G4VJ65_SCHMA Loading...

Putative paired box protein pax-6

AlphaFold DB , UniProt , Accession G4VJ65, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,258 aa.

						>G4VJ65_SCHMA|G4VJ65
MGSISDGNELNEDSSKRKLKRGHSGVNQLGGMFVNGRPLPDTTRQRIIELAHSGARPCDISRILQVSNGCVSKILCRYYETGSIRPKAIGGSKPRVATNAVVTKIDIYKRECPSIFAWEIRDRLLQEGVCTPDNIPSVSSINRVLRNLSNESQRQLSSAAAAAAVAAAAVAAQAAVHRNEVNSNSMGVSNTNQHISTQNYLSNMKCDLHGLTKSFMPSMFNFTPYHVTNNNNNANNTNINNNHNIFTIPPSISQFYSQQNSNLNRHSNSCFNDHNVIESHRTVPNTPHIHANNTIYSNLNQNPHSPIIPSFQTGDGISKSVPSNFRHEDIQSMRLPYDKFNDLLITASSGASQTSWAQAWYSAAAASANSVYSSLYNSSNSSQRNEFLQEKQFSPSLNYLNHCGLPGFYQNLENAVNSVNDTNLGMKCPGNVEINNELDNRSINESSPDCSEQQQQSHHRHQEKLSMLSHQSLHNTLPIYNENSSPVHQSLLSNNYELKPDSKWSFNADSLRHYNGQHHQTMHQAENHQRSNNNLFKSETEEFKQLASFLDEKEKTDRSRRRFSINPLFNYEDISNVNENTANFMQSHKDDFVSTHLHHYLSSRDMQSIDEQSFPHTDKEHTMNESQLGMDDDEDDDNDDGDDDDCDDVVNCNAAITSASAVSSSHENHVNQSLSSSSVKILDPKLTANLYLKQINDSKERNIGSETYSSKNSVNENRIVCDDSFIENNQLLMTRGSNSEFCGREFRENFTRKLNEINSRHEHEQQYNIMKINRMNELLQGNNNDPTTLQQPRTPTTISSSSSSSTALTENENKFIQLTNNIPTTTTTASGVSISNDSSSNMTSERNDFIQNQLNSQFYHELNETQETFLETLQANQIEQSKELIKNRIFLNTDNSDLCVRTMNKRPNSITAIVQSISTSTSSVSSLISTKSGLNERSNSVLSEINLSQMIMTDEKYQSNKQKQSDQQQQQQRHHHHEEQLQQQQQRSRTSFSNLQLEELEKEFEHTHYPDVFSREKLSSRILLPETRIQVWFSNRRAKWRREEKMRMKQLASRNQQKPIHHQYHSNNNNNKINPLISSLTMTPTIKSVVNTTYVNHTDDSLKNKINNTSRTVEINNTNRSIYSEIPHKSNDNNSSIHMTNCIDNISNKNIDCGSTDPLRLQDDYKIQSSKVPVKGSKLNDFLSLSSTRYSTTDLLVKKNNDDRYNVHHNPFYHHIEEKQWTYLPPHLQIQSQNNLDQSTIEQQTCLNNIQNITKNFV
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40	Very low	39.5	Very low	247 Å²	247	135 Å²	135	100%	1.217	79%	0.789	S	S	*	*				0	88.7	0	-63.4	-62.8	-161.1	0	0	108.5
2	G	47.5	Very low	39.5	Very low	64 Å²	64	140.9 Å²	140.9	66%	0.66	80%	0.804	S	S	*	*			cis	-164.9	134.5	-7.2	0	0	0	0	0	110.8
3	S	36.8	Very low	40.2	Very low	109 Å²	109	135.8 Å²	135.8	76%	0.762	77%	0.773	S	S	*	*			trans	63	128.2	157.3	-51.7	0	0	0	0	119.1
4	I	38.9	Very low	40.6	Very low	140 Å²	140	133.4 Å²	133.4	72%	0.718	77%	0.768	S	S	*	*				64.1	84.1	54.9	-57.7	167.9	0	0	0	107.4
5	S	37.6	Very low	41.2	Very low	91 Å²	91	132.3 Å²	132.3	64%	0.636	77%	0.771	S	S	*	*				81.3	-179.3	79.5	76.5	0	0	0	0	112.2
6	D	40.9	Very low	41.7	Very low	151 Å²	151	135.4 Å²	135.4	81%	0.807	77%	0.773	S	S	*	*			trans	76	138.2	177.8	-41.9	-6.4	0	0	0	113
7	G	40.7	Very low	42	Very low	73 Å²	73	138.1 Å²	138.1	75%	0.753	77%	0.767	S	S	*	*			cis	-166.6	165.4	-3.8	0	0	0	0	0	112.3
8	N	34.7	Very low	42.2	Very low	162 Å²	162	140.9 Å²	140.9	87%	0.866	77%	0.771	S	S	*	*			trans	-61	150.2	174.3	-61.5	-36	0	0	0	111.5
9	E	34.9	Very low	42.2	Very low	171 Å²	171	141.4 Å²	141.4	80%	0.799	77%	0.771	S	S	*	*				165.4	171.6	113.7	-85.8	-169.1	131.4	0	0	110.3
10	L	42.9	Very low	42.5	Very low	144 Å²	144	144.8 Å²	144.8	75%	0.754	78%	0.778	S	S	*	*			trans	63.1	112.9	164.8	-45.5	-172.6	0	0	0	116.1
11	N	39.3	Very low	43	Very low	133 Å²	133	149 Å²	149	71%	0.711	78%	0.783	S	S	*	*			cis	-162.1	156.5	20.7	-79	-53.7	0	0	0	111.8	D13	N11-D13 PolarHBondContact O-N 3.43Å; N11-D13 VanDerWaalsContact O-N 3.08Å
12	E	40	Very low	43.7	Very low	206 Å²	206	140.3 Å²	140.3	96%	0.963	76%	0.757	S	S	*	*			trans	-75.6	83.6	169.3	-63	-168.6	117.9	0	0	113.2
13	D	48.8	Very low	45	Very low	75 Å²	75	145.4 Å²	145.4	40%	0.401	76%	0.763	S	S	.	*			trans	-140.1	8	171.2	-170.2	45.3	0	0	0	114.4	N11 S15 R17	N11-D13 PolarHBondContact O-N 3.43Å; N11-D13 VanDerWaalsContact O-N 3.08Å; D13-S15 PolarHBondContact O-N 3.42Å; D13-R17 IonicContact OD2-CZ 3.21Å; D13-R17 IonicContact OD2-NE 2.73Å; D13-R17 PolarHBondContact OD2-NE 2.97Å; D13-R17 IonicContact OD2-NH2 3.72Å; D13-R17 PolarHBondContact OD2-NH2 3.47Å
14	S	45.9	Very low	47.2	Very low	101 Å²	101	143.1 Å²	143.1	71%	0.706	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-70.8	-29.6	-173.1	-64.8	0	0	0	0	114.2	K16	S14-K16 PolarHBondContact O-N 3.08Å
15	S	49.1	Very low	49.5	Very low	117 Å²	117	137.8 Å²	137.8	82%	0.818	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-77.4	-19	-170.4	-64.1	0	0	0	0	115.2	D13	D13-S15 PolarHBondContact O-N 3.42Å
16	K	49.9	Very low	52.1	Low	182 Å²	182	138.3 Å²	138.3	79%	0.791	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-95	-5.7	177.5	-74.8	175.1	-179.9	167.3	0	113.9	S14 K18	S14-K16 PolarHBondContact O-N 3.08Å; K16-K18 VanDerWaalsContact C-N 3.27Å; K16-K18 PolarHBondContact O-N 2.98Å
17	R	45.5	Very low	54.6	Low	181 Å²	181	133 Å²	133	68%	0.683	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	21	-179.4	-61.5	-178.6	-175	-166.8	2.8	114.9	D13 L19	D13-R17 IonicContact OD2-CZ 3.21Å; D13-R17 IonicContact OD2-NE 2.73Å; D13-R17 PolarHBondContact OD2-NE 2.97Å; D13-R17 IonicContact OD2-NH2 3.72Å; D13-R17 PolarHBondContact OD2-NH2 3.47Å; R17-L19 VanDerWaalsContact C-N 3.29Å; R17-L19 PolarHBondContact O-N 3.04Å
18	K	46.8	Very low	57.1	Low	190 Å²	190	139.2 Å²	139.2	83%	0.826	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	1.3	177.1	-91.7	-179.1	177.5	173	0	115	K16	K16-K18 VanDerWaalsContact C-N 3.27Å; K16-K18 PolarHBondContact O-N 2.98Å
19	L	41.5	Very low	59.8	Low	150 Å²	150	135 Å²	135	79%	0.785	68%	0.684	S	S	*	*	S	Bend	trans	-86	141.7	168.9	-75.8	83.9	0	0	0	111.1	R17	R17-L19 VanDerWaalsContact C-N 3.29Å; R17-L19 PolarHBondContact O-N 3.04Å
20	K	48.1	Very low	62.5	Low	209 Å²	209	128.6 Å²	128.6	91%	0.909	66%	0.663	S	S	*	*			trans	69.3	42	-179.9	-54.3	-177.3	-180	176.5	0	117.3
21	R	53.8	Low	64.8	Low	233 Å²	233	122 Å²	122	88%	0.879	63%	0.63	S	S	*	*			trans	-66.9	130.6	140.4	-74	-170.1	176.7	-168.9	-1.9	107.8
22	G	55.1	Low	67.3	Low	64 Å²	64	121.3 Å²	121.3	66%	0.66	62%	0.624	S	S	*	*			trans	-60.5	149.9	-174.9	0	0	0	0	0	112.1	S24	G22-S24 PolarHBondContact O-N 3.23Å
23	H	73.1	Confident	69.8	Low	171 Å²	171	115.2 Å²	115.2	79%	0.792	60%	0.595	S	S	*	*	S	Bend	trans	-74.2	-2.5	178.9	-65.5	23.3	0	0	0	113.2
24	S	83	Confident	71.8	Confident	61 Å²	61	114.5 Å²	114.5	43%	0.427	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.2	125.2	175.4	-51	0	0	0	0	110.3	G22 F33	G22-S24 PolarHBondContact O-N 3.23Å; S24-F33 CarbonylContact C-O 3.59Å; S24-F33 VanDerWaalsContact CA-O 3.25Å; S24-F33 WeakPolarHBondContact CA-O 3.2Å
25	G	88.6	Confident	73.9	Confident	28 Å²	28	116.3 Å²	116.3	29%	0.289	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.3	170.7	163.3	0	0	0	0	0	111.6	M32 F33	G25-M32 WeakPolarHBondContact O-CA 3.32Å; G25-F33 PolarHBondContact N-O 3.29Å; G25-F33 WeakPolarHBondContact O-CD1 3.5Å; G25-F33 PolarHBondContact O-N 2.94Å
26	V	92.1	Very high	75.7	Confident	102 Å²	102	113.6 Å²	113.6	62%	0.618	59%	0.585	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-117.5	133.7	172.2	176.7	0	0	0	0	107.7	G30	V26-G30 WeakPolarHBondContact CG1-O 3.5Å
27	N	92.5	Very high	77.7	Confident	40 Å²	40	114 Å²	114	21%	0.214	58%	0.582	C	S	.	*			trans	-91.2	173.5	-178.9	75.5	45.9	0	0	0	112	L29 G30 G31 F33 Q65	N27-L29 PolarHBondContact O-N 3.12Å; N27-L29 WeakPolarHBondContact OD1-CA 3.43Å; N27-L29 VanDerWaalsContact OD1-CB 3.32Å; N27-L29 WeakPolarHBondContact OD1-CB 3.43Å; N27-L29 PolarHBondContact OD1-N 3.39Å; N27-G30 PolarHBondContact O-N 3.14Å; N27-G31 VanDerWaalsContact CG-O 3.28Å; N27-G31 PolarHBondContact N-O 2.96Å; N27-G31 PolarHBondContact ND2-O 3.24Å; N27-G31 VanDerWaalsContact ND2-O 3.08Å; N27-G31 PolarHBondContact OD1-N 3.42Å; N27-F33 HydrophobicContact CB-CD1 3.94Å; N27-F33 HydrophobicContact CB-CE1 4.01Å; N27-Q65 PolarHBondContact ND2-O 3.47Å; N27-Q65 PolarHBondContact OD1-O 3.09Å
28	Q	93.3	Very high	80	Confident	204 Å²	204	108.2 Å²	108.2	95%	0.953	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-12.5	-177.8	-70.3	173.5	-27.2	0	0	115.2
29	L	91.9	Very high	82.3	Confident	73 Å²	73	100.7 Å²	100.7	38%	0.382	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	5.1	175.2	-54.7	173.6	0	0	0	112.6	N27 G31 Q65 V66	N27-L29 PolarHBondContact O-N 3.12Å; N27-L29 WeakPolarHBondContact OD1-CA 3.43Å; N27-L29 VanDerWaalsContact OD1-CB 3.32Å; N27-L29 WeakPolarHBondContact OD1-CB 3.43Å; N27-L29 PolarHBondContact OD1-N 3.39Å; L29-G31 VanDerWaalsContact C-N 3.32Å; L29-Q65 HydrophobicContact CB-CB 4.09Å; L29-Q65 WeakPolarHBondContact O-CB 3.44Å; L29-Q65 VanDerWaalsContact O-CD 3.28Å; L29-Q65 WeakPolarHBondContact O-CG 3.28Å; L29-V66 WeakPolarHBondContact CD1-O 3.49Å
30	G	90.8	Very high	84.7	Confident	36 Å²	36	97.1 Å²	97.1	37%	0.371	52%	0.522	S	S	.	.	S	Bend	trans	87	-7.5	-173.5	0	0	0	0	0	114.6	V26 N27 Q65	V26-G30 WeakPolarHBondContact CG1-O 3.5Å; N27-G30 PolarHBondContact O-N 3.14Å; G30-Q65 VanDerWaalsContact C-OE1 3.26Å; G30-Q65 PolarHBondContact O-OE1 2.95Å
31	G	91.9	Very high	86.9	Confident	6 Å²	6	90.7 Å²	90.7	6%	0.062	50%	0.498	C	S	.	.			trans	-75	129.4	-171.9	0	0	0	0	0	113.5	N27 L29 Q65	N27-G31 VanDerWaalsContact CG-O 3.28Å; N27-G31 PolarHBondContact N-O 2.96Å; N27-G31 PolarHBondContact ND2-O 3.24Å; N27-G31 VanDerWaalsContact ND2-O 3.08Å; N27-G31 PolarHBondContact OD1-N 3.42Å; L29-G31 VanDerWaalsContact C-N 3.32Å; G31-Q65 WeakPolarHBondContact CA-O 3.37Å
32	M	91.5	Very high	88.9	Confident	118 Å²	118	84.9 Å²	84.9	58%	0.581	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	134.4	174.3	-62.9	177.4	72.4	0	0	111.5	G25	G25-M32 WeakPolarHBondContact O-CA 3.32Å
33	F	93.1	Very high	90.8	Very high	79 Å²	79	83.7 Å²	83.7	35%	0.346	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	154.8	176	75.3	-79.6	0	0	0	111.6	S24 G25 N27 N35	S24-F33 CarbonylContact C-O 3.59Å; S24-F33 VanDerWaalsContact CA-O 3.25Å; S24-F33 WeakPolarHBondContact CA-O 3.2Å; G25-F33 PolarHBondContact N-O 3.29Å; G25-F33 WeakPolarHBondContact O-CD1 3.5Å; G25-F33 PolarHBondContact O-N 2.94Å; N27-F33 HydrophobicContact CB-CD1 3.94Å; N27-F33 HydrophobicContact CB-CE1 4.01Å; F33-N35 HydrophobicContact CE2-CB 4.13Å
34	V	91.2	Very high	91.9	Very high	60 Å²	60	76.1 Å²	76.1	36%	0.364	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	117.9	173	179.4	0	0	0	0	108.2	R37	V34-R37 HydrophobicContact CB-CB 4.08Å; V34-R37 HydrophobicContact CB-CG 4.1Å; V34-R37 HydrophobicContact CG1-CB 4.09Å; V34-R37 HydrophobicContact CG1-CG 3.54Å; V34-R37 PolarHBondContact O-N 3.03Å; V34-R37 VanDerWaalsContact O-N 3.16Å
35	N	89.3	Confident	92.6	Very high	139 Å²	139	76.1 Å²	76.1	74%	0.743	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	141.1	-174.6	-162.9	3.5	0	0	0	111.4	F33 R37	F33-N35 HydrophobicContact CE2-CB 4.13Å; N35-R37 PolarHBondContact O-N 3.23Å
36	G	87.8	Confident	93	Very high	60 Å²	60	80.4 Å²	80.4	62%	0.619	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	3.7	-175	0	0	0	0	0	115.9
37	R	91.5	Very high	93.2	Very high	189 Å²	189	75.6 Å²	75.6	71%	0.713	40%	0.404	S	S	*	.	S	Bend	trans	-108.1	152.3	174.4	-62.5	-62.6	-176	158.2	0.1	111.1	V34 N35	V34-R37 HydrophobicContact CB-CB 4.08Å; V34-R37 HydrophobicContact CB-CG 4.1Å; V34-R37 HydrophobicContact CG1-CB 4.09Å; V34-R37 HydrophobicContact CG1-CG 3.54Å; V34-R37 PolarHBondContact O-N 3.03Å; V34-R37 VanDerWaalsContact O-N 3.16Å; N35-R37 PolarHBondContact O-N 3.23Å
38	P	94	Very high	93.4	Very high	60 Å²	60	73.9 Å²	73.9	39%	0.39	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-66.6	150.8	168	31.1	-34.4	0	0	0	110	P86	P38-P86 HydrophobicContact CB-CB 3.93Å; P38-P86 HydrophobicContact CB-CG 4.23Å; P38-P86 HydrophobicContact CG-CB 4.36Å; P38-P86 HydrophobicContact CG-CG 4.21Å
39	L	94	Very high	93.6	Very high	32 Å²	32	67.8 Å²	67.8	17%	0.168	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-57.6	142.7	169.7	-169.8	71.6	0	0	0	109.8	D41 T43 R44 I47 V66 I74	L39-D41 PolarHBondContact O-N 3.13Å; L39-T43 HydrophobicContact CD1-CG2 4.37Å; L39-T43 HydrophobicContact CD2-CG2 3.8Å; L39-T43 HydrophobicContact CG-CG2 4.14Å; L39-R44 HydrophobicContact CB-CG 3.99Å; L39-R44 HydrophobicContact CD2-CG 4Å; L39-R44 HydrophobicContact CG-CG 4.22Å; L39-R44 WeakPolarHBondContact O-CD 3.48Å; L39-I47 HydrophobicContact CD2-CD1 3.81Å; L39-V66 HydrophobicContact CD1-CG2 4.32Å; L39-V66 HydrophobicContact CD2-CG1 3.97Å; L39-V66 HydrophobicContact CD2-CG2 3.78Å; L39-I74 HydrophobicContact CD2-CD1 4.03Å
40	P	93.3	Very high	93.9	Very high	75 Å²	75	65.1 Å²	65.1	49%	0.487	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-54.1	137.3	-179.3	-27.7	36	0	0	0	112.5	T42 T43 R44	P40-T42 PolarHBondContact O-N 2.94Å; P40-T42 VanDerWaalsContact O-N 3.1Å; P40-T43 PolarHBondContact O-N 3.33Å; P40-R44 WeakPolarHBondContact O-CG 3.41Å; P40-R44 PolarHBondContact O-N 2.78Å
41	D	94.2	Very high	94.2	Very high	74 Å²	74	64.2 Å²	64.2	40%	0.396	34%	0.342	S	S	.	.	H	α-helix	trans	-63	-22.6	-174.1	-69.7	-36.9	0	0	0	112.5	L39 R44 Q45	L39-D41 PolarHBondContact O-N 3.13Å; D41-R44 PolarHBondContact O-N 3.43Å; D41-R44 IonicContact OD1-NH1 3.4Å; D41-R44 PolarHBondContact OD1-NH1 2.7Å; D41-Q45 WeakPolarHBondContact O-CB 3.35Å; D41-Q45 PolarHBondContact O-N 3.43Å
42	T	94.4	Very high	94.4	Very high	112 Å²	112	69.4 Å²	69.4	69%	0.687	36%	0.364	S	S	*	.	H	α-helix	trans	-63.4	-47.3	168.5	47.8	0	0	0	0	113.1	P40 R44 Q45 R46	P40-T42 PolarHBondContact O-N 2.94Å; P40-T42 VanDerWaalsContact O-N 3.1Å; T42-R44 VanDerWaalsContact C-N 3.26Å; T42-R44 PolarHBondContact O-N 3.44Å; T42-Q45 PolarHBondContact O-N 3.02Å; T42-R46 PolarHBondContact O-N 2.88Å
43	T	95.3	Very high	94.6	Very high	38 Å²	38	68 Å²	68	23%	0.233	37%	0.365	C	S	.	.	H	α-helix	trans	-65.8	-33.1	175.2	-40.5	0	0	0	0	111	L39 P40 R46 I47 V66	L39-T43 HydrophobicContact CD1-CG2 4.37Å; L39-T43 HydrophobicContact CD2-CG2 3.8Å; L39-T43 HydrophobicContact CG-CG2 4.14Å; P40-T43 PolarHBondContact O-N 3.33Å; T43-R46 PolarHBondContact O-N 3.07Å; T43-I47 WeakPolarHBondContact O-CG1 3.38Å; T43-I47 PolarHBondContact O-N 3.06Å; T43-V66 HydrophobicContact CG2-CG2 3.96Å
44	R	97	Very high	94.7	Very high	13 Å²	13	67.2 Å²	67.2	5%	0.049	38%	0.38	C	S	.	.	H	α-helix	trans	-72.4	-40.4	178	-61.7	-179.2	66.2	-155.9	-1.5	112.1	L39 P40 D41 T42 R46 I47 I48 I74 I84 R85	L39-R44 HydrophobicContact CB-CG 3.99Å; L39-R44 HydrophobicContact CD2-CG 4Å; L39-R44 HydrophobicContact CG-CG 4.22Å; L39-R44 WeakPolarHBondContact O-CD 3.48Å; P40-R44 WeakPolarHBondContact O-CG 3.41Å; P40-R44 PolarHBondContact O-N 2.78Å; D41-R44 PolarHBondContact O-N 3.43Å; D41-R44 IonicContact OD1-NH1 3.4Å; D41-R44 PolarHBondContact OD1-NH1 2.7Å; T42-R44 VanDerWaalsContact C-N 3.26Å; T42-R44 PolarHBondContact O-N 3.44Å; R44-R46 VanDerWaalsContact C-N 3.29Å; R44-R46 PolarHBondContact O-N 2.84Å; R44-I47 WeakPolarHBondContact O-CB 3.42Å; R44-I47 PolarHBondContact O-N 3.17Å; R44-I48 PolarHBondContact O-N 3.35Å; R44-I74 HydrophobicContact CG-CD1 3.89Å; R44-I84 PolarHBondContact NE-O 3.48Å; R44-I84 PolarHBondContact NH1-O 3.27Å; R44-I84 PolarHBondContact NH2-O 3.28Å; R44-R85 VanDerWaalsContact NH1-C 3.25Å; R44-R85 PolarHBondContact NH2-O 3.13Å; R44-R85 VanDerWaalsContact NH2-O 3.08Å
45	Q	96.8	Very high	94.9	Very high	61 Å²	61	65.5 Å²	65.5	29%	0.285	37%	0.372	S	S	.	.	H	α-helix	trans	-56.7	-45.8	167.8	-179.4	61.9	14.9	0	0	110.4	D41 T42 I47 I48 E49	D41-Q45 WeakPolarHBondContact O-CB 3.35Å; D41-Q45 PolarHBondContact O-N 3.43Å; T42-Q45 PolarHBondContact O-N 3.02Å; Q45-I47 VanDerWaalsContact C-N 3.3Å; Q45-I47 PolarHBondContact O-N 3.34Å; Q45-I48 PolarHBondContact O-N 3.25Å; Q45-E49 HydrophobicContact CG-CG 4.41Å; Q45-E49 WeakPolarHBondContact CG-OE1 3.4Å; Q45-E49 WeakPolarHBondContact O-CG 3.35Å; Q45-E49 PolarHBondContact O-N 3.34Å
46	R	96.9	Very high	95.3	Very high	118 Å²	118	66.1 Å²	66.1	45%	0.445	36%	0.364	S	S	.	.	H	α-helix	trans	-64.2	-30.6	178.5	-165.8	58.3	175.1	172.9	3.5	114	T42 T43 R44 E49 L50 L64	T42-R46 PolarHBondContact O-N 2.88Å; T43-R46 PolarHBondContact O-N 3.07Å; R44-R46 VanDerWaalsContact C-N 3.29Å; R44-R46 PolarHBondContact O-N 2.84Å; R46-E49 WeakPolarHBondContact CD-OE2 3.26Å; R46-E49 IonicContact CZ-OE2 2.68Å; R46-E49 IonicContact NE-OE2 3.19Å; R46-E49 IonicContact NH1-OE2 2.87Å; R46-E49 PolarHBondContact NH1-OE2 3.47Å; R46-L50 HydrophobicContact CG-CD1 4.42Å; R46-L50 WeakPolarHBondContact O-CG 3.47Å; R46-L50 PolarHBondContact O-N 3.2Å; R46-L50 VanDerWaalsContact O-N 3.1Å; R46-L64 HydrophobicContact CB-CD1 4.1Å; R46-L64 HydrophobicContact CB-CD2 4.41Å; R46-L64 HydrophobicContact CG-CD1 3.98Å; R46-L64 HydrophobicContact CG-CD2 3.64Å; R46-L64 HydrophobicContact CG-CG 4.46Å
47	I	97.4	Very high	95.7	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-62.4	-42.3	170.4	-73.6	164.5	0	0	0	110.9	L39 T43 R44 Q45 A51 I60 L64 V66 V71 I74 L75	L39-I47 HydrophobicContact CD2-CD1 3.81Å; T43-I47 WeakPolarHBondContact O-CG1 3.38Å; T43-I47 PolarHBondContact O-N 3.06Å; R44-I47 WeakPolarHBondContact O-CB 3.42Å; R44-I47 PolarHBondContact O-N 3.17Å; Q45-I47 VanDerWaalsContact C-N 3.3Å; Q45-I47 PolarHBondContact O-N 3.34Å; I47-A51 WeakPolarHBondContact O-CB 3.26Å; I47-A51 PolarHBondContact O-N 3.08Å; I47-I60 HydrophobicContact CB-CG2 4.29Å; I47-I60 HydrophobicContact CG1-CG2 3.92Å; I47-I60 HydrophobicContact CG2-CG2 4.26Å; I47-L64 HydrophobicContact CB-CD1 4.44Å; I47-L64 HydrophobicContact CG1-CD1 3.55Å; I47-V66 HydrophobicContact CD1-CG1 4.25Å; I47-V66 HydrophobicContact CD1-CG2 4.38Å; I47-V71 HydrophobicContact CD1-CG2 4.28Å; I47-V71 HydrophobicContact CG2-CG1 4.02Å; I47-I74 HydrophobicContact CB-CG2 4.39Å; I47-I74 HydrophobicContact CD1-CD1 3.57Å; I47-I74 HydrophobicContact CG2-CB 4.36Å; I47-I74 HydrophobicContact CG2-CG2 3.91Å; I47-L75 HydrophobicContact CG2-CD2 3.91Å; I47-L75 HydrophobicContact CG2-CG 3.97Å
48	I	96.9	Very high	96	Very high	4 Å²	4	59.5 Å²	59.5	2%	0.021	34%	0.335	C	S	.	.	H	α-helix	trans	-70.7	-44.6	178	-55.4	-45.5	0	0	0	111.1	R44 Q45 L50 A51 H52 I74 L75 Y78 I84	R44-I48 PolarHBondContact O-N 3.35Å; Q45-I48 PolarHBondContact O-N 3.25Å; I48-L50 VanDerWaalsContact C-N 3.34Å; I48-L50 PolarHBondContact O-N 3.05Å; I48-A51 PolarHBondContact O-N 3.36Å; I48-A51 VanDerWaalsContact O-N 3.17Å; I48-H52 VanDerWaalsContact CG2-CE1 3.41Å; I48-H52 WeakPolarHBondContact CG2-CE1 3.19Å; I48-H52 PolarHBondContact O-N 3.17Å; I48-I74 HydrophobicContact CD1-CG2 4.04Å; I48-L75 HydrophobicContact CD1-CD2 3.8Å; I48-Y78 HydrophobicContact CD1-CD1 3.9Å; I48-Y78 HydrophobicContact CD1-CD2 4.06Å; I48-Y78 HydrophobicContact CD1-CG 3.54Å; I48-Y78 HydrophobicContact CG1-CD1 4.45Å; I48-Y78 HydrophobicContact CG1-CD2 4.05Å; I48-Y78 HydrophobicContact CG1-CE2 4.49Å; I48-Y78 HydrophobicContact CG1-CG 4.04Å; I48-Y78 HydrophobicContact CG2-CD1 4Å; I48-Y78 HydrophobicContact CG2-CD2 4.29Å; I48-Y78 HydrophobicContact CG2-CE1 3.68Å; I48-Y78 HydrophobicContact CG2-CE2 4Å; I48-Y78 HydrophobicContact CG2-CG 4.3Å; I48-I84 HydrophobicContact CG1-CG2 3.99Å
49	E	97	Very high	96.1	Very high	76 Å²	76	58.6 Å²	58.6	36%	0.355	33%	0.327	S	S	.	.	H	α-helix	trans	-55	-46.8	177	-72.5	172.7	-173.6	0	0	112.4	Q45 R46 H52 S53	Q45-E49 HydrophobicContact CG-CG 4.41Å; Q45-E49 WeakPolarHBondContact CG-OE1 3.4Å; Q45-E49 WeakPolarHBondContact O-CG 3.35Å; Q45-E49 PolarHBondContact O-N 3.34Å; R46-E49 WeakPolarHBondContact CD-OE2 3.26Å; R46-E49 IonicContact CZ-OE2 2.68Å; R46-E49 IonicContact NE-OE2 3.19Å; R46-E49 IonicContact NH1-OE2 2.87Å; R46-E49 PolarHBondContact NH1-OE2 3.47Å; E49-H52 PolarHBondContact O-N 3.02Å; E49-S53 PolarHBondContact O-N 3.5Å
50	L	97.1	Very high	96.3	Very high	17 Å²	17	57 Å²	57	9%	0.089	32%	0.319	C	S	.	.	H	α-helix	trans	-69.6	-34	179.2	-68.2	175.9	0	0	0	112.4	R46 I48 S53 G54 A55 I60 I63 L64	R46-L50 HydrophobicContact CG-CD1 4.42Å; R46-L50 WeakPolarHBondContact O-CG 3.47Å; R46-L50 PolarHBondContact O-N 3.2Å; R46-L50 VanDerWaalsContact O-N 3.1Å; I48-L50 VanDerWaalsContact C-N 3.34Å; I48-L50 PolarHBondContact O-N 3.05Å; L50-S53 WeakPolarHBondContact CA-OG 3.28Å; L50-S53 CarbonylContact O-C 3.57Å; L50-S53 PolarHBondContact O-N 3.07Å; L50-S53 PolarHBondContact O-OG 2.79Å; L50-S53 VanDerWaalsContact O-OG 3.06Å; L50-G54 PolarHBondContact O-N 2.85Å; L50-A55 HydrophobicContact CB-CB 4.17Å; L50-A55 WeakPolarHBondContact O-CB 3.35Å; L50-A55 PolarHBondContact O-N 3.09Å; L50-I60 HydrophobicContact CB-CD1 4.04Å; L50-I60 HydrophobicContact CB-CG1 3.78Å; L50-I60 HydrophobicContact CD1-CG1 4.46Å; L50-I60 HydrophobicContact CD1-CG2 4.38Å; L50-I63 HydrophobicContact CD1-CB 4.48Å; L50-I63 HydrophobicContact CD1-CG2 3.95Å; L50-L64 HydrophobicContact CD1-CD1 3.94Å; L50-L64 HydrophobicContact CD1-CD2 4.09Å; L50-L64 HydrophobicContact CD1-CG 3.91Å
51	A	97.2	Very high	96.5	Very high	17 Å²	17	53.9 Å²	53.9	14%	0.14	30%	0.298	C	S	.	.	H	α-helix	trans	-68.5	-38.5	174.5	0	0	0	0	0	112	I47 I48 S53 G54 I60 L75	I47-A51 WeakPolarHBondContact O-CB 3.26Å; I47-A51 PolarHBondContact O-N 3.08Å; I48-A51 PolarHBondContact O-N 3.36Å; I48-A51 VanDerWaalsContact O-N 3.17Å; A51-S53 VanDerWaalsContact C-N 3.32Å; A51-G54 PolarHBondContact O-N 3.01Å; A51-G54 VanDerWaalsContact O-N 3.12Å; A51-I60 HydrophobicContact CB-CD1 3.83Å; A51-L75 HydrophobicContact CB-CD1 4.43Å; A51-L75 HydrophobicContact CB-CD2 3.46Å; A51-L75 VanDerWaalsContact CB-CD2 3.46Å
52	H	96	Very high	96.6	Very high	116 Å²	116	59.5 Å²	59.5	54%	0.537	31%	0.314	S	S	.	.	H	α-helix	trans	-67	-31.4	171.6	-68.9	171.7	0	0	0	112.6	I48 E49 G54 Y78	I48-H52 VanDerWaalsContact CG2-CE1 3.41Å; I48-H52 WeakPolarHBondContact CG2-CE1 3.19Å; I48-H52 PolarHBondContact O-N 3.17Å; E49-H52 PolarHBondContact O-N 3.02Å; H52-G54 PolarHBondContact O-N 3.33Å; H52-Y78 AromaticContact CE1-CE1 3.8Å; H52-Y78 AromaticContact CE1-CZ 3.85Å; H52-Y78 PolarHBondContact CE1-OH 3.08Å; H52-Y78 AromaticContact NE2-CE1 3.4Å; H52-Y78 WeakPolarHBondContact NE2-CE1 3.24Å; H52-Y78 AromaticContact NE2-CZ 3.93Å
53	S	96.4	Very high	96.6	Very high	87 Å²	87	59.2 Å²	59.2	61%	0.608	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	18.4	170	81.5	0	0	0	0	113.7	E49 L50 A51 A55	E49-S53 PolarHBondContact O-N 3.5Å; L50-S53 WeakPolarHBondContact CA-OG 3.28Å; L50-S53 CarbonylContact O-C 3.57Å; L50-S53 PolarHBondContact O-N 3.07Å; L50-S53 PolarHBondContact O-OG 2.79Å; L50-S53 VanDerWaalsContact O-OG 3.06Å; A51-S53 VanDerWaalsContact C-N 3.32Å; S53-A55 VanDerWaalsContact C-N 3.34Å; S53-A55 PolarHBondContact O-N 3.38Å
54	G	95.3	Very high	96.7	Very high	63 Å²	63	59.2 Å²	59.2	65%	0.649	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	76	7.6	173.4	0	0	0	0	0	116.4	L50 A51 H52	L50-G54 PolarHBondContact O-N 2.85Å; A51-G54 PolarHBondContact O-N 3.01Å; A51-G54 VanDerWaalsContact O-N 3.12Å; H52-G54 PolarHBondContact O-N 3.33Å
55	A	96.3	Very high	96.6	Very high	24 Å²	24	62.9 Å²	62.9	20%	0.198	32%	0.323	C	S	.	.			trans	-71.4	137	177.3	0	0	0	0	0	111.1	L50 S53 I60	L50-A55 HydrophobicContact CB-CB 4.17Å; L50-A55 WeakPolarHBondContact O-CB 3.35Å; L50-A55 PolarHBondContact O-N 3.09Å; S53-A55 VanDerWaalsContact C-N 3.34Å; S53-A55 PolarHBondContact O-N 3.38Å; A55-I60 HydrophobicContact CB-CD1 4.28Å; A55-I60 HydrophobicContact CB-CG1 3.79Å; A55-I60 WeakPolarHBondContact O-CD1 3.37Å
56	R	96.1	Very high	96.6	Very high	153 Å²	153	60.2 Å²	60.2	58%	0.577	31%	0.311	S	S	*	.			trans	-73.6	151.6	-179.6	-52.6	170.2	-62.4	-179.7	4.7	109.9	C58 D59 I60	R56-C58 PolarHBondContact O-N 3.02Å; R56-D59 VanDerWaalsContact CB-OD2 3.29Å; R56-D59 WeakPolarHBondContact CB-OD2 3.23Å; R56-D59 IonicContact CZ-OD1 3.63Å; R56-D59 IonicContact CZ-OD2 3.67Å; R56-D59 PolarHBondContact N-OD2 2.69Å; R56-D59 IonicContact NE-OD1 2.85Å; R56-D59 IonicContact NE-OD2 3.71Å; R56-D59 PolarHBondContact NE-OD2 3.33Å; R56-D59 IonicContact NH2-OD1 3.11Å; R56-D59 PolarHBondContact NH2-OD1 3.48Å; R56-D59 IonicContact NH2-OD2 3.68Å; R56-D59 PolarHBondContact NH2-OD2 3.04Å; R56-D59 WeakPolarHBondContact O-CB 3.29Å; R56-D59 PolarHBondContact O-N 3.27Å; R56-I60 WeakPolarHBondContact O-CG1 3.39Å; R56-I60 PolarHBondContact O-N 3.25Å
57	P	96.9	Very high	96.6	Very high	60 Å²	60	57.7 Å²	57.7	39%	0.39	31%	0.312	S	S	.	.	H	α-helix	trans	-54.1	-32	-179.5	-28.6	35.6	0	0	0	114.8	S61 V71 L75	P57-S61 VanDerWaalsContact O-CB 3.24Å; P57-S61 WeakPolarHBondContact O-CB 3.49Å; P57-S61 PolarHBondContact O-N 3Å; P57-V71 HydrophobicContact CB-CG1 4.19Å; P57-L75 HydrophobicContact CB-CD1 4.16Å; P57-L75 HydrophobicContact CG-CD1 3.89Å
58	C	96.8	Very high	96.6	Very high	49 Å²	49	61.4 Å²	61.4	33%	0.331	33%	0.331	S	S	.	.	H	α-helix	trans	-70.8	-33.9	174.6	52.6	0	0	0	0	113.7	R56 R62	R56-C58 PolarHBondContact O-N 3.02Å; C58-R62 WeakPolarHBondContact O-CG 3.31Å; C58-R62 PolarHBondContact O-N 3.18Å
59	D	97.1	Very high	96.5	Very high	41 Å²	41	63.3 Å²	63.3	22%	0.219	35%	0.353	C	S	.	.	H	α-helix	trans	-73.2	-44.9	175.1	-52.6	-44.4	0	0	0	109.7	R56 S61 R62 I63	R56-D59 VanDerWaalsContact CB-OD2 3.29Å; R56-D59 WeakPolarHBondContact CB-OD2 3.23Å; R56-D59 IonicContact CZ-OD1 3.63Å; R56-D59 IonicContact CZ-OD2 3.67Å; R56-D59 PolarHBondContact N-OD2 2.69Å; R56-D59 IonicContact NE-OD1 2.85Å; R56-D59 IonicContact NE-OD2 3.71Å; R56-D59 PolarHBondContact NE-OD2 3.33Å; R56-D59 IonicContact NH2-OD1 3.11Å; R56-D59 PolarHBondContact NH2-OD1 3.48Å; R56-D59 IonicContact NH2-OD2 3.68Å; R56-D59 PolarHBondContact NH2-OD2 3.04Å; R56-D59 WeakPolarHBondContact O-CB 3.29Å; R56-D59 PolarHBondContact O-N 3.27Å; D59-S61 VanDerWaalsContact C-N 3.27Å; D59-S61 PolarHBondContact O-N 3.16Å; D59-R62 PolarHBondContact O-N 2.95Å; D59-R62 VanDerWaalsContact O-N 3.08Å; D59-I63 HydrophobicContact CB-CD1 4.34Å; D59-I63 WeakPolarHBondContact O-CB 3.34Å; D59-I63 WeakPolarHBondContact O-CD1 3.35Å; D59-I63 VanDerWaalsContact O-CG1 3.24Å; D59-I63 WeakPolarHBondContact O-CG1 3.16Å; D59-I63 PolarHBondContact O-N 3.48Å
60	I	97.3	Very high	96.5	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-55.7	-44	173.8	-61.2	173.1	0	0	0	110.8	I47 L50 A51 A55 R56 R62 I63 L64 V71 L75	I47-I60 HydrophobicContact CB-CG2 4.29Å; I47-I60 HydrophobicContact CG1-CG2 3.92Å; I47-I60 HydrophobicContact CG2-CG2 4.26Å; L50-I60 HydrophobicContact CB-CD1 4.04Å; L50-I60 HydrophobicContact CB-CG1 3.78Å; L50-I60 HydrophobicContact CD1-CG1 4.46Å; L50-I60 HydrophobicContact CD1-CG2 4.38Å; A51-I60 HydrophobicContact CB-CD1 3.83Å; A55-I60 HydrophobicContact CB-CD1 4.28Å; A55-I60 HydrophobicContact CB-CG1 3.79Å; A55-I60 WeakPolarHBondContact O-CD1 3.37Å; R56-I60 WeakPolarHBondContact O-CG1 3.39Å; R56-I60 PolarHBondContact O-N 3.25Å; I60-R62 VanDerWaalsContact C-N 3.32Å; I60-R62 PolarHBondContact O-N 3.36Å; I60-I63 PolarHBondContact O-N 3.08Å; I60-L64 HydrophobicContact CG2-CD1 3.95Å; I60-L64 WeakPolarHBondContact O-CB 3.38Å; I60-L64 PolarHBondContact O-N 3.3Å; I60-V71 HydrophobicContact CB-CG1 4.12Å; I60-V71 HydrophobicContact CG2-CG1 3.84Å; I60-V71 HydrophobicContact CG2-CG2 4.3Å; I60-L75 HydrophobicContact CD1-CD1 4.49Å
61	S	97.5	Very high	96.5	Very high	8 Å²	8	60.7 Å²	60.7	6%	0.056	34%	0.343	C	S	.	.	H	α-helix	trans	-58	-41.8	176.6	178.3	0	0	0	0	112.4	P57 D59 Q65 V66 N68	P57-S61 VanDerWaalsContact O-CB 3.24Å; P57-S61 WeakPolarHBondContact O-CB 3.49Å; P57-S61 PolarHBondContact O-N 3Å; D59-S61 VanDerWaalsContact C-N 3.27Å; D59-S61 PolarHBondContact O-N 3.16Å; S61-Q65 CarbonylContact O-C 3.6Å; S61-Q65 VanDerWaalsContact O-CA 3.28Å; S61-Q65 WeakPolarHBondContact O-CA 3.34Å; S61-Q65 PolarHBondContact O-N 3.28Å; S61-Q65 VanDerWaalsContact O-N 3.13Å; S61-V66 CarbonylContact C-O 3.59Å; S61-V66 VanDerWaalsContact CA-O 3.24Å; S61-V66 WeakPolarHBondContact CA-O 3.27Å; S61-V66 VanDerWaalsContact CB-O 3.31Å; S61-V66 WeakPolarHBondContact CB-O 3.48Å; S61-V66 PolarHBondContact O-N 3.43Å; S61-V66 PolarHBondContact OG-O 3.48Å; S61-N68 WeakPolarHBondContact OG-CA 3.48Å; S61-N68 PolarHBondContact OG-N 2.89Å
62	R	96.1	Very high	96.5	Very high	192 Å²	192	62.3 Å²	62.3	73%	0.725	35%	0.354	S	S	*	.	H	α-helix	trans	-73.1	-48.9	176.7	-69.2	172.6	177.2	-169.3	-1.9	112.2	C58 D59 I60 L64 Q65	C58-R62 WeakPolarHBondContact O-CG 3.31Å; C58-R62 PolarHBondContact O-N 3.18Å; D59-R62 PolarHBondContact O-N 2.95Å; D59-R62 VanDerWaalsContact O-N 3.08Å; I60-R62 VanDerWaalsContact C-N 3.32Å; I60-R62 PolarHBondContact O-N 3.36Å; R62-L64 VanDerWaalsContact C-N 3.35Å; R62-L64 PolarHBondContact O-N 3.49Å; R62-Q65 PolarHBondContact O-N 3.23Å
63	I	95.9	Very high	96.5	Very high	107 Å²	107	64.5 Å²	64.5	55%	0.549	36%	0.362	S	S	.	.	H	α-helix	trans	-60.4	-42.1	-176.6	-68.8	163.1	0	0	0	111.8	L50 D59 I60	L50-I63 HydrophobicContact CD1-CB 4.48Å; L50-I63 HydrophobicContact CD1-CG2 3.95Å; D59-I63 HydrophobicContact CB-CD1 4.34Å; D59-I63 WeakPolarHBondContact O-CB 3.34Å; D59-I63 WeakPolarHBondContact O-CD1 3.35Å; D59-I63 VanDerWaalsContact O-CG1 3.24Å; D59-I63 WeakPolarHBondContact O-CG1 3.16Å; D59-I63 PolarHBondContact O-N 3.48Å; I60-I63 PolarHBondContact O-N 3.08Å
64	L	96.1	Very high	96.6	Very high	38 Å²	38	60.9 Å²	60.9	20%	0.199	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	1.6	-179.2	-56.9	-179.6	0	0	0	113.3	R46 I47 L50 I60 R62 V66	R46-L64 HydrophobicContact CB-CD1 4.1Å; R46-L64 HydrophobicContact CB-CD2 4.41Å; R46-L64 HydrophobicContact CG-CD1 3.98Å; R46-L64 HydrophobicContact CG-CD2 3.64Å; R46-L64 HydrophobicContact CG-CG 4.46Å; I47-L64 HydrophobicContact CB-CD1 4.44Å; I47-L64 HydrophobicContact CG1-CD1 3.55Å; L50-L64 HydrophobicContact CD1-CD1 3.94Å; L50-L64 HydrophobicContact CD1-CD2 4.09Å; L50-L64 HydrophobicContact CD1-CG 3.91Å; I60-L64 HydrophobicContact CG2-CD1 3.95Å; I60-L64 WeakPolarHBondContact O-CB 3.38Å; I60-L64 PolarHBondContact O-N 3.3Å; R62-L64 VanDerWaalsContact C-N 3.35Å; R62-L64 PolarHBondContact O-N 3.49Å; L64-V66 HydrophobicContact CB-CG2 3.96Å; L64-V66 WeakPolarHBondContact O-CG2 3.35Å; L64-V66 PolarHBondContact O-N 3.44Å; L64-V66 VanDerWaalsContact O-N 3.11Å
65	Q	96.4	Very high	96.6	Very high	89 Å²	89	58.3 Å²	58.3	42%	0.416	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	28.7	-175.2	-54.4	177.9	-23.5	0	0	113.6	N27 L29 G30 G31 S61 R62	N27-Q65 PolarHBondContact ND2-O 3.47Å; N27-Q65 PolarHBondContact OD1-O 3.09Å; L29-Q65 HydrophobicContact CB-CB 4.09Å; L29-Q65 WeakPolarHBondContact O-CB 3.44Å; L29-Q65 VanDerWaalsContact O-CD 3.28Å; L29-Q65 WeakPolarHBondContact O-CG 3.28Å; G30-Q65 VanDerWaalsContact C-OE1 3.26Å; G30-Q65 PolarHBondContact O-OE1 2.95Å; G31-Q65 WeakPolarHBondContact CA-O 3.37Å; S61-Q65 CarbonylContact O-C 3.6Å; S61-Q65 VanDerWaalsContact O-CA 3.28Å; S61-Q65 WeakPolarHBondContact O-CA 3.34Å; S61-Q65 PolarHBondContact O-N 3.28Å; S61-Q65 VanDerWaalsContact O-N 3.13Å; R62-Q65 PolarHBondContact O-N 3.23Å
66	V	96.3	Very high	96.6	Very high	6 Å²	6	60 Å²	60	4%	0.036	32%	0.317	C	S	.	.			trans	-96	134.2	179.1	177.7	0	0	0	0	108.7	L29 L39 T43 I47 S61 L64 N68 C70 V71	L29-V66 WeakPolarHBondContact CD1-O 3.49Å; L39-V66 HydrophobicContact CD1-CG2 4.32Å; L39-V66 HydrophobicContact CD2-CG1 3.97Å; L39-V66 HydrophobicContact CD2-CG2 3.78Å; T43-V66 HydrophobicContact CG2-CG2 3.96Å; I47-V66 HydrophobicContact CD1-CG1 4.25Å; I47-V66 HydrophobicContact CD1-CG2 4.38Å; S61-V66 CarbonylContact C-O 3.59Å; S61-V66 VanDerWaalsContact CA-O 3.24Å; S61-V66 WeakPolarHBondContact CA-O 3.27Å; S61-V66 VanDerWaalsContact CB-O 3.31Å; S61-V66 WeakPolarHBondContact CB-O 3.48Å; S61-V66 PolarHBondContact O-N 3.43Å; S61-V66 PolarHBondContact OG-O 3.48Å; L64-V66 HydrophobicContact CB-CG2 3.96Å; L64-V66 WeakPolarHBondContact O-CG2 3.35Å; L64-V66 PolarHBondContact O-N 3.44Å; L64-V66 VanDerWaalsContact O-N 3.11Å; V66-N68 PolarHBondContact O-N 3.04Å; V66-C70 HydrophobicContact CG1-CB 3.76Å; V66-V71 HydrophobicContact CB-CG2 3.9Å; V66-V71 HydrophobicContact CG1-CG2 3.76Å
67	S	96.4	Very high	96.5	Very high	64 Å²	64	54.7 Å²	54.7	45%	0.448	30%	0.296	S	S	.	.			trans	-56.8	136.9	178.9	62.7	0	0	0	0	111.8	G69 C70 V71	S67-G69 VanDerWaalsContact C-N 3.27Å; S67-G69 PolarHBondContact O-N 2.62Å; S67-C70 WeakPolarHBondContact O-CA 3.47Å; S67-C70 VanDerWaalsContact O-CB 3.3Å; S67-C70 WeakPolarHBondContact O-CB 3.42Å; S67-C70 PolarHBondContact O-N 2.94Å; S67-C70 WeakPolarHBondContact OG-CB 3.18Å; S67-V71 PolarHBondContact O-N 3.29Å; S67-V71 VanDerWaalsContact O-N 3.11Å
68	N	96.7	Very high	96.5	Very high	78 Å²	78	54.5 Å²	54.5	42%	0.417	29%	0.289	S	S	.	.	H	α-helix	trans	-56.5	-40.1	-171.7	-167.7	-0.1	0	0	0	112.4	S61 V66 C70 V71 S72	S61-N68 WeakPolarHBondContact OG-CA 3.48Å; S61-N68 PolarHBondContact OG-N 2.89Å; V66-N68 PolarHBondContact O-N 3.04Å; N68-C70 PolarHBondContact O-N 3Å; N68-V71 PolarHBondContact O-N 2.83Å; N68-S72 WeakPolarHBondContact O-CB 3.18Å; N68-S72 PolarHBondContact O-N 3.06Å
69	G	96.4	Very high	96.4	Very high	45 Å²	45	59.3 Å²	59.3	46%	0.464	30%	0.301	S	S	.	.	H	α-helix	trans	-65.8	-17.1	173.7	0	0	0	0	0	115.3	S67 K73	S67-G69 VanDerWaalsContact C-N 3.27Å; S67-G69 PolarHBondContact O-N 2.62Å; G69-K73 WeakPolarHBondContact O-CB 3.41Å; G69-K73 VanDerWaalsContact O-CD 3.27Å; G69-K73 WeakPolarHBondContact O-CD 2.95Å; G69-K73 WeakPolarHBondContact O-CG 3.43Å; G69-K73 PolarHBondContact O-N 3.16Å
70	C	96.2	Very high	96.3	Very high	37 Å²	37	63.9 Å²	63.9	25%	0.25	32%	0.321	C	S	.	.	H	α-helix	trans	-84.7	-43.1	169.4	-176.4	0	0	0	0	111.2	V66 S67 N68 S72 K73 I74	V66-C70 HydrophobicContact CG1-CB 3.76Å; S67-C70 WeakPolarHBondContact O-CA 3.47Å; S67-C70 VanDerWaalsContact O-CB 3.3Å; S67-C70 WeakPolarHBondContact O-CB 3.42Å; S67-C70 PolarHBondContact O-N 2.94Å; S67-C70 WeakPolarHBondContact OG-CB 3.18Å; N68-C70 PolarHBondContact O-N 3Å; C70-S72 PolarHBondContact O-N 3.46Å; C70-K73 PolarHBondContact O-N 2.71Å; C70-I74 WeakPolarHBondContact O-CD1 3.44Å; C70-I74 WeakPolarHBondContact O-CG1 3.49Å; C70-I74 PolarHBondContact O-N 3.26Å
71	V	97.5	Very high	96.1	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-55.7	-51.8	173.1	178.2	0	0	0	0	110.7	I47 P57 I60 V66 S67 N68 K73 I74 L75	I47-V71 HydrophobicContact CD1-CG2 4.28Å; I47-V71 HydrophobicContact CG2-CG1 4.02Å; P57-V71 HydrophobicContact CB-CG1 4.19Å; I60-V71 HydrophobicContact CB-CG1 4.12Å; I60-V71 HydrophobicContact CG2-CG1 3.84Å; I60-V71 HydrophobicContact CG2-CG2 4.3Å; V66-V71 HydrophobicContact CB-CG2 3.9Å; V66-V71 HydrophobicContact CG1-CG2 3.76Å; S67-V71 PolarHBondContact O-N 3.29Å; S67-V71 VanDerWaalsContact O-N 3.11Å; N68-V71 PolarHBondContact O-N 2.83Å; V71-K73 PolarHBondContact O-N 3.1Å; V71-I74 PolarHBondContact O-N 3.45Å; V71-I74 VanDerWaalsContact O-N 3.11Å; V71-L75 HydrophobicContact CG1-CD1 3.79Å; V71-L75 HydrophobicContact CG1-CG 4.36Å; V71-L75 WeakPolarHBondContact O-CG 3.47Å; V71-L75 PolarHBondContact O-N 3Å
72	S	97.3	Very high	95.9	Very high	52 Å²	52	68.9 Å²	68.9	36%	0.364	36%	0.36	S	S	.	.	H	α-helix	trans	-55	-49	175.5	165.7	0	0	0	0	112.5	N68 C70 I74 L75 C76	N68-S72 WeakPolarHBondContact O-CB 3.18Å; N68-S72 PolarHBondContact O-N 3.06Å; C70-S72 PolarHBondContact O-N 3.46Å; S72-I74 PolarHBondContact O-N 3.21Å; S72-L75 PolarHBondContact O-N 3.02Å; S72-C76 WeakPolarHBondContact O-CB 3.41Å; S72-C76 PolarHBondContact O-N 3.08Å; S72-C76 PolarHBondContact O-SG 3.39Å; S72-C76 VanDerWaalsContact O-SG 3.33Å
73	K	96.6	Very high	95.8	Very high	162 Å²	162	61 Å²	61	70%	0.704	33%	0.334	S	S	*	.	H	α-helix	trans	-62.8	-26.2	178.1	-76.6	173.2	-173.6	175	0	113.9	G69 C70 V71 R77	G69-K73 WeakPolarHBondContact O-CB 3.41Å; G69-K73 VanDerWaalsContact O-CD 3.27Å; G69-K73 WeakPolarHBondContact O-CD 2.95Å; G69-K73 WeakPolarHBondContact O-CG 3.43Å; G69-K73 PolarHBondContact O-N 3.16Å; C70-K73 PolarHBondContact O-N 2.71Å; V71-K73 PolarHBondContact O-N 3.1Å; K73-R77 VanDerWaalsContact O-CB 3.28Å; K73-R77 WeakPolarHBondContact O-CB 3.48Å
74	I	96.6	Very high	95.6	Very high	10 Å²	10	57.7 Å²	57.7	5%	0.051	32%	0.317	C	S	.	.	H	α-helix	trans	-79.8	-45.2	175.3	-69.8	161	0	0	0	110.2	L39 R44 I47 I48 C70 V71 S72 Y78	L39-I74 HydrophobicContact CD2-CD1 4.03Å; R44-I74 HydrophobicContact CG-CD1 3.89Å; I47-I74 HydrophobicContact CB-CG2 4.39Å; I47-I74 HydrophobicContact CD1-CD1 3.57Å; I47-I74 HydrophobicContact CG2-CB 4.36Å; I47-I74 HydrophobicContact CG2-CG2 3.91Å; I48-I74 HydrophobicContact CD1-CG2 4.04Å; C70-I74 WeakPolarHBondContact O-CD1 3.44Å; C70-I74 WeakPolarHBondContact O-CG1 3.49Å; C70-I74 PolarHBondContact O-N 3.26Å; V71-I74 PolarHBondContact O-N 3.45Å; V71-I74 VanDerWaalsContact O-N 3.11Å; S72-I74 PolarHBondContact O-N 3.21Å; I74-Y78 WeakPolarHBondContact O-CB 3.26Å; I74-Y78 PolarHBondContact O-N 3.44Å
75	L	96.9	Very high	95.4	Very high	9 Å²	9	63.9 Å²	63.9	5%	0.047	34%	0.338	C	S	.	.	H	α-helix	trans	-65.8	-51.3	179.8	-68.9	173.7	0	0	0	112.5	I47 I48 A51 P57 I60 V71 S72 R77 Y78 Y79	I47-L75 HydrophobicContact CG2-CD2 3.91Å; I47-L75 HydrophobicContact CG2-CG 3.97Å; I48-L75 HydrophobicContact CD1-CD2 3.8Å; A51-L75 HydrophobicContact CB-CD1 4.43Å; A51-L75 HydrophobicContact CB-CD2 3.46Å; A51-L75 VanDerWaalsContact CB-CD2 3.46Å; P57-L75 HydrophobicContact CB-CD1 4.16Å; P57-L75 HydrophobicContact CG-CD1 3.89Å; I60-L75 HydrophobicContact CD1-CD1 4.49Å; V71-L75 HydrophobicContact CG1-CD1 3.79Å; V71-L75 HydrophobicContact CG1-CG 4.36Å; V71-L75 WeakPolarHBondContact O-CG 3.47Å; V71-L75 PolarHBondContact O-N 3Å; S72-L75 PolarHBondContact O-N 3.02Å; L75-R77 VanDerWaalsContact C-N 3.31Å; L75-R77 PolarHBondContact O-N 3.15Å; L75-Y78 WeakPolarHBondContact O-CB 3.32Å; L75-Y78 PolarHBondContact O-N 3.3Å; L75-Y79 HydrophobicContact CB-CD2 4.47Å; L75-Y79 HydrophobicContact CB-CE2 3.96Å; L75-Y79 WeakPolarHBondContact O-CD2 3.39Å; L75-Y79 PolarHBondContact O-N 3.47Å
76	C	95.5	Very high	95.2	Very high	60 Å²	60	62 Å²	62	41%	0.405	33%	0.333	S	S	.	.	H	α-helix	trans	-55	-47.9	177.4	-64.3	0	0	0	0	111.2	S72 Y78 Y79 E80	S72-C76 WeakPolarHBondContact O-CB 3.41Å; S72-C76 PolarHBondContact O-N 3.08Å; S72-C76 PolarHBondContact O-SG 3.39Å; S72-C76 VanDerWaalsContact O-SG 3.33Å; C76-Y78 VanDerWaalsContact C-N 3.32Å; C76-Y78 PolarHBondContact O-N 3.16Å; C76-Y79 PolarHBondContact O-N 3.03Å; C76-E80 WeakPolarHBondContact O-CB 3.45Å; C76-E80 VanDerWaalsContact O-CG 3.23Å; C76-E80 WeakPolarHBondContact O-CG 3.43Å; C76-E80 PolarHBondContact O-N 3.38Å
77	R	94.1	Very high	94.8	Very high	41 Å²	41	68.9 Å²	68.9	16%	0.155	36%	0.363	C	S	.	.	H	α-helix	trans	-63	-36.3	176.9	-173.5	-133.4	171	85.3	-1.7	112.7	K73 L75 E80 T81 S83 R85 P86	K73-R77 VanDerWaalsContact O-CB 3.28Å; K73-R77 WeakPolarHBondContact O-CB 3.48Å; L75-R77 VanDerWaalsContact C-N 3.31Å; L75-R77 PolarHBondContact O-N 3.15Å; R77-E80 PolarHBondContact O-N 3.27Å; R77-T81 WeakPolarHBondContact O-CB 3.4Å; R77-T81 PolarHBondContact O-N 2.89Å; R77-T81 PolarHBondContact O-OG1 3.42Å; R77-S83 PolarHBondContact NE-O 3.2Å; R77-R85 PolarHBondContact NE-O 3.23Å; R77-R85 PolarHBondContact NH2-O 3Å; R77-P86 PolarHBondContact NH2-O 2.72Å
78	Y	96.6	Very high	94.3	Very high	57 Å²	57	70.7 Å²	70.7	22%	0.224	38%	0.382	C	S	.	.	H	α-helix	trans	-66.1	-46.4	176.1	176.2	-100	0	0	0	111	I48 H52 I74 L75 C76 E80 T81 G82 I84	I48-Y78 HydrophobicContact CD1-CD1 3.9Å; I48-Y78 HydrophobicContact CD1-CD2 4.06Å; I48-Y78 HydrophobicContact CD1-CG 3.54Å; I48-Y78 HydrophobicContact CG1-CD1 4.45Å; I48-Y78 HydrophobicContact CG1-CD2 4.05Å; I48-Y78 HydrophobicContact CG1-CE2 4.49Å; I48-Y78 HydrophobicContact CG1-CG 4.04Å; I48-Y78 HydrophobicContact CG2-CD1 4Å; I48-Y78 HydrophobicContact CG2-CD2 4.29Å; I48-Y78 HydrophobicContact CG2-CE1 3.68Å; I48-Y78 HydrophobicContact CG2-CE2 4Å; I48-Y78 HydrophobicContact CG2-CG 4.3Å; H52-Y78 AromaticContact CE1-CE1 3.8Å; H52-Y78 AromaticContact CE1-CZ 3.85Å; H52-Y78 PolarHBondContact CE1-OH 3.08Å; H52-Y78 AromaticContact NE2-CE1 3.4Å; H52-Y78 WeakPolarHBondContact NE2-CE1 3.24Å; H52-Y78 AromaticContact NE2-CZ 3.93Å; I74-Y78 WeakPolarHBondContact O-CB 3.26Å; I74-Y78 PolarHBondContact O-N 3.44Å; L75-Y78 WeakPolarHBondContact O-CB 3.32Å; L75-Y78 PolarHBondContact O-N 3.3Å; C76-Y78 VanDerWaalsContact C-N 3.32Å; C76-Y78 PolarHBondContact O-N 3.16Å; Y78-E80 VanDerWaalsContact C-N 3.32Å; Y78-E80 PolarHBondContact O-N 3.24Å; Y78-T81 PolarHBondContact O-N 3.45Å; Y78-G82 WeakPolarHBondContact CE2-O 3.47Å; Y78-G82 VanDerWaalsContact O-CA 3.26Å; Y78-G82 WeakPolarHBondContact O-CA 3.46Å; Y78-G82 PolarHBondContact O-N 2.89Å; Y78-I84 HydrophobicContact CD2-CG2 4Å; Y78-I84 HydrophobicContact CE2-CG2 4.17Å
79	Y	95.4	Very high	93.7	Very high	150 Å²	150	73 Å²	73	59%	0.588	39%	0.393	S	S	*	.	H	α-helix	trans	-66.2	-31.1	174.8	-56.2	-49.3	0	0	0	113.1	L75 C76	L75-Y79 HydrophobicContact CB-CD2 4.47Å; L75-Y79 HydrophobicContact CB-CE2 3.96Å; L75-Y79 WeakPolarHBondContact O-CD2 3.39Å; L75-Y79 PolarHBondContact O-N 3.47Å; C76-Y79 PolarHBondContact O-N 3.03Å
80	E	95.2	Very high	92.8	Very high	137 Å²	137	74.2 Å²	74.2	64%	0.64	41%	0.405	S	S	*	.	H	α-helix	trans	-71.9	-30.2	174	-75.6	165.1	-160.4	0	0	114.4	C76 R77 Y78	C76-E80 WeakPolarHBondContact O-CB 3.45Å; C76-E80 VanDerWaalsContact O-CG 3.23Å; C76-E80 WeakPolarHBondContact O-CG 3.43Å; C76-E80 PolarHBondContact O-N 3.38Å; R77-E80 PolarHBondContact O-N 3.27Å; Y78-E80 VanDerWaalsContact C-N 3.32Å; Y78-E80 PolarHBondContact O-N 3.24Å
81	T	92.4	Very high	91.9	Very high	67 Å²	67	76.5 Å²	76.5	41%	0.411	44%	0.435	S	S	.	.	H	α-helix	trans	-138.9	-6.2	-162.8	69	0	0	0	0	116.2	R77 Y78 S83	R77-T81 WeakPolarHBondContact O-CB 3.4Å; R77-T81 PolarHBondContact O-N 2.89Å; R77-T81 PolarHBondContact O-OG1 3.42Å; Y78-T81 PolarHBondContact O-N 3.45Å; T81-S83 PolarHBondContact O-N 3.1Å; T81-S83 WeakPolarHBondContact OG1-CB 3.4Å; T81-S83 PolarHBondContact OG1-N 3.18Å
82	G	93.9	Very high	91	Very high	45 Å²	45	82 Å²	82	46%	0.464	47%	0.473	S	S	.	.	S	Bend	trans	62.5	-1.5	-167.8	0	0	0	0	0	115	Y78	Y78-G82 WeakPolarHBondContact CE2-O 3.47Å; Y78-G82 VanDerWaalsContact O-CA 3.26Å; Y78-G82 WeakPolarHBondContact O-CA 3.46Å; Y78-G82 PolarHBondContact O-N 2.89Å
83	S	92.7	Very high	90.1	Very high	27 Å²	27	88.6 Å²	88.6	19%	0.189	50%	0.496	C	S	.	.			trans	-104.5	107.5	-163.7	-165.8	0	0	0	0	113.1	R77 T81 R85	R77-S83 PolarHBondContact NE-O 3.2Å; T81-S83 PolarHBondContact O-N 3.1Å; T81-S83 WeakPolarHBondContact OG1-CB 3.4Å; T81-S83 PolarHBondContact OG1-N 3.18Å; S83-R85 PolarHBondContact O-N 3.14Å; S83-R85 VanDerWaalsContact O-N 3.14Å
84	I	93.4	Very high	89.1	Confident	37 Å²	37	85 Å²	85	19%	0.19	49%	0.489	C	S	.	.			trans	-62.2	-15.3	172.2	71.2	175.2	0	0	0	113.4	R44 I48 Y78	R44-I84 PolarHBondContact NE-O 3.48Å; R44-I84 PolarHBondContact NH1-O 3.27Å; R44-I84 PolarHBondContact NH2-O 3.28Å; I48-I84 HydrophobicContact CG1-CG2 3.99Å; Y78-I84 HydrophobicContact CD2-CG2 4Å; Y78-I84 HydrophobicContact CE2-CG2 4.17Å
85	R	91.9	Very high	88.2	Confident	168 Å²	168	95.6 Å²	95.6	63%	0.634	53%	0.528	S	S	*	.	S	Bend	trans	-78.6	159.2	-173	-63.3	-178.6	71.9	-177.1	3.2	111.8	R44 R77 S83	R44-R85 VanDerWaalsContact NH1-C 3.25Å; R44-R85 PolarHBondContact NH2-O 3.13Å; R44-R85 VanDerWaalsContact NH2-O 3.08Å; R77-R85 PolarHBondContact NE-O 3.23Å; R77-R85 PolarHBondContact NH2-O 3Å; S83-R85 PolarHBondContact O-N 3.14Å; S83-R85 VanDerWaalsContact O-N 3.14Å
86	P	91.8	Very high	87.2	Confident	49 Å²	49	97.7 Å²	97.7	32%	0.318	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-76.7	162.4	-179.1	28.4	-30.1	0	0	0	111.6	P38 R77	P38-P86 HydrophobicContact CB-CB 3.93Å; P38-P86 HydrophobicContact CB-CG 4.23Å; P38-P86 HydrophobicContact CG-CB 4.36Å; P38-P86 HydrophobicContact CG-CG 4.21Å; R77-P86 PolarHBondContact NH2-O 2.72Å
87	K	88.1	Confident	86.6	Confident	152 Å²	152	96 Å²	96	66%	0.661	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-70.2	143.2	160.3	-102	157.3	-175	172	0	106.6	I89	K87-I89 PolarHBondContact O-N 3.34Å
88	A	85.4	Confident	86.3	Confident	102 Å²	102	96.9 Å²	96.9	84%	0.843	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-60	130.8	179.8	0	0	0	0	0	110.2
89	I	82.9	Confident	85.9	Confident	126 Å²	126	100.7 Å²	100.7	65%	0.646	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-103	123.3	-177.9	-57.6	178.8	0	0	0	108.7	K87	K87-I89 PolarHBondContact O-N 3.34Å
90	G	77.5	Confident	85.7	Confident	70 Å²	70	96.8 Å²	96.8	72%	0.722	57%	0.565	S	S	*	*			trans	82.9	-172.7	-179.2	0	0	0	0	0	114.2
91	G	78.4	Confident	85.6	Confident	86 Å²	86	90.6 Å²	90.6	89%	0.887	54%	0.536	S	S	*	.			trans	93.8	167.9	-165.8	0	0	0	0	0	112.5
92	S	79.5	Confident	85.7	Confident	114 Å²	114	89.1 Å²	89.1	80%	0.797	53%	0.527	S	S	*	.			trans	-132.6	141.1	178.1	53.3	0	0	0	0	110.3
93	K	77.5	Confident	85.6	Confident	192 Å²	192	90.2 Å²	90.2	84%	0.835	53%	0.525	S	S	*	.			trans	-60.9	139.6	167.6	-66	-176.2	179.3	-178.4	0	108.7	R95	K93-R95 PolarHBondContact O-N 3.24Å
94	P	76.4	Confident	85.7	Confident	87 Å²	87	92.2 Å²	92.2	57%	0.565	53%	0.53	S	S	*	.			trans	-58.4	129.4	175.1	-23.6	34	0	0	0	111.3	A97	P94-A97 WeakPolarHBondContact CB-O 3.34Å
95	R	76.1	Confident	85.8	Confident	231 Å²	231	90.5 Å²	90.5	87%	0.872	52%	0.521	S	S	*	.	S	Bend	trans	-88.4	-54.4	179	-68.6	-173.5	174.7	-164.9	-3.7	112.7	K93	K93-R95 PolarHBondContact O-N 3.24Å
96	V	77.1	Confident	85.8	Confident	53 Å²	53	84.6 Å²	84.6	32%	0.321	50%	0.503	S	S	.	.	S	Bend	trans	-104.4	-6	-176.8	-60.7	0	0	0	0	114	N134 P136	V96-N134 VanDerWaalsContact CB-O 3.24Å; V96-N134 WeakPolarHBondContact CB-O 3.36Å; V96-N134 WeakPolarHBondContact CG1-O 3.46Å; V96-P136 HydrophobicContact CB-CB 4.44Å; V96-P136 HydrophobicContact CG2-CB 4.28Å
97	A	81.9	Confident	85.9	Confident	26 Å²	26	85 Å²	85	22%	0.215	50%	0.501	C	S	.	.	S	Bend	trans	-119.1	59.1	177.9	0	0	0	0	0	108.8	P94 V102 V144	P94-A97 WeakPolarHBondContact CB-O 3.34Å; A97-V102 HydrophobicContact CB-CG2 4.21Å; A97-V144 HydrophobicContact CB-CG2 4.25Å
98	T	88.2	Confident	86.3	Confident	59 Å²	59	77.8 Å²	77.8	36%	0.362	47%	0.47	S	S	.	.			trans	-65.5	162	174.1	65.9	0	0	0	0	110	A100 V101 V102	T98-A100 VanDerWaalsContact C-N 3.3Å; T98-A100 PolarHBondContact O-N 2.86Å; T98-V101 PolarHBondContact O-N 2.88Å; T98-V101 WeakPolarHBondContact OG1-CG2 3.36Å; T98-V101 PolarHBondContact OG1-N 2.69Å; T98-V102 WeakPolarHBondContact O-CG2 3.15Å; T98-V102 PolarHBondContact O-N 3.45Å
99	N	89.1	Confident	86.7	Confident	136 Å²	136	75.8 Å²	75.8	73%	0.727	44%	0.442	S	S	*	.	H	α-helix	trans	-57.7	-42.9	-178.7	-70.5	-6.5	0	0	0	112	V101 V102 T103	N99-V101 PolarHBondContact O-N 2.7Å; N99-V102 PolarHBondContact O-N 2.82Å; N99-T103 PolarHBondContact O-N 3.48Å; N99-T103 PolarHBondContact O-OG1 3.45Å
100	A	90	Very high	87.1	Confident	68 Å²	68	76.8 Å²	76.8	56%	0.562	44%	0.438	S	S	*	.	H	α-helix	trans	-59.8	-46.2	177.5	0	0	0	0	0	112.7	T98 V102 T103 K104	T98-A100 VanDerWaalsContact C-N 3.3Å; T98-A100 PolarHBondContact O-N 2.86Å; A100-V102 VanDerWaalsContact C-N 3.35Å; A100-V102 PolarHBondContact O-N 3.43Å; A100-T103 PolarHBondContact O-N 2.82Å; A100-K104 PolarHBondContact O-N 3.12Å
101	V	93.3	Very high	87.9	Confident	7 Å²	7	79.4 Å²	79.4	4%	0.042	43%	0.432	C	S	.	.	H	α-helix	trans	-64.1	-40.2	176.5	174.8	0	0	0	0	111	T98 N99 K104 I105 L124 V129 P136	T98-V101 PolarHBondContact O-N 2.88Å; T98-V101 WeakPolarHBondContact OG1-CG2 3.36Å; T98-V101 PolarHBondContact OG1-N 2.69Å; N99-V101 PolarHBondContact O-N 2.7Å; V101-K104 PolarHBondContact O-N 3.27Å; V101-I105 HydrophobicContact CG1-CD1 3.86Å; V101-I105 HydrophobicContact CG1-CG1 4.5Å; V101-I105 WeakPolarHBondContact O-CB 3.35Å; V101-I105 WeakPolarHBondContact O-CD1 3.4Å; V101-I105 WeakPolarHBondContact O-CG1 3.33Å; V101-I105 PolarHBondContact O-N 3.05Å; V101-L124 HydrophobicContact CG1-CD1 4.13Å; V101-L124 HydrophobicContact CG1-CD2 4.34Å; V101-V129 HydrophobicContact CG2-CG1 4.2Å; V101-P136 HydrophobicContact CG1-CG 3.82Å
102	V	93.9	Very high	88.5	Confident	36 Å²	36	77 Å²	77	22%	0.218	40%	0.4	C	S	.	.	H	α-helix	trans	-64.5	-42.1	176.1	168.9	0	0	0	0	111.8	A97 T98 N99 A100 I105 D106 V144 L148	A97-V102 HydrophobicContact CB-CG2 4.21Å; T98-V102 WeakPolarHBondContact O-CG2 3.15Å; T98-V102 PolarHBondContact O-N 3.45Å; N99-V102 PolarHBondContact O-N 2.82Å; A100-V102 VanDerWaalsContact C-N 3.35Å; A100-V102 PolarHBondContact O-N 3.43Å; V102-I105 PolarHBondContact O-N 2.89Å; V102-D106 PolarHBondContact O-N 2.75Å; V102-D106 VanDerWaalsContact O-N 3.07Å; V102-V144 HydrophobicContact CB-CG1 4.3Å; V102-V144 HydrophobicContact CG1-CG1 3.93Å; V102-V144 HydrophobicContact CG2-CG1 4Å; V102-V144 HydrophobicContact CG2-CG2 4.13Å; V102-L148 HydrophobicContact CG1-CD2 4.22Å
103	T	93.1	Very high	89.1	Confident	69 Å²	69	76 Å²	76	42%	0.423	39%	0.392	S	S	.	.	H	α-helix	trans	-66.1	-43.1	176.5	-61.8	0	0	0	0	111.5	N99 A100 I105 D106 I107	N99-T103 PolarHBondContact O-N 3.48Å; N99-T103 PolarHBondContact O-OG1 3.45Å; A100-T103 PolarHBondContact O-N 2.82Å; T103-I105 PolarHBondContact O-N 3.09Å; T103-D106 WeakPolarHBondContact O-CB 3.24Å; T103-D106 PolarHBondContact O-N 3.29Å; T103-D106 VanDerWaalsContact O-N 3.14Å; T103-I107 HydrophobicContact CG2-CD1 3.93Å; T103-I107 HydrophobicContact CG2-CG1 4.47Å; T103-I107 WeakPolarHBondContact O-CG1 3.45Å; T103-I107 PolarHBondContact O-N 3.28Å
104	K	93.8	Very high	89.9	Confident	69 Å²	69	71.3 Å²	71.3	30%	0.3	38%	0.383	S	S	.	.	H	α-helix	trans	-62.8	-39.1	174	-81.4	-77.2	-165.8	167	0	112.7	A100 V101 D106 I107 Y108 L124 E127 V129	A100-K104 PolarHBondContact O-N 3.12Å; V101-K104 PolarHBondContact O-N 3.27Å; K104-D106 VanDerWaalsContact C-N 3.29Å; K104-D106 PolarHBondContact O-N 2.94Å; K104-I107 PolarHBondContact O-N 3.1Å; K104-Y108 HydrophobicContact CB-CE2 4.17Å; K104-Y108 HydrophobicContact CD-CE1 4.11Å; K104-Y108 WeakPolarHBondContact O-CD2 3.44Å; K104-Y108 VanDerWaalsContact O-CG 3.26Å; K104-Y108 PolarHBondContact O-N 3.45Å; K104-L124 HydrophobicContact CB-CD2 3.99Å; K104-E127 IonicContact NZ-OE2 3.1Å; K104-E127 PolarHBondContact NZ-OE2 3.21Å; K104-V129 HydrophobicContact CB-CG1 4.16Å; K104-V129 HydrophobicContact CD-CG2 4.22Å; K104-V129 HydrophobicContact CG-CG1 3.98Å; K104-V129 HydrophobicContact CG-CG2 4.07Å
105	I	95.2	Very high	90.7	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-59.9	-37.7	172.2	-71.7	166.1	0	0	0	111.9	V101 V102 T103 K109 I120 L124 P136 I141 V144 L145 L148	V101-I105 HydrophobicContact CG1-CD1 3.86Å; V101-I105 HydrophobicContact CG1-CG1 4.5Å; V101-I105 WeakPolarHBondContact O-CB 3.35Å; V101-I105 WeakPolarHBondContact O-CD1 3.4Å; V101-I105 WeakPolarHBondContact O-CG1 3.33Å; V101-I105 PolarHBondContact O-N 3.05Å; V102-I105 PolarHBondContact O-N 2.89Å; T103-I105 PolarHBondContact O-N 3.09Å; I105-K109 WeakPolarHBondContact O-CB 3.14Å; I105-K109 PolarHBondContact O-N 3.29Å; I105-I120 HydrophobicContact CG1-CG2 3.83Å; I105-I120 HydrophobicContact CG2-CG2 4.5Å; I105-L124 HydrophobicContact CD1-CD1 4.19Å; I105-L124 HydrophobicContact CG1-CD1 3.94Å; I105-P136 HydrophobicContact CD1-CG 4.28Å; I105-I141 HydrophobicContact CD1-CG1 4.13Å; I105-I141 HydrophobicContact CG2-CG2 4.33Å; I105-V144 HydrophobicContact CB-CG1 4.23Å; I105-V144 HydrophobicContact CD1-CB 4.35Å; I105-V144 HydrophobicContact CD1-CG1 4.16Å; I105-V144 HydrophobicContact CD1-CG2 4.41Å; I105-V144 HydrophobicContact CG2-CB 4.34Å; I105-V144 HydrophobicContact CG2-CG1 3.75Å; I105-L145 HydrophobicContact CG2-CD2 3.59Å; I105-L145 HydrophobicContact CG2-CG 4.07Å; I105-L148 HydrophobicContact CG2-CD1 4.46Å
106	D	93.7	Very high	91.6	Very high	45 Å²	45	62.4 Å²	62.4	24%	0.241	34%	0.342	C	S	.	.	H	α-helix	trans	-69.7	-47.2	175	-168	67.6	0	0	0	111.9	V102 T103 K104 Y108 K109 R110 L148	V102-D106 PolarHBondContact O-N 2.75Å; V102-D106 VanDerWaalsContact O-N 3.07Å; T103-D106 WeakPolarHBondContact O-CB 3.24Å; T103-D106 PolarHBondContact O-N 3.29Å; T103-D106 VanDerWaalsContact O-N 3.14Å; K104-D106 VanDerWaalsContact C-N 3.29Å; K104-D106 PolarHBondContact O-N 2.94Å; D106-Y108 PolarHBondContact O-N 3.35Å; D106-K109 CarbonylContact O-C 3.45Å; D106-K109 PolarHBondContact O-N 3.27Å; D106-K109 VanDerWaalsContact O-N 3.07Å; D106-R110 WeakPolarHBondContact O-CG 3.32Å; D106-R110 PolarHBondContact O-N 2.86Å; D106-R110 WeakPolarHBondContact OD2-CD 3.4Å; D106-L148 HydrophobicContact CB-CD1 3.81Å; D106-L148 HydrophobicContact CB-CD2 4.36Å
107	I	94.1	Very high	92.5	Very high	57 Å²	57	60.3 Å²	60.3	29%	0.292	33%	0.33	S	S	.	.	H	α-helix	trans	-53.9	-56.1	177.7	-70.4	165.4	0	0	0	110.8	T103 K104 K109 R110 E111	T103-I107 HydrophobicContact CG2-CD1 3.93Å; T103-I107 HydrophobicContact CG2-CG1 4.47Å; T103-I107 WeakPolarHBondContact O-CG1 3.45Å; T103-I107 PolarHBondContact O-N 3.28Å; K104-I107 PolarHBondContact O-N 3.1Å; I107-K109 PolarHBondContact O-N 3.48Å; I107-K109 VanDerWaalsContact O-N 3.13Å; I107-R110 PolarHBondContact O-N 3Å; I107-E111 HydrophobicContact CG2-CG 4.29Å; I107-E111 VanDerWaalsContact CG2-OE1 3.3Å; I107-E111 WeakPolarHBondContact CG2-OE1 3.42Å; I107-E111 WeakPolarHBondContact O-CG 3.18Å; I107-E111 PolarHBondContact O-N 3.12Å
108	Y	95	Very high	93.1	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-60.1	-30	-179.8	-53.9	-37.5	0	0	0	112.6	K104 D106 C112 I120 R123 L124 E127	K104-Y108 HydrophobicContact CB-CE2 4.17Å; K104-Y108 HydrophobicContact CD-CE1 4.11Å; K104-Y108 WeakPolarHBondContact O-CD2 3.44Å; K104-Y108 VanDerWaalsContact O-CG 3.26Å; K104-Y108 PolarHBondContact O-N 3.45Å; D106-Y108 PolarHBondContact O-N 3.35Å; Y108-C112 PolarHBondContact O-N 2.91Å; Y108-I120 HydrophobicContact CD2-CG2 4.28Å; Y108-R123 HydrophobicContact CD2-CB 4.35Å; Y108-R123 HydrophobicContact CE2-CB 4.01Å; Y108-L124 HydrophobicContact CE2-CD2 3.83Å; Y108-L124 HydrophobicContact CE2-CG 3.97Å; Y108-E127 VanDerWaalsContact CE1-OE1 3.3Å; Y108-E127 WeakPolarHBondContact CE1-OE1 3.12Å; Y108-E127 PolarHBondContact OH-OE2 3.43Å
109	K	93.4	Very high	93.5	Very high	61 Å²	61	64 Å²	64	27%	0.265	33%	0.334	S	S	.	.	H	α-helix	trans	-79.9	-27	178.3	-164.8	56.9	163.6	171.9	0	113.2	I105 D106 I107 C112 P113 I115 L145	I105-K109 WeakPolarHBondContact O-CB 3.14Å; I105-K109 PolarHBondContact O-N 3.29Å; D106-K109 CarbonylContact O-C 3.45Å; D106-K109 PolarHBondContact O-N 3.27Å; D106-K109 VanDerWaalsContact O-N 3.07Å; I107-K109 PolarHBondContact O-N 3.48Å; I107-K109 VanDerWaalsContact O-N 3.13Å; K109-C112 CarbonylContact O-C 3.25Å; K109-P113 WeakPolarHBondContact CE-O 3.36Å; K109-P113 PolarHBondContact NZ-O 2.99Å; K109-P113 VanDerWaalsContact O-CA 3.29Å; K109-P113 WeakPolarHBondContact O-CA 3.43Å; K109-I115 HydrophobicContact CD-CG2 3.66Å; K109-I115 PolarHBondContact NZ-O 3.44Å; K109-L145 HydrophobicContact CB-CD2 3.91Å; K109-L145 HydrophobicContact CD-CD2 4.43Å; K109-L145 HydrophobicContact CG-CD2 3.84Å
110	R	91.9	Very high	93.8	Very high	147 Å²	147	57.5 Å²	57.5	56%	0.555	30%	0.3	S	S	*	.	H	α-helix	trans	-75.8	-42.5	171.6	-73.1	173.5	58.4	-164.5	-2.6	111.6	D106 I107	D106-R110 WeakPolarHBondContact O-CG 3.32Å; D106-R110 PolarHBondContact O-N 2.86Å; D106-R110 WeakPolarHBondContact OD2-CD 3.4Å; I107-R110 PolarHBondContact O-N 3Å
111	E	94.1	Very high	94.1	Very high	125 Å²	125	58.9 Å²	58.9	58%	0.584	29%	0.29	S	S	*	.	H	α-helix	trans	-62.3	-45.7	173.8	-70.3	171	172.3	0	0	112.1	I107 R123	I107-E111 HydrophobicContact CG2-CG 4.29Å; I107-E111 VanDerWaalsContact CG2-OE1 3.3Å; I107-E111 WeakPolarHBondContact CG2-OE1 3.42Å; I107-E111 WeakPolarHBondContact O-CG 3.18Å; I107-E111 PolarHBondContact O-N 3.12Å; E111-R123 IonicContact OE2-NH1 2.68Å
112	C	91.2	Very high	94.2	Very high	34 Å²	34	61.7 Å²	61.7	23%	0.23	31%	0.306	C	S	.	.			trans	-131	85.3	-178.1	-173.9	0	0	0	0	110.8	Y108 K109 S114 I115	Y108-C112 PolarHBondContact O-N 2.91Å; K109-C112 CarbonylContact O-C 3.25Å; C112-S114 PolarHBondContact O-N 2.89Å; C112-S114 PolarHBondContact SG-OG 2.79Å; C112-I115 HydrophobicContact CB-CB 4.01Å; C112-I115 HydrophobicContact CB-CG2 4.48Å; C112-I115 WeakPolarHBondContact O-CB 3.08Å; C112-I115 WeakPolarHBondContact O-CG2 3.37Å; C112-I115 PolarHBondContact O-N 3.19Å
113	P	92.7	Very high	94.3	Very high	95 Å²	95	64.1 Å²	64.1	62%	0.617	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-21.5	178.9	-28.9	37.4	0	0	0	114.5	K109	K109-P113 WeakPolarHBondContact CE-O 3.36Å; K109-P113 PolarHBondContact NZ-O 2.99Å; K109-P113 VanDerWaalsContact O-CA 3.29Å; K109-P113 WeakPolarHBondContact O-CA 3.43Å
114	S	93.6	Very high	94.4	Very high	93 Å²	93	60.9 Å²	60.9	65%	0.65	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-18.8	172.8	40.2	0	0	0	0	115	C112 F116	C112-S114 PolarHBondContact O-N 2.89Å; C112-S114 PolarHBondContact SG-OG 2.79Å; S114-F116 PolarHBondContact O-N 2.86Å
115	I	94	Very high	94.5	Very high	4 Å²	4	60.6 Å²	60.6	2%	0.021	29%	0.292	C	S	.	.			trans	-56.9	134.3	-170.6	-160.6	174.4	0	0	0	112.8	K109 C112 E119 I120	K109-I115 HydrophobicContact CD-CG2 3.66Å; K109-I115 PolarHBondContact NZ-O 3.44Å; C112-I115 HydrophobicContact CB-CB 4.01Å; C112-I115 HydrophobicContact CB-CG2 4.48Å; C112-I115 WeakPolarHBondContact O-CB 3.08Å; C112-I115 WeakPolarHBondContact O-CG2 3.37Å; C112-I115 PolarHBondContact O-N 3.19Å; I115-E119 WeakPolarHBondContact CA-OE2 3.5Å; I115-E119 HydrophobicContact CD1-CB 4.09Å; I115-E119 HydrophobicContact CG1-CB 3.59Å; I115-E119 VanDerWaalsContact CG1-OE2 3.32Å; I115-E119 WeakPolarHBondContact CG1-OE2 3.48Å; I115-I120 HydrophobicContact CD1-CG1 3.9Å; I115-I120 HydrophobicContact CG1-CG1 4.11Å; I115-I120 HydrophobicContact CG2-CD1 3.82Å; I115-I120 HydrophobicContact CG2-CG1 3.75Å
116	F	95.1	Very high	94.4	Very high	127 Å²	127	67.8 Å²	67.8	56%	0.557	33%	0.326	S	S	*	.			trans	-80.6	154.6	177.2	-65.6	-73.6	0	0	0	111.6	S114 W118 E119 I120	S114-F116 PolarHBondContact O-N 2.86Å; F116-W118 HydrophobicContact CB-CG 4.35Å; F116-W118 AromaticContact CG-NE1 3.85Å; F116-W118 PolarHBondContact O-N 3.15Å; F116-W118 VanDerWaalsContact O-N 3.14Å; F116-E119 HydrophobicContact CB-CG 4.23Å; F116-E119 WeakPolarHBondContact CD2-OE2 3.47Å; F116-E119 PolarHBondContact N-OE2 3.22Å; F116-E119 PolarHBondContact O-N 3.28Å; F116-I120 PolarHBondContact O-N 3.22Å
117	A	94.9	Very high	94.4	Very high	9 Å²	9	70.1 Å²	70.1	7%	0.074	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-4.1	-178.6	0	0	0	0	0	114.6	V138 I141 N142	A117-V138 HydrophobicContact CB-CG1 3.92Å; A117-I141 HydrophobicContact CB-CB 4.28Å; A117-I141 HydrophobicContact CB-CG2 3.8Å; A117-I141 WeakPolarHBondContact O-CD1 3.4Å; A117-N142 WeakPolarHBondContact CB-ND2 3.27Å
118	W	95.2	Very high	94.2	Very high	100 Å²	100	70.4 Å²	70.4	38%	0.379	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-44.5	167.4	64.5	-94.3	0	0	0	110.3	F116 I120 R121 D122 V138	F116-W118 HydrophobicContact CB-CG 4.35Å; F116-W118 AromaticContact CG-NE1 3.85Å; F116-W118 PolarHBondContact O-N 3.15Å; F116-W118 VanDerWaalsContact O-N 3.14Å; W118-I120 PolarHBondContact O-N 3.42Å; W118-R121 WeakPolarHBondContact O-CA 3.38Å; W118-R121 WeakPolarHBondContact O-CB 3.18Å; W118-R121 PolarHBondContact O-N 3.14Å; W118-D122 VanDerWaalsContact O-CG 3.28Å; W118-D122 PolarHBondContact O-N 3.4Å; W118-V138 HydrophobicContact CB-CG2 4.12Å
119	E	96.7	Very high	94	Very high	61 Å²	61	72.3 Å²	72.3	29%	0.285	36%	0.364	S	S	.	.	H	α-helix	trans	-55.9	-37.2	170.5	-61.7	168.3	159.3	0	0	112.4	I115 F116 R121 D122 R123	I115-E119 WeakPolarHBondContact CA-OE2 3.5Å; I115-E119 HydrophobicContact CD1-CB 4.09Å; I115-E119 HydrophobicContact CG1-CB 3.59Å; I115-E119 VanDerWaalsContact CG1-OE2 3.32Å; I115-E119 WeakPolarHBondContact CG1-OE2 3.48Å; F116-E119 HydrophobicContact CB-CG 4.23Å; F116-E119 WeakPolarHBondContact CD2-OE2 3.47Å; F116-E119 PolarHBondContact N-OE2 3.22Å; F116-E119 PolarHBondContact O-N 3.28Å; E119-R121 VanDerWaalsContact C-N 3.35Å; E119-D122 PolarHBondContact O-N 2.96Å; E119-R123 WeakPolarHBondContact O-CG 3.15Å; E119-R123 PolarHBondContact O-N 3.19Å
120	I	95.8	Very high	94	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-61	-41.4	170.1	-71.2	173.4	0	0	0	111.8	I105 Y108 I115 F116 W118 D122 L124 I141 L145	I105-I120 HydrophobicContact CG1-CG2 3.83Å; I105-I120 HydrophobicContact CG2-CG2 4.5Å; Y108-I120 HydrophobicContact CD2-CG2 4.28Å; I115-I120 HydrophobicContact CD1-CG1 3.9Å; I115-I120 HydrophobicContact CG1-CG1 4.11Å; I115-I120 HydrophobicContact CG2-CD1 3.82Å; I115-I120 HydrophobicContact CG2-CG1 3.75Å; F116-I120 PolarHBondContact O-N 3.22Å; W118-I120 PolarHBondContact O-N 3.42Å; I120-D122 VanDerWaalsContact C-N 3.32Å; I120-L124 HydrophobicContact CG2-CD1 4.18Å; I120-L124 VanDerWaalsContact O-CG 3.28Å; I120-L124 WeakPolarHBondContact O-CG 3.38Å; I120-L124 PolarHBondContact O-N 2.99Å; I120-I141 HydrophobicContact CB-CG2 4.09Å; I120-I141 HydrophobicContact CD1-CG2 4.07Å; I120-I141 HydrophobicContact CG2-CD1 4.15Å; I120-I141 HydrophobicContact CG2-CG1 4.48Å; I120-I141 HydrophobicContact CG2-CG2 3.65Å; I120-L145 HydrophobicContact CD1-CD1 3.95Å; I120-L145 HydrophobicContact CD1-CD2 4.32Å
121	R	95.7	Very high	94	Very high	97 Å²	97	65.8 Å²	65.8	37%	0.366	35%	0.346	S	S	.	.	H	α-helix	trans	-62.6	-44.1	178.7	-170.5	-159.8	178.8	-155.5	-2.2	110.1	W118 E119 L124 L125 I135 I141	W118-R121 WeakPolarHBondContact O-CA 3.38Å; W118-R121 WeakPolarHBondContact O-CB 3.18Å; W118-R121 PolarHBondContact O-N 3.14Å; E119-R121 VanDerWaalsContact C-N 3.35Å; R121-L124 WeakPolarHBondContact O-CB 3.47Å; R121-L124 PolarHBondContact O-N 3.07Å; R121-L125 PolarHBondContact O-N 2.79Å; R121-I135 HydrophobicContact CG-CD1 3.77Å; R121-I135 HydrophobicContact CG-CG1 3.42Å; R121-I135 VanDerWaalsContact CG-CG1 3.42Å; R121-I135 WeakPolarHBondContact O-CD1 3.37Å; R121-I141 HydrophobicContact CB-CD1 3.65Å; R121-I141 HydrophobicContact CG-CD1 4.18Å
122	D	95.9	Very high	93.8	Very high	67 Å²	67	64.9 Å²	64.9	36%	0.358	35%	0.35	S	S	.	.	H	α-helix	trans	-74.2	-36	-173.7	-53.9	-19.4	0	0	0	110.4	W118 E119 I120 L125 Q126	W118-D122 VanDerWaalsContact O-CG 3.28Å; W118-D122 PolarHBondContact O-N 3.4Å; E119-D122 PolarHBondContact O-N 2.96Å; I120-D122 VanDerWaalsContact C-N 3.32Å; D122-L125 PolarHBondContact O-N 3.34Å; D122-Q126 WeakPolarHBondContact O-CB 3.5Å; D122-Q126 PolarHBondContact O-N 2.82Å
123	R	94.8	Very high	93.8	Very high	87 Å²	87	70.1 Å²	70.1	33%	0.328	38%	0.376	S	S	.	.	H	α-helix	trans	-61.8	-41.3	167.8	-74.5	-173.5	-176.4	-158.7	-0	113.5	Y108 E111 E119 L125 Q126 E127	Y108-R123 HydrophobicContact CD2-CB 4.35Å; Y108-R123 HydrophobicContact CE2-CB 4.01Å; E111-R123 IonicContact OE2-NH1 2.68Å; E119-R123 WeakPolarHBondContact O-CG 3.15Å; E119-R123 PolarHBondContact O-N 3.19Å; R123-L125 PolarHBondContact O-N 3.47Å; R123-Q126 PolarHBondContact O-N 3.21Å; R123-E127 PolarHBondContact O-N 2.98Å
124	L	95.7	Very high	93.7	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-61.2	-32.6	176.4	-76.9	170.3	0	0	0	112.3	V101 K104 I105 Y108 I120 R121 V129 C130 I135 P136 I141	V101-L124 HydrophobicContact CG1-CD1 4.13Å; V101-L124 HydrophobicContact CG1-CD2 4.34Å; K104-L124 HydrophobicContact CB-CD2 3.99Å; I105-L124 HydrophobicContact CD1-CD1 4.19Å; I105-L124 HydrophobicContact CG1-CD1 3.94Å; Y108-L124 HydrophobicContact CE2-CD2 3.83Å; Y108-L124 HydrophobicContact CE2-CG 3.97Å; I120-L124 HydrophobicContact CG2-CD1 4.18Å; I120-L124 VanDerWaalsContact O-CG 3.28Å; I120-L124 WeakPolarHBondContact O-CG 3.38Å; I120-L124 PolarHBondContact O-N 2.99Å; R121-L124 WeakPolarHBondContact O-CB 3.47Å; R121-L124 PolarHBondContact O-N 3.07Å; L124-V129 HydrophobicContact CD2-CB 3.89Å; L124-V129 HydrophobicContact CD2-CG1 3.56Å; L124-V129 PolarHBondContact O-N 3.2Å; L124-V129 VanDerWaalsContact O-N 3.09Å; L124-C130 HydrophobicContact CB-CB 4.24Å; L124-C130 PolarHBondContact O-N 2.61Å; L124-I135 HydrophobicContact CB-CD1 3.55Å; L124-I135 HydrophobicContact CD1-CD1 4.07Å; L124-I135 HydrophobicContact CG-CD1 4.48Å; L124-P136 HydrophobicContact CD1-CG 4.04Å; L124-I141 HydrophobicContact CD1-CD1 4.47Å
125	L	95.1	Very high	93.6	Very high	63 Å²	63	65 Å²	65	33%	0.33	34%	0.336	S	S	.	.	H	α-helix	trans	-74.6	-47.5	171.4	-65.2	173.5	0	0	0	111.3	R121 D122 R123 E127 G128 C130 I135	R121-L125 PolarHBondContact O-N 2.79Å; D122-L125 PolarHBondContact O-N 3.34Å; R123-L125 PolarHBondContact O-N 3.47Å; L125-E127 VanDerWaalsContact C-N 3.34Å; L125-E127 PolarHBondContact O-N 3.37Å; L125-G128 PolarHBondContact O-N 2.88Å; L125-C130 HydrophobicContact CD2-CB 4.46Å; L125-I135 HydrophobicContact CD2-CB 4.04Å; L125-I135 HydrophobicContact CD2-CD1 3.98Å; L125-I135 HydrophobicContact CD2-CG1 4.07Å; L125-I135 HydrophobicContact CG-CD1 3.91Å; L125-I135 HydrophobicContact CG-CG1 4.2Å
126	Q	94	Very high	93.6	Very high	151 Å²	151	64.8 Å²	64.8	71%	0.706	34%	0.335	S	S	*	.	H	α-helix	trans	-63	-35.1	-176.4	-169.1	179.3	19.5	0	0	113.3	D122 R123 G128	D122-Q126 WeakPolarHBondContact O-CB 3.5Å; D122-Q126 PolarHBondContact O-N 2.82Å; R123-Q126 PolarHBondContact O-N 3.21Å; Q126-G128 VanDerWaalsContact C-N 3.31Å
127	E	92.9	Very high	93.5	Very high	95 Å²	95	61.6 Å²	61.6	44%	0.444	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	2.3	174.6	-71.4	-175.5	-164.6	0	0	113.8	K104 Y108 R123 L125 V129	K104-E127 IonicContact NZ-OE2 3.1Å; K104-E127 PolarHBondContact NZ-OE2 3.21Å; Y108-E127 VanDerWaalsContact CE1-OE1 3.3Å; Y108-E127 WeakPolarHBondContact CE1-OE1 3.12Å; Y108-E127 PolarHBondContact OH-OE2 3.43Å; R123-E127 PolarHBondContact O-N 2.98Å; L125-E127 VanDerWaalsContact C-N 3.34Å; L125-E127 PolarHBondContact O-N 3.37Å; E127-V129 HydrophobicContact CB-CG2 3.87Å; E127-V129 PolarHBondContact O-N 3.2Å; E127-V129 VanDerWaalsContact O-N 3.16Å
128	G	90.9	Very high	93.5	Very high	63 Å²	63	63.8 Å²	63.8	65%	0.649	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	10.5	-177.8	0	0	0	0	0	114.9	L125 Q126 C130	L125-G128 PolarHBondContact O-N 2.88Å; Q126-G128 VanDerWaalsContact C-N 3.31Å; G128-C130 PolarHBondContact O-N 3.34Å
129	V	91.1	Very high	93.4	Very high	40 Å²	40	63.5 Å²	63.5	24%	0.242	35%	0.354	C	S	.	.	S	Bend	trans	-67	-24.3	177.2	-179.7	0	0	0	0	111.1	V101 K104 L124 E127	V101-V129 HydrophobicContact CG2-CG1 4.2Å; K104-V129 HydrophobicContact CB-CG1 4.16Å; K104-V129 HydrophobicContact CD-CG2 4.22Å; K104-V129 HydrophobicContact CG-CG1 3.98Å; K104-V129 HydrophobicContact CG-CG2 4.07Å; L124-V129 HydrophobicContact CD2-CB 3.89Å; L124-V129 HydrophobicContact CD2-CG1 3.56Å; L124-V129 PolarHBondContact O-N 3.2Å; L124-V129 VanDerWaalsContact O-N 3.09Å; E127-V129 HydrophobicContact CB-CG2 3.87Å; E127-V129 PolarHBondContact O-N 3.2Å; E127-V129 VanDerWaalsContact O-N 3.16Å
130	C	92.3	Very high	93.2	Very high	7 Å²	7	62.5 Å²	62.5	5%	0.047	35%	0.354	C	S	.	.	S	Bend	trans	-133.6	145.4	174.7	-68.2	0	0	0	0	111.7	L124 L125 G128 N134 I135	L124-C130 HydrophobicContact CB-CB 4.24Å; L124-C130 PolarHBondContact O-N 2.61Å; L125-C130 HydrophobicContact CD2-CB 4.46Å; G128-C130 PolarHBondContact O-N 3.34Å; C130-N134 WeakPolarHBondContact CA-OD1 3.4Å; C130-N134 WeakPolarHBondContact CB-OD1 3.41Å; C130-I135 HydrophobicContact CB-CB 4.04Å; C130-I135 HydrophobicContact CB-CD1 3.49Å; C130-I135 VanDerWaalsContact CB-CD1 3.49Å; C130-I135 HydrophobicContact CB-CG1 4.36Å
131	T	91.5	Very high	93.2	Very high	64 Å²	64	62.5 Å²	62.5	39%	0.393	35%	0.354	S	S	.	.			trans	-85.9	163.7	163.8	72.4	0	0	0	0	109.7	D133 N134 I135	T131-D133 PolarHBondContact O-N 3.28Å; T131-D133 VanDerWaalsContact O-N 3.08Å; T131-D133 PolarHBondContact OG1-N 3.09Å; T131-D133 PolarHBondContact OG1-OD2 2.95Å; T131-N134 PolarHBondContact N-ND2 2.91Å; T131-N134 PolarHBondContact N-OD1 2.89Å; T131-N134 PolarHBondContact O-N 3.29Å; T131-N134 PolarHBondContact O-OD1 2.85Å; T131-N134 PolarHBondContact OG1-N 3.04Å; T131-N134 PolarHBondContact OG1-ND2 3.21Å; T131-I135 WeakPolarHBondContact O-CB 3.37Å; T131-I135 PolarHBondContact O-N 3.02Å
132	P	91.2	Very high	93.2	Very high	105 Å²	105	60.9 Å²	60.9	68%	0.682	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-27.6	174.4	-28.9	37.6	0	0	0	114.7	I135	P132-I135 VanDerWaalsContact O-CG2 3.23Å; P132-I135 WeakPolarHBondContact O-CG2 3.2Å
133	D	89.8	Confident	93	Very high	144 Å²	144	65.7 Å²	65.7	77%	0.77	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-34	-178.8	-37.4	-84.4	0	0	0	113.5	T131	T131-D133 PolarHBondContact O-N 3.28Å; T131-D133 VanDerWaalsContact O-N 3.08Å; T131-D133 PolarHBondContact OG1-N 3.09Å; T131-D133 PolarHBondContact OG1-OD2 2.95Å
134	N	90.8	Very high	93	Very high	64 Å²	64	62.1 Å²	62.1	34%	0.342	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-8.9	-174.7	78.4	27.9	0	0	0	113.7	V96 C130 T131	V96-N134 VanDerWaalsContact CB-O 3.24Å; V96-N134 WeakPolarHBondContact CB-O 3.36Å; V96-N134 WeakPolarHBondContact CG1-O 3.46Å; C130-N134 WeakPolarHBondContact CA-OD1 3.4Å; C130-N134 WeakPolarHBondContact CB-OD1 3.41Å; T131-N134 PolarHBondContact N-ND2 2.91Å; T131-N134 PolarHBondContact N-OD1 2.89Å; T131-N134 PolarHBondContact O-N 3.29Å; T131-N134 PolarHBondContact O-OD1 2.85Å; T131-N134 PolarHBondContact OG1-N 3.04Å; T131-N134 PolarHBondContact OG1-ND2 3.21Å
135	I	92.1	Very high	92.9	Very high	17 Å²	17	63.6 Å²	63.6	9%	0.087	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-56.4	122.9	179.7	-171.4	70.4	0	0	0	112.3	R121 L124 L125 C130 T131 P132 S137	R121-I135 HydrophobicContact CG-CD1 3.77Å; R121-I135 HydrophobicContact CG-CG1 3.42Å; R121-I135 VanDerWaalsContact CG-CG1 3.42Å; R121-I135 WeakPolarHBondContact O-CD1 3.37Å; L124-I135 HydrophobicContact CB-CD1 3.55Å; L124-I135 HydrophobicContact CD1-CD1 4.07Å; L124-I135 HydrophobicContact CG-CD1 4.48Å; L125-I135 HydrophobicContact CD2-CB 4.04Å; L125-I135 HydrophobicContact CD2-CD1 3.98Å; L125-I135 HydrophobicContact CD2-CG1 4.07Å; L125-I135 HydrophobicContact CG-CD1 3.91Å; L125-I135 HydrophobicContact CG-CG1 4.2Å; C130-I135 HydrophobicContact CB-CB 4.04Å; C130-I135 HydrophobicContact CB-CD1 3.49Å; C130-I135 VanDerWaalsContact CB-CD1 3.49Å; C130-I135 HydrophobicContact CB-CG1 4.36Å; T131-I135 WeakPolarHBondContact O-CB 3.37Å; T131-I135 PolarHBondContact O-N 3.02Å; P132-I135 VanDerWaalsContact O-CG2 3.23Å; P132-I135 WeakPolarHBondContact O-CG2 3.2Å; I135-S137 PolarHBondContact O-N 3.26Å
136	P	93.4	Very high	92.7	Very high	0 Å²	0	67 Å²	67	0%	0	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-65.4	134.1	175.5	25.1	-34.8	0	0	0	111.4	V96 V101 I105 L124 I141	V96-P136 HydrophobicContact CB-CB 4.44Å; V96-P136 HydrophobicContact CG2-CB 4.28Å; V101-P136 HydrophobicContact CG1-CG 3.82Å; I105-P136 HydrophobicContact CD1-CG 4.28Å; L124-P136 HydrophobicContact CD1-CG 4.04Å; P136-I141 HydrophobicContact CB-CG1 4.05Å; P136-I141 HydrophobicContact CG-CD1 4.29Å; P136-I141 HydrophobicContact CG-CG1 3.82Å; P136-I141 WeakPolarHBondContact O-CD1 3.18Å
137	S	94.2	Very high	92.5	Very high	59 Å²	59	64 Å²	64	41%	0.413	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-56.9	156	174	74.8	0	0	0	0	112.3	I135 S139 S140 I141	I135-S137 PolarHBondContact O-N 3.26Å; S137-S139 PolarHBondContact O-N 2.81Å; S137-S139 VanDerWaalsContact O-N 3.08Å; S137-S140 CarbonylContact O-C 3.57Å; S137-S140 WeakPolarHBondContact O-CA 3.37Å; S137-S140 VanDerWaalsContact O-CB 3.3Å; S137-S140 WeakPolarHBondContact O-CB 3.42Å; S137-S140 PolarHBondContact O-N 2.94Å; S137-S140 PolarHBondContact OG-N 3.29Å; S137-S140 PolarHBondContact OG-OG 3.44Å; S137-I141 PolarHBondContact O-N 3.35Å
138	V	94.8	Very high	92.3	Very high	56 Å²	56	61.3 Å²	61.3	34%	0.339	35%	0.347	S	S	.	.	H	α-helix	trans	-54.3	-32.9	177.2	-179.6	0	0	0	0	111.9	A117 W118 N142	A117-V138 HydrophobicContact CB-CG1 3.92Å; W118-V138 HydrophobicContact CB-CG2 4.12Å; V138-N142 WeakPolarHBondContact O-CB 3.41Å; V138-N142 PolarHBondContact O-N 3.16Å; V138-N142 PolarHBondContact O-ND2 3.31Å
139	S	93.8	Very high	92	Very high	93 Å²	93	61 Å²	61	65%	0.65	34%	0.335	S	S	*	.	H	α-helix	trans	-70.2	-36.3	173	-65.5	0	0	0	0	113.4	S137 R143	S137-S139 PolarHBondContact O-N 2.81Å; S137-S139 VanDerWaalsContact O-N 3.08Å; S139-R143 WeakPolarHBondContact O-CB 3.41Å; S139-R143 PolarHBondContact O-N 3.47Å
140	S	92.4	Very high	91.7	Very high	41 Å²	41	63 Å²	63	29%	0.287	34%	0.344	S	S	.	.	H	α-helix	trans	-68.4	-45.5	173	-66.6	0	0	0	0	111.6	S137 N142 R143 V144	S137-S140 CarbonylContact O-C 3.57Å; S137-S140 WeakPolarHBondContact O-CA 3.37Å; S137-S140 VanDerWaalsContact O-CB 3.3Å; S137-S140 WeakPolarHBondContact O-CB 3.42Å; S137-S140 PolarHBondContact O-N 2.94Å; S137-S140 PolarHBondContact OG-N 3.29Å; S137-S140 PolarHBondContact OG-OG 3.44Å; S140-N142 PolarHBondContact O-N 3.01Å; S140-R143 CarbonylContact O-C 3.54Å; S140-R143 WeakPolarHBondContact O-CA 3.45Å; S140-R143 WeakPolarHBondContact O-CB 3.41Å; S140-R143 PolarHBondContact O-N 2.82Å; S140-V144 PolarHBondContact O-N 3.32Å
141	I	95	Very high	91.1	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-58.1	-49.7	174.5	-65.2	166	0	0	0	110	I105 A117 I120 R121 L124 P136 S137 R143 V144 L145	I105-I141 HydrophobicContact CD1-CG1 4.13Å; I105-I141 HydrophobicContact CG2-CG2 4.33Å; A117-I141 HydrophobicContact CB-CB 4.28Å; A117-I141 HydrophobicContact CB-CG2 3.8Å; A117-I141 WeakPolarHBondContact O-CD1 3.4Å; I120-I141 HydrophobicContact CB-CG2 4.09Å; I120-I141 HydrophobicContact CD1-CG2 4.07Å; I120-I141 HydrophobicContact CG2-CD1 4.15Å; I120-I141 HydrophobicContact CG2-CG1 4.48Å; I120-I141 HydrophobicContact CG2-CG2 3.65Å; R121-I141 HydrophobicContact CB-CD1 3.65Å; R121-I141 HydrophobicContact CG-CD1 4.18Å; L124-I141 HydrophobicContact CD1-CD1 4.47Å; P136-I141 HydrophobicContact CB-CG1 4.05Å; P136-I141 HydrophobicContact CG-CD1 4.29Å; P136-I141 HydrophobicContact CG-CG1 3.82Å; P136-I141 WeakPolarHBondContact O-CD1 3.18Å; S137-I141 PolarHBondContact O-N 3.35Å; I141-R143 PolarHBondContact O-N 3.41Å; I141-R143 VanDerWaalsContact O-N 3.16Å; I141-V144 WeakPolarHBondContact O-CB 3.45Å; I141-V144 PolarHBondContact O-N 3.12Å; I141-L145 HydrophobicContact CG2-CD1 4.31Å; I141-L145 HydrophobicContact CG2-CG 4.46Å; I141-L145 WeakPolarHBondContact O-CG 3.45Å; I141-L145 PolarHBondContact O-N 2.87Å
142	N	95.7	Very high	90.6	Very high	62 Å²	62	66.5 Å²	66.5	33%	0.332	36%	0.362	S	S	.	.	H	α-helix	trans	-58.7	-27.4	173.9	-88	-73	0	0	0	113.8	A117 V138 S140 R146	A117-N142 WeakPolarHBondContact CB-ND2 3.27Å; V138-N142 WeakPolarHBondContact O-CB 3.41Å; V138-N142 PolarHBondContact O-N 3.16Å; V138-N142 PolarHBondContact O-ND2 3.31Å; S140-N142 PolarHBondContact O-N 3.01Å; N142-R146 WeakPolarHBondContact O-CG 3.25Å; N142-R146 PolarHBondContact O-N 3.37Å; N142-R146 PolarHBondContact O-NE 2.76Å; N142-R146 PolarHBondContact O-NH1 2.82Å; N142-R146 VanDerWaalsContact O-NH1 3.16Å
143	R	92.5	Very high	89.9	Confident	169 Å²	169	67.8 Å²	67.8	64%	0.638	36%	0.359	S	S	*	.	H	α-helix	trans	-76.7	-40.3	173.8	-176.5	-178.9	178.8	-174.3	-1.9	111.5	S139 S140 I141 R146 N147	S139-R143 WeakPolarHBondContact O-CB 3.41Å; S139-R143 PolarHBondContact O-N 3.47Å; S140-R143 CarbonylContact O-C 3.54Å; S140-R143 WeakPolarHBondContact O-CA 3.45Å; S140-R143 WeakPolarHBondContact O-CB 3.41Å; S140-R143 PolarHBondContact O-N 2.82Å; I141-R143 PolarHBondContact O-N 3.41Å; I141-R143 VanDerWaalsContact O-N 3.16Å; R143-R146 PolarHBondContact O-N 3.29Å; R143-N147 PolarHBondContact O-N 2.93Å; R143-N147 PolarHBondContact O-OD1 3.43Å
144	V	93.1	Very high	89.4	Confident	12 Å²	12	68.9 Å²	68.9	7%	0.073	35%	0.352	C	S	.	.	H	α-helix	trans	-59.4	-50.9	173	172.5	0	0	0	0	110.2	A97 V102 I105 S140 I141 R146 N147 L148	A97-V144 HydrophobicContact CB-CG2 4.25Å; V102-V144 HydrophobicContact CB-CG1 4.3Å; V102-V144 HydrophobicContact CG1-CG1 3.93Å; V102-V144 HydrophobicContact CG2-CG1 4Å; V102-V144 HydrophobicContact CG2-CG2 4.13Å; I105-V144 HydrophobicContact CB-CG1 4.23Å; I105-V144 HydrophobicContact CD1-CB 4.35Å; I105-V144 HydrophobicContact CD1-CG1 4.16Å; I105-V144 HydrophobicContact CD1-CG2 4.41Å; I105-V144 HydrophobicContact CG2-CB 4.34Å; I105-V144 HydrophobicContact CG2-CG1 3.75Å; S140-V144 PolarHBondContact O-N 3.32Å; I141-V144 WeakPolarHBondContact O-CB 3.45Å; I141-V144 PolarHBondContact O-N 3.12Å; V144-R146 VanDerWaalsContact C-N 3.33Å; V144-R146 PolarHBondContact O-N 3.15Å; V144-N147 WeakPolarHBondContact O-CA 3.27Å; V144-N147 WeakPolarHBondContact O-CB 3.18Å; V144-N147 PolarHBondContact O-N 2.9Å; V144-L148 HydrophobicContact CG1-CD1 3.75Å; V144-L148 HydrophobicContact CG1-CG 4.26Å; V144-L148 WeakPolarHBondContact O-CG 3.5Å; V144-L148 PolarHBondContact O-N 3.33Å
145	L	93.5	Very high	88.8	Confident	31 Å²	31	69.6 Å²	69.6	16%	0.162	35%	0.354	C	S	.	.	H	α-helix	trans	-55.8	-42.7	178.3	-67.8	178.8	0	0	0	113.5	I105 K109 I120 I141 S149	I105-L145 HydrophobicContact CG2-CD2 3.59Å; I105-L145 HydrophobicContact CG2-CG 4.07Å; K109-L145 HydrophobicContact CB-CD2 3.91Å; K109-L145 HydrophobicContact CD-CD2 4.43Å; K109-L145 HydrophobicContact CG-CD2 3.84Å; I120-L145 HydrophobicContact CD1-CD1 3.95Å; I120-L145 HydrophobicContact CD1-CD2 4.32Å; I141-L145 HydrophobicContact CG2-CD1 4.31Å; I141-L145 HydrophobicContact CG2-CG 4.46Å; I141-L145 WeakPolarHBondContact O-CG 3.45Å; I141-L145 PolarHBondContact O-N 2.87Å; L145-S149 PolarHBondContact O-N 2.86Å; L145-S149 PolarHBondContact O-OG 2.78Å
146	R	91	Very high	88.2	Confident	133 Å²	133	74.8 Å²	74.8	50%	0.502	38%	0.381	S	S	.	.	H	α-helix	trans	-70.5	-29.9	175.1	-72.1	-174.1	-58.1	-93.4	-1.1	113.4	N142 R143 V144 S149 N150	N142-R146 WeakPolarHBondContact O-CG 3.25Å; N142-R146 PolarHBondContact O-N 3.37Å; N142-R146 PolarHBondContact O-NE 2.76Å; N142-R146 PolarHBondContact O-NH1 2.82Å; N142-R146 VanDerWaalsContact O-NH1 3.16Å; R143-R146 PolarHBondContact O-N 3.29Å; V144-R146 VanDerWaalsContact C-N 3.33Å; V144-R146 PolarHBondContact O-N 3.15Å; R146-S149 PolarHBondContact O-OG 3.32Å; R146-N150 WeakPolarHBondContact O-CB 3.47Å; R146-N150 PolarHBondContact O-N 3.36Å; R146-N150 PolarHBondContact O-ND2 2.81Å
147	N	90.4	Very high	87.6	Confident	90 Å²	90	78.4 Å²	78.4	48%	0.481	41%	0.406	S	S	.	.	H	α-helix	trans	-70.3	-46.2	174.6	-71.6	-6.8	0	0	0	110	R143 V144 N150 E151	R143-N147 PolarHBondContact O-N 2.93Å; R143-N147 PolarHBondContact O-OD1 3.43Å; V144-N147 WeakPolarHBondContact O-CA 3.27Å; V144-N147 WeakPolarHBondContact O-CB 3.18Å; V144-N147 PolarHBondContact O-N 2.9Å; N147-N150 PolarHBondContact O-N 3.15Å; N147-E151 VanDerWaalsContact O-CB 3.27Å; N147-E151 WeakPolarHBondContact O-CB 3.45Å; N147-E151 PolarHBondContact O-N 2.89Å
148	L	88.9	Confident	87	Confident	37 Å²	37	78.9 Å²	78.9	19%	0.194	41%	0.41	C	S	.	.	H	α-helix	trans	-56.1	-52.4	176	-69.4	165.2	0	0	0	111	V102 I105 D106 V144 N150 E151 S152	V102-L148 HydrophobicContact CG1-CD2 4.22Å; I105-L148 HydrophobicContact CG2-CD1 4.46Å; D106-L148 HydrophobicContact CB-CD1 3.81Å; D106-L148 HydrophobicContact CB-CD2 4.36Å; V144-L148 HydrophobicContact CG1-CD1 3.75Å; V144-L148 HydrophobicContact CG1-CG 4.26Å; V144-L148 WeakPolarHBondContact O-CG 3.5Å; V144-L148 PolarHBondContact O-N 3.33Å; L148-N150 VanDerWaalsContact C-N 3.3Å; L148-N150 PolarHBondContact O-N 2.95Å; L148-E151 WeakPolarHBondContact O-CB 3.44Å; L148-E151 PolarHBondContact O-N 3.41Å; L148-S152 PolarHBondContact O-N 2.99Å; L148-S152 PolarHBondContact O-OG 3.03Å; L148-S152 VanDerWaalsContact O-OG 3.11Å
149	S	85.5	Confident	86.3	Confident	57 Å²	57	79.1 Å²	79.1	40%	0.399	42%	0.417	S	S	.	.	H	α-helix	trans	-59.7	-37.5	179.4	67	0	0	0	0	113.7	L145 R146 Q153	L145-S149 PolarHBondContact O-N 2.86Å; L145-S149 PolarHBondContact O-OG 2.78Å; R146-S149 PolarHBondContact O-OG 3.32Å; S149-Q153 WeakPolarHBondContact O-CG 3.3Å; S149-Q153 PolarHBondContact O-N 3.09Å
150	N	83	Confident	85.8	Confident	82 Å²	82	77.7 Å²	77.7	44%	0.439	41%	0.411	S	S	.	.	H	α-helix	trans	-72	-32.3	176.4	-69.5	-18.8	0	0	0	112.1	R146 N147 L148 R154	R146-N150 WeakPolarHBondContact O-CB 3.47Å; R146-N150 PolarHBondContact O-N 3.36Å; R146-N150 PolarHBondContact O-ND2 2.81Å; N147-N150 PolarHBondContact O-N 3.15Å; L148-N150 VanDerWaalsContact C-N 3.3Å; L148-N150 PolarHBondContact O-N 2.95Å; N150-R154 WeakPolarHBondContact O-CD 3.29Å; N150-R154 VanDerWaalsContact O-CG 3.24Å; N150-R154 WeakPolarHBondContact O-CG 3.34Å; N150-R154 PolarHBondContact O-N 3.38Å
151	E	81.7	Confident	85.3	Confident	85 Å²	85	78.4 Å²	78.4	40%	0.397	42%	0.419	S	S	.	.	H	α-helix	trans	-74.2	-42.8	179.4	-174.7	57	-156.1	0	0	110.9	N147 L148 Q153 R154 Q155	N147-E151 VanDerWaalsContact O-CB 3.27Å; N147-E151 WeakPolarHBondContact O-CB 3.45Å; N147-E151 PolarHBondContact O-N 2.89Å; L148-E151 WeakPolarHBondContact O-CB 3.44Å; L148-E151 PolarHBondContact O-N 3.41Å; E151-Q153 VanDerWaalsContact C-N 3.33Å; E151-Q153 PolarHBondContact O-N 3.29Å; E151-R154 WeakPolarHBondContact O-CB 3.33Å; E151-R154 PolarHBondContact O-N 3.42Å; E151-R154 VanDerWaalsContact O-N 3.15Å; E151-Q155 WeakPolarHBondContact O-CB 3.48Å; E151-Q155 WeakPolarHBondContact O-CG 3.13Å; E151-Q155 PolarHBondContact O-N 3.46Å; E151-Q155 PolarHBondContact OE1-NE2 2.83Å
152	S	79.7	Confident	84.6	Confident	60 Å²	60	81.4 Å²	81.4	42%	0.42	44%	0.444	S	S	.	.	H	α-helix	trans	-58.5	-43.2	170.5	-48.7	0	0	0	0	111.9	L148 R154 Q155 L156	L148-S152 PolarHBondContact O-N 2.99Å; L148-S152 PolarHBondContact O-OG 3.03Å; L148-S152 VanDerWaalsContact O-OG 3.11Å; S152-R154 VanDerWaalsContact C-N 3.35Å; S152-R154 PolarHBondContact O-N 2.93Å; S152-Q155 PolarHBondContact O-N 2.91Å; S152-L156 WeakPolarHBondContact O-CB 3.33Å; S152-L156 WeakPolarHBondContact O-CG 3.27Å; S152-L156 PolarHBondContact O-N 3.35Å
153	Q	76.8	Confident	84	Confident	131 Å²	131	81.1 Å²	81.1	61%	0.612	45%	0.45	S	S	*	.	H	α-helix	trans	-62.8	-39.5	175.1	-76.1	178.1	-0.2	0	0	112.5	S149 E151 S157	S149-Q153 WeakPolarHBondContact O-CG 3.3Å; S149-Q153 PolarHBondContact O-N 3.09Å; E151-Q153 VanDerWaalsContact C-N 3.33Å; E151-Q153 PolarHBondContact O-N 3.29Å; Q153-S157 WeakPolarHBondContact O-CB 3.2Å; Q153-S157 PolarHBondContact O-N 3.06Å; Q153-S157 PolarHBondContact O-OG 3.47Å
154	R	79.5	Confident	83.5	Confident	168 Å²	168	75.9 Å²	75.9	63%	0.634	44%	0.444	S	S	*	.	H	α-helix	trans	-63.2	-50.2	174.5	-77.6	165.3	171.1	-134.8	-9.2	111.3	N150 E151 S152 L156 S157 S158	N150-R154 WeakPolarHBondContact O-CD 3.29Å; N150-R154 VanDerWaalsContact O-CG 3.24Å; N150-R154 WeakPolarHBondContact O-CG 3.34Å; N150-R154 PolarHBondContact O-N 3.38Å; E151-R154 WeakPolarHBondContact O-CB 3.33Å; E151-R154 PolarHBondContact O-N 3.42Å; E151-R154 VanDerWaalsContact O-N 3.15Å; S152-R154 VanDerWaalsContact C-N 3.35Å; S152-R154 PolarHBondContact O-N 2.93Å; R154-L156 VanDerWaalsContact C-N 3.34Å; R154-L156 PolarHBondContact O-N 3.03Å; R154-S157 WeakPolarHBondContact O-CA 3.41Å; R154-S157 PolarHBondContact O-N 3.29Å; R154-S157 PolarHBondContact O-OG 3.19Å; R154-S158 PolarHBondContact O-N 2.68Å; R154-S158 PolarHBondContact O-OG 2.77Å; R154-S158 VanDerWaalsContact O-OG 3.12Å
155	Q	78	Confident	83.1	Confident	79 Å²	79	80.3 Å²	80.3	37%	0.369	47%	0.47	S	S	.	.	H	α-helix	trans	-60.1	-43.2	-179.1	-71.1	173.2	11.5	0	0	111.8	E151 S152 S157 S158 A159	E151-Q155 WeakPolarHBondContact O-CB 3.48Å; E151-Q155 WeakPolarHBondContact O-CG 3.13Å; E151-Q155 PolarHBondContact O-N 3.46Å; E151-Q155 PolarHBondContact OE1-NE2 2.83Å; S152-Q155 PolarHBondContact O-N 2.91Å; Q155-S157 PolarHBondContact O-N 2.59Å; Q155-S158 WeakPolarHBondContact CA-OG 3.4Å; Q155-S158 PolarHBondContact O-N 3.1Å; Q155-S158 PolarHBondContact O-OG 2.98Å; Q155-A159 VanDerWaalsContact O-CB 3.23Å; Q155-A159 WeakPolarHBondContact O-CB 3.24Å; Q155-A159 PolarHBondContact O-N 2.86Å
156	L	79.5	Confident	82.6	Confident	125 Å²	125	81.3 Å²	81.3	65%	0.654	48%	0.483	S	S	*	.	H	α-helix	trans	-58.7	-45.1	171.2	-74.1	166.5	0	0	0	112	S152 R154 A159 A160	S152-L156 WeakPolarHBondContact O-CB 3.33Å; S152-L156 WeakPolarHBondContact O-CG 3.27Å; S152-L156 PolarHBondContact O-N 3.35Å; R154-L156 VanDerWaalsContact C-N 3.34Å; R154-L156 PolarHBondContact O-N 3.03Å; L156-A159 PolarHBondContact O-N 3.04Å; L156-A160 WeakPolarHBondContact O-CB 3.36Å; L156-A160 PolarHBondContact O-N 2.77Å
157	S	81.4	Confident	82.1	Confident	76 Å²	76	77.9 Å²	77.9	53%	0.531	48%	0.483	S	S	.	.	H	α-helix	trans	-66.8	-38.1	179	73.5	0	0	0	0	113.5	Q153 R154 Q155 A161	Q153-S157 WeakPolarHBondContact O-CB 3.2Å; Q153-S157 PolarHBondContact O-N 3.06Å; Q153-S157 PolarHBondContact O-OG 3.47Å; R154-S157 WeakPolarHBondContact O-CA 3.41Å; R154-S157 PolarHBondContact O-N 3.29Å; R154-S157 PolarHBondContact O-OG 3.19Å; Q155-S157 PolarHBondContact O-N 2.59Å; S157-A161 WeakPolarHBondContact O-CB 3.2Å; S157-A161 PolarHBondContact O-N 2.92Å
158	S	80.7	Confident	81.6	Confident	70 Å²	70	76.5 Å²	76.5	49%	0.49	48%	0.484	S	S	.	.	H	α-helix	trans	-73.3	-36.1	175.9	50.4	0	0	0	0	112.5	R154 Q155 A161 A162	R154-S158 PolarHBondContact O-N 2.68Å; R154-S158 PolarHBondContact O-OG 2.77Å; R154-S158 VanDerWaalsContact O-OG 3.12Å; Q155-S158 WeakPolarHBondContact CA-OG 3.4Å; Q155-S158 PolarHBondContact O-N 3.1Å; Q155-S158 PolarHBondContact O-OG 2.98Å; S158-A161 PolarHBondContact O-N 3.04Å; S158-A162 WeakPolarHBondContact O-CB 3.34Å; S158-A162 PolarHBondContact O-N 3.48Å
159	A	81.1	Confident	81.2	Confident	60 Å²	60	77 Å²	77	50%	0.496	49%	0.493	S	S	.	.	H	α-helix	trans	-66.1	-42.6	174.3	0	0	0	0	0	111.2	Q155 L156 A162 A163	Q155-A159 VanDerWaalsContact O-CB 3.23Å; Q155-A159 WeakPolarHBondContact O-CB 3.24Å; Q155-A159 PolarHBondContact O-N 2.86Å; L156-A159 PolarHBondContact O-N 3.04Å; A159-A162 PolarHBondContact O-N 2.8Å; A159-A163 VanDerWaalsContact O-CB 3.27Å; A159-A163 WeakPolarHBondContact O-CB 3.11Å; A159-A163 PolarHBondContact O-N 2.83Å
160	A	82.1	Confident	81	Confident	63 Å²	63	78.1 Å²	78.1	52%	0.521	50%	0.498	S	S	.	.	H	α-helix	trans	-62.5	-41.9	173.7	0	0	0	0	0	112.2	L156 A163 A164	L156-A160 WeakPolarHBondContact O-CB 3.36Å; L156-A160 PolarHBondContact O-N 2.77Å; A160-A163 PolarHBondContact O-N 3.29Å; A160-A164 WeakPolarHBondContact O-CB 3.32Å; A160-A164 PolarHBondContact O-N 3.11Å
161	A	81.8	Confident	80.8	Confident	56 Å²	56	77 Å²	77	46%	0.463	50%	0.5	S	S	.	.	H	α-helix	trans	-64.5	-45	175.3	0	0	0	0	0	112.3	S157 S158 A164 V165	S157-A161 WeakPolarHBondContact O-CB 3.2Å; S157-A161 PolarHBondContact O-N 2.92Å; S158-A161 PolarHBondContact O-N 3.04Å; A161-A164 PolarHBondContact O-N 3.37Å; A161-V165 WeakPolarHBondContact O-CG2 3.28Å; A161-V165 PolarHBondContact O-N 3.4Å
162	A	81.6	Confident	80.6	Confident	63 Å²	63	75.8 Å²	75.8	52%	0.521	50%	0.504	S	S	.	.	H	α-helix	trans	-63.1	-41.7	176.4	0	0	0	0	0	112	S158 A159 V165 A166	S158-A162 WeakPolarHBondContact O-CB 3.34Å; S158-A162 PolarHBondContact O-N 3.48Å; A159-A162 PolarHBondContact O-N 2.8Å; A162-V165 PolarHBondContact O-N 3.06Å; A162-A166 WeakPolarHBondContact O-CB 3.3Å; A162-A166 PolarHBondContact O-N 2.68Å
163	A	83.3	Confident	80.4	Confident	56 Å²	56	78 Å²	78	46%	0.463	51%	0.508	S	S	.	.	H	α-helix	trans	-64.1	-37.9	174.8	0	0	0	0	0	112.4	A159 A160 A166 A167	A159-A163 VanDerWaalsContact O-CB 3.27Å; A159-A163 WeakPolarHBondContact O-CB 3.11Å; A159-A163 PolarHBondContact O-N 2.83Å; A160-A163 PolarHBondContact O-N 3.29Å; A163-A166 PolarHBondContact O-N 2.84Å; A163-A167 VanDerWaalsContact O-CB 3.3Å; A163-A167 WeakPolarHBondContact O-CB 3.19Å; A163-A167 PolarHBondContact O-N 3.33Å
164	A	81.5	Confident	80.2	Confident	60 Å²	60	74.2 Å²	74.2	50%	0.496	50%	0.499	S	S	.	.	H	α-helix	trans	-66.3	-41.3	174.8	0	0	0	0	0	112.3	A160 A161 A167 A168	A160-A164 WeakPolarHBondContact O-CB 3.32Å; A160-A164 PolarHBondContact O-N 3.11Å; A161-A164 PolarHBondContact O-N 3.37Å; A164-A167 PolarHBondContact O-N 3.25Å; A164-A168 WeakPolarHBondContact O-CB 3.33Å; A164-A168 PolarHBondContact O-N 3.12Å
165	V	84.4	Confident	79.9	Confident	105 Å²	105	68.8 Å²	68.8	64%	0.636	49%	0.49	S	S	*	.	H	α-helix	trans	-65.4	-43	174.4	173.3	0	0	0	0	111.2	A161 A162 A168 A169	A161-V165 WeakPolarHBondContact O-CG2 3.28Å; A161-V165 PolarHBondContact O-N 3.4Å; A162-V165 PolarHBondContact O-N 3.06Å; V165-A168 PolarHBondContact O-N 2.81Å; V165-A169 PolarHBondContact O-N 2.94Å
166	A	81.9	Confident	79.4	Confident	51 Å²	51	69.5 Å²	69.5	42%	0.421	50%	0.5	S	S	.	.	H	α-helix	trans	-62.2	-43.7	175.5	0	0	0	0	0	112	A162 A163 A168 A169 V170	A162-A166 WeakPolarHBondContact O-CB 3.3Å; A162-A166 PolarHBondContact O-N 2.68Å; A163-A166 PolarHBondContact O-N 2.84Å; A166-A168 VanDerWaalsContact C-N 3.35Å; A166-A168 PolarHBondContact O-N 3.01Å; A166-A169 PolarHBondContact O-N 2.86Å; A166-V170 WeakPolarHBondContact O-CG2 3.19Å; A166-V170 PolarHBondContact O-N 2.9Å
167	A	81.9	Confident	78.3	Confident	61 Å²	61	69.5 Å²	69.5	50%	0.504	50%	0.496	S	S	.	.	H	α-helix	trans	-62.9	-39.3	175.4	0	0	0	0	0	112.3	A163 A164 A171	A163-A167 VanDerWaalsContact O-CB 3.3Å; A163-A167 WeakPolarHBondContact O-CB 3.19Å; A163-A167 PolarHBondContact O-N 3.33Å; A164-A167 PolarHBondContact O-N 3.25Å; A167-A171 VanDerWaalsContact O-CB 3.3Å; A167-A171 WeakPolarHBondContact O-CB 3.22Å; A167-A171 PolarHBondContact O-N 3.21Å
168	A	80.3	Confident	77	Confident	61 Å²	61	75.3 Å²	75.3	50%	0.504	51%	0.506	S	S	.	.	H	α-helix	trans	-65.9	-40.1	174.9	0	0	0	0	0	112.4	A164 V165 A166 A171 A172	A164-A168 WeakPolarHBondContact O-CB 3.33Å; A164-A168 PolarHBondContact O-N 3.12Å; V165-A168 PolarHBondContact O-N 2.81Å; A166-A168 VanDerWaalsContact C-N 3.35Å; A166-A168 PolarHBondContact O-N 3.01Å; A168-A171 PolarHBondContact O-N 3.48Å; A168-A172 WeakPolarHBondContact O-CB 3.37Å; A168-A172 PolarHBondContact O-N 2.72Å
169	A	78.6	Confident	75.7	Confident	47 Å²	47	77.7 Å²	77.7	39%	0.388	51%	0.514	S	S	.	.	H	α-helix	trans	-64.2	-44.9	175.7	0	0	0	0	0	112.1	V165 A166 A172 Q173	V165-A169 PolarHBondContact O-N 2.94Å; A166-A169 PolarHBondContact O-N 2.86Å; A169-A172 PolarHBondContact O-N 3.18Å; A169-Q173 WeakPolarHBondContact O-CG 3.25Å; A169-Q173 PolarHBondContact O-N 2.82Å
170	V	81.8	Confident	74.2	Confident	82 Å²	82	80.8 Å²	80.8	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-64.3	-39.9	175.1	172.7	0	0	0	0	111.3	A166 A172 Q173 A174	A166-V170 WeakPolarHBondContact O-CG2 3.19Å; A166-V170 PolarHBondContact O-N 2.9Å; V170-A172 PolarHBondContact O-N 3.15Å; V170-Q173 PolarHBondContact O-N 2.8Å; V170-A174 WeakPolarHBondContact O-CB 3.17Å; V170-A174 PolarHBondContact O-N 3.08Å
171	A	79.7	Confident	72.7	Confident	58 Å²	58	82.9 Å²	82.9	48%	0.479	52%	0.524	S	S	.	.	H	α-helix	trans	-63.9	-38.4	175.2	0	0	0	0	0	112.5	A167 A168 A174 A175	A167-A171 VanDerWaalsContact O-CB 3.3Å; A167-A171 WeakPolarHBondContact O-CB 3.22Å; A167-A171 PolarHBondContact O-N 3.21Å; A168-A171 PolarHBondContact O-N 3.48Å; A171-A174 PolarHBondContact O-N 2.75Å; A171-A175 WeakPolarHBondContact O-CB 3.3Å; A171-A175 PolarHBondContact O-N 3.46Å
172	A	77.1	Confident	71	Confident	59 Å²	59	87 Å²	87	49%	0.488	54%	0.538	S	S	.	.	H	α-helix	trans	-65.8	-44.7	174.8	0	0	0	0	0	112	A168 A169 V170 A174 A175 V176	A168-A172 WeakPolarHBondContact O-CB 3.37Å; A168-A172 PolarHBondContact O-N 2.72Å; A169-A172 PolarHBondContact O-N 3.18Å; V170-A172 PolarHBondContact O-N 3.15Å; A172-A174 PolarHBondContact O-N 2.9Å; A172-A175 WeakPolarHBondContact O-CB 3.47Å; A172-A175 PolarHBondContact O-N 3.33Å; A172-V176 PolarHBondContact O-N 3.24Å; A172-V176 VanDerWaalsContact O-N 3.09Å
173	Q	75.6	Confident	69.2	Low	107 Å²	107	88 Å²	88	50%	0.5	54%	0.542	S	S	.	.	H	α-helix	trans	-61.2	-43.4	175.2	-70.9	172.7	-1.8	0	0	111.7	A169 V170 A175 V176 H177	A169-Q173 WeakPolarHBondContact O-CG 3.25Å; A169-Q173 PolarHBondContact O-N 2.82Å; V170-Q173 PolarHBondContact O-N 2.8Å; Q173-A175 VanDerWaalsContact C-N 3.28Å; Q173-A175 PolarHBondContact O-N 2.73Å; Q173-V176 PolarHBondContact O-N 2.9Å; Q173-H177 PolarHBondContact O-N 2.81Å; Q173-H177 VanDerWaalsContact O-N 3.1Å
174	A	73	Confident	67.2	Low	52 Å²	52	92.4 Å²	92.4	43%	0.43	56%	0.558	S	S	.	*	H	α-helix	trans	-65.3	-28.7	175.7	0	0	0	0	0	113.3	V170 A171 A172 R178	V170-A174 WeakPolarHBondContact O-CB 3.17Å; V170-A174 PolarHBondContact O-N 3.08Å; A171-A174 PolarHBondContact O-N 2.75Å; A172-A174 PolarHBondContact O-N 2.9Å; A174-R178 WeakPolarHBondContact O-CG 3.23Å; A174-R178 PolarHBondContact O-N 2.78Å
175	A	71.8	Confident	65.1	Low	54 Å²	54	94.5 Å²	94.5	45%	0.446	57%	0.568	S	S	.	*	H	α-helix	trans	-72.3	-39.4	173.9	0	0	0	0	0	112.2	A171 A172 Q173 R178	A171-A175 WeakPolarHBondContact O-CB 3.3Å; A171-A175 PolarHBondContact O-N 3.46Å; A172-A175 WeakPolarHBondContact O-CB 3.47Å; A172-A175 PolarHBondContact O-N 3.33Å; Q173-A175 VanDerWaalsContact C-N 3.28Å; Q173-A175 PolarHBondContact O-N 2.73Å; A175-R178 PolarHBondContact O-N 2.9Å
176	V	67.6	Low	62.7	Low	94 Å²	94	98.8 Å²	98.8	57%	0.57	58%	0.584	S	S	*	*	H	α-helix	trans	-60.9	-50.7	173.7	174.7	0	0	0	0	110.4	A172 Q173 R178 N179	A172-V176 PolarHBondContact O-N 3.24Å; A172-V176 VanDerWaalsContact O-N 3.09Å; Q173-V176 PolarHBondContact O-N 2.9Å; V176-R178 PolarHBondContact O-N 3.35Å; V176-R178 VanDerWaalsContact O-N 3.14Å; V176-N179 PolarHBondContact O-N 3.39Å
177	H	57.7	Low	60.5	Low	125 Å²	125	99.8 Å²	99.8	58%	0.579	60%	0.599	S	S	*	*	H	α-helix	trans	-66.5	-18.3	-175.9	-153.2	-39.9	0	0	0	113.8	Q173	Q173-H177 PolarHBondContact O-N 2.81Å; Q173-H177 VanDerWaalsContact O-N 3.1Å
178	R	54.6	Low	58.3	Low	197 Å²	197	103.4 Å²	103.4	74%	0.743	61%	0.614	S	S	*	*	H	α-helix	trans	-76.8	-25.5	171	-81.3	-173	179.8	-161.8	1.7	113.8	A174 A175 V176	A174-R178 WeakPolarHBondContact O-CG 3.23Å; A174-R178 PolarHBondContact O-N 2.78Å; A175-R178 PolarHBondContact O-N 2.9Å; V176-R178 PolarHBondContact O-N 3.35Å; V176-R178 VanDerWaalsContact O-N 3.14Å
179	N	51.6	Low	56	Low	121 Å²	121	105.2 Å²	105.2	65%	0.647	62%	0.623	S	S	*	*	H	α-helix	trans	-78.6	-37.4	-177.7	-72.7	-21.5	0	0	0	112	V176 V181 N182 S183	V176-N179 PolarHBondContact O-N 3.39Å; N179-V181 PolarHBondContact O-N 2.85Å; N179-N182 PolarHBondContact O-N 2.91Å; N179-S183 PolarHBondContact O-OG 2.88Å
180	E	51.2	Low	53.8	Low	124 Å²	124	110.3 Å²	110.3	58%	0.579	64%	0.644	S	S	*	*	H	α-helix	trans	-65	-41.8	-179.4	-65.2	-177.4	137.5	0	0	112.4	N182 S183	E180-N182 PolarHBondContact O-N 2.61Å; E180-S183 WeakPolarHBondContact O-CB 3.47Å; E180-S183 PolarHBondContact O-N 2.69Å; E180-S183 PolarHBondContact O-OG 2.87Å
181	V	50.9	Low	51.5	Low	107 Å²	107	112.7 Å²	112.7	65%	0.648	66%	0.659	S	S	*	*	H	α-helix	trans	-63.5	-25.1	-179.4	-180	0	0	0	0	112.6	N179 S183	N179-V181 PolarHBondContact O-N 2.85Å; V181-S183 VanDerWaalsContact C-N 3.31Å; V181-S183 PolarHBondContact O-N 2.67Å
182	N	44.4	Very low	49.2	Very low	143 Å²	143	117 Å²	117	77%	0.765	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	0.5	-178.4	-136.4	26	0	0	0	113.6	N179 E180	N179-N182 PolarHBondContact O-N 2.91Å; E180-N182 PolarHBondContact O-N 2.61Å
183	S	44.2	Very low	47.1	Very low	85 Å²	85	123.2 Å²	123.2	59%	0.594	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-25	-176.8	-38.4	0	0	0	0	113.8	N179 E180 V181	N179-S183 PolarHBondContact O-OG 2.88Å; E180-S183 WeakPolarHBondContact O-CB 3.47Å; E180-S183 PolarHBondContact O-N 2.69Å; E180-S183 PolarHBondContact O-OG 2.87Å; V181-S183 VanDerWaalsContact C-N 3.31Å; V181-S183 PolarHBondContact O-N 2.67Å
184	N	42.4	Very low	44.8	Very low	148 Å²	148	125.2 Å²	125.2	79%	0.791	70%	0.702	S	S	*	*	S	Bend	trans	-104.1	34.5	-162.4	-66.6	-10.5	0	0	0	113.6
185	S	36.9	Very low	42.7	Very low	103 Å²	103	129.1 Å²	129.1	72%	0.72	71%	0.714	S	S	*	*			trans	-138.4	50.1	-171.4	-147	0	0	0	0	115.5
186	M	33.6	Very low	40.6	Very low	196 Å²	196	131.3 Å²	131.3	97%	0.966	73%	0.726	S	S	*	*			trans	-146.3	133.9	160.8	-79	-162.4	-87.4	0	0	111.7
187	G	36.3	Very low	38.8	Very low	71 Å²	71	132.2 Å²	132.2	73%	0.732	73%	0.732	S	S	*	*			trans	93	77.1	179.8	0	0	0	0	0	114.5
188	V	34.6	Very low	37.4	Very low	138 Å²	138	132.8 Å²	132.8	84%	0.836	74%	0.735	S	S	*	*				71.2	118	58.1	-166.5	0	0	0	0	114.7
189	S	33.4	Very low	36.5	Very low	99 Å²	99	130.6 Å²	130.6	69%	0.692	74%	0.738	S	S	*	*			trans	108	111.8	159.6	-48.5	0	0	0	0	119.2
190	N	30.9	Very low	35.5	Very low	153 Å²	153	133.1 Å²	133.1	82%	0.818	74%	0.74	S	S	*	*				41.3	143.4	129.8	-54.1	-13.4	0	0	0	120.9
191	T	34.6	Very low	34.5	Very low	133 Å²	133	134.8 Å²	134.8	82%	0.816	75%	0.752	S	S	*	*			cis	-143	160	33.2	46.9	0	0	0	0	116
192	N	30.3	Very low	33.3	Very low	147 Å²	147	134.1 Å²	134.1	79%	0.786	75%	0.752	S	S	*	*			trans	-59.3	152.3	177.6	-48.2	-50.9	0	0	0	116.4
193	Q	32.9	Very low	32.5	Very low	190 Å²	190	134 Å²	134	89%	0.888	75%	0.751	S	S	*	*				166.2	149.8	124.6	-90.7	175.6	52.6	0	0	110.1
194	H	28.4	Very low	31.6	Very low	150 Å²	150	137.9 Å²	137.9	69%	0.694	76%	0.762	S	S	*	*			cis	-164.9	134.2	-19.3	-173	-104	0	0	0	109.9
195	I	28.4	Very low	30.7	Very low	134 Å²	134	139.4 Å²	139.4	69%	0.687	76%	0.761	S	S	*	*			trans	13.2	128.2	151.2	-68.3	160.8	0	0	0	117.4
196	S	27.4	Very low	30.1	Very low	99 Å²	99	139.9 Å²	139.9	69%	0.692	76%	0.763	S	S	*	*				-166.5	-177.7	53.5	-135.5	0	0	0	0	110.8
197	T	31	Very low	29.8	Very low	113 Å²	113	138.9 Å²	138.9	69%	0.693	76%	0.762	S	S	*	*			cis	-157.3	148.2	16.7	-6.3	0	0	0	0	111.2
198	Q	27.5	Very low	29.6	Very low	137 Å²	137	142 Å²	142	64%	0.64	76%	0.761	S	S	*	*			trans	34.3	107.6	144.2	-59.7	-67.6	-8.5	0	0	120.2
199	N	36.3	Very low	29.2	Very low	151 Å²	151	143.5 Å²	143.5	81%	0.807	76%	0.759	S	S	*	*				-159.2	141.2	115.1	-107.3	-31.3	0	0	0	114.1
200	Y	29.2	Very low	28.9	Very low	175 Å²	175	141.9 Å²	141.9	69%	0.686	76%	0.758	S	S	*	*			trans	-46.8	143.1	-179.9	-61.2	-95.4	0	0	0	114.2
201	L	30.9	Very low	28.8	Very low	159 Å²	159	143.2 Å²	143.2	83%	0.832	76%	0.764	S	S	*	*			cis	71.8	147.5	30.8	-148.8	108.6	0	0	0	114.6
202	S	26.1	Very low	28.5	Very low	92 Å²	92	142.5 Å²	142.5	64%	0.643	76%	0.76	S	S	*	*			trans	80.1	158.2	176.4	83.1	0	0	0	0	118.4
203	N	26.7	Very low	28.5	Very low	141 Å²	141	144.8 Å²	144.8	75%	0.754	76%	0.763	S	S	*	*			trans	66.7	106.2	173.1	-59.5	-22.4	0	0	0	116.9
204	M	25.1	Very low	28.3	Very low	166 Å²	166	141 Å²	141	82%	0.818	76%	0.757	S	S	*	*				89.2	106.9	62.3	-76	-83.7	-163.3	0	0	112.6
205	K	25.3	Very low	28.4	Very low	181 Å²	181	143.4 Å²	143.4	79%	0.787	77%	0.766	S	S	*	*	S	Bend		41.7	103.7	123.3	-170.9	-178.5	-177.7	-178.8	0	117.5
206	C	24.2	Very low	28.6	Very low	113 Å²	113	144.8 Å²	144.8	76%	0.764	77%	0.771	S	S	*	*			trans	57	116.3	156.6	-52.4	0	0	0	0	117.5
207	D	25.7	Very low	29.2	Very low	174 Å²	174	145 Å²	145	93%	0.93	77%	0.77	S	S	*	*				-153.2	165.1	118.8	-118.1	-30.9	0	0	0	113.5
208	L	33	Very low	29	Very low	138 Å²	138	144.1 Å²	144.1	72%	0.723	77%	0.769	S	S	*	*			trans	-114.9	136	-173.2	176.6	75.4	0	0	0	109.7
209	H	26.3	Very low	29.2	Very low	168 Å²	168	144.8 Å²	144.8	78%	0.778	77%	0.774	S	S	*	*			trans	162.2	135.8	135.4	-98.5	-85.7	0	0	0	113.2
210	G	26.1	Very low	29	Very low	65 Å²	65	145.3 Å²	145.3	67%	0.67	77%	0.769	S	S	*	*			trans	82.3	122.4	173.9	0	0	0	0	0	113.6
211	L	29.7	Very low	29	Very low	181 Å²	181	142.1 Å²	142.1	95%	0.948	76%	0.764	S	S	*	*			cis	-103.7	113.9	17.6	-74.8	161	0	0	0	113.9
212	T	28.9	Very low	29	Very low	119 Å²	119	143.6 Å²	143.6	73%	0.73	76%	0.764	S	S	*	*			trans	-122.1	121.2	159	48	0	0	0	0	109
213	K	28.9	Very low	29.1	Very low	195 Å²	195	143.4 Å²	143.4	85%	0.848	76%	0.759	S	S	*	*			trans	-141.9	122.1	162.2	-86.5	-169	173.9	-178.3	0	109.1
214	S	29.4	Very low	29.4	Very low	111 Å²	111	142.7 Å²	142.7	78%	0.776	76%	0.762	S	S	*	*	S	Bend	trans	51.4	126.4	163.6	51.8	0	0	0	0	119.5
215	F	29.9	Very low	29.6	Very low	200 Å²	200	145.2 Å²	145.2	88%	0.877	76%	0.764	S	S	*	*			cis	-160.2	160.4	-9.9	-147.5	-94.1	0	0	0	110.5
216	M	32.1	Very low	29.8	Very low	162 Å²	162	143.9 Å²	143.9	80%	0.798	76%	0.76	S	S	*	*			trans	-161.6	174.5	-177.3	-105.2	-156.2	175.5	0	0	108.6
217	P	41.8	Very low	30	Very low	104 Å²	104	144.8 Å²	144.8	68%	0.675	76%	0.762	S	S	*	*			cis	-138.3	-144.9	-35.2	40.4	-21.5	0	0	0	110.9
218	S	27.1	Very low	30	Very low	95 Å²	95	142.1 Å²	142.1	66%	0.664	75%	0.752	S	S	*	*			trans	85.4	151.2	166.3	84.8	0	0	0	0	116.1
219	M	30.9	Very low	29.8	Very low	151 Å²	151	142.6 Å²	142.6	74%	0.744	76%	0.756	S	S	*	*			cis	-136.4	139.6	23.3	-79.7	-167.2	177.9	0	0	116.4
220	F	31.3	Very low	29.8	Very low	161 Å²	161	140.8 Å²	140.8	71%	0.706	75%	0.752	S	S	*	*			trans	49.7	150.6	139.7	-57.3	-50.8	0	0	0	122.1
221	N	28.6	Very low	29.9	Very low	108 Å²	108	144 Å²	144	58%	0.578	75%	0.754	S	S	*	*			cis	-153.5	166.7	-4.5	-119	-25.5	0	0	0	107.6
222	F	30.9	Very low	30	Very low	190 Å²	190	141.5 Å²	141.5	83%	0.833	74%	0.741	S	S	*	*			cis	-145	174.6	36.8	-119.2	-80.4	0	0	0	112.6
223	T	29.4	Very low	30.2	Very low	89 Å²	89	143 Å²	143	55%	0.546	75%	0.745	S	S	.	*			trans	-102.9	147.8	-165.8	47.2	0	0	0	0	115.9
224	P	31.8	Very low	30.4	Very low	125 Å²	125	135.9 Å²	135.9	81%	0.812	72%	0.722	S	S	*	*			trans	-87.5	143.9	156.4	34.9	-30.2	0	0	0	110.5
225	Y	31.3	Very low	30.6	Very low	220 Å²	220	134.1 Å²	134.1	86%	0.863	70%	0.704	S	S	*	*			trans	-115.4	145.5	172.7	-103.5	-84.5	0	0	0	113.3
226	H	28.5	Very low	30.7	Very low	152 Å²	152	129.5 Å²	129.5	70%	0.704	69%	0.689	S	S	*	*			trans	-96.1	156.1	-168.8	-165.5	-102.7	0	0	0	111.2
227	V	29.1	Very low	30.8	Very low	133 Å²	133	128.3 Å²	128.3	81%	0.806	69%	0.69	S	S	*	*			trans	-179.7	133.7	133	144.6	0	0	0	0	110.4
228	T	25.9	Very low	30.2	Very low	117 Å²	117	129.9 Å²	129.9	72%	0.718	69%	0.693	S	S	*	*			trans	-112.2	123.7	174.4	51.4	0	0	0	0	110.3
229	N	27.2	Very low	30.4	Very low	149 Å²	149	133 Å²	133	80%	0.797	70%	0.701	S	S	*	*			trans	-156.2	166.6	153.8	-142	-21.2	0	0	0	113.4
230	N	26	Very low	30.3	Very low	130 Å²	130	131.9 Å²	131.9	70%	0.695	70%	0.698	S	S	*	*			trans	-83.2	168.5	-159.4	-65.1	-87.4	0	0	0	116.4
231	N	29.1	Very low	30.3	Very low	133 Å²	133	131 Å²	131	71%	0.711	70%	0.7	S	S	*	*			trans	88.1	98.1	149.1	-63.3	-35.5	0	0	0	121.9
232	N	31.1	Very low	30.2	Very low	127 Å²	127	132.4 Å²	132.4	68%	0.679	71%	0.708	S	S	*	*				70.6	139.7	122.9	-56.6	-38.5	0	0	0	123.5
233	N	32.8	Very low	30.4	Very low	151 Å²	151	132 Å²	132	81%	0.807	71%	0.708	S	S	*	*			trans	67.9	120.9	160.9	-64.1	-19.8	0	0	0	118.4
234	A	33.4	Very low	30.5	Very low	45 Å²	45	134.5 Å²	134.5	37%	0.372	72%	0.718	S	S	.	*			cis	132.5	137.3	17.2	0	0	0	0	0	109.7	Q258	A234-Q258 VanDerWaalsContact CB-NE2 3.26Å
235	N	33.8	Very low	30.3	Very low	74 Å²	74	136.1 Å²	136.1	40%	0.396	72%	0.719	S	S	.	*			trans	87.7	115.1	157.4	-60.1	8.4	0	0	0	121.4	Q258 Q259	N235-Q258 WeakPolarHBondContact OD1-CB 3.22Å; N235-Q258 PolarHBondContact OD1-NE2 2.91Å; N235-Q259 PolarHBondContact ND2-NE2 3.45Å
236	N	32.2	Very low	30.1	Very low	104 Å²	104	134.9 Å²	134.9	56%	0.556	72%	0.718	S	S	*	*			trans	33.3	133.3	133.7	-56.6	-33.1	0	0	0	120.5	Q258	N236-Q258 PolarHBondContact ND2-O 3.26Å
237	T	34.6	Very low	30.1	Very low	136 Å²	136	134 Å²	134	83%	0.834	72%	0.723	S	S	*	*				-163.8	145.4	64	37	0	0	0	0	116.4
238	N	28.4	Very low	30.2	Very low	137 Å²	137	135 Å²	135	73%	0.733	72%	0.723	S	S	*	*			trans	-9.3	134.1	149.2	-172	17.9	0	0	0	120.4
239	I	32	Very low	30.7	Very low	162 Å²	162	134.9 Å²	134.9	83%	0.831	72%	0.724	S	S	*	*			trans	-170.8	153	136.8	-101.8	156.7	0	0	0	111.9
240	N	27.9	Very low	31.1	Very low	126 Å²	126	133.1 Å²	133.1	67%	0.674	72%	0.721	S	S	*	*			trans	-84.5	149.6	-179.1	-51.9	-60.5	0	0	0	113.7
241	N	31.2	Very low	31.2	Very low	142 Å²	142	131.4 Å²	131.4	76%	0.759	72%	0.719	S	S	*	*				159.2	137.4	112.5	-83	-47.2	0	0	0	114.7
242	N	27.9	Very low	31.2	Very low	138 Å²	138	133 Å²	133	74%	0.738	73%	0.725	S	S	*	*			trans	2.9	126.3	152.1	-50	-24.9	0	0	0	119.7
243	H	35.5	Very low	31.2	Very low	183 Å²	183	131 Å²	131	85%	0.847	72%	0.721	S	S	*	*				-161.9	170.3	114.7	-102.4	-53.1	0	0	0	113
244	N	29.8	Very low	31.1	Very low	140 Å²	140	131 Å²	131	75%	0.749	72%	0.717	S	S	*	*			trans	-79.6	160.4	-170	-51.3	-44.3	0	0	0	113.1
245	I	27.8	Very low	31	Very low	160 Å²	160	134 Å²	134	82%	0.821	72%	0.721	S	S	*	*			trans	146.8	119.2	132	-76.2	158	0	0	0	112.8
246	F	28.5	Very low	30.8	Very low	194 Å²	194	137.6 Å²	137.6	85%	0.851	73%	0.73	S	S	*	*			trans	46.1	151.3	151	-102.3	-104.8	0	0	0	124.4
247	T	28.4	Very low	30.8	Very low	133 Å²	133	134 Å²	134	82%	0.816	71%	0.713	S	S	*	*			trans	102	161.1	155.2	-35.6	0	0	0	0	117.6
248	I	31.5	Very low	30.9	Very low	155 Å²	155	129.7 Å²	129.7	80%	0.795	68%	0.684	S	S	*	*			trans	-101	151.4	-156.5	-77	170.6	0	0	0	111.5
249	P	36.3	Very low	31.1	Very low	113 Å²	113	128.5 Å²	128.5	73%	0.734	67%	0.674	S	S	*	*			trans	-75.1	164.5	-168	33	-40.6	0	0	0	114.2
250	P	34.2	Very low	31.1	Very low	113 Å²	113	124.1 Å²	124.1	73%	0.734	65%	0.652	S	S	*	*				-154.3	176.2	57.7	41.4	-18.6	0	0	0	121
251	S	28.7	Very low	31.3	Very low	94 Å²	94	121.8 Å²	121.8	66%	0.657	65%	0.645	S	S	*	*			trans	64.9	120.3	144.8	57.2	0	0	0	0	124
252	I	29.8	Very low	31.3	Very low	166 Å²	166	119.2 Å²	119.2	85%	0.851	63%	0.632	S	S	*	*				88.6	121.6	128	-69.6	171.9	0	0	0	121.4
253	S	29.8	Very low	31.5	Very low	84 Å²	84	120.7 Å²	120.7	59%	0.587	64%	0.639	S	S	*	*			trans	90	111.4	144.5	-145.5	0	0	0	0	124.7
254	Q	32.2	Very low	31.2	Very low	153 Å²	153	117.6 Å²	117.6	72%	0.715	63%	0.628	S	S	*	*			trans	66.9	163.6	131.8	-71.2	173.8	-12.9	0	0	120.3
255	F	30.9	Very low	31.1	Very low	108 Å²	108	122 Å²	122	47%	0.474	63%	0.634	S	S	.	*			cis	-157.9	-177.6	2.3	-128.4	-48.1	0	0	0	111.8	D1100	F255-D1100 HydrophobicContact CE1-CB 4.5Å; F255-D1100 WeakPolarHBondContact CZ-OD2 3.3Å
256	Y	28.5	Very low	31.2	Very low	149 Å²	149	121.6 Å²	121.6	58%	0.584	63%	0.629	S	S	*	*			trans	102.1	71.1	153.3	-75.4	-68.3	0	0	0	125
257	S	33.8	Very low	31	Very low	28 Å²	28	116.3 Å²	116.3	20%	0.196	62%	0.616	C	S	.	*				61.4	151.7	107.8	-48.2	0	0	0	0	126.5
258	Q	35.2	Very low	30.9	Very low	45 Å²	45	117 Å²	117	21%	0.21	62%	0.615	C	S	.	*			trans	92.5	143	146.7	-87.5	173.8	132.8	0	0	120.5	A234 N235 N236 L1102 K1103	A234-Q258 VanDerWaalsContact CB-NE2 3.26Å; N235-Q258 WeakPolarHBondContact OD1-CB 3.22Å; N235-Q258 PolarHBondContact OD1-NE2 2.91Å; N236-Q258 PolarHBondContact ND2-O 3.26Å; Q258-L1102 HydrophobicContact CG-CB 3.26Å; Q258-L1102 HydrophobicContact CG-CD1 4.37Å; Q258-L1102 HydrophobicContact CG-CG 4.39Å; Q258-K1103 WeakPolarHBondContact CG-O 3.36Å; Q258-K1103 PolarHBondContact OE1-O 3.48Å
259	Q	34.1	Very low	30.7	Very low	113 Å²	113	114.7 Å²	114.7	53%	0.528	61%	0.612	S	S	.	*			cis	-140	153	13.5	-63.5	-170.3	-12.4	0	0	116.2	N235 L1102 K1103	N235-Q259 PolarHBondContact ND2-NE2 3.45Å; Q259-L1102 WeakPolarHBondContact CA-O 3.43Å; Q259-K1103 WeakPolarHBondContact CB-O 3.42Å; Q259-K1103 VanDerWaalsContact CG-O 3.3Å; Q259-K1103 WeakPolarHBondContact CG-O 3.39Å
260	N	32.2	Very low	30.2	Very low	70 Å²	70	114.7 Å²	114.7	37%	0.374	61%	0.614	S	S	.	*			trans	-20.1	157.2	157.6	-98.3	37.2	0	0	0	121.2	L1102 N1104	N260-L1102 PolarHBondContact N-O 3.04Å; N260-L1102 PolarHBondContact OD1-O 2.92Å; N260-N1104 PolarHBondContact ND2-OD1 2.84Å
261	S	31.8	Very low	29.7	Very low	76 Å²	76	118.5 Å²	118.5	53%	0.531	62%	0.619	S	S	.	*				-173.4	148.3	68.4	55.5	0	0	0	0	119.8	K1105	S261-K1105 WeakPolarHBondContact CB-O 3.31Å; S261-K1105 PolarHBondContact OG-O 2.91Å
262	N	29.7	Very low	29.7	Very low	88 Å²	88	119.5 Å²	119.5	47%	0.471	62%	0.617	S	S	.	*			trans	46	116.1	138.4	-57.6	-11.1	0	0	0	123.8
263	L	32.7	Very low	29.7	Very low	170 Å²	170	116.8 Å²	116.8	89%	0.89	60%	0.604	S	S	*	*				170.5	105.7	117.3	-99.1	142.5	0	0	0	108.4
264	N	28.5	Very low	29.9	Very low	117 Å²	117	121.7 Å²	121.7	63%	0.626	62%	0.617	S	S	*	*			cis	81.5	78.9	31	-162.4	13	0	0	0	116.6	H266	N264-H266 PolarHBondContact OD1-CE1 3.3Å; N264-H266 VanDerWaalsContact OD1-CE1 3.23Å; N264-H266 PolarHBondContact OD1-ND1 3.39Å
265	R	29.4	Very low	29.9	Very low	232 Å²	232	119.6 Å²	119.6	88%	0.875	61%	0.611	S	S	*	*			trans	-149.7	126	143.7	-90.8	173.8	-167.3	-135.1	-0.7	105.5
266	H	28.8	Very low	30	Very low	152 Å²	152	121.7 Å²	121.7	70%	0.704	63%	0.633	S	S	*	*				59.6	129.7	59.9	-66.1	68.7	0	0	0	112.4	N264	N264-H266 PolarHBondContact OD1-CE1 3.3Å; N264-H266 VanDerWaalsContact OD1-CE1 3.23Å; N264-H266 PolarHBondContact OD1-ND1 3.39Å
267	S	25.3	Very low	30.2	Very low	83 Å²	83	120 Å²	120	58%	0.58	63%	0.633	S	S	*	*			cis	-179.2	162.2	-2.9	46.9	0	0	0	0	110.9
268	N	26.1	Very low	29.9	Very low	148 Å²	148	127.4 Å²	127.4	79%	0.791	66%	0.664	S	S	*	*			trans	74.5	167.6	157	-52.5	-25.4	0	0	0	119.3
269	S	26.6	Very low	29.6	Very low	106 Å²	106	127.3 Å²	127.3	74%	0.741	67%	0.669	S	S	*	*			trans	66	134.9	178.6	20.4	0	0	0	0	115.7
270	C	25	Very low	29.5	Very low	114 Å²	114	127.1 Å²	127.1	77%	0.77	67%	0.667	S	S	*	*			cis	71.7	113.9	29.4	-57.4	0	0	0	0	115.2
271	F	25.7	Very low	29.4	Very low	193 Å²	193	129.6 Å²	129.6	85%	0.846	67%	0.671	S	S	*	*			trans	70.6	129.7	161.8	-77.8	-110.4	0	0	0	119.5
272	N	27	Very low	29.4	Very low	115 Å²	115	130.2 Å²	130.2	62%	0.615	67%	0.672	S	S	*	*			trans	79.1	126.5	142.1	-72.7	41.2	0	0	0	124.2
273	D	30.7	Very low	29.7	Very low	109 Å²	109	131.8 Å²	131.8	58%	0.583	69%	0.685	S	S	*	*				60.2	120.4	128.5	-50.2	-23.9	0	0	0	122.8
274	H	33.8	Very low	29.8	Very low	186 Å²	186	128.8 Å²	128.8	86%	0.861	68%	0.675	S	S	*	*				-172.3	113.3	113.8	-97.2	-71.7	0	0	0	106.6
275	N	32.2	Very low	29.8	Very low	109 Å²	109	129.7 Å²	129.7	58%	0.583	68%	0.68	S	S	*	*			cis	70.1	90.5	36.8	-131.3	3.8	0	0	0	112.7	I277	N275-I277 HydrophobicContact CB-CD1 4.37Å; N275-I277 HydrophobicContact CB-CG1 4.25Å
276	V	33.3	Very low	30	Very low	152 Å²	152	124.4 Å²	124.4	92%	0.921	67%	0.674	S	S	*	*			trans	-90.7	123	155.5	174.7	0	0	0	0	106.1
277	I	31.3	Very low	30.1	Very low	114 Å²	114	123 Å²	123	59%	0.585	68%	0.679	S	S	*	*			trans	-122.6	134	-170.4	-62.4	170.1	0	0	0	108.7	N275	N275-I277 HydrophobicContact CB-CD1 4.37Å; N275-I277 HydrophobicContact CB-CG1 4.25Å
278	E	28.2	Very low	30.3	Very low	183 Å²	183	127.6 Å²	127.6	86%	0.855	69%	0.69	S	S	*	*			trans	-135.7	98.5	140.9	-146.6	150.3	-139.2	0	0	106.8
279	S	29.6	Very low	30.3	Very low	44 Å²	44	128 Å²	128	31%	0.308	69%	0.691	S	S	.	*			trans	25.6	151.1	154.3	30.7	0	0	0	0	120.9	N1133	S279-N1133 WeakPolarHBondContact CA-OD1 3.37Å; S279-N1133 WeakPolarHBondContact CB-OD1 3.41Å
280	H	32.1	Very low	30.2	Very low	108 Å²	108	131.5 Å²	131.5	50%	0.5	70%	0.695	S	S	.	*				165.1	124.5	88.4	-82.6	-92.5	0	0	0	112.1	N1133 S1135	H280-N1133 VanDerWaalsContact CA-OD1 3.24Å; H280-N1133 WeakPolarHBondContact CA-OD1 3.35Å; H280-N1133 PolarHBondContact N-OD1 3.34Å; H280-N1133 WeakPolarHBondContact ND1-CA 3.39Å; H280-N1133 PolarHBondContact ND1-N 3.44Å; H280-N1133 PolarHBondContact ND1-O 2.99Å; H280-S1135 PolarHBondContact O-N 3.19Å
281	R	29.8	Very low	30.3	Very low	122 Å²	122	129.7 Å²	129.7	46%	0.46	69%	0.688	S	S	.	*			cis	-139.1	-82.8	-14.4	-123.2	134.4	-152.1	-51.9	5.9	109.8	D1132 N1133 N1134	R281-D1132 IonicContact CZ-OD1 3.28Å; R281-D1132 IonicContact CZ-OD2 2.66Å; R281-D1132 IonicContact NH1-OD1 3.06Å; R281-D1132 PolarHBondContact NH1-OD1 3.2Å; R281-D1132 IonicContact NH1-OD2 2.72Å; R281-D1132 PolarHBondContact NH1-OD2 3.12Å; R281-D1132 VanDerWaalsContact NH2-CB 3.27Å; R281-D1132 IonicContact NH2-OD2 3.68Å; R281-D1132 PolarHBondContact NH2-OD2 2.92Å; R281-N1133 HydrophobicContact CB-CB 3.51Å; R281-N1133 WeakPolarHBondContact CD-O 3.41Å; R281-N1133 HydrophobicContact CG-CB 3.14Å; R281-N1133 PolarHBondContact NE-O 3.44Å; R281-N1134 VanDerWaalsContact CA-N 3.32Å; R281-N1134 VanDerWaalsContact CB-CA 3.4Å; R281-N1134 HydrophobicContact CB-CB 3.48Å; R281-N1134 VanDerWaalsContact CB-CB 3.48Å; R281-N1134 VanDerWaalsContact CD-N 3.25Å; R281-N1134 HydrophobicContact CG-CB 4.02Å
282	T	32.2	Very low	30.4	Very low	90 Å²	90	127.1 Å²	127.1	55%	0.552	68%	0.683	S	S	*	*				-126.4	117.2	-120.8	18.6	0	0	0	0	119
283	V	35.1	Very low	30.3	Very low	120 Å²	120	128.4 Å²	128.4	73%	0.727	69%	0.69	S	S	*	*			trans	-45.9	154.5	133.8	-112.4	0	0	0	0	111.6
284	P	35.3	Very low	30.2	Very low	107 Å²	107	129 Å²	129	70%	0.695	70%	0.698	S	S	*	*				-155.5	162.8	63.2	42.2	-21	0	0	0	120.2
285	N	29.3	Very low	29.8	Very low	137 Å²	137	125.8 Å²	125.8	73%	0.733	69%	0.686	S	S	*	*			trans	67.6	104.5	140.3	-63	-3.1	0	0	0	122.8
286	T	33	Very low	29.5	Very low	121 Å²	121	130.4 Å²	130.4	74%	0.742	70%	0.697	S	S	*	*				8.5	145.3	107.8	52.6	0	0	0	0	118.5
287	P	30.7	Very low	29.2	Very low	123 Å²	123	127.5 Å²	127.5	80%	0.799	68%	0.683	S	S	*	*				-150.3	176.7	60.1	41.8	-22.1	0	0	0	119.4
288	H	28.9	Very low	29	Very low	179 Å²	179	128.9 Å²	128.9	83%	0.829	69%	0.692	S	S	*	*			trans	-51.4	154.8	157.6	-80.9	-100.2	0	0	0	112.6
289	I	25.9	Very low	29.1	Very low	157 Å²	157	127.6 Å²	127.6	81%	0.805	69%	0.69	S	S	*	*				-174.6	162.8	112.6	-95.6	158.6	0	0	0	110.8
290	H	25.9	Very low	29	Very low	178 Å²	178	131.1 Å²	131.1	82%	0.824	71%	0.705	S	S	*	*			trans	-51.4	160.5	172.1	-55.3	-100.9	0	0	0	112.1
291	A	27.3	Very low	29.1	Very low	76 Å²	76	134.1 Å²	134.1	63%	0.628	72%	0.719	S	S	*	*				176.5	172.8	56.6	0	0	0	0	0	111.6
292	N	27.1	Very low	29.2	Very low	140 Å²	140	135.1 Å²	135.1	75%	0.749	73%	0.734	S	S	*	*			trans	66	122.3	156.3	-59.2	-22.6	0	0	0	117.3
293	N	25.5	Very low	29.7	Very low	141 Å²	141	134.7 Å²	134.7	75%	0.754	73%	0.733	S	S	*	*				69.7	148.8	66.2	-87.2	-18.4	0	0	0	114.1
294	T	27.1	Very low	29.8	Very low	122 Å²	122	137 Å²	137	75%	0.748	74%	0.735	S	S	*	*			trans	69.3	140.2	157.3	43.1	0	0	0	0	116.4
295	I	25.6	Very low	29.7	Very low	119 Å²	119	136.6 Å²	136.6	61%	0.61	74%	0.735	S	S	*	*			cis	-168	168.6	-6.3	-135.5	169.1	0	0	0	110.7
296	Y	26	Very low	30.2	Very low	206 Å²	206	135.2 Å²	135.2	81%	0.808	73%	0.733	S	S	*	*			trans	62.4	154.1	168.3	-64	-29.1	0	0	0	118.7
297	S	28.2	Very low	30.3	Very low	91 Å²	91	136.5 Å²	136.5	64%	0.636	73%	0.734	S	S	*	*			cis	-167.4	149.9	-23.1	52.7	0	0	0	0	111.8
298	N	26	Very low	30.4	Very low	143 Å²	143	137.8 Å²	137.8	77%	0.765	73%	0.733	S	S	*	*			trans	21.9	122.6	146	-53	-23.4	0	0	0	120.2
299	L	30.9	Very low	30.8	Very low	156 Å²	156	134.4 Å²	134.4	82%	0.817	73%	0.726	S	S	*	*				-177.9	119.9	98.7	-106	98.7	0	0	0	107.3
300	N	27.6	Very low	31	Very low	117 Å²	117	131.1 Å²	131.1	63%	0.626	72%	0.717	S	S	*	*				87.3	96.4	60	-177.7	30.8	0	0	0	114.1
301	Q	33.9	Very low	31.4	Very low	171 Å²	171	130.5 Å²	130.5	80%	0.799	71%	0.713	S	S	*	*				173.3	98.2	126.6	-93.5	166.6	59.8	0	0	114.2
302	N	31.9	Very low	31.7	Very low	144 Å²	144	134.5 Å²	134.5	77%	0.77	72%	0.719	S	S	*	*				21.2	164.1	114.9	-90.1	2.4	0	0	0	122.1
303	P	42.5	Very low	31.8	Very low	80 Å²	80	134.3 Å²	134.3	52%	0.519	72%	0.722	S	S	.	*			cis	-147.3	-166.1	-34.5	39.9	-19.7	0	0	0	114.9
304	H	36.9	Very low	32.2	Very low	169 Å²	169	131.1 Å²	131.1	78%	0.782	72%	0.723	S	S	*	*			trans	129.7	83.4	148.2	-72.7	-70.9	0	0	0	113.9
305	S	34.5	Very low	32.4	Very low	99 Å²	99	133.2 Å²	133.2	69%	0.692	73%	0.729	S	S	*	*				65.5	152.6	53.4	-42.7	0	0	0	0	114.3
306	P	38.6	Very low	32.8	Very low	107 Å²	107	131.2 Å²	131.2	70%	0.695	74%	0.738	S	S	*	*			cis	-144.9	-157.2	-19.7	27.2	0.2	0	0	0	115
307	I	35.7	Very low	32.8	Very low	149 Å²	149	128.7 Å²	128.7	76%	0.764	74%	0.737	S	S	*	*			trans	99.7	133.2	151.8	-57.1	168.3	0	0	0	118
308	I	32.2	Very low	33	Very low	150 Å²	150	129.7 Å²	129.7	77%	0.769	74%	0.744	S	S	*	*			cis	-166.9	159.6	-41.2	-111.8	160.2	0	0	0	110.4
309	P	37.3	Very low	33.1	Very low	107 Å²	107	132 Å²	132	70%	0.695	75%	0.747	S	S	*	*			trans	-128.2	-154.6	-162.3	45.4	-31.1	0	0	0	116.5
310	S	31.5	Very low	32.9	Very low	88 Å²	88	129.7 Å²	129.7	62%	0.615	75%	0.745	S	S	*	*			trans	85.7	151.7	168.3	68.7	0	0	0	0	117.7
311	F	33.1	Very low	32.9	Very low	165 Å²	165	130.4 Å²	130.4	72%	0.724	75%	0.753	S	S	*	*			cis	-148.9	156.8	30.8	-88.5	-86.8	0	0	0	116.3
312	Q	34.1	Very low	32.6	Very low	161 Å²	161	127.4 Å²	127.4	75%	0.752	75%	0.748	S	S	*	*			trans	52.9	157.4	140	-76.9	163.9	-25.5	0	0	123.4
313	T	28.6	Very low	32.3	Very low	135 Å²	135	126.3 Å²	126.3	83%	0.828	75%	0.752	S	S	*	*			cis	-170.4	148.1	-39.6	21.9	0	0	0	0	107.8
314	G	33.2	Very low	31.6	Very low	74 Å²	74	129.2 Å²	129.2	76%	0.763	76%	0.763	S	S	*	*			trans	171	134.6	168.2	0	0	0	0	0	114.3
315	D	31.8	Very low	31.2	Very low	166 Å²	166	130.9 Å²	130.9	89%	0.888	77%	0.768	S	S	*	*			trans	-94.7	157.9	-168.2	-65.1	-79.5	0	0	0	115.7
316	G	33.5	Very low	30.8	Very low	77 Å²	77	136.7 Å²	136.7	79%	0.794	78%	0.775	S	S	*	*			trans	-179.6	105.6	170.6	0	0	0	0	0	113.3
317	I	27.9	Very low	30.3	Very low	153 Å²	153	139.8 Å²	139.8	79%	0.785	78%	0.78	S	S	*	*			trans	-109.1	122.6	-169.2	-60.4	169.4	0	0	0	112.1
318	S	30.7	Very low	29.9	Very low	112 Å²	112	139.3 Å²	139.3	78%	0.783	77%	0.774	S	S	*	*			trans	-178.8	103.6	134.5	33.2	0	0	0	0	116.7
319	K	29.8	Very low	29.8	Very low	191 Å²	191	139 Å²	139	83%	0.83	77%	0.774	S	S	*	*			trans	40.8	103.4	131.8	-62.4	-179.3	-179.7	176.7	0	121.5
320	S	25.7	Very low	29.5	Very low	109 Å²	109	140.9 Å²	140.9	76%	0.762	78%	0.777	S	S	*	*				56.3	122.1	125.5	64.8	0	0	0	0	122.5
321	V	28.3	Very low	29.4	Very low	131 Å²	131	144.2 Å²	144.2	79%	0.794	78%	0.783	S	S	*	*				-158.7	135.7	103.5	151.2	0	0	0	0	108.5
322	P	26.1	Very low	29.3	Very low	109 Å²	109	141.6 Å²	141.6	71%	0.708	79%	0.785	S	S	*	*			trans	-85	123.1	174.1	32.3	-32	0	0	0	112.3	N324	P322-N324 PolarHBondContact O-N 3.48Å; P322-N324 VanDerWaalsContact O-N 3.13Å
323	S	27	Very low	29	Very low	121 Å²	121	142.3 Å²	142.3	85%	0.846	79%	0.79	S	S	*	*			trans	-76.4	93.3	-179.3	39.4	0	0	0	0	112.9
324	N	26.6	Very low	29.1	Very low	140 Å²	140	146.5 Å²	146.5	75%	0.749	79%	0.791	S	S	*	*			trans	-121.4	85.4	174.7	-95	-51.7	0	0	0	112.2	P322	P322-N324 PolarHBondContact O-N 3.48Å; P322-N324 VanDerWaalsContact O-N 3.13Å
325	F	28.4	Very low	29.2	Very low	204 Å²	204	148.5 Å²	148.5	90%	0.895	78%	0.783	S	S	*	*			trans	-138.7	111.1	159.9	-115.7	-88.1	0	0	0	109.4	H327	F325-H327 PolarHBondContact O-N 2.85Å
326	R	26.4	Very low	29.3	Very low	221 Å²	221	144 Å²	144	83%	0.834	76%	0.764	S	S	*	*			trans	-79.2	118.7	177.4	-77.4	-176.9	168.9	-173.8	-5.5	110.2	E328	R326-E328 PolarHBondContact O-N 3.05Å
327	H	28.1	Very low	29.1	Very low	173 Å²	173	145.5 Å²	145.5	80%	0.801	75%	0.746	S	S	*	*			trans	-79.3	59.6	171.5	-90.3	-33.8	0	0	0	112.5	F325	F325-H327 PolarHBondContact O-N 2.85Å
328	E	28.2	Very low	29.5	Very low	139 Å²	139	144.3 Å²	144.3	65%	0.65	74%	0.741	S	S	*	*			trans	-131.7	81.4	174.5	-69.5	-163.3	143.2	0	0	111.9	R326	R326-E328 PolarHBondContact O-N 3.05Å
329	D	29.7	Very low	30.3	Very low	143 Å²	143	144.3 Å²	144.3	77%	0.765	73%	0.727	S	S	*	*	S	Bend	trans	-174.5	-12.2	151.8	-111.8	-24.5	0	0	0	113.8	Q331	D329-Q331 PolarHBondContact O-N 2.94Å
330	I	30.8	Very low	30.5	Very low	146 Å²	146	140.5 Å²	140.5	75%	0.749	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	48.6	-174.3	-36.1	-179.8	0	0	0	113
331	Q	30.4	Very low	31.1	Very low	159 Å²	159	140.2 Å²	140.2	74%	0.743	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127	12.7	176.2	-71	-167.9	-8.6	0	0	113.9	D329	D329-Q331 PolarHBondContact O-N 2.94Å
332	S	30.1	Very low	31.7	Very low	109 Å²	109	138.2 Å²	138.2	76%	0.762	69%	0.686	S	S	*	*	S	Bend	trans	-102.7	8.6	-176.6	57.6	0	0	0	0	115.5
333	M	28	Very low	32.5	Very low	177 Å²	177	136.5 Å²	136.5	87%	0.872	67%	0.67	S	S	*	*			trans	-125	99.1	174.4	-66.3	-159.9	-63.3	0	0	111.8
334	R	30.7	Very low	33.2	Very low	222 Å²	222	135.2 Å²	135.2	84%	0.838	65%	0.653	S	S	*	*			trans	-144.9	93.9	168.2	-160.7	170.3	-171.1	162.4	1.6	108.9
335	L	34.3	Very low	33.9	Very low	116 Å²	116	134 Å²	134	61%	0.607	65%	0.645	S	S	*	*			trans	-82.2	142.3	175.7	-74.5	167.6	0	0	0	109.9	L343	L335-L343 HydrophobicContact CD1-CD1 4.16Å
336	P	35.3	Very low	34.6	Very low	73 Å²	73	128 Å²	128	47%	0.474	63%	0.626	S	S	.	*			trans	-63.7	148.3	167.3	-20.2	33.3	0	0	0	111.6	D338 K339	P336-D338 VanDerWaalsContact C-N 3.26Å; P336-D338 PolarHBondContact O-N 3.42Å; P336-K339 PolarHBondContact O-N 3.2Å
337	Y	29.2	Very low	35	Very low	107 Å²	107	120.5 Å²	120.5	42%	0.42	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-52.5	-43.5	-177.7	-123	-74.6	0	0	0	112.3	K339 F340 Y399	Y337-K339 PolarHBondContact O-N 3.3Å; Y337-K339 VanDerWaalsContact O-N 3.13Å; Y337-F340 WeakPolarHBondContact O-CB 3.45Å; Y337-F340 PolarHBondContact O-N 2.95Å; Y337-Y399 HydrophobicContact CD2-CE1 4.3Å; Y337-Y399 AromaticContact CD2-CZ 3.96Å; Y337-Y399 WeakPolarHBondContact CD2-OH 3.4Å; Y337-Y399 HydrophobicContact CE1-CE1 4.46Å; Y337-Y399 HydrophobicContact CE2-CD1 4.38Å; Y337-Y399 AromaticContact CE2-CE1 3.39Å; Y337-Y399 HydrophobicContact CE2-CE1 3.39Å; Y337-Y399 HydrophobicContact CE2-CE2 4.39Å; Y337-Y399 AromaticContact CE2-CZ 3.4Å; Y337-Y399 VanDerWaalsContact CE2-CZ 3.4Å; Y337-Y399 WeakPolarHBondContact CE2-OH 3.45Å; Y337-Y399 AromaticContact CZ-CE1 3.5Å; Y337-Y399 VanDerWaalsContact CZ-CE1 3.5Å; Y337-Y399 WeakPolarHBondContact OH-CE1 3.15Å
338	D	36.3	Very low	35.2	Very low	129 Å²	129	115.6 Å²	115.6	69%	0.69	60%	0.596	S	S	*	*	H	α-helix	trans	-55.3	-35	-175.3	-24.2	-45.1	0	0	0	112.8	P336 F340	P336-D338 VanDerWaalsContact C-N 3.26Å; P336-D338 PolarHBondContact O-N 3.42Å; D338-F340 VanDerWaalsContact C-N 3.29Å; D338-F340 PolarHBondContact O-N 3.45Å
339	K	46.5	Very low	35.8	Very low	112 Å²	112	114.5 Å²	114.5	49%	0.487	60%	0.604	S	S	.	*	H	α-helix	trans	-76.3	-12.7	178.7	-74.1	-164.2	169	-164.2	0	114.2	P336 Y337 L343	P336-K339 PolarHBondContact O-N 3.2Å; Y337-K339 PolarHBondContact O-N 3.3Å; Y337-K339 VanDerWaalsContact O-N 3.13Å; K339-L343 WeakPolarHBondContact O-CB 3.47Å; K339-L343 WeakPolarHBondContact O-CD1 3.3Å; K339-L343 WeakPolarHBondContact O-CG 3.39Å; K339-L343 PolarHBondContact O-N 3.03Å
340	F	34.6	Very low	36	Very low	111 Å²	111	109.3 Å²	109.3	49%	0.487	58%	0.584	S	S	.	*	H	α-helix	trans	-72.2	-37.5	179.7	-170.9	-107.4	0	0	0	111.6	Y337 D338 L343 L344	Y337-F340 WeakPolarHBondContact O-CB 3.45Å; Y337-F340 PolarHBondContact O-N 2.95Å; D338-F340 VanDerWaalsContact C-N 3.29Å; D338-F340 PolarHBondContact O-N 3.45Å; F340-L343 PolarHBondContact O-N 3.04Å; F340-L344 HydrophobicContact CD1-CD1 3.92Å; F340-L344 HydrophobicContact CE1-CD1 3.51Å; F340-L344 HydrophobicContact CE2-CD1 4.21Å; F340-L344 HydrophobicContact CG-CD1 4.44Å; F340-L344 HydrophobicContact CZ-CD1 3.67Å; F340-L344 PolarHBondContact O-N 2.88Å
341	N	37.7	Very low	36.2	Very low	102 Å²	102	108 Å²	108	55%	0.545	60%	0.596	S	S	.	*	H	α-helix	trans	-69.7	-42.3	177.4	-70.5	-15.5	0	0	0	111.8	L343 L344 I345	N341-L343 VanDerWaalsContact C-N 3.25Å; N341-L343 PolarHBondContact O-N 3.19Å; N341-L344 PolarHBondContact O-N 3.39Å; N341-I345 WeakPolarHBondContact O-CG1 3.4Å; N341-I345 PolarHBondContact O-N 3.18Å
342	D	42.4	Very low	36.7	Very low	90 Å²	90	104.1 Å²	104.1	48%	0.481	59%	0.585	S	S	.	*	H	α-helix	trans	-56.7	-39.8	171.1	-78.8	-22.1	0	0	0	112	T346	D342-T346 VanDerWaalsContact O-CB 3.23Å; D342-T346 WeakPolarHBondContact O-CB 3.34Å; D342-T346 PolarHBondContact O-N 3.3Å; D342-T346 PolarHBondContact O-OG1 3.04Å
343	L	42.2	Very low	37	Very low	73 Å²	73	105 Å²	105	38%	0.382	58%	0.577	S	S	.	*	H	α-helix	trans	-69.1	-40.2	176	-79.3	166.2	0	0	0	112.4	L335 K339 F340 N341 T346 A347	L335-L343 HydrophobicContact CD1-CD1 4.16Å; K339-L343 WeakPolarHBondContact O-CB 3.47Å; K339-L343 WeakPolarHBondContact O-CD1 3.3Å; K339-L343 WeakPolarHBondContact O-CG 3.39Å; K339-L343 PolarHBondContact O-N 3.03Å; F340-L343 PolarHBondContact O-N 3.04Å; N341-L343 VanDerWaalsContact C-N 3.25Å; N341-L343 PolarHBondContact O-N 3.19Å; L343-T346 PolarHBondContact O-N 3.49Å; L343-A347 WeakPolarHBondContact O-CB 3.46Å; L343-A347 PolarHBondContact O-N 3.04Å
344	L	40.5	Very low	37.9	Very low	94 Å²	94	102 Å²	102	49%	0.492	57%	0.569	S	S	.	*	H	α-helix	trans	-61.4	-47.5	173.8	-110.3	78.4	0	0	0	111.8	F340 N341 A347 S348	F340-L344 HydrophobicContact CD1-CD1 3.92Å; F340-L344 HydrophobicContact CE1-CD1 3.51Å; F340-L344 HydrophobicContact CE2-CD1 4.21Å; F340-L344 HydrophobicContact CG-CD1 4.44Å; F340-L344 HydrophobicContact CZ-CD1 3.67Å; F340-L344 PolarHBondContact O-N 2.88Å; N341-L344 PolarHBondContact O-N 3.39Å; L344-A347 PolarHBondContact O-N 3.04Å; L344-S348 PolarHBondContact O-N 2.75Å; L344-S348 VanDerWaalsContact O-N 3.13Å
345	I	42	Very low	38.5	Very low	113 Å²	113	95 Å²	95	58%	0.579	55%	0.554	S	S	*	*	H	α-helix	trans	-66.2	-41.4	-179.6	-65.7	166.8	0	0	0	110.1	N341 A347 S348	N341-I345 WeakPolarHBondContact O-CG1 3.4Å; N341-I345 PolarHBondContact O-N 3.18Å; I345-A347 VanDerWaalsContact C-N 3.32Å; I345-A347 PolarHBondContact O-N 3.45Å; I345-S348 WeakPolarHBondContact O-CB 3.49Å; I345-S348 PolarHBondContact O-N 3.35Å; I345-S348 PolarHBondContact O-OG 2.9Å
346	T	44.1	Very low	38.8	Very low	80 Å²	80	98 Å²	98	49%	0.491	56%	0.558	S	S	.	*	H	α-helix	trans	-69.7	-28	176.7	-54.4	0	0	0	0	112.6	D342 L343 S348	D342-T346 VanDerWaalsContact O-CB 3.23Å; D342-T346 WeakPolarHBondContact O-CB 3.34Å; D342-T346 PolarHBondContact O-N 3.3Å; D342-T346 PolarHBondContact O-OG1 3.04Å; L343-T346 PolarHBondContact O-N 3.49Å; T346-S348 VanDerWaalsContact C-N 3.33Å
347	A	34.3	Very low	39.2	Very low	62 Å²	62	96.4 Å²	96.4	51%	0.512	55%	0.551	S	S	.	*	G	3₁₀ helix	trans	-80.5	-7.6	173.2	0	0	0	0	0	114.1	L343 L344 I345 S349	L343-A347 WeakPolarHBondContact O-CB 3.46Å; L343-A347 PolarHBondContact O-N 3.04Å; L344-A347 PolarHBondContact O-N 3.04Å; I345-A347 VanDerWaalsContact C-N 3.32Å; I345-A347 PolarHBondContact O-N 3.45Å; A347-S349 VanDerWaalsContact C-N 3.31Å; A347-S349 PolarHBondContact O-N 3.49Å
348	S	32.2	Very low	40.1	Very low	70 Å²	70	97.8 Å²	97.8	49%	0.49	56%	0.562	S	S	.	*	G	3₁₀ helix	trans	-71.5	-20	-176.7	71.7	0	0	0	0	114.4	L344 I345 T346 G350	L344-S348 PolarHBondContact O-N 2.75Å; L344-S348 VanDerWaalsContact O-N 3.13Å; I345-S348 WeakPolarHBondContact O-CB 3.49Å; I345-S348 PolarHBondContact O-N 3.35Å; I345-S348 PolarHBondContact O-OG 2.9Å; T346-S348 VanDerWaalsContact C-N 3.33Å; S348-G350 PolarHBondContact O-N 3.41Å; S348-G350 VanDerWaalsContact O-N 3.1Å
349	S	40.1	Very low	40.6	Very low	116 Å²	116	93.9 Å²	93.9	81%	0.811	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-83.3	27	-175.8	72	0	0	0	0	114.5	A347	A347-S349 VanDerWaalsContact C-N 3.31Å; A347-S349 PolarHBondContact O-N 3.49Å
350	G	34.5	Very low	41.1	Very low	34 Å²	34	95.8 Å²	95.8	35%	0.351	55%	0.551	S	S	.	*	S	Bend	trans	-149.6	134.5	-174.8	0	0	0	0	0	113.5	S348 S352	S348-G350 PolarHBondContact O-N 3.41Å; S348-G350 VanDerWaalsContact O-N 3.1Å; G350-S352 PolarHBondContact O-N 3.05Å
351	A	34.9	Very low	41.9	Very low	120 Å²	120	97.8 Å²	97.8	99%	0.992	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	48.8	-171.9	0	0	0	0	0	114.5
352	S	41.6	Very low	42.8	Very low	76 Å²	76	96.4 Å²	96.4	53%	0.531	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-132.7	5	-173.9	60.6	0	0	0	0	115.6	G350 T354 S355	G350-S352 PolarHBondContact O-N 3.05Å; S352-T354 PolarHBondContact O-N 2.98Å; S352-S355 PolarHBondContact O-N 2.91Å
353	Q	35.7	Very low	43	Very low	127 Å²	127	94.7 Å²	94.7	59%	0.593	55%	0.553	S	S	*	*	H	α-helix	trans	-54.6	-45.2	-171.6	-72	-174.1	-23.1	0	0	114.2	S355 W356 A357	Q353-S355 VanDerWaalsContact C-N 3.35Å; Q353-S355 PolarHBondContact O-N 3.38Å; Q353-W356 PolarHBondContact O-N 2.67Å; Q353-A357 PolarHBondContact O-N 3.21Å
354	T	47	Very low	43.3	Very low	114 Å²	114	93.1 Å²	93.1	70%	0.699	55%	0.551	S	S	*	*	H	α-helix	trans	-61.4	-39.7	-179	46.8	0	0	0	0	112.9	S352 W356 Q358	S352-T354 PolarHBondContact O-N 2.98Å; T354-W356 PolarHBondContact O-N 2.9Å; T354-Q358 VanDerWaalsContact O-CB 3.26Å; T354-Q358 WeakPolarHBondContact O-CB 3.4Å; T354-Q358 PolarHBondContact O-N 2.87Å; T354-Q358 VanDerWaalsContact O-N 3.16Å
355	S	42.8	Very low	44	Very low	75 Å²	75	91 Å²	91	52%	0.524	55%	0.547	S	S	.	.	H	α-helix	trans	-70.7	-28.5	-174.4	-173.9	0	0	0	0	113.9	S352 Q353 A359	S352-S355 PolarHBondContact O-N 2.91Å; Q353-S355 VanDerWaalsContact C-N 3.35Å; Q353-S355 PolarHBondContact O-N 3.38Å; S355-A359 VanDerWaalsContact O-CB 3.3Å; S355-A359 WeakPolarHBondContact O-CB 3.5Å; S355-A359 PolarHBondContact O-N 3.37Å
356	W	41.3	Very low	44.2	Very low	179 Å²	179	87.2 Å²	87.2	68%	0.678	53%	0.533	S	S	*	.	H	α-helix	trans	-85.8	-44.5	-178.2	-173	76.8	0	0	0	112	Q353 T354 Q358 A359 W360	Q353-W356 PolarHBondContact O-N 2.67Å; T354-W356 PolarHBondContact O-N 2.9Å; W356-Q358 PolarHBondContact O-N 3.2Å; W356-A359 PolarHBondContact O-N 2.82Å; W356-W360 PolarHBondContact O-N 3.39Å
357	A	42.4	Very low	44.3	Very low	41 Å²	41	86.8 Å²	86.8	34%	0.339	53%	0.533	S	S	.	.	H	α-helix	trans	-59.1	-47	174.8	0	0	0	0	0	111.2	Q353 A359 W360 Y361	Q353-A357 PolarHBondContact O-N 3.21Å; A357-A359 PolarHBondContact O-N 2.95Å; A357-W360 PolarHBondContact O-N 3.48Å; A357-Y361 WeakPolarHBondContact O-CD2 3.34Å; A357-Y361 PolarHBondContact O-N 3.35Å
358	Q	48.2	Very low	44.7	Very low	136 Å²	136	86.6 Å²	86.6	64%	0.636	53%	0.531	S	S	*	.	H	α-helix	trans	-65.8	-37	179.9	-165.8	167.3	3.4	0	0	112.4	T354 W356 Y361 S362	T354-Q358 VanDerWaalsContact O-CB 3.26Å; T354-Q358 WeakPolarHBondContact O-CB 3.4Å; T354-Q358 PolarHBondContact O-N 2.87Å; T354-Q358 VanDerWaalsContact O-N 3.16Å; W356-Q358 PolarHBondContact O-N 3.2Å; Q358-Y361 PolarHBondContact O-N 3.16Å; Q358-S362 WeakPolarHBondContact O-CB 3.48Å; Q358-S362 PolarHBondContact O-N 3.3Å; Q358-S362 PolarHBondContact O-OG 3Å
359	A	48.1	Very low	45.3	Very low	47 Å²	47	88.4 Å²	88.4	39%	0.388	54%	0.535	S	S	.	.	H	α-helix	trans	-65.1	-37.9	173	0	0	0	0	0	112.7	S355 W356 A357 A363	S355-A359 VanDerWaalsContact O-CB 3.3Å; S355-A359 WeakPolarHBondContact O-CB 3.5Å; S355-A359 PolarHBondContact O-N 3.37Å; W356-A359 PolarHBondContact O-N 2.82Å; A357-A359 PolarHBondContact O-N 2.95Å; A359-A363 WeakPolarHBondContact O-CB 3.42Å; A359-A363 PolarHBondContact O-N 3.04Å
360	W	55.5	Low	45.6	Very low	152 Å²	152	86.4 Å²	86.4	58%	0.576	52%	0.521	S	S	*	.	H	α-helix	trans	-67.4	-45	175.4	-174.9	79.2	0	0	0	111.9	W356 A357 A363 A364	W356-W360 PolarHBondContact O-N 3.39Å; A357-W360 PolarHBondContact O-N 3.48Å; W360-A363 PolarHBondContact O-N 2.91Å; W360-A364 WeakPolarHBondContact O-CB 3.42Å; W360-A364 PolarHBondContact O-N 3Å
361	Y	52.4	Low	46.2	Very low	153 Å²	153	88.8 Å²	88.8	60%	0.6	53%	0.529	S	S	*	.	H	α-helix	trans	-61.4	-43.2	174.4	-78.6	-63.8	0	0	0	112.5	A357 Q358 A364 A365	A357-Y361 WeakPolarHBondContact O-CD2 3.34Å; A357-Y361 PolarHBondContact O-N 3.35Å; Q358-Y361 PolarHBondContact O-N 3.16Å; Y361-A364 PolarHBondContact O-N 3.45Å; Y361-A365 WeakPolarHBondContact O-CB 3.47Å; Y361-A365 PolarHBondContact O-N 2.77Å
362	S	55.5	Low	46.6	Very low	73 Å²	73	89.6 Å²	89.6	51%	0.51	51%	0.507	S	S	.	.	H	α-helix	trans	-64.2	-38.6	174.9	-66.6	0	0	0	0	112.7	Q358 A366	Q358-S362 WeakPolarHBondContact O-CB 3.48Å; Q358-S362 PolarHBondContact O-N 3.3Å; Q358-S362 PolarHBondContact O-OG 3Å; S362-A366 VanDerWaalsContact O-CB 3.29Å; S362-A366 WeakPolarHBondContact O-CB 3.12Å; S362-A366 PolarHBondContact O-N 2.77Å
363	A	47.2	Very low	46.7	Very low	54 Å²	54	89.1 Å²	89.1	45%	0.446	50%	0.504	S	S	.	.	H	α-helix	trans	-66.7	-42.6	175.3	0	0	0	0	0	112.1	A359 W360 A366 S367	A359-A363 WeakPolarHBondContact O-CB 3.42Å; A359-A363 PolarHBondContact O-N 3.04Å; W360-A363 PolarHBondContact O-N 2.91Å; A363-A366 PolarHBondContact O-N 3.06Å; A363-S367 PolarHBondContact O-N 2.88Å; A363-S367 PolarHBondContact O-OG 3.03Å
364	A	49.1	Very low	47.1	Very low	39 Å²	39	87 Å²	87	32%	0.322	50%	0.503	S	S	.	.	H	α-helix	trans	-61.4	-48.7	175.2	0	0	0	0	0	111.3	W360 Y361 A366 S367 A368	W360-A364 WeakPolarHBondContact O-CB 3.42Å; W360-A364 PolarHBondContact O-N 3Å; Y361-A364 PolarHBondContact O-N 3.45Å; A364-A366 PolarHBondContact O-N 3.16Å; A364-S367 PolarHBondContact O-N 2.99Å; A364-S367 PolarHBondContact O-OG 2.65Å; A364-A368 PolarHBondContact O-N 2.7Å
365	A	54.7	Low	46.7	Very low	50 Å²	50	85.4 Å²	85.4	41%	0.413	49%	0.49	S	S	.	.	H	α-helix	trans	-61.2	-40.7	176.1	0	0	0	0	0	112.7	Y361 S367 A368 N369	Y361-A365 WeakPolarHBondContact O-CB 3.47Å; Y361-A365 PolarHBondContact O-N 2.77Å; A365-S367 PolarHBondContact O-N 3.39Å; A365-A368 PolarHBondContact O-N 3.48Å; A365-N369 WeakPolarHBondContact O-CB 3.37Å; A365-N369 PolarHBondContact O-N 2.91Å
366	A	45.6	Very low	46.5	Very low	34 Å²	34	89.8 Å²	89.8	28%	0.281	50%	0.496	S	S	.	.	H	α-helix	trans	-63	-40	174.6	0	0	0	0	0	112.2	S362 A363 A364 S370	S362-A366 VanDerWaalsContact O-CB 3.29Å; S362-A366 WeakPolarHBondContact O-CB 3.12Å; S362-A366 PolarHBondContact O-N 2.77Å; A363-A366 PolarHBondContact O-N 3.06Å; A364-A366 PolarHBondContact O-N 3.16Å; A366-S370 WeakPolarHBondContact O-CB 3.45Å; A366-S370 PolarHBondContact O-N 3.35Å
367	S	46.6	Very low	46.4	Very low	71 Å²	71	87.4 Å²	87.4	50%	0.497	50%	0.497	S	S	.	.	H	α-helix	trans	-68.4	-38.1	174.8	65.6	0	0	0	0	112.9	A363 A364 A365 S370 V371	A363-S367 PolarHBondContact O-N 2.88Å; A363-S367 PolarHBondContact O-OG 3.03Å; A364-S367 PolarHBondContact O-N 2.99Å; A364-S367 PolarHBondContact O-OG 2.65Å; A365-S367 PolarHBondContact O-N 3.39Å; S367-S370 PolarHBondContact O-N 3.13Å; S367-V371 WeakPolarHBondContact O-CG2 3.18Å; S367-V371 PolarHBondContact O-N 3.07Å; S367-V371 VanDerWaalsContact O-N 3.09Å
368	A	42.6	Very low	46.1	Very low	57 Å²	57	87.1 Å²	87.1	47%	0.471	49%	0.492	S	S	.	.	H	α-helix	trans	-62.9	-47.1	173.9	0	0	0	0	0	111.4	A364 A365 S370 V371 Y372	A364-A368 PolarHBondContact O-N 2.7Å; A365-A368 PolarHBondContact O-N 3.48Å; A368-S370 VanDerWaalsContact C-N 3.34Å; A368-S370 PolarHBondContact O-N 3.23Å; A368-V371 PolarHBondContact O-N 3.48Å; A368-Y372 WeakPolarHBondContact O-CB 3.36Å; A368-Y372 PolarHBondContact O-N 3.32Å
369	N	45.9	Very low	45.4	Very low	109 Å²	109	86.8 Å²	86.8	58%	0.583	51%	0.505	S	S	*	.	H	α-helix	trans	-62.3	-38.7	175.6	-74.7	-0.7	0	0	0	112.2	A365 V371 Y372 S373	A365-N369 WeakPolarHBondContact O-CB 3.37Å; A365-N369 PolarHBondContact O-N 2.91Å; N369-V371 VanDerWaalsContact C-N 3.33Å; N369-V371 PolarHBondContact O-N 3.07Å; N369-Y372 PolarHBondContact O-N 3.23Å; N369-S373 PolarHBondContact O-N 2.95Å; N369-S373 PolarHBondContact O-OG 3.48Å
370	S	45.1	Very low	44.8	Very low	74 Å²	74	88.7 Å²	88.7	52%	0.517	51%	0.508	S	S	.	.	H	α-helix	trans	-63.4	-36.7	176.1	-172.6	0	0	0	0	112.9	A366 S367 A368 S374	A366-S370 WeakPolarHBondContact O-CB 3.45Å; A366-S370 PolarHBondContact O-N 3.35Å; S367-S370 PolarHBondContact O-N 3.13Å; A368-S370 VanDerWaalsContact C-N 3.34Å; A368-S370 PolarHBondContact O-N 3.23Å; S370-S374 WeakPolarHBondContact O-CB 3.42Å; S370-S374 PolarHBondContact O-N 2.95Å; S370-S374 PolarHBondContact O-OG 2.87Å
371	V	48.7	Very low	43.9	Very low	84 Å²	84	85.9 Å²	85.9	51%	0.509	51%	0.512	S	S	.	.	H	α-helix	trans	-69.8	-43.9	172	172.6	0	0	0	0	110.1	S367 A368 N369 S373 S374 L375	S367-V371 WeakPolarHBondContact O-CG2 3.18Å; S367-V371 PolarHBondContact O-N 3.07Å; S367-V371 VanDerWaalsContact O-N 3.09Å; A368-V371 PolarHBondContact O-N 3.48Å; N369-V371 VanDerWaalsContact C-N 3.33Å; N369-V371 PolarHBondContact O-N 3.07Å; V371-S373 PolarHBondContact O-N 3.33Å; V371-S374 WeakPolarHBondContact O-CB 3.29Å; V371-S374 PolarHBondContact O-N 3.4Å; V371-S374 VanDerWaalsContact O-N 3.12Å; V371-L375 HydrophobicContact CG1-CD1 3.96Å; V371-L375 HydrophobicContact CG1-CG 4.49Å; V371-L375 WeakPolarHBondContact O-CG 3.41Å; V371-L375 PolarHBondContact O-N 3.49Å
372	Y	41.8	Very low	43.3	Very low	136 Å²	136	82.4 Å²	82.4	53%	0.533	51%	0.51	S	S	.	.	H	α-helix	trans	-59.8	-46.9	178.8	-157.3	-93.3	0	0	0	112.5	A368 N369 S374 L375 Y376	A368-Y372 WeakPolarHBondContact O-CB 3.36Å; A368-Y372 PolarHBondContact O-N 3.32Å; N369-Y372 PolarHBondContact O-N 3.23Å; Y372-S374 PolarHBondContact O-N 2.91Å; Y372-L375 PolarHBondContact O-N 3.47Å; Y372-L375 VanDerWaalsContact O-N 3.14Å; Y372-Y376 HydrophobicContact CE1-CD2 4.15Å; Y372-Y376 WeakPolarHBondContact O-CB 3.44Å; Y372-Y376 PolarHBondContact O-N 3.14Å
373	S	45.6	Very low	42.7	Very low	67 Å²	67	84.1 Å²	84.1	47%	0.469	51%	0.51	S	S	.	.	H	α-helix	trans	-62.8	-30.6	175.3	-62.1	0	0	0	0	113	N369 V371 N377	N369-S373 PolarHBondContact O-N 2.95Å; N369-S373 PolarHBondContact O-OG 3.48Å; V371-S373 PolarHBondContact O-N 3.33Å; S373-N377 PolarHBondContact O-N 3.47Å; S373-N377 PolarHBondContact O-ND2 3.32Å
374	S	43.8	Very low	42.2	Very low	82 Å²	82	87.4 Å²	87.4	57%	0.573	51%	0.511	S	S	*	.	H	α-helix	trans	-73.8	-32.5	176	-58.2	0	0	0	0	111.9	S370 V371 Y372	S370-S374 WeakPolarHBondContact O-CB 3.42Å; S370-S374 PolarHBondContact O-N 2.95Å; S370-S374 PolarHBondContact O-OG 2.87Å; V371-S374 WeakPolarHBondContact O-CB 3.29Å; V371-S374 PolarHBondContact O-N 3.4Å; V371-S374 VanDerWaalsContact O-N 3.12Å; Y372-S374 PolarHBondContact O-N 2.91Å
375	L	37.1	Very low	41.7	Very low	80 Å²	80	90.6 Å²	90.6	42%	0.419	52%	0.523	S	S	.	.	H	α-helix	trans	-76.8	-33.5	173.3	-68.2	168.1	0	0	0	112.7	V371 Y372 R384	V371-L375 HydrophobicContact CG1-CD1 3.96Å; V371-L375 HydrophobicContact CG1-CG 4.49Å; V371-L375 WeakPolarHBondContact O-CG 3.41Å; V371-L375 PolarHBondContact O-N 3.49Å; Y372-L375 PolarHBondContact O-N 3.47Å; Y372-L375 VanDerWaalsContact O-N 3.14Å; L375-R384 PolarHBondContact O-NH2 3.4Å
376	Y	39.4	Very low	40.8	Very low	167 Å²	167	94.2 Å²	94.2	66%	0.655	53%	0.531	S	S	*	.	H	α-helix	trans	-69.1	-41.1	179.9	-149.2	-95.7	0	0	0	112	Y372 S378 R384	Y372-Y376 HydrophobicContact CE1-CD2 4.15Å; Y372-Y376 WeakPolarHBondContact O-CB 3.44Å; Y372-Y376 PolarHBondContact O-N 3.14Å; Y376-S378 PolarHBondContact O-N 3.01Å; Y376-R384 PolarHBondContact O-NH2 3.47Å
377	N	39.3	Very low	40.2	Very low	130 Å²	130	98.2 Å²	98.2	70%	0.695	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	0.2	-176.5	-71.5	-23.3	0	0	0	115.2	S373 S379	S373-N377 PolarHBondContact O-N 3.47Å; S373-N377 PolarHBondContact O-ND2 3.32Å; N377-S379 PolarHBondContact O-N 3.03Å
378	S	35.9	Very low	39.8	Very low	34 Å²	34	101.4 Å²	101.4	24%	0.238	55%	0.553	C	S	.	*			trans	-85.9	112.1	174.9	-174.5	0	0	0	0	111.8	Y376 N380 R384	Y376-S378 PolarHBondContact O-N 3.01Å; S378-N380 PolarHBondContact O-N 3.02Å; S378-R384 PolarHBondContact O-NH2 2.89Å
379	S	33.8	Very low	39.3	Very low	130 Å²	130	106.7 Å²	106.7	91%	0.909	57%	0.568	S	S	*	*			trans	-79.6	6.8	179.9	-44.4	0	0	0	0	114.6	N377	N377-S379 PolarHBondContact O-N 3.03Å
380	N	34.9	Very low	38.6	Very low	86 Å²	86	107.1 Å²	107.1	46%	0.46	57%	0.566	S	S	.	*			trans	-112.1	107.4	-166.5	-157.3	-11.2	0	0	0	112.3	S378 S382 Q383	S378-N380 PolarHBondContact O-N 3.02Å; N380-S382 VanDerWaalsContact C-N 3.3Å; N380-S382 PolarHBondContact O-N 3.17Å; N380-Q383 PolarHBondContact O-N 3.22Å
381	S	37.7	Very low	38	Very low	93 Å²	93	113.6 Å²	113.6	65%	0.65	59%	0.585	S	S	*	*	H	α-helix	trans	-64.1	-28.7	-171.5	53.1	0	0	0	0	114.3	R384	S381-R384 PolarHBondContact O-N 2.9Å
382	S	39.7	Very low	37.1	Very low	81 Å²	81	116.9 Å²	116.9	57%	0.566	60%	0.595	S	S	*	*	H	α-helix	trans	-64.9	-42.9	-179.2	-150.6	0	0	0	0	112.1	N380 R384 N385 E386	N380-S382 VanDerWaalsContact C-N 3.3Å; N380-S382 PolarHBondContact O-N 3.17Å; S382-R384 VanDerWaalsContact C-N 3.31Å; S382-R384 PolarHBondContact O-N 3.32Å; S382-N385 PolarHBondContact O-N 3.5Å; S382-E386 PolarHBondContact O-N 3.06Å
383	Q	41.7	Very low	36.6	Very low	108 Å²	108	116.8 Å²	116.8	51%	0.505	60%	0.598	S	S	.	*	H	α-helix	trans	-69	-26.4	-177.7	-71	-178.8	-34	0	0	113.2	N380 F387	N380-Q383 PolarHBondContact O-N 3.22Å; Q383-F387 WeakPolarHBondContact O-CB 3.37Å; Q383-F387 PolarHBondContact O-N 3.45Å
384	R	37.1	Very low	36	Very low	124 Å²	124	117 Å²	117	47%	0.468	60%	0.599	S	S	.	*	H	α-helix	trans	-67	-35.7	175.7	-76.1	-174.5	172.4	152.1	2.5	112.4	L375 Y376 S378 S381 S382 L388	L375-R384 PolarHBondContact O-NH2 3.4Å; Y376-R384 PolarHBondContact O-NH2 3.47Å; S378-R384 PolarHBondContact O-NH2 2.89Å; S381-R384 PolarHBondContact O-N 2.9Å; S382-R384 VanDerWaalsContact C-N 3.31Å; S382-R384 PolarHBondContact O-N 3.32Å; R384-L388 WeakPolarHBondContact O-CD1 3.34Å; R384-L388 WeakPolarHBondContact O-CG 3.48Å
385	N	37.9	Very low	35.3	Very low	105 Å²	105	117.2 Å²	117.2	56%	0.561	60%	0.599	S	S	*	*	H	α-helix	trans	-82.1	-33.8	179.6	-68.9	-17	0	0	0	112.4	S382 L388 Q389	S382-N385 PolarHBondContact O-N 3.5Å; N385-L388 PolarHBondContact O-N 3.48Å; N385-Q389 PolarHBondContact O-N 2.85Å
386	E	36.7	Very low	35	Very low	126 Å²	126	117.4 Å²	117.4	59%	0.589	61%	0.606	S	S	*	*	H	α-helix	trans	-64.7	-43	177.6	-161.4	164.5	-138.9	0	0	111.5	S382 L388 Q389 E390	S382-E386 PolarHBondContact O-N 3.06Å; E386-L388 PolarHBondContact O-N 3.46Å; E386-Q389 PolarHBondContact O-N 3.26Å; E386-Q389 VanDerWaalsContact O-N 3.11Å; E386-E390 PolarHBondContact O-N 3.37Å
387	F	33	Very low	34.7	Very low	119 Å²	119	112.8 Å²	112.8	52%	0.522	59%	0.593	S	S	.	*	H	α-helix	trans	-66.2	-15.8	174.3	-163.6	-95.9	0	0	0	114.1	Q383 F393	Q383-F387 WeakPolarHBondContact O-CB 3.37Å; Q383-F387 PolarHBondContact O-N 3.45Å; F387-F393 HydrophobicContact CE1-CE1 4.24Å; F387-F393 HydrophobicContact CE1-CZ 4.11Å
388	L	37.4	Very low	34.4	Very low	138 Å²	138	112 Å²	112	72%	0.723	59%	0.588	S	S	*	*	H	α-helix	trans	-93.7	-10.1	174.8	-70.8	171.5	0	0	0	113.4	R384 N385 E386	R384-L388 WeakPolarHBondContact O-CD1 3.34Å; R384-L388 WeakPolarHBondContact O-CG 3.48Å; N385-L388 PolarHBondContact O-N 3.48Å; E386-L388 PolarHBondContact O-N 3.46Å
389	Q	33	Very low	34.2	Very low	168 Å²	168	115.9 Å²	115.9	79%	0.785	60%	0.599	S	S	*	*	H	α-helix	trans	-103.7	-29.5	177.4	-68.5	-171	6.4	0	0	113.4	N385 E386	N385-Q389 PolarHBondContact O-N 2.85Å; E386-Q389 PolarHBondContact O-N 3.26Å; E386-Q389 VanDerWaalsContact O-N 3.11Å
390	E	30.4	Very low	34.2	Very low	117 Å²	117	113.5 Å²	113.5	55%	0.547	58%	0.575	S	S	.	*	S	Bend	trans	-78.7	122.7	174.5	-73.2	-137.2	138.8	0	0	113	E386 Q392	E386-E390 PolarHBondContact O-N 3.37Å; E390-Q392 HydrophobicContact CB-CG 4.38Å; E390-Q392 PolarHBondContact O-N 2.93Å; E390-Q392 PolarHBondContact OE2-NE2 3.1Å
391	K	32.4	Very low	34	Very low	210 Å²	210	113.5 Å²	113.5	91%	0.913	58%	0.575	S	S	*	*			trans	-76.2	49.6	178.2	-64.8	-174.4	176.3	-176.9	0	113.5
392	Q	31.3	Very low	33.9	Very low	154 Å²	154	116.7 Å²	116.7	72%	0.72	58%	0.58	S	S	*	*			trans	-105.3	40.9	-174.8	-65.2	-149	70.2	0	0	114.6	E390	E390-Q392 HydrophobicContact CB-CG 4.38Å; E390-Q392 PolarHBondContact O-N 2.93Å; E390-Q392 PolarHBondContact OE2-NE2 3.1Å
393	F	29.4	Very low	33.4	Very low	134 Å²	134	115.8 Å²	115.8	59%	0.588	57%	0.572	S	S	*	*			trans	-78.1	137.3	168.1	-75.1	-71.8	0	0	0	111.9	F387 L397	F387-F393 HydrophobicContact CE1-CE1 4.24Å; F387-F393 HydrophobicContact CE1-CZ 4.11Å; F393-L397 HydrophobicContact CD1-CD1 3.76Å; F393-L397 HydrophobicContact CE1-CD1 4.44Å
394	S	33.1	Very low	32.9	Very low	71 Å²	71	114.5 Å²	114.5	50%	0.497	59%	0.588	S	S	.	*			trans	-64.3	150.1	-178.1	-75.2	0	0	0	0	112.5	S396 L397	S394-S396 WeakPolarHBondContact CB-OG 3.3Å; S394-S396 PolarHBondContact O-N 3.37Å; S394-L397 PolarHBondContact O-N 3.04Å
395	P	30	Very low	32.6	Very low	87 Å²	87	114.6 Å²	114.6	57%	0.565	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	-14	179.9	-27.4	35.7	0	0	0	116
396	S	31.3	Very low	32.2	Very low	83 Å²	83	116 Å²	116	58%	0.58	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-25	172.5	42.1	0	0	0	0	114.2	S394 Y399	S394-S396 WeakPolarHBondContact CB-OG 3.3Å; S394-S396 PolarHBondContact O-N 3.37Å; S396-Y399 WeakPolarHBondContact O-CB 3.33Å
397	L	32.7	Very low	32.1	Very low	71 Å²	71	111.3 Å²	111.3	37%	0.372	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.8	-36	-179.3	-101.3	150.5	0	0	0	112.8	F393 S394 Y399 L400	F393-L397 HydrophobicContact CD1-CD1 3.76Å; F393-L397 HydrophobicContact CE1-CD1 4.44Å; S394-L397 PolarHBondContact O-N 3.04Å; L397-Y399 PolarHBondContact O-N 3.15Å; L397-L400 PolarHBondContact O-N 3.01Å
398	N	33.5	Very low	32.2	Very low	112 Å²	112	110.3 Å²	110.3	60%	0.599	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-62.7	-21.4	170	-85.4	-7.8	0	0	0	113	L400 N401	N398-L400 PolarHBondContact O-N 3.32Å; N398-N401 PolarHBondContact O-N 3.42Å; N398-N401 VanDerWaalsContact O-N 3.11Å
399	Y	31.5	Very low	32	Very low	117 Å²	117	110 Å²	110	46%	0.459	58%	0.584	S	S	.	*	G	3₁₀ helix	trans	-64	-26.9	176.6	-122.1	-91	0	0	0	113.1	Y337 S396 L397 N401 H402	Y337-Y399 HydrophobicContact CD2-CE1 4.3Å; Y337-Y399 AromaticContact CD2-CZ 3.96Å; Y337-Y399 WeakPolarHBondContact CD2-OH 3.4Å; Y337-Y399 HydrophobicContact CE1-CE1 4.46Å; Y337-Y399 HydrophobicContact CE2-CD1 4.38Å; Y337-Y399 AromaticContact CE2-CE1 3.39Å; Y337-Y399 HydrophobicContact CE2-CE1 3.39Å; Y337-Y399 HydrophobicContact CE2-CE2 4.39Å; Y337-Y399 AromaticContact CE2-CZ 3.4Å; Y337-Y399 VanDerWaalsContact CE2-CZ 3.4Å; Y337-Y399 WeakPolarHBondContact CE2-OH 3.45Å; Y337-Y399 AromaticContact CZ-CE1 3.5Å; Y337-Y399 VanDerWaalsContact CZ-CE1 3.5Å; Y337-Y399 WeakPolarHBondContact OH-CE1 3.15Å; S396-Y399 WeakPolarHBondContact O-CB 3.33Å; L397-Y399 PolarHBondContact O-N 3.15Å; Y399-N401 VanDerWaalsContact C-N 3.29Å; Y399-N401 PolarHBondContact O-N 3.44Å; Y399-H402 PolarHBondContact O-N 2.96Å
400	L	33.1	Very low	32.2	Very low	79 Å²	79	106.8 Å²	106.8	41%	0.414	57%	0.569	S	S	.	*	G	3₁₀ helix	trans	-73.8	-18.5	175	-82.6	138.5	0	0	0	113.2	L397 N398 F408	L397-L400 PolarHBondContact O-N 3.01Å; N398-L400 PolarHBondContact O-N 3.32Å; L400-F408 HydrophobicContact CD2-CE1 4.5Å
401	N	31.9	Very low	32.6	Very low	86 Å²	86	106.6 Å²	106.6	46%	0.46	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-89	0.2	175.8	-72.7	-23.4	0	0	0	113.8	N398 Y399 Y409	N398-N401 PolarHBondContact O-N 3.42Å; N398-N401 VanDerWaalsContact O-N 3.11Å; Y399-N401 VanDerWaalsContact C-N 3.29Å; Y399-N401 PolarHBondContact O-N 3.44Å; N401-Y409 WeakPolarHBondContact OD1-CE2 3.27Å
402	H	34.9	Very low	32.9	Very low	161 Å²	161	100.8 Å²	100.8	75%	0.745	55%	0.55	S	S	*	*	S	Bend	trans	-116.6	-2.6	174.6	-71.7	-21.7	0	0	0	113.7	Y399	Y399-H402 PolarHBondContact O-N 2.96Å
403	C	29.6	Very low	33	Very low	61 Å²	61	98.6 Å²	98.6	41%	0.412	54%	0.54	S	S	.	.	S	Bend	trans	-104.8	97.5	169.2	-68.6	0	0	0	0	108.3	L405	C403-L405 PolarHBondContact O-N 3.37Å
404	G	30.3	Very low	33.6	Very low	81 Å²	81	96.1 Å²	96.1	84%	0.835	53%	0.532	S	S	*	.			trans	-56.3	90.4	-169.2	0	0	0	0	0	115.1
405	L	31.5	Very low	33.8	Very low	127 Å²	127	95.3 Å²	95.3	67%	0.665	53%	0.53	S	S	*	.			trans	-123.4	89.8	177.6	-93.5	164.6	0	0	0	109.8	C403 G407	C403-L405 PolarHBondContact O-N 3.37Å; L405-G407 PolarHBondContact O-N 2.86Å
406	P	29.2	Very low	34.3	Very low	133 Å²	133	94.8 Å²	94.8	86%	0.864	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	127.4	173.1	-21	32.8	0	0	0	110.2
407	G	34.8	Very low	34.5	Very low	29 Å²	29	94.8 Å²	94.8	30%	0.299	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.7	-4	172.9	0	0	0	0	0	117.3	L405 Q410 N411	L405-G407 PolarHBondContact O-N 2.86Å; G407-Q410 PolarHBondContact O-N 3.39Å; G407-N411 WeakPolarHBondContact O-CB 3.48Å; G407-N411 PolarHBondContact O-N 3.08Å; G407-N411 PolarHBondContact O-ND2 3.42Å
408	F	34.4	Very low	34.7	Very low	98 Å²	98	95.4 Å²	95.4	43%	0.43	53%	0.529	S	S	.	.	H	α-helix	trans	-63.7	-48.5	174	-174.5	-102.7	0	0	0	111.8	L400 L412	L400-F408 HydrophobicContact CD2-CE1 4.5Å; F408-L412 HydrophobicContact CD1-CD1 3.99Å; F408-L412 HydrophobicContact CE1-CD1 3.52Å; F408-L412 HydrophobicContact CZ-CD1 3.89Å; F408-L412 PolarHBondContact O-N 2.68Å
409	Y	33	Very low	34.8	Very low	132 Å²	132	94.3 Å²	94.3	52%	0.518	53%	0.526	S	S	.	.	H	α-helix	trans	-66.7	-42.1	173.7	-84.4	-94.8	0	0	0	112.3	N401 N411 L412 E413	N401-Y409 WeakPolarHBondContact OD1-CE2 3.27Å; Y409-N411 VanDerWaalsContact C-N 3.32Å; Y409-N411 PolarHBondContact O-N 2.87Å; Y409-L412 WeakPolarHBondContact O-CB 3.22Å; Y409-L412 PolarHBondContact O-N 3.41Å; Y409-L412 VanDerWaalsContact O-N 3.13Å; Y409-E413 WeakPolarHBondContact O-CB 3.46Å; Y409-E413 PolarHBondContact O-N 3.5Å
410	Q	37.4	Very low	34.8	Very low	100 Å²	100	94.1 Å²	94.1	47%	0.467	53%	0.533	S	S	.	.	H	α-helix	trans	-62.3	-38.6	179.8	-159.4	66.8	65.8	0	0	112.4	G407 E413 N414	G407-Q410 PolarHBondContact O-N 3.39Å; Q410-E413 PolarHBondContact NE2-OE2 3.16Å; Q410-N414 PolarHBondContact NE2-OD1 3.01Å; Q410-N414 WeakPolarHBondContact O-CB 3.41Å; Q410-N414 PolarHBondContact O-N 2.91Å; Q410-N414 PolarHBondContact O-ND2 3.05Å; Q410-N414 PolarHBondContact O-OD1 2.88Å
411	N	39.7	Very low	34.6	Very low	112 Å²	112	97.5 Å²	97.5	60%	0.599	55%	0.552	S	S	*	*	H	α-helix	trans	-72.5	-30.7	176.1	-73.6	-45.3	0	0	0	112.7	G407 Y409 A415	G407-N411 WeakPolarHBondContact O-CB 3.48Å; G407-N411 PolarHBondContact O-N 3.08Å; G407-N411 PolarHBondContact O-ND2 3.42Å; Y409-N411 VanDerWaalsContact C-N 3.32Å; Y409-N411 PolarHBondContact O-N 2.87Å; N411-A415 WeakPolarHBondContact O-CB 3.46Å; N411-A415 PolarHBondContact O-N 3.22Å
412	L	37.5	Very low	34.5	Very low	89 Å²	89	98.3 Å²	98.3	47%	0.466	56%	0.56	S	S	.	*	H	α-helix	trans	-67.9	-46.3	170.8	-89.4	163.9	0	0	0	111.8	F408 Y409 A415 V416	F408-L412 HydrophobicContact CD1-CD1 3.99Å; F408-L412 HydrophobicContact CE1-CD1 3.52Å; F408-L412 HydrophobicContact CZ-CD1 3.89Å; F408-L412 PolarHBondContact O-N 2.68Å; Y409-L412 WeakPolarHBondContact O-CB 3.22Å; Y409-L412 PolarHBondContact O-N 3.41Å; Y409-L412 VanDerWaalsContact O-N 3.13Å; L412-A415 PolarHBondContact O-N 3.15Å; L412-V416 WeakPolarHBondContact O-CG2 3.31Å; L412-V416 PolarHBondContact O-N 3.49Å
413	E	34.8	Very low	34.2	Very low	108 Å²	108	98 Å²	98	51%	0.505	56%	0.564	S	S	.	*	H	α-helix	trans	-65.7	-44.7	178.6	-173	166.1	-133.4	0	0	111.4	Y409 Q410 A415 V416 N417	Y409-E413 WeakPolarHBondContact O-CB 3.46Å; Y409-E413 PolarHBondContact O-N 3.5Å; Q410-E413 PolarHBondContact NE2-OE2 3.16Å; E413-A415 VanDerWaalsContact C-N 3.33Å; E413-A415 PolarHBondContact O-N 3.22Å; E413-V416 PolarHBondContact O-N 3.1Å; E413-N417 WeakPolarHBondContact O-CB 3.48Å; E413-N417 VanDerWaalsContact O-CG 3.23Å; E413-N417 PolarHBondContact O-N 2.98Å; E413-N417 PolarHBondContact O-ND2 2.85Å
414	N	40.8	Very low	34.1	Very low	81 Å²	81	104 Å²	104	43%	0.433	59%	0.591	S	S	.	*	H	α-helix	trans	-63.8	-36.3	173.9	-67.4	0	0	0	0	112	Q410 S418	Q410-N414 PolarHBondContact NE2-OD1 3.01Å; Q410-N414 WeakPolarHBondContact O-CB 3.41Å; Q410-N414 PolarHBondContact O-N 2.91Å; Q410-N414 PolarHBondContact O-ND2 3.05Å; Q410-N414 PolarHBondContact O-OD1 2.88Å; N414-S418 WeakPolarHBondContact O-CB 3.35Å; N414-S418 PolarHBondContact O-N 3.33Å
415	A	38.2	Very low	33.9	Very low	55 Å²	55	103 Å²	103	46%	0.455	58%	0.58	S	S	.	*	H	α-helix	trans	-70.9	-37	175.8	0	0	0	0	0	112.9	N411 L412 E413 V419	N411-A415 WeakPolarHBondContact O-CB 3.46Å; N411-A415 PolarHBondContact O-N 3.22Å; L412-A415 PolarHBondContact O-N 3.15Å; E413-A415 VanDerWaalsContact C-N 3.33Å; E413-A415 PolarHBondContact O-N 3.22Å; A415-V419 WeakPolarHBondContact O-CG2 3.3Å
416	V	39.9	Very low	33.8	Very low	76 Å²	76	106.1 Å²	106.1	46%	0.461	59%	0.594	S	S	.	*	H	α-helix	trans	-68.3	-42.8	174.3	168.4	0	0	0	0	110.7	L412 E413 V419 N420	L412-V416 WeakPolarHBondContact O-CG2 3.31Å; L412-V416 PolarHBondContact O-N 3.49Å; E413-V416 PolarHBondContact O-N 3.1Å; V416-V419 PolarHBondContact O-N 3.25Å; V416-N420 PolarHBondContact O-ND2 2.81Å
417	N	35.5	Very low	33.8	Very low	82 Å²	82	109 Å²	109	44%	0.439	59%	0.593	S	S	.	*	H	α-helix	trans	-70	-38.9	178.5	-67.7	-25	0	0	0	112	E413 V419 N420	E413-N417 WeakPolarHBondContact O-CB 3.48Å; E413-N417 VanDerWaalsContact O-CG 3.23Å; E413-N417 PolarHBondContact O-N 2.98Å; E413-N417 PolarHBondContact O-ND2 2.85Å; N417-V419 PolarHBondContact O-N 2.66Å; N417-N420 PolarHBondContact O-N 3.17Å
418	S	36.8	Very low	33.4	Very low	85 Å²	85	113.3 Å²	113.3	59%	0.594	62%	0.617	S	S	*	*	H	α-helix	trans	-60.8	-14.7	174.5	-179.2	0	0	0	0	114.5	N414	N414-S418 WeakPolarHBondContact O-CB 3.35Å; N414-S418 PolarHBondContact O-N 3.33Å
419	V	35.5	Very low	33.4	Very low	88 Å²	88	115.1 Å²	115.1	53%	0.533	64%	0.639	S	S	.	*	H	α-helix	trans	-97.2	-12.8	177.9	172.3	0	0	0	0	112.1	A415 V416 N417	A415-V419 WeakPolarHBondContact O-CG2 3.3Å; V416-V419 PolarHBondContact O-N 3.25Å; N417-V419 PolarHBondContact O-N 2.66Å
420	N	32.6	Very low	33.2	Very low	114 Å²	114	112.2 Å²	112.2	61%	0.61	65%	0.649	S	S	*	*	H	α-helix	trans	-83.3	-25.1	-179.6	-69.5	-35	0	0	0	113.7	V416 N417 T422	V416-N420 PolarHBondContact O-ND2 2.81Å; N417-N420 PolarHBondContact O-N 3.17Å; N420-T422 VanDerWaalsContact C-N 3.31Å; N420-T422 PolarHBondContact O-N 2.81Å
421	D	28.2	Very low	32.6	Very low	150 Å²	150	115.2 Å²	115.2	80%	0.802	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	5.2	-178.3	-72.7	-40.1	0	0	0	114.8
422	T	30.3	Very low	32.1	Very low	103 Å²	103	115.9 Å²	115.9	63%	0.632	68%	0.676	S	S	*	*	S	Bend	trans	-130.6	47.1	-172.9	49.8	0	0	0	0	115.1	N420	N420-T422 VanDerWaalsContact C-N 3.31Å; N420-T422 PolarHBondContact O-N 2.81Å
423	N	28.4	Very low	31.5	Very low	155 Å²	155	120 Å²	120	83%	0.829	69%	0.693	S	S	*	*			trans	-154.8	39.5	163.1	-109.6	-61.8	0	0	0	116.1	G425	N423-G425 VanDerWaalsContact C-N 3.34Å; N423-G425 PolarHBondContact O-N 3.33Å; N423-G425 VanDerWaalsContact O-N 3.1Å
424	L	27	Very low	31.2	Very low	187 Å²	187	120.9 Å²	120.9	98%	0.979	70%	0.699	S	S	*	*			trans	-84.8	74.8	170.4	-99	170.9	0	0	0	112.5
425	G	26.1	Very low	30.5	Very low	59 Å²	59	123 Å²	123	61%	0.608	71%	0.711	S	S	*	*			trans	83.6	129.2	162.5	0	0	0	0	0	116.8	N423	N423-G425 VanDerWaalsContact C-N 3.34Å; N423-G425 PolarHBondContact O-N 3.33Å; N423-G425 VanDerWaalsContact O-N 3.1Å
426	M	29.4	Very low	30	Very low	193 Å²	193	127.1 Å²	127.1	95%	0.951	73%	0.725	S	S	*	*				-152.7	160	113.3	-105.1	-55.7	153.8	0	0	110.9
427	K	29.7	Very low	29.4	Very low	192 Å²	192	131.9 Å²	131.9	84%	0.835	74%	0.742	S	S	*	*			trans	-128.5	114.2	-168.7	-169.3	176.8	-176.3	179	0	108.7
428	C	26.5	Very low	29.1	Very low	121 Å²	121	134.1 Å²	134.1	82%	0.818	75%	0.754	S	S	*	*			trans	-55.7	147.9	169.3	-54.9	0	0	0	0	109.6
429	P	33.2	Very low	28.6	Very low	136 Å²	136	134.2 Å²	134.2	88%	0.883	75%	0.748	S	S	*	*			cis	-140.6	-171.9	36.5	43.3	-26	0	0	0	115.3
430	G	29.1	Very low	28.3	Very low	70 Å²	70	135.9 Å²	135.9	72%	0.722	75%	0.754	S	S	*	*			trans	134.7	124.4	155.4	0	0	0	0	0	115.2
431	N	25.6	Very low	28.1	Very low	164 Å²	164	139.9 Å²	139.9	88%	0.877	76%	0.76	S	S	*	*			trans	-90.3	-177.5	165.3	-71.2	-6.2	0	0	0	110.4
432	V	29.2	Very low	28	Very low	126 Å²	126	137.3 Å²	137.3	76%	0.764	75%	0.754	S	S	*	*			trans	87.4	92.1	-174.7	-171.3	0	0	0	0	110.9
433	E	25.1	Very low	28	Very low	175 Å²	175	139 Å²	139	82%	0.818	76%	0.758	S	S	*	*				81.7	154.9	53.6	-161.7	178.4	-112.7	0	0	112.7
434	I	28.4	Very low	27.9	Very low	126 Å²	126	136.4 Å²	136.4	65%	0.646	74%	0.744	S	S	*	*			trans	86.3	98.2	173.8	-51.8	-178	0	0	0	116.6
435	N	25.8	Very low	27.9	Very low	126 Å²	126	135.3 Å²	135.3	67%	0.674	73%	0.734	S	S	*	*			trans	54.2	115.3	133.3	-56.8	-9.6	0	0	0	119.4
436	N	27.3	Very low	28.1	Very low	141 Å²	141	137.6 Å²	137.6	75%	0.754	74%	0.74	S	S	*	*				83.8	158	79.9	-68.1	-18.8	0	0	0	113.6
437	E	27.2	Very low	28.3	Very low	176 Å²	176	133.6 Å²	133.6	82%	0.822	73%	0.732	S	S	*	*			trans	71.5	145.3	167.8	-53.9	-161.4	149.1	0	0	116.2
438	L	29.2	Very low	28.8	Very low	129 Å²	129	129.3 Å²	129.3	68%	0.675	72%	0.723	S	S	*	*			cis	-159.1	170.3	-16.4	-116.7	172.7	0	0	0	109.1
439	D	26.9	Very low	28.9	Very low	88 Å²	88	130 Å²	130	47%	0.471	72%	0.719	S	S	.	*			trans	57.2	124.6	153.9	-87.2	2.9	0	0	0	119.7	R441	D439-R441 IonicContact OD2-CZ 3.71Å; D439-R441 IonicContact OD2-NE 3.71Å; D439-R441 IonicContact OD2-NH2 2.85Å; D439-R441 PolarHBondContact OD2-NH2 3.28Å
440	N	29.2	Very low	28.6	Very low	123 Å²	123	128.6 Å²	128.6	66%	0.658	71%	0.711	S	S	*	*				56.3	103.4	64.5	-57.8	-53.7	0	0	0	113.9
441	R	27.6	Very low	28.4	Very low	197 Å²	197	129.6 Å²	129.6	74%	0.743	71%	0.707	S	S	*	*				-172.7	124.1	107.5	-86.1	136.7	-139.8	-118.3	6.8	107.6	D439	D439-R441 IonicContact OD2-CZ 3.71Å; D439-R441 IonicContact OD2-NE 3.71Å; D439-R441 IonicContact OD2-NH2 2.85Å; D439-R441 PolarHBondContact OD2-NH2 3.28Å
442	S	27.7	Very low	28.5	Very low	96 Å²	96	129.5 Å²	129.5	67%	0.671	70%	0.701	S	S	*	*				74.2	161.8	58.8	-58.2	0	0	0	0	112.5
443	I	29.2	Very low	28.4	Very low	139 Å²	139	129.4 Å²	129.4	71%	0.713	69%	0.692	S	S	*	*			trans	76.4	126.2	161.7	-68.4	152.9	0	0	0	113.9
444	N	26.6	Very low	28.3	Very low	101 Å²	101	127.2 Å²	127.2	54%	0.54	68%	0.682	S	S	.	*			cis	-163.7	164.2	-2.2	-120.5	9.1	0	0	0	113
445	E	27.8	Very low	28.1	Very low	163 Å²	163	127.7 Å²	127.7	76%	0.762	68%	0.682	S	S	*	*			trans	62.3	147.2	141.2	-73.7	154.3	170.2	0	0	120
446	S	29.9	Very low	27.9	Very low	107 Å²	107	129.4 Å²	129.4	75%	0.748	69%	0.685	S	S	*	*			cis	-152.7	144	4	37.9	0	0	0	0	113.6
447	S	33	Very low	27.7	Very low	110 Å²	110	128.2 Å²	128.2	77%	0.769	69%	0.688	S	S	*	*			trans	-22.1	163.1	140.4	-59.5	0	0	0	0	116.7
448	P	40.2	Very low	27.6	Very low	101 Å²	101	127 Å²	127	66%	0.656	68%	0.682	S	S	*	*			cis	-147.5	179.9	32.1	46.3	-27.5	0	0	0	118.8
449	D	29.1	Very low	27.7	Very low	137 Å²	137	128.7 Å²	128.7	73%	0.733	69%	0.686	S	S	*	*			trans	58.9	144.2	152.4	-58.6	-25.5	0	0	0	119.8
450	C	26.1	Very low	27.9	Very low	106 Å²	106	132.6 Å²	132.6	72%	0.716	69%	0.694	S	S	*	*			cis	-134.2	136.5	-7.2	-111.6	0	0	0	0	106.1
451	S	26.3	Very low	28.2	Very low	90 Å²	90	134.5 Å²	134.5	63%	0.629	70%	0.699	S	S	*	*				60.8	128.9	60.2	-53.2	0	0	0	0	112.7
452	E	27.1	Very low	28.4	Very low	163 Å²	163	131.3 Å²	131.3	76%	0.762	69%	0.692	S	S	*	*			trans	81.4	136.6	164	-49.7	-134.6	106.6	0	0	116.6
453	Q	25.7	Very low	28.7	Very low	123 Å²	123	133.9 Å²	133.9	58%	0.575	69%	0.694	S	S	*	*			cis	-155.9	153.4	-1.7	-119.6	174.8	27.2	0	0	112
454	Q	23.9	Very low	28.9	Very low	129 Å²	129	134.7 Å²	134.7	60%	0.603	69%	0.692	S	S	*	*			trans	55	123	142.7	-69.5	170.9	33.5	0	0	122.6
455	Q	23.5	Very low	29.2	Very low	137 Å²	137	136.7 Å²	136.7	64%	0.64	70%	0.702	S	S	*	*				63	123.6	122.8	-58.7	175.5	32.1	0	0	121.5
456	Q	22.3	Very low	29.3	Very low	161 Å²	161	133.9 Å²	133.9	75%	0.752	70%	0.701	S	S	*	*			trans	66.5	142.2	138	-60.5	169.6	20.8	0	0	120.2
457	S	22.1	Very low	29.3	Very low	116 Å²	116	136 Å²	136	81%	0.811	70%	0.7	S	S	*	*			trans	67.6	158.6	158.2	89.3	0	0	0	0	115.5
458	H	26.1	Very low	29.1	Very low	150 Å²	150	137.3 Å²	137.3	69%	0.694	70%	0.698	S	S	*	*			cis	-177.5	129.2	-31.1	-128.6	-77.5	0	0	0	105.5
459	H	31.5	Very low	28.5	Very low	165 Å²	165	136.3 Å²	136.3	76%	0.764	69%	0.694	S	S	*	*			trans	63.3	172.1	167.7	-58.4	-42.6	0	0	0	115.4
460	R	30.9	Very low	28.4	Very low	170 Å²	170	137.2 Å²	137.2	64%	0.642	69%	0.693	S	S	*	*			cis	-156.6	141.8	25.2	-160.6	-175.7	-76.8	-152.7	2.1	108	Q462	R460-Q462 HydrophobicContact CG-CB 4.39Å; R460-Q462 HydrophobicContact CG-CG 3.82Å
461	H	36	Very low	28.3	Very low	164 Å²	164	140 Å²	140	76%	0.759	70%	0.696	S	S	*	*				-168.1	160.9	67.9	-77.9	82	0	0	0	112.7
462	Q	30.5	Very low	28.2	Very low	129 Å²	129	140.6 Å²	140.6	60%	0.603	70%	0.7	S	S	*	*			cis	-166.4	173.8	-38.9	-139.8	178.6	-18.5	0	0	111.6	R460	R460-Q462 HydrophobicContact CG-CB 4.39Å; R460-Q462 HydrophobicContact CG-CG 3.82Å
463	E	34.4	Very low	28.1	Very low	150 Å²	150	139.7 Å²	139.7	70%	0.701	70%	0.7	S	S	*	*			trans	91.5	134.5	175.8	-52.9	-152.3	142.2	0	0	115.1
464	K	34.5	Very low	28.2	Very low	157 Å²	157	141 Å²	141	68%	0.683	71%	0.705	S	S	*	*			cis	-165	154.5	-5.3	-102.1	160.8	-175.9	150.3	0	107
465	L	32.2	Very low	28.4	Very low	143 Å²	143	141.1 Å²	141.1	75%	0.749	71%	0.71	S	S	*	*			cis	-169.5	136.5	-22.7	-130	-177.1	0	0	0	109.8
466	S	30.8	Very low	28.5	Very low	104 Å²	104	141 Å²	141	73%	0.727	72%	0.718	S	S	*	*			trans	64.9	162.1	153.5	71.3	0	0	0	0	120.5
467	M	28.7	Very low	29.3	Very low	150 Å²	150	140 Å²	140	74%	0.739	72%	0.718	S	S	*	*			cis	-170.9	161	-15.1	-108.5	-80.9	-87.7	0	0	110.8
468	L	29.8	Very low	29.8	Very low	139 Å²	139	139.8 Å²	139.8	73%	0.728	71%	0.714	S	S	*	*			trans	64	137.5	164.8	-58.1	157.9	0	0	0	116
469	S	26.6	Very low	29.8	Very low	80 Å²	80	138.3 Å²	138.3	56%	0.559	71%	0.71	S	S	*	*			cis	91.1	135.1	27	84.1	0	0	0	0	115.6
470	H	27.1	Very low	29.5	Very low	155 Å²	155	140 Å²	140	72%	0.718	71%	0.711	S	S	*	*			trans	68.5	112.5	-178.8	-61.8	-80.7	0	0	0	114
471	Q	24.2	Very low	29.2	Very low	165 Å²	165	137.3 Å²	137.3	77%	0.771	71%	0.709	S	S	*	*				73.9	130.4	80.1	-77	179.1	-38.7	0	0	114.5
472	S	24.5	Very low	28.8	Very low	102 Å²	102	136 Å²	136	71%	0.713	70%	0.704	S	S	*	*			trans	73.8	113.4	154.4	-70.6	0	0	0	0	121
473	L	25.2	Very low	28.5	Very low	145 Å²	145	136.1 Å²	136.1	76%	0.759	71%	0.708	S	S	*	*				81.3	127.7	126.2	-63.1	170.2	0	0	0	120.7
474	H	27.2	Very low	28.3	Very low	150 Å²	150	135 Å²	135	69%	0.694	72%	0.717	S	S	*	*			trans	77.8	130.2	152.7	-75	-135.2	0	0	0	115.9
475	N	27.7	Very low	28.1	Very low	132 Å²	132	133 Å²	133	71%	0.706	72%	0.722	S	S	*	*				61.3	124.2	63.5	-53.4	-38.6	0	0	0	109.8
476	T	26.7	Very low	28.4	Very low	133 Å²	133	131.2 Å²	131.2	82%	0.816	72%	0.719	S	S	*	*			cis	-152.1	171.8	34.3	50.9	0	0	0	0	114.8
477	L	38.3	Very low	28.2	Very low	141 Å²	141	131.7 Å²	131.7	74%	0.738	72%	0.718	S	S	*	*			trans	-34.6	154.9	143.1	-69.4	161.2	0	0	0	113.5
478	P	34	Very low	28.1	Very low	111 Å²	111	132 Å²	132	72%	0.721	72%	0.717	S	S	*	*				-136.7	156.7	57.2	24.6	-0	0	0	0	117
479	I	25.1	Very low	28.1	Very low	120 Å²	120	133.5 Å²	133.5	62%	0.615	72%	0.721	S	S	*	*				64.4	139.2	77.8	-36.3	157.1	0	0	0	114.9
480	Y	24.7	Very low	28.1	Very low	200 Å²	200	133.6 Å²	133.6	78%	0.784	72%	0.721	S	S	*	*			trans	78	146.8	166.7	-63.9	-56.9	0	0	0	117.6
481	N	25.3	Very low	28.1	Very low	114 Å²	114	133.4 Å²	133.4	61%	0.61	72%	0.724	S	S	*	*			cis	-153.4	166.8	-19.2	-147.8	17.4	0	0	0	112.8
482	E	26.7	Very low	28.3	Very low	137 Å²	137	131.9 Å²	131.9	64%	0.64	72%	0.721	S	S	*	*			trans	25.3	147	140	-84.6	176.9	-116.3	0	0	125
483	N	24.4	Very low	28.6	Very low	130 Å²	130	132 Å²	132	70%	0.695	72%	0.721	S	S	*	*			trans	65.6	103	144.4	-56	-23.1	0	0	0	120.6
484	S	29.6	Very low	28.8	Very low	128 Å²	128	131.1 Å²	131.1	90%	0.895	72%	0.718	S	S	*	*				-167.5	130.7	127.1	21.3	0	0	0	0	114.4
485	S	32.2	Very low	29	Very low	113 Å²	113	129.6 Å²	129.6	79%	0.79	72%	0.715	S	S	*	*			trans	-111	-179.5	147.5	-146.2	0	0	0	0	105.7
486	P	37.1	Very low	29.2	Very low	106 Å²	106	132.3 Å²	132.3	69%	0.688	72%	0.716	S	S	*	*			cis	-141.6	-148.7	3.5	34.3	-8.5	0	0	0	113
487	V	26.6	Very low	29.3	Very low	114 Å²	114	133.2 Å²	133.2	69%	0.691	71%	0.711	S	S	*	*			trans	85.6	117.5	143.9	152.9	0	0	0	0	120.9
488	H	26.8	Very low	29	Very low	156 Å²	156	133.2 Å²	133.2	72%	0.722	71%	0.712	S	S	*	*			trans	61	164.7	154.9	-74.3	-125.2	0	0	0	117.5
489	Q	29.9	Very low	29	Very low	172 Å²	172	135.3 Å²	135.3	80%	0.804	71%	0.709	S	S	*	*			cis	-118.8	151.6	-2.5	-93.5	116.1	52.1	0	0	108.3
490	S	26.8	Very low	29.5	Very low	81 Å²	81	135.1 Å²	135.1	57%	0.566	72%	0.716	S	S	*	*			cis	65.4	96.5	38.8	78.8	0	0	0	0	116.1
491	L	26.9	Very low	29.7	Very low	151 Å²	151	130.7 Å²	130.7	79%	0.791	71%	0.705	S	S	*	*			trans	161.9	140.6	131.1	-88.7	163.1	0	0	0	114.7
492	L	28.1	Very low	29.8	Very low	133 Å²	133	130.4 Å²	130.4	70%	0.696	71%	0.713	S	S	*	*			trans	65.9	145.3	153.1	-60.9	162.5	0	0	0	117.4
493	S	31.6	Very low	29.9	Very low	104 Å²	104	131.2 Å²	131.2	73%	0.727	71%	0.714	S	S	*	*			cis	-140.1	127	9.2	-70	0	0	0	0	108.7
494	N	28.2	Very low	30	Very low	127 Å²	127	135.3 Å²	135.3	68%	0.679	72%	0.72	S	S	*	*				80.3	148.3	78.4	-76.6	0.3	0	0	0	116
495	N	32.8	Very low	29.8	Very low	118 Å²	118	133.2 Å²	133.2	63%	0.631	71%	0.705	S	S	*	*			trans	75.9	134.4	173.1	-49.4	-11.6	0	0	0	115.4
496	Y	32.4	Very low	29.5	Very low	189 Å²	189	136.6 Å²	136.6	74%	0.741	71%	0.706	S	S	*	*			cis	-164	160.9	-16.4	-76.6	-47	0	0	0	104.8
497	E	28.8	Very low	29	Very low	152 Å²	152	138.4 Å²	138.4	71%	0.71	71%	0.71	S	S	*	*			cis	-168.7	177.7	-19.4	-106.9	-175.8	143.8	0	0	106.1
498	L	30.9	Very low	29.1	Very low	142 Å²	142	136.1 Å²	136.1	74%	0.743	70%	0.703	S	S	*	*			cis	-151.9	-163	4.3	-131.2	171.4	0	0	0	108.8
499	K	34.5	Very low	29	Very low	155 Å²	155	136 Å²	136	67%	0.674	71%	0.707	S	S	*	*			trans	-151.8	148.2	172.1	-129.4	-178.9	172.1	-127.2	0	108.7	D501	K499-D501 IonicContact NZ-OD1 2.78Å; K499-D501 PolarHBondContact NZ-OD1 3.16Å
500	P	35	Very low	28.9	Very low	115 Å²	115	132.7 Å²	132.7	75%	0.747	70%	0.703	S	S	*	*				-148	142.2	91.3	29	-7.6	0	0	0	113.9
501	D	28.3	Very low	29	Very low	107 Å²	107	135.9 Å²	135.9	57%	0.572	71%	0.713	S	S	*	*				78	150.1	72.5	-57.8	-32	0	0	0	116.2	K499	K499-D501 IonicContact NZ-OD1 2.78Å; K499-D501 PolarHBondContact NZ-OD1 3.16Å
502	S	29.2	Very low	29	Very low	109 Å²	109	138.3 Å²	138.3	76%	0.762	71%	0.712	S	S	*	*			trans	73	151.4	156	-62.7	0	0	0	0	118.4
503	K	27.9	Very low	29.1	Very low	153 Å²	153	138.4 Å²	138.4	67%	0.665	71%	0.709	S	S	*	*			cis	-167.1	142.6	-13.9	-112.8	-169.3	-178.7	-176.8	0	109.2
504	W	26.1	Very low	29	Very low	217 Å²	217	142.9 Å²	142.9	82%	0.822	71%	0.711	S	S	*	*			trans	68	162.1	140.2	-70.3	30.7	0	0	0	116.6
505	S	26.2	Very low	29	Very low	84 Å²	84	144.2 Å²	144.2	59%	0.587	72%	0.718	S	S	*	*			cis	-168.1	153.4	-15.6	44.9	0	0	0	0	111.4
506	F	26.2	Very low	28.9	Very low	184 Å²	184	141.5 Å²	141.5	81%	0.807	72%	0.718	S	S	*	*			trans	66.7	142.4	143.4	-94.2	-118.9	0	0	0	121.3
507	N	26.7	Very low	28.7	Very low	143 Å²	143	141 Å²	141	77%	0.765	72%	0.723	S	S	*	*			trans	65.1	157.1	152.5	-70.4	0.2	0	0	0	120.1
508	A	27.3	Very low	28.8	Very low	66 Å²	66	141.2 Å²	141.2	55%	0.545	72%	0.724	S	S	.	*			cis	179.7	143.3	-34.3	0	0	0	0	0	107
509	D	25.8	Very low	28.7	Very low	153 Å²	153	142 Å²	142	82%	0.818	72%	0.723	S	S	*	*			trans	60.9	164.5	155.2	-61.4	-37.7	0	0	0	121.1
510	S	27.5	Very low	28.4	Very low	103 Å²	103	142.6 Å²	142.6	72%	0.72	73%	0.728	S	S	*	*			trans	86.7	105.4	151.3	-65.9	0	0	0	0	120.4
511	L	29.2	Very low	28.2	Very low	148 Å²	148	143 Å²	143	78%	0.775	73%	0.729	S	S	*	*			trans	70	120.2	151.4	-76	70.1	0	0	0	116.2
512	R	26.4	Very low	28.4	Very low	203 Å²	203	146.1 Å²	146.1	77%	0.766	74%	0.742	S	S	*	*				76.5	137.6	57.3	-80.9	-172.3	160.6	-143.5	1.5	114
513	H	30.4	Very low	28.5	Very low	135 Å²	135	148.5 Å²	148.5	63%	0.625	74%	0.741	S	S	*	*			trans	98.6	121.8	146	-78	4.5	0	0	0	119.6
514	Y	29.7	Very low	28.7	Very low	197 Å²	197	150.5 Å²	150.5	77%	0.773	75%	0.752	S	S	*	*			trans	58.8	123.1	157.5	-71.2	-111.1	0	0	0	117.2
515	N	28.7	Very low	29.1	Very low	155 Å²	155	144.9 Å²	144.9	83%	0.829	75%	0.752	S	S	*	*			cis	68.9	103.2	42.4	-165.8	31.6	0	0	0	113.3
516	G	28.7	Very low	29.4	Very low	62 Å²	62	146.9 Å²	146.9	64%	0.639	75%	0.752	S	S	*	*			trans	153.3	90.5	168.7	0	0	0	0	0	117.9
517	Q	28.5	Very low	29.9	Very low	178 Å²	178	145.3 Å²	145.3	83%	0.832	75%	0.752	S	S	*	*			trans	61	169.7	136.3	-59.7	-178.8	-38.1	0	0	123
518	H	31.1	Very low	30.5	Very low	157 Å²	157	147.3 Å²	147.3	73%	0.727	76%	0.757	S	S	*	*			trans	71.5	93.8	158.8	-79.7	-73.2	0	0	0	121.9
519	H	28.8	Very low	31	Very low	158 Å²	158	152.2 Å²	152.2	73%	0.731	77%	0.768	S	S	*	*				24.8	142	117.6	-93.5	-67.3	0	0	0	121.5
520	Q	28.5	Very low	31.4	Very low	168 Å²	168	153.2 Å²	153.2	79%	0.785	76%	0.76	S	S	*	*			trans	59.6	109.7	151.8	-65.4	174.1	-18.8	0	0	115.3
521	T	31	Very low	32	Very low	123 Å²	123	152.4 Å²	152.4	76%	0.755	76%	0.755	S	S	*	*				-179	130.7	68.5	-64.3	0	0	0	0	109.7
522	M	33.2	Very low	32.4	Very low	173 Å²	173	151.4 Å²	151.4	85%	0.852	75%	0.751	S	S	*	*			trans	-166.7	89.8	149.8	-100.8	-95	61.2	0	0	109.2
523	H	30.4	Very low	33	Very low	159 Å²	159	147.5 Å²	147.5	74%	0.736	75%	0.745	S	S	*	*			trans	-65.2	169.2	168.4	-99	-109.7	0	0	0	111.3
524	Q	32.2	Very low	33.4	Very low	194 Å²	194	146.5 Å²	146.5	91%	0.907	74%	0.744	S	S	*	*	S	Bend	trans	81.3	59.6	167.7	-50.7	172.6	4.3	0	0	117.1
525	A	34.4	Very low	33.8	Very low	99 Å²	99	142.5 Å²	142.5	82%	0.818	74%	0.735	S	S	*	*	S	Bend	trans	-146.9	-30.7	163.4	0	0	0	0	0	116.6	N527	A525-N527 PolarHBondContact O-N 2.87Å
526	E	32.4	Very low	34.2	Very low	126 Å²	126	142.2 Å²	142.2	59%	0.589	73%	0.727	S	S	*	*			trans	-87	7.5	-161.4	-62.2	-160	159.9	0	0	118.1	H528 R530	E526-H528 PolarHBondContact O-N 3.01Å; E526-R530 IonicContact OE2-CZ 3.59Å; E526-R530 IonicContact OE2-NE 2.79Å; E526-R530 IonicContact OE2-NH2 3.43Å; E526-R530 PolarHBondContact OE2-NH2 2.97Å
527	N	37.9	Very low	34.9	Very low	152 Å²	152	146.4 Å²	146.4	81%	0.813	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	13.3	-164.9	-89.4	9.5	0	0	0	117.1	A525	A525-N527 PolarHBondContact O-N 2.87Å
528	H	38.1	Very low	35.7	Very low	184 Å²	184	140.9 Å²	140.9	85%	0.852	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.9	9.2	-178.8	-93.7	35.5	0	0	0	116	E526	E526-H528 PolarHBondContact O-N 3.01Å
529	Q	38.3	Very low	36.3	Very low	170 Å²	170	138.4 Å²	138.4	79%	0.794	70%	0.697	S	S	*	*	S	Bend	trans	-126	8.9	177.7	-74.6	-178.1	-33.3	0	0	114.7
530	R	34.5	Very low	37.1	Very low	173 Å²	173	134 Å²	134	65%	0.653	68%	0.682	S	S	*	*	S	Bend	trans	-93.6	-3.1	-177.5	-70.1	-173.5	175.5	-139.5	3.2	115.8	E526	E526-R530 IonicContact OE2-CZ 3.59Å; E526-R530 IonicContact OE2-NE 2.79Å; E526-R530 IonicContact OE2-NH2 3.43Å; E526-R530 PolarHBondContact OE2-NH2 2.97Å
531	S	39.2	Very low	38.1	Very low	86 Å²	86	130.1 Å²	130.1	60%	0.601	66%	0.664	S	S	*	*	S	Bend	trans	-80.6	-42.2	-177.7	56.6	0	0	0	0	114.5
532	N	38.2	Very low	39.1	Very low	128 Å²	128	130.5 Å²	130.5	68%	0.684	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-14.2	-162.4	-64.7	10.7	0	0	0	114.5
533	N	38.3	Very low	40	Very low	121 Å²	121	129.9 Å²	129.9	65%	0.647	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	-4.7	-177.2	-74.2	-35.6	0	0	0	114.5
534	N	39.3	Very low	41.5	Very low	114 Å²	114	127.8 Å²	127.8	61%	0.61	64%	0.638	S	S	*	*	S	Bend	trans	-90	-30.2	178.7	-72.5	-6.2	0	0	0	112.8	F536 K537	N534-F536 PolarHBondContact O-N 3.29Å; N534-K537 PolarHBondContact O-N 3.45Å
535	L	38.4	Very low	42.9	Very low	112 Å²	112	124.7 Å²	124.7	59%	0.586	62%	0.624	S	S	*	*	H	α-helix	trans	-65.5	-36.6	-179.9	-171.3	62.8	0	0	0	112.8	K537 S538	L535-K537 VanDerWaalsContact C-N 3.26Å; L535-K537 PolarHBondContact O-N 3.05Å; L535-S538 PolarHBondContact O-OG 2.8Å
536	F	37.8	Very low	43.9	Very low	149 Å²	149	124.7 Å²	124.7	65%	0.654	61%	0.61	S	S	*	*	H	α-helix	trans	-74.3	-11.4	178.2	-107.7	-90.7	0	0	0	114.4	N534 T540	N534-F536 PolarHBondContact O-N 3.29Å; F536-T540 WeakPolarHBondContact O-CG2 3.48Å; F536-T540 PolarHBondContact O-OG1 2.84Å
537	K	43.2	Very low	45	Very low	151 Å²	151	121.4 Å²	121.4	66%	0.657	60%	0.604	S	S	*	*	H	α-helix	trans	-91.9	-31.5	177.5	-81.2	-173.4	172.9	-177.5	0	113.3	N534 L535 E541	N534-K537 PolarHBondContact O-N 3.45Å; L535-K537 VanDerWaalsContact C-N 3.26Å; L535-K537 PolarHBondContact O-N 3.05Å; K537-E541 PolarHBondContact O-N 3.31Å
538	S	44.5	Very low	45.9	Very low	62 Å²	62	117.3 Å²	117.3	43%	0.434	59%	0.587	S	S	.	*	H	α-helix	trans	-67.3	-52.1	172.1	46	0	0	0	0	110.9	L535 T540 E541 E542	L535-S538 PolarHBondContact O-OG 2.8Å; S538-T540 PolarHBondContact O-N 3.14Å; S538-E541 PolarHBondContact O-N 2.86Å; S538-E541 VanDerWaalsContact O-N 3.16Å; S538-E542 PolarHBondContact O-N 3.24Å
539	E	43	Very low	46.7	Very low	104 Å²	104	114.5 Å²	114.5	49%	0.486	57%	0.573	S	S	.	*	H	α-helix	trans	-60.8	-32.2	-178.1	-65.6	-173.8	157	0	0	113	F543	E539-F543 WeakPolarHBondContact O-CB 3.44Å; E539-F543 PolarHBondContact O-N 2.7Å; E539-F543 VanDerWaalsContact O-N 3.15Å
540	T	46	Very low	47.3	Very low	66 Å²	66	111.5 Å²	111.5	41%	0.405	56%	0.562	S	S	.	*	H	α-helix	trans	-83.4	-23.3	178.9	52.4	0	0	0	0	114.3	F536 S538 K544	F536-T540 WeakPolarHBondContact O-CG2 3.48Å; F536-T540 PolarHBondContact O-OG1 2.84Å; S538-T540 PolarHBondContact O-N 3.14Å; T540-K544 WeakPolarHBondContact O-CD 3.43Å; T540-K544 VanDerWaalsContact O-CG 3.31Å; T540-K544 WeakPolarHBondContact O-CG 3.37Å; T540-K544 PolarHBondContact O-N 3.1Å
541	E	49.8	Very low	48.2	Very low	87 Å²	87	106.6 Å²	106.6	41%	0.407	55%	0.548	S	S	.	.	H	α-helix	trans	-82.7	-35.9	168.7	-68.9	-55.1	143.5	0	0	112.1	K537 S538 F543 K544 Q545	K537-E541 PolarHBondContact O-N 3.31Å; S538-E541 PolarHBondContact O-N 2.86Å; S538-E541 VanDerWaalsContact O-N 3.16Å; E541-F543 VanDerWaalsContact C-N 3.31Å; E541-F543 PolarHBondContact O-N 2.89Å; E541-K544 PolarHBondContact O-N 3.25Å; E541-K544 VanDerWaalsContact O-N 3.12Å; E541-K544 WeakPolarHBondContact OE1-CD 3.49Å; E541-K544 IonicContact OE1-NZ 3.52Å; E541-K544 PolarHBondContact OE1-NZ 3.09Å; E541-K544 VanDerWaalsContact OE2-CD 3.27Å; E541-K544 WeakPolarHBondContact OE2-CD 2.79Å; E541-K544 IonicContact OE2-NZ 3.19Å; E541-Q545 WeakPolarHBondContact O-CG 3.41Å; E541-Q545 PolarHBondContact O-N 2.99Å
542	E	52.6	Low	48.9	Very low	130 Å²	130	108.4 Å²	108.4	61%	0.607	55%	0.547	S	S	*	.	H	α-helix	trans	-58.8	-42.9	169.5	-76.4	-164.2	141.8	0	0	111.4	S538 K544 Q545 L546	S538-E542 PolarHBondContact O-N 3.24Å; E542-K544 VanDerWaalsContact C-N 3.32Å; E542-K544 PolarHBondContact O-N 3.43Å; E542-Q545 PolarHBondContact O-N 3.4Å; E542-L546 WeakPolarHBondContact O-CB 3.47Å; E542-L546 PolarHBondContact O-N 3.03Å
543	F	50.7	Low	49.5	Very low	160 Å²	160	108.7 Å²	108.7	70%	0.702	54%	0.542	S	S	*	.	H	α-helix	trans	-65.7	-31.6	175.3	-114.7	-87.7	0	0	0	113.4	E539 E541 A547	E539-F543 WeakPolarHBondContact O-CB 3.44Å; E539-F543 PolarHBondContact O-N 2.7Å; E539-F543 VanDerWaalsContact O-N 3.15Å; E541-F543 VanDerWaalsContact C-N 3.31Å; E541-F543 PolarHBondContact O-N 2.89Å; F543-A547 WeakPolarHBondContact O-CB 3.4Å; F543-A547 PolarHBondContact O-N 3.33Å
544	K	63.7	Low	49.8	Very low	115 Å²	115	107.3 Å²	107.3	50%	0.5	53%	0.532	S	S	.	.	H	α-helix	trans	-72.3	-40.7	172.9	-76	167.5	-174.1	174.1	0	112.1	T540 E541 E542 A547 S548	T540-K544 WeakPolarHBondContact O-CD 3.43Å; T540-K544 VanDerWaalsContact O-CG 3.31Å; T540-K544 WeakPolarHBondContact O-CG 3.37Å; T540-K544 PolarHBondContact O-N 3.1Å; E541-K544 PolarHBondContact O-N 3.25Å; E541-K544 VanDerWaalsContact O-N 3.12Å; E541-K544 WeakPolarHBondContact OE1-CD 3.49Å; E541-K544 IonicContact OE1-NZ 3.52Å; E541-K544 PolarHBondContact OE1-NZ 3.09Å; E541-K544 VanDerWaalsContact OE2-CD 3.27Å; E541-K544 WeakPolarHBondContact OE2-CD 2.79Å; E541-K544 IonicContact OE2-NZ 3.19Å; E542-K544 VanDerWaalsContact C-N 3.32Å; E542-K544 PolarHBondContact O-N 3.43Å; K544-A547 PolarHBondContact O-N 2.92Å; K544-S548 WeakPolarHBondContact O-CB 3.47Å; K544-S548 PolarHBondContact O-N 3.01Å; K544-S548 PolarHBondContact O-OG 3.33Å
545	Q	60.9	Low	50.3	Low	130 Å²	130	107.2 Å²	107.2	61%	0.607	53%	0.526	S	S	*	.	H	α-helix	trans	-67	-40.8	176.1	-69.9	-178	28.9	0	0	111.1	E541 E542 S548 F549	E541-Q545 WeakPolarHBondContact O-CG 3.41Å; E541-Q545 PolarHBondContact O-N 2.99Å; E542-Q545 PolarHBondContact O-N 3.4Å; Q545-S548 WeakPolarHBondContact CA-OG 3.43Å; Q545-S548 PolarHBondContact O-N 3.39Å; Q545-S548 PolarHBondContact O-OG 2.92Å; Q545-F549 WeakPolarHBondContact O-CB 3.08Å; Q545-F549 PolarHBondContact O-N 3.13Å
546	L	55.5	Low	50.5	Low	98 Å²	98	105.6 Å²	105.6	51%	0.513	52%	0.521	S	S	.	.	H	α-helix	trans	-64.8	-38.8	170.6	-84.6	162.3	0	0	0	112.1	E542 L550	E542-L546 WeakPolarHBondContact O-CB 3.47Å; E542-L546 PolarHBondContact O-N 3.03Å; L546-L550 VanDerWaalsContact O-CB 3.22Å; L546-L550 WeakPolarHBondContact O-CB 3.31Å; L546-L550 WeakPolarHBondContact O-CG 3.39Å; L546-L550 PolarHBondContact O-N 2.89Å
547	A	55.2	Low	50.6	Low	57 Å²	57	102.3 Å²	102.3	47%	0.471	51%	0.511	S	S	.	.	H	α-helix	trans	-66.7	-42.3	175.6	0	0	0	0	0	112.6	F543 K544 D551	F543-A547 WeakPolarHBondContact O-CB 3.4Å; F543-A547 PolarHBondContact O-N 3.33Å; K544-A547 PolarHBondContact O-N 2.92Å; A547-D551 WeakPolarHBondContact O-CB 3.47Å; A547-D551 PolarHBondContact O-N 3.33Å
548	S	56.2	Low	50.4	Low	66 Å²	66	102.5 Å²	102.5	46%	0.462	51%	0.507	S	S	.	.	H	α-helix	trans	-68.1	-43.1	176.1	65.4	0	0	0	0	111.1	K544 Q545 L550 D551 E552	K544-S548 WeakPolarHBondContact O-CB 3.47Å; K544-S548 PolarHBondContact O-N 3.01Å; K544-S548 PolarHBondContact O-OG 3.33Å; Q545-S548 WeakPolarHBondContact CA-OG 3.43Å; Q545-S548 PolarHBondContact O-N 3.39Å; Q545-S548 PolarHBondContact O-OG 2.92Å; S548-L550 VanDerWaalsContact C-N 3.35Å; S548-L550 PolarHBondContact O-N 2.88Å; S548-D551 PolarHBondContact O-N 3.49Å; S548-E552 WeakPolarHBondContact O-CB 3.37Å; S548-E552 WeakPolarHBondContact O-CG 3.48Å; S548-E552 PolarHBondContact O-N 3.21Å
549	F	56	Low	50.2	Low	126 Å²	126	103.5 Å²	103.5	55%	0.553	51%	0.514	S	S	*	.	H	α-helix	trans	-66.1	-34.6	177.2	-160.5	-104.6	0	0	0	112.3	Q545 K553	Q545-F549 WeakPolarHBondContact O-CB 3.08Å; Q545-F549 PolarHBondContact O-N 3.13Å; F549-K553 WeakPolarHBondContact O-CB 3.34Å; F549-K553 PolarHBondContact O-N 3.38Å
550	L	51.1	Low	49.8	Very low	107 Å²	107	109.1 Å²	109.1	56%	0.56	53%	0.531	S	S	*	.	H	α-helix	trans	-74.1	-36.2	173.6	-73.5	171.1	0	0	0	112.9	L546 S548 K553 E554	L546-L550 VanDerWaalsContact O-CB 3.22Å; L546-L550 WeakPolarHBondContact O-CB 3.31Å; L546-L550 WeakPolarHBondContact O-CG 3.39Å; L546-L550 PolarHBondContact O-N 2.89Å; S548-L550 VanDerWaalsContact C-N 3.35Å; S548-L550 PolarHBondContact O-N 2.88Å; L550-K553 PolarHBondContact O-N 3.35Å; L550-E554 PolarHBondContact O-N 2.96Å
551	D	53.3	Low	49.3	Very low	69 Å²	69	114.4 Å²	114.4	37%	0.369	54%	0.544	S	S	.	.	H	α-helix	trans	-70.5	-36.9	173.1	-175.2	35.8	0	0	0	111.4	A547 S548 E554 K555	A547-D551 WeakPolarHBondContact O-CB 3.47Å; A547-D551 PolarHBondContact O-N 3.33Å; S548-D551 PolarHBondContact O-N 3.49Å; D551-E554 PolarHBondContact O-N 3.14Å; D551-K555 VanDerWaalsContact O-CB 3.24Å; D551-K555 WeakPolarHBondContact O-CB 3.3Å; D551-K555 WeakPolarHBondContact O-CD 3.41Å; D551-K555 WeakPolarHBondContact O-CG 3.14Å; D551-K555 PolarHBondContact O-N 3.22Å; D551-K555 WeakPolarHBondContact OD1-CE 3.27Å; D551-K555 IonicContact OD1-NZ 2.62Å; D551-K555 WeakPolarHBondContact OD2-CE 3.45Å; D551-K555 IonicContact OD2-NZ 3.08Å; D551-K555 PolarHBondContact OD2-NZ 2.89Å
552	E	53.5	Low	48.4	Very low	124 Å²	124	120 Å²	120	58%	0.579	56%	0.561	S	S	*	*	H	α-helix	trans	-63.2	-40.1	167.6	-75.3	-146.2	122.6	0	0	112.4	S548 K555 T556	S548-E552 WeakPolarHBondContact O-CB 3.37Å; S548-E552 WeakPolarHBondContact O-CG 3.48Å; S548-E552 PolarHBondContact O-N 3.21Å; E552-K555 PolarHBondContact O-N 3.35Å; E552-T556 WeakPolarHBondContact O-CB 3.32Å; E552-T556 WeakPolarHBondContact O-CG2 3.27Å; E552-T556 PolarHBondContact O-N 3.28Å; E552-T556 PolarHBondContact O-OG1 2.89Å
553	K	50.1	Low	47.4	Very low	134 Å²	134	123.3 Å²	123.3	58%	0.583	57%	0.574	S	S	*	*	H	α-helix	trans	-67.6	-34.9	176.4	-158.2	162.7	-170.9	167.8	0	112.1	F549 L550 T556 D557	F549-K553 WeakPolarHBondContact O-CB 3.34Å; F549-K553 PolarHBondContact O-N 3.38Å; L550-K553 PolarHBondContact O-N 3.35Å; K553-T556 WeakPolarHBondContact CA-OG1 3.49Å; K553-T556 PolarHBondContact O-OG1 3.02Å; K553-D557 PolarHBondContact O-N 3.02Å
554	E	45.7	Very low	46.4	Very low	93 Å²	93	120.5 Å²	120.5	44%	0.435	57%	0.574	S	S	.	*	H	α-helix	trans	-75.9	-35.5	171.9	-158.3	-179.4	-157.7	0	0	112.3	L550 D551 R558	L550-E554 PolarHBondContact O-N 2.96Å; D551-E554 PolarHBondContact O-N 3.14Å; E554-R558 VanDerWaalsContact CD-NH1 3.28Å; E554-R558 HydrophobicContact CG-CG 4.41Å; E554-R558 WeakPolarHBondContact O-CB 3.46Å; E554-R558 WeakPolarHBondContact O-CG 3.24Å; E554-R558 PolarHBondContact O-N 3.11Å; E554-R558 IonicContact OE1-CZ 3.91Å; E554-R558 IonicContact OE1-NE 3.36Å; E554-R558 IonicContact OE1-NH1 3.84Å; E554-R558 IonicContact OE1-NH2 2.98Å; E554-R558 PolarHBondContact OE1-NH2 3.5Å; E554-R558 IonicContact OE2-CZ 2.61Å; E554-R558 IonicContact OE2-NE 3.69Å; E554-R558 IonicContact OE2-NH1 2.77Å; E554-R558 PolarHBondContact OE2-NH1 2.71Å; E554-R558 IonicContact OE2-NH2 3.26Å; E554-R558 PolarHBondContact OE2-NH2 3.1Å
555	K	48.8	Very low	44.9	Very low	111 Å²	111	122.4 Å²	122.4	48%	0.483	59%	0.588	S	S	.	*	H	α-helix	trans	-63.7	-41.9	172.8	-77.2	162.1	176.3	166	0	111.7	D551 E552 S559	D551-K555 VanDerWaalsContact O-CB 3.24Å; D551-K555 WeakPolarHBondContact O-CB 3.3Å; D551-K555 WeakPolarHBondContact O-CD 3.41Å; D551-K555 WeakPolarHBondContact O-CG 3.14Å; D551-K555 PolarHBondContact O-N 3.22Å; D551-K555 WeakPolarHBondContact OD1-CE 3.27Å; D551-K555 IonicContact OD1-NZ 2.62Å; D551-K555 WeakPolarHBondContact OD2-CE 3.45Å; D551-K555 IonicContact OD2-NZ 3.08Å; D551-K555 PolarHBondContact OD2-NZ 2.89Å; E552-K555 PolarHBondContact O-N 3.35Å; K555-S559 VanDerWaalsContact O-CB 3.27Å; K555-S559 WeakPolarHBondContact O-CB 3.34Å; K555-S559 PolarHBondContact O-N 3.2Å; K555-S559 PolarHBondContact O-OG 3.26Å
556	T	43.8	Very low	43.3	Very low	78 Å²	78	123.2 Å²	123.2	48%	0.479	60%	0.596	S	S	.	*	H	α-helix	trans	-70.6	-42.3	178.7	48.9	0	0	0	0	112.7	E552 K553 S559 R560	E552-T556 WeakPolarHBondContact O-CB 3.32Å; E552-T556 WeakPolarHBondContact O-CG2 3.27Å; E552-T556 PolarHBondContact O-N 3.28Å; E552-T556 PolarHBondContact O-OG1 2.89Å; K553-T556 WeakPolarHBondContact CA-OG1 3.49Å; K553-T556 PolarHBondContact O-OG1 3.02Å; T556-S559 PolarHBondContact O-N 3.28Å; T556-R560 WeakPolarHBondContact O-CG 3.46Å; T556-R560 PolarHBondContact O-N 3.37Å
557	D	39.7	Very low	42.1	Very low	81 Å²	81	123.8 Å²	123.8	43%	0.433	61%	0.606	S	S	.	*	H	α-helix	trans	-72.8	-27	174.3	-170.5	18.2	0	0	0	113	K553 R561	K553-D557 PolarHBondContact O-N 3.02Å; D557-R561 WeakPolarHBondContact O-CG 3.32Å; D557-R561 PolarHBondContact O-NE 2.87Å; D557-R561 IonicContact OD1-CZ 3.17Å; D557-R561 VanDerWaalsContact OD1-CZ 3.3Å; D557-R561 IonicContact OD1-NE 3.12Å; D557-R561 PolarHBondContact OD1-NE 3.04Å; D557-R561 IonicContact OD1-NH2 3.65Å; D557-R561 PolarHBondContact OD1-NH2 3.26Å; D557-R561 IonicContact OD2-CZ 2.73Å; D557-R561 IonicContact OD2-NH2 3.78Å; D557-R561 PolarHBondContact OD2-NH2 3.23Å
558	R	39.1	Very low	40.8	Very low	154 Å²	154	127.9 Å²	127.9	58%	0.581	62%	0.619	S	S	*	*	H	α-helix	trans	-69.5	-34	166.7	-76.9	174.4	173.7	151.3	3.7	112.5	E554	E554-R558 VanDerWaalsContact CD-NH1 3.28Å; E554-R558 HydrophobicContact CG-CG 4.41Å; E554-R558 WeakPolarHBondContact O-CB 3.46Å; E554-R558 WeakPolarHBondContact O-CG 3.24Å; E554-R558 PolarHBondContact O-N 3.11Å; E554-R558 IonicContact OE1-CZ 3.91Å; E554-R558 IonicContact OE1-NE 3.36Å; E554-R558 IonicContact OE1-NH1 3.84Å; E554-R558 IonicContact OE1-NH2 2.98Å; E554-R558 PolarHBondContact OE1-NH2 3.5Å; E554-R558 IonicContact OE2-CZ 2.61Å; E554-R558 IonicContact OE2-NE 3.69Å; E554-R558 IonicContact OE2-NH1 2.77Å; E554-R558 PolarHBondContact OE2-NH1 2.71Å; E554-R558 IonicContact OE2-NH2 3.26Å; E554-R558 PolarHBondContact OE2-NH2 3.1Å
559	S	39.6	Very low	39.5	Very low	84 Å²	84	131.4 Å²	131.4	59%	0.587	63%	0.627	S	S	*	*	H	α-helix	trans	-76.5	-38.9	-179.3	-60.4	0	0	0	0	112.6	K555 T556 R561 R562	K555-S559 VanDerWaalsContact O-CB 3.27Å; K555-S559 WeakPolarHBondContact O-CB 3.34Å; K555-S559 PolarHBondContact O-N 3.2Å; K555-S559 PolarHBondContact O-OG 3.26Å; T556-S559 PolarHBondContact O-N 3.28Å; S559-R561 PolarHBondContact O-N 2.72Å; S559-R562 PolarHBondContact O-N 3.07Å
560	R	35.3	Very low	38.2	Very low	222 Å²	222	132.3 Å²	132.3	84%	0.838	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	6.8	177.3	-77.7	-172.5	176.9	-132.1	0.3	115.7	T556	T556-R560 WeakPolarHBondContact O-CG 3.46Å; T556-R560 PolarHBondContact O-N 3.37Å
561	R	35.3	Very low	37.1	Very low	177 Å²	177	133.8 Å²	133.8	67%	0.668	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.2	8.4	-176.8	-58.5	-177.1	-165.3	-155.4	5.6	114.5	D557 S559	D557-R561 WeakPolarHBondContact O-CG 3.32Å; D557-R561 PolarHBondContact O-NE 2.87Å; D557-R561 IonicContact OD1-CZ 3.17Å; D557-R561 VanDerWaalsContact OD1-CZ 3.3Å; D557-R561 IonicContact OD1-NE 3.12Å; D557-R561 PolarHBondContact OD1-NE 3.04Å; D557-R561 IonicContact OD1-NH2 3.65Å; D557-R561 PolarHBondContact OD1-NH2 3.26Å; D557-R561 IonicContact OD2-CZ 2.73Å; D557-R561 IonicContact OD2-NH2 3.78Å; D557-R561 PolarHBondContact OD2-NH2 3.23Å; S559-R561 PolarHBondContact O-N 2.72Å
562	R	31	Very low	36.1	Very low	205 Å²	205	138.3 Å²	138.3	77%	0.774	66%	0.655	S	S	*	*	S	Bend	trans	-147.5	124.6	169.8	-65.6	-174.2	177.9	-178.5	-0.8	110.7	S559	S559-R562 PolarHBondContact O-N 3.07Å
563	F	30.8	Very low	35.1	Very low	199 Å²	199	140.2 Å²	140.2	87%	0.873	67%	0.669	S	S	*	*			trans	64.4	150.3	-175.9	-43.7	-79.1	0	0	0	112.7
564	S	29.9	Very low	33.9	Very low	101 Å²	101	139.8 Å²	139.8	71%	0.706	67%	0.672	S	S	*	*			cis	-145.9	170.8	-19.4	-157.8	0	0	0	0	110.5
565	I	31.9	Very low	33.2	Very low	154 Å²	154	140 Å²	140	79%	0.79	68%	0.683	S	S	*	*			trans	-21	136.6	168	-63.4	156.1	0	0	0	117.2
566	N	27.3	Very low	32.4	Very low	147 Å²	147	141.9 Å²	141.9	79%	0.786	70%	0.699	S	S	*	*			trans	-54.3	148.9	171.1	-56.6	9.4	0	0	0	113.8
567	P	30.6	Very low	31.8	Very low	110 Å²	110	144 Å²	144	71%	0.714	71%	0.711	S	S	*	*				-110	152.3	111.4	-11.6	30.3	0	0	0	112.8
568	L	28.1	Very low	31.6	Very low	143 Å²	143	146.3 Å²	146.3	75%	0.749	72%	0.724	S	S	*	*				62.3	136.6	72	-48	-176.9	0	0	0	113.1
569	F	28	Very low	31.1	Very low	141 Å²	141	147.4 Å²	147.4	62%	0.618	74%	0.736	S	S	*	*			cis	-160.8	155.1	-6.3	-128.7	-50.6	0	0	0	110.1	Y571	F569-Y571 AromaticContact CD1-CD2 3.7Å; F569-Y571 HydrophobicContact CD1-CD2 3.7Å; F569-Y571 AromaticContact CD1-CE2 3.67Å; F569-Y571 HydrophobicContact CD1-CE2 3.67Å; F569-Y571 AromaticContact CE1-CD2 3.92Å; F569-Y571 HydrophobicContact CE1-CD2 3.92Å; F569-Y571 AromaticContact CE1-CE2 3.48Å; F569-Y571 HydrophobicContact CE1-CE2 3.48Å; F569-Y571 VanDerWaalsContact CE1-CE2 3.48Å; F569-Y571 HydrophobicContact CE2-CE2 4.37Å; F569-Y571 HydrophobicContact CG-CD2 4.32Å; F569-Y571 HydrophobicContact CG-CE2 4.22Å; F569-Y571 AromaticContact CZ-CE2 3.87Å; F569-Y571 HydrophobicContact CZ-CE2 3.87Å
570	N	30.1	Very low	30.8	Very low	145 Å²	145	150.8 Å²	150.8	78%	0.775	75%	0.747	S	S	*	*			trans	170.5	127.6	138.2	-84.1	-3.3	0	0	0	107.1
571	Y	27.6	Very low	30.7	Very low	138 Å²	138	147.4 Å²	147.4	54%	0.541	75%	0.751	S	S	.	*				67.8	138.5	53.9	-73.6	-72.8	0	0	0	113	F569 I574	F569-Y571 AromaticContact CD1-CD2 3.7Å; F569-Y571 HydrophobicContact CD1-CD2 3.7Å; F569-Y571 AromaticContact CD1-CE2 3.67Å; F569-Y571 HydrophobicContact CD1-CE2 3.67Å; F569-Y571 AromaticContact CE1-CD2 3.92Å; F569-Y571 HydrophobicContact CE1-CD2 3.92Å; F569-Y571 AromaticContact CE1-CE2 3.48Å; F569-Y571 HydrophobicContact CE1-CE2 3.48Å; F569-Y571 VanDerWaalsContact CE1-CE2 3.48Å; F569-Y571 HydrophobicContact CE2-CE2 4.37Å; F569-Y571 HydrophobicContact CG-CD2 4.32Å; F569-Y571 HydrophobicContact CG-CE2 4.22Å; F569-Y571 AromaticContact CZ-CE2 3.87Å; F569-Y571 HydrophobicContact CZ-CE2 3.87Å; Y571-I574 HydrophobicContact CD1-CD1 3.86Å; Y571-I574 HydrophobicContact CD1-CG1 3.96Å; Y571-I574 HydrophobicContact CE1-CD1 3.74Å; Y571-I574 HydrophobicContact CE1-CG1 3.84Å
572	E	32.1	Very low	30.5	Very low	164 Å²	164	142.8 Å²	142.8	77%	0.766	75%	0.751	S	S	*	*			cis	-89.5	-170.4	-3.4	-52.3	83.5	-174.8	0	0	113
573	D	31.4	Very low	30.5	Very low	164 Å²	164	140.8 Å²	140.8	88%	0.877	76%	0.756	S	S	*	*			cis	-92.7	149	18	-81	-52.1	0	0	0	116.3
574	I	26.4	Very low	30.5	Very low	124 Å²	124	140.5 Å²	140.5	64%	0.636	75%	0.754	S	S	*	*			trans	-131.9	133.3	171.2	-63	173.4	0	0	0	109.4	Y571	Y571-I574 HydrophobicContact CD1-CD1 3.86Å; Y571-I574 HydrophobicContact CD1-CG1 3.96Å; Y571-I574 HydrophobicContact CE1-CD1 3.74Å; Y571-I574 HydrophobicContact CE1-CG1 3.84Å
575	S	30.7	Very low	30.7	Very low	97 Å²	97	142 Å²	142	68%	0.678	75%	0.752	S	S	*	*			trans	-158.7	118.4	149	48.4	0	0	0	0	113.2
576	N	30.7	Very low	30.7	Very low	151 Å²	151	142.5 Å²	142.5	81%	0.807	75%	0.751	S	S	*	*			trans	66.8	141.9	163	-46.1	-40.2	0	0	0	115.8
577	V	33.1	Very low	30.9	Very low	122 Å²	122	139.6 Å²	139.6	74%	0.739	74%	0.742	S	S	*	*			cis	-135	165.2	21.2	172	0	0	0	0	110.4
578	N	33.8	Very low	31.2	Very low	130 Å²	130	142.3 Å²	142.3	70%	0.695	75%	0.745	S	S	*	*			trans	-39.7	146.4	177.4	51.9	60.4	0	0	0	115.9
579	E	29.1	Very low	31.5	Very low	177 Å²	177	143.3 Å²	143.3	83%	0.827	74%	0.743	S	S	*	*			cis	78.4	84	38.8	-166.3	177.3	-127.9	0	0	114
580	N	33	Very low	31.6	Very low	156 Å²	156	142.1 Å²	142.1	83%	0.834	74%	0.743	S	S	*	*			trans	-172.7	94.2	155.6	-103.4	-50	0	0	0	110
581	T	34.2	Very low	31.8	Very low	150 Å²	150	142.3 Å²	142.3	92%	0.92	74%	0.744	S	S	*	*			trans	166.5	81.9	149.6	-66.9	0	0	0	0	108
582	A	30.7	Very low	32	Very low	81 Å²	81	145.7 Å²	145.7	67%	0.669	76%	0.762	S	S	*	*			trans	-102	170.8	157.5	0	0	0	0	0	108.7
583	N	30.4	Very low	32.1	Very low	162 Å²	162	143.6 Å²	143.6	87%	0.866	76%	0.761	S	S	*	*			trans	67.7	74.3	172.2	-53.6	-27.2	0	0	0	116.7
584	F	32	Very low	32.2	Very low	193 Å²	193	140.7 Å²	140.7	85%	0.846	75%	0.753	S	S	*	*			trans	-134.1	102	145.9	-164	-96	0	0	0	111.4
585	M	32.9	Very low	32.6	Very low	132 Å²	132	140.9 Å²	140.9	65%	0.65	76%	0.76	S	S	*	*			trans	37.3	105.1	148.9	-52.4	-100.4	55.1	0	0	116.3
586	Q	33.4	Very low	32.6	Very low	166 Å²	166	143.7 Å²	143.7	78%	0.776	76%	0.762	S	S	*	*			cis	58.3	125.2	43.6	-160.5	69.9	-0.6	0	0	114.3
587	S	30.8	Very low	32.6	Very low	86 Å²	86	143.4 Å²	143.4	60%	0.601	76%	0.76	S	S	*	*			trans	84.8	153.7	166.1	78.1	0	0	0	0	120.3
588	H	37.5	Very low	32.5	Very low	166 Å²	166	144.4 Å²	144.4	77%	0.769	76%	0.756	S	S	*	*			trans	63.5	111.8	-179.1	-60.1	-83.5	0	0	0	117.3
589	K	34.5	Very low	32.5	Very low	164 Å²	164	145.3 Å²	145.3	71%	0.713	76%	0.756	S	S	*	*			cis	92.3	122.5	33.5	-76	-179.4	139.9	-87	0	115.7
590	D	30	Very low	32.4	Very low	116 Å²	116	146.5 Å²	146.5	62%	0.62	75%	0.754	S	S	*	*			trans	59.4	99.8	138.8	-45.3	-22	0	0	0	118.9
591	D	34.4	Very low	32.2	Very low	149 Å²	149	146 Å²	146	80%	0.797	75%	0.751	S	S	*	*				175.1	109.5	121.6	-97.3	-17	0	0	0	114
592	F	31.8	Very low	31.9	Very low	210 Å²	210	144.6 Å²	144.6	92%	0.921	75%	0.747	S	S	*	*				-177.1	146.2	121.4	-119.7	-93	0	0	0	111.3
593	V	33.3	Very low	32	Very low	120 Å²	120	145.8 Å²	145.8	73%	0.727	75%	0.75	S	S	*	*			trans	-125.7	162.7	-164.3	175.7	0	0	0	0	112
594	S	32.6	Very low	32.1	Very low	102 Å²	102	148.8 Å²	148.8	71%	0.713	75%	0.75	S	S	*	*			trans	76.2	140.1	175.1	-64.9	0	0	0	0	115.9
595	T	35.2	Very low	32	Very low	129 Å²	129	146 Å²	146	79%	0.791	74%	0.744	S	S	*	*			cis	-164.2	158.9	-3.8	13.9	0	0	0	0	107.5
596	H	31.2	Very low	32	Very low	155 Å²	155	147.3 Å²	147.3	72%	0.718	75%	0.75	S	S	*	*			cis	-154.7	168.1	-4	173.6	61.6	0	0	0	108.3
597	L	30.9	Very low	31.9	Very low	145 Å²	145	147.2 Å²	147.2	76%	0.759	75%	0.75	S	S	*	*			trans	-150	117.7	177.6	-166.4	173.2	0	0	0	110.1
598	H	31.3	Very low	31.9	Very low	143 Å²	143	146.2 Å²	146.2	66%	0.662	74%	0.743	S	S	*	*			trans	171.9	161.5	163.1	-100.4	-153.2	0	0	0	107.2
599	H	32.1	Very low	31.8	Very low	149 Å²	149	143.1 Å²	143.1	69%	0.69	73%	0.731	S	S	*	*			cis	-144.3	140.4	-2.6	-139.8	41.6	0	0	0	104.7
600	Y	28.7	Very low	31.7	Very low	202 Å²	202	140.6 Å²	140.6	79%	0.792	73%	0.725	S	S	*	*				59.2	147.3	63.5	-108.6	-88.2	0	0	0	117.4
601	L	27.4	Very low	31.8	Very low	146 Å²	146	144.1 Å²	144.1	76%	0.764	74%	0.738	S	S	*	*			trans	-71.2	136.9	-156.5	-59.5	161.5	0	0	0	115.6
602	S	29.3	Very low	31.8	Very low	121 Å²	121	145.4 Å²	145.4	85%	0.846	74%	0.739	S	S	*	*			trans	165.1	143.3	152.1	-79.3	0	0	0	0	108.6
603	S	31.8	Very low	31.9	Very low	105 Å²	105	140 Å²	140	73%	0.734	73%	0.727	S	S	*	*			cis	-136.8	160.9	-12.6	-48.3	0	0	0	0	106
604	R	33.7	Very low	31.8	Very low	225 Å²	225	144 Å²	144	85%	0.849	74%	0.735	S	S	*	*			cis	55.1	90.1	48.6	-134.8	174.1	-168.2	169.1	2.9	114.6
605	D	29.3	Very low	32	Very low	135 Å²	135	143.9 Å²	143.9	72%	0.722	73%	0.732	S	S	*	*			trans	30.3	112.3	145.1	-38.6	-50.6	0	0	0	118.6
606	M	32.1	Very low	31.9	Very low	160 Å²	160	145.4 Å²	145.4	79%	0.788	73%	0.73	S	S	*	*				-149.6	115.3	125.4	-92.5	-47.3	158	0	0	112.3
607	Q	32.8	Very low	31.9	Very low	163 Å²	163	143.1 Å²	143.1	76%	0.762	73%	0.727	S	S	*	*			trans	32	124.7	136.2	-65.1	170.4	-4.4	0	0	120
608	S	30.6	Very low	31.9	Very low	66 Å²	66	142.6 Å²	142.6	46%	0.462	73%	0.725	S	S	.	*			trans	-64.6	158	146.9	60.5	0	0	0	0	111
609	I	33.6	Very low	32.2	Very low	101 Å²	101	144.1 Å²	144.1	52%	0.518	73%	0.729	S	S	.	*				-167.5	150	115	-93.8	144.2	0	0	0	109.5	Q970	I609-Q970 HydrophobicContact CD1-CG 4.06Å; I609-Q970 HydrophobicContact CG1-CG 4.14Å
610	D	32.6	Very low	32.2	Very low	111 Å²	111	144.4 Å²	144.4	59%	0.594	73%	0.731	S	S	*	*			trans	-71.7	140.3	176.1	-39.7	-93.2	0	0	0	111.2	R973	D610-R973 IonicContact OD2-CZ 2.81Å; D610-R973 IonicContact OD2-NH1 2.81Å; D610-R973 PolarHBondContact OD2-NH1 3.18Å; D610-R973 IonicContact OD2-NH2 3.17Å; D610-R973 PolarHBondContact OD2-NH2 2.97Å
611	E	32	Very low	32.7	Very low	190 Å²	190	142.2 Å²	142.2	89%	0.888	73%	0.728	S	S	*	*			trans	-151.6	147.5	145.9	-127.7	167.8	-139.2	0	0	111.2
612	Q	34.8	Very low	33.1	Very low	176 Å²	176	140.1 Å²	140.1	82%	0.822	72%	0.721	S	S	*	*			trans	-112.9	162	-177.9	-68.3	-175.5	-3.3	0	0	110.8
613	S	33.6	Very low	33.4	Very low	95 Å²	95	142 Å²	142	66%	0.664	72%	0.718	S	S	*	*			trans	68.3	106.5	157	40.8	0	0	0	0	120.2
614	F	31.2	Very low	33.6	Very low	205 Å²	205	144.4 Å²	144.4	90%	0.899	72%	0.723	S	S	*	*			trans	75.6	157.3	135.3	-74.8	-68.2	0	0	0	118.2
615	P	37.8	Very low	33.5	Very low	100 Å²	100	142.6 Å²	142.6	65%	0.649	73%	0.725	S	S	*	*				-137.4	-155.1	-125.5	43.8	-23.5	0	0	0	114.6
616	H	32.2	Very low	33.9	Very low	161 Å²	161	141.6 Å²	141.6	75%	0.745	73%	0.728	S	S	*	*			trans	93.5	119.7	163.7	-81.5	-64	0	0	0	119.5
617	T	31.6	Very low	34.2	Very low	106 Å²	106	142 Å²	142	65%	0.65	73%	0.728	S	S	*	*			trans	66.8	151.6	140.9	62.9	0	0	0	0	119.4
618	D	30.6	Very low	34.4	Very low	134 Å²	134	142.7 Å²	142.7	72%	0.717	74%	0.736	S	S	*	*			cis	-168.7	-179.3	-22.6	-96.4	-19.2	0	0	0	106.6
619	K	37.5	Very low	34.7	Very low	175 Å²	175	142.6 Å²	142.6	76%	0.761	75%	0.745	S	S	*	*			trans	83.4	112.9	165.7	-54.1	-179	-177.7	174.6	0	114.7
620	E	33.1	Very low	35.1	Very low	155 Å²	155	146.1 Å²	146.1	72%	0.724	76%	0.762	S	S	*	*				74.2	110.4	64.8	-69.4	176.2	130.3	0	0	113
621	H	38.3	Very low	35.5	Very low	156 Å²	156	147.4 Å²	147.4	72%	0.722	77%	0.769	S	S	*	*				178.1	112.9	112.9	-96.1	-63.8	0	0	0	109.6
622	T	36.8	Very low	35.9	Very low	103 Å²	103	145 Å²	145	63%	0.632	76%	0.762	S	S	*	*				61.9	140.9	99.1	62.4	0	0	0	0	115.6
623	M	36	Very low	36.3	Very low	159 Å²	159	143.7 Å²	143.7	78%	0.783	76%	0.76	S	S	*	*			cis	-171.5	162	-6.5	-114.3	168.9	174.1	0	0	109
624	N	34.6	Very low	36.8	Very low	157 Å²	157	147.6 Å²	147.6	84%	0.84	77%	0.768	S	S	*	*			trans	143.5	120.1	134.2	-75.2	-25.7	0	0	0	113.5
625	E	32.8	Very low	37.2	Very low	187 Å²	187	144.6 Å²	144.6	87%	0.874	76%	0.762	S	S	*	*			trans	-89.7	163	162.7	-59.6	157.5	93.3	0	0	110
626	S	38.2	Very low	37.6	Very low	114 Å²	114	148.1 Å²	148.1	80%	0.797	78%	0.775	S	S	*	*			trans	-160.3	151.5	151.8	-78.5	0	0	0	0	111.9
627	Q	37.4	Very low	38.3	Very low	169 Å²	169	146.8 Å²	146.8	79%	0.79	77%	0.774	S	S	*	*			trans	-47.6	155.1	-175.7	-70.3	105.3	-10.2	0	0	116.4
628	L	36.3	Very low	38.9	Very low	176 Å²	176	148.6 Å²	148.6	92%	0.921	78%	0.779	S	S	*	*			cis	74.7	118.3	44.3	-78.4	171.1	0	0	0	115.6
629	G	36.7	Very low	39.6	Very low	64 Å²	64	148.6 Å²	148.6	66%	0.66	78%	0.779	S	S	*	*			trans	138.6	121.8	-179.4	0	0	0	0	0	107.6
630	M	43	Very low	40	Very low	175 Å²	175	147.6 Å²	147.6	86%	0.862	78%	0.782	S	S	*	*			cis	103.7	138.1	41.1	-87.9	179.4	152.9	0	0	110.7
631	D	41.1	Very low	40.5	Very low	139 Å²	139	143.2 Å²	143.2	74%	0.743	78%	0.779	S	S	*	*			trans	64.6	158.6	171.6	-37.6	-30.2	0	0	0	113.8
632	D	40.3	Very low	40.9	Very low	140 Å²	140	143.2 Å²	143.2	75%	0.749	78%	0.784	S	S	*	*			cis	-179.1	-175.2	-42.6	-99.8	-26.1	0	0	0	103.3
633	D	43.3	Very low	41.2	Very low	147 Å²	147	145.6 Å²	145.6	79%	0.786	79%	0.793	S	S	*	*			trans	65.9	115.9	174	-51.7	-24.2	0	0	0	115.3
634	E	43.5	Very low	41.8	Very low	177 Å²	177	146 Å²	146	83%	0.827	80%	0.799	S	S	*	*				88.3	141.9	70	-79	-167.1	175.1	0	0	114.7
635	D	40.7	Very low	42.2	Very low	143 Å²	143	145.4 Å²	145.4	77%	0.765	80%	0.795	S	S	*	*			trans	-15.8	144.8	-179.6	-50.4	-23.3	0	0	0	121.5
636	D	46.4	Very low	42.5	Very low	173 Å²	173	142.9 Å²	142.9	93%	0.925	80%	0.797	S	S	*	*			trans	-154.3	136.7	136.1	-116.6	-26.2	0	0	0	110.7
637	D	46	Very low	42.7	Very low	134 Å²	134	144.5 Å²	144.5	72%	0.717	80%	0.797	S	S	*	*			trans	-102.4	161.8	-178.5	-81.5	-52.2	0	0	0	112
638	N	44.7	Very low	42.8	Very low	144 Å²	144	144 Å²	144	77%	0.77	80%	0.799	S	S	*	*			trans	70.8	174.4	167.7	-33.3	-71.6	0	0	0	114.6
639	D	45.4	Very low	43	Very low	133 Å²	133	141.2 Å²	141.2	71%	0.711	79%	0.789	S	S	*	*			cis	-150.2	-176.1	5.9	-139.5	-26.9	0	0	0	112.1
640	D	46.2	Very low	43.1	Very low	154 Å²	154	144.6 Å²	144.6	82%	0.824	80%	0.797	S	S	*	*			trans	73.9	144.9	165.3	-53.5	-40.2	0	0	0	118.6
641	G	43.6	Very low	42.8	Very low	64 Å²	64	141.6 Å²	141.6	66%	0.66	78%	0.784	S	S	*	*			cis	171.6	-179.6	-2.4	0	0	0	0	0	113
642	D	45.7	Very low	42.5	Very low	155 Å²	155	140 Å²	140	83%	0.829	78%	0.783	S	S	*	*			trans	73	78.6	162.6	-56.1	-5.4	0	0	0	120.5
643	D	44.5	Very low	42.1	Very low	153 Å²	153	140 Å²	140	82%	0.818	78%	0.783	S	S	*	*				38.7	134.1	116.6	-54.7	-13.2	0	0	0	123.5
644	D	47.4	Very low	41.6	Very low	169 Å²	169	137.8 Å²	137.8	90%	0.904	79%	0.785	S	S	*	*				-169.2	149.6	112.7	-117.7	-24.2	0	0	0	112.4
645	D	43.4	Very low	41.2	Very low	144 Å²	144	133.2 Å²	133.2	77%	0.77	78%	0.777	S	S	*	*			trans	-83.2	158.4	-164	-77.6	-45	0	0	0	117.9
646	C	39.7	Very low	40.8	Very low	134 Å²	134	133.7 Å²	133.7	91%	0.905	78%	0.778	S	S	*	*				-174.1	124.5	124	-94.3	0	0	0	0	113.4
647	D	41.5	Very low	40.2	Very low	148 Å²	148	131 Å²	131	79%	0.791	77%	0.769	S	S	*	*			trans	-79.1	155.5	177.6	-80.9	-62.1	0	0	0	114.7
648	D	40.7	Very low	39.4	Very low	157 Å²	157	129.9 Å²	129.9	84%	0.84	77%	0.771	S	S	*	*				-164.8	139.8	108.4	-121	-25.1	0	0	0	115.3
649	V	40.3	Very low	38.8	Very low	118 Å²	118	127.3 Å²	127.3	72%	0.715	77%	0.769	S	S	*	*			trans	-60.1	159.1	-174.1	-125.8	0	0	0	0	113.8
650	V	38.7	Very low	38.1	Very low	136 Å²	136	126.7 Å²	126.7	82%	0.824	78%	0.776	S	S	*	*				-163.1	138.9	66.8	166.2	0	0	0	0	113.3
651	N	36.3	Very low	37.5	Very low	111 Å²	111	123.7 Å²	123.7	59%	0.594	77%	0.772	S	S	*	*			trans	-76.2	156	172.2	-160.3	16.3	0	0	0	110.8	N653	N651-N653 PolarHBondContact OD1-ND2 3.24Å
652	C	34.5	Very low	36.9	Very low	106 Å²	106	126.9 Å²	126.9	72%	0.716	78%	0.778	S	S	*	*				-163.7	150	54.6	-62.6	0	0	0	0	110
653	N	32.8	Very low	36.1	Very low	140 Å²	140	124.7 Å²	124.7	75%	0.749	78%	0.775	S	S	*	*			cis	79	109.8	45.5	-90.1	-48.1	0	0	0	117.1	N651	N651-N653 PolarHBondContact OD1-ND2 3.24Å
654	A	32.9	Very low	35.5	Very low	101 Å²	101	122 Å²	122	84%	0.835	77%	0.769	S	S	*	*			trans	65.1	161.5	156.8	0	0	0	0	0	118.5
655	A	33.9	Very low	34.8	Very low	80 Å²	80	118.1 Å²	118.1	66%	0.661	76%	0.755	S	S	*	*			cis	-156.5	159.2	3.5	0	0	0	0	0	113.8
656	I	33.4	Very low	34.4	Very low	154 Å²	154	118.6 Å²	118.6	79%	0.79	75%	0.752	S	S	*	*			trans	62.6	101.1	136.6	-65.3	166.8	0	0	0	120.5
657	T	32.2	Very low	34.1	Very low	117 Å²	117	119 Å²	119	72%	0.718	74%	0.741	S	S	*	*				69.7	109.4	118	-48.4	0	0	0	0	123.6
658	S	29.4	Very low	33.8	Very low	110 Å²	110	116.7 Å²	116.7	77%	0.769	73%	0.728	S	S	*	*			trans	83.7	162.7	137.8	80.4	0	0	0	0	122.3
659	A	32.8	Very low	33.6	Very low	89 Å²	89	116.9 Å²	116.9	74%	0.736	72%	0.724	S	S	*	*			trans	61.9	116.5	-178.6	0	0	0	0	0	115.5
660	S	30	Very low	33.3	Very low	121 Å²	121	116.2 Å²	116.2	85%	0.846	72%	0.72	S	S	*	*			cis	86.8	130.1	47.9	-69	0	0	0	0	115
661	A	33.1	Very low	32.9	Very low	90 Å²	90	115.7 Å²	115.7	74%	0.744	71%	0.712	S	S	*	*			trans	86.6	111.4	151.5	0	0	0	0	0	121.4
662	V	31.4	Very low	32.7	Very low	131 Å²	131	118.3 Å²	118.3	79%	0.794	72%	0.721	S	S	*	*				88.3	119.6	121	171.6	0	0	0	0	120.6
663	S	30	Very low	32.4	Very low	109 Å²	109	118 Å²	118	76%	0.762	72%	0.72	S	S	*	*			trans	72.4	149.9	150.4	-73.7	0	0	0	0	120.8
664	S	31.5	Very low	32.3	Very low	97 Å²	97	118.8 Å²	118.8	68%	0.678	72%	0.723	S	S	*	*			cis	-166.6	165.8	-13.3	51.3	0	0	0	0	114
665	S	32	Very low	32.1	Very low	88 Å²	88	118.4 Å²	118.4	62%	0.615	72%	0.715	S	S	*	*			trans	56.5	106.3	139.1	60.6	0	0	0	0	121.9
666	H	35.5	Very low	31.8	Very low	154 Å²	154	119.6 Å²	119.6	71%	0.713	72%	0.718	S	S	*	*				170.3	124.7	104.1	-94.2	-28.8	0	0	0	109.5
667	E	33.9	Very low	31.6	Very low	142 Å²	142	117.6 Å²	117.6	66%	0.664	72%	0.718	S	S	*	*				76.1	140.1	87.1	-77.9	-179	-134.5	0	0	114.3
668	N	35	Very low	31.5	Very low	99 Å²	99	117.3 Å²	117.3	53%	0.529	72%	0.72	S	S	.	*			cis	-156.3	154.4	15.1	-117.5	-29.7	0	0	0	114.5
669	H	35.6	Very low	31.3	Very low	161 Å²	161	118.7 Å²	118.7	75%	0.745	72%	0.724	S	S	*	*			trans	61	152.2	147.2	-65.6	-27.9	0	0	0	120.7
670	V	34.3	Very low	31.4	Very low	105 Å²	105	122.9 Å²	122.9	64%	0.636	73%	0.725	S	S	*	*			cis	-161.1	146.6	-5.4	114.7	0	0	0	0	111.4
671	N	30.6	Very low	31.4	Very low	124 Å²	124	125 Å²	125	66%	0.663	73%	0.725	S	S	*	*			trans	36.6	152	149.8	-54.7	-17.9	0	0	0	122.5
672	Q	32.5	Very low	31.4	Very low	167 Å²	167	127.5 Å²	127.5	78%	0.78	73%	0.726	S	S	*	*			cis	-157.4	172.9	-0.3	-122	159.4	21.8	0	0	111.4
673	S	27.2	Very low	31.5	Very low	98 Å²	98	126 Å²	126	69%	0.685	71%	0.714	S	S	*	*			trans	-56.2	147.6	-178.1	52.1	0	0	0	0	117.8
674	L	31	Very low	31.9	Very low	157 Å²	157	125.9 Å²	125.9	82%	0.822	71%	0.71	S	S	*	*				-173	134.3	112	-98.8	165.9	0	0	0	115.5
675	S	28	Very low	32.3	Very low	94 Å²	94	128.3 Å²	128.3	66%	0.657	71%	0.708	S	S	*	*			trans	26.5	129	152.3	57.5	0	0	0	0	124.7
676	S	27.6	Very low	32.6	Very low	105 Å²	105	130.2 Å²	130.2	73%	0.734	71%	0.711	S	S	*	*			trans	57	116.6	141	60.1	0	0	0	0	120
677	S	30	Very low	32.7	Very low	111 Å²	111	127.9 Å²	127.9	78%	0.776	71%	0.708	S	S	*	*				-169.3	144.7	70.1	-72	0	0	0	0	115.2	V679	S677-V679 PolarHBondContact O-N 3.36Å
678	S	29.1	Very low	32.9	Very low	111 Å²	111	123.8 Å²	123.8	78%	0.776	70%	0.698	S	S	*	*			trans	-15.2	102.1	169.4	-54	0	0	0	0	120.1
679	V	26.9	Very low	33	Very low	139 Å²	139	124.9 Å²	124.9	84%	0.842	70%	0.704	S	S	*	*			trans	-77.6	115.5	153.8	177.1	0	0	0	0	108.8	S677	S677-V679 PolarHBondContact O-N 3.36Å
680	K	33	Very low	33.2	Very low	177 Å²	177	123.2 Å²	123.2	77%	0.77	70%	0.699	S	S	*	*			trans	-99.3	113.2	170.6	-76.5	-174.9	177.4	177.8	0	110.1	L682	K680-L682 PolarHBondContact O-N 3.45Å
681	I	30.1	Very low	33	Very low	165 Å²	165	126.8 Å²	126.8	85%	0.846	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-62.3	126.5	170.8	-60	168.4	0	0	0	108.3
682	L	33.2	Very low	33.5	Very low	143 Å²	143	126.6 Å²	126.6	75%	0.749	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-89.1	154.5	177.8	-105.6	80.8	0	0	0	112.7	K680	K680-L682 PolarHBondContact O-N 3.45Å
683	D	35.1	Very low	33.9	Very low	101 Å²	101	125.5 Å²	125.5	54%	0.54	69%	0.694	S	S	.	*	P	Polyproline II helix	trans	-70.3	130.3	-170.2	-136.8	-55.1	0	0	0	112.4	K685 L686	D683-K685 PolarHBondContact O-N 3.28Å; D683-L686 PolarHBondContact O-N 2.97Å
684	P	38.2	Very low	34.3	Very low	105 Å²	105	128.1 Å²	128.1	68%	0.682	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	0.5	179.1	27.2	-35.9	0	0	0	114.5
685	K	40.2	Very low	34.7	Very low	149 Å²	149	125.7 Å²	125.7	65%	0.648	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-16	177.5	-71	172.1	-177.2	157.3	0	114.5	D683 N689	D683-K685 PolarHBondContact O-N 3.28Å; K685-N689 PolarHBondContact O-ND2 3.29Å
686	L	37.9	Very low	35	Very low	128 Å²	128	126.6 Å²	126.6	67%	0.67	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-43.6	177.9	-131.8	72	0	0	0	111.6	D683 A688 N689	D683-L686 PolarHBondContact O-N 2.97Å; L686-A688 PolarHBondContact O-N 2.87Å; L686-N689 PolarHBondContact O-N 3.45Å
687	T	37.7	Very low	35.3	Very low	105 Å²	105	125.8 Å²	125.8	64%	0.644	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-39	-176.4	-40	0	0	0	0	113	N689 L690	T687-N689 PolarHBondContact O-N 2.91Å; T687-L690 PolarHBondContact O-N 3.43Å
688	A	37.2	Very low	35.4	Very low	55 Å²	55	125.2 Å²	125.2	46%	0.455	66%	0.663	S	S	.	*	H	α-helix	trans	-63.9	-26.1	179.5	0	0	0	0	0	113.8	L686	L686-A688 PolarHBondContact O-N 2.87Å
689	N	37.3	Very low	35.7	Very low	122 Å²	122	129.1 Å²	129.1	65%	0.652	67%	0.666	S	S	*	*	H	α-helix	trans	-86.5	-10.8	-178.7	-75	-75.4	0	0	0	113.7	K685 L686 T687	K685-N689 PolarHBondContact O-ND2 3.29Å; L686-N689 PolarHBondContact O-N 3.45Å; T687-N689 PolarHBondContact O-N 2.91Å
690	L	39.2	Very low	36	Very low	126 Å²	126	131.3 Å²	131.3	66%	0.66	67%	0.667	S	S	*	*	H	α-helix	trans	-87.1	-39.6	173.9	-77.7	162.6	0	0	0	111.8	T687 L692	T687-L690 PolarHBondContact O-N 3.43Å; L690-L692 PolarHBondContact O-N 3.34Å
691	Y	31.3	Very low	35.8	Very low	181 Å²	181	132.3 Å²	132.3	71%	0.71	67%	0.666	S	S	*	*	H	α-helix	trans	-71.8	-30.2	-178.8	-140.3	-102.1	0	0	0	113.5	I695	Y691-I695 HydrophobicContact CD1-CD1 4.43Å
692	L	40.7	Very low	35.7	Very low	120 Å²	120	132 Å²	132	63%	0.628	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-16.5	179.2	-92.9	161.9	0	0	0	114.7	L690	L690-L692 PolarHBondContact O-N 3.34Å
693	K	40	Very low	35.6	Very low	143 Å²	143	133.2 Å²	133.2	62%	0.622	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-34	173.3	-164.3	178.3	179.3	-170.4	0	111.6	I695	K693-I695 VanDerWaalsContact C-N 3.25Å; K693-I695 PolarHBondContact O-N 2.91Å
694	Q	35.6	Very low	35.2	Very low	154 Å²	154	131.5 Å²	131.5	72%	0.72	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-1.7	-170.8	-141.3	163.4	-3	0	0	115
695	I	39.3	Very low	34.6	Very low	105 Å²	105	132.2 Å²	132.2	54%	0.538	69%	0.685	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.1	-24.6	-177.4	-66.4	175	0	0	0	112.7	Y691 K693	Y691-I695 HydrophobicContact CD1-CD1 4.43Å; K693-I695 VanDerWaalsContact C-N 3.25Å; K693-I695 PolarHBondContact O-N 2.91Å
696	N	35.4	Very low	34.1	Very low	114 Å²	114	134.4 Å²	134.4	61%	0.61	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-35.4	-179.8	-68.7	-26.7	0	0	0	112.8	S698 K699	N696-S698 PolarHBondContact O-N 3.19Å; N696-K699 PolarHBondContact O-N 2.73Å
697	D	33.8	Very low	33.4	Very low	88 Å²	88	133.8 Å²	133.8	47%	0.471	70%	0.7	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70	10.8	-174.9	-58.8	-3.6	0	0	0	114.2	R701	D697-R701 PolarHBondContact O-NH2 2.89Å
698	S	32.8	Very low	32.8	Very low	99 Å²	99	138.9 Å²	138.9	69%	0.692	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.5	9.4	-173.3	-60.4	0	0	0	0	115.2	N696	N696-S698 PolarHBondContact O-N 3.19Å
699	K	35.6	Very low	32.2	Very low	193 Å²	193	140.8 Å²	140.8	84%	0.839	72%	0.718	S	S	*	*	S	Bend	trans	-117.3	-5.7	179.9	-86.5	-167.8	173.1	-174.1	0	117.2	N696	N696-K699 PolarHBondContact O-N 2.73Å
700	E	32.6	Very low	31.6	Very low	185 Å²	185	139 Å²	139	86%	0.864	72%	0.715	S	S	*	*	S	Bend	trans	-113.7	13.3	-175.4	-62.1	-171	145	0	0	114.5
701	R	28.3	Very low	30.9	Very low	198 Å²	198	140.9 Å²	140.9	75%	0.747	72%	0.718	S	S	*	*	S	Bend	trans	-121.6	63.1	175.8	-77.2	-178.8	-69.4	157	0.7	113.1	D697	D697-R701 PolarHBondContact O-NH2 2.89Å
702	N	28.4	Very low	30.7	Very low	158 Å²	158	139.3 Å²	139.3	85%	0.845	72%	0.722	S	S	*	*			trans	-163.9	168.7	154.2	-113.4	-43.5	0	0	0	110.6
703	I	30.3	Very low	30	Very low	169 Å²	169	138.3 Å²	138.3	87%	0.867	73%	0.725	S	S	*	*			trans	77.4	63.1	-172.9	-43.7	172.4	0	0	0	113.1
704	G	26.4	Very low	29.6	Very low	65 Å²	65	137.2 Å²	137.2	67%	0.67	73%	0.73	S	S	*	*			trans	-94.8	146.3	144.8	0	0	0	0	0	109.5
705	S	26.4	Very low	29.4	Very low	120 Å²	120	135.6 Å²	135.6	84%	0.839	73%	0.726	S	S	*	*			trans	46	101.7	171.6	62	0	0	0	0	118.1
706	E	29.5	Very low	28.9	Very low	194 Å²	194	136.9 Å²	136.9	91%	0.907	73%	0.73	S	S	*	*				-143.9	163	125.6	-133	167.9	-140.3	0	0	110.7
707	T	24.5	Very low	28.9	Very low	116 Å²	116	138.9 Å²	138.9	71%	0.712	74%	0.741	S	S	*	*			trans	-124.2	174.7	-167.4	50.8	0	0	0	0	111.6
708	Y	25.1	Very low	28.6	Very low	212 Å²	212	143.7 Å²	143.7	83%	0.831	75%	0.752	S	S	*	*			trans	75	111	167.6	-77.3	-78.3	0	0	0	119.4
709	S	23.6	Very low	28.5	Very low	95 Å²	95	146.7 Å²	146.7	66%	0.664	76%	0.759	S	S	*	*				91.9	124.5	115	-162	0	0	0	0	119.5
710	S	24.1	Very low	28.2	Very low	83 Å²	83	141.1 Å²	141.1	58%	0.58	74%	0.741	S	S	*	*			trans	74.4	147.9	143.2	-65.1	0	0	0	0	118.4
711	K	25.9	Very low	28.1	Very low	166 Å²	166	137.6 Å²	137.6	72%	0.722	74%	0.735	S	S	*	*			cis	-167.1	156.8	-16.1	-115.7	164	-165.6	163	0	108.6
712	N	26.5	Very low	28	Very low	149 Å²	149	133.9 Å²	133.9	80%	0.797	73%	0.731	S	S	*	*			trans	65.8	164.9	151.5	-64.3	0.7	0	0	0	117.7
713	S	26.7	Very low	28.2	Very low	99 Å²	99	133.5 Å²	133.5	69%	0.692	73%	0.729	S	S	*	*			cis	-178.2	-175	-32.7	-169.9	0	0	0	0	107
714	V	30.8	Very low	28.1	Very low	119 Å²	119	129.6 Å²	129.6	72%	0.721	72%	0.716	S	S	*	*			trans	72.1	127.3	160.8	173.3	0	0	0	0	114.3
715	N	31.1	Very low	28.2	Very low	121 Å²	121	135.8 Å²	135.8	65%	0.647	73%	0.725	S	S	*	*			cis	-168.1	172.2	-0.5	-114.3	17.5	0	0	0	108.1
716	E	29.6	Very low	28.4	Very low	131 Å²	131	136.6 Å²	136.6	61%	0.612	72%	0.718	S	S	*	*			cis	-163.1	-165.2	-24	-130.8	-177.3	146.4	0	0	108.4
717	N	34.4	Very low	28.3	Very low	157 Å²	157	135.4 Å²	135.4	84%	0.84	71%	0.713	S	S	*	*			trans	82	83.2	-180	-52.2	-35.8	0	0	0	114.7
718	R	27.8	Very low	28.6	Very low	189 Å²	189	137.1 Å²	137.1	71%	0.713	72%	0.718	S	S	*	*			cis	76.4	110.9	38.7	-167.8	-173.7	177.1	170.8	1.8	115.5	V720	R718-V720 HydrophobicContact CG-CG2 4.14Å
719	I	31	Very low	29	Very low	162 Å²	162	134 Å²	134	83%	0.831	72%	0.715	S	S	*	*			trans	-159.8	99.6	140.4	-91.1	146.4	0	0	0	104.2
720	V	28.3	Very low	29.1	Very low	75 Å²	75	138.4 Å²	138.4	46%	0.455	73%	0.725	S	S	.	*				36.5	138.4	92.3	-107.7	0	0	0	0	114.9	R718	R718-V720 HydrophobicContact CG-CG2 4.14Å
721	C	30.4	Very low	29.3	Very low	111 Å²	111	141.8 Å²	141.8	75%	0.75	74%	0.736	S	S	*	*			cis	-142.3	179.5	15.7	-74.8	0	0	0	0	110.5
722	D	28.1	Very low	29.5	Very low	121 Å²	121	141.6 Å²	141.6	65%	0.647	74%	0.742	S	S	*	*			cis	-171.3	-167.4	-40.4	-81.9	-27.6	0	0	0	107.1
723	D	31.2	Very low	29.5	Very low	150 Å²	150	142.6 Å²	142.6	80%	0.802	74%	0.744	S	S	*	*			trans	65.6	124.8	174.4	-68.9	-39.5	0	0	0	119
724	S	27.9	Very low	29.8	Very low	87 Å²	87	143.4 Å²	143.4	61%	0.608	75%	0.745	S	S	*	*			cis	88.1	102.7	34	97.8	0	0	0	0	115.3
725	F	29.9	Very low	29.6	Very low	195 Å²	195	149.6 Å²	149.6	86%	0.855	76%	0.755	S	S	*	*				-173.3	158.3	114.5	-120.5	-97.9	0	0	0	112.7
726	I	29.9	Very low	29.6	Very low	136 Å²	136	147.6 Å²	147.6	70%	0.697	76%	0.763	S	S	*	*			trans	-122.8	149.7	-178.7	-71.6	176.7	0	0	0	109.5
727	E	28.3	Very low	29.5	Very low	169 Å²	169	146.5 Å²	146.5	79%	0.79	77%	0.771	S	S	*	*			trans	42.2	123.3	166.4	-71.6	174.4	121.2	0	0	119.5
728	N	30.6	Very low	29.2	Very low	152 Å²	152	146.9 Å²	146.9	81%	0.813	77%	0.773	S	S	*	*				-162	165.6	125.8	-112.9	-70.9	0	0	0	112.9
729	N	33.1	Very low	29.4	Very low	146 Å²	146	143 Å²	143	78%	0.781	78%	0.775	S	S	*	*			trans	70.2	76.9	171.1	-56.9	-51.7	0	0	0	118	L731	N729-L731 PolarHBondContact O-N 2.78Å
730	Q	25.9	Very low	29.5	Very low	188 Å²	188	141.4 Å²	141.4	88%	0.879	76%	0.763	S	S	*	*			trans	-64.7	110	136.6	-63.3	175.9	8	0	0	108.8
731	L	27.9	Very low	29.8	Very low	155 Å²	155	146.2 Å²	146.2	81%	0.812	78%	0.779	S	S	*	*			trans	169.4	109.6	144.3	-115.4	68.8	0	0	0	110.3	N729	N729-L731 PolarHBondContact O-N 2.78Å
732	L	30.6	Very low	29.8	Very low	162 Å²	162	145.6 Å²	145.6	85%	0.848	77%	0.774	S	S	*	*				-173.7	127.3	105.3	-141.6	69.5	0	0	0	111.3
733	M	27.1	Very low	30.1	Very low	169 Å²	169	142.2 Å²	142.2	83%	0.833	77%	0.768	S	S	*	*			trans	-78.9	136.2	162	-72.5	-84.7	-160.7	0	0	109.2
734	T	31.9	Very low	30.5	Very low	117 Å²	117	142.4 Å²	142.4	72%	0.718	76%	0.757	S	S	*	*				169.9	137.4	112.6	34.3	0	0	0	0	114.8
735	R	27.8	Very low	31.1	Very low	248 Å²	248	143.6 Å²	143.6	94%	0.936	75%	0.754	S	S	*	*			trans	61.5	105.3	147.4	-65.8	171.5	176	172	-1.6	119
736	G	30.3	Very low	31.6	Very low	79 Å²	79	141.9 Å²	141.9	81%	0.814	75%	0.746	S	S	*	*			trans	-168.6	76.7	164.5	0	0	0	0	0	111.6
737	S	27.5	Very low	32.3	Very low	109 Å²	109	144.4 Å²	144.4	76%	0.762	75%	0.747	S	S	*	*			trans	-69	161.2	-171	-50.1	0	0	0	0	114.5
738	N	26.9	Very low	33.5	Very low	165 Å²	165	141.7 Å²	141.7	88%	0.882	73%	0.734	S	S	*	*	S	Bend	trans	94.6	59.7	165.1	-49.4	-17.6	0	0	0	117.9
739	S	33.4	Very low	34.3	Very low	108 Å²	108	137.9 Å²	137.9	76%	0.755	71%	0.714	S	S	*	*			trans	-149.9	-27.3	158.8	64.1	0	0	0	0	116	F741	S739-F741 VanDerWaalsContact C-N 3.3Å; S739-F741 PolarHBondContact O-N 3.18Å
740	E	32.3	Very low	35.4	Very low	127 Å²	127	136 Å²	136	59%	0.593	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-19.1	-165.2	-70.5	-160.5	178.2	0	0	117.9	C742 G743 R744	E740-C742 PolarHBondContact O-N 2.9Å; E740-G743 PolarHBondContact O-N 3.5Å; E740-G743 VanDerWaalsContact O-N 3.14Å; E740-R744 IonicContact OE2-CZ 3.53Å; E740-R744 IonicContact OE2-NE 3.58Å; E740-R744 PolarHBondContact OE2-NE 2.91Å; E740-R744 IonicContact OE2-NH2 2.69Å; E740-R744 PolarHBondContact OE2-NH2 3.01Å
741	F	34.2	Very low	37.1	Very low	177 Å²	177	130.3 Å²	130.3	78%	0.776	68%	0.677	S	S	*	*	H	α-helix	trans	-61.5	-40	-165	-153.6	-91.7	0	0	0	113.4	S739 G743	S739-F741 VanDerWaalsContact C-N 3.3Å; S739-F741 PolarHBondContact O-N 3.18Å; F741-G743 PolarHBondContact O-N 3.38Å
742	C	31.9	Very low	38.8	Very low	97 Å²	97	129.4 Å²	129.4	66%	0.655	66%	0.663	S	S	*	*	H	α-helix	trans	-71.4	-29.3	-179.5	-169.3	0	0	0	0	113	E740 F746	E740-C742 PolarHBondContact O-N 2.9Å; C742-F746 WeakPolarHBondContact O-CB 3.5Å; C742-F746 PolarHBondContact O-N 3.44Å
743	G	34	Very low	40.2	Very low	50 Å²	50	128 Å²	128	52%	0.515	65%	0.65	S	S	.	*	H	α-helix	trans	-72.7	-36.7	-176.9	0	0	0	0	0	113.8	E740 F741 R747	E740-G743 PolarHBondContact O-N 3.5Å; E740-G743 VanDerWaalsContact O-N 3.14Å; F741-G743 PolarHBondContact O-N 3.38Å; G743-R747 WeakPolarHBondContact O-CB 3.38Å; G743-R747 PolarHBondContact O-N 3.29Å
744	R	38.5	Very low	41.8	Very low	154 Å²	154	123.4 Å²	123.4	58%	0.581	63%	0.628	S	S	*	*	H	α-helix	trans	-71.1	-48.9	178.2	-62.7	-173.9	-172.4	-136.5	2.7	111.3	E740 F746 R747 E748	E740-R744 IonicContact OE2-CZ 3.53Å; E740-R744 IonicContact OE2-NE 3.58Å; E740-R744 PolarHBondContact OE2-NE 2.91Å; E740-R744 IonicContact OE2-NH2 2.69Å; E740-R744 PolarHBondContact OE2-NH2 3.01Å; R744-F746 VanDerWaalsContact C-N 3.31Å; R744-F746 PolarHBondContact O-N 2.94Å; R744-R747 PolarHBondContact O-N 3.5Å; R744-R747 VanDerWaalsContact O-N 3.15Å; R744-E748 WeakPolarHBondContact O-CB 3.29Å; R744-E748 WeakPolarHBondContact O-CG 3.47Å; R744-E748 PolarHBondContact O-N 3.43Å
745	E	40.9	Very low	43.3	Very low	113 Å²	113	122.3 Å²	122.3	53%	0.528	62%	0.618	S	S	.	*	H	α-helix	trans	-61.6	-36.7	-179.5	-173	172.5	-144.3	0	0	112.6	N749	E745-N749 WeakPolarHBondContact O-CB 3.5Å; E745-N749 PolarHBondContact O-N 2.9Å; E745-N749 PolarHBondContact O-ND2 2.78Å
746	F	41.1	Very low	45	Very low	159 Å²	159	115.4 Å²	115.4	70%	0.697	60%	0.596	S	S	*	*	H	α-helix	trans	-68.9	-43.7	174	-162.8	-89.8	0	0	0	112.2	C742 R744 N749 F750	C742-F746 WeakPolarHBondContact O-CB 3.5Å; C742-F746 PolarHBondContact O-N 3.44Å; R744-F746 VanDerWaalsContact C-N 3.31Å; R744-F746 PolarHBondContact O-N 2.94Å; F746-N749 PolarHBondContact O-N 3.07Å; F746-F750 WeakPolarHBondContact O-CB 3.41Å; F746-F750 PolarHBondContact O-N 3.16Å
747	R	44.9	Very low	46.5	Very low	189 Å²	189	116.2 Å²	116.2	71%	0.713	58%	0.581	S	S	*	*	H	α-helix	trans	-64.4	-41.6	177.4	-178.6	175.8	171.5	-176.8	-3.3	112	G743 R744 F750 T751	G743-R747 WeakPolarHBondContact O-CB 3.38Å; G743-R747 PolarHBondContact O-N 3.29Å; R744-R747 PolarHBondContact O-N 3.5Å; R744-R747 VanDerWaalsContact O-N 3.15Å; R747-F750 PolarHBondContact O-N 2.82Å; R747-T751 PolarHBondContact O-N 2.87Å; R747-T751 PolarHBondContact O-OG1 2.96Å
748	E	52.8	Low	48.1	Very low	111 Å²	111	115.2 Å²	115.2	52%	0.519	57%	0.567	S	S	.	*	H	α-helix	trans	-67.5	-40.9	176.8	-74	173.6	-152.8	0	0	112	R744 T751 R752	R744-E748 WeakPolarHBondContact O-CB 3.29Å; R744-E748 WeakPolarHBondContact O-CG 3.47Å; R744-E748 PolarHBondContact O-N 3.43Å; E748-T751 PolarHBondContact O-N 3.48Å; E748-R752 VanDerWaalsContact O-CB 3.23Å; E748-R752 WeakPolarHBondContact O-CB 3.38Å; E748-R752 PolarHBondContact O-N 3.15Å
749	N	47.8	Very low	50	Low	73 Å²	73	110.7 Å²	110.7	39%	0.39	55%	0.548	S	S	.	.	H	α-helix	trans	-65.6	-37.4	172.4	-81.8	-59.5	0	0	0	112.4	E745 F746 R752 K753	E745-N749 WeakPolarHBondContact O-CB 3.5Å; E745-N749 PolarHBondContact O-N 2.9Å; E745-N749 PolarHBondContact O-ND2 2.78Å; F746-N749 PolarHBondContact O-N 3.07Å; N749-R752 PolarHBondContact O-N 3.04Å; N749-R752 PolarHBondContact OD1-NH1 3.39Å; N749-K753 VanDerWaalsContact O-CB 3.25Å; N749-K753 WeakPolarHBondContact O-CB 3.33Å; N749-K753 PolarHBondContact O-N 2.89Å
750	F	55.8	Low	51.3	Low	106 Å²	106	114.1 Å²	114.1	47%	0.465	55%	0.545	S	S	.	.	H	α-helix	trans	-64.1	-46.5	174.2	-176.1	-102	0	0	0	111.8	F746 R747 K753 L754	F746-F750 WeakPolarHBondContact O-CB 3.41Å; F746-F750 PolarHBondContact O-N 3.16Å; R747-F750 PolarHBondContact O-N 2.82Å; F750-K753 PolarHBondContact O-N 3.45Å; F750-L754 HydrophobicContact CD1-CD1 3.89Å; F750-L754 HydrophobicContact CE1-CD1 3.45Å; F750-L754 VanDerWaalsContact CE1-CD1 3.45Å; F750-L754 HydrophobicContact CE1-CG 4.26Å; F750-L754 HydrophobicContact CZ-CD1 3.97Å; F750-L754 HydrophobicContact CZ-CG 4.41Å; F750-L754 PolarHBondContact O-N 3.25Å
751	T	60.5	Low	53.1	Low	68 Å²	68	110.4 Å²	110.4	42%	0.417	53%	0.527	S	S	.	.	H	α-helix	trans	-63.3	-42.5	175.1	-56.3	0	0	0	0	112	R747 E748 K753 L754 N755	R747-T751 PolarHBondContact O-N 2.87Å; R747-T751 PolarHBondContact O-OG1 2.96Å; E748-T751 PolarHBondContact O-N 3.48Å; T751-K753 VanDerWaalsContact C-N 3.33Å; T751-K753 PolarHBondContact O-N 3.27Å; T751-L754 PolarHBondContact O-N 3.24Å; T751-N755 VanDerWaalsContact O-CG 3.31Å; T751-N755 PolarHBondContact O-N 3.18Å; T751-N755 PolarHBondContact O-OD1 3.33Å
752	R	65.1	Low	54.7	Low	136 Å²	136	107.4 Å²	107.4	51%	0.513	52%	0.515	S	S	.	.	H	α-helix	trans	-59	-43.9	174.9	-174.1	-178.9	-65	131.4	1	111.3	E748 N749 N755 E756	E748-R752 VanDerWaalsContact O-CB 3.23Å; E748-R752 WeakPolarHBondContact O-CB 3.38Å; E748-R752 PolarHBondContact O-N 3.15Å; N749-R752 PolarHBondContact O-N 3.04Å; N749-R752 PolarHBondContact OD1-NH1 3.39Å; R752-N755 PolarHBondContact O-N 3.13Å; R752-E756 PolarHBondContact O-N 3.41Å
753	K	59.9	Low	56.7	Low	134 Å²	134	109.4 Å²	109.4	58%	0.583	52%	0.515	S	S	*	.	H	α-helix	trans	-72.7	-33.1	-179.2	-163.6	169.1	-173.4	176.4	0	113.3	N749 F750 T751 E756 I757	N749-K753 VanDerWaalsContact O-CB 3.25Å; N749-K753 WeakPolarHBondContact O-CB 3.33Å; N749-K753 PolarHBondContact O-N 2.89Å; F750-K753 PolarHBondContact O-N 3.45Å; T751-K753 VanDerWaalsContact C-N 3.33Å; T751-K753 PolarHBondContact O-N 3.27Å; K753-E756 PolarHBondContact O-N 2.89Å; K753-I757 HydrophobicContact CG-CD1 4.49Å; K753-I757 WeakPolarHBondContact O-CD1 3.33Å; K753-I757 VanDerWaalsContact O-CG1 3.27Å; K753-I757 WeakPolarHBondContact O-CG1 3.44Å; K753-I757 PolarHBondContact O-N 3.1Å
754	L	59.5	Low	58.1	Low	72 Å²	72	112.6 Å²	112.6	38%	0.377	52%	0.517	S	S	.	.	H	α-helix	trans	-62.2	-44.3	168.1	-82.7	172.3	0	0	0	111.4	F750 T751 I757 N758	F750-L754 HydrophobicContact CD1-CD1 3.89Å; F750-L754 HydrophobicContact CE1-CD1 3.45Å; F750-L754 VanDerWaalsContact CE1-CD1 3.45Å; F750-L754 HydrophobicContact CE1-CG 4.26Å; F750-L754 HydrophobicContact CZ-CD1 3.97Å; F750-L754 HydrophobicContact CZ-CG 4.41Å; F750-L754 PolarHBondContact O-N 3.25Å; T751-L754 PolarHBondContact O-N 3.24Å; L754-I757 PolarHBondContact O-N 3.41Å; L754-N758 PolarHBondContact O-N 2.89Å
755	N	63.8	Low	59.2	Low	93 Å²	93	109.6 Å²	109.6	50%	0.497	51%	0.509	S	S	.	.	H	α-helix	trans	-64.6	-40.2	177.1	-67.3	-2.8	0	0	0	111.8	T751 R752 I757 N758 S759	T751-N755 VanDerWaalsContact O-CG 3.31Å; T751-N755 PolarHBondContact O-N 3.18Å; T751-N755 PolarHBondContact O-OD1 3.33Å; R752-N755 PolarHBondContact O-N 3.13Å; N755-I757 VanDerWaalsContact C-N 3.31Å; N755-I757 PolarHBondContact O-N 2.92Å; N755-N758 PolarHBondContact O-N 2.64Å; N755-S759 PolarHBondContact O-N 3.17Å; N755-S759 PolarHBondContact O-OG 2.91Å
756	E	64.4	Low	60.8	Low	104 Å²	104	110.5 Å²	110.5	49%	0.486	51%	0.513	S	S	.	.	H	α-helix	trans	-60.1	-38	172.3	-75.1	-173.7	148.8	0	0	113.1	R752 K753 R760	R752-E756 PolarHBondContact O-N 3.41Å; K753-E756 PolarHBondContact O-N 2.89Å; E756-R760 WeakPolarHBondContact O-CB 3.12Å; E756-R760 WeakPolarHBondContact O-CG 3.35Å; E756-R760 PolarHBondContact O-N 3.3Å; E756-R760 VanDerWaalsContact O-N 3.15Å
757	I	61.1	Low	62.3	Low	95 Å²	95	109.7 Å²	109.7	49%	0.487	51%	0.507	S	S	.	.	H	α-helix	trans	-69.4	-46	177.6	-70.9	164.2	0	0	0	110.3	K753 L754 N755 R760 H761	K753-I757 HydrophobicContact CG-CD1 4.49Å; K753-I757 WeakPolarHBondContact O-CD1 3.33Å; K753-I757 VanDerWaalsContact O-CG1 3.27Å; K753-I757 WeakPolarHBondContact O-CG1 3.44Å; K753-I757 PolarHBondContact O-N 3.1Å; L754-I757 PolarHBondContact O-N 3.41Å; N755-I757 VanDerWaalsContact C-N 3.31Å; N755-I757 PolarHBondContact O-N 2.92Å; I757-R760 PolarHBondContact O-N 2.93Å; I757-H761 PolarHBondContact O-N 3.49Å
758	N	60.4	Low	63.2	Low	89 Å²	89	102.9 Å²	102.9	48%	0.476	48%	0.484	S	S	.	.	H	α-helix	trans	-60.7	-49.6	177.9	-75.2	3.3	0	0	0	111.7	L754 N755 R760 H761 E762	L754-N758 PolarHBondContact O-N 2.89Å; N755-N758 PolarHBondContact O-N 2.64Å; N758-R760 VanDerWaalsContact C-N 3.29Å; N758-R760 PolarHBondContact O-N 3.13Å; N758-H761 WeakPolarHBondContact O-CB 3.45Å; N758-H761 PolarHBondContact O-N 2.82Å; N758-E762 WeakPolarHBondContact O-CG 3.25Å; N758-E762 PolarHBondContact O-N 3.19Å
759	S	68.6	Low	64.1	Low	70 Å²	70	102 Å²	102	49%	0.49	48%	0.483	S	S	.	.	H	α-helix	trans	-68.1	-25.7	-180	-63.9	0	0	0	0	113.8	N755 E762 H763	N755-S759 PolarHBondContact O-N 3.17Å; N755-S759 PolarHBondContact O-OG 2.91Å; S759-E762 WeakPolarHBondContact CA-OE2 3.47Å; S759-H763 WeakPolarHBondContact O-CB 3.43Å; S759-H763 PolarHBondContact O-N 3.27Å; S759-H763 VanDerWaalsContact O-N 3.13Å
760	R	60.6	Low	65.2	Low	179 Å²	179	104.7 Å²	104.7	68%	0.675	49%	0.494	S	S	*	.	H	α-helix	trans	-66.9	-44.2	167.3	-76.4	172.1	-171.2	-129.7	3.9	111.3	E756 I757 N758 H763 E764	E756-R760 WeakPolarHBondContact O-CB 3.12Å; E756-R760 WeakPolarHBondContact O-CG 3.35Å; E756-R760 PolarHBondContact O-N 3.3Å; E756-R760 VanDerWaalsContact O-N 3.15Å; I757-R760 PolarHBondContact O-N 2.93Å; N758-R760 VanDerWaalsContact C-N 3.29Å; N758-R760 PolarHBondContact O-N 3.13Å; R760-H763 PolarHBondContact O-N 3.39Å; R760-E764 WeakPolarHBondContact O-CB 3.43Å; R760-E764 PolarHBondContact O-N 3.4Å
761	H	68.3	Low	65.9	Low	50 Å²	50	105.1 Å²	105.1	23%	0.231	50%	0.496	C	S	.	.	H	α-helix	trans	-65.9	-40.5	179.3	-167.6	51.5	0	0	0	112.1	I757 N758 E764 Q765	I757-H761 PolarHBondContact O-N 3.49Å; N758-H761 WeakPolarHBondContact O-CB 3.45Å; N758-H761 PolarHBondContact O-N 2.82Å; H761-E764 PolarHBondContact O-N 3.26Å; H761-Q765 PolarHBondContact CD2-NE2 2.92Å; H761-Q765 PolarHBondContact NE2-NE2 3.24Å; H761-Q765 WeakPolarHBondContact O-CG 3.39Å; H761-Q765 PolarHBondContact O-N 3.45Å
762	E	68.3	Low	66.3	Low	113 Å²	113	105.1 Å²	105.1	53%	0.528	49%	0.493	S	S	.	.	H	α-helix	trans	-59.8	-45.2	172.3	-70.1	170.7	155.6	0	0	111.9	N758 S759 E764 Q765 Q766	N758-E762 WeakPolarHBondContact O-CG 3.25Å; N758-E762 PolarHBondContact O-N 3.19Å; S759-E762 WeakPolarHBondContact CA-OE2 3.47Å; E762-E764 VanDerWaalsContact C-N 3.35Å; E762-E764 PolarHBondContact O-N 3.1Å; E762-Q765 PolarHBondContact O-N 3.44Å; E762-Q766 WeakPolarHBondContact O-CG 3.42Å; E762-Q766 PolarHBondContact O-N 3.27Å
763	H	73.5	Confident	66.4	Low	140 Å²	140	102.8 Å²	102.8	65%	0.648	49%	0.49	S	S	*	.	H	α-helix	trans	-68.2	-33	178.4	-167.2	-59.8	0	0	0	112.5	S759 R760 Y767	S759-H763 WeakPolarHBondContact O-CB 3.43Å; S759-H763 PolarHBondContact O-N 3.27Å; S759-H763 VanDerWaalsContact O-N 3.13Å; R760-H763 PolarHBondContact O-N 3.39Å; H763-Y767 WeakPolarHBondContact O-CB 3.44Å; H763-Y767 PolarHBondContact O-N 3.26Å
764	E	64	Low	66.7	Low	117 Å²	117	104.6 Å²	104.6	55%	0.547	49%	0.493	S	S	.	.	H	α-helix	trans	-71.5	-40.4	174.2	-174.1	168.1	-140	0	0	111.9	R760 H761 E762 Y767 N768	R760-E764 WeakPolarHBondContact O-CB 3.43Å; R760-E764 PolarHBondContact O-N 3.4Å; H761-E764 PolarHBondContact O-N 3.26Å; E762-E764 VanDerWaalsContact C-N 3.35Å; E762-E764 PolarHBondContact O-N 3.1Å; E764-Y767 PolarHBondContact O-N 3.15Å; E764-N768 WeakPolarHBondContact O-CB 3.5Å; E764-N768 PolarHBondContact O-N 2.72Å; E764-N768 PolarHBondContact O-ND2 3.43Å
765	Q	62.6	Low	66.9	Low	91 Å²	91	105.7 Å²	105.7	43%	0.425	50%	0.497	S	S	.	.	H	α-helix	trans	-61.2	-46	170.8	-72.8	-174	24.2	0	0	111.5	H761 E762 Y767 N768 I769	H761-Q765 PolarHBondContact CD2-NE2 2.92Å; H761-Q765 PolarHBondContact NE2-NE2 3.24Å; H761-Q765 WeakPolarHBondContact O-CG 3.39Å; H761-Q765 PolarHBondContact O-N 3.45Å; E762-Q765 PolarHBondContact O-N 3.44Å; Q765-Y767 PolarHBondContact O-N 3.37Å; Q765-N768 PolarHBondContact O-N 2.97Å; Q765-I769 VanDerWaalsContact O-CG1 3.3Å; Q765-I769 WeakPolarHBondContact O-CG1 3.34Å; Q765-I769 PolarHBondContact O-N 3.07Å
766	Q	72.7	Confident	66.8	Low	132 Å²	132	104.5 Å²	104.5	62%	0.617	49%	0.491	S	S	*	.	H	α-helix	trans	-63	-39	176.2	-73.8	-168.1	14	0	0	112.8	E762 I769 M770	E762-Q766 WeakPolarHBondContact O-CG 3.42Å; E762-Q766 PolarHBondContact O-N 3.27Å; Q766-I769 PolarHBondContact O-N 2.99Å; Q766-M770 WeakPolarHBondContact O-CB 3.32Å; Q766-M770 PolarHBondContact O-N 3.36Å
767	Y	74.3	Confident	66.7	Low	142 Å²	142	105.8 Å²	105.8	56%	0.557	50%	0.497	S	S	*	.	H	α-helix	trans	-61.4	-44.4	173.8	177.4	-98.8	0	0	0	111.8	H763 E764 Q765 M770 K771	H763-Y767 WeakPolarHBondContact O-CB 3.44Å; H763-Y767 PolarHBondContact O-N 3.26Å; E764-Y767 PolarHBondContact O-N 3.15Å; Q765-Y767 PolarHBondContact O-N 3.37Å; Y767-M770 PolarHBondContact O-N 2.84Å; Y767-K771 HydrophobicContact CE1-CD 4.49Å; Y767-K771 WeakPolarHBondContact O-CB 3.32Å; Y767-K771 PolarHBondContact O-N 3.02Å
768	N	62.3	Low	66.5	Low	45 Å²	45	107.9 Å²	107.9	24%	0.241	51%	0.509	C	S	.	.	H	α-helix	trans	-66.7	-40.9	178.1	-72.3	-34.3	0	0	0	112.3	E764 Q765 K771 I772 F869	E764-N768 WeakPolarHBondContact O-CB 3.5Å; E764-N768 PolarHBondContact O-N 2.72Å; E764-N768 PolarHBondContact O-ND2 3.43Å; Q765-N768 PolarHBondContact O-N 2.97Å; N768-K771 PolarHBondContact O-N 3.2Å; N768-I772 VanDerWaalsContact O-CG1 3.29Å; N768-I772 WeakPolarHBondContact O-CG1 3.17Å; N768-I772 PolarHBondContact O-N 3.03Å; N768-F869 HydrophobicContact CB-CZ 4.4Å
769	I	72.7	Confident	66	Low	94 Å²	94	108.9 Å²	108.9	48%	0.482	51%	0.513	S	S	.	.	H	α-helix	trans	-60.3	-45.5	172.5	-68.8	163.6	0	0	0	110.8	Q765 Q766 K771 I772 N773	Q765-I769 VanDerWaalsContact O-CG1 3.3Å; Q765-I769 WeakPolarHBondContact O-CG1 3.34Å; Q765-I769 PolarHBondContact O-N 3.07Å; Q766-I769 PolarHBondContact O-N 2.99Å; I769-K771 VanDerWaalsContact C-N 3.32Å; I769-K771 PolarHBondContact O-N 3.48Å; I769-I772 PolarHBondContact O-N 2.92Å; I769-N773 WeakPolarHBondContact O-CB 3.46Å; I769-N773 PolarHBondContact O-N 3.17Å
770	M	69.9	Low	64.9	Low	129 Å²	129	112.9 Å²	112.9	64%	0.635	52%	0.524	S	S	*	.	H	α-helix	trans	-64.5	-36.8	178.3	-167.5	-176.3	-60.5	0	0	112.1	Q766 Y767 R774	Q766-M770 WeakPolarHBondContact O-CB 3.32Å; Q766-M770 PolarHBondContact O-N 3.36Å; Y767-M770 PolarHBondContact O-N 2.84Å; M770-R774 WeakPolarHBondContact O-CB 3.48Å; M770-R774 PolarHBondContact O-N 3.36Å
771	K	70.8	Confident	63.7	Low	115 Å²	115	106.8 Å²	106.8	50%	0.5	52%	0.517	S	S	.	.	H	α-helix	trans	-65.9	-43.5	174.1	-172.5	-176.4	176	-169.7	0	111.7	Y767 N768 I769 R774 M775	Y767-K771 HydrophobicContact CE1-CD 4.49Å; Y767-K771 WeakPolarHBondContact O-CB 3.32Å; Y767-K771 PolarHBondContact O-N 3.02Å; N768-K771 PolarHBondContact O-N 3.2Å; I769-K771 VanDerWaalsContact C-N 3.32Å; I769-K771 PolarHBondContact O-N 3.48Å; K771-R774 PolarHBondContact O-N 2.98Å; K771-M775 HydrophobicContact CG-CE 4.38Å; K771-M775 WeakPolarHBondContact O-CG 3.23Å; K771-M775 PolarHBondContact O-N 3.27Å
772	I	68.5	Low	62.1	Low	68 Å²	68	111.8 Å²	111.8	35%	0.349	55%	0.546	S	S	.	.	H	α-helix	trans	-62.5	-48.7	175.1	-70.1	164.6	0	0	0	110.5	N768 I769 R774 M775 N776 F869	N768-I772 VanDerWaalsContact O-CG1 3.29Å; N768-I772 WeakPolarHBondContact O-CG1 3.17Å; N768-I772 PolarHBondContact O-N 3.03Å; I769-I772 PolarHBondContact O-N 2.92Å; I772-R774 VanDerWaalsContact C-N 3.32Å; I772-R774 PolarHBondContact O-N 2.95Å; I772-M775 HydrophobicContact CG1-CE 4.28Å; I772-M775 PolarHBondContact O-N 3.38Å; I772-M775 VanDerWaalsContact O-N 3.14Å; I772-N776 PolarHBondContact O-N 3.11Å; I772-N776 PolarHBondContact O-ND2 3.42Å; I772-F869 HydrophobicContact CD1-CE1 4.48Å
773	N	67.2	Low	60.3	Low	86 Å²	86	113.6 Å²	113.6	46%	0.46	56%	0.559	S	S	.	*	H	α-helix	trans	-58.7	-42.8	177.6	-72.1	-6.8	0	0	0	111.8	I769 M775 N776 E777	I769-N773 WeakPolarHBondContact O-CB 3.46Å; I769-N773 PolarHBondContact O-N 3.17Å; N773-M775 PolarHBondContact O-N 3.19Å; N773-N776 WeakPolarHBondContact O-CB 3.31Å; N773-N776 PolarHBondContact O-N 2.96Å; N773-N776 VanDerWaalsContact O-N 3.17Å; N773-E777 WeakPolarHBondContact O-CG 3.36Å; N773-E777 PolarHBondContact O-N 3.14Å
774	R	67.6	Low	58.3	Low	173 Å²	173	114.5 Å²	114.5	65%	0.653	57%	0.569	S	S	*	*	H	α-helix	trans	-68.7	-30.4	177.7	-165.7	171.4	-175.9	121.8	3.8	113.5	M770 K771 I772 L778	M770-R774 WeakPolarHBondContact O-CB 3.48Å; M770-R774 PolarHBondContact O-N 3.36Å; K771-R774 PolarHBondContact O-N 2.98Å; I772-R774 VanDerWaalsContact C-N 3.32Å; I772-R774 PolarHBondContact O-N 2.95Å; R774-L778 WeakPolarHBondContact O-CB 3.4Å; R774-L778 WeakPolarHBondContact O-CD1 3.38Å; R774-L778 VanDerWaalsContact O-CG 3.26Å; R774-L778 WeakPolarHBondContact O-CG 3.34Å; R774-L778 PolarHBondContact O-N 3.06Å; R774-L778 VanDerWaalsContact O-N 3.13Å
775	M	63.6	Low	56.6	Low	94 Å²	94	116.8 Å²	116.8	46%	0.463	59%	0.585	S	S	.	*	H	α-helix	trans	-69.1	-39.9	169.9	-69.6	-176.6	-57	0	0	111.1	K771 I772 N773 L778 L779	K771-M775 HydrophobicContact CG-CE 4.38Å; K771-M775 WeakPolarHBondContact O-CG 3.23Å; K771-M775 PolarHBondContact O-N 3.27Å; I772-M775 HydrophobicContact CG1-CE 4.28Å; I772-M775 PolarHBondContact O-N 3.38Å; I772-M775 VanDerWaalsContact O-N 3.14Å; N773-M775 PolarHBondContact O-N 3.19Å; M775-L778 PolarHBondContact O-N 2.81Å; M775-L779 WeakPolarHBondContact O-CB 3.4Å; M775-L779 VanDerWaalsContact O-CG 3.29Å; M775-L779 WeakPolarHBondContact O-CG 3.47Å; M775-L779 PolarHBondContact O-N 3.03Å
776	N	60.3	Low	55.2	Low	69 Å²	69	117.1 Å²	117.1	37%	0.369	60%	0.595	S	S	.	*	H	α-helix	trans	-65	-40	174.7	-68.7	-24.3	0	0	0	112.5	I772 N773 L779 Q780	I772-N776 PolarHBondContact O-N 3.11Å; I772-N776 PolarHBondContact O-ND2 3.42Å; N773-N776 WeakPolarHBondContact O-CB 3.31Å; N773-N776 PolarHBondContact O-N 2.96Å; N773-N776 VanDerWaalsContact O-N 3.17Å; N776-L779 PolarHBondContact O-N 3.27Å; N776-Q780 WeakPolarHBondContact O-CB 3.38Å; N776-Q780 VanDerWaalsContact O-CG 3.31Å; N776-Q780 WeakPolarHBondContact O-CG 3.42Å; N776-Q780 PolarHBondContact O-N 3.28Å
777	E	62.3	Low	53.2	Low	130 Å²	130	116.9 Å²	116.9	61%	0.607	60%	0.602	S	S	*	*	H	α-helix	trans	-60.2	-44.3	172.7	-74.1	170.7	169.7	0	0	111.5	N773 L779 Q780 G781	N773-E777 WeakPolarHBondContact O-CG 3.36Å; N773-E777 PolarHBondContact O-N 3.14Å; E777-L779 VanDerWaalsContact C-N 3.29Å; E777-L779 PolarHBondContact O-N 3.33Å; E777-Q780 PolarHBondContact O-N 2.93Å; E777-G781 PolarHBondContact O-N 3.08Å
778	L	57.3	Low	51.1	Low	139 Å²	139	116 Å²	116	73%	0.728	61%	0.612	S	S	*	*	H	α-helix	trans	-69	-24.1	176.6	-71.1	168.9	0	0	0	113.5	R774 M775	R774-L778 WeakPolarHBondContact O-CB 3.4Å; R774-L778 WeakPolarHBondContact O-CD1 3.38Å; R774-L778 VanDerWaalsContact O-CG 3.26Å; R774-L778 WeakPolarHBondContact O-CG 3.34Å; R774-L778 PolarHBondContact O-N 3.06Å; R774-L778 VanDerWaalsContact O-N 3.13Å; M775-L778 PolarHBondContact O-N 2.81Å
779	L	50.7	Low	49.6	Very low	110 Å²	110	121.1 Å²	121.1	58%	0.576	64%	0.639	S	S	*	*	H	α-helix	trans	-84.5	-22.6	174.3	-74.3	165.5	0	0	0	113.4	M775 N776 E777	M775-L779 WeakPolarHBondContact O-CB 3.4Å; M775-L779 VanDerWaalsContact O-CG 3.29Å; M775-L779 WeakPolarHBondContact O-CG 3.47Å; M775-L779 PolarHBondContact O-N 3.03Å; N776-L779 PolarHBondContact O-N 3.27Å; E777-L779 VanDerWaalsContact C-N 3.29Å; E777-L779 PolarHBondContact O-N 3.33Å
780	Q	44.6	Very low	47.7	Very low	154 Å²	154	125.6 Å²	125.6	72%	0.72	66%	0.658	S	S	*	*	H	α-helix	trans	-98.1	-27.2	179.8	-68.4	175.1	27.8	0	0	112.7	N776 E777 N782	N776-Q780 WeakPolarHBondContact O-CB 3.38Å; N776-Q780 VanDerWaalsContact O-CG 3.31Å; N776-Q780 WeakPolarHBondContact O-CG 3.42Å; N776-Q780 PolarHBondContact O-N 3.28Å; E777-Q780 PolarHBondContact O-N 2.93Å; Q780-N782 VanDerWaalsContact C-N 3.3Å; Q780-N782 PolarHBondContact O-N 2.92Å
781	G	36	Very low	45.9	Very low	51 Å²	51	126.9 Å²	126.9	53%	0.526	66%	0.662	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.2	56	-178.4	0	0	0	0	0	115.3	E777	E777-G781 PolarHBondContact O-N 3.08Å
782	N	34.3	Very low	44.1	Very low	155 Å²	155	126.9 Å²	126.9	83%	0.829	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-173.3	38.8	159.3	-100.1	-20.1	0	0	0	114.9	Q780	Q780-N782 VanDerWaalsContact C-N 3.3Å; Q780-N782 PolarHBondContact O-N 2.92Å
783	N	31.9	Very low	42.5	Very low	152 Å²	152	134 Å²	134	81%	0.813	70%	0.696	S	S	*	*	S	Bend	trans	-162.1	78.6	168.2	-100.2	-42.3	0	0	0	112.1
784	N	31.1	Very low	40.8	Very low	158 Å²	158	135.4 Å²	135.4	85%	0.845	71%	0.708	S	S	*	*			trans	-175.7	88.8	162.1	-97.8	-38.9	0	0	0	111.3
785	D	28.8	Very low	39.4	Very low	166 Å²	166	132.5 Å²	132.5	89%	0.888	71%	0.712	S	S	*	*			trans	-153.5	80	152.8	-149.5	-10.6	0	0	0	113.3
786	P	32.5	Very low	37.9	Very low	98 Å²	98	134.5 Å²	134.5	64%	0.636	73%	0.729	S	S	*	*			trans	-117.9	100.6	179.4	35.6	-19.8	0	0	0	113.9
787	T	30.7	Very low	36.5	Very low	126 Å²	126	136.9 Å²	136.9	77%	0.773	75%	0.746	S	S	*	*			trans	50.4	113.6	145.6	46.3	0	0	0	0	121.9
788	T	29.6	Very low	35	Very low	125 Å²	125	137.6 Å²	137.6	77%	0.767	75%	0.753	S	S	*	*				90.7	149.8	127.7	-51.6	0	0	0	0	120.6
789	L	30.7	Very low	33.6	Very low	151 Å²	151	135.7 Å²	135.7	79%	0.791	75%	0.751	S	S	*	*			trans	100	128.2	174	-57	173.4	0	0	0	114.1
790	Q	34.1	Very low	32.6	Very low	189 Å²	189	135.4 Å²	135.4	88%	0.883	76%	0.759	S	S	*	*			cis	-127.2	177.4	23.2	-66.1	-178.4	-7.4	0	0	115
791	Q	32.4	Very low	31.8	Very low	156 Å²	156	132.8 Å²	132.8	73%	0.729	76%	0.757	S	S	*	*			trans	-95.5	-179.8	-172.1	-53.5	178.1	-3.7	0	0	113.8
792	P	31	Very low	31.4	Very low	115 Å²	115	135.4 Å²	135.4	75%	0.747	77%	0.767	S	S	*	*				-144	140.4	89.3	36.3	-20.4	0	0	0	117.1
793	R	35.3	Very low	31.2	Very low	218 Å²	218	132.8 Å²	132.8	82%	0.823	76%	0.761	S	S	*	*			trans	72.7	118.3	160.3	-59.7	173.4	-171.1	-157.3	0.7	116.3
794	T	33	Very low	30.9	Very low	115 Å²	115	130.5 Å²	130.5	71%	0.706	76%	0.757	S	S	*	*			cis	85.2	148.9	46.2	73.4	0	0	0	0	113.6
795	P	37.9	Very low	30.8	Very low	112 Å²	112	127.7 Å²	127.7	73%	0.727	75%	0.75	S	S	*	*				-138.5	169.5	-87.8	35	-13.9	0	0	0	115.3
796	T	32.3	Very low	30.8	Very low	136 Å²	136	126.2 Å²	126.2	83%	0.834	75%	0.747	S	S	*	*			trans	172.3	164.3	144.2	38.3	0	0	0	0	110
797	T	29.8	Very low	30.6	Very low	118 Å²	118	125.3 Å²	125.3	72%	0.724	75%	0.748	S	S	*	*			cis	168.6	167.3	-25	-63.7	0	0	0	0	104.4
798	I	30.2	Very low	30.4	Very low	145 Å²	145	127.4 Å²	127.4	74%	0.744	75%	0.753	S	S	*	*			trans	82.8	79.1	167	-44.4	-174.8	0	0	0	117.3
799	S	28.4	Very low	30.5	Very low	99 Å²	99	127.1 Å²	127.1	69%	0.692	75%	0.752	S	S	*	*				18.7	138.3	125.8	61.5	0	0	0	0	122.2
800	S	29.6	Very low	30.4	Very low	105 Å²	105	128.1 Å²	128.1	73%	0.734	75%	0.752	S	S	*	*				136.1	147.2	111.7	68.2	0	0	0	0	117.4
801	S	28.4	Very low	30.1	Very low	98 Å²	98	126.4 Å²	126.4	69%	0.685	75%	0.749	S	S	*	*			trans	55	98.6	157.6	55.4	0	0	0	0	121.4
802	S	28.5	Very low	29.9	Very low	106 Å²	106	126.6 Å²	126.6	74%	0.741	75%	0.75	S	S	*	*				85.8	151.4	117.5	80.5	0	0	0	0	121.9
803	S	28.2	Very low	29.9	Very low	100 Å²	100	127.2 Å²	127.2	70%	0.699	75%	0.747	S	S	*	*			trans	92.1	126.6	150	-51.7	0	0	0	0	120
804	S	27.6	Very low	29.5	Very low	105 Å²	105	126.6 Å²	126.6	73%	0.734	75%	0.751	S	S	*	*			trans	63.4	104.7	145.1	52	0	0	0	0	121.9
805	S	28.1	Very low	29.1	Very low	98 Å²	98	129.9 Å²	129.9	69%	0.685	76%	0.755	S	S	*	*				75.9	131.2	122.8	62	0	0	0	0	123
806	T	28.3	Very low	28.6	Very low	135 Å²	135	130.8 Å²	130.8	83%	0.828	75%	0.753	S	S	*	*			trans	59.7	125.4	145.1	50.2	0	0	0	0	118.3
807	A	28.5	Very low	28.4	Very low	80 Å²	80	132.6 Å²	132.6	66%	0.661	75%	0.752	S	S	*	*			cis	-173.4	153.9	23.1	0	0	0	0	0	111.8
808	L	27.5	Very low	28.2	Very low	169 Å²	169	133.8 Å²	133.8	89%	0.885	75%	0.753	S	S	*	*			trans	64	154.4	161.2	-54.4	172.3	0	0	0	116.8
809	T	30.1	Very low	28	Very low	119 Å²	119	131.9 Å²	131.9	73%	0.73	75%	0.748	S	S	*	*			cis	-123.1	164	-3	46.4	0	0	0	0	112.3
810	E	28.5	Very low	28	Very low	172 Å²	172	133.6 Å²	133.6	80%	0.804	75%	0.75	S	S	*	*			trans	-44.1	135	176.3	-61	138.1	136.6	0	0	116.5
811	N	28.7	Very low	27.9	Very low	154 Å²	154	136.2 Å²	136.2	82%	0.824	76%	0.755	S	S	*	*			trans	-163.7	149.1	137.8	-114.4	-25.4	0	0	0	112.8
812	E	28.5	Very low	27.9	Very low	159 Å²	159	138.7 Å²	138.7	74%	0.743	76%	0.759	S	S	*	*			trans	57.6	117.5	157.3	-61.6	-166.6	167	0	0	123.3
813	N	29.6	Very low	28.1	Very low	129 Å²	129	139.6 Å²	139.6	69%	0.69	76%	0.763	S	S	*	*				60.9	85.8	128.1	-59	-39.1	0	0	0	121.7
814	K	27.5	Very low	28.2	Very low	205 Å²	205	140.5 Å²	140.5	89%	0.891	76%	0.764	S	S	*	*			trans	-167	133.7	131.1	-93.1	131	-163.2	160.6	0	109.2
815	F	24.7	Very low	28.4	Very low	183 Å²	183	141.5 Å²	141.5	80%	0.803	77%	0.766	S	S	*	*				84	91	50.2	-152	-99.1	0	0	0	114
816	I	28.1	Very low	28.4	Very low	131 Å²	131	142.6 Å²	142.6	67%	0.672	77%	0.769	S	S	*	*			trans	61.5	107.6	159.8	-43.2	179.7	0	0	0	118.7
817	Q	27.2	Very low	28.5	Very low	174 Å²	174	141.6 Å²	141.6	81%	0.813	76%	0.763	S	S	*	*				-178.7	179.6	113.1	-97.7	-157.7	22.4	0	0	112
818	L	25.7	Very low	28.6	Very low	143 Å²	143	144.1 Å²	144.1	75%	0.749	77%	0.77	S	S	*	*			trans	74.2	88.9	174.4	-53.3	177.3	0	0	0	115.4
819	T	27.2	Very low	28.9	Very low	106 Å²	106	140 Å²	140	65%	0.65	76%	0.76	S	S	*	*				82	131.6	71	61.3	0	0	0	0	115.5
820	N	27.1	Very low	29.1	Very low	135 Å²	135	140.5 Å²	140.5	72%	0.722	77%	0.769	S	S	*	*			trans	66.2	104.5	158.2	-52.3	-19.2	0	0	0	117.7
821	N	28.7	Very low	29.3	Very low	159 Å²	159	135.7 Å²	135.7	85%	0.85	77%	0.766	S	S	*	*				-179.5	122.7	101.5	-86.6	-33.6	0	0	0	111.9
822	I	27.9	Very low	29.5	Very low	150 Å²	150	135.1 Å²	135.1	77%	0.769	77%	0.767	S	S	*	*			trans	-111.5	122.8	169.6	-63	172.5	0	0	0	108.2	T824	I822-T824 PolarHBondContact O-N 2.81Å
823	P	31.7	Very low	29.6	Very low	126 Å²	126	132.3 Å²	132.3	82%	0.818	77%	0.765	S	S	*	*			trans	-78.4	109	162.5	-7.8	25.6	0	0	0	109.4
824	T	30.2	Very low	29.6	Very low	118 Å²	118	133.2 Å²	133.2	72%	0.724	77%	0.768	S	S	*	*			trans	-75.7	150.5	177.1	53	0	0	0	0	112.8	I822	I822-T824 PolarHBondContact O-N 2.81Å
825	T	32.5	Very low	29.8	Very low	126 Å²	126	129 Å²	129	77%	0.773	77%	0.765	S	S	*	*			trans	-159.9	112.2	142.4	-0.8	0	0	0	0	112.9
826	T	28.3	Very low	30.1	Very low	122 Å²	122	126.9 Å²	126.9	75%	0.748	76%	0.762	S	S	*	*			trans	42.2	130.8	140.3	58	0	0	0	0	119.7
827	T	30.4	Very low	30.2	Very low	114 Å²	114	127.8 Å²	127.8	70%	0.699	77%	0.768	S	S	*	*			cis	-168.3	135.6	48.1	-43.9	0	0	0	0	112.2
828	T	31	Very low	30.5	Very low	132 Å²	132	125.1 Å²	125.1	81%	0.81	77%	0.769	S	S	*	*			trans	51.2	144.6	158.8	52.6	0	0	0	0	121.5
829	A	33.8	Very low	30.7	Very low	82 Å²	82	123.5 Å²	123.5	68%	0.678	77%	0.769	S	S	*	*			cis	-168	153.1	-15.8	0	0	0	0	0	110.1
830	S	34.7	Very low	30.9	Very low	130 Å²	130	123.8 Å²	123.8	91%	0.909	78%	0.776	S	S	*	*			trans	45.2	125.7	157.3	-52.8	0	0	0	0	120.7
831	G	32.1	Very low	31.2	Very low	72 Å²	72	124.1 Å²	124.1	74%	0.742	78%	0.777	S	S	*	*			cis	163.3	177.5	-2.2	0	0	0	0	0	112.7
832	V	32.5	Very low	31.4	Very low	142 Å²	142	123.2 Å²	123.2	86%	0.861	77%	0.77	S	S	*	*			trans	77.4	91.1	170.3	-165.7	0	0	0	0	118
833	S	31.1	Very low	32	Very low	99 Å²	99	121.6 Å²	121.6	69%	0.692	77%	0.767	S	S	*	*			trans	-16.1	166.9	139.2	58.3	0	0	0	0	119.5
834	I	29.4	Very low	32.3	Very low	149 Å²	149	119.2 Å²	119.2	76%	0.764	75%	0.753	S	S	*	*			cis	-151.8	141.1	31	-52.5	161.5	0	0	0	110.7
835	S	32.3	Very low	32.8	Very low	116 Å²	116	119.6 Å²	119.6	81%	0.811	75%	0.747	S	S	*	*			trans	-158.7	140.5	147.3	54.3	0	0	0	0	110.9
836	N	30.2	Very low	33.1	Very low	138 Å²	138	122.5 Å²	122.5	74%	0.738	74%	0.744	S	S	*	*			trans	-106	179.4	-178.1	-79	-3.7	0	0	0	112.1
837	D	30.6	Very low	33.8	Very low	151 Å²	151	121.6 Å²	121.6	81%	0.807	73%	0.734	S	S	*	*			trans	90.8	122	158.5	-57.2	-22.8	0	0	0	119
838	S	32.7	Very low	34.6	Very low	118 Å²	118	120.3 Å²	120.3	83%	0.825	72%	0.723	S	S	*	*			trans	-175.5	149.5	-176	-77	0	0	0	0	105.6
839	S	30.5	Very low	35.3	Very low	109 Å²	109	120.5 Å²	120.5	76%	0.762	71%	0.713	S	S	*	*			cis	-175	128.9	-4.6	47.2	0	0	0	0	109.4
840	S	30.7	Very low	36.2	Very low	112 Å²	112	120.4 Å²	120.4	78%	0.783	70%	0.7	S	S	*	*	S	Bend	trans	-169.2	104.1	164.1	54.6	0	0	0	0	112.5
841	N	33.8	Very low	36.7	Very low	141 Å²	141	119.7 Å²	119.7	75%	0.754	68%	0.682	S	S	*	*	S	Bend	trans	179.4	-22.1	153.3	-103.3	-0.7	0	0	0	114.3	T843	N841-T843 VanDerWaalsContact C-N 3.26Å; N841-T843 PolarHBondContact O-N 3.22Å
842	M	33.1	Very low	37.8	Very low	141 Å²	141	121.5 Å²	121.5	70%	0.695	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	13.2	-166.8	-67.1	-85.4	90.1	0	0	116.9	E845	M842-E845 VanDerWaalsContact CE-OE2 3.24Å; M842-E845 WeakPolarHBondContact CE-OE2 3.39Å
843	T	40.5	Very low	38.6	Very low	116 Å²	116	119.5 Å²	119.5	71%	0.712	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	-16.9	-172.3	47	0	0	0	0	115.7	N841	N841-T843 VanDerWaalsContact C-N 3.26Å; N841-T843 PolarHBondContact O-N 3.22Å
844	S	38.7	Very low	39.5	Very low	75 Å²	75	119.1 Å²	119.1	52%	0.524	65%	0.646	S	S	.	*	S	Bend	trans	-83.2	-57.4	175	-160.3	0	0	0	0	111.3	R846 N847 D848	S844-R846 PolarHBondContact O-N 2.69Å; S844-N847 PolarHBondContact O-N 3.46Å; S844-D848 PolarHBondContact O-N 3.19Å; S844-D848 PolarHBondContact OG-OD2 2.8Å
845	E	39.8	Very low	40.5	Very low	126 Å²	126	115.9 Å²	115.9	59%	0.589	63%	0.63	S	S	*	*	H	α-helix	trans	-53	-31.7	-174.7	-59.2	177.6	135.1	0	0	113.2	M842 F849	M842-E845 VanDerWaalsContact CE-OE2 3.24Å; M842-E845 WeakPolarHBondContact CE-OE2 3.39Å; E845-F849 VanDerWaalsContact O-CB 3.26Å; E845-F849 WeakPolarHBondContact O-CB 3.36Å; E845-F849 PolarHBondContact O-N 3.44Å
846	R	39.8	Very low	41.8	Very low	188 Å²	188	114.3 Å²	114.3	71%	0.709	62%	0.619	S	S	*	*	H	α-helix	trans	-69.4	-33.3	179.1	-160.6	179	-170.5	104.9	1.6	113.1	S844 I850	S844-R846 PolarHBondContact O-N 2.69Å; R846-I850 WeakPolarHBondContact O-CD1 3.39Å; R846-I850 VanDerWaalsContact O-CG1 3.27Å; R846-I850 WeakPolarHBondContact O-CG1 3.43Å; R846-I850 PolarHBondContact O-N 3.5Å
847	N	41.8	Very low	42.6	Very low	103 Å²	103	113.1 Å²	113.1	55%	0.551	61%	0.609	S	S	*	*	H	α-helix	trans	-78.4	-41.8	176.1	-71.4	-23.5	0	0	0	110.8	S844 F849 I850 Q851	S844-N847 PolarHBondContact O-N 3.46Å; N847-F849 VanDerWaalsContact C-N 3.29Å; N847-F849 PolarHBondContact O-N 3.23Å; N847-I850 PolarHBondContact O-N 3.11Å; N847-Q851 WeakPolarHBondContact O-CG 3.41Å; N847-Q851 PolarHBondContact O-N 3.03Å
848	D	47.4	Very low	43.9	Very low	86 Å²	86	110.9 Å²	110.9	46%	0.46	59%	0.592	S	S	.	*	H	α-helix	trans	-62.4	-37.1	175.9	-61	-47.5	0	0	0	111.5	S844 N852	S844-D848 PolarHBondContact O-N 3.19Å; S844-D848 PolarHBondContact OG-OD2 2.8Å; D848-N852 WeakPolarHBondContact O-CB 3.39Å; D848-N852 PolarHBondContact O-N 3.27Å; D848-N852 PolarHBondContact O-ND2 2.87Å
849	F	46.7	Very low	44.6	Very low	137 Å²	137	112.4 Å²	112.4	60%	0.601	58%	0.581	S	S	*	*	H	α-helix	trans	-65.2	-45.2	173.4	-171.8	-92	0	0	0	112.4	E845 N847 N852 Q853	E845-F849 VanDerWaalsContact O-CB 3.26Å; E845-F849 WeakPolarHBondContact O-CB 3.36Å; E845-F849 PolarHBondContact O-N 3.44Å; N847-F849 VanDerWaalsContact C-N 3.29Å; N847-F849 PolarHBondContact O-N 3.23Å; F849-N852 PolarHBondContact O-N 3.5Å; F849-Q853 WeakPolarHBondContact O-CB 3.49Å; F849-Q853 PolarHBondContact O-N 3.08Å
850	I	51.6	Low	45.8	Very low	80 Å²	80	112.9 Å²	112.9	41%	0.41	57%	0.571	S	S	.	*	H	α-helix	trans	-64.8	-42.5	178.7	-70.5	167.3	0	0	0	111	R846 N847 Q853 L854	R846-I850 WeakPolarHBondContact O-CD1 3.39Å; R846-I850 VanDerWaalsContact O-CG1 3.27Å; R846-I850 WeakPolarHBondContact O-CG1 3.43Å; R846-I850 PolarHBondContact O-N 3.5Å; N847-I850 PolarHBondContact O-N 3.11Å; I850-Q853 PolarHBondContact O-N 3Å; I850-L854 HydrophobicContact CG2-CD1 3.95Å; I850-L854 HydrophobicContact CG2-CG 4.48Å; I850-L854 WeakPolarHBondContact O-CG 3.32Å; I850-L854 PolarHBondContact O-N 3.05Å
851	Q	45.9	Very low	46.7	Very low	114 Å²	114	113.9 Å²	113.9	53%	0.533	56%	0.563	S	S	.	*	H	α-helix	trans	-65.9	-42.5	177.5	-73.3	-66.9	-5.8	0	0	112.5	N847 Q853 L854 N855	N847-Q851 WeakPolarHBondContact O-CG 3.41Å; N847-Q851 PolarHBondContact O-N 3.03Å; Q851-Q853 VanDerWaalsContact C-N 3.32Å; Q851-Q853 PolarHBondContact O-N 3.29Å; Q851-L854 PolarHBondContact O-N 3.03Å; Q851-N855 WeakPolarHBondContact O-CB 3.38Å; Q851-N855 PolarHBondContact O-N 2.85Å
852	N	54.1	Low	47.7	Very low	111 Å²	111	109.6 Å²	109.6	59%	0.594	54%	0.54	S	S	*	.	H	α-helix	trans	-64.3	-36.8	173.7	-80	-63.7	0	0	0	112.2	D848 F849 S856	D848-N852 WeakPolarHBondContact O-CB 3.39Å; D848-N852 PolarHBondContact O-N 3.27Å; D848-N852 PolarHBondContact O-ND2 2.87Å; F849-N852 PolarHBondContact O-N 3.5Å; N852-S856 WeakPolarHBondContact O-CB 3.49Å; N852-S856 PolarHBondContact O-N 3.12Å
853	Q	49.7	Very low	48.6	Very low	99 Å²	99	107.5 Å²	107.5	46%	0.463	53%	0.532	S	S	.	.	H	α-helix	trans	-69.4	-39.2	177.9	-167.8	163.3	27.7	0	0	112.4	F849 I850 Q851 Q857	F849-Q853 WeakPolarHBondContact O-CB 3.49Å; F849-Q853 PolarHBondContact O-N 3.08Å; I850-Q853 PolarHBondContact O-N 3Å; Q851-Q853 VanDerWaalsContact C-N 3.32Å; Q851-Q853 PolarHBondContact O-N 3.29Å; Q853-Q857 WeakPolarHBondContact O-CG 3.1Å; Q853-Q857 PolarHBondContact O-N 2.87Å; Q853-Q857 VanDerWaalsContact O-N 3.08Å
854	L	50.6	Low	49.3	Very low	91 Å²	91	107.2 Å²	107.2	48%	0.476	52%	0.522	S	S	.	.	H	α-helix	trans	-67	-47.2	174.2	-72.6	169.7	0	0	0	112	I850 Q851 S856 Q857 F858	I850-L854 HydrophobicContact CG2-CD1 3.95Å; I850-L854 HydrophobicContact CG2-CG 4.48Å; I850-L854 WeakPolarHBondContact O-CG 3.32Å; I850-L854 PolarHBondContact O-N 3.05Å; Q851-L854 PolarHBondContact O-N 3.03Å; L854-S856 VanDerWaalsContact C-N 3.33Å; L854-S856 PolarHBondContact O-N 3Å; L854-Q857 PolarHBondContact O-N 3.4Å; L854-F858 PolarHBondContact O-N 3.49Å
855	N	50.6	Low	50	Low	81 Å²	81	107.8 Å²	107.8	43%	0.433	52%	0.523	S	S	.	.	H	α-helix	trans	-59.1	-44.3	174.2	-84.2	-27.4	0	0	0	111.5	Q851 Q857 F858 Y859	Q851-N855 WeakPolarHBondContact O-CB 3.38Å; Q851-N855 PolarHBondContact O-N 2.85Å; N855-Q857 VanDerWaalsContact C-N 3.27Å; N855-Q857 PolarHBondContact O-N 3.01Å; N855-F858 PolarHBondContact O-N 2.93Å; N855-Y859 HydrophobicContact CB-CD2 4.48Å; N855-Y859 WeakPolarHBondContact O-CD2 3.48Å; N855-Y859 PolarHBondContact O-N 3.46Å
856	S	58.3	Low	50.7	Low	83 Å²	83	107.1 Å²	107.1	58%	0.58	52%	0.52	S	S	*	.	H	α-helix	trans	-65.3	-28	178.9	-174	0	0	0	0	113.4	N852 L854 H860	N852-S856 WeakPolarHBondContact O-CB 3.49Å; N852-S856 PolarHBondContact O-N 3.12Å; L854-S856 VanDerWaalsContact C-N 3.33Å; L854-S856 PolarHBondContact O-N 3Å; S856-H860 PolarHBondContact O-N 3.24Å
857	Q	48.3	Very low	51.5	Low	114 Å²	114	103.8 Å²	103.8	53%	0.533	51%	0.512	S	S	.	.	H	α-helix	trans	-75.4	-45.3	172.3	-76	178.1	-27.6	0	0	111.1	Q853 L854 N855 Y859 H860 E861	Q853-Q857 WeakPolarHBondContact O-CG 3.1Å; Q853-Q857 PolarHBondContact O-N 2.87Å; Q853-Q857 VanDerWaalsContact O-N 3.08Å; L854-Q857 PolarHBondContact O-N 3.4Å; N855-Q857 VanDerWaalsContact C-N 3.27Å; N855-Q857 PolarHBondContact O-N 3.01Å; Q857-Y859 PolarHBondContact O-N 3.04Å; Q857-H860 WeakPolarHBondContact O-CB 3.14Å; Q857-H860 PolarHBondContact O-N 2.92Å; Q857-E861 PolarHBondContact O-N 3.33Å
858	F	57.2	Low	52.2	Low	103 Å²	103	102.1 Å²	102.1	45%	0.452	51%	0.506	S	S	.	.	H	α-helix	trans	-61.2	-42.6	179.2	-173.6	-108.9	0	0	0	113	L854 N855 H860 E861 L862	L854-F858 PolarHBondContact O-N 3.49Å; N855-F858 PolarHBondContact O-N 2.93Å; F858-H860 VanDerWaalsContact C-N 3.3Å; F858-H860 PolarHBondContact O-N 3.38Å; F858-E861 PolarHBondContact O-N 3.48Å; F858-L862 HydrophobicContact CD1-CD1 3.89Å; F858-L862 HydrophobicContact CE1-CD1 3.48Å; F858-L862 VanDerWaalsContact CE1-CD1 3.48Å; F858-L862 HydrophobicContact CZ-CD1 3.9Å; F858-L862 WeakPolarHBondContact O-CB 3.3Å; F858-L862 PolarHBondContact O-N 3.25Å
859	Y	47	Very low	52.9	Low	150 Å²	150	101.9 Å²	101.9	59%	0.588	50%	0.501	S	S	*	.	H	α-helix	trans	-68.2	-26.4	174.1	-76.9	-65.4	0	0	0	113.3	N855 Q857 N863	N855-Y859 HydrophobicContact CB-CD2 4.48Å; N855-Y859 WeakPolarHBondContact O-CD2 3.48Å; N855-Y859 PolarHBondContact O-N 3.46Å; Q857-Y859 PolarHBondContact O-N 3.04Å; Y859-N863 PolarHBondContact O-N 3.43Å; Y859-N863 VanDerWaalsContact O-N 3.15Å
860	H	56.1	Low	53.4	Low	119 Å²	119	100.6 Å²	100.6	55%	0.551	50%	0.5	S	S	*	.	H	α-helix	trans	-72	-48	173.7	-164.6	-65.6	0	0	0	111.2	S856 Q857 F858 L862 N863 E864	S856-H860 PolarHBondContact O-N 3.24Å; Q857-H860 WeakPolarHBondContact O-CB 3.14Å; Q857-H860 PolarHBondContact O-N 2.92Å; F858-H860 VanDerWaalsContact C-N 3.3Å; F858-H860 PolarHBondContact O-N 3.38Å; H860-L862 VanDerWaalsContact C-N 3.28Å; H860-L862 PolarHBondContact O-N 3.44Å; H860-N863 PolarHBondContact O-N 2.9Å; H860-E864 IonicContact CE1-OE2 2.77Å; H860-E864 PolarHBondContact CE1-OE2 3.21Å; H860-E864 VanDerWaalsContact CE1-OE2 3.26Å; H860-E864 IonicContact ND1-OE2 2.65Å; H860-E864 PolarHBondContact ND1-OE2 3.08Å; H860-E864 VanDerWaalsContact ND1-OE2 3.1Å; H860-E864 VanDerWaalsContact O-CB 3.31Å; H860-E864 WeakPolarHBondContact O-CB 3.42Å; H860-E864 PolarHBondContact O-N 3.23Å
861	E	49.9	Very low	53.8	Low	133 Å²	133	103.1 Å²	103.1	62%	0.621	51%	0.51	S	S	*	.	H	α-helix	trans	-61.6	-35.2	175.8	-71.4	-172	128.8	0	0	112.1	Q857 F858 T865	Q857-E861 PolarHBondContact O-N 3.33Å; F858-E861 PolarHBondContact O-N 3.48Å; E861-T865 WeakPolarHBondContact O-CB 3.49Å; E861-T865 WeakPolarHBondContact O-CG2 3.39Å; E861-T865 PolarHBondContact O-N 3Å; E861-T865 PolarHBondContact O-OG1 2.97Å
862	L	54.9	Low	54.4	Low	51 Å²	51	101.6 Å²	101.6	27%	0.267	51%	0.508	S	S	.	.	H	α-helix	trans	-65.8	-43.7	174.2	-91.2	168.8	0	0	0	113.2	F858 H860 T865 Q866	F858-L862 HydrophobicContact CD1-CD1 3.89Å; F858-L862 HydrophobicContact CE1-CD1 3.48Å; F858-L862 VanDerWaalsContact CE1-CD1 3.48Å; F858-L862 HydrophobicContact CZ-CD1 3.9Å; F858-L862 WeakPolarHBondContact O-CB 3.3Å; F858-L862 PolarHBondContact O-N 3.25Å; H860-L862 VanDerWaalsContact C-N 3.28Å; H860-L862 PolarHBondContact O-N 3.44Å; L862-T865 PolarHBondContact O-OG1 2.96Å; L862-Q866 WeakPolarHBondContact O-CB 3.27Å; L862-Q866 WeakPolarHBondContact O-CG 3.19Å; L862-Q866 PolarHBondContact O-N 3.42Å; L862-Q866 VanDerWaalsContact O-N 3.07Å
863	N	51	Low	54.7	Low	98 Å²	98	99.2 Å²	99.2	52%	0.524	50%	0.495	S	S	.	.	H	α-helix	trans	-67.3	-43.8	175.7	-82	5.6	0	0	0	111.5	Y859 H860 T865 Q866 E867	Y859-N863 PolarHBondContact O-N 3.43Å; Y859-N863 VanDerWaalsContact O-N 3.15Å; H860-N863 PolarHBondContact O-N 2.9Å; N863-T865 VanDerWaalsContact C-N 3.3Å; N863-T865 PolarHBondContact O-N 2.94Å; N863-Q866 PolarHBondContact O-N 3.45Å; N863-E867 PolarHBondContact O-N 3.14Å
864	E	55.9	Low	55.1	Low	109 Å²	109	100.6 Å²	100.6	51%	0.509	50%	0.502	S	S	.	.	H	α-helix	trans	-63.8	-34.7	-179.3	-166.4	167.7	171.4	0	0	111.8	H860 T868	H860-E864 IonicContact CE1-OE2 2.77Å; H860-E864 PolarHBondContact CE1-OE2 3.21Å; H860-E864 VanDerWaalsContact CE1-OE2 3.26Å; H860-E864 IonicContact ND1-OE2 2.65Å; H860-E864 PolarHBondContact ND1-OE2 3.08Å; H860-E864 VanDerWaalsContact ND1-OE2 3.1Å; H860-E864 VanDerWaalsContact O-CB 3.31Å; H860-E864 WeakPolarHBondContact O-CB 3.42Å; H860-E864 PolarHBondContact O-N 3.23Å; E864-T868 WeakPolarHBondContact O-CB 3.49Å; E864-T868 WeakPolarHBondContact O-CG2 3.35Å; E864-T868 PolarHBondContact O-N 2.97Å; E864-T868 PolarHBondContact O-OG1 3.31Å
865	T	53.9	Low	55.4	Low	87 Å²	87	98.9 Å²	98.9	53%	0.534	50%	0.501	S	S	.	.	H	α-helix	trans	-78.3	-20	171.8	52.3	0	0	0	0	114.5	E861 L862 N863 F869	E861-T865 WeakPolarHBondContact O-CB 3.49Å; E861-T865 WeakPolarHBondContact O-CG2 3.39Å; E861-T865 PolarHBondContact O-N 3Å; E861-T865 PolarHBondContact O-OG1 2.97Å; L862-T865 PolarHBondContact O-OG1 2.96Å; N863-T865 VanDerWaalsContact C-N 3.3Å; N863-T865 PolarHBondContact O-N 2.94Å; T865-F869 WeakPolarHBondContact O-CB 3.3Å
866	Q	53.1	Low	55.6	Low	113 Å²	113	98.7 Å²	98.7	53%	0.528	50%	0.5	S	S	.	.	H	α-helix	trans	-81.4	-44.6	171.6	-76.9	-176.8	17.6	0	0	112.5	L862 N863 F869 L870	L862-Q866 WeakPolarHBondContact O-CB 3.27Å; L862-Q866 WeakPolarHBondContact O-CG 3.19Å; L862-Q866 PolarHBondContact O-N 3.42Å; L862-Q866 VanDerWaalsContact O-N 3.07Å; N863-Q866 PolarHBondContact O-N 3.45Å; Q866-F869 PolarHBondContact O-N 3.2Å; Q866-L870 WeakPolarHBondContact O-CG 3.4Å; Q866-L870 PolarHBondContact O-N 3.46Å
867	E	57.8	Low	55.3	Low	117 Å²	117	100.9 Å²	100.9	55%	0.547	50%	0.501	S	S	.	.	H	α-helix	trans	-64	-46.7	178.3	-71.3	-172	160.9	0	0	110.9	N863 F869 L870 E871	N863-E867 PolarHBondContact O-N 3.14Å; E867-F869 VanDerWaalsContact C-N 3.26Å; E867-F869 PolarHBondContact O-N 3.31Å; E867-L870 PolarHBondContact O-N 3.13Å; E867-L870 VanDerWaalsContact O-N 3.09Å; E867-E871 PolarHBondContact O-N 3.29Å
868	T	55.9	Low	55.8	Low	69 Å²	69	99.1 Å²	99.1	42%	0.423	49%	0.494	S	S	.	.	H	α-helix	trans	-62.3	-29.6	175.9	51.2	0	0	0	0	113.6	E864 T872	E864-T868 WeakPolarHBondContact O-CB 3.49Å; E864-T868 WeakPolarHBondContact O-CG2 3.35Å; E864-T868 PolarHBondContact O-N 2.97Å; E864-T868 PolarHBondContact O-OG1 3.31Å; T868-T872 VanDerWaalsContact O-CB 3.31Å; T868-T872 WeakPolarHBondContact O-CB 3.47Å; T868-T872 PolarHBondContact O-N 2.89Å; T868-T872 VanDerWaalsContact O-N 3.1Å; T868-T872 PolarHBondContact O-OG1 2.99Å
869	F	61.7	Low	55.9	Low	81 Å²	81	100.5 Å²	100.5	36%	0.355	50%	0.502	S	S	.	.	H	α-helix	trans	-71.7	-40.6	172.9	-179.6	-106.6	0	0	0	112.3	N768 I772 T865 Q866 E867 T872 L873	N768-F869 HydrophobicContact CB-CZ 4.4Å; I772-F869 HydrophobicContact CD1-CE1 4.48Å; T865-F869 WeakPolarHBondContact O-CB 3.3Å; Q866-F869 PolarHBondContact O-N 3.2Å; E867-F869 VanDerWaalsContact C-N 3.26Å; E867-F869 PolarHBondContact O-N 3.31Å; F869-T872 PolarHBondContact O-N 2.86Å; F869-L873 HydrophobicContact CD1-CD1 3.99Å; F869-L873 HydrophobicContact CE1-CD1 3.5Å; F869-L873 HydrophobicContact CE1-CG 4.49Å; F869-L873 HydrophobicContact CZ-CD1 3.83Å; F869-L873 HydrophobicContact CZ-CG 4.45Å; F869-L873 PolarHBondContact O-N 3.48Å
870	L	59.1	Low	55.9	Low	110 Å²	110	97.7 Å²	97.7	58%	0.576	49%	0.494	S	S	*	.	H	α-helix	trans	-66.4	-44.6	175.8	-74.3	167.3	0	0	0	112.1	Q866 E867 T872 L873 Q874	Q866-L870 WeakPolarHBondContact O-CG 3.4Å; Q866-L870 PolarHBondContact O-N 3.46Å; E867-L870 PolarHBondContact O-N 3.13Å; E867-L870 VanDerWaalsContact O-N 3.09Å; L870-T872 VanDerWaalsContact C-N 3.32Å; L870-T872 PolarHBondContact O-N 3.33Å; L870-L873 PolarHBondContact O-N 2.97Å; L870-Q874 WeakPolarHBondContact O-CB 3.5Å; L870-Q874 PolarHBondContact O-N 2.84Å
871	E	58.3	Low	55.7	Low	133 Å²	133	94.5 Å²	94.5	62%	0.621	49%	0.486	S	S	*	.	H	α-helix	trans	-58.6	-43.7	173	-71.3	-169.6	140.3	0	0	111.5	E867 L873 Q874 A875	E867-E871 PolarHBondContact O-N 3.29Å; E871-L873 VanDerWaalsContact C-N 3.35Å; E871-L873 PolarHBondContact O-N 2.97Å; E871-Q874 PolarHBondContact O-N 3.34Å; E871-A875 WeakPolarHBondContact O-CB 3.32Å; E871-A875 PolarHBondContact O-N 2.95Å
872	T	58.9	Low	56	Low	81 Å²	81	94.5 Å²	94.5	50%	0.497	48%	0.484	S	S	.	.	H	α-helix	trans	-63.2	-39.3	178	-61	0	0	0	0	111.8	T868 F869 L870 N876	T868-T872 VanDerWaalsContact O-CB 3.31Å; T868-T872 WeakPolarHBondContact O-CB 3.47Å; T868-T872 PolarHBondContact O-N 2.89Å; T868-T872 VanDerWaalsContact O-N 3.1Å; T868-T872 PolarHBondContact O-OG1 2.99Å; F869-T872 PolarHBondContact O-N 2.86Å; L870-T872 VanDerWaalsContact C-N 3.32Å; L870-T872 PolarHBondContact O-N 3.33Å; T872-N876 PolarHBondContact O-N 3.11Å; T872-N876 VanDerWaalsContact O-N 3.17Å; T872-N876 PolarHBondContact O-ND2 3.46Å
873	L	60.8	Low	55.7	Low	62 Å²	62	95.8 Å²	95.8	33%	0.325	49%	0.488	S	S	.	.	H	α-helix	trans	-64.8	-45.5	173.3	-87.4	166.8	0	0	0	112.1	F869 L870 E871 N876 Q877	F869-L873 HydrophobicContact CD1-CD1 3.99Å; F869-L873 HydrophobicContact CE1-CD1 3.5Å; F869-L873 HydrophobicContact CE1-CG 4.49Å; F869-L873 HydrophobicContact CZ-CD1 3.83Å; F869-L873 HydrophobicContact CZ-CG 4.45Å; F869-L873 PolarHBondContact O-N 3.48Å; L870-L873 PolarHBondContact O-N 2.97Å; E871-L873 VanDerWaalsContact C-N 3.35Å; E871-L873 PolarHBondContact O-N 2.97Å; L873-N876 PolarHBondContact O-N 2.96Å; L873-Q877 PolarHBondContact O-N 3.44Å; L873-Q877 VanDerWaalsContact O-N 3.1Å
874	Q	57.9	Low	55.6	Low	127 Å²	127	97.1 Å²	97.1	59%	0.593	50%	0.495	S	S	*	.	H	α-helix	trans	-66.3	-40.7	-178.7	-163	174.4	18.7	0	0	111.7	L870 E871 Q877 I878	L870-Q874 WeakPolarHBondContact O-CB 3.5Å; L870-Q874 PolarHBondContact O-N 2.84Å; E871-Q874 PolarHBondContact O-N 3.34Å; Q874-Q877 PolarHBondContact O-N 3.17Å; Q874-I878 HydrophobicContact CG-CD1 4.25Å; Q874-I878 VanDerWaalsContact O-CG1 3.3Å; Q874-I878 WeakPolarHBondContact O-CG1 3.23Å; Q874-I878 PolarHBondContact O-N 3.19Å
875	A	58	Low	55.4	Low	56 Å²	56	96.8 Å²	96.8	46%	0.463	50%	0.495	S	S	.	.	H	α-helix	trans	-59.4	-45.6	173.4	0	0	0	0	0	112.1	E871 Q877 I878 E879	E871-A875 WeakPolarHBondContact O-CB 3.32Å; E871-A875 PolarHBondContact O-N 2.95Å; A875-Q877 PolarHBondContact O-N 3.22Å; A875-I878 PolarHBondContact O-N 3.13Å; A875-E879 PolarHBondContact O-N 3.19Å
876	N	54.1	Low	55.1	Low	77 Å²	77	98 Å²	98	41%	0.412	49%	0.493	S	S	.	.	H	α-helix	trans	-62.6	-40.7	177.7	-86.2	-74.9	0	0	0	112.8	T872 L873 I878 E879 Q880	T872-N876 PolarHBondContact O-N 3.11Å; T872-N876 VanDerWaalsContact O-N 3.17Å; T872-N876 PolarHBondContact O-ND2 3.46Å; L873-N876 PolarHBondContact O-N 2.96Å; N876-I878 VanDerWaalsContact C-N 3.34Å; N876-I878 PolarHBondContact O-N 3.1Å; N876-E879 PolarHBondContact O-N 2.62Å; N876-Q880 WeakPolarHBondContact O-CG 3.28Å; N876-Q880 PolarHBondContact O-N 3.05Å
877	Q	52.2	Low	54.4	Low	129 Å²	129	96 Å²	96	60%	0.603	49%	0.486	S	S	*	.	H	α-helix	trans	-65.4	-37.2	175	-69.8	-175.2	6.1	0	0	112.3	L873 Q874 A875 E879 S881	L873-Q877 PolarHBondContact O-N 3.44Å; L873-Q877 VanDerWaalsContact O-N 3.1Å; Q874-Q877 PolarHBondContact O-N 3.17Å; A875-Q877 PolarHBondContact O-N 3.22Å; Q877-E879 VanDerWaalsContact C-N 3.34Å; Q877-S881 WeakPolarHBondContact O-CB 3.19Å; Q877-S881 PolarHBondContact O-N 3.41Å; Q877-S881 PolarHBondContact O-OG 3.42Å
878	I	57.8	Low	53.7	Low	76 Å²	76	99.8 Å²	99.8	39%	0.39	50%	0.495	S	S	.	.	H	α-helix	trans	-67	-34.9	174.6	-70.1	167.2	0	0	0	111.1	Q874 A875 N876 S881 K882	Q874-I878 HydrophobicContact CG-CD1 4.25Å; Q874-I878 VanDerWaalsContact O-CG1 3.3Å; Q874-I878 WeakPolarHBondContact O-CG1 3.23Å; Q874-I878 PolarHBondContact O-N 3.19Å; A875-I878 PolarHBondContact O-N 3.13Å; N876-I878 VanDerWaalsContact C-N 3.34Å; N876-I878 PolarHBondContact O-N 3.1Å; I878-S881 WeakPolarHBondContact CA-OG 3.13Å; I878-S881 PolarHBondContact O-OG 2.83Å; I878-S881 VanDerWaalsContact O-OG 3.09Å; I878-K882 HydrophobicContact CG2-CD 4.06Å; I878-K882 VanDerWaalsContact CG2-CE 3.45Å; I878-K882 WeakPolarHBondContact O-CB 3.2Å; I878-K882 WeakPolarHBondContact O-CD 3.46Å; I878-K882 WeakPolarHBondContact O-CG 3.33Å; I878-K882 PolarHBondContact O-N 3.17Å
879	E	58.9	Low	53	Low	132 Å²	132	101.1 Å²	101.1	62%	0.617	50%	0.499	S	S	*	.	H	α-helix	trans	-76.3	-41.5	178	-167.9	149.8	-155	0	0	112.7	A875 N876 Q877 S881 K882 E883	A875-E879 PolarHBondContact O-N 3.19Å; N876-E879 PolarHBondContact O-N 2.62Å; Q877-E879 VanDerWaalsContact C-N 3.34Å; E879-S881 PolarHBondContact O-N 3.38Å; E879-K882 PolarHBondContact O-N 3.19Å; E879-E883 PolarHBondContact O-N 2.94Å
880	Q	48.8	Very low	51.8	Low	91 Å²	91	102.8 Å²	102.8	43%	0.425	51%	0.506	S	S	.	.	H	α-helix	trans	-59	-44.6	171.7	-72.5	179.9	15.1	0	0	112	N876 E883 L884	N876-Q880 WeakPolarHBondContact O-CG 3.28Å; N876-Q880 PolarHBondContact O-N 3.05Å; Q880-E883 PolarHBondContact O-N 3.11Å; Q880-L884 WeakPolarHBondContact O-CG 3.22Å; Q880-L884 PolarHBondContact O-N 3.43Å
881	S	51.8	Low	50.7	Low	53 Å²	53	103.9 Å²	103.9	37%	0.371	51%	0.512	S	S	.	.	H	α-helix	trans	-68.3	-35.7	177.8	53.3	0	0	0	0	112.8	Q877 I878 E879 L884 I885	Q877-S881 WeakPolarHBondContact O-CB 3.19Å; Q877-S881 PolarHBondContact O-N 3.41Å; Q877-S881 PolarHBondContact O-OG 3.42Å; I878-S881 WeakPolarHBondContact CA-OG 3.13Å; I878-S881 PolarHBondContact O-OG 2.83Å; I878-S881 VanDerWaalsContact O-OG 3.09Å; E879-S881 PolarHBondContact O-N 3.38Å; S881-L884 PolarHBondContact O-N 3.06Å; S881-I885 WeakPolarHBondContact O-CB 3.21Å; S881-I885 VanDerWaalsContact O-CG1 3.28Å; S881-I885 WeakPolarHBondContact O-CG1 3.29Å; S881-I885 PolarHBondContact O-N 3.37Å
882	K	54.9	Low	49.6	Very low	132 Å²	132	104.2 Å²	104.2	57%	0.574	52%	0.518	S	S	*	.	H	α-helix	trans	-61.4	-46.4	171.2	-78.9	166.4	-176.8	170.1	0	112.4	I878 E879 I885 K886	I878-K882 HydrophobicContact CG2-CD 4.06Å; I878-K882 VanDerWaalsContact CG2-CE 3.45Å; I878-K882 WeakPolarHBondContact O-CB 3.2Å; I878-K882 WeakPolarHBondContact O-CD 3.46Å; I878-K882 WeakPolarHBondContact O-CG 3.33Å; I878-K882 PolarHBondContact O-N 3.17Å; E879-K882 PolarHBondContact O-N 3.19Å; K882-I885 PolarHBondContact O-N 2.89Å; K882-K886 WeakPolarHBondContact O-CB 3.46Å; K882-K886 PolarHBondContact O-N 3.4Å
883	E	49.5	Very low	48.6	Very low	79 Å²	79	104.5 Å²	104.5	37%	0.369	52%	0.52	S	S	.	.	H	α-helix	trans	-67.1	-39.2	175.8	-84.2	-62.4	148.4	0	0	112.1	E879 Q880 I885 K886 N887	E879-E883 PolarHBondContact O-N 2.94Å; Q880-E883 PolarHBondContact O-N 3.11Å; E883-I885 VanDerWaalsContact C-N 3.32Å; E883-I885 PolarHBondContact O-N 3.14Å; E883-K886 PolarHBondContact O-N 2.93Å; E883-K886 WeakPolarHBondContact OE1-CD 3.49Å; E883-K886 WeakPolarHBondContact OE1-CE 3.31Å; E883-K886 IonicContact OE1-NZ 3.1Å; E883-K886 PolarHBondContact OE1-NZ 3.48Å; E883-N887 WeakPolarHBondContact O-CB 3.45Å; E883-N887 PolarHBondContact O-N 2.89Å; E883-N887 PolarHBondContact O-ND2 2.92Å; E883-N887 PolarHBondContact OE2-ND2 3.03Å
884	L	47.6	Very low	47.3	Very low	125 Å²	125	105.6 Å²	105.6	65%	0.654	53%	0.526	S	S	*	.	H	α-helix	trans	-59.5	-40.9	173.2	-75.6	170.9	0	0	0	112.3	Q880 S881 R888	Q880-L884 WeakPolarHBondContact O-CG 3.22Å; Q880-L884 PolarHBondContact O-N 3.43Å; S881-L884 PolarHBondContact O-N 3.06Å; L884-R888 WeakPolarHBondContact O-CB 3.48Å; L884-R888 PolarHBondContact O-N 3.32Å; L884-R888 VanDerWaalsContact O-N 3.1Å
885	I	52.6	Low	46.1	Very low	103 Å²	103	106.6 Å²	106.6	53%	0.528	54%	0.535	S	S	.	.	H	α-helix	trans	-68	-47.5	175.8	-70.7	165.3	0	0	0	110.9	S881 K882 E883 N887 R888 I889	S881-I885 WeakPolarHBondContact O-CB 3.21Å; S881-I885 VanDerWaalsContact O-CG1 3.28Å; S881-I885 WeakPolarHBondContact O-CG1 3.29Å; S881-I885 PolarHBondContact O-N 3.37Å; K882-I885 PolarHBondContact O-N 2.89Å; E883-I885 VanDerWaalsContact C-N 3.32Å; E883-I885 PolarHBondContact O-N 3.14Å; I885-N887 PolarHBondContact O-N 2.84Å; I885-R888 CarbonylContact O-C 3.56Å; I885-R888 PolarHBondContact O-N 2.87Å; I885-R888 VanDerWaalsContact O-N 3.08Å; I885-I889 HydrophobicContact CG2-CD1 3.76Å; I885-I889 HydrophobicContact CG2-CG1 4.45Å; I885-I889 WeakPolarHBondContact O-CG1 3.21Å; I885-I889 PolarHBondContact O-N 3.4Å
886	K	47.7	Very low	45.3	Very low	113 Å²	113	107.4 Å²	107.4	49%	0.491	54%	0.538	S	S	.	.	H	α-helix	trans	-59.9	-44.7	-179	-176.5	176.6	164.6	-161.5	0	112.2	K882 E883 R888 I889 F890	K882-K886 WeakPolarHBondContact O-CB 3.46Å; K882-K886 PolarHBondContact O-N 3.4Å; E883-K886 PolarHBondContact O-N 2.93Å; E883-K886 WeakPolarHBondContact OE1-CD 3.49Å; E883-K886 WeakPolarHBondContact OE1-CE 3.31Å; E883-K886 IonicContact OE1-NZ 3.1Å; E883-K886 PolarHBondContact OE1-NZ 3.48Å; K886-R888 VanDerWaalsContact C-N 3.35Å; K886-I889 PolarHBondContact O-N 3.22Å; K886-F890 PolarHBondContact O-N 3.33Å
887	N	39.2	Very low	44.3	Very low	70 Å²	70	108 Å²	108	37%	0.374	54%	0.541	S	S	.	.	H	α-helix	trans	-71.3	-26.9	174.9	-69.3	-74	0	0	0	112.8	E883 I885 L891	E883-N887 WeakPolarHBondContact O-CB 3.45Å; E883-N887 PolarHBondContact O-N 2.89Å; E883-N887 PolarHBondContact O-ND2 2.92Å; E883-N887 PolarHBondContact OE2-ND2 3.03Å; I885-N887 PolarHBondContact O-N 2.84Å; N887-L891 WeakPolarHBondContact O-CG 3.26Å; N887-L891 PolarHBondContact O-N 3.38Å
888	R	41.6	Very low	43.6	Very low	196 Å²	196	108.7 Å²	108.7	74%	0.74	55%	0.548	S	S	*	.	H	α-helix	trans	-77.7	-24.1	174.3	-164.8	175.9	-164.6	173.9	4.5	113.3	L884 I885 K886 N892	L884-R888 WeakPolarHBondContact O-CB 3.48Å; L884-R888 PolarHBondContact O-N 3.32Å; L884-R888 VanDerWaalsContact O-N 3.1Å; I885-R888 CarbonylContact O-C 3.56Å; I885-R888 PolarHBondContact O-N 2.87Å; I885-R888 VanDerWaalsContact O-N 3.08Å; K886-R888 VanDerWaalsContact C-N 3.35Å; R888-N892 PolarHBondContact O-ND2 3.47Å; R888-N892 VanDerWaalsContact O-ND2 3.16Å
889	I	41.4	Very low	42.2	Very low	97 Å²	97	109.2 Å²	109.2	50%	0.497	56%	0.558	S	S	.	*	H	α-helix	trans	-76.8	-50	170.3	-68.2	167.5	0	0	0	109.8	I885 K886 L891 N892 T893	I885-I889 HydrophobicContact CG2-CD1 3.76Å; I885-I889 HydrophobicContact CG2-CG1 4.45Å; I885-I889 WeakPolarHBondContact O-CG1 3.21Å; I885-I889 PolarHBondContact O-N 3.4Å; K886-I889 PolarHBondContact O-N 3.22Å; I889-L891 PolarHBondContact O-N 2.92Å; I889-N892 PolarHBondContact O-N 3.23Å; I889-T893 PolarHBondContact O-OG1 3.02Å
890	F	36.2	Very low	41.2	Very low	117 Å²	117	107.7 Å²	107.7	51%	0.513	56%	0.557	S	S	.	*	H	α-helix	trans	-56.6	-21.2	-179.8	-117.8	-82.4	0	0	0	115	K886	K886-F890 PolarHBondContact O-N 3.33Å
891	L	35.7	Very low	40.4	Very low	133 Å²	133	112 Å²	112	70%	0.696	57%	0.57	S	S	*	*	H	α-helix	trans	-86.9	-8.9	177.8	-72.4	171.4	0	0	0	114.3	N887 I889	N887-L891 WeakPolarHBondContact O-CG 3.26Å; N887-L891 PolarHBondContact O-N 3.38Å; I889-L891 PolarHBondContact O-N 2.92Å
892	N	36.5	Very low	39.6	Very low	139 Å²	139	114.9 Å²	114.9	74%	0.743	59%	0.585	S	S	*	*	H	α-helix	trans	-112.8	-10.3	-176.3	-75.1	-41.7	0	0	0	114.7	R888 I889	R888-N892 PolarHBondContact O-ND2 3.47Å; R888-N892 VanDerWaalsContact O-ND2 3.16Å; I889-N892 PolarHBondContact O-N 3.23Å
893	T	37.5	Very low	38.5	Very low	88 Å²	88	116.1 Å²	116.1	54%	0.54	59%	0.594	S	S	.	*	H	α-helix	trans	-113.5	-24	-171.8	42.4	0	0	0	0	116.3	I889	I889-T893 PolarHBondContact O-OG1 3.02Å
894	D	33.4	Very low	37.6	Very low	84 Å²	84	118.1 Å²	118.1	45%	0.449	61%	0.608	S	S	.	*	S	Bend	trans	-107.5	15.8	-159	-67.2	-79.8	0	0	0	116.3
895	N	33.7	Very low	37	Very low	148 Å²	148	121.7 Å²	121.7	79%	0.791	62%	0.618	S	S	*	*	S	Bend	trans	-100	-1.5	-175	-81.2	-54.2	0	0	0	116.4
896	S	39.5	Very low	36	Very low	74 Å²	74	128.8 Å²	128.8	52%	0.517	64%	0.638	S	S	.	*	S	Bend	trans	-95.4	-51.2	174.8	56.5	0	0	0	0	113.3
897	D	34.5	Very low	35.3	Very low	90 Å²	90	128.6 Å²	128.6	48%	0.481	65%	0.648	S	S	.	*	H	α-helix	trans	-86.1	-20.8	-157.6	-83.4	38.5	0	0	0	114.7	R901	D897-R901 IonicContact OD2-CZ 3.99Å; D897-R901 IonicContact OD2-NH1 3.27Å; D897-R901 PolarHBondContact OD2-NH1 3.01Å; D897-R901 VanDerWaalsContact OD2-NH1 3.08Å
898	L	36.8	Very low	34.9	Very low	142 Å²	142	133.4 Å²	133.4	74%	0.743	67%	0.674	S	S	*	*	H	α-helix	trans	-80	-19.1	-178.1	-143	71.6	0	0	0	113.1	T902	L898-T902 PolarHBondContact O-OG1 2.86Å; L898-T902 VanDerWaalsContact O-OG1 3.04Å
899	C	29.3	Very low	34.4	Very low	88 Å²	88	129.3 Å²	129.3	60%	0.595	68%	0.676	S	S	*	*	H	α-helix	trans	-83.9	-31.8	-179.4	-162.5	0	0	0	0	112.8	T902	C899-T902 PolarHBondContact O-OG1 2.64Å
900	V	36.4	Very low	33.9	Very low	100 Å²	100	131.8 Å²	131.8	61%	0.606	69%	0.688	S	S	*	*	H	α-helix	trans	-83.6	-33.1	-176.4	-177.6	0	0	0	0	112.4	T902	V900-T902 PolarHBondContact O-N 3.24Å
901	R	32.9	Very low	33.8	Very low	182 Å²	182	133 Å²	133	69%	0.687	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-10.1	-176	-71.3	177.3	170.2	130.2	-1.6	114.4	D897	D897-R901 IonicContact OD2-CZ 3.99Å; D897-R901 IonicContact OD2-NH1 3.27Å; D897-R901 PolarHBondContact OD2-NH1 3.01Å; D897-R901 VanDerWaalsContact OD2-NH1 3.08Å
902	T	35.4	Very low	33.6	Very low	113 Å²	113	130.7 Å²	130.7	69%	0.693	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-15.8	177.6	37.5	0	0	0	0	114.3	L898 C899 V900	L898-T902 PolarHBondContact O-OG1 2.86Å; L898-T902 VanDerWaalsContact O-OG1 3.04Å; C899-T902 PolarHBondContact O-OG1 2.64Å; V900-T902 PolarHBondContact O-N 3.24Å
903	M	31	Very low	33.4	Very low	157 Å²	157	131 Å²	131	77%	0.773	71%	0.706	S	S	*	*	S	Bend	trans	-82.8	-15	178.9	-74.3	-70.7	-176.8	0	0	114.7
904	N	31.1	Very low	33.2	Very low	122 Å²	122	133.5 Å²	133.5	65%	0.652	72%	0.721	S	S	*	*	S	Bend	trans	-128.7	71.5	-165.7	-78.7	-61.2	0	0	0	114
905	K	34	Very low	33.2	Very low	200 Å²	200	138.2 Å²	138.2	87%	0.87	74%	0.74	S	S	*	*			trans	178.6	70.3	156.5	-99.4	149.5	-171.6	172.2	0	114.9
906	R	32	Very low	33	Very low	251 Å²	251	136 Å²	136	95%	0.947	74%	0.736	S	S	*	*			trans	-144.4	153.2	150.8	-90.5	-160.3	172.9	163.5	0.1	111.9
907	P	34.1	Very low	32.6	Very low	109 Å²	109	139.8 Å²	139.8	71%	0.708	75%	0.749	S	S	*	*			trans	-112.8	164.1	-153.3	40.1	-31.5	0	0	0	116.1	S909	P907-S909 PolarHBondContact O-N 2.86Å; P907-S909 VanDerWaalsContact O-N 3.16Å
908	N	29.9	Very low	32.6	Very low	172 Å²	172	141 Å²	141	92%	0.92	76%	0.764	S	S	*	*			trans	-18	98.6	166.7	-57.2	-13.4	0	0	0	116.3
909	S	30.9	Very low	32.3	Very low	110 Å²	110	140.4 Å²	140.4	77%	0.769	77%	0.767	S	S	*	*			trans	-156.1	23.6	169.1	-166.1	0	0	0	0	115.8	P907	P907-S909 PolarHBondContact O-N 2.86Å; P907-S909 VanDerWaalsContact O-N 3.16Å
910	I	31	Very low	32.5	Very low	148 Å²	148	141.5 Å²	141.5	76%	0.759	78%	0.775	S	S	*	*			trans	-131.5	97	173.6	-53.7	-179.7	0	0	0	110
911	T	33.6	Very low	32.4	Very low	143 Å²	143	142.9 Å²	142.9	88%	0.877	78%	0.784	S	S	*	*	S	Bend	trans	-149.3	36.5	173.7	-38.9	0	0	0	0	110.4
912	A	31.9	Very low	32.5	Very low	85 Å²	85	138.9 Å²	138.9	70%	0.702	78%	0.784	S	S	*	*	S	Bend	trans	-148.9	-4.8	-170.1	0	0	0	0	0	116.3
913	I	33	Very low	32.2	Very low	145 Å²	145	139 Å²	139	74%	0.744	79%	0.79	S	S	*	*	S	Bend	trans	-138.2	41.7	-171.7	-35.4	-178.9	0	0	0	112.7
914	V	33.2	Very low	32.4	Very low	140 Å²	140	138 Å²	138	85%	0.848	79%	0.792	S	S	*	*	S	Bend	trans	-143.1	50.2	164.2	-162.2	0	0	0	0	109.5
915	Q	32.4	Very low	32.4	Very low	184 Å²	184	137.3 Å²	137.3	86%	0.86	80%	0.797	S	S	*	*	S	Bend	trans	-139.6	28.6	-173.3	-152.6	174.2	8.8	0	0	112.6
916	S	30	Very low	32.2	Very low	100 Å²	100	132.2 Å²	132.2	70%	0.699	79%	0.786	S	S	*	*	S	Bend	trans	-141.8	8.6	-165.8	46.9	0	0	0	0	115
917	I	32	Very low	32.1	Very low	154 Å²	154	127.3 Å²	127.3	79%	0.79	78%	0.778	S	S	*	*	S	Bend	trans	-138.9	148.4	172.7	-52.7	-179.4	0	0	0	108.3
918	S	34.6	Very low	32.1	Very low	115 Å²	115	129.1 Å²	129.1	80%	0.804	78%	0.781	S	S	*	*			trans	71.3	57	176.6	-54.6	0	0	0	0	116.8
919	T	29.6	Very low	32	Very low	130 Å²	130	126.4 Å²	126.4	80%	0.798	78%	0.775	S	S	*	*			trans	-73.6	160.7	145.4	44	0	0	0	0	110.6
920	S	33.8	Very low	32.3	Very low	111 Å²	111	127.7 Å²	127.7	78%	0.776	78%	0.778	S	S	*	*			trans	75.2	135.6	-177.2	-18.3	0	0	0	0	113.7
921	T	34.6	Very low	32.5	Very low	129 Å²	129	130 Å²	130	79%	0.791	78%	0.783	S	S	*	*			cis	-141.8	167.5	6.7	43.8	0	0	0	0	113.5
922	S	34	Very low	32.3	Very low	99 Å²	99	128.7 Å²	128.7	69%	0.692	78%	0.78	S	S	*	*			trans	-21	133.1	164.6	49.4	0	0	0	0	118.4
923	S	29.8	Very low	32.2	Very low	115 Å²	115	127.8 Å²	127.8	80%	0.804	78%	0.778	S	S	*	*				83	99.1	59.6	-60.4	0	0	0	0	116.3
924	V	34.1	Very low	32.4	Very low	135 Å²	135	128.6 Å²	128.6	82%	0.818	78%	0.783	S	S	*	*			trans	-177.3	130.3	137.3	-92	0	0	0	0	107.5
925	S	31.3	Very low	32.5	Very low	108 Å²	108	127.7 Å²	127.7	76%	0.755	77%	0.774	S	S	*	*				58.5	134	79.7	-48.8	0	0	0	0	114.1
926	S	29.7	Very low	32.6	Very low	93 Å²	93	126 Å²	126	65%	0.65	77%	0.766	S	S	*	*			cis	176	178.3	-8.2	49.6	0	0	0	0	109.5
927	L	31	Very low	32.6	Very low	148 Å²	148	131.3 Å²	131.3	78%	0.775	77%	0.771	S	S	*	*			trans	83.8	140.9	148.4	-75.2	166.3	0	0	0	123.3
928	I	33.3	Very low	32.9	Very low	148 Å²	148	129 Å²	129	76%	0.759	77%	0.769	S	S	*	*			trans	89.5	142.9	148.4	-70.6	156.2	0	0	0	120.3
929	S	28.6	Very low	32.8	Very low	114 Å²	114	130.6 Å²	130.6	80%	0.797	77%	0.768	S	S	*	*			trans	-142.5	137.5	-175	-42.6	0	0	0	0	111.9
930	T	36	Very low	32.8	Very low	138 Å²	138	129.6 Å²	129.6	85%	0.847	77%	0.766	S	S	*	*			trans	-154.1	128.7	161.3	38.1	0	0	0	0	106.7
931	K	35.2	Very low	32.9	Very low	195 Å²	195	130.2 Å²	130.2	85%	0.848	77%	0.765	S	S	*	*			cis	96.8	105.3	30.5	-146.6	-175	-167.8	-171.3	0	114.1
932	S	30.2	Very low	32.9	Very low	116 Å²	116	131.9 Å²	131.9	81%	0.811	77%	0.768	S	S	*	*			trans	62.2	132.8	146.1	61.1	0	0	0	0	123.6
933	G	30.2	Very low	32.8	Very low	66 Å²	66	131.5 Å²	131.5	68%	0.68	77%	0.765	S	S	*	*				143.1	148.1	128.8	0	0	0	0	0	118.7
934	L	37.1	Very low	33	Very low	162 Å²	162	134.1 Å²	134.1	85%	0.848	77%	0.765	S	S	*	*			trans	71.6	142.9	159.5	-44.5	-177.6	0	0	0	116.7
935	N	35.3	Very low	33.2	Very low	121 Å²	121	135.1 Å²	135.1	65%	0.647	76%	0.764	S	S	*	*			cis	-150	142.9	-8.7	-98.4	-5	0	0	0	107.9
936	E	33.9	Very low	33.5	Very low	150 Å²	150	135.3 Å²	135.3	70%	0.701	76%	0.757	S	S	*	*				50.5	145.1	88.8	-69.4	-148.2	124.2	0	0	117.4
937	R	31.3	Very low	34	Very low	210 Å²	210	136.8 Å²	136.8	79%	0.792	76%	0.757	S	S	*	*			cis	179.1	136.2	-20	-179.9	174.7	-175.3	172.7	-0.9	108.6
938	S	36.8	Very low	34.5	Very low	107 Å²	107	134.8 Å²	134.8	75%	0.748	76%	0.755	S	S	*	*			trans	-165.9	123.4	166.9	-83.9	0	0	0	0	114.4
939	N	33.5	Very low	34.9	Very low	148 Å²	148	134.7 Å²	134.7	79%	0.791	75%	0.751	S	S	*	*			trans	48.9	122.4	151.6	-49.4	-24.1	0	0	0	119.2
940	S	29.9	Very low	35.3	Very low	108 Å²	108	135.2 Å²	135.2	76%	0.755	74%	0.743	S	S	*	*				61.9	128	54.2	-155.8	0	0	0	0	111.3
941	V	35.2	Very low	35.8	Very low	124 Å²	124	134.6 Å²	134.6	75%	0.752	73%	0.733	S	S	*	*				-145.4	170.6	51.3	172	0	0	0	0	111.5
942	L	35.3	Very low	36.2	Very low	165 Å²	165	133 Å²	133	86%	0.864	73%	0.731	S	S	*	*			trans	86	66	179.1	-55.6	-175.5	0	0	0	116.3
943	S	30.9	Very low	37	Very low	90 Å²	90	131.6 Å²	131.6	63%	0.629	72%	0.717	S	S	*	*			trans	-75.5	179.2	149.2	44.5	0	0	0	0	111.9
944	E	34	Very low	37.7	Very low	170 Å²	170	132.5 Å²	132.5	79%	0.794	71%	0.707	S	S	*	*			trans	70.2	94.4	162.6	-67.2	139.7	-104.5	0	0	118.6
945	I	38	Very low	38.3	Very low	157 Å²	157	132.5 Å²	132.5	81%	0.805	70%	0.702	S	S	*	*	S	Bend		-162.5	142.9	116.7	-96.3	151.2	0	0	0	109.4
946	N	38.4	Very low	39.1	Very low	112 Å²	112	134.8 Å²	134.8	60%	0.599	71%	0.706	S	S	*	*			trans	61.4	39.1	168.2	-68.1	-12.2	0	0	0	120.5	S948 Q949	N946-S948 PolarHBondContact O-N 3.28Å; N946-S948 VanDerWaalsContact O-N 3.08Å; N946-Q949 PolarHBondContact O-N 2.84Å
947	L	40.1	Very low	39.7	Very low	124 Å²	124	135.8 Å²	135.8	65%	0.649	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-14.8	167.5	-168.7	58	0	0	0	114	Q949 M950	L947-Q949 PolarHBondContact O-N 3.3Å; L947-M950 HydrophobicContact CD1-CE 4.05Å
948	S	40.8	Very low	40.8	Very low	106 Å²	106	131.8 Å²	131.8	74%	0.741	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-5.1	-179.2	-51.4	0	0	0	0	115.8	N946	N946-S948 PolarHBondContact O-N 3.28Å; N946-S948 VanDerWaalsContact O-N 3.08Å
949	Q	42.6	Very low	41.5	Very low	145 Å²	145	129.5 Å²	129.5	68%	0.678	68%	0.679	S	S	*	*	S	Bend	trans	-100.5	-20.8	176.5	-75.2	-176.7	-25.5	0	0	113.8	N946 L947	N946-Q949 PolarHBondContact O-N 2.84Å; L947-Q949 PolarHBondContact O-N 3.3Å
950	M	37.2	Very low	42.5	Very low	125 Å²	125	127.4 Å²	127.4	62%	0.616	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-81.3	-15.7	-176	-160.6	162.6	70.6	0	0	113.7	L947 T953	L947-M950 HydrophobicContact CD1-CE 4.05Å; M950-T953 PolarHBondContact O-OG1 3.39Å
951	I	45.1	Very low	43.6	Very low	126 Å²	126	129.4 Å²	129.4	65%	0.646	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-79.8	-18.4	-172.5	-64.2	174.2	0	0	0	112.9
952	M	44.3	Very low	44.6	Very low	161 Å²	161	129.6 Å²	129.6	79%	0.793	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-95.4	2.2	177.8	-65.7	-163.8	-63.9	0	0	114.6
953	T	46.6	Very low	45.6	Very low	87 Å²	87	127.6 Å²	127.6	53%	0.534	64%	0.64	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.7	-21.2	-176.2	41.3	0	0	0	0	114.8	M950 Y957	M950-T953 PolarHBondContact O-OG1 3.39Å; T953-Y957 PolarHBondContact O-N 3.33Å
954	D	44.6	Very low	46.9	Very low	85 Å²	85	129.5 Å²	129.5	46%	0.455	64%	0.639	S	S	.	*	H	α-helix	trans	-74	-41	-172.4	-132.1	-53.7	0	0	0	113.1	K956 Y957 Q958	D954-K956 VanDerWaalsContact C-N 3.32Å; D954-K956 PolarHBondContact O-N 3.21Å; D954-Y957 WeakPolarHBondContact O-CB 3.4Å; D954-Y957 PolarHBondContact O-N 3.11Å; D954-Q958 PolarHBondContact O-N 3.46Å; D954-Q958 PolarHBondContact OD1-NE2 2.81Å
955	E	51.3	Low	47.7	Very low	162 Å²	162	123.8 Å²	123.8	76%	0.757	62%	0.618	S	S	*	*	H	α-helix	trans	-59.7	-39.7	-178.6	-64.1	-171.6	142.1	0	0	112.7	S959	E955-S959 VanDerWaalsContact O-CB 3.32Å; E955-S959 WeakPolarHBondContact O-CB 3.16Å; E955-S959 PolarHBondContact O-N 3.49Å
956	K	52.1	Low	48.8	Very low	168 Å²	168	119.2 Å²	119.2	73%	0.73	60%	0.595	S	S	*	*	H	α-helix	trans	-70.5	-30.2	174.3	-79.9	-173.1	174.5	179.4	0	112.9	D954 N960	D954-K956 VanDerWaalsContact C-N 3.32Å; D954-K956 PolarHBondContact O-N 3.21Å; K956-N960 PolarHBondContact O-N 3.19Å
957	Y	45.3	Very low	49.7	Very low	172 Å²	172	119.3 Å²	119.3	68%	0.675	59%	0.592	S	S	*	*	H	α-helix	trans	-74.2	-40.7	178.6	-157	-110.3	0	0	0	111.6	T953 D954 K961	T953-Y957 PolarHBondContact O-N 3.33Å; D954-Y957 WeakPolarHBondContact O-CB 3.4Å; D954-Y957 PolarHBondContact O-N 3.11Å; Y957-K961 PolarHBondContact O-N 3.46Å
958	Q	54.1	Low	50.5	Low	126 Å²	126	119.3 Å²	119.3	59%	0.589	59%	0.588	S	S	*	*	H	α-helix	trans	-69.3	-42.4	175.6	-63	-174.2	29.2	0	0	111.8	D954 N960 K961 Q962	D954-Q958 PolarHBondContact O-N 3.46Å; D954-Q958 PolarHBondContact OD1-NE2 2.81Å; Q958-N960 PolarHBondContact O-N 3.5Å; Q958-K961 PolarHBondContact O-N 3.46Å; Q958-K961 VanDerWaalsContact O-N 3.12Å; Q958-Q962 PolarHBondContact O-N 3.43Å; Q958-Q962 VanDerWaalsContact O-N 3.09Å
959	S	52.3	Low	51.3	Low	58 Å²	58	119.6 Å²	119.6	41%	0.406	58%	0.578	S	S	.	*	H	α-helix	trans	-58.9	-42.1	176.1	-172	0	0	0	0	113	E955 K961 Q962 K963	E955-S959 VanDerWaalsContact O-CB 3.32Å; E955-S959 WeakPolarHBondContact O-CB 3.16Å; E955-S959 PolarHBondContact O-N 3.49Å; S959-K961 VanDerWaalsContact C-N 3.34Å; S959-K961 PolarHBondContact O-N 2.92Å; S959-Q962 WeakPolarHBondContact O-CB 3.2Å; S959-Q962 PolarHBondContact O-N 3.3Å; S959-K963 PolarHBondContact O-N 3.47Å; S959-K963 VanDerWaalsContact O-N 3.14Å
960	N	53.9	Low	52.1	Low	105 Å²	105	115 Å²	115	56%	0.561	56%	0.557	S	S	*	*	H	α-helix	trans	-66.3	-34.1	175.8	-84.7	-12.1	0	0	0	113	K956 Q958 K963 Q964	K956-N960 PolarHBondContact O-N 3.19Å; Q958-N960 PolarHBondContact O-N 3.5Å; N960-K963 PolarHBondContact O-N 2.95Å; N960-Q964 PolarHBondContact O-N 2.93Å
961	K	53.9	Low	53	Low	149 Å²	149	115.7 Å²	115.7	65%	0.648	56%	0.558	S	S	*	*	H	α-helix	trans	-69.3	-36.7	178.4	-145.5	173.9	-171.3	179.6	0	112	Y957 Q958 S959 S965	Y957-K961 PolarHBondContact O-N 3.46Å; Q958-K961 PolarHBondContact O-N 3.46Å; Q958-K961 VanDerWaalsContact O-N 3.12Å; S959-K961 VanDerWaalsContact C-N 3.34Å; S959-K961 PolarHBondContact O-N 2.92Å; K961-S965 PolarHBondContact O-N 3.4Å
962	Q	54.9	Low	53.4	Low	128 Å²	128	116 Å²	116	60%	0.598	56%	0.557	S	S	*	*	H	α-helix	trans	-59.6	-54.9	170.8	-151.5	85.3	13.9	0	0	110.4	Q958 S959 Q964 S965 D966	Q958-Q962 PolarHBondContact O-N 3.43Å; Q958-Q962 VanDerWaalsContact O-N 3.09Å; S959-Q962 WeakPolarHBondContact O-CB 3.2Å; S959-Q962 PolarHBondContact O-N 3.3Å; Q962-Q964 VanDerWaalsContact C-N 3.3Å; Q962-Q964 PolarHBondContact O-N 2.82Å; Q962-S965 PolarHBondContact O-N 3.4Å; Q962-S965 PolarHBondContact O-OG 3Å; Q962-D966 PolarHBondContact O-N 3.01Å; Q962-D966 VanDerWaalsContact O-N 3.07Å
963	K	57.2	Low	53.8	Low	124 Å²	124	114.8 Å²	114.8	54%	0.539	54%	0.544	S	S	.	.	H	α-helix	trans	-61.7	-31.6	-177.5	-71.4	-172	173.7	-170.2	0	114.1	S959 N960 Q967	S959-K963 PolarHBondContact O-N 3.47Å; S959-K963 VanDerWaalsContact O-N 3.14Å; N960-K963 PolarHBondContact O-N 2.95Å; K963-Q967 WeakPolarHBondContact O-CG 3.4Å; K963-Q967 PolarHBondContact O-N 3.44Å; K963-Q967 VanDerWaalsContact O-N 3.13Å
964	Q	57.3	Low	54.1	Low	130 Å²	130	116 Å²	116	61%	0.607	54%	0.543	S	S	*	.	H	α-helix	trans	-67.2	-38.1	171.6	-78.4	-174.6	-20.6	0	0	112.8	N960 Q962 Q968	N960-Q964 PolarHBondContact O-N 2.93Å; Q962-Q964 VanDerWaalsContact C-N 3.3Å; Q962-Q964 PolarHBondContact O-N 2.82Å; Q964-Q968 WeakPolarHBondContact O-CG 3.28Å; Q964-Q968 PolarHBondContact O-N 3.49Å
965	S	51.4	Low	54.5	Low	49 Å²	49	118.3 Å²	118.3	34%	0.343	55%	0.551	S	S	.	*	H	α-helix	trans	-69.8	-32.8	176	66.6	0	0	0	0	113.1	K961 Q962 Q969	K961-S965 PolarHBondContact O-N 3.4Å; Q962-S965 PolarHBondContact O-N 3.4Å; Q962-S965 PolarHBondContact O-OG 3Å; S965-Q969 WeakPolarHBondContact O-CG 3.47Å; S965-Q969 PolarHBondContact O-N 2.84Å; S965-Q969 VanDerWaalsContact O-N 3.13Å; S965-Q969 PolarHBondContact O-NE2 2.84Å
966	D	60.9	Low	54.4	Low	61 Å²	61	115.3 Å²	115.3	33%	0.326	54%	0.536	S	S	.	.	H	α-helix	trans	-73.7	-39	178.8	-61.5	-39.6	0	0	0	111.9	Q962 Q969 Q970	Q962-D966 PolarHBondContact O-N 3.01Å; Q962-D966 VanDerWaalsContact O-N 3.07Å; D966-Q969 PolarHBondContact O-N 3.37Å; D966-Q970 WeakPolarHBondContact O-CB 3.46Å; D966-Q970 WeakPolarHBondContact O-CG 3.24Å; D966-Q970 PolarHBondContact O-N 3.46Å
967	Q	57.4	Low	54.2	Low	114 Å²	114	112.4 Å²	112.4	53%	0.533	53%	0.525	S	S	.	.	H	α-helix	trans	-63.9	-39.9	174	-74.5	-177.8	-4.6	0	0	112.6	K963 Q970 Q971	K963-Q967 WeakPolarHBondContact O-CG 3.4Å; K963-Q967 PolarHBondContact O-N 3.44Å; K963-Q967 VanDerWaalsContact O-N 3.13Å; Q967-Q970 PolarHBondContact O-N 2.9Å; Q967-Q971 WeakPolarHBondContact O-CG 3.48Å; Q967-Q971 PolarHBondContact O-N 3.46Å
968	Q	56.9	Low	54.4	Low	124 Å²	124	109.1 Å²	109.1	58%	0.579	52%	0.516	S	S	*	.	H	α-helix	trans	-65.2	-38.7	174.4	-71.8	-175.4	5.8	0	0	112	Q964 Q972	Q964-Q968 WeakPolarHBondContact O-CG 3.28Å; Q964-Q968 PolarHBondContact O-N 3.49Å; Q968-Q972 WeakPolarHBondContact O-CG 3.46Å; Q968-Q972 PolarHBondContact O-N 3.34Å
969	Q	57.9	Low	54.2	Low	112 Å²	112	107.7 Å²	107.7	52%	0.523	51%	0.509	S	S	.	.	H	α-helix	trans	-65.6	-41.8	173.4	-75.8	178.9	73.2	0	0	112.1	S965 D966 Q971 Q972 R973	S965-Q969 WeakPolarHBondContact O-CG 3.47Å; S965-Q969 PolarHBondContact O-N 2.84Å; S965-Q969 VanDerWaalsContact O-N 3.13Å; S965-Q969 PolarHBondContact O-NE2 2.84Å; D966-Q969 PolarHBondContact O-N 3.37Å; Q969-Q971 PolarHBondContact O-N 2.89Å; Q969-Q972 PolarHBondContact O-N 3.4Å; Q969-R973 WeakPolarHBondContact O-CG 3.43Å; Q969-R973 PolarHBondContact O-N 3.39Å
970	Q	58.8	Low	54.1	Low	49 Å²	49	108.8 Å²	108.8	23%	0.229	51%	0.508	C	S	.	.	H	α-helix	trans	-62.7	-40.9	178.8	-71.7	159.2	5.9	0	0	112.4	I609 D966 Q967 R973 H974	I609-Q970 HydrophobicContact CD1-CG 4.06Å; I609-Q970 HydrophobicContact CG1-CG 4.14Å; D966-Q970 WeakPolarHBondContact O-CB 3.46Å; D966-Q970 WeakPolarHBondContact O-CG 3.24Å; D966-Q970 PolarHBondContact O-N 3.46Å; Q967-Q970 PolarHBondContact O-N 2.9Å; Q970-R973 PolarHBondContact O-N 3.38Å; Q970-H974 PolarHBondContact O-N 2.87Å
971	Q	56.1	Low	54	Low	139 Å²	139	107.8 Å²	107.8	65%	0.65	50%	0.502	S	S	*	.	H	α-helix	trans	-63.2	-41	173.7	-69.6	176.1	13.1	0	0	111.7	Q967 Q969 H974 H975	Q967-Q971 WeakPolarHBondContact O-CG 3.48Å; Q967-Q971 PolarHBondContact O-N 3.46Å; Q969-Q971 PolarHBondContact O-N 2.89Å; Q971-H974 PolarHBondContact O-N 3.26Å; Q971-H975 PolarHBondContact O-N 3.2Å; Q971-H975 VanDerWaalsContact O-N 3.08Å
972	Q	54.9	Low	53.8	Low	132 Å²	132	107 Å²	107	62%	0.617	50%	0.501	S	S	*	.	H	α-helix	trans	-65.2	-38	173.2	-68.7	174.5	32.7	0	0	112.6	Q968 Q969 H974 H976	Q968-Q972 WeakPolarHBondContact O-CG 3.46Å; Q968-Q972 PolarHBondContact O-N 3.34Å; Q969-Q972 PolarHBondContact O-N 3.4Å; Q972-H974 PolarHBondContact O-N 3.42Å; Q972-H976 WeakPolarHBondContact O-CB 3.31Å; Q972-H976 PolarHBondContact O-N 3.44Å; Q972-H976 VanDerWaalsContact O-N 3.07Å
973	R	51.9	Low	53.4	Low	137 Å²	137	106.8 Å²	106.8	52%	0.517	50%	0.5	S	S	.	.	H	α-helix	trans	-60.6	-44.1	173.6	-64.6	-154.8	-58	-153.7	14.5	111.3	D610 Q969 Q970 H977	D610-R973 IonicContact OD2-CZ 2.81Å; D610-R973 IonicContact OD2-NH1 2.81Å; D610-R973 PolarHBondContact OD2-NH1 3.18Å; D610-R973 IonicContact OD2-NH2 3.17Å; D610-R973 PolarHBondContact OD2-NH2 2.97Å; Q969-R973 WeakPolarHBondContact O-CG 3.43Å; Q969-R973 PolarHBondContact O-N 3.39Å; Q970-R973 PolarHBondContact O-N 3.38Å; R973-H977 WeakPolarHBondContact O-CB 3.37Å; R973-H977 PolarHBondContact O-N 3.21Å
974	H	52.9	Low	52.7	Low	112 Å²	112	107.3 Å²	107.3	52%	0.519	50%	0.504	S	S	.	.	H	α-helix	trans	-63.4	-50.1	178.5	-95.4	-85.1	0	0	0	112.5	Q970 Q971 Q972 H976 H977 E978	Q970-H974 PolarHBondContact O-N 2.87Å; Q971-H974 PolarHBondContact O-N 3.26Å; Q972-H974 PolarHBondContact O-N 3.42Å; H974-H976 VanDerWaalsContact C-N 3.32Å; H974-H976 PolarHBondContact O-N 3.42Å; H974-H977 PolarHBondContact O-N 2.79Å; H974-H977 VanDerWaalsContact O-N 3.09Å; H974-E978 PolarHBondContact O-N 2.97Å
975	H	53.5	Low	52.3	Low	134 Å²	134	108.7 Å²	108.7	62%	0.62	51%	0.511	S	S	*	.	H	α-helix	trans	-64.8	-37.8	-177.2	-137.5	22.6	0	0	0	111.9	Q971 H977 E978 E979	Q971-H975 PolarHBondContact O-N 3.2Å; Q971-H975 VanDerWaalsContact O-N 3.08Å; H975-H977 VanDerWaalsContact C-N 3.34Å; H975-H977 PolarHBondContact O-N 2.69Å; H975-E978 IonicContact ND1-OE2 3.38Å; H975-E978 PolarHBondContact O-N 3.3Å; H975-E979 PolarHBondContact O-N 3.32Å
976	H	48.9	Very low	52	Low	98 Å²	98	112.2 Å²	112.2	45%	0.454	52%	0.522	S	S	.	.	H	α-helix	trans	-70.5	-28.6	175.2	-160.2	51.8	0	0	0	112.9	Q972 H974 E979 Q980	Q972-H976 WeakPolarHBondContact O-CB 3.31Å; Q972-H976 PolarHBondContact O-N 3.44Å; Q972-H976 VanDerWaalsContact O-N 3.07Å; H974-H976 VanDerWaalsContact C-N 3.32Å; H974-H976 PolarHBondContact O-N 3.42Å; H976-E979 IonicContact CE1-OE2 3.82Å; H976-E979 IonicContact ND1-OE2 3.3Å; H976-E979 PolarHBondContact ND1-OE2 3.1Å; H976-Q980 PolarHBondContact CD2-NE2 3.45Å; H976-Q980 PolarHBondContact NE2-NE2 3.08Å; H976-Q980 WeakPolarHBondContact O-CB 3.33Å; H976-Q980 VanDerWaalsContact O-CG 3.26Å; H976-Q980 WeakPolarHBondContact O-CG 3.38Å; H976-Q980 PolarHBondContact O-N 2.89Å
977	H	49	Very low	51.5	Low	107 Å²	107	120.7 Å²	120.7	50%	0.495	55%	0.549	S	S	.	.	H	α-helix	trans	-70.3	-38.2	172.3	-158	61.6	0	0	0	111.9	R973 H974 H975 Q980 L981	R973-H977 WeakPolarHBondContact O-CB 3.37Å; R973-H977 PolarHBondContact O-N 3.21Å; H974-H977 PolarHBondContact O-N 2.79Å; H974-H977 VanDerWaalsContact O-N 3.09Å; H975-H977 VanDerWaalsContact C-N 3.34Å; H975-H977 PolarHBondContact O-N 2.69Å; H977-Q980 PolarHBondContact O-N 2.81Å; H977-L981 WeakPolarHBondContact O-CB 3.24Å; H977-L981 VanDerWaalsContact O-CG 3.26Å; H977-L981 WeakPolarHBondContact O-CG 3.48Å; H977-L981 PolarHBondContact O-N 3.23Å
978	E	48.2	Very low	51.2	Low	103 Å²	103	120 Å²	120	48%	0.481	56%	0.557	S	S	.	*	H	α-helix	trans	-63.5	-46.1	171.9	-71.4	-167.9	111.9	0	0	112.6	H974 H975 Q980 L981 Q982	H974-E978 PolarHBondContact O-N 2.97Å; H975-E978 IonicContact ND1-OE2 3.38Å; H975-E978 PolarHBondContact O-N 3.3Å; E978-Q980 VanDerWaalsContact C-N 3.28Å; E978-Q980 PolarHBondContact O-N 3.4Å; E978-L981 PolarHBondContact O-N 3.26Å; E978-Q982 WeakPolarHBondContact O-CG 3.1Å; E978-Q982 PolarHBondContact O-N 3.34Å
979	E	50.3	Low	51.6	Low	96 Å²	96	125.5 Å²	125.5	45%	0.449	57%	0.572	S	S	.	*	H	α-helix	trans	-56.3	-43.8	173.8	-77.7	-163	120.5	0	0	111.7	H975 H976 Q982 Q983	H975-E979 PolarHBondContact O-N 3.32Å; H976-E979 IonicContact CE1-OE2 3.82Å; H976-E979 IonicContact ND1-OE2 3.3Å; H976-E979 PolarHBondContact ND1-OE2 3.1Å; E979-Q982 PolarHBondContact O-N 2.95Å; E979-Q983 WeakPolarHBondContact O-CB 3.47Å; E979-Q983 VanDerWaalsContact O-CG 3.29Å; E979-Q983 WeakPolarHBondContact O-CG 3.44Å; E979-Q983 PolarHBondContact O-N 2.99Å; E979-Q983 PolarHBondContact O-NE2 3.47Å
980	Q	50.9	Low	52.6	Low	82 Å²	82	122.1 Å²	122.1	38%	0.383	56%	0.56	S	S	.	*	H	α-helix	trans	-68.1	-36.8	177.8	-73.7	-177.7	22	0	0	112.4	H976 H977 E978 Q984	H976-Q980 PolarHBondContact CD2-NE2 3.45Å; H976-Q980 PolarHBondContact NE2-NE2 3.08Å; H976-Q980 WeakPolarHBondContact O-CB 3.33Å; H976-Q980 VanDerWaalsContact O-CG 3.26Å; H976-Q980 WeakPolarHBondContact O-CG 3.38Å; H976-Q980 PolarHBondContact O-N 2.89Å; H977-Q980 PolarHBondContact O-N 2.81Å; E978-Q980 VanDerWaalsContact C-N 3.28Å; E978-Q980 PolarHBondContact O-N 3.4Å; Q980-Q984 VanDerWaalsContact O-CB 3.28Å; Q980-Q984 WeakPolarHBondContact O-CB 3.35Å; Q980-Q984 WeakPolarHBondContact O-CG 3.49Å; Q980-Q984 PolarHBondContact O-N 2.84Å; Q980-Q984 PolarHBondContact O-NE2 3.32Å
981	L	51.2	Low	53.8	Low	83 Å²	83	125.1 Å²	125.1	44%	0.435	59%	0.586	S	S	.	*	H	α-helix	trans	-70	-35	176.4	-76.3	168.6	0	0	0	112.3	H977 E978 Q985	H977-L981 WeakPolarHBondContact O-CB 3.24Å; H977-L981 VanDerWaalsContact O-CG 3.26Å; H977-L981 WeakPolarHBondContact O-CG 3.48Å; H977-L981 PolarHBondContact O-N 3.23Å; E978-L981 PolarHBondContact O-N 3.26Å; L981-Q985 PolarHBondContact O-NE2 3.42Å
982	Q	48.9	Very low	55.4	Low	134 Å²	134	120.8 Å²	120.8	63%	0.626	57%	0.565	S	S	*	*	H	α-helix	trans	-72	-40.6	174.2	-68.1	-176.6	40.7	0	0	111.6	E978 E979	E978-Q982 WeakPolarHBondContact O-CG 3.1Å; E978-Q982 PolarHBondContact O-N 3.34Å; E979-Q982 PolarHBondContact O-N 2.95Å
983	Q	47.5	Very low	57.1	Low	123 Å²	123	117.1 Å²	117.1	58%	0.575	55%	0.554	S	S	*	*	H	α-helix	trans	-67.1	-37.7	175.3	-73.1	176.8	60.3	0	0	112.6	E979 Q985 Q986	E979-Q983 WeakPolarHBondContact O-CB 3.47Å; E979-Q983 VanDerWaalsContact O-CG 3.29Å; E979-Q983 WeakPolarHBondContact O-CG 3.44Å; E979-Q983 PolarHBondContact O-N 2.99Å; E979-Q983 PolarHBondContact O-NE2 3.47Å; Q983-Q985 VanDerWaalsContact C-N 3.27Å; Q983-Q985 PolarHBondContact O-N 3.1Å; Q983-Q986 PolarHBondContact O-N 2.99Å
984	Q	43.1	Very low	59	Low	134 Å²	134	116.3 Å²	116.3	63%	0.626	56%	0.56	S	S	*	*	H	α-helix	trans	-67.9	-19.1	-179.8	-79.7	174.2	89.3	0	0	114.7	Q980 Q986	Q980-Q984 VanDerWaalsContact O-CB 3.28Å; Q980-Q984 WeakPolarHBondContact O-CB 3.35Å; Q980-Q984 WeakPolarHBondContact O-CG 3.49Å; Q980-Q984 PolarHBondContact O-N 2.84Å; Q980-Q984 PolarHBondContact O-NE2 3.32Å; Q984-Q986 VanDerWaalsContact C-N 3.28Å; Q984-Q986 PolarHBondContact O-N 3.25Å
985	Q	47.9	Very low	60.8	Low	159 Å²	159	117 Å²	117	74%	0.743	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-19.4	175.6	-71.9	179.7	55.6	0	0	113	L981 Q983 R987	L981-Q985 PolarHBondContact O-NE2 3.42Å; Q983-Q985 VanDerWaalsContact C-N 3.27Å; Q983-Q985 PolarHBondContact O-N 3.1Å; Q985-R987 PolarHBondContact O-N 3.33Å
986	Q	44.8	Very low	62.7	Low	123 Å²	123	112.3 Å²	112.3	58%	0.575	55%	0.545	S	S	*	.	S	Bend	trans	-87	81.1	174.2	-66.1	-154.1	38.7	0	0	112.4	Q983 Q984 S988	Q983-Q986 PolarHBondContact O-N 2.99Å; Q984-Q986 VanDerWaalsContact C-N 3.28Å; Q984-Q986 PolarHBondContact O-N 3.25Å; Q986-S988 PolarHBondContact O-N 3.47Å
987	R	50.8	Low	64.9	Low	240 Å²	240	110.7 Å²	110.7	91%	0.906	54%	0.54	S	S	*	.			trans	-58	111.7	171.5	-62.7	-171.4	-169.2	-157.2	2.9	110.8	Q985 R989	Q985-R987 PolarHBondContact O-N 3.33Å; R987-R989 PolarHBondContact O-N 3Å; R987-R989 VanDerWaalsContact O-N 3.15Å
988	S	51.8	Low	67	Low	100 Å²	100	111.2 Å²	111.2	70%	0.699	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-56.7	120.3	-177.5	-43.4	0	0	0	0	111.8	Q986 T990 R1028	Q986-S988 PolarHBondContact O-N 3.47Å; S988-T990 PolarHBondContact O-N 2.89Å; S988-R1028 PolarHBondContact O-NH1 3.39Å; S988-R1028 PolarHBondContact O-NH2 3.17Å
989	R	64.8	Low	69.2	Low	238 Å²	238	108.5 Å²	108.5	90%	0.898	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-69	125.2	176.6	-178.9	177	177.1	-178.5	-2.7	109.1	R987 S991	R987-R989 PolarHBondContact O-N 3Å; R987-R989 VanDerWaalsContact O-N 3.15Å; R989-S991 PolarHBondContact O-N 3.02Å
990	T	78.6	Confident	71.4	Confident	42 Å²	42	104 Å²	104	26%	0.258	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-65.4	121.6	170.4	27.6	0	0	0	0	109.7	S988 R1028	S988-T990 PolarHBondContact O-N 2.89Å; T990-R1028 HydrophobicContact CG2-CG 4.08Å; T990-R1028 PolarHBondContact OG1-NH1 2.88Å; T990-R1028 VanDerWaalsContact OG1-NH1 3.15Å
991	S	83.7	Confident	73.5	Confident	111 Å²	111	102.4 Å²	102.4	78%	0.776	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-79.5	154	154.3	-162.1	0	0	0	0	108.8	R989	R989-S991 PolarHBondContact O-N 3.02Å
992	F	89.7	Confident	75.6	Confident	49 Å²	49	104.3 Å²	104.3	22%	0.215	51%	0.506	C	S	.	.			trans	-127.5	140.7	177.9	-54.5	-71.1	0	0	0	107.7	Q996 L997 L1024 W1032	F992-Q996 HydrophobicContact CB-CB 4.45Å; F992-L997 HydrophobicContact CB-CD1 4.38Å; F992-L997 HydrophobicContact CB-CD2 3.78Å; F992-L997 HydrophobicContact CB-CG 3.81Å; F992-L997 HydrophobicContact CD2-CD2 4.08Å; F992-L997 HydrophobicContact CG-CD2 4.17Å; F992-L1024 HydrophobicContact CD1-CD1 3.52Å; F992-L1024 HydrophobicContact CD1-CD2 4.28Å; F992-L1024 HydrophobicContact CE1-CD1 3.82Å; F992-W1032 AromaticContact CE2-CD1 3.69Å; F992-W1032 HydrophobicContact CZ-CB 4.48Å; F992-W1032 AromaticContact CZ-CD1 3.89Å
993	S	91.3	Very high	77.8	Confident	55 Å²	55	99 Å²	99	39%	0.385	48%	0.481	S	S	.	.			trans	-74.8	162.5	171.8	76.8	0	0	0	0	111.1	L995 Q996 L997	S993-L995 VanDerWaalsContact C-N 3.33Å; S993-L995 PolarHBondContact O-N 3.44Å; S993-Q996 WeakPolarHBondContact O-CB 3.49Å; S993-Q996 PolarHBondContact O-N 3Å; S993-Q996 VanDerWaalsContact O-N 3.12Å; S993-Q996 WeakPolarHBondContact OG-CG 3.23Å; S993-Q996 PolarHBondContact OG-N 2.88Å; S993-L997 WeakPolarHBondContact O-CG 3.43Å; S993-L997 PolarHBondContact O-N 3.26Å
994	N	90.9	Very high	80.1	Confident	120 Å²	120	93.4 Å²	93.4	64%	0.642	46%	0.455	S	S	*	.	H	α-helix	trans	-58.4	-44.9	177.8	-65.7	-9.2	0	0	0	111.5	Q996 L997 E998	N994-Q996 VanDerWaalsContact C-N 3.31Å; N994-Q996 PolarHBondContact O-N 3.05Å; N994-L997 CarbonylContact O-C 3.57Å; N994-L997 WeakPolarHBondContact O-CA 3.4Å; N994-L997 WeakPolarHBondContact O-CB 3.39Å; N994-L997 PolarHBondContact O-N 3.2Å; N994-E998 WeakPolarHBondContact O-CG 3.39Å; N994-E998 PolarHBondContact O-N 2.99Å
995	L	91.2	Very high	82.4	Confident	127 Å²	127	94.5 Å²	94.5	67%	0.665	46%	0.46	S	S	*	.	H	α-helix	trans	-59.3	-37.8	175.1	-65	172.3	0	0	0	113	S993 E999	S993-L995 VanDerWaalsContact C-N 3.33Å; S993-L995 PolarHBondContact O-N 3.44Å; L995-E999 PolarHBondContact O-N 2.94Å
996	Q	93.5	Very high	84.6	Confident	35 Å²	35	94.1 Å²	94.1	16%	0.164	46%	0.458	C	S	.	.	H	α-helix	trans	-66.8	-40.2	174.3	-72.1	173.3	-28.9	0	0	111.3	F992 S993 N994 L1000 I1022 L1024	F992-Q996 HydrophobicContact CB-CB 4.45Å; S993-Q996 WeakPolarHBondContact O-CB 3.49Å; S993-Q996 PolarHBondContact O-N 3Å; S993-Q996 VanDerWaalsContact O-N 3.12Å; S993-Q996 WeakPolarHBondContact OG-CG 3.23Å; S993-Q996 PolarHBondContact OG-N 2.88Å; N994-Q996 VanDerWaalsContact C-N 3.31Å; N994-Q996 PolarHBondContact O-N 3.05Å; Q996-L1000 VanDerWaalsContact O-CB 3.29Å; Q996-L1000 WeakPolarHBondContact O-CB 3.27Å; Q996-L1000 VanDerWaalsContact O-CD1 3.27Å; Q996-L1000 WeakPolarHBondContact O-CD1 3.32Å; Q996-L1000 WeakPolarHBondContact O-CG 3.39Å; Q996-L1000 PolarHBondContact O-N 3.45Å; Q996-I1022 HydrophobicContact CG-CB 4.18Å; Q996-I1022 PolarHBondContact NE2-O 3.45Å; Q996-L1024 HydrophobicContact CB-CD1 4.15Å; Q996-L1024 HydrophobicContact CG-CD1 4.17Å; Q996-L1024 HydrophobicContact CG-CG 4.49Å
997	L	94.2	Very high	86.8	Confident	64 Å²	64	90.2 Å²	90.2	34%	0.335	44%	0.442	S	S	.	.	H	α-helix	trans	-68.7	-37.5	177.1	-68.9	171.6	0	0	0	112.5	F992 S993 N994 L1000 E1001	F992-L997 HydrophobicContact CB-CD1 4.38Å; F992-L997 HydrophobicContact CB-CD2 3.78Å; F992-L997 HydrophobicContact CB-CG 3.81Å; F992-L997 HydrophobicContact CD2-CD2 4.08Å; F992-L997 HydrophobicContact CG-CD2 4.17Å; S993-L997 WeakPolarHBondContact O-CG 3.43Å; S993-L997 PolarHBondContact O-N 3.26Å; N994-L997 CarbonylContact O-C 3.57Å; N994-L997 WeakPolarHBondContact O-CA 3.4Å; N994-L997 WeakPolarHBondContact O-CB 3.39Å; N994-L997 PolarHBondContact O-N 3.2Å; L997-L1000 PolarHBondContact O-N 3.28Å; L997-E1001 VanDerWaalsContact O-CB 3.3Å; L997-E1001 WeakPolarHBondContact O-CB 3.33Å; L997-E1001 PolarHBondContact O-N 3.42Å
998	E	93.9	Very high	88.9	Confident	117 Å²	117	81.9 Å²	81.9	55%	0.547	41%	0.414	S	S	.	.	H	α-helix	trans	-63.6	-49.7	177	-74.8	160.3	-150.7	0	0	111.5	N994 L1000 E1001 K1002	N994-E998 WeakPolarHBondContact O-CG 3.39Å; N994-E998 PolarHBondContact O-N 2.99Å; E998-L1000 PolarHBondContact O-N 3.33Å; E998-E1001 PolarHBondContact O-N 3.36Å; E998-K1002 WeakPolarHBondContact O-CB 3.39Å; E998-K1002 PolarHBondContact O-N 3.27Å
999	E	94.7	Very high	91	Very high	47 Å²	47	84 Å²	84	22%	0.22	41%	0.407	C	S	.	.	H	α-helix	trans	-66.5	-34.4	174.9	-79.8	-76.2	116.4	0	0	112.5	L995 K1002 E1003 L1018 R1021 I1022	L995-E999 PolarHBondContact O-N 2.94Å; E999-K1002 WeakPolarHBondContact OE1-CD 3.34Å; E999-K1002 WeakPolarHBondContact OE1-CE 3.25Å; E999-K1002 IonicContact OE1-NZ 3.95Å; E999-K1002 PolarHBondContact OE1-NZ 3.3Å; E999-E1003 WeakPolarHBondContact O-CB 3.27Å; E999-E1003 PolarHBondContact O-N 2.9Å; E999-L1018 HydrophobicContact CB-CD1 4.24Å; E999-R1021 IonicContact OE2-CZ 3.26Å; E999-R1021 IonicContact OE2-NE 2.7Å; E999-R1021 IonicContact OE2-NH1 2.69Å; E999-R1021 PolarHBondContact OE2-NH1 2.86Å; E999-I1022 HydrophobicContact CB-CG2 3.64Å; E999-I1022 HydrophobicContact CG-CG2 4.17Å
1000	L	96.3	Very high	92.3	Very high	0 Å²	0	73 Å²	73	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-65.6	-41.3	174.1	-80.9	162.8	0	0	0	112.7	Q996 L997 E998 F1004 L1018 I1022 L1024 I1029 W1032 F1033	Q996-L1000 VanDerWaalsContact O-CB 3.29Å; Q996-L1000 WeakPolarHBondContact O-CB 3.27Å; Q996-L1000 VanDerWaalsContact O-CD1 3.27Å; Q996-L1000 WeakPolarHBondContact O-CD1 3.32Å; Q996-L1000 WeakPolarHBondContact O-CG 3.39Å; Q996-L1000 PolarHBondContact O-N 3.45Å; L997-L1000 PolarHBondContact O-N 3.28Å; E998-L1000 PolarHBondContact O-N 3.33Å; L1000-F1004 WeakPolarHBondContact O-CB 3.29Å; L1000-F1004 PolarHBondContact O-N 2.9Å; L1000-L1018 HydrophobicContact CD2-CD2 3.66Å; L1000-L1018 HydrophobicContact CG-CD2 4.38Å; L1000-I1022 HydrophobicContact CD1-CD1 3.92Å; L1000-I1022 HydrophobicContact CD2-CD1 3.9Å; L1000-I1022 HydrophobicContact CG-CD1 3.59Å; L1000-L1024 HydrophobicContact CD1-CD1 4.24Å; L1000-I1029 HydrophobicContact CD2-CG1 4.29Å; L1000-I1029 HydrophobicContact CD2-CG2 4.07Å; L1000-W1032 HydrophobicContact CB-CD2 4.03Å; L1000-W1032 HydrophobicContact CB-CE3 4.05Å; L1000-W1032 HydrophobicContact CB-CH2 3.82Å; L1000-W1032 HydrophobicContact CB-CZ2 3.75Å; L1000-W1032 HydrophobicContact CB-CZ3 3.95Å; L1000-W1032 HydrophobicContact CD1-CD2 4.05Å; L1000-W1032 HydrophobicContact CD1-CG 3.98Å; L1000-W1032 HydrophobicContact CD2-CB 4.49Å; L1000-W1032 HydrophobicContact CD2-CD2 3.93Å; L1000-W1032 HydrophobicContact CD2-CE3 3.83Å; L1000-W1032 HydrophobicContact CD2-CG 4.21Å; L1000-W1032 HydrophobicContact CD2-CZ3 4.41Å; L1000-W1032 HydrophobicContact CG-CD2 4.24Å; L1000-W1032 HydrophobicContact CG-CE3 4.41Å; L1000-W1032 WeakPolarHBondContact O-CH2 3.43Å; L1000-W1032 WeakPolarHBondContact O-CZ3 3.48Å; L1000-F1033 HydrophobicContact CD2-CD2 4.35Å; L1000-F1033 HydrophobicContact CD2-CE2 3.92Å
1001	E	95.2	Very high	93	Very high	50 Å²	50	74.1 Å²	74.1	23%	0.234	37%	0.371	C	S	.	.	H	α-helix	trans	-74.7	-40.3	-179.9	-163.6	70.5	-142.8	0	0	111.4	L997 E998 E1003 F1004 E1005 W1032 R1036	L997-E1001 VanDerWaalsContact O-CB 3.3Å; L997-E1001 WeakPolarHBondContact O-CB 3.33Å; L997-E1001 PolarHBondContact O-N 3.42Å; E998-E1001 PolarHBondContact O-N 3.36Å; E1001-E1003 VanDerWaalsContact C-N 3.35Å; E1001-E1003 PolarHBondContact O-N 3.48Å; E1001-F1004 CarbonylContact O-C 3.48Å; E1001-F1004 WeakPolarHBondContact O-CA 3.45Å; E1001-F1004 VanDerWaalsContact O-CB 3.31Å; E1001-F1004 WeakPolarHBondContact O-CB 3.47Å; E1001-F1004 PolarHBondContact O-N 2.94Å; E1001-E1005 PolarHBondContact O-N 3.48Å; E1001-W1032 HydrophobicContact CB-CH2 4.5Å; E1001-R1036 IonicContact OE1-CZ 3.93Å; E1001-R1036 IonicContact OE1-NE 3.86Å; E1001-R1036 PolarHBondContact OE1-NE 3.18Å; E1001-R1036 IonicContact OE1-NH2 3.78Å; E1001-R1036 PolarHBondContact OE1-NH2 3.39Å; E1001-R1036 WeakPolarHBondContact OE2-CD 3.47Å; E1001-R1036 IonicContact OE2-CZ 3.6Å; E1001-R1036 IonicContact OE2-NE 2.67Å; E1001-R1036 PolarHBondContact OE2-NE 3.45Å; E1001-R1036 IonicContact OE2-NH2 2.91Å
1002	K	94.5	Very high	93.5	Very high	123 Å²	123	71.7 Å²	71.7	54%	0.535	35%	0.351	S	S	.	.	H	α-helix	trans	-59.1	-41.4	172	174.8	-179.8	166.8	-168.6	0	112.8	E998 E999 F1004 E1005 H1006	E998-K1002 WeakPolarHBondContact O-CB 3.39Å; E998-K1002 PolarHBondContact O-N 3.27Å; E999-K1002 WeakPolarHBondContact OE1-CD 3.34Å; E999-K1002 WeakPolarHBondContact OE1-CE 3.25Å; E999-K1002 IonicContact OE1-NZ 3.95Å; E999-K1002 PolarHBondContact OE1-NZ 3.3Å; K1002-F1004 VanDerWaalsContact C-N 3.33Å; K1002-E1005 PolarHBondContact O-N 2.76Å; K1002-H1006 PolarHBondContact O-N 2.92Å; K1002-H1006 VanDerWaalsContact O-N 3.15Å
1003	E	94.8	Very high	93.7	Very high	23 Å²	23	76.7 Å²	76.7	11%	0.107	37%	0.373	C	S	.	.	H	α-helix	trans	-71	-30.1	173.5	-161.2	76.7	-134.7	0	0	111.7	E999 E1001 H1006 T1007 L1018 R1021 F1033	E999-E1003 WeakPolarHBondContact O-CB 3.27Å; E999-E1003 PolarHBondContact O-N 2.9Å; E1001-E1003 VanDerWaalsContact C-N 3.35Å; E1001-E1003 PolarHBondContact O-N 3.48Å; E1003-H1006 PolarHBondContact O-N 2.89Å; E1003-H1006 IonicContact OE1-CD2 2.77Å; E1003-T1007 PolarHBondContact O-N 3.38Å; E1003-L1018 HydrophobicContact CB-CD1 4.36Å; E1003-L1018 HydrophobicContact CB-CD2 4.07Å; E1003-L1018 HydrophobicContact CG-CD2 4.14Å; E1003-R1021 IonicContact OE2-CZ 2.71Å; E1003-R1021 IonicContact OE2-NH1 3.12Å; E1003-R1021 PolarHBondContact OE2-NH1 2.78Å; E1003-R1021 VanDerWaalsContact OE2-NH1 3.1Å; E1003-R1021 IonicContact OE2-NH2 3.86Å; E1003-R1021 PolarHBondContact OE2-NH2 2.89Å; E1003-F1033 HydrophobicContact CB-CZ 4.03Å; E1003-F1033 HydrophobicContact CG-CZ 4.12Å
1004	F	95.7	Very high	93.7	Very high	4 Å²	4	75.6 Å²	75.6	2%	0.018	37%	0.366	C	S	.	.	H	α-helix	trans	-69.4	-36.7	173.5	-173.1	-98.1	0	0	0	113.2	L1000 E1001 K1002 T1007 H1008 W1032 F1033 R1036 R1037 W1040	L1000-F1004 WeakPolarHBondContact O-CB 3.29Å; L1000-F1004 PolarHBondContact O-N 2.9Å; E1001-F1004 CarbonylContact O-C 3.48Å; E1001-F1004 WeakPolarHBondContact O-CA 3.45Å; E1001-F1004 VanDerWaalsContact O-CB 3.31Å; E1001-F1004 WeakPolarHBondContact O-CB 3.47Å; E1001-F1004 PolarHBondContact O-N 2.94Å; K1002-F1004 VanDerWaalsContact C-N 3.33Å; F1004-T1007 CarbonylContact O-C 3.46Å; F1004-T1007 VanDerWaalsContact O-C 3.25Å; F1004-H1008 AromaticContact CD1-CD2 3.73Å; F1004-H1008 AromaticContact CE1-CD2 3.31Å; F1004-H1008 WeakPolarHBondContact CE1-CD2 3.39Å; F1004-H1008 AromaticContact CE1-NE2 3.64Å; F1004-H1008 HydrophobicContact CE2-CB 4.24Å; F1004-H1008 AromaticContact CE2-CD2 3.74Å; F1004-H1008 HydrophobicContact CZ-CB 4.46Å; F1004-H1008 AromaticContact CZ-CD2 3.3Å; F1004-H1008 WeakPolarHBondContact CZ-CD2 3.35Å; F1004-H1008 AromaticContact CZ-NE2 3.96Å; F1004-H1008 PolarHBondContact O-CD2 2.96Å; F1004-H1008 VanDerWaalsContact O-CD2 3.22Å; F1004-H1008 PolarHBondContact O-N 3.19Å; F1004-W1032 HydrophobicContact CB-CH2 4.16Å; F1004-W1032 HydrophobicContact CB-CZ3 4.01Å; F1004-W1032 HydrophobicContact CD2-CZ3 4.25Å; F1004-W1032 HydrophobicContact CG-CZ3 4.34Å; F1004-F1033 HydrophobicContact CB-CE1 3.96Å; F1004-F1033 HydrophobicContact CB-CZ 4.36Å; F1004-F1033 AromaticContact CD2-CD1 3.77Å; F1004-F1033 HydrophobicContact CD2-CD1 3.77Å; F1004-F1033 AromaticContact CD2-CE1 3.79Å; F1004-F1033 HydrophobicContact CD2-CE1 3.79Å; F1004-F1033 HydrophobicContact CG-CE1 4.38Å; F1004-R1036 HydrophobicContact CD1-CG 3.76Å; F1004-R1036 HydrophobicContact CD2-CB 4.01Å; F1004-R1036 HydrophobicContact CD2-CG 3.64Å; F1004-R1036 HydrophobicContact CE1-CG 3.68Å; F1004-R1036 HydrophobicContact CE2-CB 3.82Å; F1004-R1036 HydrophobicContact CE2-CG 3.56Å; F1004-R1036 HydrophobicContact CG-CG 3.76Å; F1004-R1036 HydrophobicContact CZ-CB 4.23Å; F1004-R1036 HydrophobicContact CZ-CG 3.59Å; F1004-R1037 HydrophobicContact CE2-CG 3.85Å; F1004-R1037 HydrophobicContact CZ-CG 4.44Å; F1004-W1040 HydrophobicContact CE1-CB 4.46Å; F1004-W1040 HydrophobicContact CZ-CB 4.11Å; F1004-W1040 HydrophobicContact CZ-CG 4.41Å
1005	E	93.2	Very high	93.9	Very high	157 Å²	157	71.6 Å²	71.6	73%	0.734	34%	0.342	S	S	*	.	H	α-helix	trans	-66.2	-36.2	171.4	-71.7	-178.7	168.9	0	0	111.9	E1001 K1002	E1001-E1005 PolarHBondContact O-N 3.48Å; K1002-E1005 PolarHBondContact O-N 2.76Å
1006	H	92.6	Very high	94.1	Very high	151 Å²	151	69.9 Å²	69.9	70%	0.699	33%	0.33	S	S	*	.	H	α-helix	trans	-69.5	-46.5	173.1	-175.3	51.5	0	0	0	112.4	K1002 E1003	K1002-H1006 PolarHBondContact O-N 2.92Å; K1002-H1006 VanDerWaalsContact O-N 3.15Å; E1003-H1006 PolarHBondContact O-N 2.89Å; E1003-H1006 IonicContact OE1-CD2 2.77Å
1007	T	92.5	Very high	94.1	Very high	41 Å²	41	75.1 Å²	75.1	25%	0.252	35%	0.352	S	S	.	.			trans	-150.3	126	173	175.5	0	0	0	0	112.8	E1003 F1004 Y1009 P1010 F1033	E1003-T1007 PolarHBondContact O-N 3.38Å; F1004-T1007 CarbonylContact O-C 3.46Å; F1004-T1007 VanDerWaalsContact O-C 3.25Å; T1007-Y1009 PolarHBondContact O-N 3.45Å; T1007-Y1009 VanDerWaalsContact OG1-C 3.24Å; T1007-Y1009 PolarHBondContact OG1-N 3.32Å; T1007-Y1009 PolarHBondContact OG1-O 3.46Å; T1007-P1010 HydrophobicContact CG2-CB 3.84Å; T1007-F1033 WeakPolarHBondContact O-CE1 3.36Å
1008	H	93.6	Very high	94.2	Very high	66 Å²	66	72.1 Å²	72.1	31%	0.306	34%	0.337	S	S	.	.	S	Bend	trans	-65.2	-17	170.2	-61.3	145	0	0	0	113.1	F1004 R1037 W1040	F1004-H1008 AromaticContact CD1-CD2 3.73Å; F1004-H1008 AromaticContact CE1-CD2 3.31Å; F1004-H1008 WeakPolarHBondContact CE1-CD2 3.39Å; F1004-H1008 AromaticContact CE1-NE2 3.64Å; F1004-H1008 HydrophobicContact CE2-CB 4.24Å; F1004-H1008 AromaticContact CE2-CD2 3.74Å; F1004-H1008 HydrophobicContact CZ-CB 4.46Å; F1004-H1008 AromaticContact CZ-CD2 3.3Å; F1004-H1008 WeakPolarHBondContact CZ-CD2 3.35Å; F1004-H1008 AromaticContact CZ-NE2 3.96Å; F1004-H1008 PolarHBondContact O-CD2 2.96Å; F1004-H1008 VanDerWaalsContact O-CD2 3.22Å; F1004-H1008 PolarHBondContact O-N 3.19Å; H1008-R1037 WeakPolarHBondContact O-CD 3.46Å; H1008-R1037 WeakPolarHBondContact O-CG 3.24Å; H1008-R1037 PolarHBondContact O-NH1 2.89Å; H1008-W1040 AromaticContact CE1-CE2 3.84Å; H1008-W1040 AromaticContact CE1-CZ2 3.94Å; H1008-W1040 AromaticContact CE1-NE1 3.91Å; H1008-W1040 AromaticContact NE2-NE1 3.94Å
1009	Y	95.4	Very high	94.2	Very high	145 Å²	145	67.8 Å²	67.8	57%	0.569	32%	0.32	S	S	*	.	S	Bend	trans	-135.8	71	-175.4	-63.9	-90.4	0	0	0	111	T1007 R1037 R1041	T1007-Y1009 PolarHBondContact O-N 3.45Å; T1007-Y1009 VanDerWaalsContact OG1-C 3.24Å; T1007-Y1009 PolarHBondContact OG1-N 3.32Å; T1007-Y1009 PolarHBondContact OG1-O 3.46Å; Y1009-R1037 VanDerWaalsContact CZ-CD 3.45Å; Y1009-R1041 PolarHBondContact OH-NH2 3.16Å
1010	P	92.8	Very high	94.1	Very high	7 Å²	7	69.8 Å²	69.8	5%	0.045	34%	0.339	C	S	.	.			trans	-67.2	139.4	175.2	28.9	-35.9	0	0	0	111.2	T1007 R1015 F1033	T1007-P1010 HydrophobicContact CG2-CB 3.84Å; P1010-R1015 HydrophobicContact CB-CG 3.73Å; P1010-R1015 HydrophobicContact CG-CG 3.53Å; P1010-R1015 PolarHBondContact O-NH1 2.98Å; P1010-F1033 VanDerWaalsContact CD-CD1 3.43Å; P1010-F1033 VanDerWaalsContact CD-CE1 3.45Å; P1010-F1033 HydrophobicContact CG-CD1 3.65Å; P1010-F1033 HydrophobicContact CG-CD2 4.18Å; P1010-F1033 HydrophobicContact CG-CE1 3.49Å; P1010-F1033 VanDerWaalsContact CG-CE1 3.49Å; P1010-F1033 HydrophobicContact CG-CE2 4.04Å; P1010-F1033 HydrophobicContact CG-CG 4Å; P1010-F1033 HydrophobicContact CG-CZ 3.71Å
1011	D	93.7	Very high	94	Very high	64 Å²	64	74.6 Å²	74.6	34%	0.342	36%	0.357	S	S	.	.			trans	-69.9	-175.9	174.9	66.6	81.7	0	0	0	112.4	F1013 S1014 R1015	D1011-F1013 WeakPolarHBondContact OD1-CA 3.49Å; D1011-F1013 WeakPolarHBondContact OD1-CB 3.24Å; D1011-F1013 PolarHBondContact OD1-N 2.92Å; D1011-S1014 PolarHBondContact OD1-N 3.19Å; D1011-S1014 VanDerWaalsContact OD2-CB 3.25Å; D1011-S1014 WeakPolarHBondContact OD2-CB 3.43Å; D1011-S1014 PolarHBondContact OD2-OG 3.29Å; D1011-R1015 VanDerWaalsContact O-CG 3.27Å; D1011-R1015 WeakPolarHBondContact O-CG 3.43Å; D1011-R1015 PolarHBondContact O-N 3.42Å; D1011-R1015 PolarHBondContact O-NH1 3.42Å
1012	V	93.2	Very high	93.9	Very high	61 Å²	61	72.9 Å²	72.9	37%	0.37	35%	0.349	S	S	.	.	H	α-helix	trans	-65.2	-47.7	-178.2	64.7	0	0	0	0	112.7	S1014 R1015 E1016	V1012-S1014 PolarHBondContact O-N 3.33Å; V1012-R1015 PolarHBondContact O-N 2.92Å; V1012-E1016 HydrophobicContact CG2-CG 4.41Å; V1012-E1016 WeakPolarHBondContact O-CB 3.45Å; V1012-E1016 WeakPolarHBondContact O-CG 3.44Å; V1012-E1016 PolarHBondContact O-N 3.48Å
1013	F	94.2	Very high	93.9	Very high	153 Å²	153	74 Å²	74	67%	0.671	36%	0.36	S	S	*	.	H	α-helix	trans	-67.3	-38.4	-179.2	-53	-70.2	0	0	0	111.7	D1011 R1015 E1016 K1017	D1011-F1013 WeakPolarHBondContact OD1-CA 3.49Å; D1011-F1013 WeakPolarHBondContact OD1-CB 3.24Å; D1011-F1013 PolarHBondContact OD1-N 2.92Å; F1013-R1015 PolarHBondContact O-N 3.22Å; F1013-E1016 PolarHBondContact O-N 3.29Å; F1013-K1017 WeakPolarHBondContact O-CB 3.45Å; F1013-K1017 PolarHBondContact O-N 3.41Å
1014	S	92.5	Very high	93.7	Very high	33 Å²	33	73.8 Å²	73.8	23%	0.231	36%	0.36	C	S	.	.	H	α-helix	trans	-60.5	-42.8	174.8	-70.6	0	0	0	0	112.1	D1011 V1012 L1018	D1011-S1014 PolarHBondContact OD1-N 3.19Å; D1011-S1014 VanDerWaalsContact OD2-CB 3.25Å; D1011-S1014 WeakPolarHBondContact OD2-CB 3.43Å; D1011-S1014 PolarHBondContact OD2-OG 3.29Å; V1012-S1014 PolarHBondContact O-N 3.33Å; S1014-L1018 PolarHBondContact O-N 3.45Å; S1014-L1018 VanDerWaalsContact O-N 3.09Å
1015	R	94.8	Very high	93.6	Very high	36 Å²	36	77.2 Å²	77.2	14%	0.136	38%	0.382	C	S	.	.	H	α-helix	trans	-75.9	-35.7	178	-60.9	-177.9	-41.3	-91.2	-8.1	112.5	P1010 D1011 V1012 F1013 L1018 S1019 E1026 I1029	P1010-R1015 HydrophobicContact CB-CG 3.73Å; P1010-R1015 HydrophobicContact CG-CG 3.53Å; P1010-R1015 PolarHBondContact O-NH1 2.98Å; D1011-R1015 VanDerWaalsContact O-CG 3.27Å; D1011-R1015 WeakPolarHBondContact O-CG 3.43Å; D1011-R1015 PolarHBondContact O-N 3.42Å; D1011-R1015 PolarHBondContact O-NH1 3.42Å; V1012-R1015 PolarHBondContact O-N 2.92Å; F1013-R1015 PolarHBondContact O-N 3.22Å; R1015-L1018 CarbonylContact O-C 3.54Å; R1015-L1018 WeakPolarHBondContact O-CA 3.49Å; R1015-L1018 WeakPolarHBondContact O-CB 3.41Å; R1015-L1018 PolarHBondContact O-N 3.22Å; R1015-L1018 VanDerWaalsContact O-N 3.12Å; R1015-S1019 WeakPolarHBondContact O-CB 3.35Å; R1015-S1019 PolarHBondContact O-N 3.22Å; R1015-E1026 WeakPolarHBondContact CB-OE2 3.4Å; R1015-E1026 IonicContact CZ-OE1 2.73Å; R1015-E1026 IonicContact NE-OE1 3.18Å; R1015-E1026 PolarHBondContact NE-OE1 2.73Å; R1015-E1026 IonicContact NE-OE2 3.99Å; R1015-E1026 IonicContact NH2-OE1 2.78Å; R1015-E1026 PolarHBondContact NH2-OE1 2.91Å; R1015-I1029 HydrophobicContact CB-CG2 4.14Å; R1015-I1029 HydrophobicContact CG-CG2 4.22Å
1016	E	94.9	Very high	93.6	Very high	90 Å²	90	71.3 Å²	71.3	42%	0.421	36%	0.355	S	S	.	.	H	α-helix	trans	-64.6	-39.8	172.6	-74.8	175.5	167	0	0	112.6	V1012 F1013 L1018 S1019 S1020 E1026	V1012-E1016 HydrophobicContact CG2-CG 4.41Å; V1012-E1016 WeakPolarHBondContact O-CB 3.45Å; V1012-E1016 WeakPolarHBondContact O-CG 3.44Å; V1012-E1016 PolarHBondContact O-N 3.48Å; F1013-E1016 PolarHBondContact O-N 3.29Å; E1016-L1018 VanDerWaalsContact C-N 3.28Å; E1016-L1018 PolarHBondContact O-N 2.76Å; E1016-S1019 WeakPolarHBondContact O-CB 3.5Å; E1016-S1019 PolarHBondContact O-N 3.47Å; E1016-S1020 WeakPolarHBondContact O-CB 3.45Å; E1016-S1020 PolarHBondContact O-N 3.18Å; E1016-S1020 PolarHBondContact O-OG 3.24Å; E1016-E1026 HydrophobicContact CG-CG 4.45Å; E1016-E1026 PolarHBondContact N-OE2 3.35Å
1017	K	93.9	Very high	93.6	Very high	145 Å²	145	68.2 Å²	68.2	63%	0.63	35%	0.346	S	S	*	.	H	α-helix	trans	-64.5	-31.6	171	-176.3	177.4	-179.3	179.8	0	112.2	F1013 R1021	F1013-K1017 WeakPolarHBondContact O-CB 3.45Å; F1013-K1017 PolarHBondContact O-N 3.41Å; K1017-R1021 PolarHBondContact O-N 2.68Å; K1017-R1021 PolarHBondContact O-NE 2.86Å
1018	L	94.9	Very high	93.7	Very high	1 Å²	1	70.6 Å²	70.6	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-75.1	-44.4	172.5	-169.5	68.3	0	0	0	111.5	E999 L1000 E1003 S1014 R1015 E1016 S1020 R1021 I1022 I1029 F1033	E999-L1018 HydrophobicContact CB-CD1 4.24Å; L1000-L1018 HydrophobicContact CD2-CD2 3.66Å; L1000-L1018 HydrophobicContact CG-CD2 4.38Å; E1003-L1018 HydrophobicContact CB-CD1 4.36Å; E1003-L1018 HydrophobicContact CB-CD2 4.07Å; E1003-L1018 HydrophobicContact CG-CD2 4.14Å; S1014-L1018 PolarHBondContact O-N 3.45Å; S1014-L1018 VanDerWaalsContact O-N 3.09Å; R1015-L1018 CarbonylContact O-C 3.54Å; R1015-L1018 WeakPolarHBondContact O-CA 3.49Å; R1015-L1018 WeakPolarHBondContact O-CB 3.41Å; R1015-L1018 PolarHBondContact O-N 3.22Å; R1015-L1018 VanDerWaalsContact O-N 3.12Å; E1016-L1018 VanDerWaalsContact C-N 3.28Å; E1016-L1018 PolarHBondContact O-N 2.76Å; L1018-S1020 PolarHBondContact O-N 3.37Å; L1018-R1021 VanDerWaalsContact CD1-CZ 3.46Å; L1018-R1021 WeakPolarHBondContact O-CB 3.43Å; L1018-R1021 PolarHBondContact O-N 3.11Å; L1018-I1022 HydrophobicContact CD1-CD1 4.45Å; L1018-I1022 HydrophobicContact CD1-CG2 3.99Å; L1018-I1022 HydrophobicContact CD2-CD1 4.33Å; L1018-I1022 HydrophobicContact CG-CD1 3.96Å; L1018-I1022 HydrophobicContact CG-CG1 4.5Å; L1018-I1022 HydrophobicContact CG-CG2 4.43Å; L1018-I1022 WeakPolarHBondContact O-CG1 3.41Å; L1018-I1022 PolarHBondContact O-N 3.26Å; L1018-I1029 HydrophobicContact CB-CD1 4.13Å; L1018-I1029 HydrophobicContact CD2-CD1 4.2Å; L1018-I1029 HydrophobicContact CD2-CG2 3.98Å; L1018-I1029 HydrophobicContact CG-CD1 4.05Å; L1018-F1033 HydrophobicContact CD2-CE2 3.93Å; L1018-F1033 HydrophobicContact CD2-CZ 4.5Å
1019	S	94.9	Very high	93.7	Very high	27 Å²	27	67.5 Å²	67.5	19%	0.189	34%	0.336	C	S	.	.	H	α-helix	trans	-50	-45.2	172.5	164.6	0	0	0	0	111.3	R1015 E1016 L1023 L1024 I1029	R1015-S1019 WeakPolarHBondContact O-CB 3.35Å; R1015-S1019 PolarHBondContact O-N 3.22Å; E1016-S1019 WeakPolarHBondContact O-CB 3.5Å; E1016-S1019 PolarHBondContact O-N 3.47Å; S1019-L1023 WeakPolarHBondContact O-CA 3.48Å; S1019-L1023 PolarHBondContact O-N 3.4Å; S1019-L1024 VanDerWaalsContact CA-O 3.32Å; S1019-L1024 WeakPolarHBondContact CA-O 3.43Å; S1019-L1024 VanDerWaalsContact CB-O 3.26Å; S1019-L1024 WeakPolarHBondContact CB-O 3.4Å; S1019-L1024 PolarHBondContact O-N 3.23Å; S1019-L1024 PolarHBondContact OG-O 2.8Å; S1019-I1029 VanDerWaalsContact CA-CD1 3.41Å; S1019-I1029 VanDerWaalsContact N-CD1 3.26Å
1020	S	93.3	Very high	93.6	Very high	89 Å²	89	63.9 Å²	63.9	62%	0.622	33%	0.325	S	S	*	.	H	α-helix	trans	-67	-38.2	176.9	-54.6	0	0	0	0	113.4	E1016 L1018	E1016-S1020 WeakPolarHBondContact O-CB 3.45Å; E1016-S1020 PolarHBondContact O-N 3.18Å; E1016-S1020 PolarHBondContact O-OG 3.24Å; L1018-S1020 PolarHBondContact O-N 3.37Å
1021	R	93.1	Very high	93.7	Very high	101 Å²	101	67.4 Å²	67.4	38%	0.381	35%	0.346	S	S	.	.	H	α-helix	trans	-68.6	-45.7	176.1	-85	-179.4	-76.6	162.4	-10.7	113.1	E999 E1003 K1017 L1018	E999-R1021 IonicContact OE2-CZ 3.26Å; E999-R1021 IonicContact OE2-NE 2.7Å; E999-R1021 IonicContact OE2-NH1 2.69Å; E999-R1021 PolarHBondContact OE2-NH1 2.86Å; E1003-R1021 IonicContact OE2-CZ 2.71Å; E1003-R1021 IonicContact OE2-NH1 3.12Å; E1003-R1021 PolarHBondContact OE2-NH1 2.78Å; E1003-R1021 VanDerWaalsContact OE2-NH1 3.1Å; E1003-R1021 IonicContact OE2-NH2 3.86Å; E1003-R1021 PolarHBondContact OE2-NH2 2.89Å; K1017-R1021 PolarHBondContact O-N 2.68Å; K1017-R1021 PolarHBondContact O-NE 2.86Å; L1018-R1021 VanDerWaalsContact CD1-CZ 3.46Å; L1018-R1021 WeakPolarHBondContact O-CB 3.43Å; L1018-R1021 PolarHBondContact O-N 3.11Å
1022	I	93.9	Very high	93.8	Very high	13 Å²	13	65.6 Å²	65.6	7%	0.067	33%	0.334	C	S	.	.	H	α-helix	trans	-105.1	1.1	-165.6	79	-179	0	0	0	113.8	Q996 E999 L1000 L1018 L1024 I1029	Q996-I1022 HydrophobicContact CG-CB 4.18Å; Q996-I1022 PolarHBondContact NE2-O 3.45Å; E999-I1022 HydrophobicContact CB-CG2 3.64Å; E999-I1022 HydrophobicContact CG-CG2 4.17Å; L1000-I1022 HydrophobicContact CD1-CD1 3.92Å; L1000-I1022 HydrophobicContact CD2-CD1 3.9Å; L1000-I1022 HydrophobicContact CG-CD1 3.59Å; L1018-I1022 HydrophobicContact CD1-CD1 4.45Å; L1018-I1022 HydrophobicContact CD1-CG2 3.99Å; L1018-I1022 HydrophobicContact CD2-CD1 4.33Å; L1018-I1022 HydrophobicContact CG-CD1 3.96Å; L1018-I1022 HydrophobicContact CG-CG1 4.5Å; L1018-I1022 HydrophobicContact CG-CG2 4.43Å; L1018-I1022 WeakPolarHBondContact O-CG1 3.41Å; L1018-I1022 PolarHBondContact O-N 3.26Å; I1022-L1024 HydrophobicContact CD1-CB 4.41Å; I1022-L1024 HydrophobicContact CD1-CD1 3.7Å; I1022-L1024 HydrophobicContact CD1-CG 4.35Å; I1022-L1024 HydrophobicContact CG1-CB 4.03Å; I1022-L1024 HydrophobicContact CG1-CD1 3.92Å; I1022-L1024 HydrophobicContact CG1-CG 4.03Å; I1022-L1024 PolarHBondContact O-N 2.73Å; I1022-I1029 HydrophobicContact CD1-CD1 3.86Å; I1022-I1029 HydrophobicContact CD1-CG1 4.32Å; I1022-I1029 HydrophobicContact CG1-CD1 4.13Å
1023	L	93.2	Very high	93.9	Very high	148 Å²	148	62.8 Å²	62.8	78%	0.775	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	46.2	178.6	-55.8	178.4	0	0	0	113.1	S1019	S1019-L1023 WeakPolarHBondContact O-CA 3.48Å; S1019-L1023 PolarHBondContact O-N 3.4Å
1024	L	92.4	Very high	94	Very high	17 Å²	17	58.5 Å²	58.5	9%	0.089	31%	0.306	C	S	.	.			trans	-126.7	134.3	175	-68.4	175.1	0	0	0	109.8	F992 Q996 L1000 S1019 I1022 E1026 I1029	F992-L1024 HydrophobicContact CD1-CD1 3.52Å; F992-L1024 HydrophobicContact CD1-CD2 4.28Å; F992-L1024 HydrophobicContact CE1-CD1 3.82Å; Q996-L1024 HydrophobicContact CB-CD1 4.15Å; Q996-L1024 HydrophobicContact CG-CD1 4.17Å; Q996-L1024 HydrophobicContact CG-CG 4.49Å; L1000-L1024 HydrophobicContact CD1-CD1 4.24Å; S1019-L1024 VanDerWaalsContact CA-O 3.32Å; S1019-L1024 WeakPolarHBondContact CA-O 3.43Å; S1019-L1024 VanDerWaalsContact CB-O 3.26Å; S1019-L1024 WeakPolarHBondContact CB-O 3.4Å; S1019-L1024 PolarHBondContact O-N 3.23Å; S1019-L1024 PolarHBondContact OG-O 2.8Å; I1022-L1024 HydrophobicContact CD1-CB 4.41Å; I1022-L1024 HydrophobicContact CD1-CD1 3.7Å; I1022-L1024 HydrophobicContact CD1-CG 4.35Å; I1022-L1024 HydrophobicContact CG1-CB 4.03Å; I1022-L1024 HydrophobicContact CG1-CD1 3.92Å; I1022-L1024 HydrophobicContact CG1-CG 4.03Å; I1022-L1024 PolarHBondContact O-N 2.73Å; L1024-E1026 PolarHBondContact O-N 3.21Å; L1024-I1029 HydrophobicContact CB-CD1 4.42Å; L1024-I1029 HydrophobicContact CB-CG1 4.22Å
1025	P	93.3	Very high	94.1	Very high	76 Å²	76	61.5 Å²	61.5	49%	0.494	32%	0.32	S	S	.	.			trans	-55.2	139	178.9	-25.6	33.6	0	0	0	112.7	T1027 R1028 I1029	P1025-T1027 PolarHBondContact O-N 3.39Å; P1025-T1027 VanDerWaalsContact O-N 3.1Å; P1025-R1028 HydrophobicContact CB-CG 4.27Å; P1025-R1028 HydrophobicContact CG-CG 4.38Å; P1025-R1028 WeakPolarHBondContact O-CA 3.26Å; P1025-R1028 WeakPolarHBondContact O-CB 3.4Å; P1025-R1028 PolarHBondContact O-N 3.06Å; P1025-I1029 PolarHBondContact O-N 3.37Å
1026	E	93.4	Very high	94.1	Very high	34 Å²	34	61.6 Å²	61.6	16%	0.159	32%	0.32	C	S	.	.	H	α-helix	trans	-41.3	-47.1	175.2	167.7	50.6	-155.7	0	0	113.5	R1015 E1016 L1024 R1028 I1029 Q1030	R1015-E1026 WeakPolarHBondContact CB-OE2 3.4Å; R1015-E1026 IonicContact CZ-OE1 2.73Å; R1015-E1026 IonicContact NE-OE1 3.18Å; R1015-E1026 PolarHBondContact NE-OE1 2.73Å; R1015-E1026 IonicContact NE-OE2 3.99Å; R1015-E1026 IonicContact NH2-OE1 2.78Å; R1015-E1026 PolarHBondContact NH2-OE1 2.91Å; E1016-E1026 HydrophobicContact CG-CG 4.45Å; E1016-E1026 PolarHBondContact N-OE2 3.35Å; L1024-E1026 PolarHBondContact O-N 3.21Å; E1026-R1028 VanDerWaalsContact C-N 3.29Å; E1026-R1028 PolarHBondContact O-N 2.77Å; E1026-I1029 WeakPolarHBondContact O-CB 3.38Å; E1026-I1029 PolarHBondContact O-N 3.37Å; E1026-I1029 VanDerWaalsContact O-N 3.1Å; E1026-Q1030 PolarHBondContact O-N 2.92Å
1027	T	92.6	Very high	94.1	Very high	85 Å²	85	59.2 Å²	59.2	52%	0.521	31%	0.307	S	S	.	.	H	α-helix	trans	-62.3	-31.3	177.9	57.4	0	0	0	0	113.8	P1025 V1031	P1025-T1027 PolarHBondContact O-N 3.39Å; P1025-T1027 VanDerWaalsContact O-N 3.1Å; T1027-V1031 WeakPolarHBondContact O-CB 3.17Å; T1027-V1031 VanDerWaalsContact O-CG2 3.24Å; T1027-V1031 WeakPolarHBondContact O-CG2 3.26Å; T1027-V1031 PolarHBondContact O-N 3.47Å; T1027-V1031 VanDerWaalsContact O-N 3.12Å
1028	R	93.3	Very high	94	Very high	91 Å²	91	53.8 Å²	53.8	34%	0.343	29%	0.289	S	S	.	.	H	α-helix	trans	-75.1	-34.7	174.9	-62.7	-65.8	-172.7	146.4	-2.2	111.2	S988 T990 P1025 E1026 W1032	S988-R1028 PolarHBondContact O-NH1 3.39Å; S988-R1028 PolarHBondContact O-NH2 3.17Å; T990-R1028 HydrophobicContact CG2-CG 4.08Å; T990-R1028 PolarHBondContact OG1-NH1 2.88Å; T990-R1028 VanDerWaalsContact OG1-NH1 3.15Å; P1025-R1028 HydrophobicContact CB-CG 4.27Å; P1025-R1028 HydrophobicContact CG-CG 4.38Å; P1025-R1028 WeakPolarHBondContact O-CA 3.26Å; P1025-R1028 WeakPolarHBondContact O-CB 3.4Å; P1025-R1028 PolarHBondContact O-N 3.06Å; E1026-R1028 VanDerWaalsContact C-N 3.29Å; E1026-R1028 PolarHBondContact O-N 2.77Å; R1028-W1032 WeakPolarHBondContact O-CB 3.3Å; R1028-W1032 PolarHBondContact O-N 3.32Å
1029	I	94.2	Very high	93.8	Very high	1 Å²	1	58 Å²	58	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-67	-48.7	173.1	-64.6	-175.3	0	0	0	110.4	L1000 R1015 L1018 S1019 I1022 L1024 P1025 E1026 V1031 W1032 F1033	L1000-I1029 HydrophobicContact CD2-CG1 4.29Å; L1000-I1029 HydrophobicContact CD2-CG2 4.07Å; R1015-I1029 HydrophobicContact CB-CG2 4.14Å; R1015-I1029 HydrophobicContact CG-CG2 4.22Å; L1018-I1029 HydrophobicContact CB-CD1 4.13Å; L1018-I1029 HydrophobicContact CD2-CD1 4.2Å; L1018-I1029 HydrophobicContact CD2-CG2 3.98Å; L1018-I1029 HydrophobicContact CG-CD1 4.05Å; S1019-I1029 VanDerWaalsContact CA-CD1 3.41Å; S1019-I1029 VanDerWaalsContact N-CD1 3.26Å; I1022-I1029 HydrophobicContact CD1-CD1 3.86Å; I1022-I1029 HydrophobicContact CD1-CG1 4.32Å; I1022-I1029 HydrophobicContact CG1-CD1 4.13Å; L1024-I1029 HydrophobicContact CB-CD1 4.42Å; L1024-I1029 HydrophobicContact CB-CG1 4.22Å; P1025-I1029 PolarHBondContact O-N 3.37Å; E1026-I1029 WeakPolarHBondContact O-CB 3.38Å; E1026-I1029 PolarHBondContact O-N 3.37Å; E1026-I1029 VanDerWaalsContact O-N 3.1Å; I1029-V1031 VanDerWaalsContact C-N 3.28Å; I1029-V1031 PolarHBondContact O-N 2.94Å; I1029-W1032 WeakPolarHBondContact O-CA 3.3Å; I1029-W1032 WeakPolarHBondContact O-CB 3.48Å; I1029-W1032 PolarHBondContact O-N 3.01Å; I1029-F1033 HydrophobicContact CG2-CD2 3.7Å; I1029-F1033 HydrophobicContact CG2-CE2 3.84Å; I1029-F1033 WeakPolarHBondContact O-CD2 3.27Å; I1029-F1033 PolarHBondContact O-N 3.5Å
1030	Q	94.1	Very high	93.7	Very high	69 Å²	69	61.9 Å²	61.9	32%	0.322	32%	0.318	S	S	.	.	H	α-helix	trans	-53	-44.9	174	-173.2	-165.6	6.4	0	0	112.1	E1026 S1034 Y1213	E1026-Q1030 PolarHBondContact O-N 2.92Å; Q1030-S1034 WeakPolarHBondContact O-CB 3.26Å; Q1030-S1034 PolarHBondContact O-N 3.29Å; Q1030-Y1213 PolarHBondContact NE2-OH 3.23Å
1031	V	93.7	Very high	93.5	Very high	81 Å²	81	62.7 Å²	62.7	49%	0.491	31%	0.308	S	S	.	.	H	α-helix	trans	-67.5	-39.2	175.6	168.2	0	0	0	0	112	T1027 I1029 S1034 N1035	T1027-V1031 WeakPolarHBondContact O-CB 3.17Å; T1027-V1031 VanDerWaalsContact O-CG2 3.24Å; T1027-V1031 WeakPolarHBondContact O-CG2 3.26Å; T1027-V1031 PolarHBondContact O-N 3.47Å; T1027-V1031 VanDerWaalsContact O-N 3.12Å; I1029-V1031 VanDerWaalsContact C-N 3.28Å; I1029-V1031 PolarHBondContact O-N 2.94Å; V1031-S1034 PolarHBondContact O-N 2.98Å; V1031-N1035 WeakPolarHBondContact CG1-ND2 3.37Å; V1031-N1035 WeakPolarHBondContact O-CB 3.19Å; V1031-N1035 PolarHBondContact O-N 2.73Å; V1031-N1035 PolarHBondContact O-ND2 3.23Å
1032	W	95.7	Very high	93.1	Very high	27 Å²	27	65 Å²	65	10%	0.102	32%	0.316	C	S	.	.	H	α-helix	trans	-61	-51	174.4	-174.4	102.4	0	0	0	110.9	F992 L1000 E1001 F1004 R1028 I1029 S1034 N1035 R1036	F992-W1032 AromaticContact CE2-CD1 3.69Å; F992-W1032 HydrophobicContact CZ-CB 4.48Å; F992-W1032 AromaticContact CZ-CD1 3.89Å; L1000-W1032 HydrophobicContact CB-CD2 4.03Å; L1000-W1032 HydrophobicContact CB-CE3 4.05Å; L1000-W1032 HydrophobicContact CB-CH2 3.82Å; L1000-W1032 HydrophobicContact CB-CZ2 3.75Å; L1000-W1032 HydrophobicContact CB-CZ3 3.95Å; L1000-W1032 HydrophobicContact CD1-CD2 4.05Å; L1000-W1032 HydrophobicContact CD1-CG 3.98Å; L1000-W1032 HydrophobicContact CD2-CB 4.49Å; L1000-W1032 HydrophobicContact CD2-CD2 3.93Å; L1000-W1032 HydrophobicContact CD2-CE3 3.83Å; L1000-W1032 HydrophobicContact CD2-CG 4.21Å; L1000-W1032 HydrophobicContact CD2-CZ3 4.41Å; L1000-W1032 HydrophobicContact CG-CD2 4.24Å; L1000-W1032 HydrophobicContact CG-CE3 4.41Å; L1000-W1032 WeakPolarHBondContact O-CH2 3.43Å; L1000-W1032 WeakPolarHBondContact O-CZ3 3.48Å; E1001-W1032 HydrophobicContact CB-CH2 4.5Å; F1004-W1032 HydrophobicContact CB-CH2 4.16Å; F1004-W1032 HydrophobicContact CB-CZ3 4.01Å; F1004-W1032 HydrophobicContact CD2-CZ3 4.25Å; F1004-W1032 HydrophobicContact CG-CZ3 4.34Å; R1028-W1032 WeakPolarHBondContact O-CB 3.3Å; R1028-W1032 PolarHBondContact O-N 3.32Å; I1029-W1032 WeakPolarHBondContact O-CA 3.3Å; I1029-W1032 WeakPolarHBondContact O-CB 3.48Å; I1029-W1032 PolarHBondContact O-N 3.01Å; W1032-S1034 VanDerWaalsContact C-N 3.34Å; W1032-S1034 PolarHBondContact O-N 2.74Å; W1032-N1035 CarbonylContact O-C 3.57Å; W1032-N1035 PolarHBondContact O-N 3.37Å; W1032-N1035 VanDerWaalsContact O-N 3.11Å; W1032-R1036 HydrophobicContact CE3-CB 4.06Å; W1032-R1036 HydrophobicContact CH2-CB 3.92Å; W1032-R1036 HydrophobicContact CH2-CG 3.65Å; W1032-R1036 HydrophobicContact CZ2-CB 4.4Å; W1032-R1036 HydrophobicContact CZ2-CG 4.27Å; W1032-R1036 HydrophobicContact CZ3-CB 3.74Å; W1032-R1036 HydrophobicContact CZ3-CG 3.89Å; W1032-R1036 PolarHBondContact O-N 3.12Å
1033	F	96.9	Very high	92.7	Very high	1 Å²	1	68.4 Å²	68.4	0%	0.004	33%	0.332	C	S	.	.	H	α-helix	trans	-60.4	-40.5	178.2	-92.3	-90.7	0	0	0	112.5	L1000 E1003 F1004 T1007 P1010 L1018 I1029 N1035 R1036 R1037	L1000-F1033 HydrophobicContact CD2-CD2 4.35Å; L1000-F1033 HydrophobicContact CD2-CE2 3.92Å; E1003-F1033 HydrophobicContact CB-CZ 4.03Å; E1003-F1033 HydrophobicContact CG-CZ 4.12Å; F1004-F1033 HydrophobicContact CB-CE1 3.96Å; F1004-F1033 HydrophobicContact CB-CZ 4.36Å; F1004-F1033 AromaticContact CD2-CD1 3.77Å; F1004-F1033 HydrophobicContact CD2-CD1 3.77Å; F1004-F1033 AromaticContact CD2-CE1 3.79Å; F1004-F1033 HydrophobicContact CD2-CE1 3.79Å; F1004-F1033 HydrophobicContact CG-CE1 4.38Å; T1007-F1033 WeakPolarHBondContact O-CE1 3.36Å; P1010-F1033 VanDerWaalsContact CD-CD1 3.43Å; P1010-F1033 VanDerWaalsContact CD-CE1 3.45Å; P1010-F1033 HydrophobicContact CG-CD1 3.65Å; P1010-F1033 HydrophobicContact CG-CD2 4.18Å; P1010-F1033 HydrophobicContact CG-CE1 3.49Å; P1010-F1033 VanDerWaalsContact CG-CE1 3.49Å; P1010-F1033 HydrophobicContact CG-CE2 4.04Å; P1010-F1033 HydrophobicContact CG-CG 4Å; P1010-F1033 HydrophobicContact CG-CZ 3.71Å; L1018-F1033 HydrophobicContact CD2-CE2 3.93Å; L1018-F1033 HydrophobicContact CD2-CZ 4.5Å; I1029-F1033 HydrophobicContact CG2-CD2 3.7Å; I1029-F1033 HydrophobicContact CG2-CE2 3.84Å; I1029-F1033 WeakPolarHBondContact O-CD2 3.27Å; I1029-F1033 PolarHBondContact O-N 3.5Å; F1033-N1035 PolarHBondContact O-N 3.3Å; F1033-R1036 PolarHBondContact O-N 2.92Å; F1033-R1037 WeakPolarHBondContact O-CB 3.09Å; F1033-R1037 WeakPolarHBondContact O-CG 3.03Å; F1033-R1037 PolarHBondContact O-N 2.99Å
1034	S	94.3	Very high	92.3	Very high	63 Å²	63	63.6 Å²	63.6	44%	0.441	31%	0.306	S	S	.	.	H	α-helix	trans	-60.5	-44.8	174.6	-165.7	0	0	0	0	111.8	Q1030 V1031 W1032 A1038	Q1030-S1034 WeakPolarHBondContact O-CB 3.26Å; Q1030-S1034 PolarHBondContact O-N 3.29Å; V1031-S1034 PolarHBondContact O-N 2.98Å; W1032-S1034 VanDerWaalsContact C-N 3.34Å; W1032-S1034 PolarHBondContact O-N 2.74Å; S1034-A1038 WeakPolarHBondContact O-CB 3.2Å; S1034-A1038 PolarHBondContact O-N 3.39Å
1035	N	95.2	Very high	91.8	Very high	96 Å²	96	70 Å²	70	51%	0.513	33%	0.333	S	S	.	.	H	α-helix	trans	-67.6	-38.5	176	-77.3	-59.1	0	0	0	113	V1031 W1032 F1033 A1038 K1039	V1031-N1035 WeakPolarHBondContact CG1-ND2 3.37Å; V1031-N1035 WeakPolarHBondContact O-CB 3.19Å; V1031-N1035 PolarHBondContact O-N 2.73Å; V1031-N1035 PolarHBondContact O-ND2 3.23Å; W1032-N1035 CarbonylContact O-C 3.57Å; W1032-N1035 PolarHBondContact O-N 3.37Å; W1032-N1035 VanDerWaalsContact O-N 3.11Å; F1033-N1035 PolarHBondContact O-N 3.3Å; N1035-A1038 CarbonylContact O-C 3.54Å; N1035-A1038 WeakPolarHBondContact O-CB 3.23Å; N1035-A1038 PolarHBondContact O-N 2.87Å; N1035-K1039 PolarHBondContact O-N 2.89Å
1036	R	95.4	Very high	91.2	Very high	39 Å²	39	71.8 Å²	71.8	15%	0.147	34%	0.336	C	S	.	.	H	α-helix	trans	-67.6	-44.3	177.6	-169	67.7	-176.7	100.9	-4.8	111.5	E1001 F1004 W1032 F1033 A1038 K1039 W1040 E1043	E1001-R1036 IonicContact OE1-CZ 3.93Å; E1001-R1036 IonicContact OE1-NE 3.86Å; E1001-R1036 PolarHBondContact OE1-NE 3.18Å; E1001-R1036 IonicContact OE1-NH2 3.78Å; E1001-R1036 PolarHBondContact OE1-NH2 3.39Å; E1001-R1036 WeakPolarHBondContact OE2-CD 3.47Å; E1001-R1036 IonicContact OE2-CZ 3.6Å; E1001-R1036 IonicContact OE2-NE 2.67Å; E1001-R1036 PolarHBondContact OE2-NE 3.45Å; E1001-R1036 IonicContact OE2-NH2 2.91Å; F1004-R1036 HydrophobicContact CD1-CG 3.76Å; F1004-R1036 HydrophobicContact CD2-CB 4.01Å; F1004-R1036 HydrophobicContact CD2-CG 3.64Å; F1004-R1036 HydrophobicContact CE1-CG 3.68Å; F1004-R1036 HydrophobicContact CE2-CB 3.82Å; F1004-R1036 HydrophobicContact CE2-CG 3.56Å; F1004-R1036 HydrophobicContact CG-CG 3.76Å; F1004-R1036 HydrophobicContact CZ-CB 4.23Å; F1004-R1036 HydrophobicContact CZ-CG 3.59Å; W1032-R1036 HydrophobicContact CE3-CB 4.06Å; W1032-R1036 HydrophobicContact CH2-CB 3.92Å; W1032-R1036 HydrophobicContact CH2-CG 3.65Å; W1032-R1036 HydrophobicContact CZ2-CB 4.4Å; W1032-R1036 HydrophobicContact CZ2-CG 4.27Å; W1032-R1036 HydrophobicContact CZ3-CB 3.74Å; W1032-R1036 HydrophobicContact CZ3-CG 3.89Å; W1032-R1036 PolarHBondContact O-N 3.12Å; F1033-R1036 PolarHBondContact O-N 2.92Å; R1036-A1038 VanDerWaalsContact C-N 3.29Å; R1036-A1038 PolarHBondContact O-N 3.27Å; R1036-K1039 WeakPolarHBondContact O-CB 3.48Å; R1036-K1039 PolarHBondContact O-N 2.85Å; R1036-K1039 VanDerWaalsContact O-N 3.1Å; R1036-W1040 PolarHBondContact O-N 2.96Å; R1036-E1043 IonicContact NH1-OE2 2.69Å; R1036-E1043 PolarHBondContact NH1-OE2 2.98Å; R1036-E1043 VanDerWaalsContact NH1-OE2 3.17Å
1037	R	95.1	Very high	90.8	Very high	40 Å²	40	76.7 Å²	76.7	15%	0.151	35%	0.353	C	S	.	.	H	α-helix	trans	-56.5	-40.9	168	-73.3	-170.7	-71.2	-97	5.7	112	F1004 H1008 Y1009 F1033 K1039 R1041	F1004-R1037 HydrophobicContact CE2-CG 3.85Å; F1004-R1037 HydrophobicContact CZ-CG 4.44Å; H1008-R1037 WeakPolarHBondContact O-CD 3.46Å; H1008-R1037 WeakPolarHBondContact O-CG 3.24Å; H1008-R1037 PolarHBondContact O-NH1 2.89Å; Y1009-R1037 VanDerWaalsContact CZ-CD 3.45Å; F1033-R1037 WeakPolarHBondContact O-CB 3.09Å; F1033-R1037 WeakPolarHBondContact O-CG 3.03Å; F1033-R1037 PolarHBondContact O-N 2.99Å; R1037-K1039 VanDerWaalsContact C-N 3.33Å; R1037-K1039 PolarHBondContact O-N 3.38Å; R1037-R1041 WeakPolarHBondContact O-CG 3.41Å; R1037-R1041 PolarHBondContact O-N 3.2Å
1038	A	91.2	Very high	90.3	Very high	31 Å²	31	77.6 Å²	77.6	26%	0.256	35%	0.353	S	S	.	.	H	α-helix	trans	-68.1	-30.3	177.3	0	0	0	0	0	113.2	S1034 N1035 R1036 R1042	S1034-A1038 WeakPolarHBondContact O-CB 3.2Å; S1034-A1038 PolarHBondContact O-N 3.39Å; N1035-A1038 CarbonylContact O-C 3.54Å; N1035-A1038 WeakPolarHBondContact O-CB 3.23Å; N1035-A1038 PolarHBondContact O-N 2.87Å; R1036-A1038 VanDerWaalsContact C-N 3.29Å; R1036-A1038 PolarHBondContact O-N 3.27Å; A1038-R1042 PolarHBondContact O-NE 2.94Å; A1038-R1042 PolarHBondContact O-NH2 3.18Å
1039	K	91	Very high	89.7	Confident	89 Å²	89	80 Å²	80	39%	0.387	37%	0.366	S	S	.	.	H	α-helix	trans	-70.5	-51.9	171.4	-177.4	-175.7	156.7	-173.5	0	110.8	N1035 R1036 R1037 R1041 R1042 E1043	N1035-K1039 PolarHBondContact O-N 2.89Å; R1036-K1039 WeakPolarHBondContact O-CB 3.48Å; R1036-K1039 PolarHBondContact O-N 2.85Å; R1036-K1039 VanDerWaalsContact O-N 3.1Å; R1037-K1039 VanDerWaalsContact C-N 3.33Å; R1037-K1039 PolarHBondContact O-N 3.38Å; K1039-R1041 PolarHBondContact O-N 2.94Å; K1039-R1042 WeakPolarHBondContact O-CA 3.3Å; K1039-R1042 WeakPolarHBondContact O-CB 3.46Å; K1039-R1042 PolarHBondContact O-N 2.97Å; K1039-E1043 WeakPolarHBondContact CE-OE1 3.44Å; K1039-E1043 HydrophobicContact CG-CG 4.46Å; K1039-E1043 IonicContact NZ-OE1 2.67Å; K1039-E1043 WeakPolarHBondContact O-CG 3.45Å; K1039-E1043 PolarHBondContact O-N 3.49Å
1040	W	92	Very high	89	Confident	108 Å²	108	86.2 Å²	86.2	41%	0.409	39%	0.394	S	S	.	.	H	α-helix	trans	-54.6	-46.4	178.4	-178.6	86.8	0	0	0	112.9	F1004 H1008 R1036 R1042 E1043 E1044	F1004-W1040 HydrophobicContact CE1-CB 4.46Å; F1004-W1040 HydrophobicContact CZ-CB 4.11Å; F1004-W1040 HydrophobicContact CZ-CG 4.41Å; H1008-W1040 AromaticContact CE1-CE2 3.84Å; H1008-W1040 AromaticContact CE1-CZ2 3.94Å; H1008-W1040 AromaticContact CE1-NE1 3.91Å; H1008-W1040 AromaticContact NE2-NE1 3.94Å; R1036-W1040 PolarHBondContact O-N 2.96Å; W1040-R1042 PolarHBondContact O-N 2.88Å; W1040-R1042 VanDerWaalsContact O-N 3.16Å; W1040-E1043 WeakPolarHBondContact CA-OE2 3.36Å; W1040-E1043 PolarHBondContact O-N 2.85Å; W1040-E1043 VanDerWaalsContact O-N 3.14Å; W1040-E1044 PolarHBondContact O-N 2.72Å
1041	R	90.5	Very high	88.3	Confident	106 Å²	106	86.8 Å²	86.8	40%	0.4	40%	0.399	S	S	.	.	H	α-helix	trans	-65	-16.8	175.8	-66.7	-174.1	-150.3	103.9	-9	114.6	Y1009 R1037 K1039 K1045	Y1009-R1041 PolarHBondContact OH-NH2 3.16Å; R1037-R1041 WeakPolarHBondContact O-CG 3.41Å; R1037-R1041 PolarHBondContact O-N 3.2Å; K1039-R1041 PolarHBondContact O-N 2.94Å; R1041-K1045 WeakPolarHBondContact O-CD 3.49Å; R1041-K1045 VanDerWaalsContact O-CG 3.27Å; R1041-K1045 WeakPolarHBondContact O-CG 3.2Å
1042	R	84.8	Confident	87.6	Confident	149 Å²	149	85.4 Å²	85.4	56%	0.562	40%	0.396	S	S	*	.	H	α-helix	trans	-87	-40.9	171.7	-77.9	178.4	-97.4	116.5	-5.9	110.9	A1038 K1039 W1040 K1045 M1046	A1038-R1042 PolarHBondContact O-NE 2.94Å; A1038-R1042 PolarHBondContact O-NH2 3.18Å; K1039-R1042 WeakPolarHBondContact O-CA 3.3Å; K1039-R1042 WeakPolarHBondContact O-CB 3.46Å; K1039-R1042 PolarHBondContact O-N 2.97Å; W1040-R1042 PolarHBondContact O-N 2.88Å; W1040-R1042 VanDerWaalsContact O-N 3.16Å; R1042-K1045 PolarHBondContact O-N 3.39Å; R1042-M1046 WeakPolarHBondContact O-CG 3.03Å; R1042-M1046 PolarHBondContact O-N 3.05Å; R1042-M1046 VanDerWaalsContact O-N 3.1Å
1043	E	85.7	Confident	86.4	Confident	86 Å²	86	87.1 Å²	87.1	40%	0.402	41%	0.412	S	S	.	.	H	α-helix	trans	-60.7	-49.6	177.5	-68.5	167.2	149	0	0	110.8	R1036 K1039 W1040 K1045 M1046 R1047	R1036-E1043 IonicContact NH1-OE2 2.69Å; R1036-E1043 PolarHBondContact NH1-OE2 2.98Å; R1036-E1043 VanDerWaalsContact NH1-OE2 3.17Å; K1039-E1043 WeakPolarHBondContact CE-OE1 3.44Å; K1039-E1043 HydrophobicContact CG-CG 4.46Å; K1039-E1043 IonicContact NZ-OE1 2.67Å; K1039-E1043 WeakPolarHBondContact O-CG 3.45Å; K1039-E1043 PolarHBondContact O-N 3.49Å; W1040-E1043 WeakPolarHBondContact CA-OE2 3.36Å; W1040-E1043 PolarHBondContact O-N 2.85Å; W1040-E1043 VanDerWaalsContact O-N 3.14Å; E1043-K1045 VanDerWaalsContact C-N 3.33Å; E1043-K1045 PolarHBondContact O-N 3.34Å; E1043-M1046 PolarHBondContact O-N 3.28Å; E1043-R1047 PolarHBondContact O-N 3.39Å
1044	E	83.5	Confident	85	Confident	47 Å²	47	96.1 Å²	96.1	22%	0.22	45%	0.446	C	S	.	.	H	α-helix	trans	-65.5	-34.9	179.2	-168.7	57.5	-160.2	0	0	112.8	W1040 M1046 R1047 M1048	W1040-E1044 PolarHBondContact O-N 2.72Å; E1044-M1046 VanDerWaalsContact C-N 3.27Å; E1044-M1046 PolarHBondContact O-N 3.07Å; E1044-R1047 VanDerWaalsContact CD-NH2 3.33Å; E1044-R1047 PolarHBondContact O-N 2.93Å; E1044-R1047 IonicContact OE1-CZ 3.3Å; E1044-R1047 IonicContact OE1-NE 2.73Å; E1044-R1047 PolarHBondContact OE1-NE 3.49Å; E1044-R1047 IonicContact OE1-NH2 3.79Å; E1044-R1047 PolarHBondContact OE1-NH2 3.5Å; E1044-R1047 IonicContact OE2-CZ 3Å; E1044-R1047 VanDerWaalsContact OE2-CZ 3.3Å; E1044-R1047 IonicContact OE2-NE 2.77Å; E1044-R1047 PolarHBondContact OE2-NE 3.29Å; E1044-R1047 IonicContact OE2-NH2 2.77Å; E1044-R1047 PolarHBondContact OE2-NH2 2.93Å; E1044-M1048 WeakPolarHBondContact O-CB 3.36Å; E1044-M1048 WeakPolarHBondContact O-CG 3.4Å; E1044-M1048 PolarHBondContact O-N 2.89Å; E1044-M1048 WeakPolarHBondContact OE1-CE 3.33Å
1045	K	83.1	Confident	83.4	Confident	152 Å²	152	98.9 Å²	98.9	66%	0.661	46%	0.456	S	S	*	.	H	α-helix	trans	-67.3	-24.8	172.9	-76.6	-177.5	-179.4	-172.4	0	113.3	R1041 R1042 E1043 K1049	R1041-K1045 WeakPolarHBondContact O-CD 3.49Å; R1041-K1045 VanDerWaalsContact O-CG 3.27Å; R1041-K1045 WeakPolarHBondContact O-CG 3.2Å; R1042-K1045 PolarHBondContact O-N 3.39Å; E1043-K1045 VanDerWaalsContact C-N 3.33Å; E1043-K1045 PolarHBondContact O-N 3.34Å; K1045-K1049 WeakPolarHBondContact O-CG 3.29Å; K1045-K1049 PolarHBondContact O-N 3.24Å
1046	M	79.1	Confident	81.6	Confident	113 Å²	113	102.5 Å²	102.5	56%	0.557	47%	0.47	S	S	*	.	H	α-helix	trans	-81.2	-40.7	170.7	-65.9	-57	-163.7	0	0	111.3	R1042 E1043 E1044 M1048 K1049 Q1050	R1042-M1046 WeakPolarHBondContact O-CG 3.03Å; R1042-M1046 PolarHBondContact O-N 3.05Å; R1042-M1046 VanDerWaalsContact O-N 3.1Å; E1043-M1046 PolarHBondContact O-N 3.28Å; E1044-M1046 VanDerWaalsContact C-N 3.27Å; E1044-M1046 PolarHBondContact O-N 3.07Å; M1046-M1048 PolarHBondContact O-N 3.43Å; M1046-K1049 WeakPolarHBondContact O-CB 3.47Å; M1046-K1049 PolarHBondContact O-N 2.87Å; M1046-K1049 VanDerWaalsContact O-N 3.14Å; M1046-K1049 HydrophobicContact SD-CD 4.35Å; M1046-Q1050 WeakPolarHBondContact O-CG 3.41Å; M1046-Q1050 PolarHBondContact O-N 3Å
1047	R	86	Confident	79.4	Confident	137 Å²	137	108.2 Å²	108.2	52%	0.517	50%	0.498	S	S	.	.	H	α-helix	trans	-57.6	-46.9	174.9	-167	171.1	75.3	137.5	4.9	111.6	E1043 E1044 K1049 Q1050 L1051	E1043-R1047 PolarHBondContact O-N 3.39Å; E1044-R1047 VanDerWaalsContact CD-NH2 3.33Å; E1044-R1047 PolarHBondContact O-N 2.93Å; E1044-R1047 IonicContact OE1-CZ 3.3Å; E1044-R1047 IonicContact OE1-NE 2.73Å; E1044-R1047 PolarHBondContact OE1-NE 3.49Å; E1044-R1047 IonicContact OE1-NH2 3.79Å; E1044-R1047 PolarHBondContact OE1-NH2 3.5Å; E1044-R1047 IonicContact OE2-CZ 3Å; E1044-R1047 VanDerWaalsContact OE2-CZ 3.3Å; E1044-R1047 IonicContact OE2-NE 2.77Å; E1044-R1047 PolarHBondContact OE2-NE 3.29Å; E1044-R1047 IonicContact OE2-NH2 2.77Å; E1044-R1047 PolarHBondContact OE2-NH2 2.93Å; R1047-K1049 VanDerWaalsContact C-N 3.32Å; R1047-K1049 PolarHBondContact O-N 3.23Å; R1047-Q1050 PolarHBondContact O-N 3Å; R1047-L1051 HydrophobicContact CG-CD1 4.37Å; R1047-L1051 WeakPolarHBondContact O-CG 3.39Å; R1047-L1051 PolarHBondContact O-N 3.09Å
1048	M	81.5	Confident	77	Confident	104 Å²	104	114.5 Å²	114.5	51%	0.512	53%	0.527	S	S	.	.	H	α-helix	trans	-62.6	-34.8	175.9	-72.1	-68.9	160.3	0	0	113.2	E1044 M1046 L1051 A1052	E1044-M1048 WeakPolarHBondContact O-CB 3.36Å; E1044-M1048 WeakPolarHBondContact O-CG 3.4Å; E1044-M1048 PolarHBondContact O-N 2.89Å; E1044-M1048 WeakPolarHBondContact OE1-CE 3.33Å; M1046-M1048 PolarHBondContact O-N 3.43Å; M1048-L1051 HydrophobicContact CE-CD1 4.49Å; M1048-L1051 HydrophobicContact SD-CD1 4.3Å; M1048-A1052 WeakPolarHBondContact O-CB 3.24Å; M1048-A1052 PolarHBondContact O-N 2.96Å
1049	K	81.3	Confident	74.6	Confident	142 Å²	142	118.7 Å²	118.7	62%	0.617	55%	0.551	S	S	*	*	H	α-helix	trans	-67.7	-42.4	172.7	-77.2	177.1	177	-170.2	0	112.4	K1045 M1046 R1047 L1051 A1052 S1053	K1045-K1049 WeakPolarHBondContact O-CG 3.29Å; K1045-K1049 PolarHBondContact O-N 3.24Å; M1046-K1049 WeakPolarHBondContact O-CB 3.47Å; M1046-K1049 PolarHBondContact O-N 2.87Å; M1046-K1049 VanDerWaalsContact O-N 3.14Å; M1046-K1049 HydrophobicContact SD-CD 4.35Å; R1047-K1049 VanDerWaalsContact C-N 3.32Å; R1047-K1049 PolarHBondContact O-N 3.23Å; K1049-L1051 VanDerWaalsContact C-N 3.35Å; K1049-A1052 PolarHBondContact O-N 2.92Å; K1049-S1053 PolarHBondContact O-N 3.32Å; K1049-S1053 PolarHBondContact O-OG 3.36Å; K1049-S1053 VanDerWaalsContact O-OG 3.11Å
1050	Q	79.2	Confident	72.1	Confident	130 Å²	130	123 Å²	123	61%	0.607	58%	0.577	S	S	*	*	H	α-helix	trans	-62.5	-42	176.6	-70.6	171.4	-2.7	0	0	111.5	M1046 R1047 S1053 R1054	M1046-Q1050 WeakPolarHBondContact O-CG 3.41Å; M1046-Q1050 PolarHBondContact O-N 3Å; R1047-Q1050 PolarHBondContact O-N 3Å; Q1050-S1053 WeakPolarHBondContact CA-OG 3.33Å; Q1050-S1053 PolarHBondContact O-N 2.84Å; Q1050-S1053 PolarHBondContact O-OG 3.36Å; Q1050-R1054 WeakPolarHBondContact O-CB 3.46Å; Q1050-R1054 PolarHBondContact O-N 2.98Å
1051	L	79.4	Confident	69.6	Low	82 Å²	82	125.2 Å²	125.2	43%	0.429	59%	0.591	S	S	.	*	H	α-helix	trans	-63	-42.4	173.8	-69	170	0	0	0	111.9	R1047 M1048 K1049 R1054 N1055	R1047-L1051 HydrophobicContact CG-CD1 4.37Å; R1047-L1051 WeakPolarHBondContact O-CG 3.39Å; R1047-L1051 PolarHBondContact O-N 3.09Å; M1048-L1051 HydrophobicContact CE-CD1 4.49Å; M1048-L1051 HydrophobicContact SD-CD1 4.3Å; K1049-L1051 VanDerWaalsContact C-N 3.35Å; L1051-R1054 PolarHBondContact O-N 3.48Å; L1051-N1055 PolarHBondContact O-N 3.22Å
1052	A	78.9	Confident	67	Low	52 Å²	52	129.1 Å²	129.1	43%	0.43	61%	0.614	S	S	.	*	H	α-helix	trans	-61.4	-46.2	175.3	0	0	0	0	0	112.3	M1048 K1049 R1054 N1055 Q1056	M1048-A1052 WeakPolarHBondContact O-CB 3.24Å; M1048-A1052 PolarHBondContact O-N 2.96Å; K1049-A1052 PolarHBondContact O-N 2.92Å; A1052-R1054 VanDerWaalsContact C-N 3.34Å; A1052-R1054 PolarHBondContact O-N 3.19Å; A1052-N1055 PolarHBondContact O-N 3.11Å; A1052-Q1056 PolarHBondContact O-N 3.31Å
1053	S	70.7	Confident	64.6	Low	62 Å²	62	129.9 Å²	129.9	43%	0.434	62%	0.624	S	S	.	*	H	α-helix	trans	-64.4	-35.6	175.2	47.1	0	0	0	0	113	K1049 Q1050 Q1056 Q1057	K1049-S1053 PolarHBondContact O-N 3.32Å; K1049-S1053 PolarHBondContact O-OG 3.36Å; K1049-S1053 VanDerWaalsContact O-OG 3.11Å; Q1050-S1053 WeakPolarHBondContact CA-OG 3.33Å; Q1050-S1053 PolarHBondContact O-N 2.84Å; Q1050-S1053 PolarHBondContact O-OG 3.36Å; S1053-Q1056 PolarHBondContact O-N 2.85Å; S1053-Q1057 PolarHBondContact O-N 3.13Å
1054	R	67.5	Low	62.1	Low	191 Å²	191	134.7 Å²	134.7	72%	0.721	64%	0.639	S	S	*	*	H	α-helix	trans	-69.1	-35.3	177.1	-171.7	171.8	178.5	168.5	-1.1	112.2	Q1050 L1051 A1052 Q1056 Q1057	Q1050-R1054 WeakPolarHBondContact O-CB 3.46Å; Q1050-R1054 PolarHBondContact O-N 2.98Å; L1051-R1054 PolarHBondContact O-N 3.48Å; A1052-R1054 VanDerWaalsContact C-N 3.34Å; A1052-R1054 PolarHBondContact O-N 3.19Å; R1054-Q1056 VanDerWaalsContact C-N 3.29Å; R1054-Q1056 PolarHBondContact O-N 3.39Å; R1054-Q1057 PolarHBondContact O-N 3.27Å; R1054-Q1057 VanDerWaalsContact O-N 3.1Å
1055	N	60.5	Low	59.8	Low	121 Å²	121	140.8 Å²	140.8	65%	0.647	67%	0.667	S	S	*	*	H	α-helix	trans	-73.6	-18.5	175	-76.3	-19.3	0	0	0	113.7	L1051 A1052 Q1057	L1051-N1055 PolarHBondContact O-N 3.22Å; A1052-N1055 PolarHBondContact O-N 3.11Å; N1055-Q1057 VanDerWaalsContact C-N 3.27Å
1056	Q	57.4	Low	57.3	Low	171 Å²	171	138.4 Å²	138.4	80%	0.799	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-8.5	167.7	-70.6	178.3	-17.3	0	0	113	A1052 S1053 R1054	A1052-Q1056 PolarHBondContact O-N 3.31Å; S1053-Q1056 PolarHBondContact O-N 2.85Å; R1054-Q1056 VanDerWaalsContact C-N 3.29Å; R1054-Q1056 PolarHBondContact O-N 3.39Å
1057	Q	49.9	Very low	55.2	Low	160 Å²	160	140.8 Å²	140.8	75%	0.748	69%	0.685	S	S	*	*			trans	-103.9	50.3	174.1	-67	-177.8	-17.7	0	0	111.9	S1053 R1054 N1055	S1053-Q1057 PolarHBondContact O-N 3.13Å; R1054-Q1057 PolarHBondContact O-N 3.27Å; R1054-Q1057 VanDerWaalsContact O-N 3.1Å; N1055-Q1057 VanDerWaalsContact C-N 3.27Å
1058	K	43.1	Very low	52.7	Low	171 Å²	171	140.3 Å²	140.3	74%	0.743	69%	0.693	S	S	*	*			trans	-85.9	130.6	158.4	-83.5	-171	173	-175.6	0	109	I1060	K1058-I1060 PolarHBondContact O-N 3.47Å
1059	P	41.6	Very low	50.5	Low	120 Å²	120	142.8 Å²	142.8	78%	0.779	71%	0.708	S	S	*	*			trans	-67.7	130.8	-179.4	27.2	-33.8	0	0	0	111.3	H1061	P1059-H1061 PolarHBondContact O-N 3.13Å; P1059-H1061 VanDerWaalsContact O-N 3.07Å
1060	I	39.1	Very low	48.2	Very low	178 Å²	178	142.6 Å²	142.6	91%	0.913	71%	0.714	S	S	*	*			trans	-78.9	88.3	173.2	-56.4	174.6	0	0	0	108	K1058	K1058-I1060 PolarHBondContact O-N 3.47Å
1061	H	38.9	Very low	46.3	Very low	156 Å²	156	144.3 Å²	144.3	72%	0.722	73%	0.727	S	S	*	*			trans	-149.8	65.8	175	-168.1	-72.1	0	0	0	112.4	P1059	P1059-H1061 PolarHBondContact O-N 3.13Å; P1059-H1061 VanDerWaalsContact O-N 3.07Å
1062	H	35.3	Very low	44.1	Very low	187 Å²	187	149.9 Å²	149.9	87%	0.866	75%	0.748	S	S	*	*			trans	-155.5	87	160.9	-84.5	-51.7	0	0	0	112.4
1063	Q	35.3	Very low	42.1	Very low	165 Å²	165	154.9 Å²	154.9	77%	0.771	77%	0.766	S	S	*	*			trans	-158.8	151.7	151.6	-134.6	165.2	0.1	0	0	109.9
1064	Y	33.4	Very low	40.3	Very low	187 Å²	187	159.1 Å²	159.1	73%	0.733	78%	0.784	S	S	*	*	S	Bend	trans	57.4	82	174.7	-59.6	-74.3	0	0	0	116.6
1065	H	35.5	Very low	38.9	Very low	175 Å²	175	155.5 Å²	155.5	81%	0.81	79%	0.785	S	S	*	*				-170.4	143.6	59.5	-92.5	83.5	0	0	0	111
1066	S	29.8	Very low	37.4	Very low	102 Å²	102	156.9 Å²	156.9	71%	0.713	79%	0.792	S	S	*	*			trans	-89.6	128.5	160.8	-177.4	0	0	0	0	109.3
1067	N	35.6	Very low	36.2	Very low	164 Å²	164	156.4 Å²	156.4	88%	0.877	79%	0.793	S	S	*	*			trans	-155.2	125.6	147.8	-114.3	-23.5	0	0	0	109.6
1068	N	32.1	Very low	35.3	Very low	127 Å²	127	154.5 Å²	154.5	68%	0.679	80%	0.797	S	S	*	*			trans	-71.7	143.8	179.4	-71.2	-51.2	0	0	0	110.6
1069	N	37	Very low	35	Very low	156 Å²	156	151.5 Å²	151.5	83%	0.834	80%	0.798	S	S	*	*				-158.8	148.8	104.2	-99.6	-38.1	0	0	0	113.3
1070	N	33.2	Very low	34.3	Very low	137 Å²	137	154.6 Å²	154.6	73%	0.733	81%	0.807	S	S	*	*			trans	-73.7	140.2	-173.2	-59.6	-78.2	0	0	0	111.6
1071	N	38.1	Very low	33.8	Very low	166 Å²	166	151.2 Å²	151.2	89%	0.888	80%	0.795	S	S	*	*				-152.9	127.8	128.4	-101	-33.5	0	0	0	110.7
1072	K	33.4	Very low	33.5	Very low	200 Å²	200	151.4 Å²	151.4	87%	0.87	80%	0.798	S	S	*	*			trans	-80.7	126.6	171.3	-68.6	175.3	178.5	174.6	0	108.7
1073	I	37.2	Very low	33.5	Very low	156 Å²	156	147.6 Å²	147.6	80%	0.8	79%	0.788	S	S	*	*			trans	-158.5	122.9	147.6	-97.7	140.8	0	0	0	106.4
1074	N	32.2	Very low	33.2	Very low	152 Å²	152	145.9 Å²	145.9	81%	0.813	79%	0.791	S	S	*	*			trans	-79.1	144.8	162.1	-72.5	-17.6	0	0	0	107.3
1075	P	39.2	Very low	33.3	Very low	114 Å²	114	143.3 Å²	143.3	74%	0.74	80%	0.795	S	S	*	*				-131.5	125.5	108.9	33.4	-24.8	0	0	0	113.2
1076	L	29.1	Very low	33	Very low	151 Å²	151	142.2 Å²	142.2	79%	0.791	79%	0.793	S	S	*	*			trans	-68.6	165.3	140	-75.2	163.1	0	0	0	108.4
1077	I	31	Very low	33.1	Very low	160 Å²	160	146.4 Å²	146.4	82%	0.821	80%	0.799	S	S	*	*			trans	90.6	136.6	177.5	-51.9	160.2	0	0	0	113.5
1078	S	30.5	Very low	32.8	Very low	121 Å²	121	143.2 Å²	143.2	85%	0.846	79%	0.789	S	S	*	*	S	Bend	trans	76.7	117.5	-166.8	-39.4	0	0	0	0	113
1079	S	36.7	Very low	32.8	Very low	108 Å²	108	142.1 Å²	142.1	76%	0.755	79%	0.787	S	S	*	*			cis	-137.4	97.3	7.5	43.3	0	0	0	0	112.8	T1081	S1079-T1081 PolarHBondContact O-N 3.27Å
1080	L	27.5	Very low	32.4	Very low	185 Å²	185	141.1 Å²	141.1	97%	0.969	79%	0.786	S	S	*	*			trans	-90.6	63	172.9	-99.2	171.1	0	0	0	111.7
1081	T	29.9	Very low	32	Very low	107 Å²	107	141.1 Å²	141.1	66%	0.656	79%	0.786	S	S	*	*			trans	-147.8	95.2	177.9	49.2	0	0	0	0	112.6	S1079	S1079-T1081 PolarHBondContact O-N 3.27Å
1082	M	31.3	Very low	31.7	Very low	159 Å²	159	138.5 Å²	138.5	78%	0.783	78%	0.776	S	S	*	*	S	Bend		179.8	124.8	125.4	-94.2	-52.2	106.7	0	0	112
1083	T	35.3	Very low	31.4	Very low	107 Å²	107	133.1 Å²	133.1	66%	0.656	76%	0.76	S	S	*	*			trans	42.1	104.3	157.8	51.6	0	0	0	0	120.8	T1085	T1083-T1085 PolarHBondContact O-N 3.09Å
1084	P	29.7	Very low	30.8	Very low	129 Å²	129	137.2 Å²	137.2	84%	0.838	77%	0.767	S	S	*	*			trans	-81.4	98.5	159.7	32.7	-30.7	0	0	0	110.9
1085	T	34.5	Very low	30.6	Very low	134 Å²	134	134.1 Å²	134.1	82%	0.822	75%	0.754	S	S	*	*			trans	-71.7	131.2	171.7	-52.8	0	0	0	0	110.5	T1083 K1087	T1083-T1085 PolarHBondContact O-N 3.09Å; T1085-K1087 PolarHBondContact O-N 3.38Å
1086	I	30.7	Very low	30.3	Very low	152 Å²	152	136 Å²	136	78%	0.779	76%	0.757	S	S	*	*			trans	-70.5	114.3	-166.3	-59	169.3	0	0	0	112.4
1087	K	30.2	Very low	30.3	Very low	190 Å²	190	136.9 Å²	136.9	83%	0.826	76%	0.757	S	S	*	*			trans	-134.1	85.5	142.6	-78.1	-163.4	175.2	-178.4	0	110.2	T1085 V1089	T1085-K1087 PolarHBondContact O-N 3.38Å; K1087-V1089 PolarHBondContact O-N 3.17Å
1088	S	30.3	Very low	30.4	Very low	96 Å²	96	135.4 Å²	135.4	67%	0.671	76%	0.756	S	S	*	*			trans	-50.5	121.7	157.1	-162.9	0	0	0	0	107.5
1089	V	31.3	Very low	30.4	Very low	104 Å²	104	137.2 Å²	137.2	63%	0.63	76%	0.756	S	S	*	*				59.9	92.4	65.9	-176.4	0	0	0	0	110.8	K1087 N1091	K1087-V1089 PolarHBondContact O-N 3.17Å; V1089-N1091 HydrophobicContact CG1-CB 3.97Å
1090	V	29.7	Very low	30	Very low	135 Å²	135	136.4 Å²	136.4	82%	0.818	74%	0.743	S	S	*	*			trans	-101.2	68.9	158.4	-172.9	0	0	0	0	107.6
1091	N	25.3	Very low	30.1	Very low	138 Å²	138	130.5 Å²	130.5	74%	0.738	72%	0.717	S	S	*	*			trans	-104.9	104.3	157.3	-95.5	-9.5	0	0	0	106.1	V1089	V1089-N1091 HydrophobicContact CG1-CB 3.97Å
1092	T	30.2	Very low	30.2	Very low	110 Å²	110	127.7 Å²	127.7	68%	0.675	70%	0.698	S	S	*	*			trans	-131.5	61.4	-176.8	-41.3	0	0	0	0	110.9	Y1094	T1092-Y1094 PolarHBondContact O-N 3.48Å
1093	T	28.5	Very low	30.1	Very low	87 Å²	87	126 Å²	126	53%	0.534	69%	0.687	S	S	.	*				22.4	102.6	118.4	-48.5	0	0	0	0	115.6	V1095	T1093-V1095 HydrophobicContact CG2-CB 3.68Å; T1093-V1095 HydrophobicContact CG2-CG2 3.76Å; T1093-V1095 PolarHBondContact O-N 3.1Å
1094	Y	24.8	Very low	29.8	Very low	242 Å²	242	124.9 Å²	124.9	95%	0.949	68%	0.677	S	S	*	*	S	Bend	trans	-84.5	63.5	166.2	-143.8	-82.7	0	0	0	110	T1092	T1092-Y1094 PolarHBondContact O-N 3.48Å
1095	V	27.9	Very low	29.9	Very low	87 Å²	87	126 Å²	126	53%	0.527	67%	0.668	S	S	.	*	S	Bend	trans	-137.9	117.2	176.4	-172.8	0	0	0	0	108.7	T1093 H1097	T1093-V1095 HydrophobicContact CG2-CB 3.68Å; T1093-V1095 HydrophobicContact CG2-CG2 3.76Å; T1093-V1095 PolarHBondContact O-N 3.1Å; V1095-H1097 PolarHBondContact O-N 3.36Å; V1095-H1097 PolarHBondContact O-ND1 2.76Å
1096	N	31.2	Very low	29.7	Very low	153 Å²	153	124.5 Å²	124.5	82%	0.818	65%	0.654	S	S	*	*			trans	20.2	94.6	158.3	-54	-14.9	0	0	0	115.6
1097	H	29	Very low	29.6	Very low	170 Å²	170	123.5 Å²	123.5	79%	0.787	65%	0.65	S	S	*	*			trans	-110.1	107.7	163	-80.8	11.3	0	0	0	109.5	V1095	V1095-H1097 PolarHBondContact O-N 3.36Å; V1095-H1097 PolarHBondContact O-ND1 2.76Å
1098	T	34.8	Very low	29.4	Very low	130 Å²	130	120.4 Å²	120.4	80%	0.798	64%	0.643	S	S	*	*			trans	-66.7	150.3	164.1	48.4	0	0	0	0	110.3
1099	D	28.7	Very low	29.3	Very low	159 Å²	159	121.5 Å²	121.5	85%	0.85	65%	0.646	S	S	*	*			trans	-154.8	169.3	136.9	-129.2	-35.5	0	0	0	113.6
1100	D	29.3	Very low	29.2	Very low	91 Å²	91	121.4 Å²	121.4	49%	0.487	65%	0.649	S	S	.	*			trans	77.1	104.1	161.1	-102.3	-47.6	0	0	0	122.6	F255	F255-D1100 HydrophobicContact CE1-CB 4.5Å; F255-D1100 WeakPolarHBondContact CZ-OD2 3.3Å
1101	S	29.9	Very low	29.1	Very low	60 Å²	60	126 Å²	126	42%	0.42	65%	0.652	S	S	.	*				76.6	128.5	127.9	-73.9	0	0	0	0	121.7
1102	L	32.2	Very low	29.3	Very low	49 Å²	49	125 Å²	125	26%	0.257	65%	0.651	S	S	.	*			cis	-174.6	175.9	10.5	-115.6	165.7	0	0	0	114.3	Q258 Q259 N260	Q258-L1102 HydrophobicContact CG-CB 3.26Å; Q258-L1102 HydrophobicContact CG-CD1 4.37Å; Q258-L1102 HydrophobicContact CG-CG 4.39Å; Q259-L1102 WeakPolarHBondContact CA-O 3.43Å; N260-L1102 PolarHBondContact N-O 3.04Å; N260-L1102 PolarHBondContact OD1-O 2.92Å
1103	K	29.6	Very low	29.2	Very low	124 Å²	124	125.2 Å²	125.2	54%	0.539	65%	0.652	S	S	.	*			trans	-46	171.7	176.6	-65	157.7	-158.5	159.3	0	117.1	Q258 Q259	Q258-K1103 WeakPolarHBondContact CG-O 3.36Å; Q258-K1103 PolarHBondContact OE1-O 3.48Å; Q259-K1103 WeakPolarHBondContact CB-O 3.42Å; Q259-K1103 VanDerWaalsContact CG-O 3.3Å; Q259-K1103 WeakPolarHBondContact CG-O 3.39Å
1104	N	28.8	Very low	29.4	Very low	83 Å²	83	129.6 Å²	129.6	44%	0.444	67%	0.666	S	S	.	*			cis	-166.5	121.2	-20	-103.5	-11.8	0	0	0	111.9	N260	N260-N1104 PolarHBondContact ND2-OD1 2.84Å
1105	K	32.1	Very low	29.7	Very low	153 Å²	153	123.9 Å²	123.9	67%	0.665	65%	0.651	S	S	*	*			trans	176	138.8	145.1	-96.6	151.7	-175.1	-178.6	0	110.7	S261	S261-K1105 WeakPolarHBondContact CB-O 3.31Å; S261-K1105 PolarHBondContact OG-O 2.91Å
1106	I	29.1	Very low	30	Very low	102 Å²	102	126.6 Å²	126.6	52%	0.523	66%	0.662	S	S	.	*			cis	91.5	135.4	30.9	-61.7	165.5	0	0	0	113.3
1107	N	28.2	Very low	30	Very low	131 Å²	131	125.2 Å²	125.2	70%	0.701	66%	0.655	S	S	*	*			trans	86.3	146.2	-177	-56.2	-28.5	0	0	0	116.4
1108	N	27.6	Very low	30.4	Very low	125 Å²	125	123 Å²	123	67%	0.668	65%	0.653	S	S	*	*			cis	-166.3	139	-25.1	-105.7	-15.9	0	0	0	112.2
1109	T	28.1	Very low	30.1	Very low	119 Å²	119	123.4 Å²	123.4	73%	0.73	65%	0.651	S	S	*	*			trans	45.5	151.5	144.1	61.2	0	0	0	0	124.3
1110	S	29	Very low	30.3	Very low	101 Å²	101	127.6 Å²	127.6	71%	0.706	66%	0.655	S	S	*	*			trans	92.3	118	163	-58.7	0	0	0	0	115.8
1111	R	26.9	Very low	30.4	Very low	233 Å²	233	127.4 Å²	127.4	88%	0.879	66%	0.661	S	S	*	*				70.9	133.6	76.7	-73.4	178	171.8	177.5	-3.4	112.1
1112	T	30.6	Very low	30.3	Very low	117 Å²	117	130.3 Å²	130.3	72%	0.718	67%	0.67	S	S	*	*			cis	-153.1	143.3	6.2	10	0	0	0	0	108.3
1113	V	27.6	Very low	30.2	Very low	113 Å²	113	137.7 Å²	137.7	69%	0.685	70%	0.696	S	S	*	*				50.4	107.7	88.9	-170.9	0	0	0	0	115.7	I1115	V1113-I1115 HydrophobicContact CG1-CD1 4.2Å
1114	E	31.7	Very low	30.1	Very low	179 Å²	179	135.2 Å²	135.2	84%	0.836	69%	0.694	S	S	*	*			trans	171.1	117.2	134.6	-95	172.6	-153.5	0	0	107.5
1115	I	30.9	Very low	29.9	Very low	123 Å²	123	139.6 Å²	139.6	63%	0.631	71%	0.712	S	S	*	*				95.3	116.3	52.6	-72.6	167.6	0	0	0	112.7	V1113	V1113-I1115 HydrophobicContact CG1-CD1 4.2Å
1116	N	34.9	Very low	29.9	Very low	143 Å²	143	140 Å²	140	77%	0.765	72%	0.72	S	S	*	*			trans	157.7	103.4	143.2	-85.3	-50.1	0	0	0	110
1117	N	30.5	Very low	30.1	Very low	125 Å²	125	139.7 Å²	139.7	67%	0.668	73%	0.725	S	S	*	*				70.4	114.6	78.9	-68.2	-34.3	0	0	0	113.4
1118	T	37	Very low	30.1	Very low	122 Å²	122	141.6 Å²	141.6	75%	0.748	73%	0.729	S	S	*	*				-171.5	133.7	77.5	28.3	0	0	0	0	115.7
1119	N	30.3	Very low	30.1	Very low	140 Å²	140	144.9 Å²	144.9	75%	0.749	74%	0.737	S	S	*	*			trans	51.9	102.3	131.4	-53.5	-18.6	0	0	0	123.4
1120	R	31.7	Very low	30.1	Very low	246 Å²	246	144.8 Å²	144.8	93%	0.928	74%	0.741	S	S	*	*				159	142.9	109.5	-88.9	-171.7	-179.4	-133.2	0.1	110.9
1121	S	31.4	Very low	30.1	Very low	88 Å²	88	146 Å²	146	62%	0.615	74%	0.74	S	S	*	*			cis	-156.1	128.2	-5.6	178.1	0	0	0	0	111.3
1122	I	28.2	Very low	30.3	Very low	120 Å²	120	138.4 Å²	138.4	62%	0.615	72%	0.717	S	S	*	*			trans	12.1	134.8	135.3	-9.9	167	0	0	0	116.3
1123	Y	29.9	Very low	30.3	Very low	205 Å²	205	135.3 Å²	135.3	80%	0.804	70%	0.696	S	S	*	*			cis	-137.5	142.6	29.2	-76.7	-107.2	0	0	0	110.8
1124	S	26.8	Very low	30.4	Very low	71 Å²	71	133.7 Å²	133.7	50%	0.497	68%	0.683	S	S	.	*			cis	102	128.8	21.8	76.4	0	0	0	0	114.9
1125	E	25.4	Very low	30.3	Very low	176 Å²	176	128.8 Å²	128.8	82%	0.822	67%	0.669	S	S	*	*			trans	58.7	125.4	148.5	-63.3	168.8	-163.6	0	0	120.4
1126	I	31.5	Very low	30.1	Very low	161 Å²	161	127.1 Å²	127.1	83%	0.826	67%	0.668	S	S	*	*				172.7	134.8	116.6	-87.6	155.7	0	0	0	109.7
1127	P	33.7	Very low	29.8	Very low	96 Å²	96	127.1 Å²	127.1	62%	0.623	67%	0.667	S	S	*	*			trans	-99.6	179.8	172.7	38	-32.6	0	0	0	113.2
1128	H	28.5	Very low	29.6	Very low	171 Å²	171	128.4 Å²	128.4	79%	0.792	67%	0.668	S	S	*	*			trans	112.3	123.8	160.5	-59.9	-62.6	0	0	0	118.4
1129	K	28.3	Very low	29	Very low	194 Å²	194	129.8 Å²	129.8	84%	0.843	67%	0.668	S	S	*	*			trans	13.9	120.8	138.6	-59.2	176.3	178.3	179.3	0	117.7
1130	S	27.9	Very low	28.9	Very low	117 Å²	117	128.4 Å²	128.4	82%	0.818	67%	0.665	S	S	*	*				-172.3	161.4	114.3	33.3	0	0	0	0	113.1
1131	N	27.8	Very low	28.6	Very low	125 Å²	125	123.6 Å²	123.6	67%	0.668	66%	0.658	S	S	*	*				-19.7	158.4	129.8	-70.3	15.3	0	0	0	113.9
1132	D	32.4	Very low	28.3	Very low	74 Å²	74	124 Å²	124	40%	0.396	66%	0.659	S	S	.	*			cis	-165.6	173.8	17.7	-106	-20.6	0	0	0	111.2	R281	R281-D1132 IonicContact CZ-OD1 3.28Å; R281-D1132 IonicContact CZ-OD2 2.66Å; R281-D1132 IonicContact NH1-OD1 3.06Å; R281-D1132 PolarHBondContact NH1-OD1 3.2Å; R281-D1132 IonicContact NH1-OD2 2.72Å; R281-D1132 PolarHBondContact NH1-OD2 3.12Å; R281-D1132 VanDerWaalsContact NH2-CB 3.27Å; R281-D1132 IonicContact NH2-OD2 3.68Å; R281-D1132 PolarHBondContact NH2-OD2 2.92Å
1133	N	29.5	Very low	28.3	Very low	52 Å²	52	124 Å²	124	28%	0.278	66%	0.659	S	S	.	*				175.8	-170.5	-58.2	-92.3	-29	0	0	0	112.9	S279 H280 R281	S279-N1133 WeakPolarHBondContact CA-OD1 3.37Å; S279-N1133 WeakPolarHBondContact CB-OD1 3.41Å; H280-N1133 VanDerWaalsContact CA-OD1 3.24Å; H280-N1133 WeakPolarHBondContact CA-OD1 3.35Å; H280-N1133 PolarHBondContact N-OD1 3.34Å; H280-N1133 WeakPolarHBondContact ND1-CA 3.39Å; H280-N1133 PolarHBondContact ND1-N 3.44Å; H280-N1133 PolarHBondContact ND1-O 2.99Å; R281-N1133 HydrophobicContact CB-CB 3.51Å; R281-N1133 WeakPolarHBondContact CD-O 3.41Å; R281-N1133 HydrophobicContact CG-CB 3.14Å; R281-N1133 PolarHBondContact NE-O 3.44Å
1134	N	29.4	Very low	28.2	Very low	79 Å²	79	121.2 Å²	121.2	42%	0.422	66%	0.658	S	S	.	*			trans	63.8	120.8	-166.8	-128.5	11.3	0	0	0	123.7	R281	R281-N1134 VanDerWaalsContact CA-N 3.32Å; R281-N1134 VanDerWaalsContact CB-CA 3.4Å; R281-N1134 HydrophobicContact CB-CB 3.48Å; R281-N1134 VanDerWaalsContact CB-CB 3.48Å; R281-N1134 VanDerWaalsContact CD-N 3.25Å; R281-N1134 HydrophobicContact CG-CB 4.02Å
1135	S	29.8	Very low	28.2	Very low	76 Å²	76	123.3 Å²	123.3	53%	0.531	66%	0.664	S	S	.	*			trans	68.8	177.8	149.2	75.1	0	0	0	0	115.4	H280	H280-S1135 PolarHBondContact O-N 3.19Å
1136	S	26.9	Very low	28.3	Very low	88 Å²	88	122.3 Å²	122.3	62%	0.615	66%	0.662	S	S	*	*			cis	-160.7	179.6	3.4	-145.9	0	0	0	0	110.9
1137	I	27.9	Very low	28.1	Very low	144 Å²	144	119 Å²	119	74%	0.738	65%	0.654	S	S	*	*			trans	45.3	108.2	142.2	-70.6	161.2	0	0	0	117.3
1138	H	26.6	Very low	27.8	Very low	152 Å²	152	119.7 Å²	119.7	70%	0.704	65%	0.652	S	S	*	*				80	129.6	71.2	-171.6	-70.7	0	0	0	114.3
1139	M	25.7	Very low	27.9	Very low	151 Å²	151	119.3 Å²	119.3	74%	0.744	65%	0.648	S	S	*	*			trans	67.3	135.5	-175.6	-73.9	179.8	-56	0	0	115.4
1140	T	27	Very low	27.9	Very low	111 Å²	111	115.7 Å²	115.7	68%	0.681	64%	0.638	S	S	*	*			cis	78.7	120.9	40.5	-55.5	0	0	0	0	112.2
1141	N	26.2	Very low	28	Very low	145 Å²	145	116.5 Å²	116.5	78%	0.775	63%	0.632	S	S	*	*			trans	65.4	155.3	173.3	-66.8	-7.5	0	0	0	113.6
1142	C	25.4	Very low	28.1	Very low	95 Å²	95	117.2 Å²	117.2	64%	0.642	64%	0.636	S	S	*	*			cis	-160.3	-179	-4	-127.9	0	0	0	0	109.7
1143	I	27.3	Very low	27.8	Very low	121 Å²	121	118.8 Å²	118.8	62%	0.621	65%	0.651	S	S	*	*			trans	52.3	106.7	144.5	-62.3	158.1	0	0	0	116.5	N1145	I1143-N1145 HydrophobicContact CG2-CB 4.43Å; I1143-N1145 WeakPolarHBondContact CG2-ND2 3.29Å
1144	D	27.3	Very low	27.9	Very low	147 Å²	147	119.3 Å²	119.3	79%	0.786	67%	0.669	S	S	*	*				-140.4	122.6	104.8	-93.2	-37.1	0	0	0	106.7
1145	N	26.9	Very low	28	Very low	114 Å²	114	121 Å²	121	61%	0.61	69%	0.687	S	S	*	*				92.4	150	55	-89.7	-32.2	0	0	0	112.7	I1143	I1143-N1145 HydrophobicContact CG2-CB 4.43Å; I1143-N1145 WeakPolarHBondContact CG2-ND2 3.29Å
1146	I	28.8	Very low	28.2	Very low	155 Å²	155	122.8 Å²	122.8	80%	0.795	70%	0.695	S	S	*	*			trans	62.9	89.1	166.3	-59.6	148.9	0	0	0	113.2
1147	S	27	Very low	28.4	Very low	92 Å²	92	125.4 Å²	125.4	64%	0.643	70%	0.702	S	S	*	*				82.6	146.3	60.5	-171.3	0	0	0	0	114.2
1148	N	26.9	Very low	28.9	Very low	110 Å²	110	122.8 Å²	122.8	59%	0.588	69%	0.694	S	S	*	*			trans	68.2	120	161.8	-76.7	-46.8	0	0	0	119.2
1149	K	30.1	Very low	29.1	Very low	163 Å²	163	122.3 Å²	122.3	71%	0.709	70%	0.696	S	S	*	*				72.2	146	125.2	-63.6	172	-175.6	154.2	0	116.5
1150	N	28.7	Very low	29.1	Very low	118 Å²	118	123.5 Å²	123.5	63%	0.631	69%	0.693	S	S	*	*			cis	-166.9	166.7	2.6	-117.8	1	0	0	0	109.2
1151	I	30.3	Very low	29.3	Very low	135 Å²	135	124.8 Å²	124.8	69%	0.692	69%	0.694	S	S	*	*			trans	42	125.9	130.3	-56.9	173.3	0	0	0	117.1
1152	D	29.6	Very low	29.5	Very low	140 Å²	140	125.1 Å²	125.1	75%	0.749	69%	0.691	S	S	*	*			cis	-157.5	-169.8	27.8	-140.7	-26	0	0	0	115.2
1153	C	26.9	Very low	29.9	Very low	106 Å²	106	125.9 Å²	125.9	72%	0.716	69%	0.689	S	S	*	*			trans	-27.8	157.6	159.1	66.4	0	0	0	0	117.7
1154	G	30.1	Very low	30	Very low	64 Å²	64	126 Å²	126	66%	0.66	69%	0.691	S	S	*	*			cis	123.2	178.1	9.7	0	0	0	0	0	111.6
1155	S	32.9	Very low	30	Very low	115 Å²	115	128.4 Å²	128.4	80%	0.804	69%	0.69	S	S	*	*			trans	68.3	145.5	-177	-141.4	0	0	0	0	113.5
1156	T	33.2	Very low	30.1	Very low	113 Å²	113	131.1 Å²	131.1	69%	0.693	70%	0.697	S	S	*	*			cis	-154.4	140.7	-12.7	7	0	0	0	0	104.6
1157	D	32.4	Very low	30	Very low	142 Å²	142	129.5 Å²	129.5	76%	0.759	69%	0.689	S	S	*	*				60.9	148.1	69	-129.9	31.3	0	0	0	112.7
1158	P	38.7	Very low	30	Very low	89 Å²	89	133.2 Å²	133.2	58%	0.578	70%	0.695	S	S	*	*			cis	-132.4	-145	-45.7	25.5	-3.5	0	0	0	111
1159	L	28.9	Very low	30	Very low	142 Å²	142	132.9 Å²	132.9	74%	0.743	70%	0.702	S	S	*	*			trans	84	148.1	151.3	-61.9	-162.1	0	0	0	119.2
1160	R	27.4	Very low	29.9	Very low	177 Å²	177	130.3 Å²	130.3	67%	0.668	70%	0.704	S	S	*	*			cis	-171.5	130.4	-10.1	160.8	171.1	176.9	135.5	2.4	113.9
1161	L	29.8	Very low	30.1	Very low	137 Å²	137	133.7 Å²	133.7	72%	0.717	71%	0.714	S	S	*	*			trans	49.3	176.6	147.5	-67.2	171.8	0	0	0	120.8
1162	Q	31.7	Very low	30.2	Very low	152 Å²	152	133.3 Å²	133.3	71%	0.71	72%	0.717	S	S	*	*			trans	93.2	122.4	154.6	-48.4	-163.3	-101.7	0	0	117.9
1163	D	32.2	Very low	30.3	Very low	112 Å²	112	132.3 Å²	132.3	60%	0.599	72%	0.718	S	S	*	*			cis	-158	160.8	-12.3	-103.9	-22.2	0	0	0	112.1
1164	D	31.4	Very low	30.6	Very low	122 Å²	122	134 Å²	134	65%	0.652	73%	0.725	S	S	*	*			trans	50.9	118.9	142.6	-71.4	-7.1	0	0	0	124.5
1165	Y	27.3	Very low	30.6	Very low	198 Å²	198	140.8 Å²	140.8	78%	0.776	74%	0.737	S	S	*	*				57.2	139.8	126	-74.5	-73.5	0	0	0	124
1166	K	28.5	Very low	30.6	Very low	171 Å²	171	138.5 Å²	138.5	74%	0.743	73%	0.731	S	S	*	*			trans	77.8	120.8	135.7	-83.3	177.5	167.6	-179.9	0	120.9
1167	I	26.3	Very low	30.6	Very low	122 Å²	122	138 Å²	138	63%	0.626	73%	0.732	S	S	*	*				86.3	132.9	123.2	-71.7	173.7	0	0	0	119.4
1168	Q	28	Very low	30.6	Very low	169 Å²	169	140.1 Å²	140.1	79%	0.79	74%	0.735	S	S	*	*			trans	65.4	117.1	156.9	-77.7	158.3	15.2	0	0	121.4
1169	S	26.9	Very low	30.2	Very low	103 Å²	103	142 Å²	142	72%	0.72	74%	0.739	S	S	*	*				66.9	107	119	-54.5	0	0	0	0	121
1170	S	27.8	Very low	30.3	Very low	109 Å²	109	141 Å²	141	76%	0.762	73%	0.734	S	S	*	*			trans	93	140.2	131.9	86	0	0	0	0	120.4
1171	K	31.3	Very low	30.4	Very low	190 Å²	190	137.6 Å²	137.6	83%	0.826	73%	0.729	S	S	*	*			trans	67.2	120.2	144.7	-80.2	178.8	176.4	177.6	0	121.2
1172	V	32.4	Very low	30.5	Very low	127 Å²	127	138.8 Å²	138.8	77%	0.77	73%	0.729	S	S	*	*			trans	86.2	126.6	143.7	178.6	0	0	0	0	117.8
1173	P	31.7	Very low	30.4	Very low	118 Å²	118	139 Å²	139	77%	0.766	73%	0.734	S	S	*	*			trans	-102.5	157.2	174.9	39.2	-33.6	0	0	0	113.6
1174	V	34.5	Very low	30.3	Very low	143 Å²	143	137.8 Å²	137.8	87%	0.867	73%	0.734	S	S	*	*			trans	-136.9	151.9	168.6	-177.5	0	0	0	0	110.3
1175	K	28.9	Very low	30.2	Very low	206 Å²	206	139.6 Å²	139.6	90%	0.896	74%	0.743	S	S	*	*			trans	-101.7	148.4	-179.1	-61.6	174	-179.9	174.4	0	112.2
1176	G	33.6	Very low	30.3	Very low	67 Å²	67	135 Å²	135	69%	0.691	74%	0.74	S	S	*	*			trans	-177.7	98.7	161.1	0	0	0	0	0	108.6
1177	S	32.2	Very low	30.3	Very low	101 Å²	101	131.3 Å²	131.3	71%	0.706	74%	0.736	S	S	*	*			cis	79.1	129.6	49.4	89	0	0	0	0	113.3
1178	K	33.7	Very low	30.5	Very low	188 Å²	188	130.9 Å²	130.9	82%	0.817	74%	0.739	S	S	*	*			trans	72.1	151.1	170.1	-57.1	-177.4	173.8	-177.1	0	114.5
1179	L	30.7	Very low	30.6	Very low	129 Å²	129	133.8 Å²	133.8	68%	0.675	74%	0.743	S	S	*	*			cis	-158.9	146.8	-15.6	-114	170	0	0	0	109
1180	N	29.5	Very low	30.6	Very low	120 Å²	120	139 Å²	139	64%	0.642	75%	0.748	S	S	*	*			trans	69.2	146.2	139.8	-94.2	27.9	0	0	0	124.8
1181	D	31	Very low	30.7	Very low	106 Å²	106	137.8 Å²	137.8	57%	0.567	74%	0.74	S	S	*	*				96.9	118.6	126.3	-73.8	-12.5	0	0	0	124.2
1182	F	30.2	Very low	30.7	Very low	162 Å²	162	133.6 Å²	133.6	71%	0.711	73%	0.731	S	S	*	*			trans	75.2	114	136.5	-68.7	-46.2	0	0	0	121.8
1183	L	31.4	Very low	30.9	Very low	155 Å²	155	133.1 Å²	133.1	81%	0.812	73%	0.728	S	S	*	*			trans	71.5	146.3	135.1	-58.2	170.7	0	0	0	116.9
1184	S	29.3	Very low	31	Very low	87 Å²	87	135 Å²	135	61%	0.608	73%	0.732	S	S	*	*			cis	-163	170.8	-17.1	51.2	0	0	0	0	108.9
1185	L	28.6	Very low	30.9	Very low	160 Å²	160	135.2 Å²	135.2	84%	0.838	73%	0.727	S	S	*	*			trans	26.4	119.3	144.8	-60.9	167.1	0	0	0	117.1
1186	S	30.3	Very low	31.2	Very low	101 Å²	101	132.5 Å²	132.5	71%	0.706	72%	0.722	S	S	*	*			cis	179.6	170.8	28.1	51.1	0	0	0	0	113.4
1187	S	28.3	Very low	31.2	Very low	95 Å²	95	134.3 Å²	134.3	66%	0.664	72%	0.719	S	S	*	*			trans	51.8	112.7	144.6	-62.6	0	0	0	0	122.5
1188	T	29.5	Very low	31.3	Very low	112 Å²	112	138.3 Å²	138.3	69%	0.687	72%	0.724	S	S	*	*			trans	68.1	146.2	133.7	61.8	0	0	0	0	119.6
1189	R	30.2	Very low	31.4	Very low	230 Å²	230	137.7 Å²	137.7	87%	0.868	72%	0.721	S	S	*	*			cis	-159.7	170.7	-4.1	-117	174.3	-123.4	-173.9	2.3	109.3
1190	Y	26.8	Very low	31.5	Very low	212 Å²	212	137 Å²	137	83%	0.831	72%	0.718	S	S	*	*			trans	-59.2	165.8	168	-59.2	-90.1	0	0	0	112.2
1191	S	30.7	Very low	31.8	Very low	84 Å²	84	137.2 Å²	137.2	59%	0.587	72%	0.719	S	S	*	*			cis	-150.8	-172.9	31.5	-159.9	0	0	0	0	113.8	E1218	S1191-E1218 PolarHBondContact OG-OE1 3.21Å
1192	T	30.7	Very low	32.2	Very low	103 Å²	103	139 Å²	139	63%	0.632	73%	0.729	S	S	*	*			trans	-123.4	154.8	-169.5	53.1	0	0	0	0	114
1193	T	36.3	Very low	32.5	Very low	116 Å²	116	136.3 Å²	136.3	71%	0.712	72%	0.721	S	S	*	*			trans	-165.2	146.3	150.1	17.6	0	0	0	0	112.8
1194	D	34.3	Very low	32.6	Very low	159 Å²	159	136.6 Å²	136.6	85%	0.85	71%	0.712	S	S	*	*			trans	-117.6	161.6	176.2	-77.6	-58.3	0	0	0	112
1195	L	33.6	Very low	32.8	Very low	147 Å²	147	141.6 Å²	141.6	77%	0.77	72%	0.719	S	S	*	*			trans	-147.9	126.4	172.8	-78.3	178.2	0	0	0	114.6
1196	L	34.6	Very low	33	Very low	149 Å²	149	140.2 Å²	140.2	78%	0.78	71%	0.712	S	S	*	*			trans	68	149.9	141.8	-59.4	169.7	0	0	0	120.5
1197	V	34.3	Very low	33.3	Very low	104 Å²	104	140 Å²	140	63%	0.63	71%	0.707	S	S	*	*			cis	-169.4	152.1	-27.6	85.7	0	0	0	0	112
1198	K	33.6	Very low	33.5	Very low	186 Å²	186	144 Å²	144	81%	0.809	72%	0.715	S	S	*	*			trans	69	159.1	164.1	-72.4	168.2	-170.5	170	0	116.9
1199	K	35.1	Very low	33.6	Very low	174 Å²	174	146.1 Å²	146.1	76%	0.757	72%	0.716	S	S	*	*			cis	-160.7	165.4	13.6	-141.9	-172.4	167.7	-163.1	0	113.9
1200	N	33.9	Very low	33.6	Very low	114 Å²	114	141.5 Å²	141.5	61%	0.61	71%	0.709	S	S	*	*			trans	86.5	140.3	145.9	-91.1	37.2	0	0	0	124
1201	N	36.1	Very low	34	Very low	125 Å²	125	135.9 Å²	135.9	67%	0.668	70%	0.698	S	S	*	*			trans	69.4	110.7	163.7	-54.3	14.2	0	0	0	116.3
1202	D	37.9	Very low	34	Very low	144 Å²	144	140.7 Å²	140.7	77%	0.77	71%	0.709	S	S	*	*				70.2	130.1	50.6	-50	-38.8	0	0	0	111.9
1203	D	37.2	Very low	33.9	Very low	105 Å²	105	143.3 Å²	143.3	56%	0.561	71%	0.708	S	S	*	*			cis	-163.3	174.5	1.5	-140.7	-10.8	0	0	0	107.1
1204	R	32.8	Very low	33.7	Very low	162 Å²	162	144.3 Å²	144.3	61%	0.611	71%	0.705	S	S	*	*			cis	-164.7	157.6	-3.8	-155.1	-179.4	-67.4	144.8	8.4	105.4
1205	Y	33.2	Very low	33.5	Very low	191 Å²	191	144.8 Å²	144.8	75%	0.749	70%	0.702	S	S	*	*			cis	-119.3	168.7	-3	-64.5	-106.5	0	0	0	108.1
1206	N	34.2	Very low	33.4	Very low	131 Å²	131	143 Å²	143	70%	0.701	69%	0.692	S	S	*	*			cis	85.1	133.6	18.7	-73.3	-15.2	0	0	0	118.4
1207	V	35.4	Very low	33.2	Very low	98 Å²	98	142.8 Å²	142.8	59%	0.594	69%	0.686	S	S	*	*			cis	-162.4	144.6	-25.2	94.1	0	0	0	0	107.7
1208	H	33.3	Very low	32.9	Very low	179 Å²	179	144.8 Å²	144.8	83%	0.829	69%	0.689	S	S	*	*				-154.5	106	88.8	-112.9	-58.3	0	0	0	113
1209	H	31.8	Very low	32.9	Very low	155 Å²	155	143.8 Å²	143.8	72%	0.718	69%	0.685	S	S	*	*			trans	-66.1	155.7	145.2	-79.9	-22.4	0	0	0	110.3
1210	N	30.7	Very low	32.5	Very low	133 Å²	133	143.5 Å²	143.5	71%	0.711	69%	0.686	S	S	*	*				-156.4	92	116.6	-148.8	-1.2	0	0	0	114.1	F1212	N1210-F1212 WeakPolarHBondContact OD1-CD2 3.45Å; N1210-F1212 WeakPolarHBondContact OD1-CE2 3.46Å
1211	P	34.1	Very low	32.3	Very low	95 Å²	95	149.5 Å²	149.5	62%	0.617	70%	0.7	S	S	*	*			trans	-89.9	134.5	156.6	34.2	-26.7	0	0	0	110
1212	F	30.7	Very low	31.9	Very low	185 Å²	185	148 Å²	148	81%	0.811	70%	0.696	S	S	*	*			trans	-123.3	124.3	163.5	-102	-81.9	0	0	0	112.3	N1210	N1210-F1212 WeakPolarHBondContact OD1-CD2 3.45Å; N1210-F1212 WeakPolarHBondContact OD1-CE2 3.46Å
1213	Y	29.6	Very low	31.6	Very low	157 Å²	157	150.4 Å²	150.4	62%	0.616	70%	0.696	S	S	*	*			trans	-118.3	152	174	-133	-114.4	0	0	0	106.7	Q1030	Q1030-Y1213 PolarHBondContact NE2-OH 3.23Å
1214	H	30.9	Very low	31.3	Very low	138 Å²	138	151.4 Å²	151.4	64%	0.639	70%	0.7	S	S	*	*			trans	37.1	112.9	158.4	-79.4	-123.5	0	0	0	120
1215	H	31.2	Very low	31.2	Very low	169 Å²	169	148.9 Å²	148.9	78%	0.782	71%	0.705	S	S	*	*				-159.7	133	110.5	-90.6	-71.9	0	0	0	106.1
1216	I	30.9	Very low	31.9	Very low	109 Å²	109	146 Å²	146	56%	0.559	71%	0.71	S	S	*	*				58.5	96.3	70.8	-55.7	179.7	0	0	0	111.9
1217	E	30.4	Very low	31.8	Very low	144 Å²	144	147.5 Å²	147.5	67%	0.673	71%	0.712	S	S	*	*				-158.2	141.6	128.5	-133.7	-175.5	-124.5	0	0	110.1	K1219	E1217-K1219 IonicContact OE2-NZ 3.42Å; E1217-K1219 PolarHBondContact OE2-NZ 3.22Å
1218	E	27.4	Very low	31.7	Very low	147 Å²	147	150.2 Å²	150.2	69%	0.687	72%	0.722	S	S	*	*			trans	-90.6	107.1	-176.8	-64	178.9	158.2	0	0	111	S1191	S1191-E1218 PolarHBondContact OG-OE1 3.21Å
1219	K	33.4	Very low	31.5	Very low	164 Å²	164	148.8 Å²	148.8	71%	0.713	72%	0.716	S	S	*	*			trans	-135	133.7	163.3	-70.1	-169.3	174.9	101.1	0	112.2	E1217	E1217-K1219 IonicContact OE2-NZ 3.42Å; E1217-K1219 PolarHBondContact OE2-NZ 3.22Å
1220	Q	27.2	Very low	31.6	Very low	169 Å²	169	147.6 Å²	147.6	79%	0.79	71%	0.714	S	S	*	*			trans	-73.6	140.9	-171.3	-63.4	164.5	-12.8	0	0	111.5
1221	W	30.4	Very low	31.7	Very low	239 Å²	239	149.4 Å²	149.4	91%	0.905	72%	0.718	S	S	*	*			trans	-124.3	58	160.2	-79.5	100.9	0	0	0	111
1222	T	26.4	Very low	31.5	Very low	95 Å²	95	149.6 Å²	149.6	58%	0.583	72%	0.722	S	S	*	*			trans	-66.3	168.2	133.6	39.5	0	0	0	0	109.4
1223	Y	31.8	Very low	31.6	Very low	194 Å²	194	148.8 Å²	148.8	76%	0.761	72%	0.72	S	S	*	*			trans	95.3	126.6	-170.7	-77.4	-98.6	0	0	0	114.5
1224	L	30.7	Very low	31.9	Very low	126 Å²	126	148.1 Å²	148.1	66%	0.66	73%	0.727	S	S	*	*			cis	173.2	131.4	-21.1	-133.1	72.5	0	0	0	101.7
1225	P	31.8	Very low	32.1	Very low	108 Å²	108	148.9 Å²	148.9	70%	0.701	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-69.8	149.5	163.4	31	-32.6	0	0	0	109.5	H1227	P1225-H1227 PolarHBondContact O-N 3.18Å
1226	P	48.1	Very low	32.6	Very low	132 Å²	132	147.7 Å²	147.7	86%	0.857	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-61.9	128.7	173.8	-23.4	34.5	0	0	0	112.1
1227	H	31.3	Very low	33	Very low	161 Å²	161	148.2 Å²	148.2	75%	0.745	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-68.5	149.1	166.5	-115.3	-112.8	0	0	0	111	P1225	P1225-H1227 PolarHBondContact O-N 3.18Å
1228	L	33.8	Very low	33.4	Very low	155 Å²	155	147.1 Å²	147.1	81%	0.812	73%	0.733	S	S	*	*			trans	160.8	91	139.5	-86.9	163	0	0	0	108
1229	Q	29.6	Very low	34.1	Very low	150 Å²	150	143.8 Å²	143.8	70%	0.701	73%	0.726	S	S	*	*				93	143.2	65.2	-161.3	-174.2	-39.7	0	0	113
1230	I	32.8	Very low	34.8	Very low	129 Å²	129	140.3 Å²	140.3	66%	0.662	72%	0.719	S	S	*	*			trans	92.2	108.3	167.1	-51.5	-174.5	0	0	0	118.6
1231	Q	32.3	Very low	36.1	Very low	172 Å²	172	136.6 Å²	136.6	80%	0.804	70%	0.704	S	S	*	*			trans	63.5	92.8	146.1	-67.1	166.6	-9.9	0	0	122.4
1232	S	30.9	Very low	37.1	Very low	99 Å²	99	131.4 Å²	131.4	69%	0.692	69%	0.689	S	S	*	*				31.9	114.4	116.5	63.1	0	0	0	0	120.4
1233	Q	32.5	Very low	38.3	Very low	168 Å²	168	133.5 Å²	133.5	79%	0.785	69%	0.693	S	S	*	*				179.9	158.1	98.4	-96.4	-175	12.1	0	0	112.6
1234	N	36.4	Very low	40	Very low	143 Å²	143	128.9 Å²	128.9	77%	0.765	68%	0.678	S	S	*	*			trans	69.8	121.6	160.5	-56.7	-29	0	0	0	120
1235	N	34	Very low	42.1	Very low	154 Å²	154	126 Å²	126	82%	0.824	67%	0.666	S	S	*	*			trans	-68.2	142.4	172.6	-45.7	-71.3	0	0	0	112.2
1236	L	42.2	Very low	43.3	Very low	143 Å²	143	124.2 Å²	124.2	75%	0.749	66%	0.655	S	S	*	*				-170.2	126.3	123.8	-125.6	67.3	0	0	0	112.5	Q1238	L1236-Q1238 PolarHBondContact O-N 2.87Å
1237	D	39	Very low	44.4	Very low	120 Å²	120	122.2 Å²	122.2	64%	0.642	64%	0.637	S	S	*	*			trans	37.4	54.9	155.5	-61	-13	0	0	0	120.4	S1239	D1237-S1239 VanDerWaalsContact C-N 3.27Å; D1237-S1239 PolarHBondContact O-N 3.32Å
1238	Q	39.8	Very low	46.3	Very low	121 Å²	121	117.8 Å²	117.8	57%	0.565	62%	0.618	S	S	*	*	H	α-helix	trans	-58.2	-31.7	175.2	-146.1	76.2	21.4	0	0	114.5	L1236 T1240 I1241 E1242	L1236-Q1238 PolarHBondContact O-N 2.87Å; Q1238-T1240 PolarHBondContact O-N 2.91Å; Q1238-I1241 CarbonylContact O-C 3.48Å; Q1238-I1241 PolarHBondContact O-N 3.23Å; Q1238-I1241 VanDerWaalsContact O-N 3.11Å; Q1238-E1242 HydrophobicContact CG-CG 4.41Å; Q1238-E1242 PolarHBondContact O-N 2.86Å
1239	S	41	Very low	48	Very low	77 Å²	77	114.6 Å²	114.6	54%	0.538	60%	0.602	S	S	.	*	H	α-helix	trans	-67.9	-34.3	-169.9	61.1	0	0	0	0	113.9	D1237 Q1243	D1237-S1239 VanDerWaalsContact C-N 3.27Å; D1237-S1239 PolarHBondContact O-N 3.32Å; S1239-Q1243 WeakPolarHBondContact O-CG 3.48Å; S1239-Q1243 PolarHBondContact O-N 2.97Å
1240	T	49.3	Very low	50.1	Low	92 Å²	92	111.8 Å²	111.8	56%	0.564	59%	0.591	S	S	*	*	H	α-helix	trans	-72	-36.2	173	-43.9	0	0	0	0	110.6	Q1238 Q1244	Q1238-T1240 PolarHBondContact O-N 2.91Å; T1240-Q1244 VanDerWaalsContact O-CB 3.3Å; T1240-Q1244 WeakPolarHBondContact O-CB 3.13Å; T1240-Q1244 PolarHBondContact O-N 3.14Å
1241	I	54.5	Low	51.8	Low	90 Å²	90	110.7 Å²	110.7	46%	0.462	58%	0.583	S	S	.	*	H	α-helix	trans	-70.1	-38.9	178.8	-62.6	174.8	0	0	0	111.2	Q1238 Q1244 T1245	Q1238-I1241 CarbonylContact O-C 3.48Å; Q1238-I1241 PolarHBondContact O-N 3.23Å; Q1238-I1241 VanDerWaalsContact O-N 3.11Å; I1241-Q1244 PolarHBondContact O-N 3.43Å; I1241-T1245 WeakPolarHBondContact O-CB 3.17Å; I1241-T1245 PolarHBondContact O-N 3.31Å; I1241-T1245 PolarHBondContact O-OG1 3.14Å
1242	E	51.6	Low	53.4	Low	130 Å²	130	106.5 Å²	106.5	61%	0.607	57%	0.567	S	S	*	*	H	α-helix	trans	-67.3	-40.2	175.1	-74.5	-178.2	176.9	0	0	112.2	Q1238 T1245 C1246	Q1238-E1242 HydrophobicContact CG-CG 4.41Å; Q1238-E1242 PolarHBondContact O-N 2.86Å; E1242-T1245 PolarHBondContact O-N 3.26Å; E1242-C1246 VanDerWaalsContact O-CB 3.29Å; E1242-C1246 WeakPolarHBondContact O-CB 3.47Å; E1242-C1246 PolarHBondContact O-N 3.25Å
1243	Q	50.2	Low	55.2	Low	140 Å²	140	107.2 Å²	107.2	65%	0.654	56%	0.561	S	S	*	*	H	α-helix	trans	-66.5	-42.5	173.7	-71.1	-174.7	15.8	0	0	111.9	S1239 C1246 L1247	S1239-Q1243 WeakPolarHBondContact O-CG 3.48Å; S1239-Q1243 PolarHBondContact O-N 2.97Å; Q1243-C1246 PolarHBondContact O-N 2.88Å; Q1243-L1247 WeakPolarHBondContact O-CB 3.45Å; Q1243-L1247 WeakPolarHBondContact O-CG 3.41Å; Q1243-L1247 PolarHBondContact O-N 3.31Å
1244	Q	68.7	Low	56.5	Low	96 Å²	96	102.9 Å²	102.9	45%	0.449	55%	0.546	S	S	.	.	H	α-helix	trans	-68.8	-33.1	176	-167.6	61.8	51.7	0	0	112.3	T1240 I1241 L1247 N1248	T1240-Q1244 VanDerWaalsContact O-CB 3.3Å; T1240-Q1244 WeakPolarHBondContact O-CB 3.13Å; T1240-Q1244 PolarHBondContact O-N 3.14Å; I1241-Q1244 PolarHBondContact O-N 3.43Å; Q1244-L1247 PolarHBondContact O-N 3.37Å; Q1244-N1248 PolarHBondContact NE2-OD1 2.88Å; Q1244-N1248 VanDerWaalsContact O-CB 3.23Å; Q1244-N1248 WeakPolarHBondContact O-CB 3.42Å; Q1244-N1248 PolarHBondContact O-N 3.29Å; Q1244-N1248 PolarHBondContact O-OD1 3.45Å
1245	T	74.1	Confident	57.9	Low	66 Å²	66	103 Å²	103	41%	0.405	54%	0.54	S	S	.	.	H	α-helix	trans	-71.8	-37.4	174.8	-57.5	0	0	0	0	110.9	I1241 E1242 N1248 N1249	I1241-T1245 WeakPolarHBondContact O-CB 3.17Å; I1241-T1245 PolarHBondContact O-N 3.31Å; I1241-T1245 PolarHBondContact O-OG1 3.14Å; E1242-T1245 PolarHBondContact O-N 3.26Å; T1245-N1248 PolarHBondContact O-N 3.45Å; T1245-N1249 VanDerWaalsContact O-CB 3.25Å; T1245-N1249 WeakPolarHBondContact O-CB 3.43Å; T1245-N1249 VanDerWaalsContact O-CG 3.24Å; T1245-N1249 PolarHBondContact O-N 3.29Å; T1245-N1249 PolarHBondContact O-ND2 3.05Å
1246	C	57.6	Low	58.9	Low	71 Å²	71	102.2 Å²	102.2	48%	0.48	54%	0.536	S	S	.	.	H	α-helix	trans	-62.7	-46.1	170.9	-169.4	0	0	0	0	111.3	E1242 Q1243 N1249 I1250	E1242-C1246 VanDerWaalsContact O-CB 3.29Å; E1242-C1246 WeakPolarHBondContact O-CB 3.47Å; E1242-C1246 PolarHBondContact O-N 3.25Å; Q1243-C1246 PolarHBondContact O-N 2.88Å; C1246-N1249 PolarHBondContact O-N 3.02Å; C1246-I1250 WeakPolarHBondContact O-CB 3.46Å; C1246-I1250 VanDerWaalsContact O-CG1 3.27Å; C1246-I1250 WeakPolarHBondContact O-CG1 3.48Å; C1246-I1250 PolarHBondContact O-N 3.38Å
1247	L	71.3	Confident	59	Low	90 Å²	90	103.3 Å²	103.3	47%	0.471	54%	0.535	S	S	.	.	H	α-helix	trans	-62.4	-43.9	174.5	-79.6	165.3	0	0	0	112.7	Q1243 Q1244 I1250 Q1251	Q1243-L1247 WeakPolarHBondContact O-CB 3.45Å; Q1243-L1247 WeakPolarHBondContact O-CG 3.41Å; Q1243-L1247 PolarHBondContact O-N 3.31Å; Q1244-L1247 PolarHBondContact O-N 3.37Å; L1247-I1250 PolarHBondContact O-N 3.5Å; L1247-Q1251 WeakPolarHBondContact O-CB 3.49Å; L1247-Q1251 WeakPolarHBondContact O-CG 3.36Å; L1247-Q1251 PolarHBondContact O-N 3.34Å
1248	N	70.3	Confident	59.5	Low	67 Å²	67	105.7 Å²	105.7	36%	0.358	55%	0.553	S	S	.	*	H	α-helix	trans	-67.1	-37.3	177.8	-71.8	-0.4	0	0	0	111.5	Q1244 T1245 Q1251 N1252	Q1244-N1248 PolarHBondContact NE2-OD1 2.88Å; Q1244-N1248 VanDerWaalsContact O-CB 3.23Å; Q1244-N1248 WeakPolarHBondContact O-CB 3.42Å; Q1244-N1248 PolarHBondContact O-N 3.29Å; Q1244-N1248 PolarHBondContact O-OD1 3.45Å; T1245-N1248 PolarHBondContact O-N 3.45Å; N1248-Q1251 PolarHBondContact O-N 3.4Å; N1248-N1252 WeakPolarHBondContact O-CB 3.35Å; N1248-N1252 VanDerWaalsContact O-CG 3.31Å; N1248-N1252 PolarHBondContact O-N 3.36Å
1249	N	70.6	Confident	60.4	Low	88 Å²	88	104.9 Å²	104.9	47%	0.471	55%	0.553	S	S	.	*	H	α-helix	trans	-68.2	-40.1	173.6	-75.9	-19	0	0	0	111.6	T1245 C1246 N1252 I1253	T1245-N1249 VanDerWaalsContact O-CB 3.25Å; T1245-N1249 WeakPolarHBondContact O-CB 3.43Å; T1245-N1249 VanDerWaalsContact O-CG 3.24Å; T1245-N1249 PolarHBondContact O-N 3.29Å; T1245-N1249 PolarHBondContact O-ND2 3.05Å; C1246-N1249 PolarHBondContact O-N 3.02Å; N1249-N1252 PolarHBondContact O-N 3.34Å; N1249-I1253 WeakPolarHBondContact O-CB 3.41Å; N1249-I1253 WeakPolarHBondContact O-CD1 3.35Å; N1249-I1253 WeakPolarHBondContact O-CG1 3.34Å; N1249-I1253 PolarHBondContact O-N 3.21Å
1250	I	73.4	Confident	61.5	Low	92 Å²	92	106.4 Å²	106.4	47%	0.472	55%	0.553	S	S	.	*	H	α-helix	trans	-63.5	-41.6	172.3	-70.7	165.7	0	0	0	110.6	C1246 L1247 T1254	C1246-I1250 WeakPolarHBondContact O-CB 3.46Å; C1246-I1250 VanDerWaalsContact O-CG1 3.27Å; C1246-I1250 WeakPolarHBondContact O-CG1 3.48Å; C1246-I1250 PolarHBondContact O-N 3.38Å; L1247-I1250 PolarHBondContact O-N 3.5Å; I1250-T1254 WeakPolarHBondContact O-CB 3.09Å; I1250-T1254 PolarHBondContact O-N 3.44Å; I1250-T1254 PolarHBondContact O-OG1 3.38Å
1251	Q	67.7	Low	62.1	Low	105 Å²	105	107.2 Å²	107.2	49%	0.491	55%	0.553	S	S	.	*	H	α-helix	trans	-67.3	-38.3	176.1	-76.4	-174	1.9	0	0	112.8	L1247 N1248 T1254 K1255	L1247-Q1251 WeakPolarHBondContact O-CB 3.49Å; L1247-Q1251 WeakPolarHBondContact O-CG 3.36Å; L1247-Q1251 PolarHBondContact O-N 3.34Å; N1248-Q1251 PolarHBondContact O-N 3.4Å; Q1251-T1254 CarbonylContact O-C 3.6Å; Q1251-T1254 PolarHBondContact O-N 3.28Å; Q1251-K1255 WeakPolarHBondContact O-CB 3.47Å; Q1251-K1255 WeakPolarHBondContact O-CG 3.45Å; Q1251-K1255 PolarHBondContact O-N 2.77Å
1252	N	66	Low	62.6	Low	85 Å²	85	108.2 Å²	108.2	46%	0.455	56%	0.558	S	S	.	*	H	α-helix	trans	-72.9	-36.4	176.1	-75.7	-13	0	0	0	112.2	N1248 N1249 T1254 K1255 N1256	N1248-N1252 WeakPolarHBondContact O-CB 3.35Å; N1248-N1252 VanDerWaalsContact O-CG 3.31Å; N1248-N1252 PolarHBondContact O-N 3.36Å; N1249-N1252 PolarHBondContact O-N 3.34Å; N1252-T1254 VanDerWaalsContact C-N 3.28Å; N1252-T1254 PolarHBondContact O-N 3.2Å; N1252-K1255 PolarHBondContact O-N 3.31Å; N1252-N1256 WeakPolarHBondContact O-CB 3.35Å; N1252-N1256 VanDerWaalsContact O-CG 3.31Å; N1252-N1256 PolarHBondContact O-N 3.5Å; N1252-N1256 PolarHBondContact O-ND2 3.1Å
1253	I	68.3	Low	63.3	Low	113 Å²	113	106.8 Å²	106.8	58%	0.579	56%	0.555	S	S	*	*	H	α-helix	trans	-61.9	-40.5	169	-71.2	165.4	0	0	0	109.9	N1249 N1256 F1257	N1249-I1253 WeakPolarHBondContact O-CB 3.41Å; N1249-I1253 WeakPolarHBondContact O-CD1 3.35Å; N1249-I1253 WeakPolarHBondContact O-CG1 3.34Å; N1249-I1253 PolarHBondContact O-N 3.21Å; I1253-N1256 PolarHBondContact O-N 3.48Å; I1253-F1257 PolarHBondContact O-N 3.41Å
1254	T	61.4	Low	64.1	Low	77 Å²	77	104.6 Å²	104.6	47%	0.472	55%	0.549	S	S	.	.	H	α-helix	trans	-68.7	-39	176.7	-52.9	0	0	0	0	112.2	I1250 Q1251 N1252 N1256 F1257 V1258	I1250-T1254 WeakPolarHBondContact O-CB 3.09Å; I1250-T1254 PolarHBondContact O-N 3.44Å; I1250-T1254 PolarHBondContact O-OG1 3.38Å; Q1251-T1254 CarbonylContact O-C 3.6Å; Q1251-T1254 PolarHBondContact O-N 3.28Å; N1252-T1254 VanDerWaalsContact C-N 3.28Å; N1252-T1254 PolarHBondContact O-N 3.2Å; T1254-N1256 VanDerWaalsContact C-N 3.28Å; T1254-N1256 PolarHBondContact O-N 3.17Å; T1254-F1257 PolarHBondContact O-N 2.85Å; T1254-V1258 WeakPolarHBondContact O-CG2 3.45Å; T1254-V1258 PolarHBondContact O-N 3.49Å
1255	K	64.8	Low	63.8	Low	146 Å²	146	105.2 Å²	105.2	64%	0.635	56%	0.556	S	S	*	*	H	α-helix	trans	-75.6	-8.6	176.2	-78.8	-177.5	173.6	-178.5	0	114.9	Q1251 N1252	Q1251-K1255 WeakPolarHBondContact O-CB 3.47Å; Q1251-K1255 WeakPolarHBondContact O-CG 3.45Å; Q1251-K1255 PolarHBondContact O-N 2.77Å; N1252-K1255 PolarHBondContact O-N 3.31Å
1256	N	55.9	Low	63	Low	137 Å²	137	108.2 Å²	108.2	73%	0.733	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	9	170.2	-66.6	-19.8	0	0	0	111.7	N1252 I1253 T1254	N1252-N1256 WeakPolarHBondContact O-CB 3.35Å; N1252-N1256 VanDerWaalsContact O-CG 3.31Å; N1252-N1256 PolarHBondContact O-N 3.5Å; N1252-N1256 PolarHBondContact O-ND2 3.1Å; I1253-N1256 PolarHBondContact O-N 3.48Å; T1254-N1256 VanDerWaalsContact C-N 3.28Å; T1254-N1256 PolarHBondContact O-N 3.17Å
1257	F	42.9	Very low	63.5	Low	166 Å²	166	111.3 Å²	111.3	73%	0.728	58%	0.575	S	S	*	*			trans	-121	2	171.4	-116.2	-84.7	0	0	0	112.7	I1253 T1254	I1253-F1257 PolarHBondContact O-N 3.41Å; T1254-F1257 PolarHBondContact O-N 2.85Å
1258	V	49.2	Very low	62.8	Low	170 Å²	170	113.3 Å²	113.3	100%	1.03	58%	0.584	S	S	*	*			trans	-115.9	0	167.7	173.5	0	0	0	0	106.6	T1254	T1254-V1258 WeakPolarHBondContact O-CG2 3.45Å; T1254-V1258 PolarHBondContact O-N 3.49Å

Retrieved 1,258 of 1,258 residues in 348.7 ms (Link to these results)

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