-CA 3.29Å; D1327-T1559 WeakPolarHBondContact OD2-CB 3.4Å
1560	S	29.5	Very low	30.6	Very low	69 Å²	69	122.6 Å²	122.6	48%	0.483	68%	0.683	S	S	.	*			trans	98.4	111.7	141	-57.7	0	0	0	0	122.2	D1327	D1327-S1560 WeakPolarHBondContact OD1-CA 3.2Å; D1327-S1560 PolarHBondContact OD1-N 2.78Å; D1327-S1560 WeakPolarHBondContact OD2-CA 2.65Å; D1327-S1560 PolarHBondContact OD2-N 2.85Å; D1327-S1560 PolarHBondContact OD2-OG 2.81Å
1561	S	28.7	Very low	30.5	Very low	92 Å²	92	122.9 Å²	122.9	64%	0.643	69%	0.687	S	S	*	*			trans	80	151.2	132.7	-70.3	0	0	0	0	123
1562	I	32.5	Very low	30.5	Very low	152 Å²	152	121.1 Å²	121.1	78%	0.779	69%	0.688	S	S	*	*			trans	82	78.4	156	-71.4	164.6	0	0	0	120.3
1563	T	30.7	Very low	30.5	Very low	106 Å²	106	118.1 Å²	118.1	65%	0.65	68%	0.683	S	S	*	*				40.9	132.9	123.1	61.9	0	0	0	0	124.7
1564	R	31.2	Very low	30.5	Very low	142 Å²	142	118 Å²	118	54%	0.536	68%	0.68	S	S	.	*			trans	94.6	112.2	133.9	-82.7	163.7	161	-146.8	-16.3	124	S878 T879 D880	S878-R1564 PolarHBondContact OG-O 2.95Å; T879-R1564 HydrophobicContact CG2-CB 4.17Å; T879-R1564 HydrophobicContact CG2-CG 4.35Å; D880-R1564 IonicContact OD1-CZ 3.71Å; D880-R1564 IonicContact OD1-NH1 2.68Å; D880-R1564 PolarHBondContact OD1-NH1 3.24Å; D880-R1564 IonicContact OD1-NH2 3.53Å; D880-R1564 PolarHBondContact OD1-NH2 2.67Å; D880-R1564 IonicContact OD2-CZ 3.77Å; D880-R1564 IonicContact OD2-NH1 2.81Å; D880-R1564 PolarHBondContact OD2-NH1 2.85Å; D880-R1564 IonicContact OD2-NH2 2.75Å; D880-R1564 PolarHBondContact OD2-NH2 3.48Å
1565	N	30.5	Very low	30.6	Very low	106 Å²	106	121.7 Å²	121.7	57%	0.567	69%	0.687	S	S	*	*			trans	56.9	139.5	141.1	-50.2	2.3	0	0	0	120.8	S878	S878-N1565 WeakPolarHBondContact OG-CB 3.25Å; S878-N1565 PolarHBondContact OG-O 3.19Å
1566	T	33.5	Very low	30.9	Very low	56 Å²	56	122.7 Å²	122.7	34%	0.344	68%	0.679	S	S	.	*			cis	-172.9	158.7	46.2	-168.8	0	0	0	0	114.8	T876 I877	T876-T1566 HydrophobicContact CG2-CG2 4.16Å; I877-T1566 VanDerWaalsContact CA-CG2 3.44Å
1567	T	31.5	Very low	31.2	Very low	109 Å²	109	120.8 Å²	120.8	67%	0.669	67%	0.673	S	S	*	*			trans	31.7	107.2	152.1	52.6	0	0	0	0	122.4
1568	G	31.7	Very low	31.5	Very low	66 Å²	66	124.1 Å²	124.1	68%	0.68	68%	0.678	S	S	*	*				91.6	129.2	94.5	0	0	0	0	0	121.4
1569	T	33.1	Very low	31.8	Very low	114 Å²	114	121.1 Å²	121.1	70%	0.699	67%	0.669	S	S	*	*				-173.3	149.4	119.9	20.4	0	0	0	0	113.7	V873	V873-T1569 WeakPolarHBondContact CG1-OG1 3.34Å
1570	K	30.9	Very low	32.1	Very low	196 Å²	196	121.1 Å²	121.1	85%	0.852	68%	0.675	S	S	*	*			trans	-71.8	150.4	-165	-53.4	167	178.6	178.4	0	116.4
1571	L	32	Very low	32.2	Very low	176 Å²	176	124.9 Å²	124.9	92%	0.921	69%	0.689	S	S	*	*			trans	-177.6	104.2	143.7	-101.3	155.4	0	0	0	107
1572	A	31.3	Very low	32.4	Very low	78 Å²	78	125.3 Å²	125.3	65%	0.645	69%	0.692	S	S	*	*			cis	110.1	132.5	30.1	0	0	0	0	0	111.9
1573	T	29	Very low	32.2	Very low	126 Å²	126	122.6 Å²	122.6	77%	0.773	69%	0.687	S	S	*	*			trans	61.6	93.8	172.2	30.3	0	0	0	0	119
1574	F	32.5	Very low	32.2	Very low	191 Å²	191	124 Å²	124	84%	0.838	70%	0.696	S	S	*	*				-158.2	57.4	123.9	-118.8	-69.2	0	0	0	112.5	N1576	F1574-N1576 VanDerWaalsContact C-N 3.32Å; F1574-N1576 HydrophobicContact CD1-CB 4.42Å; F1574-N1576 PolarHBondContact O-N 2.69Å
1575	E	30.1	Very low	32.1	Very low	182 Å²	182	122.9 Å²	122.9	85%	0.85	70%	0.7	S	S	*	*			trans	-65.9	87.2	166.5	-70.7	173.7	110.3	0	0	110
1576	N	33.8	Very low	32.1	Very low	116 Å²	116	121 Å²	121	62%	0.62	71%	0.705	S	S	*	*			trans	-163.6	14.7	172.9	-113.2	-32.3	0	0	0	115.9	F1574 A1580	F1574-N1576 VanDerWaalsContact C-N 3.32Å; F1574-N1576 HydrophobicContact CD1-CB 4.42Å; F1574-N1576 PolarHBondContact O-N 2.69Å; N1576-A1580 WeakPolarHBondContact O-CB 3.48Å
1577	L	35.4	Very low	31.9	Very low	124 Å²	124	124.6 Å²	124.6	65%	0.649	73%	0.727	S	S	*	*	S	Bend	trans	-119.8	-37.8	-175	-111.7	157.8	0	0	0	114.9	T1579 A1580 L1581	L1577-T1579 VanDerWaalsContact C-N 3.31Å; L1577-A1580 PolarHBondContact O-N 2.77Å; L1577-L1581 HydrophobicContact CD2-CD1 4.45Å; L1577-L1581 PolarHBondContact O-N 3.09Å
1578	E	36.6	Very low	31.9	Very low	174 Å²	174	124.6 Å²	124.6	81%	0.813	72%	0.719	S	S	*	*	H	α-helix	trans	-68.1	-33.2	169.5	-71.3	-178	107	0	0	111.9	A1580 S1582	E1578-A1580 VanDerWaalsContact C-N 3.33Å; E1578-S1582 WeakPolarHBondContact O-CB 3.39Å; E1578-S1582 PolarHBondContact O-N 3.49Å; E1578-S1582 PolarHBondContact O-OG 2.86Å
1579	T	35.6	Very low	31.8	Very low	103 Å²	103	126.4 Å²	126.4	63%	0.632	71%	0.712	S	S	*	*	H	α-helix	trans	-67.9	-32	171.6	-36.9	0	0	0	0	112.2	L1577	L1577-T1579 VanDerWaalsContact C-N 3.31Å
1580	A	34.1	Very low	31.6	Very low	65 Å²	65	128.1 Å²	128.1	54%	0.537	71%	0.706	S	S	.	*	H	α-helix	trans	-76.4	-25.8	-179.4	0	0	0	0	0	113.5	N1576 L1577 E1578	N1576-A1580 WeakPolarHBondContact O-CB 3.48Å; L1577-A1580 PolarHBondContact O-N 2.77Å; E1578-A1580 VanDerWaalsContact C-N 3.33Å
1581	L	32.6	Very low	31.6	Very low	149 Å²	149	128 Å²	128	78%	0.78	71%	0.708	S	S	*	*	H	α-helix	trans	-100.2	-3.4	178.5	-64.9	175.7	0	0	0	113.9	L1577	L1577-L1581 HydrophobicContact CD2-CD1 4.45Å; L1577-L1581 PolarHBondContact O-N 3.09Å
1582	S	31.9	Very low	31.6	Very low	100 Å²	100	124 Å²	124	70%	0.699	69%	0.693	S	S	*	*	S	Bend	trans	-95.1	-1.4	176.6	-60.7	0	0	0	0	114.3	E1578	E1578-S1582 WeakPolarHBondContact O-CB 3.39Å; E1578-S1582 PolarHBondContact O-N 3.49Å; E1578-S1582 PolarHBondContact O-OG 2.86Å
1583	S	28.8	Very low	31.6	Very low	96 Å²	96	128.1 Å²	128.1	67%	0.671	70%	0.704	S	S	*	*			trans	-114.3	50.6	-165.1	-157.4	0	0	0	0	115
1584	T	29.4	Very low	31.7	Very low	136 Å²	136	126.8 Å²	126.8	83%	0.834	71%	0.706	S	S	*	*	S	Bend	trans	-149.3	45.2	164.8	-36.2	0	0	0	0	112.5
1585	L	30.9	Very low	31.8	Very low	118 Å²	118	124 Å²	124	62%	0.618	71%	0.707	S	S	*	*	S	Bend	trans	-150.4	71.3	173.1	-154.6	88.5	0	0	0	114.9	M424	M424-L1585 HydrophobicContact CE-CD2 4.39Å
1586	G	30.3	Very low	31.9	Very low	65 Å²	65	120.7 Å²	120.7	67%	0.67	70%	0.704	S	S	*	*			trans	113.2	131.1	147.3	0	0	0	0	0	118.8
1587	T	28.7	Very low	31.8	Very low	132 Å²	132	120 Å²	120	81%	0.81	71%	0.708	S	S	*	*			trans	82.4	119.9	147.5	63.6	0	0	0	0	121.9
1588	H	30.5	Very low	31.7	Very low	109 Å²	109	124.9 Å²	124.9	51%	0.505	72%	0.718	S	S	.	*			trans	73.8	115.2	139.8	-85.1	-65.2	0	0	0	121.1	K971	K971-H1588 WeakPolarHBondContact CE-CD2 3.25Å; K971-H1588 WeakPolarHBondContact CE-NE2 3.23Å; K971-H1588 PolarHBondContact NZ-ND1 2.9Å
1589	I	30.6	Very low	31.5	Very low	104 Å²	104	123.1 Å²	123.1	53%	0.533	71%	0.714	S	S	.	*				173.1	154.1	107.8	-92.6	148.5	0	0	0	114.9	E994	E994-I1589 HydrophobicContact CB-CD1 3.73Å; E994-I1589 HydrophobicContact CB-CG1 3.89Å; E994-I1589 HydrophobicContact CB-CG2 4.46Å; E994-I1589 HydrophobicContact CG-CD1 3.99Å; E994-I1589 HydrophobicContact CG-CG1 4.34Å; E994-I1589 HydrophobicContact CG-CG2 4.23Å; E994-I1589 WeakPolarHBondContact O-CG1 3.23Å
1590	R	29.7	Very low	31.5	Very low	150 Å²	150	127.4 Å²	127.4	57%	0.566	73%	0.727	S	S	*	*			trans	-88.9	160.8	-174.8	-125.6	-172.4	-158.2	149.8	0.5	114.8	A993 D995	A993-R1590 WeakPolarHBondContact O-CB 3.34Å; D995-R1590 WeakPolarHBondContact OD1-CD 3.41Å; D995-R1590 IonicContact OD1-CZ 3.44Å; D995-R1590 VanDerWaalsContact OD1-CZ 3.31Å; D995-R1590 IonicContact OD1-NE 3.88Å; D995-R1590 IonicContact OD1-NH1 3.64Å; D995-R1590 PolarHBondContact OD1-NH1 3.43Å; D995-R1590 WeakPolarHBondContact OD2-CB 3.49Å; D995-R1590 VanDerWaalsContact OD2-CD 3.22Å; D995-R1590 WeakPolarHBondContact OD2-CD 3.3Å; D995-R1590 WeakPolarHBondContact OD2-CG 3.42Å; D995-R1590 IonicContact OD2-CZ 2.92Å; D995-R1590 IonicContact OD2-NE 2.72Å; D995-R1590 PolarHBondContact OD2-NE 3.16Å; D995-R1590 IonicContact OD2-NH1 3.42Å
1591	Q	30.1	Very low	31.4	Very low	193 Å²	193	130 Å²	130	90%	0.902	74%	0.736	S	S	*	*			trans	-146.7	139.5	136.9	-77.9	-159.4	-5.4	0	0	111.2
1592	P	32.5	Very low	31.4	Very low	93 Å²	93	128.9 Å²	128.9	60%	0.604	74%	0.736	S	S	*	*			trans	-123.5	159.3	171.4	39.3	-28.5	0	0	0	115.4
1593	N	30	Very low	31.5	Very low	164 Å²	164	128.6 Å²	128.6	88%	0.877	74%	0.74	S	S	*	*			trans	65.6	115.3	164.5	-69.9	6.5	0	0	0	120.8
1594	A	31.4	Very low	31.8	Very low	99 Å²	99	130 Å²	130	82%	0.818	75%	0.746	S	S	*	*				-164.5	142.8	119	0	0	0	0	0	110.9
1595	P	35.7	Very low	32	Very low	131 Å²	131	132.3 Å²	132.3	85%	0.851	75%	0.75	S	S	*	*			trans	-112.6	157.5	-172.5	39.9	-32.9	0	0	0	115.6
1596	S	32.4	Very low	32	Very low	114 Å²	114	132.6 Å²	132.6	80%	0.797	76%	0.757	S	S	*	*			trans	-158.4	143.9	152.4	-165	0	0	0	0	112.5
1597	S	31.1	Very low	32.3	Very low	100 Å²	100	135 Å²	135	70%	0.699	76%	0.761	S	S	*	*			trans	-16.4	151.2	170.2	64.2	0	0	0	0	119.2
1598	R	33.2	Very low	32.2	Very low	227 Å²	227	132.5 Å²	132.5	86%	0.857	75%	0.749	S	S	*	*			cis	-167	157.9	41.5	-167.8	170.6	171.4	138.5	-0.7	113.5
1599	D	32.6	Very low	32.1	Very low	138 Å²	138	136.4 Å²	136.4	74%	0.738	76%	0.764	S	S	*	*			trans	-58.8	160.4	174.4	-42.6	-95.8	0	0	0	113.3
1600	E	34.4	Very low	32.1	Very low	192 Å²	192	137.5 Å²	137.5	90%	0.897	78%	0.776	S	S	*	*				-156.2	154.2	63.7	-133.2	172.6	113.3	0	0	116.8
1601	T	33.6	Very low	31.9	Very low	119 Å²	119	136.8 Å²	136.8	73%	0.73	78%	0.784	S	S	*	*			trans	-69	155.3	-170.7	-37.2	0	0	0	0	116.3
1602	T	32.4	Very low	32	Very low	126 Å²	126	136.3 Å²	136.3	77%	0.773	78%	0.781	S	S	*	*				157.8	103	119.9	-63.4	0	0	0	0	116.9
1603	A	32.6	Very low	31.8	Very low	95 Å²	95	142.1 Å²	142.1	79%	0.785	79%	0.791	S	S	*	*			trans	58.5	157.9	133	0	0	0	0	0	123.5
1604	P	35.8	Very low	31.9	Very low	124 Å²	124	142.6 Å²	142.6	81%	0.805	79%	0.792	S	S	*	*			trans	-114.2	174.5	-160.9	43	-34.1	0	0	0	116
1605	M	33	Very low	31.8	Very low	185 Å²	185	141.5 Å²	141.5	91%	0.911	79%	0.79	S	S	*	*			trans	-140.1	149.1	162.9	-66.6	-163.5	75.4	0	0	112.8
1606	T	31.5	Very low	31.6	Very low	125 Å²	125	139.1 Å²	139.1	77%	0.767	79%	0.79	S	S	*	*			trans	-115.2	153.9	168.3	52.7	0	0	0	0	109.9
1607	P	36.8	Very low	31.6	Very low	116 Å²	116	137.9 Å²	137.9	75%	0.753	80%	0.795	S	S	*	*				-142.8	166	104.4	38.9	-24.7	0	0	0	112.2
1608	S	26.5	Very low	31.6	Very low	79 Å²	79	137 Å²	137	55%	0.552	80%	0.802	S	S	*	*			cis	88.5	118.7	13.9	87	0	0	0	0	117.9
1609	F	27.4	Very low	31.6	Very low	191 Å²	191	130.4 Å²	130.4	84%	0.838	80%	0.804	S	S	*	*			trans	65.1	156.1	168	-51	-71.7	0	0	0	117.1
1610	T	30.6	Very low	31.6	Very low	126 Å²	126	128 Å²	128	77%	0.773	81%	0.812	S	S	*	*			cis	-146.4	159.5	-5	-13.5	0	0	0	0	111.4
1611	N	26.4	Very low	31.6	Very low	136 Å²	136	122.9 Å²	122.9	73%	0.727	81%	0.811	S	S	*	*			trans	-71.4	131.3	162.9	158.5	99.2	0	0	0	111.3
1612	E	32.5	Very low	31.6	Very low	182 Å²	182	122 Å²	122	85%	0.85	82%	0.815	S	S	*	*			trans	-140.8	144.1	162.7	-92.4	-77.2	90.8	0	0	109.3
1613	R	27.1	Very low	31.6	Very low	215 Å²	215	123 Å²	123	81%	0.811	82%	0.822	S	S	*	*			trans	-146.9	116.6	-178.4	173.3	-147.1	-81	-158.4	-5.4	109.6
1614	I	31.9	Very low	31.7	Very low	174 Å²	174	122.7 Å²	122.7	89%	0.892	81%	0.813	S	S	*	*			trans	-167.9	146.5	152.3	-100.5	143.6	0	0	0	109.2
1615	G	30.3	Very low	31.4	Very low	76 Å²	76	125.8 Å²	125.8	78%	0.784	82%	0.815	S	S	*	*			trans	-96.9	-177	-169.1	0	0	0	0	0	115.9
1616	G	31.4	Very low	31.3	Very low	82 Å²	82	122.2 Å²	122.2	85%	0.845	81%	0.808	S	S	*	*			trans	-162.3	13.1	-171.2	0	0	0	0	0	120.6
1617	G	31.8	Very low	31.3	Very low	87 Å²	87	124.8 Å²	124.8	90%	0.897	82%	0.815	S	S	*	*			trans	64	166.4	160.2	0	0	0	0	0	120.9
1618	G	32.3	Very low	31	Very low	83 Å²	83	122.6 Å²	122.6	86%	0.856	81%	0.814	S	S	*	*			trans	128.3	65.2	153.4	0	0	0	0	0	120.6
1619	G	33.1	Very low	31.3	Very low	87 Å²	87	125.7 Å²	125.7	90%	0.897	83%	0.829	S	S	*	*			trans	74.2	166	161.2	0	0	0	0	0	117.1
1620	G	32.8	Very low	31.7	Very low	87 Å²	87	122 Å²	122	90%	0.897	83%	0.825	S	S	*	*			cis	157.8	99.5	-7.3	0	0	0	0	0	112.8
1621	G	34.8	Very low	31.9	Very low	85 Å²	85	122.2 Å²	122.2	88%	0.876	83%	0.828	S	S	*	*			trans	172.4	126	175.7	0	0	0	0	0	112.2
1622	A	31.9	Very low	32.3	Very low	100 Å²	100	119.4 Å²	119.4	83%	0.826	82%	0.819	S	S	*	*			trans	-137.9	140	-179.2	0	0	0	0	0	110.7
1623	T	33.9	Very low	32.2	Very low	148 Å²	148	115.5 Å²	115.5	91%	0.908	80%	0.801	S	S	*	*			trans	-136.6	154	160.5	46.4	0	0	0	0	108.3
1624	S	33.5	Very low	32.4	Very low	88 Å²	88	111 Å²	111	62%	0.615	80%	0.802	S	S	*	*			trans	-142.6	176.3	-167.1	176.9	0	0	0	0	109.5
1625	F	29	Very low	32.5	Very low	189 Å²	189	108.1 Å²	108.1	83%	0.829	80%	0.795	S	S	*	*			trans	77.9	145.1	171.8	-49.2	-72.4	0	0	0	115
1626	S	32.2	Very low	32.4	Very low	111 Å²	111	113.8 Å²	113.8	78%	0.776	80%	0.798	S	S	*	*			cis	-151.7	169.6	-1.8	-127.9	0	0	0	0	113
1627	I	31.1	Very low	32.4	Very low	178 Å²	178	115.4 Å²	115.4	91%	0.913	79%	0.794	S	S	*	*			trans	-85.2	136.7	171.3	-66.5	170.3	0	0	0	109.4
1628	G	31.2	Very low	32.3	Very low	70 Å²	70	118 Å²	118	72%	0.722	79%	0.792	S	S	*	*			trans	-170	142.1	176.1	0	0	0	0	0	112.7
1629	T	31.9	Very low	32.4	Very low	144 Å²	144	118.8 Å²	118.8	88%	0.883	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-77.6	164.5	-168.6	18.4	0	0	0	0	115.5
1630	P	35	Very low	32.2	Very low	114 Å²	114	123.6 Å²	123.6	74%	0.74	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-101.9	161.9	-168.3	39.5	-35.9	0	0	0	115.5
1631	P	36.4	Very low	32.3	Very low	130 Å²	130	124.5 Å²	124.5	84%	0.844	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-97.5	166.4	159.3	37.8	-31.6	0	0	0	112.5
1632	S	33.2	Very low	32.2	Very low	78 Å²	78	128.3 Å²	128.3	55%	0.545	78%	0.775	S	S	.	*			trans	-123.1	166.2	-175.2	54.6	0	0	0	0	114.2
1633	H	31.3	Very low	32.3	Very low	100 Å²	100	134.1 Å²	134.1	46%	0.463	78%	0.777	S	S	.	*			trans	67.5	107.8	168.8	-61.3	-71.6	0	0	0	120.4	E1469	E1469-H1633 VanDerWaalsContact CD-NE2 3.26Å; E1469-H1633 VanDerWaalsContact CG-NE2 3.33Å; E1469-H1633 WeakPolarHBondContact CG-NE2 3.37Å; E1469-H1633 IonicContact OE1-CD2 3.5Å; E1469-H1633 PolarHBondContact OE1-CD2 3.5Å; E1469-H1633 IonicContact OE1-CE1 3.04Å; E1469-H1633 IonicContact OE1-CG 3.68Å; E1469-H1633 IonicContact OE1-NE2 3.22Å; E1469-H1633 PolarHBondContact OE1-NE2 3.02Å; E1469-H1633 IonicContact OE2-CE1 2.76Å; E1469-H1633 IonicContact OE2-NE2 3.76Å
1634	S	30.9	Very low	32.4	Very low	120 Å²	120	133.4 Å²	133.4	84%	0.839	77%	0.768	S	S	*	*			trans	-163.4	158.8	133.6	16	0	0	0	0	110.1
1635	P	35.1	Very low	32.5	Very low	114 Å²	114	137.1 Å²	137.1	74%	0.74	78%	0.78	S	S	*	*			trans	-99.7	175.6	-161.8	38.8	-36.8	0	0	0	116
1636	F	27.7	Very low	32.7	Very low	194 Å²	194	136.8 Å²	136.8	85%	0.851	78%	0.779	S	S	*	*			trans	-13.2	138.7	169	-67.2	-85	0	0	0	117.8
1637	P	31.5	Very low	32.9	Very low	117 Å²	117	135.2 Å²	135.2	76%	0.76	78%	0.779	S	S	*	*				-125.3	162.5	97.2	37.2	-35	0	0	0	114.2
1638	V	29.2	Very low	33.3	Very low	141 Å²	141	134 Å²	134	86%	0.855	77%	0.77	S	S	*	*			trans	-71.8	130.4	155.9	-81.1	0	0	0	0	109.1
1639	S	34.2	Very low	34	Very low	100 Å²	100	134.8 Å²	134.8	70%	0.699	76%	0.756	S	S	*	*			trans	-140.1	136.1	160.8	-170.4	0	0	0	0	108.5
1640	E	29.3	Very low	34.4	Very low	188 Å²	188	135.7 Å²	135.7	88%	0.879	76%	0.755	S	S	*	*			trans	-70	144.2	163.4	-66.7	158.9	127	0	0	108.4
1641	C	34.4	Very low	35.4	Very low	105 Å²	105	133.5 Å²	133.5	71%	0.709	74%	0.737	S	S	*	*			trans	-140.1	109.1	173.8	-72.7	0	0	0	0	107.9	Y1643	C1641-Y1643 PolarHBondContact O-N 3.23Å
1642	D	32.7	Very low	35.6	Very low	166 Å²	166	136.8 Å²	136.8	89%	0.888	74%	0.741	S	S	*	*			trans	-61.4	130.5	177.4	-68.6	-75.7	0	0	0	111.8
1643	Y	34.8	Very low	36.4	Very low	221 Å²	221	138.5 Å²	138.5	87%	0.867	75%	0.753	S	S	*	*			trans	-94.4	100.2	161.1	-96.6	-81.9	0	0	0	109	C1641 L1645	C1641-Y1643 PolarHBondContact O-N 3.23Å; Y1643-L1645 PolarHBondContact O-N 3.33Å
1644	D	35.7	Very low	37.4	Very low	134 Å²	134	137.6 Å²	137.6	72%	0.717	75%	0.749	S	S	*	*			trans	-53	128.4	-174.8	-174.2	7	0	0	0	113	K1646	D1644-K1646 PolarHBondContact O-N 3.19Å
1645	L	34.9	Very low	39.6	Very low	166 Å²	166	136.3 Å²	136.3	87%	0.869	73%	0.733	S	S	*	*			trans	-80.1	66.6	176.3	-94.5	74.4	0	0	0	110.8	Y1643	Y1643-L1645 PolarHBondContact O-N 3.33Å
1646	K	34.1	Very low	41.4	Very low	182 Å²	182	135.1 Å²	135.1	79%	0.791	73%	0.725	S	S	*	*			trans	-137.5	106.3	175.1	-131.8	73.8	171.8	-171	0	112.2	D1644	D1644-K1646 PolarHBondContact O-N 3.19Å
1647	G	36.9	Very low	43.6	Very low	77 Å²	77	133.1 Å²	133.1	79%	0.794	72%	0.718	S	S	*	*	S	Bend	trans	127.7	21.2	164.1	0	0	0	0	0	118.6
1648	Q	38.4	Very low	45.4	Very low	152 Å²	152	130 Å²	130	71%	0.71	70%	0.697	S	S	*	*			trans	-153.5	43.5	177.6	-138.6	168.7	95.4	0	0	117.7	K406	K406-Q1648 VanDerWaalsContact CE-OE1 3.24Å
1649	M	45.7	Very low	47.4	Very low	88 Å²	88	125.6 Å²	125.6	43%	0.433	67%	0.668	S	S	.	*			trans	-141.6	84.3	163.6	-87.4	173.4	63.5	0	0	109.8	L1651	M1649-L1651 VanDerWaalsContact C-N 3.32Å; M1649-L1651 HydrophobicContact CE-CD1 3.71Å; M1649-L1651 HydrophobicContact CG-CD1 4.27Å; M1649-L1651 PolarHBondContact O-N 2.62Å; M1649-L1651 VanDerWaalsContact O-N 3.11Å
1650	D	40.8	Very low	49.5	Very low	163 Å²	163	127.3 Å²	127.3	87%	0.872	67%	0.665	S	S	*	*			trans	-76.3	89.2	161.5	-69.8	-26.9	0	0	0	107.9
1651	L	56.1	Low	51.8	Low	68 Å²	68	124.1 Å²	124.1	36%	0.356	65%	0.652	S	S	.	*			trans	-132.8	52.8	177.8	-80.5	166.3	0	0	0	109.8	M1649 S1653 E1654	M1649-L1651 VanDerWaalsContact C-N 3.32Å; M1649-L1651 HydrophobicContact CE-CD1 3.71Å; M1649-L1651 HydrophobicContact CG-CD1 4.27Å; M1649-L1651 PolarHBondContact O-N 2.62Å; M1649-L1651 VanDerWaalsContact O-N 3.11Å; L1651-S1653 PolarHBondContact O-N 2.65Å; L1651-E1654 HydrophobicContact CD2-CG 4.22Å
1652	E	41.9	Very low	53.7	Low	199 Å²	199	122 Å²	122	93%	0.93	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	22	180	-58.6	-163.4	125.4	0	0	113.9
1653	S	48.7	Very low	56.1	Low	114 Å²	114	118.1 Å²	118.1	80%	0.797	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.8	12	-176.9	71.8	0	0	0	0	115.1	L1651	L1651-S1653 PolarHBondContact O-N 2.65Å
1654	E	53.2	Low	58.5	Low	81 Å²	81	115.1 Å²	115.1	38%	0.379	60%	0.602	S	S	.	*	S	Bend	trans	-105.7	151.2	173.7	-71.2	-165.6	134.4	0	0	112.1	L1651 I1659	L1651-E1654 HydrophobicContact CD2-CG 4.22Å; E1654-I1659 HydrophobicContact CB-CD1 4.2Å; E1654-I1659 HydrophobicContact CB-CG1 4.04Å
1655	D	75.4	Confident	60.8	Low	93 Å²	93	113.8 Å²	113.8	50%	0.497	59%	0.591	S	S	.	*			trans	-64.3	134.3	178.7	-169.7	-56.9	0	0	0	111	E1657 V1658 I1659	D1655-E1657 PolarHBondContact O-N 2.97Å; D1655-E1657 VanDerWaalsContact O-N 3.12Å; D1655-E1657 WeakPolarHBondContact OD1-CB 3.08Å; D1655-E1657 PolarHBondContact OD1-N 3.12Å; D1655-V1658 HydrophobicContact CB-CB 4.26Å; D1655-V1658 HydrophobicContact CB-CG2 4.03Å; D1655-V1658 WeakPolarHBondContact O-CA 3.44Å; D1655-V1658 WeakPolarHBondContact O-CB 3.28Å; D1655-V1658 PolarHBondContact O-N 3.04Å; D1655-I1659 PolarHBondContact O-N 3.11Å
1656	P	74.8	Confident	62.8	Low	89 Å²	89	113.6 Å²	113.6	58%	0.578	58%	0.579	S	S	*	*	H	α-helix	trans	-57.7	-24.1	177.7	24.1	-35.5	0	0	0	114.4	Q1660	P1656-Q1660 WeakPolarHBondContact O-CB 3.24Å; P1656-Q1660 WeakPolarHBondContact O-CG 3.42Å; P1656-Q1660 PolarHBondContact O-N 2.77Å; P1656-Q1660 PolarHBondContact O-NE2 3.05Å
1657	E	73.6	Confident	65.2	Low	151 Å²	151	110.8 Å²	110.8	71%	0.706	57%	0.57	S	S	*	*	H	α-helix	trans	-75.6	-36	174	-164.4	162.3	-114.5	0	0	111.6	D1655 Q1660 M1661	D1655-E1657 PolarHBondContact O-N 2.97Å; D1655-E1657 VanDerWaalsContact O-N 3.12Å; D1655-E1657 WeakPolarHBondContact OD1-CB 3.08Å; D1655-E1657 PolarHBondContact OD1-N 3.12Å; E1657-Q1660 PolarHBondContact O-N 2.59Å; E1657-M1661 WeakPolarHBondContact O-CB 3.36Å; E1657-M1661 PolarHBondContact O-N 2.66Å
1658	V	68.5	Low	67.5	Low	52 Å²	52	111.6 Å²	111.6	32%	0.315	55%	0.553	S	S	.	*	H	α-helix	trans	-66.9	-43.7	171	173.7	0	0	0	0	110.8	D1655 Q1660 M1661 I1662	D1655-V1658 HydrophobicContact CB-CB 4.26Å; D1655-V1658 HydrophobicContact CB-CG2 4.03Å; D1655-V1658 WeakPolarHBondContact O-CA 3.44Å; D1655-V1658 WeakPolarHBondContact O-CB 3.28Å; D1655-V1658 PolarHBondContact O-N 3.04Å; V1658-Q1660 VanDerWaalsContact C-N 3.34Å; V1658-Q1660 PolarHBondContact O-N 3.35Å; V1658-M1661 HydrophobicContact CG2-CE 4.36Å; V1658-M1661 WeakPolarHBondContact O-CB 3.38Å; V1658-M1661 PolarHBondContact O-N 2.78Å; V1658-M1661 VanDerWaalsContact O-N 3.15Å; V1658-I1662 HydrophobicContact CG1-CD1 3.86Å; V1658-I1662 HydrophobicContact CG1-CG1 4.43Å; V1658-I1662 WeakPolarHBondContact O-CG1 3.44Å; V1658-I1662 PolarHBondContact O-N 3.37Å
1659	I	71.8	Confident	69.4	Low	49 Å²	49	108.5 Å²	108.5	25%	0.251	54%	0.539	S	S	.	.	H	α-helix	trans	-60.9	-43.8	175.9	-64.4	171.9	0	0	0	110.5	E1654 D1655 M1661 I1662 V1663	E1654-I1659 HydrophobicContact CB-CD1 4.2Å; E1654-I1659 HydrophobicContact CB-CG1 4.04Å; D1655-I1659 PolarHBondContact O-N 3.11Å; I1659-M1661 PolarHBondContact O-N 2.87Å; I1659-I1662 PolarHBondContact O-N 3.03Å; I1659-V1663 HydrophobicContact CG2-CG2 4.5Å; I1659-V1663 WeakPolarHBondContact O-CB 3.4Å; I1659-V1663 WeakPolarHBondContact O-CG2 3.18Å; I1659-V1663 PolarHBondContact O-N 3.22Å
1660	Q	77.9	Confident	71.2	Confident	136 Å²	136	110.3 Å²	110.3	64%	0.636	55%	0.546	S	S	*	.	H	α-helix	trans	-61.7	-40.6	173.8	-80.3	179	69.1	0	0	112.7	P1656 E1657 V1658 V1663 R1664	P1656-Q1660 WeakPolarHBondContact O-CB 3.24Å; P1656-Q1660 WeakPolarHBondContact O-CG 3.42Å; P1656-Q1660 PolarHBondContact O-N 2.77Å; P1656-Q1660 PolarHBondContact O-NE2 3.05Å; E1657-Q1660 PolarHBondContact O-N 2.59Å; V1658-Q1660 VanDerWaalsContact C-N 3.34Å; V1658-Q1660 PolarHBondContact O-N 3.35Å; Q1660-V1663 PolarHBondContact O-N 2.88Å; Q1660-R1664 WeakPolarHBondContact O-CB 3.48Å; Q1660-R1664 PolarHBondContact O-N 3.48Å
1661	M	77.4	Confident	73.3	Confident	121 Å²	121	110.4 Å²	110.4	60%	0.596	54%	0.538	S	S	*	.	H	α-helix	trans	-64.2	-40.8	175.9	177.3	164.5	48	0	0	112.3	E1657 V1658 I1659 R1664 H1665	E1657-M1661 WeakPolarHBondContact O-CB 3.36Å; E1657-M1661 PolarHBondContact O-N 2.66Å; V1658-M1661 HydrophobicContact CG2-CE 4.36Å; V1658-M1661 WeakPolarHBondContact O-CB 3.38Å; V1658-M1661 PolarHBondContact O-N 2.78Å; V1658-M1661 VanDerWaalsContact O-N 3.15Å; I1659-M1661 PolarHBondContact O-N 2.87Å; M1661-R1664 PolarHBondContact O-N 2.88Å; M1661-H1665 WeakPolarHBondContact O-CB 3.39Å; M1661-H1665 PolarHBondContact O-N 3.45Å
1662	I	75.5	Confident	74.7	Confident	61 Å²	61	111.5 Å²	111.5	31%	0.313	54%	0.544	S	S	.	.	H	α-helix	trans	-65.1	-46.3	175	-68.8	167	0	0	0	111	V1658 I1659 H1665 R1666	V1658-I1662 HydrophobicContact CG1-CD1 3.86Å; V1658-I1662 HydrophobicContact CG1-CG1 4.43Å; V1658-I1662 WeakPolarHBondContact O-CG1 3.44Å; V1658-I1662 PolarHBondContact O-N 3.37Å; I1659-I1662 PolarHBondContact O-N 3.03Å; I1662-H1665 PolarHBondContact O-N 2.91Å; I1662-R1666 WeakPolarHBondContact O-CB 3.07Å; I1662-R1666 PolarHBondContact O-N 2.86Å
1663	V	82.1	Confident	76.5	Confident	83 Å²	83	107.1 Å²	107.1	50%	0.503	53%	0.527	S	S	.	.	H	α-helix	trans	-61	-45.5	176.7	168.5	0	0	0	0	110.6	I1659 Q1660 R1666 M1667	I1659-V1663 HydrophobicContact CG2-CG2 4.5Å; I1659-V1663 WeakPolarHBondContact O-CB 3.4Å; I1659-V1663 WeakPolarHBondContact O-CG2 3.18Å; I1659-V1663 PolarHBondContact O-N 3.22Å; Q1660-V1663 PolarHBondContact O-N 2.88Å; V1663-R1666 PolarHBondContact O-N 3.3Å; V1663-M1667 WeakPolarHBondContact O-CB 3.31Å; V1663-M1667 PolarHBondContact O-N 2.78Å
1664	R	84.7	Confident	78.2	Confident	158 Å²	158	105 Å²	105	60%	0.596	50%	0.504	S	S	*	.	H	α-helix	trans	-58.9	-50.9	175.9	-177.6	-179.4	-171.9	133.2	5.3	111.7	Q1660 M1661 R1666 M1667 E1668	Q1660-R1664 WeakPolarHBondContact O-CB 3.48Å; Q1660-R1664 PolarHBondContact O-N 3.48Å; M1661-R1664 PolarHBondContact O-N 2.88Å; R1664-R1666 VanDerWaalsContact C-N 3.34Å; R1664-R1666 PolarHBondContact O-N 2.84Å; R1664-M1667 PolarHBondContact O-N 3.48Å; R1664-E1668 HydrophobicContact CG-CG 4.47Å; R1664-E1668 WeakPolarHBondContact CG-OE1 3.41Å; R1664-E1668 IonicContact CZ-OE1 2.77Å; R1664-E1668 IonicContact NE-OE1 2.79Å; R1664-E1668 PolarHBondContact NE-OE1 3.25Å; R1664-E1668 IonicContact NH2-OE1 3.96Å; R1664-E1668 WeakPolarHBondContact O-CG 3.42Å; R1664-E1668 PolarHBondContact O-N 3.14Å
1665	H	84.4	Confident	79.9	Confident	107 Å²	107	108.7 Å²	108.7	50%	0.495	52%	0.519	S	S	.	.	H	α-helix	trans	-62.3	-41.6	179.9	-171.3	76.9	0	0	0	111.6	M1661 I1662 M1667 E1668 Q1669	M1661-H1665 WeakPolarHBondContact O-CB 3.39Å; M1661-H1665 PolarHBondContact O-N 3.45Å; I1662-H1665 PolarHBondContact O-N 2.91Å; H1665-M1667 VanDerWaalsContact C-N 3.33Å; H1665-M1667 PolarHBondContact O-N 2.7Å; H1665-E1668 PolarHBondContact O-N 2.91Å; H1665-Q1669 PolarHBondContact NE2-NE2 2.9Å; H1665-Q1669 VanDerWaalsContact O-CG 3.26Å; H1665-Q1669 WeakPolarHBondContact O-CG 3.01Å; H1665-Q1669 PolarHBondContact O-N 3.46Å
1666	R	77.6	Confident	80.2	Confident	162 Å²	162	109.3 Å²	109.3	61%	0.611	52%	0.519	S	S	*	.	H	α-helix	trans	-63.2	-38.3	176.5	-168.8	179.6	-69.9	176.1	1	112	I1662 V1663 R1664 H1670	I1662-R1666 WeakPolarHBondContact O-CB 3.07Å; I1662-R1666 PolarHBondContact O-N 2.86Å; V1663-R1666 PolarHBondContact O-N 3.3Å; R1664-R1666 VanDerWaalsContact C-N 3.34Å; R1664-R1666 PolarHBondContact O-N 2.84Å; R1666-H1670 PolarHBondContact O-N 3.33Å
1667	M	83.5	Confident	80.7	Confident	122 Å²	122	112.5 Å²	112.5	60%	0.601	52%	0.519	S	S	*	.	H	α-helix	trans	-68.7	-40.8	174.4	-177.5	175.9	59.8	0	0	112.4	V1663 R1664 H1665 H1670 K1671	V1663-M1667 WeakPolarHBondContact O-CB 3.31Å; V1663-M1667 PolarHBondContact O-N 2.78Å; R1664-M1667 PolarHBondContact O-N 3.48Å; H1665-M1667 VanDerWaalsContact C-N 3.33Å; H1665-M1667 PolarHBondContact O-N 2.7Å; M1667-H1670 PolarHBondContact O-N 2.91Å; M1667-K1671 WeakPolarHBondContact O-CB 3.3Å; M1667-K1671 PolarHBondContact O-N 3.49Å
1668	E	86	Confident	81.1	Confident	94 Å²	94	109.2 Å²	109.2	44%	0.439	51%	0.509	S	S	.	.	H	α-helix	trans	-64.6	-39.7	175.5	-73.2	171.9	-176.1	0	0	111.5	R1664 H1665 K1671 L1672	R1664-E1668 HydrophobicContact CG-CG 4.47Å; R1664-E1668 WeakPolarHBondContact CG-OE1 3.41Å; R1664-E1668 IonicContact CZ-OE1 2.77Å; R1664-E1668 IonicContact NE-OE1 2.79Å; R1664-E1668 PolarHBondContact NE-OE1 3.25Å; R1664-E1668 IonicContact NH2-OE1 3.96Å; R1664-E1668 WeakPolarHBondContact O-CG 3.42Å; R1664-E1668 PolarHBondContact O-N 3.14Å; H1665-E1668 PolarHBondContact O-N 2.91Å; E1668-K1671 PolarHBondContact O-N 2.84Å; E1668-L1672 PolarHBondContact O-N 3.05Å
1669	Q	77.5	Confident	81.7	Confident	87 Å²	87	110.7 Å²	110.7	41%	0.407	51%	0.513	S	S	.	.	H	α-helix	trans	-62.4	-45.8	171.4	-70	-72	-4.3	0	0	112.3	H1665 K1671 L1672 L1673	H1665-Q1669 PolarHBondContact NE2-NE2 2.9Å; H1665-Q1669 VanDerWaalsContact O-CG 3.26Å; H1665-Q1669 WeakPolarHBondContact O-CG 3.01Å; H1665-Q1669 PolarHBondContact O-N 3.46Å; Q1669-K1671 VanDerWaalsContact C-N 3.31Å; Q1669-K1671 PolarHBondContact O-N 3.37Å; Q1669-L1672 PolarHBondContact O-N 3.12Å; Q1669-L1673 WeakPolarHBondContact O-CG 3.39Å; Q1669-L1673 PolarHBondContact O-N 3.37Å
1670	H	83.7	Confident	81.9	Confident	127 Å²	127	112.5 Å²	112.5	59%	0.588	52%	0.522	S	S	*	.	H	α-helix	trans	-61.2	-41.3	177	-165	-83.5	0	0	0	111.7	R1666 M1667 L1672 L1673 E1674	R1666-H1670 PolarHBondContact O-N 3.33Å; M1667-H1670 PolarHBondContact O-N 2.91Å; H1670-L1672 VanDerWaalsContact C-N 3.32Å; H1670-L1672 PolarHBondContact O-N 2.9Å; H1670-L1673 PolarHBondContact O-N 3.3Å; H1670-E1674 PolarHBondContact O-N 3.48Å
1671	K	85.7	Confident	81.9	Confident	164 Å²	164	110.4 Å²	110.4	71%	0.713	51%	0.512	S	S	*	.	H	α-helix	trans	-65.9	-32.5	176.6	-166.6	169	-173.4	169.5	0	112.8	M1667 E1668 Q1669 K1675	M1667-K1671 WeakPolarHBondContact O-CB 3.3Å; M1667-K1671 PolarHBondContact O-N 3.49Å; E1668-K1671 PolarHBondContact O-N 2.84Å; Q1669-K1671 VanDerWaalsContact C-N 3.31Å; Q1669-K1671 PolarHBondContact O-N 3.37Å; K1671-K1675 WeakPolarHBondContact O-CB 3.16Å; K1671-K1675 PolarHBondContact O-N 2.67Å; K1671-K1675 VanDerWaalsContact O-N 3.16Å
1672	L	84.3	Confident	82	Confident	91 Å²	91	111.7 Å²	111.7	48%	0.476	51%	0.511	S	S	.	.	H	α-helix	trans	-72.4	-42.2	173.6	-175.5	61.4	0	0	0	112	E1668 Q1669 H1670 K1675 Q1676	E1668-L1672 PolarHBondContact O-N 3.05Å; Q1669-L1672 PolarHBondContact O-N 3.12Å; H1670-L1672 VanDerWaalsContact C-N 3.32Å; H1670-L1672 PolarHBondContact O-N 2.9Å; L1672-K1675 PolarHBondContact O-N 3.47Å; L1672-Q1676 WeakPolarHBondContact O-CG 3.09Å; L1672-Q1676 PolarHBondContact O-N 3.35Å
1673	L	79.6	Confident	82	Confident	108 Å²	108	112.8 Å²	112.8	57%	0.565	52%	0.517	S	S	*	.	H	α-helix	trans	-63	-46.4	176.3	-74.9	169.2	0	0	0	112	Q1669 H1670 K1675 Q1676 R1677	Q1669-L1673 WeakPolarHBondContact O-CG 3.39Å; Q1669-L1673 PolarHBondContact O-N 3.37Å; H1670-L1673 PolarHBondContact O-N 3.3Å; L1673-K1675 VanDerWaalsContact C-N 3.32Å; L1673-K1675 PolarHBondContact O-N 2.83Å; L1673-Q1676 WeakPolarHBondContact O-CB 3.49Å; L1673-Q1676 PolarHBondContact O-N 3.37Å; L1673-Q1676 VanDerWaalsContact O-N 3.14Å; L1673-R1677 PolarHBondContact O-N 2.83Å
1674	E	85.7	Confident	81.4	Confident	70 Å²	70	115.9 Å²	115.9	33%	0.327	52%	0.519	S	S	.	.	H	α-helix	trans	-66.5	-35.6	177.6	-168.6	55.9	-138.8	0	0	111.2	H1670 Q1676 R1677 V1678	H1670-E1674 PolarHBondContact O-N 3.48Å; E1674-Q1676 VanDerWaalsContact C-N 3.34Å; E1674-Q1676 PolarHBondContact O-N 3.45Å; E1674-R1677 WeakPolarHBondContact O-CB 3.47Å; E1674-R1677 PolarHBondContact O-N 2.86Å; E1674-R1677 WeakPolarHBondContact OE1-CD 3.46Å; E1674-R1677 IonicContact OE1-NH1 3.35Å; E1674-R1677 PolarHBondContact OE1-NH1 3.01Å; E1674-R1677 VanDerWaalsContact OE2-CD 3.27Å; E1674-R1677 WeakPolarHBondContact OE2-CD 3.31Å; E1674-R1677 IonicContact OE2-CZ 3.29Å; E1674-R1677 IonicContact OE2-NH1 3.98Å; E1674-R1677 PolarHBondContact OE2-NH1 2.73Å; E1674-V1678 WeakPolarHBondContact O-CG2 3.49Å; E1674-V1678 PolarHBondContact O-N 2.85Å
1675	K	87.6	Confident	80.8	Confident	157 Å²	157	112.4 Å²	112.4	68%	0.683	52%	0.519	S	S	*	.	H	α-helix	trans	-61.8	-38.9	171.2	-173.1	178.6	179.5	-176.4	0	112.5	K1671 L1672 L1673 E1679	K1671-K1675 WeakPolarHBondContact O-CB 3.16Å; K1671-K1675 PolarHBondContact O-N 2.67Å; K1671-K1675 VanDerWaalsContact O-N 3.16Å; L1672-K1675 PolarHBondContact O-N 3.47Å; L1673-K1675 VanDerWaalsContact C-N 3.32Å; L1673-K1675 PolarHBondContact O-N 2.83Å; K1675-E1679 PolarHBondContact O-N 2.94Å; K1675-E1679 VanDerWaalsContact O-N 3.12Å
1676	Q	82.3	Confident	80.3	Confident	106 Å²	106	113.4 Å²	113.4	50%	0.495	52%	0.522	S	S	.	.	H	α-helix	trans	-67.6	-42	173.9	-72.2	-178.4	11.7	0	0	111.8	L1672 L1673 E1674 E1679 I1680	L1672-Q1676 WeakPolarHBondContact O-CG 3.09Å; L1672-Q1676 PolarHBondContact O-N 3.35Å; L1673-Q1676 WeakPolarHBondContact O-CB 3.49Å; L1673-Q1676 PolarHBondContact O-N 3.37Å; L1673-Q1676 VanDerWaalsContact O-N 3.14Å; E1674-Q1676 VanDerWaalsContact C-N 3.34Å; E1674-Q1676 PolarHBondContact O-N 3.45Å; Q1676-E1679 PolarHBondContact O-N 2.84Å; Q1676-I1680 WeakPolarHBondContact O-CB 3.47Å; Q1676-I1680 VanDerWaalsContact O-CG1 3.26Å; Q1676-I1680 WeakPolarHBondContact O-CG1 2.93Å; Q1676-I1680 PolarHBondContact O-N 3.39Å
1677	R	86	Confident	79.3	Confident	156 Å²	156	112.3 Å²	112.3	59%	0.589	53%	0.527	S	S	*	.	H	α-helix	trans	-58.7	-48.6	175.3	-175.5	-174.3	176.1	-162.6	2.2	111.5	L1673 E1674 E1679 I1680 E1681	L1673-R1677 PolarHBondContact O-N 2.83Å; E1674-R1677 WeakPolarHBondContact O-CB 3.47Å; E1674-R1677 PolarHBondContact O-N 2.86Å; E1674-R1677 WeakPolarHBondContact OE1-CD 3.46Å; E1674-R1677 IonicContact OE1-NH1 3.35Å; E1674-R1677 PolarHBondContact OE1-NH1 3.01Å; E1674-R1677 VanDerWaalsContact OE2-CD 3.27Å; E1674-R1677 WeakPolarHBondContact OE2-CD 3.31Å; E1674-R1677 IonicContact OE2-CZ 3.29Å; E1674-R1677 IonicContact OE2-NH1 3.98Å; E1674-R1677 PolarHBondContact OE2-NH1 2.73Å; R1677-E1679 PolarHBondContact O-N 3.27Å; R1677-I1680 PolarHBondContact O-N 3.45Å; R1677-E1681 PolarHBondContact O-N 2.85Å
1678	V	81.6	Confident	77.3	Confident	82 Å²	82	116.7 Å²	116.7	50%	0.497	54%	0.537	S	S	.	.	H	α-helix	trans	-62.1	-41.4	178.2	171.1	0	0	0	0	111.9	E1674 E1681 R1682	E1674-V1678 WeakPolarHBondContact O-CG2 3.49Å; E1674-V1678 PolarHBondContact O-N 2.85Å; V1678-E1681 PolarHBondContact O-N 3.19Å; V1678-R1682 WeakPolarHBondContact O-CB 3.4Å; V1678-R1682 PolarHBondContact O-N 2.66Å
1679	E	81.8	Confident	75	Confident	84 Å²	84	118.2 Å²	118.2	39%	0.393	55%	0.552	S	S	.	*	H	α-helix	trans	-71	-34.9	176	-166.4	60.5	-137	0	0	112.2	K1675 Q1676 R1677 R1682 L1683 K1686	K1675-E1679 PolarHBondContact O-N 2.94Å; K1675-E1679 VanDerWaalsContact O-N 3.12Å; Q1676-E1679 PolarHBondContact O-N 2.84Å; R1677-E1679 PolarHBondContact O-N 3.27Å; E1679-R1682 PolarHBondContact O-N 3.09Å; E1679-L1683 HydrophobicContact CG-CD1 4.21Å; E1679-L1683 HydrophobicContact CG-CG 4.49Å; E1679-L1683 WeakPolarHBondContact O-CB 3.5Å; E1679-L1683 VanDerWaalsContact O-CG 3.23Å; E1679-L1683 WeakPolarHBondContact O-CG 3.26Å; E1679-L1683 PolarHBondContact O-N 3.47Å; E1679-K1686 IonicContact OE1-NZ 2.61Å
1680	I	75.8	Confident	73.1	Confident	87 Å²	87	119.7 Å²	119.7	45%	0.446	57%	0.569	S	S	.	*	H	α-helix	trans	-63.4	-43.3	172.7	-71.5	166.2	0	0	0	110.8	Q1676 R1677 L1683 R1684	Q1676-I1680 WeakPolarHBondContact O-CB 3.47Å; Q1676-I1680 VanDerWaalsContact O-CG1 3.26Å; Q1676-I1680 WeakPolarHBondContact O-CG1 2.93Å; Q1676-I1680 PolarHBondContact O-N 3.39Å; R1677-I1680 PolarHBondContact O-N 3.45Å; I1680-L1683 PolarHBondContact O-N 2.85Å; I1680-R1684 WeakPolarHBondContact O-CB 3.23Å; I1680-R1684 VanDerWaalsContact O-CG 3.31Å; I1680-R1684 WeakPolarHBondContact O-CG 3.42Å; I1680-R1684 PolarHBondContact O-N 3.36Å
1681	E	78	Confident	70.6	Confident	91 Å²	91	120.2 Å²	120.2	43%	0.425	57%	0.566	S	S	.	*	H	α-helix	trans	-70.1	-34.9	178.2	-147.3	60.3	-109.2	0	0	111.6	R1677 V1678 R1684 S1685	R1677-E1681 PolarHBondContact O-N 2.85Å; V1678-E1681 PolarHBondContact O-N 3.19Å; E1681-R1684 PolarHBondContact O-N 3.26Å; E1681-R1684 VanDerWaalsContact OE1-CD 3.31Å; E1681-R1684 WeakPolarHBondContact OE1-CD 3.43Å; E1681-R1684 IonicContact OE2-NH1 3.17Å; E1681-S1685 VanDerWaalsContact O-CB 3.28Å; E1681-S1685 WeakPolarHBondContact O-CB 3.33Å; E1681-S1685 PolarHBondContact O-N 3.37Å; E1681-S1685 PolarHBondContact O-OG 3.49Å
1682	R	78	Confident	68.3	Low	148 Å²	148	117.1 Å²	117.1	56%	0.558	57%	0.571	S	S	*	*	H	α-helix	trans	-64.2	-38.2	170.5	-175.2	173.8	-179	74.8	-3.8	112.1	V1678 E1679 K1686	V1678-R1682 WeakPolarHBondContact O-CB 3.4Å; V1678-R1682 PolarHBondContact O-N 2.66Å; E1679-R1682 PolarHBondContact O-N 3.09Å; R1682-K1686 WeakPolarHBondContact O-CD 3.39Å; R1682-K1686 VanDerWaalsContact O-CG 3.22Å; R1682-K1686 WeakPolarHBondContact O-CG 3.36Å; R1682-K1686 PolarHBondContact O-N 3.36Å; R1682-K1686 VanDerWaalsContact O-N 3.07Å
1683	L	76.6	Confident	66	Low	84 Å²	84	116.5 Å²	116.5	44%	0.44	57%	0.571	S	S	.	*	H	α-helix	trans	-71.6	-40.2	174.4	-73.5	166.6	0	0	0	112.1	E1679 I1680 K1686 I1687	E1679-L1683 HydrophobicContact CG-CD1 4.21Å; E1679-L1683 HydrophobicContact CG-CG 4.49Å; E1679-L1683 WeakPolarHBondContact O-CB 3.5Å; E1679-L1683 VanDerWaalsContact O-CG 3.23Å; E1679-L1683 WeakPolarHBondContact O-CG 3.26Å; E1679-L1683 PolarHBondContact O-N 3.47Å; I1680-L1683 PolarHBondContact O-N 2.85Å; L1683-K1686 HydrophobicContact CD2-CD 4.31Å; L1683-K1686 PolarHBondContact O-N 2.89Å; L1683-I1687 WeakPolarHBondContact O-CD1 3.45Å; L1683-I1687 WeakPolarHBondContact O-CG1 3.42Å; L1683-I1687 PolarHBondContact O-N 2.99Å
1684	R	69.6	Low	63.9	Low	149 Å²	149	116.8 Å²	116.8	56%	0.562	58%	0.582	S	S	*	*	H	α-helix	trans	-61.1	-44.2	171.9	-74.4	171.1	170.9	-157.2	-4.1	111.7	I1680 E1681 K1686 I1687 R1688	I1680-R1684 WeakPolarHBondContact O-CB 3.23Å; I1680-R1684 VanDerWaalsContact O-CG 3.31Å; I1680-R1684 WeakPolarHBondContact O-CG 3.42Å; I1680-R1684 PolarHBondContact O-N 3.36Å; E1681-R1684 PolarHBondContact O-N 3.26Å; E1681-R1684 VanDerWaalsContact OE1-CD 3.31Å; E1681-R1684 WeakPolarHBondContact OE1-CD 3.43Å; E1681-R1684 IonicContact OE2-NH1 3.17Å; R1684-K1686 VanDerWaalsContact C-N 3.32Å; R1684-K1686 PolarHBondContact O-N 3.07Å; R1684-I1687 PolarHBondContact O-N 2.92Å; R1684-R1688 PolarHBondContact O-N 2.94Å
1685	S	70.7	Confident	61.5	Low	85 Å²	85	120.3 Å²	120.3	59%	0.594	61%	0.608	S	S	*	*	H	α-helix	trans	-63.6	-34.3	176.9	-58.5	0	0	0	0	112.7	E1681 I1687	E1681-S1685 VanDerWaalsContact O-CB 3.28Å; E1681-S1685 WeakPolarHBondContact O-CB 3.33Å; E1681-S1685 PolarHBondContact O-N 3.37Å; E1681-S1685 PolarHBondContact O-OG 3.49Å; S1685-I1687 VanDerWaalsContact C-N 3.28Å; S1685-I1687 PolarHBondContact O-N 2.82Å
1686	K	74.3	Confident	58.8	Low	128 Å²	128	119.7 Å²	119.7	56%	0.557	61%	0.613	S	S	*	*	H	α-helix	trans	-70.1	-19.2	172.7	-73.9	163.1	-179.2	168.3	0	114	E1679 R1682 L1683 R1684	E1679-K1686 IonicContact OE1-NZ 2.61Å; R1682-K1686 WeakPolarHBondContact O-CD 3.39Å; R1682-K1686 VanDerWaalsContact O-CG 3.22Å; R1682-K1686 WeakPolarHBondContact O-CG 3.36Å; R1682-K1686 PolarHBondContact O-N 3.36Å; R1682-K1686 VanDerWaalsContact O-N 3.07Å; L1683-K1686 HydrophobicContact CD2-CD 4.31Å; L1683-K1686 PolarHBondContact O-N 2.89Å; R1684-K1686 VanDerWaalsContact C-N 3.32Å; R1684-K1686 PolarHBondContact O-N 3.07Å
1687	I	56.4	Low	56.6	Low	138 Å²	138	119.7 Å²	119.7	71%	0.708	62%	0.622	S	S	*	*	H	α-helix	trans	-101.1	-25.2	-175.4	-68.5	168	0	0	0	112	L1683 R1684 S1685 V1689	L1683-I1687 WeakPolarHBondContact O-CD1 3.45Å; L1683-I1687 WeakPolarHBondContact O-CG1 3.42Å; L1683-I1687 PolarHBondContact O-N 2.99Å; R1684-I1687 PolarHBondContact O-N 2.92Å; S1685-I1687 VanDerWaalsContact C-N 3.28Å; S1685-I1687 PolarHBondContact O-N 2.82Å; I1687-V1689 PolarHBondContact O-N 2.98Å; I1687-V1689 VanDerWaalsContact O-N 3.12Å
1688	R	42.2	Very low	54.1	Low	214 Å²	214	120.1 Å²	120.1	81%	0.808	63%	0.63	S	S	*	*			trans	-82.1	87.2	177.5	-178.6	172.6	-90.7	166.3	-9.2	111.6	R1684	R1684-R1688 PolarHBondContact O-N 2.94Å
1689	V	38	Very low	51.8	Low	126 Å²	126	123 Å²	123	76%	0.764	64%	0.64	S	S	*	*			trans	-70.5	124.6	161.2	-178.4	0	0	0	0	108.7	I1687	I1687-V1689 PolarHBondContact O-N 2.98Å; I1687-V1689 VanDerWaalsContact O-N 3.12Å
1690	P	37.2	Very low	49.6	Very low	118 Å²	118	126.2 Å²	126.2	77%	0.766	66%	0.659	S	S	*	*			trans	-86.4	131.7	178.3	32.7	-32.1	0	0	0	111.5
1691	R	32	Very low	47.6	Very low	138 Å²	138	124.9 Å²	124.9	52%	0.521	67%	0.666	S	S	.	*			trans	-150.5	113.1	168.4	-166.5	179.7	-158.5	87.8	28.2	111.5	M1546 T1547	M1546-R1691 VanDerWaalsContact CB-NH2 3.26Å; M1546-R1691 PolarHBondContact O-NE 3.08Å; M1546-R1691 VanDerWaalsContact O-NE 3.17Å; M1546-R1691 PolarHBondContact O-NH2 3.29Å; T1547-R1691 PolarHBondContact O-NH1 3.35Å; T1547-R1691 PolarHBondContact O-NH2 2.96Å
1692	A	36.9	Very low	45.7	Very low	100 Å²	100	127.2 Å²	127.2	83%	0.826	68%	0.681	S	S	*	*			trans	-152.9	137.3	166	0	0	0	0	0	108
1693	T	36.8	Very low	43.9	Very low	77 Å²	77	127.3 Å²	127.3	47%	0.472	69%	0.693	S	S	.	*			trans	-135.5	113.5	-170.6	36.5	0	0	0	0	112.1	M1546	M1546-T1693 HydrophobicContact SD-CG2 4.45Å
1694	S	33.9	Very low	42.2	Very low	114 Å²	114	131.9 Å²	131.9	80%	0.797	71%	0.712	S	S	*	*			trans	39.5	116	144.7	-171.6	0	0	0	0	120
1695	V	35.4	Very low	40.8	Very low	144 Å²	144	128.5 Å²	128.5	87%	0.873	72%	0.716	S	S	*	*				-136.9	144.5	128	-146.7	0	0	0	0	108.6
1696	N	31.8	Very low	39.3	Very low	145 Å²	145	131 Å²	131	78%	0.775	72%	0.722	S	S	*	*			trans	-115.8	170.8	174.5	-120.4	-2.8	0	0	0	107.9
1697	P	35.3	Very low	37.7	Very low	105 Å²	105	130.1 Å²	130.1	68%	0.682	73%	0.728	S	S	*	*			cis	-129.5	-159.6	29.1	43.9	-24.5	0	0	0	112.3
1698	E	34.5	Very low	36.8	Very low	166 Å²	166	128.8 Å²	128.8	78%	0.776	73%	0.727	S	S	*	*			cis	-160.8	159.1	23.1	-138.8	-173.7	127.5	0	0	112.4
1699	M	33.6	Very low	36.4	Very low	141 Å²	141	125.2 Å²	125.2	70%	0.695	72%	0.723	S	S	*	*			trans	60.6	123.6	156.4	-70.9	-69.5	-79.4	0	0	122.4
1700	I	35.5	Very low	36.2	Very low	153 Å²	153	125.3 Å²	125.3	79%	0.785	72%	0.724	S	S	*	*			trans	67.6	131.4	160.3	-51	156.9	0	0	0	113.9
1701	G	33.7	Very low	35.9	Very low	58 Å²	58	123.4 Å²	123.4	60%	0.598	72%	0.718	S	S	*	*			cis	142.8	141.8	13.6	0	0	0	0	0	106.8
1702	D	38.4	Very low	36	Very low	141 Å²	141	123.2 Å²	123.2	75%	0.754	73%	0.727	S	S	*	*			cis	-146.2	174.8	7.5	-59.1	-53.3	0	0	0	109.7
1703	D	39.7	Very low	35.7	Very low	149 Å²	149	126.7 Å²	126.7	80%	0.797	73%	0.726	S	S	*	*			trans	34.3	147.5	146.6	-57.7	-19	0	0	0	121.8
1704	E	40.4	Very low	35.2	Very low	181 Å²	181	127.5 Å²	127.5	85%	0.846	74%	0.735	S	S	*	*			cis	-165.4	164.3	1.4	-116.9	-164.4	133.4	0	0	104.9
1705	A	41.2	Very low	35.2	Very low	78 Å²	78	126.6 Å²	126.6	65%	0.645	73%	0.734	S	S	*	*			cis	-156.2	172.8	-9.5	0	0	0	0	0	109.3
1706	D	38.5	Very low	35.1	Very low	136 Å²	136	127.1 Å²	127.1	73%	0.727	73%	0.731	S	S	*	*			trans	-16.4	158.2	152.2	-88.9	-60.1	0	0	0	119.4
1707	T	39.7	Very low	35.1	Very low	111 Å²	111	123.3 Å²	123.3	68%	0.681	73%	0.726	S	S	*	*			cis	-160.4	128.8	44.2	-13.9	0	0	0	0	114.6
1708	T	39.3	Very low	34.9	Very low	110 Å²	110	126.1 Å²	126.1	68%	0.675	74%	0.736	S	S	*	*			trans	59.6	164.8	138.5	57.8	0	0	0	0	122.9
1709	L	33.6	Very low	34.9	Very low	138 Å²	138	123 Å²	123	72%	0.723	74%	0.738	S	S	*	*			cis	167.4	147.2	-44.3	-112.8	164.1	0	0	0	108.5
1710	T	33.1	Very low	34.7	Very low	128 Å²	128	121.3 Å²	121.3	79%	0.785	74%	0.74	S	S	*	*			trans	61.6	155.8	161.9	35.5	0	0	0	0	116.4
1711	A	31.5	Very low	34.5	Very low	79 Å²	79	122.1 Å²	122.1	65%	0.653	75%	0.745	S	S	*	*			cis	-151.4	147.3	34.4	0	0	0	0	0	114.6
1712	L	33.4	Very low	34.5	Very low	134 Å²	134	124.4 Å²	124.4	70%	0.702	75%	0.752	S	S	*	*			trans	49.8	116.8	137.1	-55.5	170.2	0	0	0	118.2
1713	Q	29.9	Very low	34.3	Very low	172 Å²	172	125.7 Å²	125.7	80%	0.804	76%	0.758	S	S	*	*				66.5	139	56.4	-59.3	-176.9	-63.7	0	0	116
1714	S	27.9	Very low	34.2	Very low	95 Å²	95	124.1 Å²	124.1	66%	0.664	76%	0.756	S	S	*	*			trans	61.8	91	148.7	58.5	0	0	0	0	120.4
1715	A	33.2	Very low	33.9	Very low	95 Å²	95	119.8 Å²	119.8	79%	0.785	75%	0.751	S	S	*	*				-127.5	122.1	120.1	0	0	0	0	0	106
1716	L	32.4	Very low	33.6	Very low	155 Å²	155	121.7 Å²	121.7	81%	0.812	76%	0.76	S	S	*	*				53.9	126.9	62.2	-67.6	85.7	0	0	0	112.1
1717	G	32.2	Very low	33.3	Very low	65 Å²	65	120.9 Å²	120.9	67%	0.67	76%	0.762	S	S	*	*			cis	154.2	174.9	-2.4	0	0	0	0	0	112
1718	N	31.4	Very low	33	Very low	164 Å²	164	120.3 Å²	120.3	88%	0.877	76%	0.76	S	S	*	*			trans	66.5	99.3	162.7	-57.3	-10.4	0	0	0	120.2
1719	A	33.4	Very low	33	Very low	99 Å²	99	120.2 Å²	120.2	82%	0.818	76%	0.761	S	S	*	*			trans	175.1	104.4	134.2	0	0	0	0	0	107.6
1720	S	30.5	Very low	32.6	Very low	106 Å²	106	120.3 Å²	120.3	74%	0.741	76%	0.763	S	S	*	*			cis	72.1	130.3	20.5	-155.7	0	0	0	0	115.7
1721	L	32.1	Very low	32.2	Very low	170 Å²	170	119 Å²	119	89%	0.89	75%	0.754	S	S	*	*			trans	69.5	142.4	-173.6	-47.6	178.3	0	0	0	113.9
1722	S	33.6	Very low	31.9	Very low	107 Å²	107	123.3 Å²	123.3	75%	0.748	76%	0.761	S	S	*	*			cis	-149.4	147.2	5.6	52.1	0	0	0	0	113
1723	L	33.4	Very low	31.6	Very low	167 Å²	167	122.6 Å²	122.6	87%	0.874	76%	0.762	S	S	*	*			trans	-67.1	149	166.2	-69.8	162.1	0	0	0	111.8
1724	P	37.1	Very low	31.7	Very low	117 Å²	117	120 Å²	120	76%	0.76	76%	0.758	S	S	*	*				-123.4	126.2	114.8	34.2	-29.4	0	0	0	110.3
1725	A	34.2	Very low	31.9	Very low	89 Å²	89	124 Å²	124	74%	0.736	76%	0.764	S	S	*	*				76.5	112.2	67.7	0	0	0	0	0	113.4
1726	S	34.7	Very low	31.9	Very low	119 Å²	119	125.3 Å²	125.3	83%	0.832	76%	0.762	S	S	*	*			trans	-58.1	161.6	170	-31.2	0	0	0	0	111.6
1727	P	33.3	Very low	31.8	Very low	119 Å²	119	124.1 Å²	124.1	77%	0.773	76%	0.756	S	S	*	*			cis	-144.4	-146.3	42.6	46.4	-25.9	0	0	0	111.5
1728	P	33.8	Very low	31.6	Very low	98 Å²	98	126.2 Å²	126.2	64%	0.636	76%	0.756	S	S	*	*			cis	-124.2	-178.7	-26.9	42.4	-28.6	0	0	0	112.7
1729	P	37.9	Very low	31.5	Very low	108 Å²	108	124 Å²	124	70%	0.701	75%	0.749	S	S	*	*			trans	-76.6	168.8	148.8	34.7	-34.4	0	0	0	111.5
1730	N	24.7	Very low	31.4	Very low	141 Å²	141	124.5 Å²	124.5	75%	0.754	74%	0.741	S	S	*	*			trans	84.4	151	-177	-56.9	-7.5	0	0	0	115.8
1731	T	26.2	Very low	31.5	Very low	100 Å²	100	126 Å²	126	61%	0.613	74%	0.74	S	S	*	*			cis	-168.4	166.6	-30.6	36.9	0	0	0	0	106.9
1732	E	25.3	Very low	31.5	Very low	169 Å²	169	122.7 Å²	122.7	79%	0.79	73%	0.728	S	S	*	*			trans	67.3	159.3	159.5	-70.8	162.8	115.7	0	0	117.2
1733	T	26.9	Very low	31.4	Very low	119 Å²	119	121.9 Å²	121.9	73%	0.73	72%	0.723	S	S	*	*			cis	-144.7	177.4	1.1	-8.9	0	0	0	0	110.4
1734	T	32	Very low	31.3	Very low	117 Å²	117	118.8 Å²	118.8	72%	0.718	71%	0.707	S	S	*	*			trans	86.5	116.5	162.6	-46.9	0	0	0	0	115
1735	K	32.1	Very low	31	Very low	181 Å²	181	116 Å²	116	79%	0.787	69%	0.687	S	S	*	*			cis	-161.5	146.4	2.9	-116.3	169.1	-166.9	166.8	0	111.2
1736	V	32.5	Very low	30.8	Very low	121 Å²	121	116.7 Å²	116.7	73%	0.733	68%	0.678	S	S	*	*			trans	66.1	126	151.7	177.6	0	0	0	0	117.5
1737	N	29.6	Very low	30.5	Very low	131 Å²	131	112.2 Å²	112.2	70%	0.701	65%	0.649	S	S	*	*			cis	-159.7	136.4	-8.5	-115.3	16	0	0	0	111.3
1738	T	29.4	Very low	30.4	Very low	109 Å²	109	109.7 Å²	109.7	67%	0.669	63%	0.631	S	S	*	*			trans	45.2	145.4	131.2	6.1	0	0	0	0	121.7
1739	T	29.8	Very low	30.2	Very low	118 Å²	118	110.7 Å²	110.7	72%	0.724	62%	0.622	S	S	*	*			cis	-164.6	159	26	-27.2	0	0	0	0	112.7
1740	V	31.3	Very low	29.7	Very low	109 Å²	109	109.3 Å²	109.3	66%	0.661	61%	0.607	S	S	*	*			trans	67.2	122.2	160.8	-175.8	0	0	0	0	117.7
1741	I	30.8	Very low	29.9	Very low	138 Å²	138	107 Å²	107	71%	0.708	60%	0.599	S	S	*	*			cis	62.2	120.5	-5.5	-54.4	178.9	0	0	0	115.9
1742	P	33.5	Very low	30.2	Very low	99 Å²	99	109.9 Å²	109.9	64%	0.643	61%	0.607	S	S	*	*			cis	-123.4	169.9	39.2	14.8	10.9	0	0	0	114.6
1743	S	30.4	Very low	30.2	Very low	91 Å²	91	105.9 Å²	105.9	64%	0.636	60%	0.598	S	S	*	*			cis	86	135.9	32.8	-45.8	0	0	0	0	116.1
1744	D	32.2	Very low	30.4	Very low	101 Å²	101	108.5 Å²	108.5	54%	0.54	60%	0.602	S	S	.	*			trans	149.3	134.4	131.1	-87.7	27.6	0	0	0	114.2	Q782	Q782-D1744 PolarHBondContact NE2-OD2 3.18Å
1745	V	31.1	Very low	30.2	Very low	58 Å²	58	107.9 Å²	107.9	35%	0.352	60%	0.602	S	S	.	*			cis	-169.7	-167.3	-16.8	42.3	0	0	0	0	108.4	Q782 Q783 S784	Q782-V1745 HydrophobicContact CB-CB 4.02Å; Q782-V1745 HydrophobicContact CB-CG1 3.93Å; Q782-V1745 HydrophobicContact CB-CG2 3.71Å; Q782-V1745 HydrophobicContact CG-CG1 4.1Å; Q783-V1745 VanDerWaalsContact O-CG1 3.28Å; Q783-V1745 WeakPolarHBondContact O-CG1 3.34Å; S784-V1745 WeakPolarHBondContact CB-O 3.47Å; S784-V1745 CarbonylContact O-C 3.2Å; S784-V1745 PolarHBondContact OG-O 3.4Å
1746	L	28.6	Very low	30.2	Very low	104 Å²	104	103.8 Å²	103.8	55%	0.545	60%	0.596	S	S	.	*			cis	150	50.2	1	177.2	178.5	0	0	0	119.6	Q782 Q783 S784	Q782-L1746 CarbonylContact C-O 3.36Å; Q783-L1746 CarbonylContact C-O 3.54Å; Q783-L1746 WeakPolarHBondContact CA-O 3.22Å; Q783-L1746 PolarHBondContact N-O 3.31Å; S784-L1746 VanDerWaalsContact N-N 3.18Å; S784-L1746 PolarHBondContact N-O 3.17Å; S784-L1746 CarbonylContact O-C 3.43Å; S784-L1746 WeakPolarHBondContact O-CA 3.48Å; S784-L1746 PolarHBondContact O-N 3.18Å
1747	A	28.7	Very low	30.2	Very low	25 Å²	25	103.7 Å²	103.7	21%	0.207	60%	0.596	C	S	.	*	B	Isolated β-bridge	trans	81.1	177.4	177	0	0	0	0	0	121.4	S784 A785	S784-A1747 VanDerWaalsContact C-N 3.25Å; S784-A1747 CarbonylContact C-O 3.22Å; S784-A1747 WeakPolarHBondContact CA-O 3.36Å; S784-A1747 PolarHBondContact N-O 2.71Å; S784-A1747 PolarHBondContact O-N 2.93Å; A785-A1747 VanDerWaalsContact CB-C 3.47Å
1748	T	32.4	Very low	30.3	Very low	66 Å²	66	106.5 Å²	106.5	41%	0.405	60%	0.602	S	S	.	*			trans	116.7	129.2	166.5	-53.8	0	0	0	0	116.9	S778 A785	S778-T1748 WeakPolarHBondContact CB-OG1 3.41Å; S778-T1748 PolarHBondContact OG-OG1 2.86Å; A785-T1748 WeakPolarHBondContact CB-O 3.36Å
1749	R	27.9	Very low	30.6	Very low	120 Å²	120	105.9 Å²	105.9	45%	0.453	60%	0.602	S	S	.	*			cis	-164.3	29	-5.3	-123.8	-157.4	163.1	-118.7	-13.8	120.4	Q776 T777	Q776-R1749 HydrophobicContact CB-CG 4.23Å; Q776-R1749 VanDerWaalsContact CD-CZ 3.44Å; Q776-R1749 VanDerWaalsContact CD-NH1 3.27Å; Q776-R1749 HydrophobicContact CG-CG 3.95Å; Q776-R1749 VanDerWaalsContact CG-O 3.25Å; Q776-R1749 WeakPolarHBondContact CG-O 3.45Å; Q776-R1749 PolarHBondContact NE2-O 2.79Å; Q776-R1749 VanDerWaalsContact OE1-NH2 3.1Å; T777-R1749 HydrophobicContact CG2-CG 4.28Å; T777-R1749 VanDerWaalsContact CG2-NE 3.29Å; T777-R1749 PolarHBondContact OG1-NH2 3.4Å
1750	M	29.2	Very low	30.9	Very low	79 Å²	79	105.2 Å²	105.2	39%	0.389	60%	0.603	S	S	.	*			trans	74	157.5	169.4	-150.7	-137.3	-30	0	0	120.2	T775 Q776	T775-M1750 WeakPolarHBondContact CB-SD 3.49Å; T775-M1750 HydrophobicContact CG2-CG 3.88Å; T775-M1750 HydrophobicContact CG2-SD 4.13Å; T775-M1750 VanDerWaalsContact OG1-CE 3.23Å; T775-M1750 WeakPolarHBondContact OG1-CE 3.47Å; T775-M1750 PolarHBondContact OG1-SD 2.78Å; Q776-M1750 HydrophobicContact CG-CB 3.82Å; Q776-M1750 HydrophobicContact CG-CE 3.68Å
1751	T	27.6	Very low	31	Very low	93 Å²	93	107.2 Å²	107.2	57%	0.571	61%	0.61	S	S	*	*			trans	66.5	114.6	153.6	27.9	0	0	0	0	122.5
1752	M	31.9	Very low	31.2	Very low	159 Å²	159	105.7 Å²	105.7	78%	0.783	61%	0.606	S	S	*	*				-176.2	134.4	115.7	-85.6	-94.2	158.5	0	0	105.9
1753	S	26.1	Very low	31.2	Very low	86 Å²	86	105.7 Å²	105.7	60%	0.601	61%	0.608	S	S	*	*				73.7	133	57.5	-54.5	0	0	0	0	113.7
1754	Q	32	Very low	31.4	Very low	173 Å²	173	107.6 Å²	107.6	81%	0.808	62%	0.616	S	S	*	*			trans	79.9	112.6	-176.8	-55.7	166.3	106.9	0	0	112.9
1755	S	27.8	Very low	31.5	Very low	104 Å²	104	107.9 Å²	107.9	73%	0.727	63%	0.626	S	S	*	*				69.5	138.4	69.9	78.8	0	0	0	0	113
1756	S	31	Very low	31.6	Very low	95 Å²	95	109.9 Å²	109.9	66%	0.664	64%	0.642	S	S	*	*			cis	-166	171.9	38.9	-40.4	0	0	0	0	114.8
1757	T	32.7	Very low	31.9	Very low	120 Å²	120	116 Å²	116	74%	0.736	66%	0.658	S	S	*	*			trans	73.1	123.6	144.7	45.1	0	0	0	0	124.4
1758	K	32.4	Very low	32.1	Very low	190 Å²	190	123.4 Å²	123.4	83%	0.826	69%	0.688	S	S	*	*			trans	75.9	142.1	139.9	-66.3	176.1	178.4	-179.9	0	118.9
1759	S	34.4	Very low	32.3	Very low	96 Å²	96	130.6 Å²	130.6	67%	0.671	71%	0.708	S	S	*	*			cis	-165.6	156	-8.8	-108.4	0	0	0	0	112.4
1760	S	35.9	Very low	32.6	Very low	104 Å²	104	130.2 Å²	130.2	73%	0.727	72%	0.715	S	S	*	*			trans	59	138	165.4	46.2	0	0	0	0	117.6
1761	N	34.2	Very low	32.8	Very low	151 Å²	151	132.7 Å²	132.7	81%	0.807	73%	0.73	S	S	*	*			cis	-167.8	166.1	2.3	-107.4	11.8	0	0	0	107.1
1762	V	35.3	Very low	33.1	Very low	106 Å²	106	136 Å²	136	64%	0.642	74%	0.739	S	S	*	*			cis	-163.1	128.8	-17.8	116.5	0	0	0	0	104.9
1763	S	33.5	Very low	33.3	Very low	98 Å²	98	133.2 Å²	133.2	69%	0.685	74%	0.735	S	S	*	*				55.8	134.8	91.8	-48.3	0	0	0	0	114.5
1764	V	34.6	Very low	33.9	Very low	131 Å²	131	133.9 Å²	133.9	79%	0.794	75%	0.746	S	S	*	*			cis	-153.2	132.7	38	167	0	0	0	0	107.4
1765	S	33.8	Very low	34.3	Very low	108 Å²	108	131.2 Å²	131.2	76%	0.755	74%	0.743	S	S	*	*				77.9	112.4	52.5	-75.7	0	0	0	0	117.8
1766	S	34.2	Very low	34.9	Very low	99 Å²	99	131.3 Å²	131.3	69%	0.692	74%	0.741	S	S	*	*				161.7	145.2	95.7	87	0	0	0	0	117.7
1767	R	34.9	Very low	35.1	Very low	232 Å²	232	136.8 Å²	136.8	88%	0.875	75%	0.748	S	S	*	*			trans	78.7	123.2	139.9	-71.8	165.5	-175.7	-175.4	1.8	124.6
1768	H	32.9	Very low	35.4	Very low	181 Å²	181	137.4 Å²	137.4	84%	0.838	74%	0.742	S	S	*	*			trans	-34.4	149.1	154.3	-54.8	-93.8	0	0	0	118.4
1769	R	35.3	Very low	35.7	Very low	218 Å²	218	135.1 Å²	135.1	82%	0.823	73%	0.734	S	S	*	*				174.7	142.1	101	-101.2	-168.3	145.5	131.2	3.6	116.9
1770	D	35.4	Very low	35.8	Very low	112 Å²	112	137.4 Å²	137.4	60%	0.599	73%	0.734	S	S	*	*			trans	42.1	119.2	133.7	-47.9	-18.7	0	0	0	123.7
1771	N	32.7	Very low	35.9	Very low	131 Å²	131	140.6 Å²	140.6	70%	0.701	74%	0.737	S	S	*	*				76.2	123.5	130	-80.5	-49.1	0	0	0	125.2
1772	Q	34.2	Very low	35.9	Very low	161 Å²	161	139 Å²	139	75%	0.752	72%	0.724	S	S	*	*				88.5	137.5	124.4	-75.9	172.8	48.6	0	0	124.8
1773	S	35.2	Very low	36.1	Very low	102 Å²	102	138.6 Å²	138.6	71%	0.713	72%	0.724	S	S	*	*			trans	86.8	90.8	139.9	-66.8	0	0	0	0	123.6
1774	A	38.8	Very low	36.5	Very low	99 Å²	99	139.9 Å²	139.9	82%	0.818	72%	0.719	S	S	*	*				74.2	152.8	113.5	0	0	0	0	0	122.7
1775	P	41.3	Very low	36.8	Very low	117 Å²	117	138.8 Å²	138.8	76%	0.76	71%	0.714	S	S	*	*			trans	-107.1	-178	-168.8	47.3	-39.4	0	0	0	112.7
1776	P	39.9	Very low	37.1	Very low	106 Å²	106	138.7 Å²	138.7	69%	0.688	71%	0.711	S	S	*	*				-163.2	169.4	73.9	44.4	-22	0	0	0	121.1
1777	R	35.9	Very low	37.3	Very low	211 Å²	211	142.6 Å²	142.6	80%	0.796	72%	0.718	S	S	*	*			trans	80.2	130.2	133.7	-89.4	169.9	177.1	-154.4	1.1	126
1778	H	38	Very low	37.6	Very low	133 Å²	133	139.7 Å²	139.7	62%	0.616	71%	0.714	S	S	*	*				96.9	116.9	129.6	-75.3	-49	0	0	0	125
1779	H	38.5	Very low	38	Very low	142 Å²	142	136 Å²	136	66%	0.657	71%	0.706	S	S	*	*			trans	83.2	111.6	130.7	-78	-62.1	0	0	0	125.7
1780	H	38.1	Very low	38	Very low	144 Å²	144	133.3 Å²	133.3	67%	0.667	70%	0.703	S	S	*	*				90.8	129.9	121.7	-90.3	7	0	0	0	125
1781	H	37.2	Very low	37.9	Very low	170 Å²	170	134.3 Å²	134.3	79%	0.787	71%	0.707	S	S	*	*			trans	102.4	154.7	138.4	-72.7	-16.2	0	0	0	122.3
1782	Q	33.4	Very low	38	Very low	118 Å²	118	134.9 Å²	134.9	55%	0.551	71%	0.706	S	S	*	*			trans	-116	-165.5	-163.2	-137.6	-168.2	0.5	0	0	107.5	T1438	T1438-Q1782 PolarHBondContact OG1-NE2 3.24Å
1783	P	39.4	Very low	37.9	Very low	97 Å²	97	132.5 Å²	132.5	63%	0.63	70%	0.698	S	S	*	*			cis	-145.1	167.7	-7.9	42.1	-22.5	0	0	0	119.5
1784	H	42.4	Very low	37.9	Very low	126 Å²	126	134.1 Å²	134.1	58%	0.583	69%	0.694	S	S	*	*			trans	67.4	162.7	138.1	-78.2	-45.7	0	0	0	124.5
1785	P	41.5	Very low	37.7	Very low	108 Å²	108	137.9 Å²	137.9	70%	0.701	69%	0.689	S	S	*	*			trans	-109.5	-164.7	-153.6	43.8	-35.9	0	0	0	114.6
1786	P	40.2	Very low	37.4	Very low	106 Å²	106	140.2 Å²	140.2	69%	0.688	69%	0.689	S	S	*	*				-158.3	175.8	110.3	43.3	-25.9	0	0	0	119.7
1787	H	37.4	Very low	37.4	Very low	180 Å²	180	140.2 Å²	140.2	83%	0.833	69%	0.689	S	S	*	*			trans	88.5	105.5	145.7	-74.8	-53.2	0	0	0	124.9
1788	H	41.6	Very low	37.3	Very low	172 Å²	172	135 Å²	135	80%	0.796	68%	0.682	S	S	*	*			trans	-69.8	155.1	146.3	-106.2	-74	0	0	0	114.1
1789	P	41	Very low	36.9	Very low	104 Å²	104	136.2 Å²	136.2	68%	0.675	69%	0.688	S	S	*	*			trans	-133.6	-176.5	135.6	26.1	-6.2	0	0	0	112.4
1790	H	35.7	Very low	36.5	Very low	160 Å²	160	135 Å²	135	74%	0.741	69%	0.687	S	S	*	*				-169.4	140.2	-51.2	-105.4	14.1	0	0	0	112.9
1791	L	33.6	Very low	36.3	Very low	134 Å²	134	135.7 Å²	135.7	70%	0.702	69%	0.69	S	S	*	*			trans	70.4	159.5	149.2	-58.1	167.6	0	0	0	118.9
1792	Q	33.8	Very low	35.9	Very low	142 Å²	142	133.4 Å²	133.4	66%	0.664	69%	0.688	S	S	*	*			cis	-161.3	155.7	1.5	-130.4	158.2	-15.4	0	0	114.5
1793	N	32.8	Very low	35.7	Very low	111 Å²	111	133.3 Å²	133.3	59%	0.594	70%	0.701	S	S	*	*			trans	36.1	153.4	134.7	-71.3	3.4	0	0	0	123
1794	H	35.7	Very low	35.1	Very low	137 Å²	137	132.4 Å²	132.4	63%	0.634	70%	0.701	S	S	*	*			cis	-167	156.7	12.6	-117.2	-18.3	0	0	0	113.8
1795	Y	33.9	Very low	34.5	Very low	178 Å²	178	132.6 Å²	132.6	70%	0.698	71%	0.711	S	S	*	*			trans	50.6	122.4	142.3	-80.5	-59.5	0	0	0	126.1
1796	H	35.4	Very low	33.8	Very low	165 Å²	165	131.6 Å²	131.6	76%	0.764	71%	0.712	S	S	*	*				86.5	161.8	129.6	-87.6	-25.1	0	0	0	122.3
1797	P	40.2	Very low	33.6	Very low	106 Å²	106	132.2 Å²	132.2	69%	0.688	72%	0.716	S	S	*	*			trans	-117.3	-154.3	-144.9	49.4	-37.1	0	0	0	111
1798	P	33.3	Very low	33.7	Very low	102 Å²	102	129.6 Å²	129.6	66%	0.662	72%	0.717	S	S	*	*			cis	-136	-163.3	-5.1	42.9	-23.6	0	0	0	114.8
1799	Q	30.5	Very low	33.3	Very low	158 Å²	158	127 Å²	127	74%	0.738	72%	0.716	S	S	*	*			trans	68.4	128.8	152	-78.2	-175.1	12.2	0	0	121
1800	N	29.5	Very low	32.7	Very low	117 Å²	117	127.2 Å²	127.2	63%	0.626	72%	0.719	S	S	*	*			trans	72.8	157	138.9	-62.5	-16.6	0	0	0	120.8
1801	H	34.3	Very low	32.3	Very low	158 Å²	158	122.6 Å²	122.6	73%	0.731	71%	0.709	S	S	*	*			trans	71.2	104.3	171.9	-51.6	-61.1	0	0	0	114.9
1802	T	28.1	Very low	32	Very low	122 Å²	122	122.5 Å²	122.5	75%	0.748	71%	0.707	S	S	*	*				46.1	106.8	69.1	77.8	0	0	0	0	110.3
1803	S	29.1	Very low	31.7	Very low	117 Å²	117	120 Å²	120	82%	0.818	70%	0.7	S	S	*	*				-179.7	169.5	61.6	48.6	0	0	0	0	109.5
1804	A	27.7	Very low	31.5	Very low	78 Å²	78	120.9 Å²	120.9	65%	0.645	70%	0.701	S	S	*	*			cis	-171.7	162.1	-26	0	0	0	0	0	108.6
1805	T	29	Very low	31	Very low	129 Å²	129	122.7 Å²	122.7	79%	0.791	71%	0.714	S	S	*	*			trans	51.6	125.6	156.6	48	0	0	0	0	119.4
1806	A	27.3	Very low	30.6	Very low	87 Å²	87	120.2 Å²	120.2	72%	0.719	71%	0.709	S	S	*	*			cis	67.5	172.6	43.2	0	0	0	0	0	113.1
1807	P	35.4	Very low	30.2	Very low	119 Å²	119	116.5 Å²	116.5	77%	0.773	71%	0.707	S	S	*	*				-117.2	-157.1	-107.9	27.3	-6.1	0	0	0	113.9
1808	C	40	Very low	29.6	Very low	126 Å²	126	117.4 Å²	117.4	85%	0.851	71%	0.711	S	S	*	*			trans	-17.2	136.1	175	-54.3	0	0	0	0	116.8
1809	P	33.7	Very low	29.4	Very low	118 Å²	118	116.9 Å²	116.9	77%	0.766	71%	0.709	S	S	*	*				-153.3	-170.2	87.8	40.7	-22.1	0	0	0	116.3
1810	S	27.7	Very low	29.3	Very low	108 Å²	108	115.3 Å²	115.3	76%	0.755	71%	0.706	S	S	*	*			trans	-12.8	151.7	142.8	-56.6	0	0	0	0	116.6
1811	A	27.9	Very low	29.3	Very low	63 Å²	63	116.1 Å²	116.1	52%	0.521	71%	0.71	S	S	.	*			cis	166.9	172	-2.9	0	0	0	0	0	105.2
1812	M	27.5	Very low	29.2	Very low	132 Å²	132	115.6 Å²	115.6	65%	0.65	71%	0.713	S	S	*	*			trans	69.6	138.1	159.4	-94.8	-170.4	154.4	0	0	120.6
1813	V	27.3	Very low	29.5	Very low	88 Å²	88	115.4 Å²	115.4	53%	0.533	71%	0.711	S	S	.	*			trans	85.2	100.6	134.9	168.3	0	0	0	0	120.1
1814	Q	27.4	Very low	29.6	Very low	130 Å²	130	116.7 Å²	116.7	61%	0.607	71%	0.709	S	S	*	*				52	115	127.2	-63.1	166.1	-55.1	0	0	121.5	Q1816	Q1814-Q1816 HydrophobicContact CB-CB 3.92Å; Q1814-Q1816 HydrophobicContact CG-CB 4.39Å; Q1814-Q1816 VanDerWaalsContact NE2-OE1 3.09Å
1815	L	26.3	Very low	30.1	Very low	175 Å²	175	118.6 Å²	118.6	92%	0.916	72%	0.715	S	S	*	*			trans	-147	97.4	130.7	-91.3	169	0	0	0	104.8
1816	Q	25.6	Very low	30.2	Very low	126 Å²	126	119.4 Å²	119.4	59%	0.589	71%	0.714	S	S	*	*			cis	67.1	99.6	26.1	-159.5	177.6	18.9	0	0	114.6	Q1814	Q1814-Q1816 HydrophobicContact CB-CB 3.92Å; Q1814-Q1816 HydrophobicContact CG-CB 4.39Å; Q1814-Q1816 VanDerWaalsContact NE2-OE1 3.09Å
1817	A	27.5	Very low	30.5	Very low	88 Å²	88	121.9 Å²	121.9	73%	0.727	71%	0.71	S	S	*	*			trans	73.3	163.6	151	0	0	0	0	0	116.2
1818	V	26.8	Very low	30.4	Very low	125 Å²	125	123.8 Å²	123.8	76%	0.758	71%	0.709	S	S	*	*			cis	-138.2	162.4	12.9	-149.1	0	0	0	0	111.1
1819	S	28.6	Very low	30.2	Very low	90 Å²	90	123.2 Å²	123.2	63%	0.629	70%	0.703	S	S	*	*			trans	73.5	139.1	153.9	-62.7	0	0	0	0	117
1820	N	29.1	Very low	30.2	Very low	125 Å²	125	122 Å²	122	67%	0.668	70%	0.695	S	S	*	*			cis	-165.1	159.4	-2.9	-113.8	-12.3	0	0	0	110.3
1821	N	30	Very low	30.5	Very low	135 Å²	135	125.2 Å²	125.2	72%	0.722	70%	0.698	S	S	*	*			trans	56.4	107	140.4	-62.7	-14.3	0	0	0	120.9
1822	N	30.3	Very low	31	Very low	147 Å²	147	127.4 Å²	127.4	79%	0.786	71%	0.707	S	S	*	*				96.4	155.7	105	-161.1	23.1	0	0	0	118.7
1823	V	34.6	Very low	31.1	Very low	117 Å²	117	126.9 Å²	126.9	71%	0.709	71%	0.711	S	S	*	*			trans	61.3	113.7	170.9	-118.7	0	0	0	0	120.2
1824	N	31.5	Very low	31.3	Very low	145 Å²	145	127.9 Å²	127.9	78%	0.775	72%	0.722	S	S	*	*				-25.2	155.9	128.7	-77.1	-33.8	0	0	0	114.3
1825	P	37.8	Very low	31.5	Very low	118 Å²	118	126 Å²	126	77%	0.766	72%	0.723	S	S	*	*			cis	-152.4	156	47.7	40	-18.1	0	0	0	120
1826	L	31.6	Very low	31.8	Very low	146 Å²	146	125.4 Å²	125.4	76%	0.764	72%	0.716	S	S	*	*				41.7	129.6	122.4	-146.2	83.6	0	0	0	122
1827	H	34.5	Very low	32.2	Very low	138 Å²	138	124.6 Å²	124.6	64%	0.639	71%	0.714	S	S	*	*			trans	75.2	115.6	143.5	-97.9	50.1	0	0	0	122.3
1828	Q	32.5	Very low	32.7	Very low	160 Å²	160	124 Å²	124	75%	0.748	70%	0.703	S	S	*	*				59.9	177	127.1	-73.6	-174.1	3.3	0	0	119.4
1829	P	36.8	Very low	33	Very low	113 Å²	113	122 Å²	122	73%	0.734	69%	0.693	S	S	*	*			cis	-114.5	-153.6	-14.7	45.8	-32.1	0	0	0	109.5
1830	P	33.7	Very low	33	Very low	93 Å²	93	124 Å²	124	60%	0.604	69%	0.692	S	S	*	*			trans	-95.5	166.3	173	34.9	-27.3	0	0	0	113.9
1831	H	33.7	Very low	33.3	Very low	175 Å²	175	126.6 Å²	126.6	81%	0.81	73%	0.731	S	S	*	*			trans	73	155.7	168.8	-47.6	-67.5	0	0	0	117.4
1832	P	37.9	Very low	33.4	Very low	109 Å²	109	126.2 Å²	126.2	71%	0.708	73%	0.731	S	S	*	*			cis	-135.6	-167.8	-36.4	29.6	-7.5	0	0	0	112.8
1833	V	30.3	Very low	33.6	Very low	121 Å²	121	125.1 Å²	125.1	73%	0.733	73%	0.728	S	S	*	*			trans	77.7	113	157.6	-168.5	0	0	0	0	118.9
1834	S	30.9	Very low	33.5	Very low	110 Å²	110	125.5 Å²	125.5	77%	0.769	73%	0.729	S	S	*	*			trans	60.3	162.8	146.9	-62.6	0	0	0	0	119.8
1835	S	31.8	Very low	33.7	Very low	91 Å²	91	124.4 Å²	124.4	64%	0.636	73%	0.727	S	S	*	*			cis	-172.8	158.5	-23.3	51.4	0	0	0	0	107.9
1836	Q	33.4	Very low	33.4	Very low	162 Å²	162	124.8 Å²	124.8	76%	0.757	72%	0.724	S	S	*	*			trans	62.3	91.9	169.2	-63.6	167.1	-8.6	0	0	113.5
1837	I	33.1	Very low	33.5	Very low	108 Å²	108	123.3 Å²	123.3	55%	0.554	72%	0.722	S	S	*	*				57.8	134.5	66	-34.3	150.9	0	0	0	112.3	H1287	H1287-I1837 VanDerWaalsContact CD2-CG2 3.46Å; H1287-I1837 WeakPolarHBondContact CD2-CG2 3.43Å; H1287-I1837 WeakPolarHBondContact NE2-CB 3.16Å; H1287-I1837 WeakPolarHBondContact NE2-CG2 3.35Å
1838	P	38.8	Very low	33.5	Very low	77 Å²	77	122.3 Å²	122.3	50%	0.5	73%	0.728	S	S	.	*			cis	-102.2	-79.7	-43.6	17.2	1.8	0	0	0	114	Q1286	Q1286-P1838 HydrophobicContact CG-CG 3.71Å
1839	P	31.9	Very low	33.5	Very low	82 Å²	82	119.4 Å²	119.4	53%	0.532	73%	0.726	S	S	.	*			cis	-110.7	-104.5	-4.3	38	-20.7	0	0	0	115.9	D1284	D1284-P1839 WeakPolarHBondContact OD1-CB 3.18Å
1840	Q	29.4	Very low	33.3	Very low	131 Å²	131	119.9 Å²	119.9	61%	0.612	73%	0.725	S	S	*	*			trans	-142.6	139	-170.3	-74.7	167.8	-18.5	0	0	112.2	D1284	D1284-Q1840 VanDerWaalsContact C-OE1 3.31Å
1841	A	34.4	Very low	33.2	Very low	180 Å²	180	122.4 Å²	122.4	100%	1.488	74%	0.736	S	S	*	*			trans	-165.7	0	136.7	0	0	0	0	0	108.9

Retrieved 1,841 of 1,841 residues in 2100.3 ms (Link to these results)

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