A0A087Y006_POEFO Loading...

Insulin receptor substrate 2

AlphaFold DB , UniProt , Accession A0A087Y006, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,112 aa.

						>A0A087Y006_POEFO|A0A087Y006
MASPPATGGQALMTSTSNTNANNSAKKCGYLKKQKHGHKRFFVLKEPCEGFPARLEYYENEKKWRNKSAAKRVVPLDCCLNVSKRADAKHKYLIALYTKDEYFAVAAENEQEQENWYRALTDLMAEGKVCDGSASNSASSLVGFDESSYGVITPVAAAYKEVWQVNLKSRGLGQSRNLTGVYRLCLSSRMISFVKLNSEVASVVLQLMNIRRCGHSDSFFFIEVGRSAAIGPGELWMQADDSVVAQNIHETILEAMKAMKELSEFRPRSKSQSSSTNPISVPTRRHLNNLPPSQTGLPRRSRTDSTCATSPVSSKCLSCRIRTASEGDGTMTRPMSVTGSPLSPGVHRTLLSRSHTITARPSLTFESSTLQHSKSMSMPLSHSPPVATPCPGHVSNCVDSSVPRPSSCSASFSGSPSDAGFISCEEYGSSPADARDLRLPLSLRSNTPESLKADTPPSRDGSELDGYMVMERQNQNGYRRLSELDKVYRKRTYSLTTPRQQRRPPQVSSASLDEYTLMRATYTSGSRSSLRCHTASPKGSGLEDYKDVHISSNSLQGDSGYMPMMPGVAPKTPGSKDDPYMPMSPMCVSAPKQIINPRSHSCTAGLAPRTDSPGSISLEDNGYMPMWCGHKMSVESSDGKPSNGEYLYMSPVDALVSLTPPEYLLSLSGDPHPHHRQPYCYSSLPRSVKGQLQRTGSADTDQYVVMSLQRQRIEEESNGGPISPGESGTGSSPGTPTTPSSLPSPLKLTRSDGGLLHRSRVCRPTRLALESLRTLPCMSEHPLPSEPRSPGEYINIDFGSAADVPLLESSEAGSVMCTEEGSLSLSDYANIDINSSVHLESHQGESSHPVGRLKNTSEVLMCSSMVSNQQDTQRVEGKEDEKRMEGETKTMGQKGSPVCEPAITKSDYTEMTFGPPAPLSVLCTTDATPVPTSPTACVKRLSLESSLVDVVPPVPVDSFLLGAPSLSLTVVDPDRGAKVIRADPQGRRRHSSETFSSTTTVTPVCPSFAHDTKRHSSASVENVSRSVHSSEEPGEDHSSPMCRETSAGYQNGLNYIALNLMEGNLGGGRLGSCDKFLRFKTTCGCKGGLNGFSASPYTSLGFKETTTAAVKE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.4	Very low	32.9	Very low	251 Å²	251	129.7 Å²	129.7	100%	1.236	88%	0.876	S	S	*	*				0	81.4	0	-78.6	-64.1	-144.9	0	0	109.6
2	A	29.7	Very low	32.6	Very low	103 Å²	103	132.6 Å²	132.6	85%	0.851	87%	0.874	S	S	*	*			trans	-164.9	152.1	169	0	0	0	0	0	108.2
3	S	29.6	Very low	32.3	Very low	115 Å²	115	135.5 Å²	135.5	80%	0.804	87%	0.872	S	S	*	*			trans	-97.4	151.9	-172	-49.5	0	0	0	0	113
4	P	38.2	Very low	31.9	Very low	115 Å²	115	135.3 Å²	135.3	75%	0.747	87%	0.867	S	S	*	*			trans	-70.7	157.6	152.2	32.8	-33	0	0	0	110.9
5	P	39.5	Very low	32	Very low	135 Å²	135	133.7 Å²	133.7	88%	0.877	86%	0.862	S	S	*	*			trans	-83.2	178.1	-172.5	35	-37.5	0	0	0	113.8
6	A	29.7	Very low	31.9	Very low	88 Å²	88	133.8 Å²	133.8	73%	0.727	86%	0.859	S	S	*	*			trans	-123.4	160.3	-174.7	0	0	0	0	0	114
7	T	34.8	Very low	32	Very low	154 Å²	154	131.8 Å²	131.8	95%	0.945	85%	0.85	S	S	*	*			trans	83.5	128.9	163.1	-21.6	0	0	0	0	117.2
8	G	26.9	Very low	32.4	Very low	82 Å²	82	133.1 Å²	133.1	85%	0.845	85%	0.849	S	S	*	*			trans	155.2	57.7	178.5	0	0	0	0	0	112
9	G	28	Very low	32.4	Very low	75 Å²	75	133.3 Å²	133.3	77%	0.773	85%	0.848	S	S	*	*			trans	-99.1	156	-170.3	0	0	0	0	0	114.9
10	Q	29.2	Very low	32.5	Very low	203 Å²	203	132.2 Å²	132.2	95%	0.949	84%	0.835	S	S	*	*			trans	-150	150.4	152.5	-109.8	175.2	50.4	0	0	109.5
11	A	31.7	Very low	32.9	Very low	106 Å²	106	130.2 Å²	130.2	88%	0.876	83%	0.831	S	S	*	*			trans	-91.8	133.7	-176.9	0	0	0	0	0	111
12	L	29.1	Very low	33	Very low	164 Å²	164	124.6 Å²	124.6	86%	0.859	81%	0.807	S	S	*	*			trans	-128.5	129.3	172.1	-165.9	65.7	0	0	0	111.4	T14	L12-T14 PolarHBondContact O-N 2.81Å
13	M	28.7	Very low	34.2	Very low	171 Å²	171	123.5 Å²	123.5	84%	0.842	79%	0.787	S	S	*	*			trans	-28.3	114.1	176	-64.2	-69.7	158.9	0	0	115.5	S15	M13-S15 PolarHBondContact O-N 2.99Å; M13-S15 VanDerWaalsContact O-N 3.09Å
14	T	27.6	Very low	36.1	Very low	132 Å²	132	119.6 Å²	119.6	81%	0.81	76%	0.759	S	S	*	*			trans	-74	92.9	162.2	50.8	0	0	0	0	110	L12	L12-T14 PolarHBondContact O-N 2.81Å
15	S	32.7	Very low	38.2	Very low	112 Å²	112	115.5 Å²	115.5	78%	0.783	74%	0.735	S	S	*	*			trans	-71	133	154.6	47.1	0	0	0	0	108.8	M13	M13-S15 PolarHBondContact O-N 2.99Å; M13-S15 VanDerWaalsContact O-N 3.09Å
16	T	30	Very low	40.4	Very low	134 Å²	134	112.3 Å²	112.3	82%	0.822	71%	0.707	S	S	*	*			trans	-148.4	125.8	173	-50.4	0	0	0	0	108.5
17	S	34.1	Very low	43.3	Very low	100 Å²	100	110.5 Å²	110.5	70%	0.699	68%	0.683	S	S	*	*			trans	-100.7	159.5	-169.1	46.2	0	0	0	0	113.1
18	N	38.8	Very low	46.1	Very low	156 Å²	156	106.1 Å²	106.1	83%	0.834	66%	0.658	S	S	*	*			trans	45.7	82.8	155.6	-66.4	-2.8	0	0	0	118.7
19	T	32.6	Very low	49.2	Very low	136 Å²	136	103 Å²	103	83%	0.834	63%	0.625	S	S	*	*	S	Bend	trans	-155.4	51.6	146.1	-3.5	0	0	0	0	113.9
20	N	34.4	Very low	52.4	Low	111 Å²	111	102.8 Å²	102.8	59%	0.594	60%	0.602	S	S	*	*			trans	-163.9	54.1	170.3	-111.7	-51.8	0	0	0	116.3	N22 N23	N20-N22 PolarHBondContact O-N 3.13Å; N20-N23 HydrophobicContact CB-CB 4.33Å; N20-N23 PolarHBondContact O-N 3.43Å; N20-N23 PolarHBondContact OD1-ND2 2.92Å
21	A	41.5	Very low	55.5	Low	91 Å²	91	93.2 Å²	93.2	75%	0.752	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	-17.5	176.6	0	0	0	0	0	114.9
22	N	45.8	Very low	58.4	Low	134 Å²	134	91.4 Å²	91.4	72%	0.717	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	4.8	178.8	-78.3	-69.4	0	0	0	114.9	N20	N20-N22 PolarHBondContact O-N 3.13Å
23	N	55.9	Low	61.3	Low	80 Å²	80	84.9 Å²	84.9	43%	0.428	49%	0.494	S	S	.	.			trans	-133.8	41.9	-176.3	-77.4	-46.8	0	0	0	112.9	N20 A25	N20-N23 HydrophobicContact CB-CB 4.33Å; N20-N23 PolarHBondContact O-N 3.43Å; N20-N23 PolarHBondContact OD1-ND2 2.92Å; N23-A25 PolarHBondContact O-N 3.44Å
24	S	68	Low	64.2	Low	33 Å²	33	77.8 Å²	77.8	23%	0.231	46%	0.459	C	S	.	.			trans	-70.2	57.1	177.2	46.6	0	0	0	0	114.2	K45 E46	S24-K45 WeakPolarHBondContact O-CA 3.29Å; S24-E46 PolarHBondContact O-N 2.87Å; S24-E46 VanDerWaalsContact O-N 3.07Å
25	A	82.4	Confident	66.8	Low	29 Å²	29	80 Å²	80	24%	0.24	46%	0.457	C	S	.	.			trans	-98	95.2	178.3	0	0	0	0	0	111.2	N23 K27 V43 L44 W64	N23-A25 PolarHBondContact O-N 3.44Å; A25-K27 PolarHBondContact O-N 3.23Å; A25-K27 VanDerWaalsContact O-N 3.07Å; A25-V43 HydrophobicContact CB-CG1 3.63Å; A25-L44 CarbonylContact C-O 3.43Å; A25-L44 VanDerWaalsContact CA-O 3.29Å; A25-L44 WeakPolarHBondContact CA-O 3.37Å; A25-W64 HydrophobicContact CB-CZ2 4.41Å
26	K	87.4	Confident	69.2	Low	68 Å²	68	78.3 Å²	78.3	30%	0.296	44%	0.437	S	S	.	.	S	Bend	trans	-49.7	-34.6	175.2	-153.1	167.2	-155.8	178.7	0	112.9	L44 E46 L123 E126	K26-L44 HydrophobicContact CB-CG 4.46Å; K26-L44 PolarHBondContact N-O 2.81Å; K26-E46 HydrophobicContact CB-CG 3.61Å; K26-E46 HydrophobicContact CD-CG 4.07Å; K26-E46 VanDerWaalsContact CD-OE1 3.23Å; K26-E46 WeakPolarHBondContact CD-OE1 3.25Å; K26-E46 WeakPolarHBondContact CE-OE1 3.05Å; K26-E46 HydrophobicContact CG-CG 4.1Å; K26-E46 WeakPolarHBondContact CG-OE1 3.5Å; K26-L123 HydrophobicContact CB-CD1 4.27Å; K26-L123 HydrophobicContact CD-CD1 3.63Å; K26-L123 HydrophobicContact CD-CD2 4.05Å; K26-L123 HydrophobicContact CD-CG 3.63Å; K26-E126 IonicContact NZ-OE1 2.75Å; K26-E126 PolarHBondContact NZ-OE1 2.85Å; K26-E126 IonicContact NZ-OE2 3.15Å; K26-E126 PolarHBondContact NZ-OE2 2.87Å
27	K	90.8	Very high	71.8	Confident	50 Å²	50	73.5 Å²	73.5	22%	0.217	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	137.7	178.4	-162.7	173.1	-178.4	75	0	111.8	A25 L44 N115 W116 A119	A25-K27 PolarHBondContact O-N 3.23Å; A25-K27 VanDerWaalsContact O-N 3.07Å; K27-L44 HydrophobicContact CB-CB 4.07Å; K27-L44 HydrophobicContact CB-CD2 4.07Å; K27-L44 PolarHBondContact N-O 2.74Å; K27-L44 WeakPolarHBondContact O-CB 3.48Å; K27-L44 PolarHBondContact O-N 3.01Å; K27-N115 WeakPolarHBondContact CD-O 3.41Å; K27-N115 WeakPolarHBondContact CE-O 3.42Å; K27-N115 PolarHBondContact NZ-O 3.33Å; K27-W116 HydrophobicContact CB-CE3 4.44Å; K27-W116 HydrophobicContact CB-CH2 4.43Å; K27-W116 HydrophobicContact CB-CZ3 4.13Å; K27-W116 HydrophobicContact CD-CD2 3.53Å; K27-W116 HydrophobicContact CD-CE3 3.59Å; K27-W116 HydrophobicContact CD-CG 3.93Å; K27-W116 HydrophobicContact CD-CH2 4.45Å; K27-W116 HydrophobicContact CD-CZ2 4.43Å; K27-W116 HydrophobicContact CD-CZ3 4.06Å; K27-W116 VanDerWaalsContact CE-CD2 3.42Å; K27-W116 VanDerWaalsContact CE-CG 3.4Å; K27-W116 HydrophobicContact CG-CD2 4.19Å; K27-W116 HydrophobicContact CG-CE3 4.09Å; K27-W116 HydrophobicContact CG-CH2 4.08Å; K27-W116 HydrophobicContact CG-CZ2 4.21Å; K27-W116 HydrophobicContact CG-CZ3 4.02Å; K27-A119 HydrophobicContact CD-CB 3.94Å
28	C	92.7	Very high	74.5	Confident	62 Å²	62	74 Å²	74	42%	0.419	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	151.7	169.4	65.3	0	0	0	0	111.3	F41 F42 V43	C28-F41 HydrophobicContact CB-CE1 3.89Å; C28-F41 HydrophobicContact CB-CZ 3.61Å; C28-F42 VanDerWaalsContact CA-O 3.26Å; C28-F42 WeakPolarHBondContact CA-O 3.39Å; C28-V43 HydrophobicContact CB-CG2 4.29Å
29	G	92.8	Very high	77	Confident	15 Å²	15	70.8 Å²	70.8	16%	0.155	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.9	178.5	-178.7	0	0	0	0	0	113.1	F41 F42	G29-F41 CarbonylContact O-C 3.59Å; G29-F42 PolarHBondContact N-O 2.95Å; G29-F42 PolarHBondContact O-N 3.03Å
30	Y	94.1	Very high	80	Confident	71 Å²	71	66 Å²	66	28%	0.278	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	105.4	-175.2	-75.8	-87.2	0	0	0	112.9	K39 R40 F41 E61	Y30-K39 HydrophobicContact CD1-CG 4.1Å; Y30-K39 HydrophobicContact CG-CG 4.38Å; Y30-R40 WeakPolarHBondContact CA-O 3.42Å; Y30-F41 HydrophobicContact CD1-CB 4.08Å; Y30-F41 HydrophobicContact CD1-CD2 4.06Å; Y30-F41 AromaticContact CD2-CD2 3.7Å; Y30-F41 HydrophobicContact CD2-CD2 3.7Å; Y30-F41 HydrophobicContact CD2-CE2 4.16Å; Y30-F41 HydrophobicContact CE1-CB 3.93Å; Y30-F41 AromaticContact CE1-CD2 3.99Å; Y30-F41 HydrophobicContact CE1-CD2 3.99Å; Y30-F41 HydrophobicContact CE1-CG 4.44Å; Y30-F41 AromaticContact CE2-CD2 3.59Å; Y30-F41 HydrophobicContact CE2-CD2 3.59Å; Y30-F41 HydrophobicContact CE2-CE2 4.03Å; Y30-F41 AromaticContact CG-CD2 3.93Å; Y30-F41 HydrophobicContact CG-CD2 3.93Å; Y30-F41 AromaticContact CZ-CD2 3.76Å; Y30-E61 HydrophobicContact CE2-CB 4.1Å; Y30-E61 WeakPolarHBondContact OH-CB 3.34Å; Y30-E61 PolarHBondContact OH-N 3.31Å; Y30-E61 VanDerWaalsContact OH-N 3.16Å
31	L	93.8	Very high	82.8	Confident	2 Å²	2	61 Å²	61	1%	0.01	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	155.5	173.1	-60.3	170.3	0	0	0	111.5	K39 R40 F42 V105 A107 E112 W116	L31-K39 WeakPolarHBondContact O-CA 3.26Å; L31-R40 PolarHBondContact N-O 3.4Å; L31-R40 VanDerWaalsContact N-O 3.09Å; L31-R40 PolarHBondContact O-N 2.99Å; L31-F42 HydrophobicContact CB-CD2 3.58Å; L31-F42 HydrophobicContact CB-CE2 3.75Å; L31-F42 HydrophobicContact CB-CG 4.35Å; L31-F42 HydrophobicContact CD1-CB 4.35Å; L31-F42 HydrophobicContact CD1-CD2 4.2Å; L31-F42 HydrophobicContact CD1-CG 4.13Å; L31-F42 HydrophobicContact CG-CD2 4.17Å; L31-V105 HydrophobicContact CB-CB 4.26Å; L31-V105 HydrophobicContact CD1-CB 4.05Å; L31-V105 HydrophobicContact CD1-CG2 3.87Å; L31-A107 HydrophobicContact CD2-CB 3.99Å; L31-E112 VanDerWaalsContact CD2-OE1 3.31Å; L31-E112 WeakPolarHBondContact CD2-OE1 3.48Å; L31-W116 HydrophobicContact CD1-CD2 3.93Å; L31-W116 HydrophobicContact CD1-CE3 4.35Å; L31-W116 HydrophobicContact CD1-CG 4.23Å; L31-W116 HydrophobicContact CD1-CZ2 4.19Å; L31-W116 HydrophobicContact CG-CZ2 4.31Å
32	K	92.5	Very high	85.4	Confident	68 Å²	68	56.6 Å²	56.6	30%	0.296	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	148.3	168.6	-65.9	168.5	-175.1	149.2	0	108.5	G37 K39 V105 A106 E108	K32-G37 WeakPolarHBondContact CB-O 3.04Å; K32-G37 WeakPolarHBondContact CG-O 3.18Å; K32-K39 HydrophobicContact CG-CB 4.32Å; K32-V105 CarbonylContact O-C 3.58Å; K32-V105 WeakPolarHBondContact O-CA 3.39Å; K32-A106 HydrophobicContact CB-CB 4.19Å; K32-A106 PolarHBondContact N-O 3.04Å; K32-A106 PolarHBondContact O-N 3.07Å; K32-E108 WeakPolarHBondContact CE-OE1 3.29Å; K32-E108 IonicContact NZ-OE1 2.74Å; K32-E108 PolarHBondContact NZ-OE1 3.26Å
33	K	91.8	Very high	87.7	Confident	28 Å²	28	50.2 Å²	50.2	12%	0.122	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	130.9	172.3	-76.4	169.6	149.6	-157.8	0	110.8	K35 H36 G37 H38 F42 Y57 V105	K33-K35 VanDerWaalsContact C-N 3.35Å; K33-K35 PolarHBondContact O-N 3.43Å; K33-H36 WeakPolarHBondContact CD-CE1 3.46Å; K33-H36 VanDerWaalsContact CD-NE2 3.25Å; K33-H36 WeakPolarHBondContact CD-NE2 3.12Å; K33-H36 PolarHBondContact O-N 3.13Å; K33-H36 VanDerWaalsContact O-N 3.17Å; K33-G37 PolarHBondContact O-N 2.86Å; K33-H38 PolarHBondContact N-O 2.8Å; K33-F42 HydrophobicContact CG-CZ 3.98Å; K33-Y57 PolarHBondContact NZ-OH 3.06Å; K33-V105 HydrophobicContact CG-CG1 4.32Å
34	Q	88.4	Confident	89.5	Confident	22 Å²	22	46.4 Å²	46.4	10%	0.103	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-43.7	-54.7	-178	-175.6	-150.2	30.7	0	0	112.9	H36 D87 H90 L93 Y102 A104	Q34-H36 VanDerWaalsContact C-N 3.34Å; Q34-H36 PolarHBondContact O-N 3.19Å; Q34-D87 WeakPolarHBondContact CG-OD2 3.18Å; Q34-D87 PolarHBondContact NE2-OD2 2.92Å; Q34-H90 PolarHBondContact O-CE1 3.01Å; Q34-L93 HydrophobicContact CB-CD2 3.89Å; Q34-L93 HydrophobicContact CG-CD1 4.39Å; Q34-L93 HydrophobicContact CG-CD2 3.98Å; Q34-Y102 PolarHBondContact NE2-OH 3.39Å; Q34-A104 HydrophobicContact CB-CB 3.9Å; Q34-A104 WeakPolarHBondContact CB-O 3.43Å; Q34-A104 HydrophobicContact CG-CB 4.3Å; Q34-A104 PolarHBondContact N-O 2.62Å
35	K	83.4	Confident	90.5	Very high	177 Å²	177	46.9 Å²	46.9	77%	0.77	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-17.5	-172.5	-67.7	-164.6	175.1	-172.4	0	116.5	K33	K33-K35 VanDerWaalsContact C-N 3.35Å; K33-K35 PolarHBondContact O-N 3.43Å
36	H	81.6	Confident	90.8	Very high	78 Å²	78	48.8 Å²	48.8	36%	0.361	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-142.9	2.3	-172.1	71.3	33.2	0	0	0	115.7	K33 Q34 H38	K33-H36 WeakPolarHBondContact CD-CE1 3.46Å; K33-H36 VanDerWaalsContact CD-NE2 3.25Å; K33-H36 WeakPolarHBondContact CD-NE2 3.12Å; K33-H36 PolarHBondContact O-N 3.13Å; K33-H36 VanDerWaalsContact O-N 3.17Å; Q34-H36 VanDerWaalsContact C-N 3.34Å; Q34-H36 PolarHBondContact O-N 3.19Å; H36-H38 AromaticContact CD2-ND1 3.59Å; H36-H38 VanDerWaalsContact CE1-CB 3.49Å; H36-H38 WeakPolarHBondContact CE1-CB 3.31Å; H36-H38 AromaticContact CE1-CG 3.77Å; H36-H38 AromaticContact CE1-ND1 3.35Å; H36-H38 PolarHBondContact CE1-ND1 2.97Å; H36-H38 VanDerWaalsContact CE1-ND1 3.35Å; H36-H38 AromaticContact CG-CE1 3.98Å; H36-H38 AromaticContact CG-ND1 3.29Å; H36-H38 VanDerWaalsContact CG-ND1 3.29Å; H36-H38 AromaticContact ND1-CG 3.55Å; H36-H38 PolarHBondContact ND1-N 2.98Å; H36-H38 AromaticContact ND1-ND1 3.13Å; H36-H38 PolarHBondContact ND1-ND1 2.66Å; H36-H38 VanDerWaalsContact ND1-ND1 3.13Å; H36-H38 AromaticContact NE2-ND1 3.63Å; H36-H38 PolarHBondContact O-N 3.04Å
37	G	84.8	Confident	90.7	Very high	33 Å²	33	48.5 Å²	48.5	34%	0.34	24%	0.24	S	C	.	.			trans	69.2	-31.6	176.3	0	0	0	0	0	116.5	K32 K33 K39	K32-G37 WeakPolarHBondContact CB-O 3.04Å; K32-G37 WeakPolarHBondContact CG-O 3.18Å; K33-G37 PolarHBondContact O-N 2.86Å; G37-K39 PolarHBondContact O-N 3.23Å
38	H	90.2	Very high	90	Very high	111 Å²	111	49 Å²	49	51%	0.514	25%	0.249	S	C	.	.			trans	-53.2	126.2	-176	-42.9	121.4	0	0	0	112.1	K33 H36	K33-H38 PolarHBondContact N-O 2.8Å; H36-H38 AromaticContact CD2-ND1 3.59Å; H36-H38 VanDerWaalsContact CE1-CB 3.49Å; H36-H38 WeakPolarHBondContact CE1-CB 3.31Å; H36-H38 AromaticContact CE1-CG 3.77Å; H36-H38 AromaticContact CE1-ND1 3.35Å; H36-H38 PolarHBondContact CE1-ND1 2.97Å; H36-H38 VanDerWaalsContact CE1-ND1 3.35Å; H36-H38 AromaticContact CG-CE1 3.98Å; H36-H38 AromaticContact CG-ND1 3.29Å; H36-H38 VanDerWaalsContact CG-ND1 3.29Å; H36-H38 AromaticContact ND1-CG 3.55Å; H36-H38 PolarHBondContact ND1-N 2.98Å; H36-H38 AromaticContact ND1-ND1 3.13Å; H36-H38 PolarHBondContact ND1-ND1 2.66Å; H36-H38 VanDerWaalsContact ND1-ND1 3.13Å; H36-H38 AromaticContact NE2-ND1 3.63Å; H36-H38 PolarHBondContact O-N 3.04Å
39	K	93.1	Very high	88.7	Confident	88 Å²	88	55.3 Å²	55.3	38%	0.383	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	132.1	170	-163.1	161.9	-171.7	163.6	0	108.9	Y30 L31 K32 G37 E108	Y30-K39 HydrophobicContact CD1-CG 4.1Å; Y30-K39 HydrophobicContact CG-CG 4.38Å; L31-K39 WeakPolarHBondContact O-CA 3.26Å; K32-K39 HydrophobicContact CG-CB 4.32Å; G37-K39 PolarHBondContact O-N 3.23Å; K39-E108 IonicContact NZ-OE1 3.18Å; K39-E108 PolarHBondContact NZ-OE1 3.12Å; K39-E108 IonicContact NZ-OE2 2.79Å; K39-E108 PolarHBondContact NZ-OE2 3.12Å
40	R	94.3	Very high	87.5	Confident	34 Å²	34	58.3 Å²	58.3	13%	0.128	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	153.4	-179.5	-65.5	-60.2	-179.2	-176.5	8.6	109.1	Y30 L31 F42 Y57 E59	Y30-R40 WeakPolarHBondContact CA-O 3.42Å; L31-R40 PolarHBondContact N-O 3.4Å; L31-R40 VanDerWaalsContact N-O 3.09Å; L31-R40 PolarHBondContact O-N 2.99Å; R40-F42 HydrophobicContact CB-CD2 4.38Å; R40-F42 HydrophobicContact CB-CE2 3.81Å; R40-F42 WeakPolarHBondContact O-CD2 3.09Å; R40-Y57 HydrophobicContact CB-CD2 4.16Å; R40-Y57 HydrophobicContact CG-CD2 4.32Å; R40-E59 IonicContact CZ-OE1 3.09Å; R40-E59 PolarHBondContact NH1-O 2.85Å; R40-E59 IonicContact NH1-OE1 3.25Å; R40-E59 PolarHBondContact NH1-OE1 2.86Å; R40-E59 IonicContact NH2-OE1 2.78Å; R40-E59 PolarHBondContact NH2-OE1 2.92Å
41	F	94.6	Very high	86.6	Confident	6 Å²	6	61 Å²	61	3%	0.026	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	113.5	-180	-169.1	-100.4	0	0	0	110	C28 G29 Y30 V43 Y57 Y58 E61 W64	C28-F41 HydrophobicContact CB-CE1 3.89Å; C28-F41 HydrophobicContact CB-CZ 3.61Å; G29-F41 CarbonylContact O-C 3.59Å; Y30-F41 HydrophobicContact CD1-CB 4.08Å; Y30-F41 HydrophobicContact CD1-CD2 4.06Å; Y30-F41 AromaticContact CD2-CD2 3.7Å; Y30-F41 HydrophobicContact CD2-CD2 3.7Å; Y30-F41 HydrophobicContact CD2-CE2 4.16Å; Y30-F41 HydrophobicContact CE1-CB 3.93Å; Y30-F41 AromaticContact CE1-CD2 3.99Å; Y30-F41 HydrophobicContact CE1-CD2 3.99Å; Y30-F41 HydrophobicContact CE1-CG 4.44Å; Y30-F41 AromaticContact CE2-CD2 3.59Å; Y30-F41 HydrophobicContact CE2-CD2 3.59Å; Y30-F41 HydrophobicContact CE2-CE2 4.03Å; Y30-F41 AromaticContact CG-CD2 3.93Å; Y30-F41 HydrophobicContact CG-CD2 3.93Å; Y30-F41 AromaticContact CZ-CD2 3.76Å; F41-V43 HydrophobicContact CD1-CG2 3.69Å; F41-V43 HydrophobicContact CE1-CG2 3.52Å; F41-Y57 CarbonylContact O-C 3.53Å; F41-Y57 VanDerWaalsContact O-CA 3.29Å; F41-Y57 WeakPolarHBondContact O-CA 3.35Å; F41-Y58 PolarHBondContact N-O 2.81Å; F41-Y58 PolarHBondContact O-N 3.39Å; F41-E61 HydrophobicContact CB-CB 4.48Å; F41-E61 HydrophobicContact CD1-CB 4.24Å; F41-E61 HydrophobicContact CD1-CG 4.49Å; F41-E61 HydrophobicContact CD2-CB 3.62Å; F41-E61 HydrophobicContact CD2-CG 4.11Å; F41-E61 HydrophobicContact CE1-CB 4.37Å; F41-E61 HydrophobicContact CE1-CG 4.14Å; F41-E61 HydrophobicContact CE2-CB 3.76Å; F41-E61 HydrophobicContact CE2-CG 3.71Å; F41-E61 HydrophobicContact CG-CB 3.85Å; F41-E61 HydrophobicContact CG-CG 4.46Å; F41-E61 HydrophobicContact CZ-CB 4.13Å; F41-E61 HydrophobicContact CZ-CG 3.72Å; F41-W64 HydrophobicContact CD1-CB 3.98Å; F41-W64 HydrophobicContact CD1-CD2 4.3Å; F41-W64 HydrophobicContact CD1-CE3 4.19Å; F41-W64 HydrophobicContact CD1-CG 4.24Å; F41-W64 HydrophobicContact CE1-CB 4.2Å; F41-W64 AromaticContact CE1-CD2 3.63Å; F41-W64 HydrophobicContact CE1-CD2 3.63Å; F41-W64 AromaticContact CE1-CE3 3.27Å; F41-W64 HydrophobicContact CE1-CE3 3.27Å; F41-W64 HydrophobicContact CE1-CG 4.04Å; F41-W64 AromaticContact CE1-CZ3 3.83Å; F41-W64 HydrophobicContact CE1-CZ3 3.83Å; F41-W64 AromaticContact CZ-CE3 3.8Å; F41-W64 HydrophobicContact CZ-CE3 3.8Å; F41-W64 AromaticContact CZ-CZ3 3.95Å; F41-W64 HydrophobicContact CZ-CZ3 3.95Å
42	F	95.1	Very high	86.1	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	143.8	179.9	-75.7	-97.8	0	0	0	110.6	C28 G29 L31 K33 R40 L55 E56 Y57 F103 V105 W116	C28-F42 VanDerWaalsContact CA-O 3.26Å; C28-F42 WeakPolarHBondContact CA-O 3.39Å; G29-F42 PolarHBondContact N-O 2.95Å; G29-F42 PolarHBondContact O-N 3.03Å; L31-F42 HydrophobicContact CB-CD2 3.58Å; L31-F42 HydrophobicContact CB-CE2 3.75Å; L31-F42 HydrophobicContact CB-CG 4.35Å; L31-F42 HydrophobicContact CD1-CB 4.35Å; L31-F42 HydrophobicContact CD1-CD2 4.2Å; L31-F42 HydrophobicContact CD1-CG 4.13Å; L31-F42 HydrophobicContact CG-CD2 4.17Å; K33-F42 HydrophobicContact CG-CZ 3.98Å; R40-F42 HydrophobicContact CB-CD2 4.38Å; R40-F42 HydrophobicContact CB-CE2 3.81Å; R40-F42 WeakPolarHBondContact O-CD2 3.09Å; F42-L55 HydrophobicContact CB-CD1 4.41Å; F42-L55 HydrophobicContact CD1-CD1 4.06Å; F42-L55 HydrophobicContact CD1-CD2 4.26Å; F42-L55 HydrophobicContact CD1-CG 4.14Å; F42-E56 WeakPolarHBondContact CA-O 3.48Å; F42-Y57 HydrophobicContact CD1-CD1 4.49Å; F42-Y57 HydrophobicContact CD1-CG 4.41Å; F42-Y57 AromaticContact CE1-CD1 3.71Å; F42-Y57 HydrophobicContact CE1-CD1 3.71Å; F42-Y57 AromaticContact CE1-CG 3.87Å; F42-Y57 HydrophobicContact CE1-CG 3.87Å; F42-Y57 AromaticContact CZ-CD1 3.99Å; F42-Y57 HydrophobicContact CZ-CD1 3.99Å; F42-Y57 AromaticContact CZ-CG 3.94Å; F42-Y57 HydrophobicContact CZ-CG 3.94Å; F42-F103 AromaticContact CE1-CE1 3.83Å; F42-F103 HydrophobicContact CE1-CE1 3.83Å; F42-F103 AromaticContact CE1-CZ 3.78Å; F42-F103 HydrophobicContact CE1-CZ 3.78Å; F42-F103 HydrophobicContact CZ-CE1 4.44Å; F42-F103 HydrophobicContact CZ-CZ 4.1Å; F42-V105 HydrophobicContact CD1-CG1 4.48Å; F42-V105 HydrophobicContact CE1-CG1 3.61Å; F42-V105 HydrophobicContact CE2-CG1 4.02Å; F42-V105 HydrophobicContact CZ-CG1 3.34Å; F42-W116 HydrophobicContact CB-CH2 3.67Å; F42-W116 HydrophobicContact CB-CZ2 4.21Å; F42-W116 HydrophobicContact CB-CZ3 4.24Å
43	V	94.4	Very high	86	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	111.8	179.8	-174.4	0	0	0	0	107.8	A25 C28 F41 K45 E56 Y58 W64	A25-V43 HydrophobicContact CB-CG1 3.63Å; C28-V43 HydrophobicContact CB-CG2 4.29Å; F41-V43 HydrophobicContact CD1-CG2 3.69Å; F41-V43 HydrophobicContact CE1-CG2 3.52Å; V43-K45 HydrophobicContact CG1-CG 4.15Å; V43-E56 PolarHBondContact N-O 3.23Å; V43-E56 PolarHBondContact O-N 2.98Å; V43-Y58 HydrophobicContact CB-CE2 4.07Å; V43-Y58 HydrophobicContact CG2-CD2 3.82Å; V43-Y58 HydrophobicContact CG2-CE2 3.73Å; V43-W64 HydrophobicContact CG1-CZ2 4.39Å; V43-W64 HydrophobicContact CG2-CD2 4Å; V43-W64 HydrophobicContact CG2-CG 3.87Å
44	L	92.9	Very high	85.9	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	111.9	173.9	178	57.7	0	0	0	107.7	A25 K26 K27 L55 L76 W116 A119 L120 L123	A25-L44 CarbonylContact C-O 3.43Å; A25-L44 VanDerWaalsContact CA-O 3.29Å; A25-L44 WeakPolarHBondContact CA-O 3.37Å; K26-L44 HydrophobicContact CB-CG 4.46Å; K26-L44 PolarHBondContact N-O 2.81Å; K27-L44 HydrophobicContact CB-CB 4.07Å; K27-L44 HydrophobicContact CB-CD2 4.07Å; K27-L44 PolarHBondContact N-O 2.74Å; K27-L44 WeakPolarHBondContact O-CB 3.48Å; K27-L44 PolarHBondContact O-N 3.01Å; L44-L55 HydrophobicContact CB-CD1 4.2Å; L44-L55 HydrophobicContact CD1-CD1 4.45Å; L44-L76 HydrophobicContact CD1-CD1 3.74Å; L44-W116 HydrophobicContact CB-CZ3 4.01Å; L44-A119 HydrophobicContact CD2-CB 3.75Å; L44-L120 HydrophobicContact CD1-CD2 3.66Å; L44-L120 HydrophobicContact CD2-CD2 4.2Å; L44-L120 HydrophobicContact CD2-CG 4.22Å; L44-L123 HydrophobicContact CD1-CD1 3.5Å; L44-L123 HydrophobicContact CD2-CD1 3.87Å; L44-L123 HydrophobicContact CG-CD1 3.51Å
45	K	90.4	Very high	86.1	Confident	42 Å²	42	59.2 Å²	59.2	18%	0.183	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	141.4	177.8	-69.6	-177	-176.8	163.4	0	111.2	S24 V43 R54 E56	S24-K45 WeakPolarHBondContact O-CA 3.29Å; V43-K45 HydrophobicContact CG1-CG 4.15Å; K45-R54 HydrophobicContact CB-CG 4.04Å; K45-R54 PolarHBondContact N-O 3.26Å; K45-R54 PolarHBondContact O-N 2.8Å; K45-E56 WeakPolarHBondContact CD-OE1 3.32Å; K45-E56 WeakPolarHBondContact CE-OE1 3.49Å; K45-E56 WeakPolarHBondContact CE-OE2 3.45Å; K45-E56 IonicContact NZ-OE1 3.62Å; K45-E56 PolarHBondContact NZ-OE1 3.16Å; K45-E56 IonicContact NZ-OE2 2.98Å; K45-E56 PolarHBondContact NZ-OE2 2.89Å
46	E	87.8	Confident	86.6	Confident	69 Å²	69	51.2 Å²	51.2	32%	0.322	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-70.1	158	174.6	-60.2	-168.8	131.5	0	0	110.6	S24 K26 C48 L123	S24-E46 PolarHBondContact O-N 2.87Å; S24-E46 VanDerWaalsContact O-N 3.07Å; K26-E46 HydrophobicContact CB-CG 3.61Å; K26-E46 HydrophobicContact CD-CG 4.07Å; K26-E46 VanDerWaalsContact CD-OE1 3.23Å; K26-E46 WeakPolarHBondContact CD-OE1 3.25Å; K26-E46 WeakPolarHBondContact CE-OE1 3.05Å; K26-E46 HydrophobicContact CG-CG 4.1Å; K26-E46 WeakPolarHBondContact CG-OE1 3.5Å; E46-C48 PolarHBondContact O-N 3.04Å; E46-L123 HydrophobicContact CB-CD2 4.44Å; E46-L123 HydrophobicContact CG-CD2 4.34Å
47	P	85.6	Confident	87.1	Confident	63 Å²	63	48.3 Å²	48.3	41%	0.409	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-59.1	137.1	164.8	29.8	-34.4	0	0	0	108	A53 L123	P47-A53 HydrophobicContact CB-CB 4.33Å; P47-A53 HydrophobicContact CG-CB 4.5Å; P47-L123 VanDerWaalsContact CD-CD2 3.45Å
48	C	75.3	Confident	87.6	Confident	61 Å²	61	47.4 Å²	47.4	41%	0.412	25%	0.251	S	S	.	.	B	Isolated β-bridge	trans	-141	167.6	-177.4	-148.6	0	0	0	0	108.2	E46 G50 F51	E46-C48 PolarHBondContact O-N 3.04Å; C48-G50 PolarHBondContact O-N 3.47Å; C48-F51 PolarHBondContact N-O 3.01Å; C48-F51 PolarHBondContact O-N 3.2Å
49	E	65.7	Low	87.7	Confident	193 Å²	193	45.7 Å²	45.7	90%	0.902	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58	115.6	-172.7	-156.5	161.5	-145.9	0	0	110.9	F51	E49-F51 VanDerWaalsContact C-N 3.34Å; E49-F51 PolarHBondContact O-N 2.57Å
50	G	68.6	Low	87.7	Confident	79 Å²	79	45.3 Å²	45.3	81%	0.814	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.9	0.9	-174.3	0	0	0	0	0	117.3	C48	C48-G50 PolarHBondContact O-N 3.47Å
51	F	75.4	Confident	87.6	Confident	127 Å²	127	46.1 Å²	46.1	56%	0.557	25%	0.25	S	S	*	.	B	Isolated β-bridge	trans	-134.2	128	-179.3	-70	-81.5	0	0	0	114.4	C48 E49	C48-F51 PolarHBondContact N-O 3.01Å; C48-F51 PolarHBondContact O-N 3.2Å; E49-F51 VanDerWaalsContact C-N 3.34Å; E49-F51 PolarHBondContact O-N 2.57Å
52	P	83.1	Confident	87.5	Confident	47 Å²	47	53.8 Å²	53.8	31%	0.305	28%	0.284	S	S	.	.			trans	-68.8	162.1	-179	29.5	-37	0	0	0	113.8	R54 D77	P52-R54 PolarHBondContact O-N 2.84Å; P52-R54 PolarHBondContact O-NH1 2.79Å; P52-D77 VanDerWaalsContact CB-CG 3.47Å; P52-D77 WeakPolarHBondContact CB-OD1 2.99Å; P52-D77 WeakPolarHBondContact CB-OD2 3.13Å
53	A	88.9	Confident	87.3	Confident	2 Å²	2	59 Å²	59	2%	0.017	31%	0.306	C	S	.	.			trans	-59.6	132.4	171.5	0	0	0	0	0	109.3	P47 L76 L123	P47-A53 HydrophobicContact CB-CB 4.33Å; P47-A53 HydrophobicContact CG-CB 4.5Å; A53-L76 HydrophobicContact CB-CB 4.21Å; A53-L76 HydrophobicContact CB-CD1 4.11Å; A53-L76 HydrophobicContact CB-CG 4.5Å; A53-L76 WeakPolarHBondContact O-CB 3.4Å; A53-L76 PolarHBondContact O-N 2.7Å; A53-L123 HydrophobicContact CB-CD2 4.18Å
54	R	90.6	Very high	87.1	Confident	30 Å²	30	61 Å²	61	11%	0.113	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	141	-168.5	61.3	-165.3	-179.1	-80.4	11.5	114.7	K45 P52 E56 V73 V74	K45-R54 HydrophobicContact CB-CG 4.04Å; K45-R54 PolarHBondContact N-O 3.26Å; K45-R54 PolarHBondContact O-N 2.8Å; P52-R54 PolarHBondContact O-N 2.84Å; P52-R54 PolarHBondContact O-NH1 2.79Å; R54-E56 HydrophobicContact CG-CG 4.24Å; R54-E56 IonicContact CZ-OE1 3.21Å; R54-E56 IonicContact NE-OE1 2.88Å; R54-E56 PolarHBondContact NE-OE1 3.13Å; R54-V73 HydrophobicContact CB-CG1 4.06Å; R54-V73 HydrophobicContact CG-CG1 4.28Å; R54-V74 CarbonylContact C-O 3.29Å; R54-V74 WeakPolarHBondContact CA-O 3.42Å
55	L	92.3	Very high	86.9	Confident	3 Å²	3	69.2 Å²	69.2	2%	0.016	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	109.7	170.2	-175.9	64.9	0	0	0	109.7	F42 L44 V74 L76 L96 F103 W116 L120	F42-L55 HydrophobicContact CB-CD1 4.41Å; F42-L55 HydrophobicContact CD1-CD1 4.06Å; F42-L55 HydrophobicContact CD1-CD2 4.26Å; F42-L55 HydrophobicContact CD1-CG 4.14Å; L44-L55 HydrophobicContact CB-CD1 4.2Å; L44-L55 HydrophobicContact CD1-CD1 4.45Å; L55-V74 HydrophobicContact CB-CB 4.5Å; L55-V74 PolarHBondContact N-O 3.09Å; L55-V74 PolarHBondContact O-N 3.21Å; L55-L76 HydrophobicContact CB-CD2 4.41Å; L55-L96 HydrophobicContact CD2-CD1 4.09Å; L55-L96 HydrophobicContact CD2-CD2 3.79Å; L55-F103 HydrophobicContact CD2-CE1 4.34Å; L55-W116 HydrophobicContact CD1-CZ3 4.14Å; L55-L120 HydrophobicContact CD2-CD2 4.42Å
56	E	93.3	Very high	86.9	Confident	10 Å²	10	73.2 Å²	73.2	5%	0.047	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	154.7	174.4	-57.8	179.4	177	0	0	110.1	F42 V43 K45 R54 Y58 A70 R72 V73	F42-E56 WeakPolarHBondContact CA-O 3.48Å; V43-E56 PolarHBondContact N-O 3.23Å; V43-E56 PolarHBondContact O-N 2.98Å; K45-E56 WeakPolarHBondContact CD-OE1 3.32Å; K45-E56 WeakPolarHBondContact CE-OE1 3.49Å; K45-E56 WeakPolarHBondContact CE-OE2 3.45Å; K45-E56 IonicContact NZ-OE1 3.62Å; K45-E56 PolarHBondContact NZ-OE1 3.16Å; K45-E56 IonicContact NZ-OE2 2.98Å; K45-E56 PolarHBondContact NZ-OE2 2.89Å; R54-E56 HydrophobicContact CG-CG 4.24Å; R54-E56 IonicContact CZ-OE1 3.21Å; R54-E56 IonicContact NE-OE1 2.88Å; R54-E56 PolarHBondContact NE-OE1 3.13Å; E56-Y58 HydrophobicContact CB-CE2 3.9Å; E56-Y58 PolarHBondContact OE2-OH 3.46Å; E56-A70 HydrophobicContact CB-CB 4.26Å; E56-R72 WeakPolarHBondContact CA-O 3.37Å; E56-V73 HydrophobicContact CG-CG1 4.17Å; E56-V73 HydrophobicContact CG-CG2 4.15Å
57	Y	93.6	Very high	86.9	Confident	16 Å²	16	77.4 Å²	77.4	6%	0.063	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	151.4	162.8	77.8	-100.1	0	0	0	113.5	K33 R40 F41 F42 K71 R72 F103	K33-Y57 PolarHBondContact NZ-OH 3.06Å; R40-Y57 HydrophobicContact CB-CD2 4.16Å; R40-Y57 HydrophobicContact CG-CD2 4.32Å; F41-Y57 CarbonylContact O-C 3.53Å; F41-Y57 VanDerWaalsContact O-CA 3.29Å; F41-Y57 WeakPolarHBondContact O-CA 3.35Å; F42-Y57 HydrophobicContact CD1-CD1 4.49Å; F42-Y57 HydrophobicContact CD1-CG 4.41Å; F42-Y57 AromaticContact CE1-CD1 3.71Å; F42-Y57 HydrophobicContact CE1-CD1 3.71Å; F42-Y57 AromaticContact CE1-CG 3.87Å; F42-Y57 HydrophobicContact CE1-CG 3.87Å; F42-Y57 AromaticContact CZ-CD1 3.99Å; F42-Y57 HydrophobicContact CZ-CD1 3.99Å; F42-Y57 AromaticContact CZ-CG 3.94Å; F42-Y57 HydrophobicContact CZ-CG 3.94Å; Y57-K71 HydrophobicContact CD2-CB 4.13Å; Y57-K71 HydrophobicContact CE2-CB 3.57Å; Y57-K71 HydrophobicContact CE2-CD 4.23Å; Y57-K71 HydrophobicContact CE2-CG 3.73Å; Y57-K71 PolarHBondContact O-N 3.09Å; Y57-K71 PolarHBondContact OH-O 3.28Å; Y57-R72 HydrophobicContact CD1-CB 3.92Å; Y57-R72 HydrophobicContact CE1-CB 3.24Å; Y57-R72 HydrophobicContact CE1-CG 4.16Å; Y57-R72 PolarHBondContact N-O 3.23Å; Y57-F103 AromaticContact CD1-CZ 3.94Å; Y57-F103 HydrophobicContact CD1-CZ 3.94Å; Y57-F103 HydrophobicContact CE1-CE2 4.11Å; Y57-F103 AromaticContact CE1-CZ 3.96Å; Y57-F103 HydrophobicContact CE1-CZ 3.96Å
58	Y	93.8	Very high	87.1	Confident	14 Å²	14	76.2 Å²	76.2	6%	0.055	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	165.3	-172.9	-63.2	-92.6	0	0	0	110.6	F41 V43 E56 W64 S68 A70	F41-Y58 PolarHBondContact N-O 2.81Å; F41-Y58 PolarHBondContact O-N 3.39Å; V43-Y58 HydrophobicContact CB-CE2 4.07Å; V43-Y58 HydrophobicContact CG2-CD2 3.82Å; V43-Y58 HydrophobicContact CG2-CE2 3.73Å; E56-Y58 HydrophobicContact CB-CE2 3.9Å; E56-Y58 PolarHBondContact OE2-OH 3.46Å; Y58-W64 HydrophobicContact CD1-CB 4.04Å; Y58-W64 HydrophobicContact CD2-CB 3.83Å; Y58-W64 HydrophobicContact CD2-CG 4.19Å; Y58-W64 HydrophobicContact CE1-CB 4.36Å; Y58-W64 HydrophobicContact CE2-CB 4.21Å; Y58-W64 AromaticContact CE2-CD1 3.59Å; Y58-W64 HydrophobicContact CE2-CG 4.15Å; Y58-W64 HydrophobicContact CG-CB 3.75Å; Y58-W64 AromaticContact CZ-CD1 3.68Å; Y58-S68 VanDerWaalsContact CE1-O 3.29Å; Y58-S68 WeakPolarHBondContact CE1-O 3.46Å; Y58-A70 HydrophobicContact CD1-CB 4.46Å; Y58-A70 HydrophobicContact CE1-CB 3.86Å; Y58-A70 HydrophobicContact CE2-CB 4.37Å
59	E	93	Very high	87.8	Confident	76 Å²	76	77.8 Å²	77.8	36%	0.355	40%	0.396	S	S	.	.	S	Bend	trans	-57.2	-51.9	176	-176.1	105.8	-96.3	0	0	111.2	R40 K63 K71	R40-E59 IonicContact CZ-OE1 3.09Å; R40-E59 PolarHBondContact NH1-O 2.85Å; R40-E59 IonicContact NH1-OE1 3.25Å; R40-E59 PolarHBondContact NH1-OE1 2.86Å; R40-E59 IonicContact NH2-OE1 2.78Å; R40-E59 PolarHBondContact NH2-OE1 2.92Å; E59-K63 HydrophobicContact CB-CG 4.17Å; E59-K71 IonicContact OE1-NZ 3.52Å
60	N	92.7	Very high	89	Confident	80 Å²	80	70.1 Å²	70.1	43%	0.428	37%	0.366	S	S	.	.	S	Bend	trans	-152.8	159.4	-177.3	-71.7	-50.6	0	0	0	108.4	K62 K63 W64	N60-K62 VanDerWaalsContact C-N 3.25Å; N60-K62 PolarHBondContact O-N 3.44Å; N60-K63 WeakPolarHBondContact O-CB 3.29Å; N60-K63 PolarHBondContact O-N 2.86Å; N60-W64 PolarHBondContact O-N 3.05Å
61	E	93	Very high	90.2	Very high	50 Å²	50	71.8 Å²	71.8	23%	0.234	35%	0.35	C	S	.	.	H	α-helix	trans	-54.9	-39	176.6	-177.5	-173.7	167	0	0	113	Y30 F41 K63 W64 R65	Y30-E61 HydrophobicContact CE2-CB 4.1Å; Y30-E61 WeakPolarHBondContact OH-CB 3.34Å; Y30-E61 PolarHBondContact OH-N 3.31Å; Y30-E61 VanDerWaalsContact OH-N 3.16Å; F41-E61 HydrophobicContact CB-CB 4.48Å; F41-E61 HydrophobicContact CD1-CB 4.24Å; F41-E61 HydrophobicContact CD1-CG 4.49Å; F41-E61 HydrophobicContact CD2-CB 3.62Å; F41-E61 HydrophobicContact CD2-CG 4.11Å; F41-E61 HydrophobicContact CE1-CB 4.37Å; F41-E61 HydrophobicContact CE1-CG 4.14Å; F41-E61 HydrophobicContact CE2-CB 3.76Å; F41-E61 HydrophobicContact CE2-CG 3.71Å; F41-E61 HydrophobicContact CG-CB 3.85Å; F41-E61 HydrophobicContact CG-CG 4.46Å; F41-E61 HydrophobicContact CZ-CB 4.13Å; F41-E61 HydrophobicContact CZ-CG 3.72Å; E61-K63 PolarHBondContact O-N 2.86Å; E61-W64 HydrophobicContact CG-CE3 4.2Å; E61-W64 WeakPolarHBondContact O-CA 3.44Å; E61-W64 WeakPolarHBondContact O-CB 3.35Å; E61-W64 PolarHBondContact O-N 2.79Å; E61-R65 HydrophobicContact CG-CG 4.27Å; E61-R65 PolarHBondContact O-N 2.62Å; E61-R65 IonicContact OE1-CZ 3.89Å; E61-R65 IonicContact OE1-NE 2.81Å; E61-R65 PolarHBondContact OE1-NE 2.63Å; E61-R65 IonicContact OE1-NH2 3.01Å; E61-R65 PolarHBondContact OE1-NH2 3.31Å
62	K	91.3	Very high	90.9	Very high	167 Å²	167	69.4 Å²	69.4	73%	0.726	34%	0.338	S	S	*	.	H	α-helix	trans	-57	-32.2	176.4	-63.5	-171.7	179.5	-175	0	112.7	N60 N66	N60-K62 VanDerWaalsContact C-N 3.25Å; N60-K62 PolarHBondContact O-N 3.44Å; K62-N66 VanDerWaalsContact O-CB 3.26Å; K62-N66 WeakPolarHBondContact O-CB 3.26Å; K62-N66 PolarHBondContact O-N 2.88Å; K62-N66 VanDerWaalsContact O-N 3.13Å; K62-N66 PolarHBondContact O-OD1 2.87Å; K62-N66 VanDerWaalsContact O-OD1 3.04Å
63	K	91.1	Very high	91.2	Very high	109 Å²	109	70.5 Å²	70.5	47%	0.474	34%	0.344	S	S	.	.	H	α-helix	trans	-74.7	-36.1	175.8	-73	-72.5	-171.7	174.6	0	111.8	E59 N60 E61 N66 K67 S68	E59-K63 HydrophobicContact CB-CG 4.17Å; N60-K63 WeakPolarHBondContact O-CB 3.29Å; N60-K63 PolarHBondContact O-N 2.86Å; E61-K63 PolarHBondContact O-N 2.86Å; K63-N66 CarbonylContact O-C 3.59Å; K63-K67 PolarHBondContact O-N 2.8Å; K63-S68 WeakPolarHBondContact CD-OG 3.33Å; K63-S68 WeakPolarHBondContact O-CB 3.49Å; K63-S68 PolarHBondContact O-N 3.35Å; K63-S68 PolarHBondContact O-OG 3.45Å; K63-S68 VanDerWaalsContact O-OG 3.13Å
64	W	90.3	Very high	91.3	Very high	42 Å²	42	70.6 Å²	70.6	16%	0.159	34%	0.344	C	S	.	.	H	α-helix	trans	-66.2	-50.1	172.7	168.7	62.8	0	0	0	112.2	A25 F41 V43 Y58 N60 E61 N66 K67	A25-W64 HydrophobicContact CB-CZ2 4.41Å; F41-W64 HydrophobicContact CD1-CB 3.98Å; F41-W64 HydrophobicContact CD1-CD2 4.3Å; F41-W64 HydrophobicContact CD1-CE3 4.19Å; F41-W64 HydrophobicContact CD1-CG 4.24Å; F41-W64 HydrophobicContact CE1-CB 4.2Å; F41-W64 AromaticContact CE1-CD2 3.63Å; F41-W64 HydrophobicContact CE1-CD2 3.63Å; F41-W64 AromaticContact CE1-CE3 3.27Å; F41-W64 HydrophobicContact CE1-CE3 3.27Å; F41-W64 HydrophobicContact CE1-CG 4.04Å; F41-W64 AromaticContact CE1-CZ3 3.83Å; F41-W64 HydrophobicContact CE1-CZ3 3.83Å; F41-W64 AromaticContact CZ-CE3 3.8Å; F41-W64 HydrophobicContact CZ-CE3 3.8Å; F41-W64 AromaticContact CZ-CZ3 3.95Å; F41-W64 HydrophobicContact CZ-CZ3 3.95Å; V43-W64 HydrophobicContact CG1-CZ2 4.39Å; V43-W64 HydrophobicContact CG2-CD2 4Å; V43-W64 HydrophobicContact CG2-CG 3.87Å; Y58-W64 HydrophobicContact CD1-CB 4.04Å; Y58-W64 HydrophobicContact CD2-CB 3.83Å; Y58-W64 HydrophobicContact CD2-CG 4.19Å; Y58-W64 HydrophobicContact CE1-CB 4.36Å; Y58-W64 HydrophobicContact CE2-CB 4.21Å; Y58-W64 AromaticContact CE2-CD1 3.59Å; Y58-W64 HydrophobicContact CE2-CG 4.15Å; Y58-W64 HydrophobicContact CG-CB 3.75Å; Y58-W64 AromaticContact CZ-CD1 3.68Å; N60-W64 PolarHBondContact O-N 3.05Å; E61-W64 HydrophobicContact CG-CE3 4.2Å; E61-W64 WeakPolarHBondContact O-CA 3.44Å; E61-W64 WeakPolarHBondContact O-CB 3.35Å; E61-W64 PolarHBondContact O-N 2.79Å; W64-N66 PolarHBondContact O-N 3.07Å; W64-K67 WeakPolarHBondContact O-CA 3.28Å; W64-K67 PolarHBondContact O-N 3.05Å
65	R	88.6	Confident	91.2	Very high	174 Å²	174	71.4 Å²	71.4	66%	0.657	35%	0.353	S	S	*	.	H	α-helix	trans	-57	-37.7	176.2	-70.2	-174.6	-178.4	-121.6	6.3	111.9	E61 K67	E61-R65 HydrophobicContact CG-CG 4.27Å; E61-R65 PolarHBondContact O-N 2.62Å; E61-R65 IonicContact OE1-CZ 3.89Å; E61-R65 IonicContact OE1-NE 2.81Å; E61-R65 PolarHBondContact OE1-NE 2.63Å; E61-R65 IonicContact OE1-NH2 3.01Å; E61-R65 PolarHBondContact OE1-NH2 3.31Å; R65-K67 PolarHBondContact O-N 2.78Å
66	N	91.8	Very high	90.9	Very high	125 Å²	125	71.5 Å²	71.5	67%	0.668	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	16.5	174.7	-65.5	22.6	0	0	0	113.7	K62 K63 W64 S68	K62-N66 VanDerWaalsContact O-CB 3.26Å; K62-N66 WeakPolarHBondContact O-CB 3.26Å; K62-N66 PolarHBondContact O-N 2.88Å; K62-N66 VanDerWaalsContact O-N 3.13Å; K62-N66 PolarHBondContact O-OD1 2.87Å; K62-N66 VanDerWaalsContact O-OD1 3.04Å; K63-N66 CarbonylContact O-C 3.59Å; W64-N66 PolarHBondContact O-N 3.07Å; N66-S68 PolarHBondContact O-N 2.84Å
67	K	87.2	Confident	90.3	Very high	157 Å²	157	76.3 Å²	76.3	68%	0.683	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	32.4	179.7	-59	-175.3	179.1	-177.8	0	114.7	K63 W64 R65	K63-K67 PolarHBondContact O-N 2.8Å; W64-K67 WeakPolarHBondContact O-CA 3.28Å; W64-K67 PolarHBondContact O-N 3.05Å; R65-K67 PolarHBondContact O-N 2.78Å
68	S	90.1	Very high	89.4	Confident	38 Å²	38	79 Å²	79	27%	0.266	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-64.6	160.2	173.8	-58.2	0	0	0	0	110.6	Y58 K63 N66	Y58-S68 VanDerWaalsContact CE1-O 3.29Å; Y58-S68 WeakPolarHBondContact CE1-O 3.46Å; K63-S68 WeakPolarHBondContact CD-OG 3.33Å; K63-S68 WeakPolarHBondContact O-CB 3.49Å; K63-S68 PolarHBondContact O-N 3.35Å; K63-S68 PolarHBondContact O-OG 3.45Å; K63-S68 VanDerWaalsContact O-OG 3.13Å; N66-S68 PolarHBondContact O-N 2.84Å
69	A	89.5	Confident	88.7	Confident	95 Å²	95	78.7 Å²	78.7	79%	0.785	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-58.7	141.1	174.2	0	0	0	0	0	112.3
70	A	91.8	Very high	88	Confident	31 Å²	31	78.3 Å²	78.3	26%	0.256	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-67.4	140.9	172.6	0	0	0	0	0	110.5	E56 Y58 R72 V73	E56-A70 HydrophobicContact CB-CB 4.26Å; Y58-A70 HydrophobicContact CD1-CB 4.46Å; Y58-A70 HydrophobicContact CE1-CB 3.86Å; Y58-A70 HydrophobicContact CE2-CB 4.37Å; A70-R72 PolarHBondContact O-N 2.86Å; A70-V73 HydrophobicContact CB-CG2 4.06Å
71	K	91.8	Very high	87.6	Confident	114 Å²	114	75.6 Å²	75.6	50%	0.496	39%	0.385	S	S	.	.	S	Bend	trans	-82.2	-4.2	179.4	-171.2	162.7	-175.6	159.2	0	112.8	Y57 E59	Y57-K71 HydrophobicContact CD2-CB 4.13Å; Y57-K71 HydrophobicContact CE2-CB 3.57Å; Y57-K71 HydrophobicContact CE2-CD 4.23Å; Y57-K71 HydrophobicContact CE2-CG 3.73Å; Y57-K71 PolarHBondContact O-N 3.09Å; Y57-K71 PolarHBondContact OH-O 3.28Å; E59-K71 IonicContact OE1-NZ 3.52Å
72	R	90.1	Very high	87.4	Confident	77 Å²	77	73.6 Å²	73.6	29%	0.291	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.9	152.7	159.7	-168.2	-174.3	-176.4	116.6	-44.5	107.7	E56 Y57 A70 V74 E101 F103	E56-R72 WeakPolarHBondContact CA-O 3.37Å; Y57-R72 HydrophobicContact CD1-CB 3.92Å; Y57-R72 HydrophobicContact CE1-CB 3.24Å; Y57-R72 HydrophobicContact CE1-CG 4.16Å; Y57-R72 PolarHBondContact N-O 3.23Å; A70-R72 PolarHBondContact O-N 2.86Å; R72-V74 HydrophobicContact CG-CG2 4.1Å; R72-E101 IonicContact CZ-OE1 3.93Å; R72-E101 IonicContact CZ-OE2 2.7Å; R72-E101 IonicContact NE-OE1 2.71Å; R72-E101 PolarHBondContact NE-OE1 2.92Å; R72-E101 IonicContact NH1-OE2 2.66Å; R72-E101 PolarHBondContact NH1-OE2 2.75Å; R72-E101 IonicContact NH2-OE1 3.33Å; R72-E101 PolarHBondContact NH2-OE1 3.17Å; R72-E101 IonicContact NH2-OE2 3.94Å; R72-E101 PolarHBondContact NH2-OE2 2.92Å; R72-F103 VanDerWaalsContact NH2-CD2 3.33Å
73	V	91.1	Very high	87.3	Confident	71 Å²	71	66 Å²	66	43%	0.43	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	135.1	163.9	-176.7	0	0	0	0	107	R54 E56 A70	R54-V73 HydrophobicContact CB-CG1 4.06Å; R54-V73 HydrophobicContact CG-CG1 4.28Å; E56-V73 HydrophobicContact CG-CG1 4.17Å; E56-V73 HydrophobicContact CG-CG2 4.15Å; A70-V73 HydrophobicContact CB-CG2 4.06Å
74	V	90.3	Very high	87.2	Confident	3 Å²	3	64.4 Å²	64.4	2%	0.018	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	104.5	173	-178.5	0	0	0	0	107.8	R54 L55 R72 T98	R54-V74 CarbonylContact C-O 3.29Å; R54-V74 WeakPolarHBondContact CA-O 3.42Å; L55-V74 HydrophobicContact CB-CB 4.5Å; L55-V74 PolarHBondContact N-O 3.09Å; L55-V74 PolarHBondContact O-N 3.21Å; R72-V74 HydrophobicContact CG-CG2 4.1Å; V74-T98 HydrophobicContact CG1-CG2 3.97Å
75	P	88.9	Confident	87.2	Confident	48 Å²	48	63.4 Å²	63.4	31%	0.312	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	134.9	172.5	-19.9	32.8	0	0	0	110.8	C78	P75-C78 HydrophobicContact CB-CB 4.49Å
76	L	85.9	Confident	87.2	Confident	5 Å²	5	56.8 Å²	56.8	3%	0.026	32%	0.316	C	S	.	.	S	Bend	trans	-82	-24.3	180	-61.4	-179.2	0	0	0	112.5	L44 A53 L55 C78 C79 L96 L120 L123 M124	L44-L76 HydrophobicContact CD1-CD1 3.74Å; A53-L76 HydrophobicContact CB-CB 4.21Å; A53-L76 HydrophobicContact CB-CD1 4.11Å; A53-L76 HydrophobicContact CB-CG 4.5Å; A53-L76 WeakPolarHBondContact O-CB 3.4Å; A53-L76 PolarHBondContact O-N 2.7Å; L55-L76 HydrophobicContact CB-CD2 4.41Å; L76-C78 PolarHBondContact O-N 2.83Å; L76-C79 VanDerWaalsContact O-CB 3.23Å; L76-C79 WeakPolarHBondContact O-CB 3.46Å; L76-C79 PolarHBondContact O-N 2.63Å; L76-L96 HydrophobicContact CD2-CD2 4.03Å; L76-L120 HydrophobicContact CD1-CD2 4.19Å; L76-L120 HydrophobicContact CD2-CD2 3.9Å; L76-L123 HydrophobicContact CD1-CB 3.91Å; L76-L123 HydrophobicContact CD1-CD1 4.23Å; L76-M124 HydrophobicContact CB-CG 4.18Å
77	D	81.1	Confident	87	Confident	111 Å²	111	51.4 Å²	51.4	59%	0.594	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-33.3	170.3	-51.4	27.1	0	0	0	111.1	P52	P52-D77 VanDerWaalsContact CB-CG 3.47Å; P52-D77 WeakPolarHBondContact CB-OD1 2.99Å; P52-D77 WeakPolarHBondContact CB-OD2 3.13Å
78	C	74.6	Confident	87	Confident	72 Å²	72	47.2 Å²	47.2	49%	0.486	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	0.3	176.4	-65	0	0	0	0	113.9	P75 L76 T98 K99	P75-C78 HydrophobicContact CB-CB 4.49Å; L76-C78 PolarHBondContact O-N 2.83Å; C78-T98 CarbonylContact O-C 3.43Å; C78-T98 WeakPolarHBondContact O-CA 3.47Å; C78-T98 WeakPolarHBondContact O-CB 3.47Å; C78-K99 PolarHBondContact O-N 2.75Å
79	C	79.4	Confident	86.7	Confident	8 Å²	8	52.2 Å²	52.2	5%	0.054	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	120.5	175.5	-70.7	0	0	0	0	110.7	L76 Y97 M124	L76-C79 VanDerWaalsContact O-CB 3.23Å; L76-C79 WeakPolarHBondContact O-CB 3.46Å; L76-C79 PolarHBondContact O-N 2.63Å; C79-Y97 CarbonylContact C-O 3.54Å; C79-Y97 WeakPolarHBondContact CA-O 3.11Å; C79-M124 HydrophobicContact CB-CE 3.56Å; C79-M124 HydrophobicContact CB-SD 3.61Å; C79-M124 WeakPolarHBondContact O-CE 3.28Å
80	L	77.1	Confident	86.7	Confident	68 Å²	68	49.7 Å²	49.7	36%	0.356	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	-37.3	174	-60.7	173.5	0	0	0	111.5	Y97	L80-Y97 PolarHBondContact N-O 2.92Å
81	N	84.4	Confident	86.5	Confident	22 Å²	22	56 Å²	56	12%	0.118	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	150.9	-177.7	179.3	-90.8	0	0	0	111.3	S83 Y97 Y159 V162	N81-S83 PolarHBondContact OD1-OG 2.88Å; N81-Y97 HydrophobicContact CB-CD2 4.31Å; N81-Y97 PolarHBondContact N-O 2.94Å; N81-Y97 PolarHBondContact O-N 3.18Å; N81-Y159 PolarHBondContact ND2-O 3.21Å; N81-V162 HydrophobicContact CB-CB 4.22Å; N81-V162 HydrophobicContact CB-CG2 3.65Å
82	V	88.7	Confident	86.6	Confident	9 Å²	9	54.1 Å²	54.1	6%	0.055	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	131.3	163.7	172.6	0	0	0	0	108.5	I94 A95 L96 Y117 L120 M124	V82-I94 HydrophobicContact CG1-CG2 3.78Å; V82-A95 VanDerWaalsContact CA-O 3.31Å; V82-A95 WeakPolarHBondContact CA-O 3.21Å; V82-L96 HydrophobicContact CG2-CD2 4.45Å; V82-L96 HydrophobicContact CG2-CG 4.02Å; V82-Y117 HydrophobicContact CG1-CD2 3.88Å; V82-Y117 HydrophobicContact CG1-CE2 4.05Å; V82-L120 HydrophobicContact CG1-CB 4.38Å; V82-M124 HydrophobicContact CB-SD 4.32Å; V82-M124 HydrophobicContact CG2-SD 3.42Å; V82-M124 WeakPolarHBondContact CG2-SD 3.37Å
83	S	88.5	Confident	86.7	Confident	6 Å²	6	50.5 Å²	50.5	4%	0.042	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	145.4	-178.9	-72.1	0	0	0	0	111.7	N81 A95	N81-S83 PolarHBondContact OD1-OG 2.88Å; S83-A95 PolarHBondContact N-O 3.1Å; S83-A95 PolarHBondContact O-N 3.02Å
84	K	90.9	Very high	86.9	Confident	76 Å²	76	47.1 Å²	47.1	33%	0.33	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	135.6	162.2	-56.7	175.4	-168.1	172.3	0	108.8	E114 Y117	K84-E114 WeakPolarHBondContact CE-OE2 3.23Å; K84-E114 IonicContact NZ-OE1 2.62Å; K84-E114 PolarHBondContact NZ-OE1 3.21Å; K84-E114 IonicContact NZ-OE2 3.17Å; K84-E114 PolarHBondContact NZ-OE2 2.97Å; K84-Y117 HydrophobicContact CD-CD1 4.39Å; K84-Y117 HydrophobicContact CD-CD2 4.29Å; K84-Y117 HydrophobicContact CD-CG 4.19Å; K84-Y117 HydrophobicContact CG-CD1 4.4Å; K84-Y117 HydrophobicContact CG-CD2 3.45Å; K84-Y117 VanDerWaalsContact CG-CD2 3.45Å; K84-Y117 HydrophobicContact CG-CE2 3.82Å; K84-Y117 HydrophobicContact CG-CG 3.78Å
85	R	89.3	Confident	86.9	Confident	22 Å²	22	47 Å²	47	8%	0.083	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	165.5	-177.2	-65	-66.9	166.2	-128.9	20.4	110.9	L93 A95 Q113 E161 V162	R85-L93 HydrophobicContact CB-CB 4.06Å; R85-L93 PolarHBondContact N-O 3.22Å; R85-L93 WeakPolarHBondContact O-CA 3.15Å; R85-L93 WeakPolarHBondContact O-CB 3.47Å; R85-L93 PolarHBondContact O-N 3.46Å; R85-A95 HydrophobicContact CG-CB 3.86Å; R85-Q113 PolarHBondContact O-NE2 3.43Å; R85-E161 IonicContact CZ-OE2 3.47Å; R85-E161 VanDerWaalsContact CZ-OE2 3.25Å; R85-E161 IonicContact NH1-OE2 3.76Å; R85-E161 PolarHBondContact NH1-OE2 2.82Å; R85-E161 IonicContact NH2-OE2 3.17Å; R85-E161 PolarHBondContact NH2-OE2 3.5Å; R85-V162 PolarHBondContact NE-O 3.04Å; R85-V162 PolarHBondContact NH2-O 3.42Å
86	A	89.3	Confident	87.1	Confident	34 Å²	34	44.7 Å²	44.7	28%	0.281	23%	0.232	S	C	.	.			trans	-143	133.4	172.2	0	0	0	0	0	109.4	K91	A86-K91 WeakPolarHBondContact CB-O 3.36Å
87	D	87.3	Confident	87.2	Confident	13 Å²	13	44.6 Å²	44.6	7%	0.07	23%	0.232	C	C	.	.			trans	-107.6	167.7	174	-70	-4.4	0	0	0	109.2	Q34 K89 H90 L93	Q34-D87 WeakPolarHBondContact CG-OD2 3.18Å; Q34-D87 PolarHBondContact NE2-OD2 2.92Å; D87-K89 PolarHBondContact O-N 2.82Å; D87-K89 VanDerWaalsContact O-N 3.1Å; D87-H90 PolarHBondContact N-O 3.07Å; D87-H90 PolarHBondContact O-N 3.15Å; D87-L93 HydrophobicContact CB-CD1 3.69Å; D87-L93 VanDerWaalsContact OD1-CD1 3.29Å; D87-L93 WeakPolarHBondContact OD1-CD1 3.32Å; D87-L93 WeakPolarHBondContact OD2-CD1 3.06Å
88	A	86	Confident	87.5	Confident	68 Å²	68	39.8 Å²	39.8	56%	0.562	21%	0.206	S	C	*	.	S	Bend	trans	-61	-21.4	170.5	0	0	0	0	0	112.6	D241 V243	A88-D241 HydrophobicContact CB-CB 4.09Å; A88-D241 WeakPolarHBondContact CB-OD2 3.2Å; A88-D241 PolarHBondContact N-OD2 3.3Å; A88-V243 HydrophobicContact CB-CG2 4.01Å
89	K	85.6	Confident	87.9	Confident	143 Å²	143	39.9 Å²	39.9	62%	0.622	20%	0.199	S	C	*	.	S	Bend	trans	-96.7	-26.2	-178.1	-58.8	174.6	-167.1	80.8	0	114	D87 D241	D87-K89 PolarHBondContact O-N 2.82Å; D87-K89 VanDerWaalsContact O-N 3.1Å; K89-D241 IonicContact NZ-OD1 3.67Å; K89-D241 PolarHBondContact NZ-OD1 3.46Å; K89-D241 IonicContact NZ-OD2 2.77Å; K89-D241 PolarHBondContact NZ-OD2 3.05Å; K89-D241 VanDerWaalsContact NZ-OD2 3.09Å
90	H	87.6	Confident	88.1	Confident	43 Å²	43	43.6 Å²	43.6	20%	0.199	22%	0.218	C	C	.	.			trans	-145.9	110.8	-173.1	-58.8	104	0	0	0	110.3	Q34 D87 Y92 L93 A106	Q34-H90 PolarHBondContact O-CE1 3.01Å; D87-H90 PolarHBondContact N-O 3.07Å; D87-H90 PolarHBondContact O-N 3.15Å; H90-Y92 VanDerWaalsContact C-N 3.32Å; H90-Y92 PolarHBondContact O-N 2.74Å; H90-L93 HydrophobicContact CB-CD1 4.01Å; H90-L93 HydrophobicContact CB-CD2 3.98Å; H90-L93 HydrophobicContact CB-CG 3.82Å; H90-A106 HydrophobicContact CB-CB 3.99Å
91	K	89.4	Confident	88.5	Confident	162 Å²	162	43.4 Å²	43.4	70%	0.704	22%	0.215	S	C	*	.	S	Bend	trans	-67.9	-28.8	-179.7	-65.7	-171.8	175.6	-172.5	0	114	A86	A86-K91 WeakPolarHBondContact CB-O 3.36Å
92	Y	92.8	Very high	88.8	Confident	76 Å²	76	43.5 Å²	43.5	30%	0.298	21%	0.214	S	C	.	.	S	Bend	trans	-117.3	69.4	-167.4	-52.3	-48.8	0	0	0	111.9	H90 A106 A107 E110	H90-Y92 VanDerWaalsContact C-N 3.32Å; H90-Y92 PolarHBondContact O-N 2.74Å; Y92-A106 WeakPolarHBondContact O-CA 2.98Å; Y92-A107 PolarHBondContact O-N 3.03Å; Y92-E110 HydrophobicContact CD1-CB 4Å; Y92-E110 HydrophobicContact CD1-CG 4.44Å; Y92-E110 HydrophobicContact CE1-CB 3.65Å; Y92-E110 HydrophobicContact CE1-CG 4.2Å
93	L	93.2	Very high	88.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	144.8	-179.5	-70.5	161.5	0	0	0	113.1	Q34 R85 D87 H90 V105 A106 Q113	Q34-L93 HydrophobicContact CB-CD2 3.89Å; Q34-L93 HydrophobicContact CG-CD1 4.39Å; Q34-L93 HydrophobicContact CG-CD2 3.98Å; R85-L93 HydrophobicContact CB-CB 4.06Å; R85-L93 PolarHBondContact N-O 3.22Å; R85-L93 WeakPolarHBondContact O-CA 3.15Å; R85-L93 WeakPolarHBondContact O-CB 3.47Å; R85-L93 PolarHBondContact O-N 3.46Å; D87-L93 HydrophobicContact CB-CD1 3.69Å; D87-L93 VanDerWaalsContact OD1-CD1 3.29Å; D87-L93 WeakPolarHBondContact OD1-CD1 3.32Å; D87-L93 WeakPolarHBondContact OD2-CD1 3.06Å; H90-L93 HydrophobicContact CB-CD1 4.01Å; H90-L93 HydrophobicContact CB-CD2 3.98Å; H90-L93 HydrophobicContact CB-CG 3.82Å; L93-V105 CarbonylContact C-O 3.34Å; L93-V105 WeakPolarHBondContact CA-O 3.31Å; L93-A106 HydrophobicContact CD2-CB 3.74Å; L93-Q113 PolarHBondContact O-NE2 3.29Å
94	I	93.7	Very high	89	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	120.6	166.2	-48.5	172.3	0	0	0	106.7	V82 L96 A104 V105 Q113 W116 L120	V82-I94 HydrophobicContact CG1-CG2 3.78Å; I94-L96 HydrophobicContact CG2-CD1 4.43Å; I94-A104 VanDerWaalsContact O-CA 3.31Å; I94-A104 WeakPolarHBondContact O-CA 3.38Å; I94-V105 HydrophobicContact CB-CG2 4.15Å; I94-V105 PolarHBondContact N-O 3.22Å; I94-V105 PolarHBondContact O-N 2.8Å; I94-Q113 HydrophobicContact CD1-CG 4.4Å; I94-Q113 WeakPolarHBondContact CD1-O 3.21Å; I94-Q113 HydrophobicContact CG1-CG 3.78Å; I94-W116 HydrophobicContact CD1-CB 3.28Å; I94-W116 HydrophobicContact CD1-CG 4.3Å; I94-L120 HydrophobicContact CG2-CD1 4Å
95	A	92.2	Very high	89.1	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	121.9	179.3	0	0	0	0	0	110	V82 S83 R85 Y97 Y102	V82-A95 VanDerWaalsContact CA-O 3.31Å; V82-A95 WeakPolarHBondContact CA-O 3.21Å; S83-A95 PolarHBondContact N-O 3.1Å; S83-A95 PolarHBondContact O-N 3.02Å; R85-A95 HydrophobicContact CG-CB 3.86Å; A95-Y97 HydrophobicContact CB-CD2 4.45Å; A95-Y97 HydrophobicContact CB-CE2 3.67Å; A95-Y102 HydrophobicContact CB-CD2 4.48Å; A95-Y102 HydrophobicContact CB-CE2 3.68Å
96	L	91.1	Very high	89.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	121.5	168.5	-63.8	87.4	0	0	0	108.4	L55 L76 V82 I94 F103 V105 L120	L55-L96 HydrophobicContact CD2-CD1 4.09Å; L55-L96 HydrophobicContact CD2-CD2 3.79Å; L76-L96 HydrophobicContact CD2-CD2 4.03Å; V82-L96 HydrophobicContact CG2-CD2 4.45Å; V82-L96 HydrophobicContact CG2-CG 4.02Å; I94-L96 HydrophobicContact CG2-CD1 4.43Å; L96-F103 HydrophobicContact CD1-CD1 4.22Å; L96-F103 PolarHBondContact N-O 3.39Å; L96-F103 PolarHBondContact O-N 2.72Å; L96-V105 HydrophobicContact CD1-CG2 4.43Å; L96-L120 HydrophobicContact CD1-CD1 4.29Å; L96-L120 HydrophobicContact CD2-CD1 4.44Å; L96-L120 HydrophobicContact CD2-CD2 4.13Å
97	Y	88.9	Confident	89.6	Confident	4 Å²	4	38.1 Å²	38.1	2%	0.016	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	107.9	175.5	-61.5	-82.7	0	0	0	109	C79 L80 N81 A95 Y102 V162 Q164	C79-Y97 CarbonylContact C-O 3.54Å; C79-Y97 WeakPolarHBondContact CA-O 3.11Å; L80-Y97 PolarHBondContact N-O 2.92Å; N81-Y97 HydrophobicContact CB-CD2 4.31Å; N81-Y97 PolarHBondContact N-O 2.94Å; N81-Y97 PolarHBondContact O-N 3.18Å; A95-Y97 HydrophobicContact CB-CD2 4.45Å; A95-Y97 HydrophobicContact CB-CE2 3.67Å; Y97-Y102 AromaticContact CD1-CD2 3.73Å; Y97-Y102 HydrophobicContact CD1-CD2 3.73Å; Y97-Y102 HydrophobicContact CD1-CE2 4.47Å; Y97-Y102 AromaticContact CE1-CD2 3.27Å; Y97-Y102 HydrophobicContact CE1-CD2 3.27Å; Y97-Y102 AromaticContact CE1-CE2 3.64Å; Y97-Y102 HydrophobicContact CE1-CE2 3.64Å; Y97-Y102 HydrophobicContact CE1-CG 4.31Å; Y97-Y102 AromaticContact CZ-CD2 3.84Å; Y97-Y102 AromaticContact CZ-CE2 3.74Å; Y97-V162 HydrophobicContact CD1-CG1 3.81Å; Y97-V162 HydrophobicContact CD2-CB 3.85Å; Y97-V162 HydrophobicContact CD2-CG1 3.9Å; Y97-V162 HydrophobicContact CE1-CG1 4.06Å; Y97-V162 HydrophobicContact CE2-CB 3.95Å; Y97-V162 HydrophobicContact CE2-CG1 4.14Å; Y97-V162 WeakPolarHBondContact CE2-O 3.23Å; Y97-V162 HydrophobicContact CG-CB 4.23Å; Y97-V162 HydrophobicContact CG-CG1 3.75Å; Y97-V162 PolarHBondContact OH-O 3.41Å; Y97-Q164 HydrophobicContact CE1-CB 4.2Å
98	T	87.4	Confident	89.9	Confident	9 Å²	9	41 Å²	41	6%	0.055	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-173.9	171.9	68.1	0	0	0	0	110.8	V74 C78 D100 E101 R183	V74-T98 HydrophobicContact CG1-CG2 3.97Å; C78-T98 CarbonylContact O-C 3.43Å; C78-T98 WeakPolarHBondContact O-CA 3.47Å; C78-T98 WeakPolarHBondContact O-CB 3.47Å; T98-D100 PolarHBondContact OG1-N 3.21Å; T98-E101 HydrophobicContact CG2-CG 4.36Å; T98-E101 PolarHBondContact N-O 3.07Å; T98-E101 VanDerWaalsContact N-O 3.1Å; T98-E101 WeakPolarHBondContact OG1-CG 3.31Å; T98-E101 PolarHBondContact OG1-N 2.89Å; T98-E101 PolarHBondContact OG1-O 3.2Å; T98-R183 PolarHBondContact O-NE 2.99Å; T98-R183 PolarHBondContact O-NH2 2.89Å
99	K	82.3	Confident	90.3	Very high	75 Å²	75	42.8 Å²	42.8	33%	0.326	20%	0.2	S	C	.	.	S	Bend	trans	-62.4	-40.8	170.6	-176.7	170.4	172.6	168.8	0	113.2	C78 R183 N197 E199	C78-K99 PolarHBondContact O-N 2.75Å; K99-R183 VanDerWaalsContact C-NH2 3.25Å; K99-R183 PolarHBondContact O-NH1 2.8Å; K99-R183 PolarHBondContact O-NH2 2.88Å; K99-N197 PolarHBondContact O-N 2.94Å; K99-E199 WeakPolarHBondContact CE-OE2 3.21Å; K99-E199 IonicContact NZ-OE2 2.6Å; K99-E199 PolarHBondContact NZ-OE2 2.91Å
100	D	83.9	Confident	90.6	Very high	86 Å²	86	41.9 Å²	41.9	46%	0.46	20%	0.198	S	C	.	.	S	Bend	trans	-112	-18	-168.4	-52.8	-63.3	0	0	0	114	T98 N197	T98-D100 PolarHBondContact OG1-N 3.21Å; D100-N197 WeakPolarHBondContact CA-OD1 3.43Å; D100-N197 PolarHBondContact O-OD1 3.03Å
101	E	86.9	Confident	90.9	Very high	64 Å²	64	45.4 Å²	45.4	30%	0.299	21%	0.214	S	C	.	.			trans	-138.9	169.3	-175.6	53.4	171.5	-144.5	0	0	114.4	R72 T98 R183	R72-E101 IonicContact CZ-OE1 3.93Å; R72-E101 IonicContact CZ-OE2 2.7Å; R72-E101 IonicContact NE-OE1 2.71Å; R72-E101 PolarHBondContact NE-OE1 2.92Å; R72-E101 IonicContact NH1-OE2 2.66Å; R72-E101 PolarHBondContact NH1-OE2 2.75Å; R72-E101 IonicContact NH2-OE1 3.33Å; R72-E101 PolarHBondContact NH2-OE1 3.17Å; R72-E101 IonicContact NH2-OE2 3.94Å; R72-E101 PolarHBondContact NH2-OE2 2.92Å; T98-E101 HydrophobicContact CG2-CG 4.36Å; T98-E101 PolarHBondContact N-O 3.07Å; T98-E101 VanDerWaalsContact N-O 3.1Å; T98-E101 WeakPolarHBondContact OG1-CG 3.31Å; T98-E101 PolarHBondContact OG1-N 2.89Å; T98-E101 PolarHBondContact OG1-O 3.2Å; E101-R183 VanDerWaalsContact N-NH2 3.19Å; E101-R183 PolarHBondContact O-NH2 2.91Å; E101-R183 VanDerWaalsContact O-NH2 3.15Å
102	Y	89.1	Confident	91.1	Very high	24 Å²	24	39.6 Å²	39.6	9%	0.094	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	123.5	169.7	162.7	-108.5	0	0	0	107.5	Q34 A95 Y97 A104 Q164	Q34-Y102 PolarHBondContact NE2-OH 3.39Å; A95-Y102 HydrophobicContact CB-CD2 4.48Å; A95-Y102 HydrophobicContact CB-CE2 3.68Å; Y97-Y102 AromaticContact CD1-CD2 3.73Å; Y97-Y102 HydrophobicContact CD1-CD2 3.73Å; Y97-Y102 HydrophobicContact CD1-CE2 4.47Å; Y97-Y102 AromaticContact CE1-CD2 3.27Å; Y97-Y102 HydrophobicContact CE1-CD2 3.27Å; Y97-Y102 AromaticContact CE1-CE2 3.64Å; Y97-Y102 HydrophobicContact CE1-CE2 3.64Å; Y97-Y102 HydrophobicContact CE1-CG 4.31Å; Y97-Y102 AromaticContact CZ-CD2 3.84Å; Y97-Y102 AromaticContact CZ-CE2 3.74Å; Y102-A104 HydrophobicContact CE1-CB 4.1Å; Y102-A104 HydrophobicContact CE2-CB 4.18Å; Y102-A104 WeakPolarHBondContact OH-CB 3.46Å; Y102-Q164 VanDerWaalsContact CB-OE1 3.29Å; Y102-Q164 HydrophobicContact CG-CB 4.38Å
103	F	90.6	Very high	91.2	Very high	14 Å²	14	36.8 Å²	36.8	6%	0.061	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	108.5	-176.3	-176.3	-98.2	0	0	0	110.3	F42 L55 Y57 R72 L96 V105	F42-F103 AromaticContact CE1-CE1 3.83Å; F42-F103 HydrophobicContact CE1-CE1 3.83Å; F42-F103 AromaticContact CE1-CZ 3.78Å; F42-F103 HydrophobicContact CE1-CZ 3.78Å; F42-F103 HydrophobicContact CZ-CE1 4.44Å; F42-F103 HydrophobicContact CZ-CZ 4.1Å; L55-F103 HydrophobicContact CD2-CE1 4.34Å; Y57-F103 AromaticContact CD1-CZ 3.94Å; Y57-F103 HydrophobicContact CD1-CZ 3.94Å; Y57-F103 HydrophobicContact CE1-CE2 4.11Å; Y57-F103 AromaticContact CE1-CZ 3.96Å; Y57-F103 HydrophobicContact CE1-CZ 3.96Å; R72-F103 VanDerWaalsContact NH2-CD2 3.33Å; L96-F103 HydrophobicContact CD1-CD1 4.22Å; L96-F103 PolarHBondContact N-O 3.39Å; L96-F103 PolarHBondContact O-N 2.72Å; F103-V105 HydrophobicContact CE1-CG1 3.77Å; F103-V105 HydrophobicContact CZ-CG1 4.1Å
104	A	92.1	Very high	91.2	Very high	7 Å²	7	39 Å²	39	6%	0.058	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	137.9	-178.2	0	0	0	0	0	113.3	Q34 I94 Y102	Q34-A104 HydrophobicContact CB-CB 3.9Å; Q34-A104 WeakPolarHBondContact CB-O 3.43Å; Q34-A104 HydrophobicContact CG-CB 4.3Å; Q34-A104 PolarHBondContact N-O 2.62Å; I94-A104 VanDerWaalsContact O-CA 3.31Å; I94-A104 WeakPolarHBondContact O-CA 3.38Å; Y102-A104 HydrophobicContact CE1-CB 4.1Å; Y102-A104 HydrophobicContact CE2-CB 4.18Å; Y102-A104 WeakPolarHBondContact OH-CB 3.46Å
105	V	93.4	Very high	91.2	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.012	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	135.9	178.6	-77.9	0	0	0	0	110.5	L31 K32 K33 F42 L93 I94 L96 F103	L31-V105 HydrophobicContact CB-CB 4.26Å; L31-V105 HydrophobicContact CD1-CB 4.05Å; L31-V105 HydrophobicContact CD1-CG2 3.87Å; K32-V105 CarbonylContact O-C 3.58Å; K32-V105 WeakPolarHBondContact O-CA 3.39Å; K33-V105 HydrophobicContact CG-CG1 4.32Å; F42-V105 HydrophobicContact CD1-CG1 4.48Å; F42-V105 HydrophobicContact CE1-CG1 3.61Å; F42-V105 HydrophobicContact CE2-CG1 4.02Å; F42-V105 HydrophobicContact CZ-CG1 3.34Å; L93-V105 CarbonylContact C-O 3.34Å; L93-V105 WeakPolarHBondContact CA-O 3.31Å; I94-V105 HydrophobicContact CB-CG2 4.15Å; I94-V105 PolarHBondContact N-O 3.22Å; I94-V105 PolarHBondContact O-N 2.8Å; L96-V105 HydrophobicContact CD1-CG2 4.43Å; F103-V105 HydrophobicContact CE1-CG1 3.77Å; F103-V105 HydrophobicContact CZ-CG1 4.1Å
106	A	94.8	Very high	91.3	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.008	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	121.8	175.7	0	0	0	0	0	109.6	K32 H90 Y92 L93	K32-A106 HydrophobicContact CB-CB 4.19Å; K32-A106 PolarHBondContact N-O 3.04Å; K32-A106 PolarHBondContact O-N 3.07Å; H90-A106 HydrophobicContact CB-CB 3.99Å; Y92-A106 WeakPolarHBondContact O-CA 2.98Å; L93-A106 HydrophobicContact CD2-CB 3.74Å
107	A	94.3	Very high	91.4	Very high	9 Å²	9	45 Å²	45	7%	0.074	22%	0.218	C	C	.	.			trans	-74	163	165.1	0	0	0	0	0	110.5	L31 Y92 E112 Q113	L31-A107 HydrophobicContact CD2-CB 3.99Å; Y92-A107 PolarHBondContact O-N 3.03Å; A107-E112 HydrophobicContact CB-CB 4.2Å; A107-Q113 HydrophobicContact CB-CB 3.85Å
108	E	92.1	Very high	91.6	Very high	74 Å²	74	50.9 Å²	50.9	35%	0.346	24%	0.24	S	C	.	.	S	Bend	trans	-86	-30.5	174.2	-62.9	-169.8	141.1	0	0	111.8	K32 K39 E112	K32-E108 WeakPolarHBondContact CE-OE1 3.29Å; K32-E108 IonicContact NZ-OE1 2.74Å; K32-E108 PolarHBondContact NZ-OE1 3.26Å; K39-E108 IonicContact NZ-OE1 3.18Å; K39-E108 PolarHBondContact NZ-OE1 3.12Å; K39-E108 IonicContact NZ-OE2 2.79Å; K39-E108 PolarHBondContact NZ-OE2 3.12Å; E108-E112 PolarHBondContact N-OE2 3.38Å
109	N	94	Very high	91.8	Very high	105 Å²	105	51.1 Å²	51.1	56%	0.561	24%	0.242	S	C	*	.	S	Bend	trans	-129.2	153.1	-178.3	-57.8	-22.6	0	0	0	111.7	Q111 E112 Q113	N109-Q111 PolarHBondContact O-N 2.83Å; N109-E112 HydrophobicContact CB-CB 4.16Å; N109-E112 WeakPolarHBondContact O-CA 3.08Å; N109-E112 WeakPolarHBondContact O-CB 3.26Å; N109-E112 PolarHBondContact O-N 2.9Å; N109-Q113 PolarHBondContact O-N 2.68Å
110	E	93.1	Very high	92.3	Very high	125 Å²	125	47.6 Å²	47.6	58%	0.584	23%	0.227	S	C	*	.	H	α-helix	trans	-57.4	-47	173.6	-171	178.4	166.9	0	0	112.5	Y92 E112 Q113 E114	Y92-E110 HydrophobicContact CD1-CB 4Å; Y92-E110 HydrophobicContact CD1-CG 4.44Å; Y92-E110 HydrophobicContact CE1-CB 3.65Å; Y92-E110 HydrophobicContact CE1-CG 4.2Å; E110-E112 PolarHBondContact O-N 3.12Å; E110-Q113 VanDerWaalsContact O-CB 3.32Å; E110-Q113 WeakPolarHBondContact O-CB 3.47Å; E110-Q113 PolarHBondContact O-N 2.65Å; E110-Q113 VanDerWaalsContact O-N 3.14Å; E110-E114 WeakPolarHBondContact O-CB 3.49Å; E110-E114 PolarHBondContact O-N 2.88Å
111	Q	93.3	Very high	92.5	Very high	116 Å²	116	45.8 Å²	45.8	54%	0.542	22%	0.219	S	C	.	.	H	α-helix	trans	-61.2	-29.8	175.3	-172.5	65.1	64.3	0	0	112.4	N109 N115	N109-Q111 PolarHBondContact O-N 2.83Å; Q111-N115 PolarHBondContact NE2-OD1 3.24Å; Q111-N115 WeakPolarHBondContact O-CB 3.43Å; Q111-N115 PolarHBondContact O-N 3.3Å; Q111-N115 PolarHBondContact O-ND2 3.35Å; Q111-N115 PolarHBondContact O-OD1 2.95Å
112	E	93.6	Very high	92.6	Very high	40 Å²	40	46.3 Å²	46.3	19%	0.187	22%	0.224	C	C	.	.	H	α-helix	trans	-74.2	-43.7	176	-157.3	-142.3	165.3	0	0	110.5	L31 A107 E108 N109 E110 E114 N115 W116	L31-E112 VanDerWaalsContact CD2-OE1 3.31Å; L31-E112 WeakPolarHBondContact CD2-OE1 3.48Å; A107-E112 HydrophobicContact CB-CB 4.2Å; E108-E112 PolarHBondContact N-OE2 3.38Å; N109-E112 HydrophobicContact CB-CB 4.16Å; N109-E112 WeakPolarHBondContact O-CA 3.08Å; N109-E112 WeakPolarHBondContact O-CB 3.26Å; N109-E112 PolarHBondContact O-N 2.9Å; E110-E112 PolarHBondContact O-N 3.12Å; E112-E114 VanDerWaalsContact C-N 3.31Å; E112-E114 PolarHBondContact O-N 3.18Å; E112-N115 PolarHBondContact O-N 3.08Å; E112-W116 VanDerWaalsContact O-CD1 3.23Å; E112-W116 PolarHBondContact O-N 3.17Å; E112-W116 PolarHBondContact OE1-NE1 2.76Å
113	Q	94.8	Very high	92.5	Very high	18 Å²	18	45.2 Å²	45.2	8%	0.084	22%	0.22	C	C	.	.	H	α-helix	trans	-53.9	-48	171.8	-171.7	-169.5	7.6	0	0	111.2	R85 L93 I94 A107 N109 E110 W116 Y117	R85-Q113 PolarHBondContact O-NE2 3.43Å; L93-Q113 PolarHBondContact O-NE2 3.29Å; I94-Q113 HydrophobicContact CD1-CG 4.4Å; I94-Q113 WeakPolarHBondContact CD1-O 3.21Å; I94-Q113 HydrophobicContact CG1-CG 3.78Å; A107-Q113 HydrophobicContact CB-CB 3.85Å; N109-Q113 PolarHBondContact O-N 2.68Å; E110-Q113 VanDerWaalsContact O-CB 3.32Å; E110-Q113 WeakPolarHBondContact O-CB 3.47Å; E110-Q113 PolarHBondContact O-N 2.65Å; E110-Q113 VanDerWaalsContact O-N 3.14Å; Q113-W116 PolarHBondContact O-N 2.74Å; Q113-Y117 WeakPolarHBondContact O-CB 3.41Å; Q113-Y117 PolarHBondContact O-N 2.94Å
114	E	94.1	Very high	92.1	Very high	45 Å²	45	45.8 Å²	45.8	21%	0.21	22%	0.223	C	C	.	.	H	α-helix	trans	-62.1	-45.5	177.8	-171.1	62	-123.1	0	0	112.2	K84 E110 E112 W116 Y117 R118	K84-E114 WeakPolarHBondContact CE-OE2 3.23Å; K84-E114 IonicContact NZ-OE1 2.62Å; K84-E114 PolarHBondContact NZ-OE1 3.21Å; K84-E114 IonicContact NZ-OE2 3.17Å; K84-E114 PolarHBondContact NZ-OE2 2.97Å; E110-E114 WeakPolarHBondContact O-CB 3.49Å; E110-E114 PolarHBondContact O-N 2.88Å; E112-E114 VanDerWaalsContact C-N 3.31Å; E112-E114 PolarHBondContact O-N 3.18Å; E114-W116 VanDerWaalsContact C-N 3.32Å; E114-W116 PolarHBondContact O-N 3.43Å; E114-Y117 PolarHBondContact O-N 2.91Å; E114-R118 PolarHBondContact O-N 2.85Å; E114-R118 IonicContact OE1-CZ 2.7Å; E114-R118 IonicContact OE1-NE 2.8Å; E114-R118 PolarHBondContact OE1-NE 3.09Å
115	N	94.1	Very high	91.4	Very high	66 Å²	66	48.4 Å²	48.4	35%	0.353	25%	0.245	S	C	.	.	H	α-helix	trans	-71.8	-23.2	-178.4	-71	-6.6	0	0	0	113.4	K27 Q111 E112	K27-N115 WeakPolarHBondContact CD-O 3.41Å; K27-N115 WeakPolarHBondContact CE-O 3.42Å; K27-N115 PolarHBondContact NZ-O 3.33Å; Q111-N115 PolarHBondContact NE2-OD1 3.24Å; Q111-N115 WeakPolarHBondContact O-CB 3.43Å; Q111-N115 PolarHBondContact O-N 3.3Å; Q111-N115 PolarHBondContact O-ND2 3.35Å; Q111-N115 PolarHBondContact O-OD1 2.95Å; E112-N115 PolarHBondContact O-N 3.08Å
116	W	94.3	Very high	90.1	Very high	4 Å²	4	52.2 Å²	52.2	2%	0.015	26%	0.262	C	S	.	.	H	α-helix	trans	-85.6	-39	170.4	-82.9	106.2	0	0	0	111.8	K27 L31 F42 L44 L55 I94 E112 Q113 E114 L120	K27-W116 HydrophobicContact CB-CE3 4.44Å; K27-W116 HydrophobicContact CB-CH2 4.43Å; K27-W116 HydrophobicContact CB-CZ3 4.13Å; K27-W116 HydrophobicContact CD-CD2 3.53Å; K27-W116 HydrophobicContact CD-CE3 3.59Å; K27-W116 HydrophobicContact CD-CG 3.93Å; K27-W116 HydrophobicContact CD-CH2 4.45Å; K27-W116 HydrophobicContact CD-CZ2 4.43Å; K27-W116 HydrophobicContact CD-CZ3 4.06Å; K27-W116 VanDerWaalsContact CE-CD2 3.42Å; K27-W116 VanDerWaalsContact CE-CG 3.4Å; K27-W116 HydrophobicContact CG-CD2 4.19Å; K27-W116 HydrophobicContact CG-CE3 4.09Å; K27-W116 HydrophobicContact CG-CH2 4.08Å; K27-W116 HydrophobicContact CG-CZ2 4.21Å; K27-W116 HydrophobicContact CG-CZ3 4.02Å; L31-W116 HydrophobicContact CD1-CD2 3.93Å; L31-W116 HydrophobicContact CD1-CE3 4.35Å; L31-W116 HydrophobicContact CD1-CG 4.23Å; L31-W116 HydrophobicContact CD1-CZ2 4.19Å; L31-W116 HydrophobicContact CG-CZ2 4.31Å; F42-W116 HydrophobicContact CB-CH2 3.67Å; F42-W116 HydrophobicContact CB-CZ2 4.21Å; F42-W116 HydrophobicContact CB-CZ3 4.24Å; L44-W116 HydrophobicContact CB-CZ3 4.01Å; L55-W116 HydrophobicContact CD1-CZ3 4.14Å; I94-W116 HydrophobicContact CD1-CB 3.28Å; I94-W116 HydrophobicContact CD1-CG 4.3Å; E112-W116 VanDerWaalsContact O-CD1 3.23Å; E112-W116 PolarHBondContact O-N 3.17Å; E112-W116 PolarHBondContact OE1-NE1 2.76Å; Q113-W116 PolarHBondContact O-N 2.74Å; E114-W116 VanDerWaalsContact C-N 3.32Å; E114-W116 PolarHBondContact O-N 3.43Å; W116-L120 WeakPolarHBondContact O-CB 3.48Å; W116-L120 WeakPolarHBondContact O-CG 3.42Å; W116-L120 PolarHBondContact O-N 3.35Å
117	Y	92.8	Very high	88.2	Confident	58 Å²	58	53.6 Å²	53.6	23%	0.227	28%	0.277	C	S	.	.	H	α-helix	trans	-59.8	-48.2	176.6	173.1	-88	0	0	0	111.4	V82 K84 Q113 E114 L120 T121	V82-Y117 HydrophobicContact CG1-CD2 3.88Å; V82-Y117 HydrophobicContact CG1-CE2 4.05Å; K84-Y117 HydrophobicContact CD-CD1 4.39Å; K84-Y117 HydrophobicContact CD-CD2 4.29Å; K84-Y117 HydrophobicContact CD-CG 4.19Å; K84-Y117 HydrophobicContact CG-CD1 4.4Å; K84-Y117 HydrophobicContact CG-CD2 3.45Å; K84-Y117 VanDerWaalsContact CG-CD2 3.45Å; K84-Y117 HydrophobicContact CG-CE2 3.82Å; K84-Y117 HydrophobicContact CG-CG 3.78Å; Q113-Y117 WeakPolarHBondContact O-CB 3.41Å; Q113-Y117 PolarHBondContact O-N 2.94Å; E114-Y117 PolarHBondContact O-N 2.91Å; Y117-L120 PolarHBondContact O-N 2.88Å; Y117-T121 WeakPolarHBondContact CE1-OG1 3.38Å; Y117-T121 WeakPolarHBondContact O-CB 3.45Å; Y117-T121 PolarHBondContact O-N 2.84Å; Y117-T121 PolarHBondContact O-OG1 2.87Å
118	R	92.9	Very high	86.2	Confident	127 Å²	127	58.7 Å²	58.7	48%	0.479	30%	0.297	S	S	.	.	H	α-helix	trans	-58.8	-58.4	176.9	-78.9	-171.1	-101.7	-165.6	-2	110.7	E114 L120 T121 D122	E114-R118 PolarHBondContact O-N 2.85Å; E114-R118 IonicContact OE1-CZ 2.7Å; E114-R118 IonicContact OE1-NE 2.8Å; E114-R118 PolarHBondContact OE1-NE 3.09Å; R118-L120 PolarHBondContact O-N 3.41Å; R118-T121 CarbonylContact O-C 3.6Å; R118-T121 WeakPolarHBondContact O-CA 3.48Å; R118-T121 WeakPolarHBondContact O-CB 3.41Å; R118-T121 PolarHBondContact O-N 2.92Å; R118-D122 PolarHBondContact O-N 2.91Å
119	A	92.3	Very high	83.8	Confident	13 Å²	13	60.8 Å²	60.8	11%	0.107	32%	0.315	C	S	.	.	H	α-helix	trans	-54.7	-31.7	-179.8	0	0	0	0	0	114.8	K27 L44 D122 L123	K27-A119 HydrophobicContact CD-CB 3.94Å; L44-A119 HydrophobicContact CD2-CB 3.75Å; A119-D122 PolarHBondContact N-OD2 2.88Å; A119-L123 PolarHBondContact O-N 2.96Å
120	L	91.3	Very high	80.8	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.01	32%	0.322	C	S	.	.	H	α-helix	trans	-73.5	-43.3	171.8	-77.9	166.7	0	0	0	112.9	L44 L55 L76 V82 I94 L96 W116 Y117 R118 M124	L44-L120 HydrophobicContact CD1-CD2 3.66Å; L44-L120 HydrophobicContact CD2-CD2 4.2Å; L44-L120 HydrophobicContact CD2-CG 4.22Å; L55-L120 HydrophobicContact CD2-CD2 4.42Å; L76-L120 HydrophobicContact CD1-CD2 4.19Å; L76-L120 HydrophobicContact CD2-CD2 3.9Å; V82-L120 HydrophobicContact CG1-CB 4.38Å; I94-L120 HydrophobicContact CG2-CD1 4Å; L96-L120 HydrophobicContact CD1-CD1 4.29Å; L96-L120 HydrophobicContact CD2-CD1 4.44Å; L96-L120 HydrophobicContact CD2-CD2 4.13Å; W116-L120 WeakPolarHBondContact O-CB 3.48Å; W116-L120 WeakPolarHBondContact O-CG 3.42Å; W116-L120 PolarHBondContact O-N 3.35Å; Y117-L120 PolarHBondContact O-N 2.88Å; R118-L120 PolarHBondContact O-N 3.41Å; L120-M124 WeakPolarHBondContact O-CG 3.31Å; L120-M124 PolarHBondContact O-N 2.84Å; L120-M124 VanDerWaalsContact O-N 3.08Å
121	T	89.1	Confident	78	Confident	48 Å²	48	62.1 Å²	62.1	29%	0.294	33%	0.333	S	S	.	.	H	α-helix	trans	-66.3	-41.4	178.3	-54.4	0	0	0	0	111.1	Y117 R118 M124 A125	Y117-T121 WeakPolarHBondContact CE1-OG1 3.38Å; Y117-T121 WeakPolarHBondContact O-CB 3.45Å; Y117-T121 PolarHBondContact O-N 2.84Å; Y117-T121 PolarHBondContact O-OG1 2.87Å; R118-T121 CarbonylContact O-C 3.6Å; R118-T121 WeakPolarHBondContact O-CA 3.48Å; R118-T121 WeakPolarHBondContact O-CB 3.41Å; R118-T121 PolarHBondContact O-N 2.92Å; T121-M124 CarbonylContact O-C 3.5Å; T121-M124 PolarHBondContact O-N 3.38Å; T121-A125 PolarHBondContact O-N 3.39Å
122	D	88.9	Confident	75.1	Confident	74 Å²	74	60 Å²	60	40%	0.396	34%	0.342	S	S	.	.	H	α-helix	trans	-60	-49.1	178.2	-54	-29.1	0	0	0	110	R118 A119 M124 A125 E126	R118-D122 PolarHBondContact O-N 2.91Å; A119-D122 PolarHBondContact N-OD2 2.88Å; D122-M124 VanDerWaalsContact C-N 3.32Å; D122-M124 PolarHBondContact O-N 3.04Å; D122-A125 WeakPolarHBondContact O-CB 3.3Å; D122-A125 PolarHBondContact O-N 3.3Å; D122-A125 VanDerWaalsContact O-N 3.12Å; D122-E126 WeakPolarHBondContact O-CB 3.42Å; D122-E126 VanDerWaalsContact O-CG 3.26Å; D122-E126 WeakPolarHBondContact O-CG 3.45Å; D122-E126 PolarHBondContact O-N 3.49Å
123	L	86.6	Confident	72.1	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.01	37%	0.372	C	S	.	.	H	α-helix	trans	-63.6	-33.3	175	-84	166.7	0	0	0	113.7	K26 L44 E46 P47 A53 L76 A119 A125 E126 G127	K26-L123 HydrophobicContact CB-CD1 4.27Å; K26-L123 HydrophobicContact CD-CD1 3.63Å; K26-L123 HydrophobicContact CD-CD2 4.05Å; K26-L123 HydrophobicContact CD-CG 3.63Å; L44-L123 HydrophobicContact CD1-CD1 3.5Å; L44-L123 HydrophobicContact CD2-CD1 3.87Å; L44-L123 HydrophobicContact CG-CD1 3.51Å; E46-L123 HydrophobicContact CB-CD2 4.44Å; E46-L123 HydrophobicContact CG-CD2 4.34Å; P47-L123 VanDerWaalsContact CD-CD2 3.45Å; A53-L123 HydrophobicContact CB-CD2 4.18Å; L76-L123 HydrophobicContact CD1-CB 3.91Å; L76-L123 HydrophobicContact CD1-CD1 4.23Å; A119-L123 PolarHBondContact O-N 2.96Å; L123-A125 VanDerWaalsContact C-N 3.33Å; L123-E126 WeakPolarHBondContact CD2-OE2 3.42Å; L123-G127 PolarHBondContact O-N 3.29Å
124	M	82.8	Confident	69.4	Low	26 Å²	26	67.7 Å²	67.7	13%	0.128	41%	0.409	C	S	.	.	H	α-helix	trans	-76.2	-18.5	174.8	-77.4	-173	63.1	0	0	113.9	L76 C79 V82 L120 T121 D122	L76-M124 HydrophobicContact CB-CG 4.18Å; C79-M124 HydrophobicContact CB-CE 3.56Å; C79-M124 HydrophobicContact CB-SD 3.61Å; C79-M124 WeakPolarHBondContact O-CE 3.28Å; V82-M124 HydrophobicContact CB-SD 4.32Å; V82-M124 HydrophobicContact CG2-SD 3.42Å; V82-M124 WeakPolarHBondContact CG2-SD 3.37Å; L120-M124 WeakPolarHBondContact O-CG 3.31Å; L120-M124 PolarHBondContact O-N 2.84Å; L120-M124 VanDerWaalsContact O-N 3.08Å; T121-M124 CarbonylContact O-C 3.5Å; T121-M124 PolarHBondContact O-N 3.38Å; D122-M124 VanDerWaalsContact C-N 3.32Å; D122-M124 PolarHBondContact O-N 3.04Å
125	A	78	Confident	66.7	Low	61 Å²	61	70.8 Å²	70.8	50%	0.504	44%	0.435	S	S	.	.	H	α-helix	trans	-80.8	-49.5	168	0	0	0	0	0	110.1	T121 D122 L123 G127 K128	T121-A125 PolarHBondContact O-N 3.39Å; D122-A125 WeakPolarHBondContact O-CB 3.3Å; D122-A125 PolarHBondContact O-N 3.3Å; D122-A125 VanDerWaalsContact O-N 3.12Å; L123-A125 VanDerWaalsContact C-N 3.33Å; A125-G127 PolarHBondContact O-N 2.87Å; A125-K128 PolarHBondContact O-N 2.88Å; A125-K128 VanDerWaalsContact O-N 3.12Å
126	E	64.6	Low	63.8	Low	82 Å²	82	74.6 Å²	74.6	38%	0.383	46%	0.456	S	S	.	.	H	α-helix	trans	-54.5	-48.6	177.1	-71.6	158.3	-163.7	0	0	112.1	K26 D122 L123 K128 V129	K26-E126 IonicContact NZ-OE1 2.75Å; K26-E126 PolarHBondContact NZ-OE1 2.85Å; K26-E126 IonicContact NZ-OE2 3.15Å; K26-E126 PolarHBondContact NZ-OE2 2.87Å; D122-E126 WeakPolarHBondContact O-CB 3.42Å; D122-E126 VanDerWaalsContact O-CG 3.26Å; D122-E126 WeakPolarHBondContact O-CG 3.45Å; D122-E126 PolarHBondContact O-N 3.49Å; L123-E126 WeakPolarHBondContact CD2-OE2 3.42Å; E126-K128 PolarHBondContact O-N 2.85Å; E126-K128 VanDerWaalsContact O-N 3.12Å; E126-V129 WeakPolarHBondContact O-CB 3.18Å; E126-V129 PolarHBondContact O-N 2.94Å
127	G	54.6	Low	61	Low	30 Å²	30	80.6 Å²	80.6	31%	0.309	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-22.9	179.4	0	0	0	0	0	114.6	L123 A125 V129	L123-G127 PolarHBondContact O-N 3.29Å; A125-G127 PolarHBondContact O-N 2.87Å; G127-V129 VanDerWaalsContact C-N 3.31Å
128	K	53.8	Low	58.2	Low	117 Å²	117	82.2 Å²	82.2	51%	0.509	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	2.2	177.3	-70.6	-175.8	177.5	-174.8	0	114.1	A125 E126	A125-K128 PolarHBondContact O-N 2.88Å; A125-K128 VanDerWaalsContact O-N 3.12Å; E126-K128 PolarHBondContact O-N 2.85Å; E126-K128 VanDerWaalsContact O-N 3.12Å
129	V	40.9	Very low	55.4	Low	118 Å²	118	81.7 Å²	81.7	72%	0.715	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-21.5	176.9	-175.2	0	0	0	0	111.9	E126 G127	E126-V129 WeakPolarHBondContact O-CB 3.18Å; E126-V129 PolarHBondContact O-N 2.94Å; G127-V129 VanDerWaalsContact C-N 3.31Å
130	C	31.6	Very low	52.7	Low	104 Å²	104	87 Å²	87	70%	0.703	58%	0.576	S	S	*	*	S	Bend	trans	-82.6	-24.7	-172	-62.4	0	0	0	0	115.1	G132	C130-G132 PolarHBondContact O-N 3.44Å
131	D	34.3	Very low	49.8	Very low	153 Å²	153	94.2 Å²	94.2	82%	0.818	61%	0.613	S	S	*	*	S	Bend	trans	-78.9	87.4	175.6	-80	-25.5	0	0	0	110.8	S133	D131-S133 PolarHBondContact O-N 3.43Å; D131-S133 VanDerWaalsContact O-N 3.07Å
132	G	33.1	Very low	47.3	Very low	72 Å²	72	99.1 Å²	99.1	74%	0.742	64%	0.643	S	S	*	*			trans	-72.1	94.9	-171.3	0	0	0	0	0	115.5	C130	C130-G132 PolarHBondContact O-N 3.44Å
133	S	29.7	Very low	44.4	Very low	115 Å²	115	99.3 Å²	99.3	80%	0.804	66%	0.662	S	S	*	*			trans	-154.1	140	148.7	-86.1	0	0	0	0	112.2	D131 S135	D131-S133 PolarHBondContact O-N 3.43Å; D131-S133 VanDerWaalsContact O-N 3.07Å; S133-S135 PolarHBondContact O-N 3.23Å
134	A	38.4	Very low	42	Very low	104 Å²	104	109.1 Å²	109.1	86%	0.86	71%	0.706	S	S	*	*	S	Bend	trans	-67.1	119.1	-165.5	0	0	0	0	0	113.7
135	S	37.5	Very low	39.6	Very low	110 Å²	110	113.6 Å²	113.6	77%	0.769	73%	0.73	S	S	*	*			trans	-159.8	-23.3	164.8	-80.7	0	0	0	0	115.2	S133	S133-S135 PolarHBondContact O-N 3.23Å
136	N	31.8	Very low	38.1	Very low	147 Å²	147	118.4 Å²	118.4	79%	0.786	74%	0.742	S	S	*	*	S	Bend	trans	-91.6	-4.1	-168.9	-65.3	-20.8	0	0	0	115.7
137	S	35.9	Very low	36.9	Very low	129 Å²	129	119.4 Å²	119.4	90%	0.902	76%	0.758	S	S	*	*	S	Bend	trans	-100.9	31.4	-171.6	-54.4	0	0	0	0	114.7
138	A	34.8	Very low	35.9	Very low	93 Å²	93	123.4 Å²	123.4	77%	0.769	78%	0.782	S	S	*	*	S	Bend	trans	-155.5	63	179.1	0	0	0	0	0	115.3
139	S	33.8	Very low	35.1	Very low	116 Å²	116	129.5 Å²	129.5	81%	0.811	80%	0.803	S	S	*	*			trans	-169.4	72.5	148.2	-157.1	0	0	0	0	112.9
140	S	34.5	Very low	34.5	Very low	125 Å²	125	126.6 Å²	126.6	87%	0.874	80%	0.797	S	S	*	*	S	Bend	trans	-125.9	36.2	164.7	-173.5	0	0	0	0	111.2
141	L	31.4	Very low	34.7	Very low	152 Å²	152	128.1 Å²	128.1	80%	0.796	80%	0.803	S	S	*	*	S	Bend	trans	-142.8	139.5	170.6	-145.4	74.5	0	0	0	109.5	G143	L141-G143 PolarHBondContact O-N 3.41Å
142	V	36.9	Very low	34.6	Very low	151 Å²	151	128.1 Å²	128.1	92%	0.915	80%	0.801	S	S	*	*			trans	-45.9	120.2	-174.6	-80.3	0	0	0	0	114.4
143	G	27.7	Very low	34.5	Very low	78 Å²	78	128.9 Å²	128.9	80%	0.804	79%	0.792	S	S	*	*			trans	-154.4	142.5	175.1	0	0	0	0	0	111.7	L141	L141-G143 PolarHBondContact O-N 3.41Å
144	F	36.1	Very low	34.9	Very low	209 Å²	209	125.5 Å²	125.5	92%	0.917	77%	0.767	S	S	*	*			trans	-115.3	110.8	-175.2	-178.4	-79.3	0	0	0	109.9
145	D	31.5	Very low	35.1	Very low	120 Å²	120	124.3 Å²	124.3	64%	0.642	75%	0.748	S	S	*	*			trans	-147	142.7	159	-170.5	10.1	0	0	0	110.2	S147	D145-S147 PolarHBondContact OD1-N 2.78Å; D145-S147 VanDerWaalsContact OD1-N 3.12Å; D145-S147 PolarHBondContact OD1-OG 2.94Å
146	E	48.2	Very low	35.3	Very low	161 Å²	161	122.7 Å²	122.7	75%	0.752	74%	0.742	S	S	*	*			trans	-146.7	61.3	175.5	-169.7	176.2	125.3	0	0	108.3	R189	E146-R189 IonicContact OE2-NH1 2.72Å
147	S	38.5	Very low	36.2	Very low	103 Å²	103	118.1 Å²	118.1	72%	0.72	73%	0.725	S	S	*	*			trans	-152.9	17.8	-178.2	64.9	0	0	0	0	118.4	D145	D145-S147 PolarHBondContact OD1-N 2.78Å; D145-S147 VanDerWaalsContact OD1-N 3.12Å; D145-S147 PolarHBondContact OD1-OG 2.94Å
148	S	33.1	Very low	37.4	Very low	115 Å²	115	116.3 Å²	116.3	80%	0.804	72%	0.718	S	S	*	*			trans	-119	130.7	176.2	-165.8	0	0	0	0	114.3	G150	S148-G150 PolarHBondContact O-N 2.89Å
149	Y	38.2	Very low	39.5	Very low	245 Å²	245	113.3 Å²	113.3	96%	0.961	69%	0.686	S	S	*	*			trans	-101	75.9	-171.2	-150.1	-92.8	0	0	0	110.8
150	G	28.1	Very low	41.9	Very low	57 Å²	57	113.3 Å²	113.3	59%	0.588	67%	0.672	S	S	*	*			trans	-120.3	134	179.6	0	0	0	0	0	112.4	S148 I152	S148-G150 PolarHBondContact O-N 2.89Å; G150-I152 VanDerWaalsContact C-N 3.33Å; G150-I152 PolarHBondContact O-N 3.09Å
151	V	34.5	Very low	44.5	Very low	136 Å²	136	108.7 Å²	108.7	82%	0.824	64%	0.637	S	S	*	*			trans	-78.8	81.1	-179.5	-174.7	0	0	0	0	110.4	T153	V151-T153 PolarHBondContact O-N 2.98Å
152	I	32.5	Very low	47.3	Very low	153 Å²	153	101.6 Å²	101.6	79%	0.785	60%	0.6	S	S	*	*			trans	-76	99.2	163.6	-57	177.6	0	0	0	107.4	G150 P154	G150-I152 VanDerWaalsContact C-N 3.33Å; G150-I152 PolarHBondContact O-N 3.09Å; I152-P154 WeakPolarHBondContact O-CD 3.39Å
153	T	30.5	Very low	50	Low	88 Å²	88	94.6 Å²	94.6	54%	0.54	56%	0.557	S	S	.	*			trans	-60.5	116.7	177.2	-46.3	0	0	0	0	109.7	V151 V155	V151-T153 PolarHBondContact O-N 2.98Å; T153-V155 HydrophobicContact CG2-CG2 3.87Å; T153-V155 PolarHBondContact O-N 3.18Å
154	P	39.6	Very low	53.1	Low	44 Å²	44	92.8 Å²	92.8	29%	0.286	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	57.4	-167.4	34.4	-37.1	0	0	0	112.6	I152 A157 Y159	I152-P154 WeakPolarHBondContact O-CD 3.39Å; P154-A157 HydrophobicContact CB-CB 4.37Å; P154-Y159 PolarHBondContact O-OH 3.44Å
155	V	41.6	Very low	55.9	Low	78 Å²	78	83 Å²	83	47%	0.473	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-36.8	173.2	-170.1	0	0	0	0	110.8	T153	T153-V155 HydrophobicContact CG2-CG2 3.87Å; T153-V155 PolarHBondContact O-N 3.18Å
156	A	43.1	Very low	58.9	Low	77 Å²	77	80 Å²	80	64%	0.636	47%	0.469	S	S	*	.	S	Bend	trans	-101.1	-11.1	-176.8	0	0	0	0	0	114.8	A158	A156-A158 PolarHBondContact O-N 2.78Å
157	A	49.2	Very low	61.1	Low	51 Å²	51	72.5 Å²	72.5	42%	0.421	43%	0.434	S	S	.	.	S	Bend	trans	-63.8	108.4	173	0	0	0	0	0	109.1	P154 Y159	P154-A157 HydrophobicContact CB-CB 4.37Å; A157-Y159 PolarHBondContact O-N 3.1Å
158	A	61.3	Low	63.9	Low	91 Å²	91	70.3 Å²	70.3	75%	0.752	41%	0.411	S	S	*	.			trans	-62.9	102.2	-172.3	0	0	0	0	0	111.2	A156 K160	A156-A158 PolarHBondContact O-N 2.78Å; A158-K160 PolarHBondContact O-N 3.33Å
159	Y	78.8	Confident	66.7	Low	29 Å²	29	68.7 Å²	68.7	11%	0.114	40%	0.4	C	S	.	.			trans	-57.6	126.1	171.3	-62.1	-74.5	0	0	0	109	N81 P154 A157 E161 V162 C185 L186	N81-Y159 PolarHBondContact ND2-O 3.21Å; P154-Y159 PolarHBondContact O-OH 3.44Å; A157-Y159 PolarHBondContact O-N 3.1Å; Y159-E161 PolarHBondContact O-N 3.3Å; Y159-V162 HydrophobicContact CG-CG2 4.46Å; Y159-C185 HydrophobicContact CD1-CB 3.43Å; Y159-C185 VanDerWaalsContact CD1-CB 3.43Å; Y159-C185 HydrophobicContact CD2-CB 3.94Å; Y159-C185 HydrophobicContact CE1-CB 3.54Å; Y159-C185 HydrophobicContact CE2-CB 4.07Å; Y159-C185 HydrophobicContact CG-CB 3.64Å; Y159-L186 CarbonylContact C-O 3.55Å; Y159-L186 WeakPolarHBondContact CA-O 3.49Å
160	K	84.6	Confident	69.3	Low	116 Å²	116	63.1 Å²	63.1	50%	0.504	38%	0.377	S	S	.	.	S	Bend	trans	-52.8	-44.2	176.2	-172.4	-161.4	176.2	-168.9	0	108.9	A158 L186 E254	A158-K160 PolarHBondContact O-N 3.33Å; K160-L186 PolarHBondContact N-O 3.3Å; K160-E254 IonicContact NZ-OE1 3.14Å; K160-E254 PolarHBondContact NZ-OE1 3.21Å
161	E	88.9	Confident	72.3	Confident	29 Å²	29	62.4 Å²	62.4	14%	0.136	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	144.8	-176	-71	-160.7	-127.7	0	0	112.2	R85 Y159 W163 L186 T251	R85-E161 IonicContact CZ-OE2 3.47Å; R85-E161 VanDerWaalsContact CZ-OE2 3.25Å; R85-E161 IonicContact NH1-OE2 3.76Å; R85-E161 PolarHBondContact NH1-OE2 2.82Å; R85-E161 IonicContact NH2-OE2 3.17Å; R85-E161 PolarHBondContact NH2-OE2 3.5Å; Y159-E161 PolarHBondContact O-N 3.3Å; E161-W163 HydrophobicContact CB-CH2 3.56Å; E161-W163 HydrophobicContact CB-CZ2 3.93Å; E161-W163 HydrophobicContact CB-CZ3 3.91Å; E161-W163 HydrophobicContact CG-CH2 4.45Å; E161-W163 WeakPolarHBondContact OE2-CZ2 3.21Å; E161-L186 PolarHBondContact N-O 3.27Å; E161-L186 PolarHBondContact O-N 2.87Å; E161-T251 HydrophobicContact CG-CG2 4.49Å; E161-T251 WeakPolarHBondContact OE1-CG2 3.43Å
162	V	91.6	Very high	75.1	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.018	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	144.9	174.2	-179.2	0	0	0	0	109.5	N81 R85 Y97 Y159 R183 L184 C185	N81-V162 HydrophobicContact CB-CB 4.22Å; N81-V162 HydrophobicContact CB-CG2 3.65Å; R85-V162 PolarHBondContact NE-O 3.04Å; R85-V162 PolarHBondContact NH2-O 3.42Å; Y97-V162 HydrophobicContact CD1-CG1 3.81Å; Y97-V162 HydrophobicContact CD2-CB 3.85Å; Y97-V162 HydrophobicContact CD2-CG1 3.9Å; Y97-V162 HydrophobicContact CE1-CG1 4.06Å; Y97-V162 HydrophobicContact CE2-CB 3.95Å; Y97-V162 HydrophobicContact CE2-CG1 4.14Å; Y97-V162 WeakPolarHBondContact CE2-O 3.23Å; Y97-V162 HydrophobicContact CG-CB 4.23Å; Y97-V162 HydrophobicContact CG-CG1 3.75Å; Y97-V162 PolarHBondContact OH-O 3.41Å; Y159-V162 HydrophobicContact CG-CG2 4.46Å; V162-R183 HydrophobicContact CG1-CB 4.11Å; V162-L184 WeakPolarHBondContact CA-O 3.33Å; V162-C185 HydrophobicContact CG2-CB 4.31Å
163	W	92.5	Very high	77.8	Confident	3 Å²	3	49.1 Å²	49.1	1%	0.011	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	148.5	168.7	-55.1	-98.6	0	0	0	110	E161 V165 R183 L184 L186 I248 T251	E161-W163 HydrophobicContact CB-CH2 3.56Å; E161-W163 HydrophobicContact CB-CZ2 3.93Å; E161-W163 HydrophobicContact CB-CZ3 3.91Å; E161-W163 HydrophobicContact CG-CH2 4.45Å; E161-W163 WeakPolarHBondContact OE2-CZ2 3.21Å; W163-V165 HydrophobicContact CB-CG1 4.34Å; W163-R183 CarbonylContact O-C 3.58Å; W163-R183 VanDerWaalsContact O-CA 3.3Å; W163-R183 WeakPolarHBondContact O-CA 3.11Å; W163-L184 HydrophobicContact CE3-CB 4.43Å; W163-L184 HydrophobicContact CE3-CD2 3.94Å; W163-L184 HydrophobicContact CE3-CG 4.15Å; W163-L184 HydrophobicContact CZ3-CD2 4.43Å; W163-L184 PolarHBondContact N-O 3Å; W163-L184 PolarHBondContact O-N 2.8Å; W163-L186 HydrophobicContact CH2-CB 4.29Å; W163-L186 HydrophobicContact CH2-CD2 3.97Å; W163-L186 HydrophobicContact CZ3-CB 3.81Å; W163-L186 HydrophobicContact CZ3-CD2 4.3Å; W163-I248 HydrophobicContact CB-CD1 4.09Å; W163-I248 HydrophobicContact CB-CG1 4.3Å; W163-I248 VanDerWaalsContact CD1-CG1 3.43Å; W163-I248 HydrophobicContact CD2-CD1 4.49Å; W163-I248 HydrophobicContact CD2-CG1 3.75Å; W163-I248 HydrophobicContact CG-CD1 3.92Å; W163-I248 HydrophobicContact CG-CG1 3.61Å; W163-I248 HydrophobicContact CZ2-CG1 4.38Å; W163-T251 HydrophobicContact CH2-CG2 3.68Å; W163-T251 HydrophobicContact CZ2-CG2 3.91Å
164	Q	93.3	Very high	80.7	Confident	41 Å²	41	50 Å²	50	19%	0.192	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	128.8	167.9	-173.6	-179.3	-102.9	0	0	108.4	Y97 Y102 V181	Y97-Q164 HydrophobicContact CE1-CB 4.2Å; Y102-Q164 VanDerWaalsContact CB-OE1 3.29Å; Y102-Q164 HydrophobicContact CG-CB 4.38Å; Q164-V181 HydrophobicContact CG-CG1 3.57Å
165	V	93.8	Very high	83.2	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.018	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	150.9	-175	-65	0	0	0	0	110.9	W163 Y182 L184 M237 I248	W163-V165 HydrophobicContact CB-CG1 4.34Å; V165-Y182 PolarHBondContact N-O 2.96Å; V165-Y182 PolarHBondContact O-N 2.71Å; V165-Y182 VanDerWaalsContact O-O 3.09Å; V165-L184 HydrophobicContact CG1-CB 4.38Å; V165-L184 HydrophobicContact CG1-CD2 4.45Å; V165-L184 HydrophobicContact CG2-CB 3.9Å; V165-M237 HydrophobicContact CB-CB 4.15Å; V165-M237 HydrophobicContact CB-CG 4.02Å; V165-M237 HydrophobicContact CB-SD 4.15Å; V165-M237 HydrophobicContact CG1-CG 4.27Å; V165-M237 HydrophobicContact CG1-SD 4.27Å; V165-M237 HydrophobicContact CG2-CB 4.31Å; V165-M237 HydrophobicContact CG2-CG 4.23Å; V165-M237 HydrophobicContact CG2-SD 3.77Å; V165-I248 HydrophobicContact CG1-CD1 4.08Å
166	N	95	Very high	85.4	Confident	58 Å²	58	54.6 Å²	54.6	31%	0.31	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	95.5	177.7	-173	-22.4	0	0	0	109.9	K168 G180 M237 Q238	N166-K168 PolarHBondContact O-N 3.14Å; N166-G180 CarbonylContact C-O 3.6Å; N166-G180 WeakPolarHBondContact CA-O 3.3Å; N166-M237 CarbonylContact O-C 3.58Å; N166-M237 WeakPolarHBondContact O-CA 3.29Å; N166-Q238 HydrophobicContact CB-CB 4.37Å; N166-Q238 PolarHBondContact N-O 2.81Å; N166-Q238 PolarHBondContact O-N 2.91Å
167	L	95	Very high	87.6	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.01	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	128.2	177.3	-96	166.5	0	0	0	110.6	L178 T179 G180 Y182 F193 L235 M237	L167-L178 WeakPolarHBondContact CB-O 3.37Å; L167-L178 HydrophobicContact CD1-CB 4.44Å; L167-T179 WeakPolarHBondContact O-CA 3.44Å; L167-G180 PolarHBondContact N-O 3.15Å; L167-G180 PolarHBondContact O-N 3.37Å; L167-Y182 HydrophobicContact CB-CD2 4Å; L167-Y182 HydrophobicContact CB-CE2 4.3Å; L167-Y182 HydrophobicContact CD1-CD1 4.33Å; L167-Y182 HydrophobicContact CD1-CD2 3.62Å; L167-Y182 HydrophobicContact CD1-CE2 4.01Å; L167-Y182 HydrophobicContact CD1-CG 3.82Å; L167-Y182 HydrophobicContact CG-CD2 4.31Å; L167-F193 HydrophobicContact CD1-CD1 3.62Å; L167-F193 HydrophobicContact CD1-CE1 3.91Å; L167-F193 HydrophobicContact CD1-CG 4.35Å; L167-F193 HydrophobicContact CD2-CE1 4.44Å; L167-F193 HydrophobicContact CG-CD1 4.48Å; L167-F193 HydrophobicContact CG-CE1 4.36Å; L167-L235 HydrophobicContact CD2-CB 4.28Å; L167-L235 HydrophobicContact CD2-CD2 4.1Å; L167-M237 HydrophobicContact CD2-CB 4.05Å; L167-M237 HydrophobicContact CD2-CE 4.44Å; L167-M237 HydrophobicContact CG-CB 4.13Å
168	K	95.9	Very high	89.5	Confident	58 Å²	58	55 Å²	55	25%	0.252	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	153.7	-176.1	-60.6	-57.5	-175.8	-175.1	0	111.9	N166 R170 G173 F219 W236	N166-K168 PolarHBondContact O-N 3.14Å; K168-R170 PolarHBondContact O-N 3.15Å; K168-G173 WeakPolarHBondContact O-CA 3.4Å; K168-F219 HydrophobicContact CG-CE1 4.22Å; K168-W236 PolarHBondContact N-O 3.14Å
169	S	92.7	Very high	91	Very high	80 Å²	80	53.5 Å²	53.5	56%	0.559	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	52.6	172.3	47.5	0	0	0	0	113.1	Q174	S169-Q174 VanDerWaalsContact CB-OE1 3.26Å
170	R	92.8	Very high	91.7	Very high	128 Å²	128	53.5 Å²	53.5	48%	0.483	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	137.6	179.7	-177.6	175.4	175.8	-167.3	-3.7	110	K168 L172 G173 W236	K168-R170 PolarHBondContact O-N 3.15Å; R170-L172 PolarHBondContact O-N 2.95Å; R170-G173 PolarHBondContact O-N 3.29Å; R170-W236 HydrophobicContact CB-CB 4.26Å; R170-W236 HydrophobicContact CB-CG 4.38Å; R170-W236 HydrophobicContact CG-CG 4.14Å; R170-W236 VanDerWaalsContact CZ-CZ2 3.46Å
171	G	91.8	Very high	92.1	Very high	43 Å²	43	50.4 Å²	50.4	44%	0.443	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	58.1	-125.7	-178.4	0	0	0	0	0	111.9	G173 Q174 S175	G171-G173 PolarHBondContact O-N 2.87Å; G171-Q174 PolarHBondContact O-N 3.44Å; G171-Q174 VanDerWaalsContact O-N 3.14Å; G171-S175 PolarHBondContact O-N 3.01Å
172	L	92	Very high	92.3	Very high	10 Å²	10	49.5 Å²	49.5	5%	0.052	27%	0.27	C	S	.	.	H	α-helix	trans	-63.1	-23.3	177.2	-67.3	178.5	0	0	0	113.2	R170 Q174 R176 V224 I230 E234 L235	R170-L172 PolarHBondContact O-N 2.95Å; L172-Q174 VanDerWaalsContact C-N 3.3Å; L172-Q174 PolarHBondContact O-N 2.79Å; L172-R176 WeakPolarHBondContact O-CB 3.45Å; L172-R176 PolarHBondContact O-N 3.17Å; L172-R176 VanDerWaalsContact O-N 3.14Å; L172-V224 HydrophobicContact CD1-CG2 3.4Å; L172-V224 VanDerWaalsContact CD1-CG2 3.4Å; L172-I230 HydrophobicContact CB-CG2 4.48Å; L172-I230 HydrophobicContact CD1-CB 4.34Å; L172-I230 HydrophobicContact CD1-CG2 4.05Å; L172-I230 HydrophobicContact CD2-CG2 4.09Å; L172-I230 HydrophobicContact CG-CG2 4.44Å; L172-E234 PolarHBondContact N-O 2.86Å; L172-L235 HydrophobicContact CB-CD2 3.6Å; L172-L235 HydrophobicContact CB-CG 3.99Å; L172-L235 HydrophobicContact CD1-CG 4.31Å
173	G	90.5	Very high	92.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.8	-42.1	172.5	0	0	0	0	0	112.3	K168 R170 G171 N177 L178 T179	K168-G173 WeakPolarHBondContact O-CA 3.4Å; R170-G173 PolarHBondContact O-N 3.29Å; G171-G173 PolarHBondContact O-N 2.87Å; G173-N177 CarbonylContact O-C 3.59Å; G173-N177 WeakPolarHBondContact O-CA 3.38Å; G173-N177 PolarHBondContact O-N 2.81Å; G173-L178 WeakPolarHBondContact CA-O 3.48Å; G173-L178 PolarHBondContact O-N 2.77Å; G173-T179 WeakPolarHBondContact O-CG2 3.36Å
174	Q	91.6	Very high	92.4	Very high	107 Å²	107	49.2 Å²	49.2	50%	0.5	27%	0.269	S	S	.	.	H	α-helix	trans	-80	-47.6	176.9	-173.9	58.8	35.3	0	0	112.3	S169 G171 L172 R176 N177	S169-Q174 VanDerWaalsContact CB-OE1 3.26Å; G171-Q174 PolarHBondContact O-N 3.44Å; G171-Q174 VanDerWaalsContact O-N 3.14Å; L172-Q174 VanDerWaalsContact C-N 3.3Å; L172-Q174 PolarHBondContact O-N 2.79Å; Q174-R176 PolarHBondContact O-N 3.43Å; Q174-R176 VanDerWaalsContact O-N 3.15Å; Q174-N177 PolarHBondContact O-N 2.96Å
175	S	91.1	Very high	92.3	Very high	82 Å²	82	47.5 Å²	47.5	57%	0.573	26%	0.261	S	S	*	.	H	α-helix	trans	-70.5	-12.3	-173.4	66.8	0	0	0	0	114.5	G171	G171-S175 PolarHBondContact O-N 3.01Å
176	R	87.9	Confident	92.3	Very high	135 Å²	135	47.4 Å²	47.4	51%	0.509	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.4	8.4	177.2	-59.8	-71.3	-164.7	176.6	1.6	113.7	L172 Q174 L178 I230	L172-R176 WeakPolarHBondContact O-CB 3.45Å; L172-R176 PolarHBondContact O-N 3.17Å; L172-R176 VanDerWaalsContact O-N 3.14Å; Q174-R176 PolarHBondContact O-N 3.43Å; Q174-R176 VanDerWaalsContact O-N 3.15Å; R176-L178 HydrophobicContact CB-CD1 3.76Å; R176-L178 HydrophobicContact CB-CG 3.82Å; R176-L178 PolarHBondContact O-N 3.14Å; R176-I230 HydrophobicContact CG-CG2 3.57Å; R176-I230 PolarHBondContact NE-O 3.26Å; R176-I230 VanDerWaalsContact NE-O 3.14Å; R176-I230 PolarHBondContact NH2-O 3.02Å
177	N	89.9	Confident	92.1	Very high	123 Å²	123	46 Å²	46	66%	0.658	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	31.3	-177.1	-55	-54.9	0	0	0	114.1	G173 Q174 T179	G173-N177 CarbonylContact O-C 3.59Å; G173-N177 WeakPolarHBondContact O-CA 3.38Å; G173-N177 PolarHBondContact O-N 2.81Å; Q174-N177 PolarHBondContact O-N 2.96Å; N177-T179 PolarHBondContact O-N 2.88Å; N177-T179 VanDerWaalsContact O-N 3.17Å
178	L	89.6	Confident	91.8	Very high	13 Å²	13	50.2 Å²	50.2	7%	0.068	29%	0.285	C	S	.	.			trans	-88.4	76.7	178.6	-59.9	169.1	0	0	0	108.8	L167 G173 R176 V203 L235	L167-L178 WeakPolarHBondContact CB-O 3.37Å; L167-L178 HydrophobicContact CD1-CB 4.44Å; G173-L178 WeakPolarHBondContact CA-O 3.48Å; G173-L178 PolarHBondContact O-N 2.77Å; R176-L178 HydrophobicContact CB-CD1 3.76Å; R176-L178 HydrophobicContact CB-CG 3.82Å; R176-L178 PolarHBondContact O-N 3.14Å; L178-V203 HydrophobicContact CD1-CG2 3.66Å; L178-V203 HydrophobicContact CD2-CG2 3.77Å; L178-V203 HydrophobicContact CG-CG2 4.37Å; L178-L235 HydrophobicContact CD1-CD2 4.04Å
179	T	92.4	Very high	91.5	Very high	61 Å²	61	54.9 Å²	54.9	37%	0.374	30%	0.301	S	S	.	.			trans	-132.8	143.8	-174.2	59.8	0	0	0	0	112.5	L167 G173 N177	L167-T179 WeakPolarHBondContact O-CA 3.44Å; G173-T179 WeakPolarHBondContact O-CG2 3.36Å; N177-T179 PolarHBondContact O-N 2.88Å; N177-T179 VanDerWaalsContact O-N 3.17Å
180	G	92.9	Very high	91.5	Very high	28 Å²	28	53.4 Å²	53.4	29%	0.289	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	104.7	-158.3	-179.5	0	0	0	0	0	113.1	N166 L167 Y182	N166-G180 CarbonylContact C-O 3.6Å; N166-G180 WeakPolarHBondContact CA-O 3.3Å; L167-G180 PolarHBondContact N-O 3.15Å; L167-G180 PolarHBondContact O-N 3.37Å; G180-Y182 WeakPolarHBondContact O-CD2 2.98Å
181	V	93.5	Very high	91.6	Very high	52 Å²	52	47.3 Å²	47.3	32%	0.315	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	125.3	-174.4	-173.6	0	0	0	0	111.5	Q164 L196	Q164-V181 HydrophobicContact CG-CG1 3.57Å; V181-L196 HydrophobicContact CB-CB 4.21Å; V181-L196 HydrophobicContact CB-CD2 4.36Å; V181-L196 HydrophobicContact CG1-CB 4.21Å; V181-L196 HydrophobicContact CG1-CD1 4.14Å; V181-L196 HydrophobicContact CG1-CD2 4.25Å; V181-L196 HydrophobicContact CG1-CG 4.44Å; V181-L196 PolarHBondContact O-N 3.14Å
182	Y	93	Very high	91.7	Very high	9 Å²	9	45.2 Å²	45.2	4%	0.035	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	156.2	175.1	-70.8	-105.6	0	0	0	110	V165 L167 G180 F193 V194 K195	V165-Y182 PolarHBondContact N-O 2.96Å; V165-Y182 PolarHBondContact O-N 2.71Å; V165-Y182 VanDerWaalsContact O-O 3.09Å; L167-Y182 HydrophobicContact CB-CD2 4Å; L167-Y182 HydrophobicContact CB-CE2 4.3Å; L167-Y182 HydrophobicContact CD1-CD1 4.33Å; L167-Y182 HydrophobicContact CD1-CD2 3.62Å; L167-Y182 HydrophobicContact CD1-CE2 4.01Å; L167-Y182 HydrophobicContact CD1-CG 3.82Å; L167-Y182 HydrophobicContact CG-CD2 4.31Å; G180-Y182 WeakPolarHBondContact O-CD2 2.98Å; Y182-F193 HydrophobicContact CD1-CB 4.03Å; Y182-V194 CarbonylContact C-O 2.82Å; Y182-V194 WeakPolarHBondContact CA-O 3.48Å; Y182-K195 VanDerWaalsContact CD1-CA 3.44Å; Y182-K195 HydrophobicContact CD1-CB 3.87Å; Y182-K195 HydrophobicContact CD1-CG 4.35Å; Y182-K195 HydrophobicContact CE1-CB 3.61Å; Y182-K195 HydrophobicContact CE1-CD 4.5Å; Y182-K195 HydrophobicContact CE1-CG 3.94Å; Y182-K195 HydrophobicContact CE2-CG 4.49Å
183	R	91.9	Very high	91.7	Very high	1 Å²	1	44.8 Å²	44.8	0%	0.004	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	120.4	162.1	-59.8	-174.6	-175.3	87.5	1.5	108.2	T98 K99 E101 V162 W163 F193 V194	T98-R183 PolarHBondContact O-NE 2.99Å; T98-R183 PolarHBondContact O-NH2 2.89Å; K99-R183 VanDerWaalsContact C-NH2 3.25Å; K99-R183 PolarHBondContact O-NH1 2.8Å; K99-R183 PolarHBondContact O-NH2 2.88Å; E101-R183 VanDerWaalsContact N-NH2 3.19Å; E101-R183 PolarHBondContact O-NH2 2.91Å; E101-R183 VanDerWaalsContact O-NH2 3.15Å; V162-R183 HydrophobicContact CG1-CB 4.11Å; W163-R183 CarbonylContact O-C 3.58Å; W163-R183 VanDerWaalsContact O-CA 3.3Å; W163-R183 WeakPolarHBondContact O-CA 3.11Å; R183-F193 WeakPolarHBondContact O-CA 3.4Å; R183-V194 HydrophobicContact CB-CB 4.43Å; R183-V194 PolarHBondContact N-O 3.37Å; R183-V194 PolarHBondContact O-N 3.11Å
184	L	93.4	Very high	91.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	107.8	170.5	-179.2	73.2	0	0	0	106.8	V162 W163 V165 I191 F193 F220 M237 I248 I252	V162-L184 WeakPolarHBondContact CA-O 3.33Å; W163-L184 HydrophobicContact CE3-CB 4.43Å; W163-L184 HydrophobicContact CE3-CD2 3.94Å; W163-L184 HydrophobicContact CE3-CG 4.15Å; W163-L184 HydrophobicContact CZ3-CD2 4.43Å; W163-L184 PolarHBondContact N-O 3Å; W163-L184 PolarHBondContact O-N 2.8Å; V165-L184 HydrophobicContact CG1-CB 4.38Å; V165-L184 HydrophobicContact CG1-CD2 4.45Å; V165-L184 HydrophobicContact CG2-CB 3.9Å; L184-I191 HydrophobicContact CD1-CG2 3.42Å; L184-I191 VanDerWaalsContact CD1-CG2 3.42Å; L184-I191 HydrophobicContact CG-CG2 4.38Å; L184-F193 HydrophobicContact CD1-CD1 4.06Å; L184-F193 HydrophobicContact CD1-CE1 3.45Å; L184-F193 VanDerWaalsContact CD1-CE1 3.45Å; L184-F193 HydrophobicContact CD1-CE2 4.44Å; L184-F193 HydrophobicContact CD1-CZ 3.67Å; L184-F220 HydrophobicContact CD2-CD1 4.49Å; L184-F220 HydrophobicContact CD2-CE1 4.29Å; L184-M237 HydrophobicContact CD1-SD 4.24Å; L184-M237 HydrophobicContact CD2-SD 4.15Å; L184-I248 HydrophobicContact CD2-CG2 3.65Å; L184-I252 HydrophobicContact CD2-CD1 4.02Å
185	C	92.6	Very high	91.7	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.034	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	110.7	-172.3	-56	0	0	0	0	109.8	Y159 V162 I191 S192	Y159-C185 HydrophobicContact CD1-CB 3.43Å; Y159-C185 VanDerWaalsContact CD1-CB 3.43Å; Y159-C185 HydrophobicContact CD2-CB 3.94Å; Y159-C185 HydrophobicContact CE1-CB 3.54Å; Y159-C185 HydrophobicContact CE2-CB 4.07Å; Y159-C185 HydrophobicContact CG-CB 3.64Å; V162-C185 HydrophobicContact CG2-CB 4.31Å; C185-I191 WeakPolarHBondContact O-CA 3.48Å; C185-S192 PolarHBondContact N-O 3.29Å; C185-S192 PolarHBondContact O-N 3.16Å
186	L	93.3	Very high	91.6	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	127.3	-177.4	175.9	66.8	0	0	0	111.2	Y159 K160 E161 W163 I191 L207 T251 I252 A255	Y159-L186 CarbonylContact C-O 3.55Å; Y159-L186 WeakPolarHBondContact CA-O 3.49Å; K160-L186 PolarHBondContact N-O 3.3Å; E161-L186 PolarHBondContact N-O 3.27Å; E161-L186 PolarHBondContact O-N 2.87Å; W163-L186 HydrophobicContact CH2-CB 4.29Å; W163-L186 HydrophobicContact CH2-CD2 3.97Å; W163-L186 HydrophobicContact CZ3-CB 3.81Å; W163-L186 HydrophobicContact CZ3-CD2 4.3Å; L186-I191 HydrophobicContact CD1-CD1 4.32Å; L186-I191 HydrophobicContact CD1-CG1 3.68Å; L186-L207 HydrophobicContact CD1-CD1 4.18Å; L186-L207 HydrophobicContact CD1-CD2 4.01Å; L186-T251 HydrophobicContact CD2-CG2 3.69Å; L186-I252 HydrophobicContact CD2-CG1 4.19Å; L186-A255 HydrophobicContact CD1-CB 4.19Å; L186-A255 HydrophobicContact CD2-CB 4.15Å
187	S	91.5	Very high	91.5	Very high	29 Å²	29	42.1 Å²	42.1	20%	0.203	23%	0.227	C	C	.	.			trans	-115.4	170.5	169	179.1	0	0	0	0	109.7	R189 M190	S187-R189 PolarHBondContact O-N 2.85Å; S187-R189 VanDerWaalsContact O-N 3.12Å; S187-M190 WeakPolarHBondContact CA-O 3.47Å; S187-M190 PolarHBondContact N-O 2.84Å; S187-M190 PolarHBondContact O-N 2.83Å
188	S	87.8	Confident	91.3	Very high	89 Å²	89	37.8 Å²	37.8	62%	0.622	21%	0.206	S	C	*	.	S	Bend	trans	-60.1	-23.1	-174.8	58.1	0	0	0	0	115.1
189	R	89.9	Confident	90.7	Very high	157 Å²	157	42.3 Å²	42.3	59%	0.592	23%	0.227	S	C	*	.	S	Bend	trans	-126.1	-7.5	179.7	-60.1	-174.9	-176.4	-169.5	2.3	114.3	E146 S187 L207	E146-R189 IonicContact OE2-NH1 2.72Å; S187-R189 PolarHBondContact O-N 2.85Å; S187-R189 VanDerWaalsContact O-N 3.12Å; R189-L207 PolarHBondContact O-N 2.84Å
190	M	93	Very high	90.3	Very high	48 Å²	48	43.7 Å²	43.7	24%	0.236	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	152.3	-168.8	59.4	-175.4	-103.7	0	0	114.2	S187 S192 V204 L205	S187-M190 WeakPolarHBondContact CA-O 3.47Å; S187-M190 PolarHBondContact N-O 2.84Å; S187-M190 PolarHBondContact O-N 2.83Å; M190-S192 VanDerWaalsContact CE-OG 3.27Å; M190-S192 WeakPolarHBondContact CE-OG 3.42Å; M190-V204 HydrophobicContact CB-CG1 4.28Å; M190-V204 HydrophobicContact CE-CG1 3.64Å; M190-V204 HydrophobicContact CE-CG2 4.2Å; M190-V204 HydrophobicContact SD-CG1 4.11Å; M190-L205 CarbonylContact C-O 3.54Å; M190-L205 WeakPolarHBondContact CA-O 3.22Å; M190-L205 VanDerWaalsContact CB-O 3.28Å; M190-L205 WeakPolarHBondContact CB-O 3.37Å
191	I	94.3	Very high	90.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	129.8	170.1	-67.8	177.3	0	0	0	108.2	L184 C185 L186 F193 L205 L207 I210 I222 I252	L184-I191 HydrophobicContact CD1-CG2 3.42Å; L184-I191 VanDerWaalsContact CD1-CG2 3.42Å; L184-I191 HydrophobicContact CG-CG2 4.38Å; C185-I191 WeakPolarHBondContact O-CA 3.48Å; L186-I191 HydrophobicContact CD1-CD1 4.32Å; L186-I191 HydrophobicContact CD1-CG1 3.68Å; I191-F193 HydrophobicContact CG2-CE2 4.08Å; I191-F193 HydrophobicContact CG2-CZ 4.37Å; I191-L205 HydrophobicContact CB-CB 4.47Å; I191-L205 PolarHBondContact N-O 3.11Å; I191-L205 PolarHBondContact O-N 2.75Å; I191-L207 HydrophobicContact CD1-CD2 3.76Å; I191-L207 HydrophobicContact CG1-CD2 3.76Å; I191-I210 HydrophobicContact CD1-CD1 3.86Å; I191-I222 HydrophobicContact CD1-CD1 4.04Å; I191-I252 HydrophobicContact CD1-CD1 3.83Å; I191-I252 HydrophobicContact CD1-CG1 4.06Å; I191-I252 HydrophobicContact CD1-CG2 3.86Å
192	S	93.2	Very high	89.8	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	138.1	175.3	-52.7	0	0	0	0	110.2	C185 M190 V203	C185-S192 PolarHBondContact N-O 3.29Å; C185-S192 PolarHBondContact O-N 3.16Å; M190-S192 VanDerWaalsContact CE-OG 3.27Å; M190-S192 WeakPolarHBondContact CE-OG 3.42Å; S192-V203 WeakPolarHBondContact CA-O 3.44Å
193	F	92.9	Very high	89.7	Confident	1 Å²	1	44.3 Å²	44.3	0%	0.004	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	103.2	171.2	-67.2	-90	0	0	0	109.1	L167 Y182 R183 L184 I191 A201 S202 V203 L205 I222 L235 M237	L167-F193 HydrophobicContact CD1-CD1 3.62Å; L167-F193 HydrophobicContact CD1-CE1 3.91Å; L167-F193 HydrophobicContact CD1-CG 4.35Å; L167-F193 HydrophobicContact CD2-CE1 4.44Å; L167-F193 HydrophobicContact CG-CD1 4.48Å; L167-F193 HydrophobicContact CG-CE1 4.36Å; Y182-F193 HydrophobicContact CD1-CB 4.03Å; R183-F193 WeakPolarHBondContact O-CA 3.4Å; L184-F193 HydrophobicContact CD1-CD1 4.06Å; L184-F193 HydrophobicContact CD1-CE1 3.45Å; L184-F193 VanDerWaalsContact CD1-CE1 3.45Å; L184-F193 HydrophobicContact CD1-CE2 4.44Å; L184-F193 HydrophobicContact CD1-CZ 3.67Å; I191-F193 HydrophobicContact CG2-CE2 4.08Å; I191-F193 HydrophobicContact CG2-CZ 4.37Å; F193-A201 CarbonylContact O-C 3.44Å; F193-A201 WeakPolarHBondContact O-CA 3.45Å; F193-S202 PolarHBondContact O-N 3.43Å; F193-V203 HydrophobicContact CB-CB 4.28Å; F193-V203 HydrophobicContact CD2-CB 4.09Å; F193-V203 HydrophobicContact CD2-CG1 3.77Å; F193-V203 HydrophobicContact CE2-CG1 4.37Å; F193-V203 PolarHBondContact N-O 2.95Å; F193-L205 HydrophobicContact CE2-CD1 3.93Å; F193-L205 HydrophobicContact CE2-CG 4.5Å; F193-I222 HydrophobicContact CZ-CD1 4.32Å; F193-L235 HydrophobicContact CE2-CD1 3.73Å; F193-L235 HydrophobicContact CZ-CD1 3.82Å; F193-M237 HydrophobicContact CE1-CE 3.95Å; F193-M237 HydrophobicContact CE1-SD 4.02Å; F193-M237 HydrophobicContact CZ-CE 4.01Å
194	V	91.1	Very high	89.7	Confident	9 Å²	9	47.1 Å²	47.1	6%	0.055	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	116.9	176.5	-175	0	0	0	0	108.1	Y182 R183 S198 A201	Y182-V194 CarbonylContact C-O 2.82Å; Y182-V194 WeakPolarHBondContact CA-O 3.48Å; R183-V194 HydrophobicContact CB-CB 4.43Å; R183-V194 PolarHBondContact N-O 3.37Å; R183-V194 PolarHBondContact O-N 3.11Å; V194-S198 WeakPolarHBondContact CG1-O 3.38Å; V194-A201 HydrophobicContact CG2-CB 4.08Å
195	K	91.3	Very high	89.7	Confident	107 Å²	107	47.1 Å²	47.1	47%	0.465	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	147.3	179.1	-168.1	177.6	177.5	-178.1	0	110.4	Y182 N197 S198	Y182-K195 VanDerWaalsContact CD1-CA 3.44Å; Y182-K195 HydrophobicContact CD1-CB 3.87Å; Y182-K195 HydrophobicContact CD1-CG 4.35Å; Y182-K195 HydrophobicContact CE1-CB 3.61Å; Y182-K195 HydrophobicContact CE1-CD 4.5Å; Y182-K195 HydrophobicContact CE1-CG 3.94Å; Y182-K195 HydrophobicContact CE2-CG 4.49Å; K195-N197 PolarHBondContact O-N 3.22Å; K195-S198 VanDerWaalsContact O-CB 3.28Å; K195-S198 WeakPolarHBondContact O-CB 3.45Å; K195-S198 PolarHBondContact O-N 3.46Å
196	L	89	Confident	89.8	Confident	49 Å²	49	51.5 Å²	51.5	26%	0.257	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	138.5	171.4	-159.1	78	0	0	0	110.1	V181 S198	V181-L196 HydrophobicContact CB-CB 4.21Å; V181-L196 HydrophobicContact CB-CD2 4.36Å; V181-L196 HydrophobicContact CG1-CB 4.21Å; V181-L196 HydrophobicContact CG1-CD1 4.14Å; V181-L196 HydrophobicContact CG1-CD2 4.25Å; V181-L196 HydrophobicContact CG1-CG 4.44Å; V181-L196 PolarHBondContact O-N 3.14Å; L196-S198 PolarHBondContact O-N 2.83Å
197	N	85.6	Confident	89.8	Confident	102 Å²	102	51.4 Å²	51.4	55%	0.545	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.3	8.1	-172.8	-46.8	-2.4	0	0	0	115.1	K99 D100 K195	K99-N197 PolarHBondContact O-N 2.94Å; D100-N197 WeakPolarHBondContact CA-OD1 3.43Å; D100-N197 PolarHBondContact O-OD1 3.03Å; K195-N197 PolarHBondContact O-N 3.22Å
198	S	85.1	Confident	89.8	Confident	32 Å²	32	55.8 Å²	55.8	22%	0.224	30%	0.295	C	S	.	.			trans	-102.6	145.9	168.8	-172.4	0	0	0	0	110.2	V194 K195 L196 V200	V194-S198 WeakPolarHBondContact CG1-O 3.38Å; K195-S198 VanDerWaalsContact O-CB 3.28Å; K195-S198 WeakPolarHBondContact O-CB 3.45Å; K195-S198 PolarHBondContact O-N 3.46Å; L196-S198 PolarHBondContact O-N 2.83Å; S198-V200 PolarHBondContact OG-N 3.31Å; S198-V200 PolarHBondContact OG-O 3.43Å
199	E	77.6	Confident	90.1	Very high	108 Å²	108	52.5 Å²	52.5	51%	0.505	27%	0.27	S	S	.	.	S	Bend	trans	-96.8	-23.7	165.1	65.2	-146.2	171.5	0	0	112.2	K99	K99-E199 WeakPolarHBondContact CE-OE2 3.21Å; K99-E199 IonicContact NZ-OE2 2.6Å; K99-E199 PolarHBondContact NZ-OE2 2.91Å
200	V	83.3	Confident	90.3	Very high	90 Å²	90	45.5 Å²	45.5	55%	0.545	25%	0.245	S	C	.	.	S	Bend	trans	-82.7	132	176.3	-175.7	0	0	0	0	109.8	S198 S202	S198-V200 PolarHBondContact OG-N 3.31Å; S198-V200 PolarHBondContact OG-O 3.43Å; V200-S202 PolarHBondContact O-N 2.97Å
201	A	88	Confident	90.3	Very high	25 Å²	25	51.6 Å²	51.6	21%	0.207	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	119.1	169.4	0	0	0	0	0	110.1	F193 V194 V203 V204	F193-A201 CarbonylContact O-C 3.44Å; F193-A201 WeakPolarHBondContact O-CA 3.45Å; V194-A201 HydrophobicContact CG2-CB 4.08Å; A201-V203 PolarHBondContact O-N 2.7Å; A201-V204 HydrophobicContact CB-CG2 4.1Å
202	S	88.1	Confident	90.3	Very high	59 Å²	59	56.6 Å²	56.6	41%	0.413	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	-24.9	178.2	-49	0	0	0	0	112.3	F193 V200	F193-S202 PolarHBondContact O-N 3.43Å; V200-S202 PolarHBondContact O-N 2.97Å
203	V	90.4	Very high	90.5	Very high	19 Å²	19	57.3 Å²	57.3	12%	0.115	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	140.6	177.6	161.2	0	0	0	0	109.2	L178 S192 F193 A201 L205 I230	L178-V203 HydrophobicContact CD1-CG2 3.66Å; L178-V203 HydrophobicContact CD2-CG2 3.77Å; L178-V203 HydrophobicContact CG-CG2 4.37Å; S192-V203 WeakPolarHBondContact CA-O 3.44Å; F193-V203 HydrophobicContact CB-CB 4.28Å; F193-V203 HydrophobicContact CD2-CB 4.09Å; F193-V203 HydrophobicContact CD2-CG1 3.77Å; F193-V203 HydrophobicContact CE2-CG1 4.37Å; F193-V203 PolarHBondContact N-O 2.95Å; A201-V203 PolarHBondContact O-N 2.7Å; V203-L205 HydrophobicContact CG1-CG 4.14Å; V203-I230 HydrophobicContact CG1-CD1 3.46Å; V203-I230 VanDerWaalsContact CG1-CD1 3.46Å; V203-I230 HydrophobicContact CG1-CG1 4Å; V203-I230 HydrophobicContact CG2-CD1 4.28Å
204	V	92.9	Very high	90.6	Very high	59 Å²	59	57.7 Å²	57.7	36%	0.358	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	132.2	164.7	175.3	0	0	0	0	109.2	M190 A201	M190-V204 HydrophobicContact CB-CG1 4.28Å; M190-V204 HydrophobicContact CE-CG1 3.64Å; M190-V204 HydrophobicContact CE-CG2 4.2Å; M190-V204 HydrophobicContact SD-CG1 4.11Å; A201-V204 HydrophobicContact CB-CG2 4.1Å
205	L	93.5	Very high	90.9	Very high	1 Å²	1	60.6 Å²	60.6	1%	0.005	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	128.8	172.7	-71.5	-179.8	0	0	0	109.6	M190 I191 F193 V203 V224 A228 I230 L235	M190-L205 CarbonylContact C-O 3.54Å; M190-L205 WeakPolarHBondContact CA-O 3.22Å; M190-L205 VanDerWaalsContact CB-O 3.28Å; M190-L205 WeakPolarHBondContact CB-O 3.37Å; I191-L205 HydrophobicContact CB-CB 4.47Å; I191-L205 PolarHBondContact N-O 3.11Å; I191-L205 PolarHBondContact O-N 2.75Å; F193-L205 HydrophobicContact CE2-CD1 3.93Å; F193-L205 HydrophobicContact CE2-CG 4.5Å; V203-L205 HydrophobicContact CG1-CG 4.14Å; L205-V224 HydrophobicContact CD1-CG1 3.58Å; L205-V224 HydrophobicContact CD2-CG1 3.77Å; L205-V224 HydrophobicContact CG-CG1 4.3Å; L205-A228 HydrophobicContact CD2-CB 3.89Å; L205-I230 HydrophobicContact CD1-CD1 4.45Å; L205-I230 HydrophobicContact CD2-CD1 3.59Å; L205-I230 HydrophobicContact CD2-CG1 3.87Å; L205-I230 HydrophobicContact CG-CD1 4.15Å; L205-L235 HydrophobicContact CD1-CD1 4.09Å
206	Q	93.1	Very high	91.1	Very high	96 Å²	96	58.1 Å²	58.1	45%	0.449	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	139.1	164	-60.1	166.7	-31	0	0	109	M208 N209	Q206-M208 HydrophobicContact CB-CG 3.94Å; Q206-M208 PolarHBondContact O-N 3.3Å; Q206-N209 PolarHBondContact O-N 2.81Å; Q206-N209 PolarHBondContact OE1-ND2 2.86Å
207	L	93.6	Very high	91.3	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-59.2	-31.8	179.7	-73.9	172.1	0	0	0	112.1	L186 R189 I191 N209 I210 I252 A255 M256 M259	L186-L207 HydrophobicContact CD1-CD1 4.18Å; L186-L207 HydrophobicContact CD1-CD2 4.01Å; R189-L207 PolarHBondContact O-N 2.84Å; I191-L207 HydrophobicContact CD1-CD2 3.76Å; I191-L207 HydrophobicContact CG1-CD2 3.76Å; L207-N209 PolarHBondContact O-N 2.8Å; L207-I210 HydrophobicContact CD2-CD1 3.87Å; L207-I210 WeakPolarHBondContact O-CB 3.38Å; L207-I210 PolarHBondContact O-N 2.78Å; L207-I252 HydrophobicContact CD2-CG2 4.47Å; L207-A255 HydrophobicContact CD1-CB 3.95Å; L207-M256 HydrophobicContact CB-CG 4.41Å; L207-M256 HydrophobicContact CD2-CG 4.05Å; L207-M259 HydrophobicContact CB-CE 3.95Å; L207-M259 HydrophobicContact CB-SD 3.45Å; L207-M259 WeakPolarHBondContact CB-SD 3.48Å
208	M	91.7	Very high	91.7	Very high	121 Å²	121	57.8 Å²	57.8	60%	0.596	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-64.5	-18.3	176	69.8	-177.8	73.4	0	0	114.6	Q206 M259	Q206-M208 HydrophobicContact CB-CG 3.94Å; Q206-M208 PolarHBondContact O-N 3.3Å; M208-M259 HydrophobicContact CB-CE 4.03Å; M208-M259 HydrophobicContact CB-SD 3.94Å; M208-M259 PolarHBondContact N-SD 3.43Å; M208-M259 VanDerWaalsContact N-SD 3.36Å
209	N	93.8	Very high	92.2	Very high	19 Å²	19	59.5 Å²	59.5	10%	0.102	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-92.5	0.3	179.3	-63.4	-32.3	0	0	0	112.7	Q206 L207 V224 G225 S227 A228	Q206-N209 PolarHBondContact O-N 2.81Å; Q206-N209 PolarHBondContact OE1-ND2 2.86Å; L207-N209 PolarHBondContact O-N 2.8Å; N209-V224 CarbonylContact O-C 3.59Å; N209-V224 WeakPolarHBondContact O-CA 3.34Å; N209-G225 PolarHBondContact O-N 3.43Å; N209-S227 PolarHBondContact ND2-O 2.79Å; N209-S227 WeakPolarHBondContact OD1-CB 3.04Å; N209-A228 HydrophobicContact CB-CB 4.01Å
210	I	94.9	Very high	93.1	Very high	11 Å²	11	54.4 Å²	54.4	6%	0.056	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	124.6	175.2	-58.1	174.1	0	0	0	108.9	I191 L207 R212 I222 V224 M256	I191-I210 HydrophobicContact CD1-CD1 3.86Å; L207-I210 HydrophobicContact CD2-CD1 3.87Å; L207-I210 WeakPolarHBondContact O-CB 3.38Å; L207-I210 PolarHBondContact O-N 2.78Å; I210-R212 WeakPolarHBondContact CG2-O 3.43Å; I210-I222 HydrophobicContact CB-CG2 4.29Å; I210-I222 HydrophobicContact CD1-CG2 3.94Å; I210-I222 HydrophobicContact CG1-CG2 3.8Å; I210-I222 HydrophobicContact CG2-CG2 3.63Å; I210-V224 HydrophobicContact CG1-CG1 4.35Å; I210-M256 HydrophobicContact CB-CE 3.71Å; I210-M256 HydrophobicContact CB-SD 3.87Å; I210-M256 HydrophobicContact CD1-SD 4.16Å; I210-M256 HydrophobicContact CG2-CE 3.66Å; I210-M256 HydrophobicContact CG2-SD 3.62Å; I210-M256 WeakPolarHBondContact O-CE 3.41Å
211	R	93.7	Very high	93.7	Very high	176 Å²	176	51.6 Å²	51.6	66%	0.664	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86	-39.1	178.1	-68.8	-178.9	70.1	-149.1	11.1	112.2	E223	R211-E223 WeakPolarHBondContact CB-OE1 3.34Å; R211-E223 VanDerWaalsContact CD-OE1 3.23Å; R211-E223 WeakPolarHBondContact CD-OE1 3.32Å; R211-E223 IonicContact CZ-OE1 2.62Å; R211-E223 VanDerWaalsContact CZ-OE1 3.29Å; R211-E223 PolarHBondContact N-O 3.36Å; R211-E223 IonicContact NE-OE1 2.8Å; R211-E223 PolarHBondContact NE-OE1 2.84Å; R211-E223 IonicContact NH1-OE1 2.68Å; R211-E223 PolarHBondContact NH1-OE1 3.26Å; R211-E223 IonicContact NH1-OE2 3.12Å
212	R	94.3	Very high	94.1	Very high	105 Å²	105	50.4 Å²	50.4	40%	0.396	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	154.7	169.5	61.4	174	-179.5	-70.4	-10.4	109.6	I210 F221 E223 E234	I210-R212 WeakPolarHBondContact CG2-O 3.43Å; R212-F221 HydrophobicContact CG-CE2 4.32Å; R212-E223 HydrophobicContact CG-CB 3.84Å; R212-E223 IonicContact CZ-OE1 2.63Å; R212-E223 IonicContact CZ-OE2 3.29Å; R212-E223 PolarHBondContact N-O 3.41Å; R212-E223 IonicContact NH1-OE1 3.91Å; R212-E223 PolarHBondContact NH1-OE1 3.07Å; R212-E223 VanDerWaalsContact NH1-OE1 3.12Å; R212-E223 IonicContact NH1-OE2 2.68Å; R212-E223 PolarHBondContact NH1-OE2 3.17Å; R212-E223 IonicContact NH2-OE2 3.43Å; R212-E223 PolarHBondContact NH2-OE2 2.71Å; R212-E223 PolarHBondContact O-N 2.98Å; R212-E234 IonicContact CZ-OE1 3.31Å; R212-E234 IonicContact NH2-OE1 2.63Å; R212-E234 PolarHBondContact NH2-OE1 2.85Å
213	C	95.9	Very high	94.5	Very high	15 Å²	15	48.8 Å²	48.8	10%	0.101	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	165.2	158.6	55.9	0	0	0	0	108.8	F220 F221 I222	C213-F220 HydrophobicContact CB-CE2 3.85Å; C213-F220 HydrophobicContact CB-CZ 3.84Å; C213-F221 CarbonylContact C-O 3.48Å; C213-F221 WeakPolarHBondContact CA-O 3.06Å; C213-F221 WeakPolarHBondContact CB-O 3.36Å; C213-I222 HydrophobicContact CB-CG1 4.39Å
214	G	96.2	Very high	94.8	Very high	8 Å²	8	48 Å²	48	8%	0.082	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.9	169.8	-178.3	0	0	0	0	0	111.5	F220 F221 H249	G214-F220 WeakPolarHBondContact O-CD2 3.49Å; G214-F221 VanDerWaalsContact C-CE1 3.45Å; G214-F221 PolarHBondContact N-O 3.11Å; G214-F221 VanDerWaalsContact O-CD1 3.27Å; G214-F221 WeakPolarHBondContact O-CD1 3.24Å; G214-F221 PolarHBondContact O-N 2.97Å; G214-H249 VanDerWaalsContact CA-CD2 3.48Å; G214-H249 WeakPolarHBondContact CA-CD2 3.21Å
215	H	96.3	Very high	94.9	Very high	70 Å²	70	45.5 Å²	45.5	32%	0.324	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	158.4	174.6	68.5	-75.5	0	0	0	110.9	F219 A245 H249	H215-F219 CarbonylContact C-O 3.54Å; H215-F219 WeakPolarHBondContact CA-O 3.48Å; H215-F219 WeakPolarHBondContact CB-O 3.39Å; H215-A245 HydrophobicContact CB-CB 4.07Å; H215-H249 HydrophobicContact CB-CB 4.29Å; H215-H249 AromaticContact CE1-ND1 3.82Å; H215-H249 AromaticContact ND1-CG 3.66Å; H215-H249 AromaticContact ND1-ND1 3.31Å; H215-H249 PolarHBondContact ND1-ND1 2.77Å
216	S	95.2	Very high	94.9	Very high	55 Å²	55	56.1 Å²	56.1	39%	0.385	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	114.2	173.4	-175.4	0	0	0	0	106.3	S218 F219	S216-S218 PolarHBondContact O-N 3.32Å; S216-F219 PolarHBondContact N-O 2.86Å; S216-F219 WeakPolarHBondContact O-CA 3.27Å; S216-F219 WeakPolarHBondContact O-CB 3.46Å; S216-F219 PolarHBondContact O-N 3.33Å
217	D	93.3	Very high	94.9	Very high	116 Å²	116	56.1 Å²	56.1	62%	0.62	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	-127.4	-175.9	-42.8	-72.1	0	0	0	111	F219 S242	D217-F219 VanDerWaalsContact C-N 3.3Å; D217-S242 VanDerWaalsContact O-CA 3.23Å; D217-S242 WeakPolarHBondContact O-CA 3.23Å; D217-S242 WeakPolarHBondContact O-CB 3.46Å
218	S	94.3	Very high	94.8	Very high	29 Å²	29	56.4 Å²	56.4	20%	0.203	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	5.8	172.9	55	0	0	0	0	114.3	S216 A239	S216-S218 PolarHBondContact O-N 3.32Å; S218-A239 PolarHBondContact O-N 2.84Å
219	F	96.3	Very high	94.6	Very high	68 Å²	68	55.1 Å²	55.1	30%	0.298	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	140.8	176.2	-61.9	-86.1	0	0	0	111.9	K168 H215 S216 D217 W236 M237 Q238	K168-F219 HydrophobicContact CG-CE1 4.22Å; H215-F219 CarbonylContact C-O 3.54Å; H215-F219 WeakPolarHBondContact CA-O 3.48Å; H215-F219 WeakPolarHBondContact CB-O 3.39Å; S216-F219 PolarHBondContact N-O 2.86Å; S216-F219 WeakPolarHBondContact O-CA 3.27Å; S216-F219 WeakPolarHBondContact O-CB 3.46Å; S216-F219 PolarHBondContact O-N 3.33Å; D217-F219 VanDerWaalsContact C-N 3.3Å; F219-W236 HydrophobicContact CB-CE3 4.41Å; F219-M237 CarbonylContact C-O 3.52Å; F219-M237 WeakPolarHBondContact CA-O 3.38Å; F219-Q238 HydrophobicContact CD1-CB 3.95Å; F219-Q238 HydrophobicContact CD1-CG 4.44Å; F219-Q238 HydrophobicContact CE1-CB 3.87Å; F219-Q238 HydrophobicContact CE1-CG 4.2Å
220	F	97.1	Very high	94.5	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	143.6	168.9	172.6	-111.9	0	0	0	109.1	L184 C213 G214 I222 M237 A245 I248 H249 I252	L184-F220 HydrophobicContact CD2-CD1 4.49Å; L184-F220 HydrophobicContact CD2-CE1 4.29Å; C213-F220 HydrophobicContact CB-CE2 3.85Å; C213-F220 HydrophobicContact CB-CZ 3.84Å; G214-F220 WeakPolarHBondContact O-CD2 3.49Å; F220-I222 HydrophobicContact CD1-CG1 4.46Å; F220-I222 HydrophobicContact CE1-CD1 3.81Å; F220-I222 HydrophobicContact CE1-CG1 3.52Å; F220-I222 HydrophobicContact CZ-CD1 4.19Å; F220-I222 HydrophobicContact CZ-CG1 3.67Å; F220-M237 HydrophobicContact CB-CG 4.23Å; F220-M237 HydrophobicContact CD1-CE 3.81Å; F220-M237 HydrophobicContact CD1-CG 4.01Å; F220-M237 HydrophobicContact CD1-SD 3.73Å; F220-M237 HydrophobicContact CE1-CE 4.08Å; F220-M237 HydrophobicContact CE1-SD 4.3Å; F220-M237 PolarHBondContact N-O 2.87Å; F220-M237 PolarHBondContact O-N 2.97Å; F220-M237 VanDerWaalsContact O-O 3.09Å; F220-A245 HydrophobicContact CB-CB 4.49Å; F220-I248 HydrophobicContact CB-CG2 4.48Å; F220-I248 HydrophobicContact CD1-CG2 3.4Å; F220-I248 HydrophobicContact CD2-CG2 4Å; F220-I248 HydrophobicContact CE1-CG2 3.46Å; F220-I248 VanDerWaalsContact CE1-CG2 3.46Å; F220-I248 HydrophobicContact CE2-CG2 4.09Å; F220-I248 HydrophobicContact CG-CB 4.4Å; F220-I248 HydrophobicContact CG-CG2 3.69Å; F220-I248 HydrophobicContact CZ-CG2 3.83Å; F220-H249 HydrophobicContact CD2-CB 3.92Å; F220-H249 HydrophobicContact CE2-CB 3.82Å; F220-I252 HydrophobicContact CE1-CD1 3.73Å; F220-I252 HydrophobicContact CZ-CD1 3.62Å
221	F	95.9	Very high	94.3	Very high	32 Å²	32	55.1 Å²	55.1	14%	0.14	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	149.9	178.8	71.4	-93.3	0	0	0	112.8	R212 C213 G214 L235 W236	R212-F221 HydrophobicContact CG-CE2 4.32Å; C213-F221 CarbonylContact C-O 3.48Å; C213-F221 WeakPolarHBondContact CA-O 3.06Å; C213-F221 WeakPolarHBondContact CB-O 3.36Å; G214-F221 VanDerWaalsContact C-CE1 3.45Å; G214-F221 PolarHBondContact N-O 3.11Å; G214-F221 VanDerWaalsContact O-CD1 3.27Å; G214-F221 WeakPolarHBondContact O-CD1 3.24Å; G214-F221 PolarHBondContact O-N 2.97Å; F221-L235 VanDerWaalsContact CA-O 3.24Å; F221-L235 WeakPolarHBondContact CA-O 3.27Å; F221-W236 HydrophobicContact CB-CD2 3.8Å; F221-W236 HydrophobicContact CB-CE3 4.01Å; F221-W236 HydrophobicContact CB-CG 4.21Å; F221-W236 HydrophobicContact CB-CH2 4.38Å; F221-W236 HydrophobicContact CB-CZ2 4.19Å; F221-W236 HydrophobicContact CB-CZ3 4.3Å; F221-W236 AromaticContact CD1-CH2 3.79Å; F221-W236 HydrophobicContact CD1-CH2 3.79Å; F221-W236 HydrophobicContact CD1-CZ2 4.18Å; F221-W236 AromaticContact CD1-CZ3 4Å; F221-W236 HydrophobicContact CD1-CZ3 4Å; F221-W236 HydrophobicContact CE1-CH2 4.35Å; F221-W236 HydrophobicContact CG-CH2 4.17Å; F221-W236 HydrophobicContact CG-CZ2 4.1Å; F221-W236 HydrophobicContact CG-CZ3 4.44Å
222	I	96.4	Very high	94.4	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	118.9	173.6	-54.6	-178.7	0	0	0	107.7	I191 F193 I210 C213 F220 V224 E234 L235 M237	I191-I222 HydrophobicContact CD1-CD1 4.04Å; F193-I222 HydrophobicContact CZ-CD1 4.32Å; I210-I222 HydrophobicContact CB-CG2 4.29Å; I210-I222 HydrophobicContact CD1-CG2 3.94Å; I210-I222 HydrophobicContact CG1-CG2 3.8Å; I210-I222 HydrophobicContact CG2-CG2 3.63Å; C213-I222 HydrophobicContact CB-CG1 4.39Å; F220-I222 HydrophobicContact CD1-CG1 4.46Å; F220-I222 HydrophobicContact CE1-CD1 3.81Å; F220-I222 HydrophobicContact CE1-CG1 3.52Å; F220-I222 HydrophobicContact CZ-CD1 4.19Å; F220-I222 HydrophobicContact CZ-CG1 3.67Å; I222-V224 HydrophobicContact CG2-CG1 3.97Å; I222-E234 CarbonylContact O-C 3.58Å; I222-E234 WeakPolarHBondContact O-CA 3.42Å; I222-L235 PolarHBondContact N-O 3.41Å; I222-L235 PolarHBondContact O-N 2.93Å; I222-M237 HydrophobicContact CD1-CE 4.2Å; I222-M237 HydrophobicContact CG1-CE 4.16Å
223	E	96	Very high	94.4	Very high	25 Å²	25	46.6 Å²	46.6	12%	0.117	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	122.7	162.5	-165.8	-164.7	77.7	0	0	109.6	R211 R212 G233 E234	R211-E223 WeakPolarHBondContact CB-OE1 3.34Å; R211-E223 VanDerWaalsContact CD-OE1 3.23Å; R211-E223 WeakPolarHBondContact CD-OE1 3.32Å; R211-E223 IonicContact CZ-OE1 2.62Å; R211-E223 VanDerWaalsContact CZ-OE1 3.29Å; R211-E223 PolarHBondContact N-O 3.36Å; R211-E223 IonicContact NE-OE1 2.8Å; R211-E223 PolarHBondContact NE-OE1 2.84Å; R211-E223 IonicContact NH1-OE1 2.68Å; R211-E223 PolarHBondContact NH1-OE1 3.26Å; R211-E223 IonicContact NH1-OE2 3.12Å; R212-E223 HydrophobicContact CG-CB 3.84Å; R212-E223 IonicContact CZ-OE1 2.63Å; R212-E223 IonicContact CZ-OE2 3.29Å; R212-E223 PolarHBondContact N-O 3.41Å; R212-E223 IonicContact NH1-OE1 3.91Å; R212-E223 PolarHBondContact NH1-OE1 3.07Å; R212-E223 VanDerWaalsContact NH1-OE1 3.12Å; R212-E223 IonicContact NH1-OE2 2.68Å; R212-E223 PolarHBondContact NH1-OE2 3.17Å; R212-E223 IonicContact NH2-OE2 3.43Å; R212-E223 PolarHBondContact NH2-OE2 2.71Å; R212-E223 PolarHBondContact O-N 2.98Å; E223-G233 CarbonylContact C-O 3.52Å; E223-G233 WeakPolarHBondContact CA-O 3.42Å; E223-E234 HydrophobicContact CB-CG 4.04Å; E223-E234 HydrophobicContact CG-CG 3.96Å
224	V	95.8	Very high	94.3	Very high	1 Å²	1	48 Å²	48	1%	0.006	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	146.8	172.4	-65.2	0	0	0	0	111.8	L172 L205 N209 I210 I222 A228 G231 P232 G233	L172-V224 HydrophobicContact CD1-CG2 3.4Å; L172-V224 VanDerWaalsContact CD1-CG2 3.4Å; L205-V224 HydrophobicContact CD1-CG1 3.58Å; L205-V224 HydrophobicContact CD2-CG1 3.77Å; L205-V224 HydrophobicContact CG-CG1 4.3Å; N209-V224 CarbonylContact O-C 3.59Å; N209-V224 WeakPolarHBondContact O-CA 3.34Å; I210-V224 HydrophobicContact CG1-CG1 4.35Å; I222-V224 HydrophobicContact CG2-CG1 3.97Å; V224-A228 HydrophobicContact CB-CB 3.77Å; V224-A228 HydrophobicContact CG1-CB 4.37Å; V224-A228 HydrophobicContact CG2-CB 4Å; V224-G231 WeakPolarHBondContact CG2-O 3.35Å; V224-P232 WeakPolarHBondContact O-CA 3.5Å; V224-G233 WeakPolarHBondContact CG2-O 3.22Å; V224-G233 PolarHBondContact N-O 3.16Å; V224-G233 PolarHBondContact O-N 3.08Å
225	G	95.2	Very high	94.3	Very high	8 Å²	8	47.6 Å²	47.6	8%	0.082	27%	0.272	C	S	.	.			trans	-84.9	176.6	177.1	0	0	0	0	0	113.6	N209 S227 A228	N209-G225 PolarHBondContact O-N 3.43Å; G225-S227 PolarHBondContact O-N 2.6Å; G225-A228 WeakPolarHBondContact O-CB 3.2Å; G225-A228 PolarHBondContact O-N 2.77Å
226	R	94.6	Very high	94.2	Very high	223 Å²	223	45.7 Å²	45.7	84%	0.842	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-23.6	-177.9	-60.7	-174.9	-63.6	-156.9	1.2	114	A228 P232	R226-A228 VanDerWaalsContact C-N 3.34Å; R226-P232 HydrophobicContact CG-CB 4.06Å; R226-P232 HydrophobicContact CG-CG 4.09Å
227	S	92.6	Very high	94.3	Very high	96 Å²	96	43.1 Å²	43.1	67%	0.671	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-11.6	179.7	-49.4	0	0	0	0	114.2	N209 G225	N209-S227 PolarHBondContact ND2-O 2.79Å; N209-S227 WeakPolarHBondContact OD1-CB 3.04Å; G225-S227 PolarHBondContact O-N 2.6Å
228	A	92.3	Very high	94.4	Very high	6 Å²	6	40.7 Å²	40.7	5%	0.05	23%	0.229	C	C	.	.	S	Bend	trans	-71.2	143.7	174.7	0	0	0	0	0	111.3	L205 N209 V224 G225 R226 I230 G231	L205-A228 HydrophobicContact CD2-CB 3.89Å; N209-A228 HydrophobicContact CB-CB 4.01Å; V224-A228 HydrophobicContact CB-CB 3.77Å; V224-A228 HydrophobicContact CG1-CB 4.37Å; V224-A228 HydrophobicContact CG2-CB 4Å; G225-A228 WeakPolarHBondContact O-CB 3.2Å; G225-A228 PolarHBondContact O-N 2.77Å; R226-A228 VanDerWaalsContact C-N 3.34Å; A228-I230 PolarHBondContact O-N 2.84Å; A228-G231 PolarHBondContact O-N 2.85Å
229	A	87.5	Confident	94.4	Very high	95 Å²	95	39.6 Å²	39.6	79%	0.785	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-22	177.9	0	0	0	0	0	113.9	G231	A229-G231 VanDerWaalsContact C-N 3.3Å
230	I	90.4	Very high	94.2	Very high	11 Å²	11	40.4 Å²	40.4	6%	0.056	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-16.6	175.8	-37.2	-178.6	0	0	0	112.2	L172 R176 V203 L205 A228 L235	L172-I230 HydrophobicContact CB-CG2 4.48Å; L172-I230 HydrophobicContact CD1-CB 4.34Å; L172-I230 HydrophobicContact CD1-CG2 4.05Å; L172-I230 HydrophobicContact CD2-CG2 4.09Å; L172-I230 HydrophobicContact CG-CG2 4.44Å; R176-I230 HydrophobicContact CG-CG2 3.57Å; R176-I230 PolarHBondContact NE-O 3.26Å; R176-I230 VanDerWaalsContact NE-O 3.14Å; R176-I230 PolarHBondContact NH2-O 3.02Å; V203-I230 HydrophobicContact CG1-CD1 3.46Å; V203-I230 VanDerWaalsContact CG1-CD1 3.46Å; V203-I230 HydrophobicContact CG1-CG1 4Å; V203-I230 HydrophobicContact CG2-CD1 4.28Å; L205-I230 HydrophobicContact CD1-CD1 4.45Å; L205-I230 HydrophobicContact CD2-CD1 3.59Å; L205-I230 HydrophobicContact CD2-CG1 3.87Å; L205-I230 HydrophobicContact CG-CD1 4.15Å; A228-I230 PolarHBondContact O-N 2.84Å; I230-L235 HydrophobicContact CD1-CD1 3.94Å
231	G	91.3	Very high	94	Very high	18 Å²	18	41.6 Å²	41.6	19%	0.186	24%	0.236	C	C	.	.			trans	81.3	177.3	-158.8	0	0	0	0	0	112.2	V224 A228 A229	V224-G231 WeakPolarHBondContact CG2-O 3.35Å; A228-G231 PolarHBondContact O-N 2.85Å; A229-G231 VanDerWaalsContact C-N 3.3Å
232	P	94.9	Very high	93.9	Very high	80 Å²	80	43 Å²	43	52%	0.519	25%	0.249	S	C	.	.	S	Bend	trans	-74.8	148.9	-177.9	32.9	-36.1	0	0	0	112.5	V224 R226	V224-P232 WeakPolarHBondContact O-CA 3.5Å; R226-P232 HydrophobicContact CG-CB 4.06Å; R226-P232 HydrophobicContact CG-CG 4.09Å
233	G	94.3	Very high	93.8	Very high	22 Å²	22	45.8 Å²	45.8	23%	0.227	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	146.6	-174.9	171.8	0	0	0	0	0	113.5	E223 V224	E223-G233 CarbonylContact C-O 3.52Å; E223-G233 WeakPolarHBondContact CA-O 3.42Å; V224-G233 WeakPolarHBondContact CG2-O 3.22Å; V224-G233 PolarHBondContact N-O 3.16Å; V224-G233 PolarHBondContact O-N 3.08Å
234	E	94.9	Very high	93.6	Very high	45 Å²	45	45.4 Å²	45.4	21%	0.21	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	134.1	-177.8	-60.6	-175.3	146.4	0	0	112.5	L172 R212 I222 E223 W236	L172-E234 PolarHBondContact N-O 2.86Å; R212-E234 IonicContact CZ-OE1 3.31Å; R212-E234 IonicContact NH2-OE1 2.63Å; R212-E234 PolarHBondContact NH2-OE1 2.85Å; I222-E234 CarbonylContact O-C 3.58Å; I222-E234 WeakPolarHBondContact O-CA 3.42Å; E223-E234 HydrophobicContact CB-CG 4.04Å; E223-E234 HydrophobicContact CG-CG 3.96Å; E234-W236 PolarHBondContact OE2-NE1 3.37Å
235	L	95.5	Very high	93.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	122.2	162.5	-71.8	167.9	0	0	0	108.7	L167 L172 L178 F193 L205 F221 I222 I230 M237	L167-L235 HydrophobicContact CD2-CB 4.28Å; L167-L235 HydrophobicContact CD2-CD2 4.1Å; L172-L235 HydrophobicContact CB-CD2 3.6Å; L172-L235 HydrophobicContact CB-CG 3.99Å; L172-L235 HydrophobicContact CD1-CG 4.31Å; L178-L235 HydrophobicContact CD1-CD2 4.04Å; F193-L235 HydrophobicContact CE2-CD1 3.73Å; F193-L235 HydrophobicContact CZ-CD1 3.82Å; L205-L235 HydrophobicContact CD1-CD1 4.09Å; F221-L235 VanDerWaalsContact CA-O 3.24Å; F221-L235 WeakPolarHBondContact CA-O 3.27Å; I222-L235 PolarHBondContact N-O 3.41Å; I222-L235 PolarHBondContact O-N 2.93Å; I230-L235 HydrophobicContact CD1-CD1 3.94Å; L235-M237 HydrophobicContact CB-CE 4.42Å
236	W	95.6	Very high	93.6	Very high	30 Å²	30	49 Å²	49	11%	0.114	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	129.2	176.7	-73.7	76.9	0	0	0	110.1	K168 R170 F219 F221 E234	K168-W236 PolarHBondContact N-O 3.14Å; R170-W236 HydrophobicContact CB-CB 4.26Å; R170-W236 HydrophobicContact CB-CG 4.38Å; R170-W236 HydrophobicContact CG-CG 4.14Å; R170-W236 VanDerWaalsContact CZ-CZ2 3.46Å; F219-W236 HydrophobicContact CB-CE3 4.41Å; F221-W236 HydrophobicContact CB-CD2 3.8Å; F221-W236 HydrophobicContact CB-CE3 4.01Å; F221-W236 HydrophobicContact CB-CG 4.21Å; F221-W236 HydrophobicContact CB-CH2 4.38Å; F221-W236 HydrophobicContact CB-CZ2 4.19Å; F221-W236 HydrophobicContact CB-CZ3 4.3Å; F221-W236 AromaticContact CD1-CH2 3.79Å; F221-W236 HydrophobicContact CD1-CH2 3.79Å; F221-W236 HydrophobicContact CD1-CZ2 4.18Å; F221-W236 AromaticContact CD1-CZ3 4Å; F221-W236 HydrophobicContact CD1-CZ3 4Å; F221-W236 HydrophobicContact CE1-CH2 4.35Å; F221-W236 HydrophobicContact CG-CH2 4.17Å; F221-W236 HydrophobicContact CG-CZ2 4.1Å; F221-W236 HydrophobicContact CG-CZ3 4.44Å; E234-W236 PolarHBondContact OE2-NE1 3.37Å
237	M	96.3	Very high	93.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	148.6	179.7	69.3	-154	84.3	0	0	111.6	V165 N166 L167 L184 F193 F219 F220 I222 L235	V165-M237 HydrophobicContact CB-CB 4.15Å; V165-M237 HydrophobicContact CB-CG 4.02Å; V165-M237 HydrophobicContact CB-SD 4.15Å; V165-M237 HydrophobicContact CG1-CG 4.27Å; V165-M237 HydrophobicContact CG1-SD 4.27Å; V165-M237 HydrophobicContact CG2-CB 4.31Å; V165-M237 HydrophobicContact CG2-CG 4.23Å; V165-M237 HydrophobicContact CG2-SD 3.77Å; N166-M237 CarbonylContact O-C 3.58Å; N166-M237 WeakPolarHBondContact O-CA 3.29Å; L167-M237 HydrophobicContact CD2-CB 4.05Å; L167-M237 HydrophobicContact CD2-CE 4.44Å; L167-M237 HydrophobicContact CG-CB 4.13Å; L184-M237 HydrophobicContact CD1-SD 4.24Å; L184-M237 HydrophobicContact CD2-SD 4.15Å; F193-M237 HydrophobicContact CE1-CE 3.95Å; F193-M237 HydrophobicContact CE1-SD 4.02Å; F193-M237 HydrophobicContact CZ-CE 4.01Å; F219-M237 CarbonylContact C-O 3.52Å; F219-M237 WeakPolarHBondContact CA-O 3.38Å; F220-M237 HydrophobicContact CB-CG 4.23Å; F220-M237 HydrophobicContact CD1-CE 3.81Å; F220-M237 HydrophobicContact CD1-CG 4.01Å; F220-M237 HydrophobicContact CD1-SD 3.73Å; F220-M237 HydrophobicContact CE1-CE 4.08Å; F220-M237 HydrophobicContact CE1-SD 4.3Å; F220-M237 PolarHBondContact N-O 2.87Å; F220-M237 PolarHBondContact O-N 2.97Å; F220-M237 VanDerWaalsContact O-O 3.09Å; I222-M237 HydrophobicContact CD1-CE 4.2Å; I222-M237 HydrophobicContact CG1-CE 4.16Å; L235-M237 HydrophobicContact CB-CE 4.42Å
238	Q	96.3	Very high	93.7	Very high	65 Å²	65	36.1 Å²	36.1	30%	0.304	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	130.5	177	-177.1	176.6	17.7	0	0	109.8	N166 F219	N166-Q238 HydrophobicContact CB-CB 4.37Å; N166-Q238 PolarHBondContact N-O 2.81Å; N166-Q238 PolarHBondContact O-N 2.91Å; F219-Q238 HydrophobicContact CD1-CB 3.95Å; F219-Q238 HydrophobicContact CD1-CG 4.44Å; F219-Q238 HydrophobicContact CE1-CB 3.87Å; F219-Q238 HydrophobicContact CE1-CG 4.2Å
239	A	94.4	Very high	93.9	Very high	6 Å²	6	37.5 Å²	37.5	5%	0.05	23%	0.226	C	C	.	.			trans	-94.9	174.9	168.6	0	0	0	0	0	110.6	S218 V244 A245 I248	S218-A239 PolarHBondContact O-N 2.84Å; A239-V244 HydrophobicContact CB-CB 4.23Å; A239-V244 HydrophobicContact CB-CG1 4.12Å; A239-A245 HydrophobicContact CB-CB 4.17Å; A239-I248 HydrophobicContact CB-CD1 4.06Å
240	D	91.5	Very high	94.2	Very high	86 Å²	86	37.8 Å²	37.8	46%	0.46	21%	0.211	S	C	.	.	S	Bend	trans	-70.2	-44.8	-176.7	-72.5	-25.7	0	0	0	113.3
241	D	92.9	Very high	94.4	Very high	25 Å²	25	37.8 Å²	37.8	13%	0.134	21%	0.212	C	C	.	.	S	Bend	trans	-135.6	163.4	176.8	-79.4	-33.3	0	0	0	109.7	A88 K89 V243 V244 A245	A88-D241 HydrophobicContact CB-CB 4.09Å; A88-D241 WeakPolarHBondContact CB-OD2 3.2Å; A88-D241 PolarHBondContact N-OD2 3.3Å; K89-D241 IonicContact NZ-OD1 3.67Å; K89-D241 PolarHBondContact NZ-OD1 3.46Å; K89-D241 IonicContact NZ-OD2 2.77Å; K89-D241 PolarHBondContact NZ-OD2 3.05Å; K89-D241 VanDerWaalsContact NZ-OD2 3.09Å; D241-V243 VanDerWaalsContact C-N 3.35Å; D241-V243 PolarHBondContact O-N 2.85Å; D241-V244 HydrophobicContact CB-CG2 4.32Å; D241-V244 WeakPolarHBondContact O-CB 3.28Å; D241-V244 PolarHBondContact O-N 3.33Å; D241-V244 VanDerWaalsContact O-N 3.11Å; D241-A245 PolarHBondContact O-N 3.06Å; D241-A245 VanDerWaalsContact O-N 3.16Å
242	S	93.9	Very high	94.6	Very high	61 Å²	61	36.9 Å²	36.9	43%	0.427	20%	0.203	S	C	.	.	H	α-helix	trans	-62.9	-36.1	177.6	52.5	0	0	0	0	113.9	D217 V244 A245 Q246	D217-S242 VanDerWaalsContact O-CA 3.23Å; D217-S242 WeakPolarHBondContact O-CA 3.23Å; D217-S242 WeakPolarHBondContact O-CB 3.46Å; S242-V244 PolarHBondContact O-N 2.9Å; S242-A245 PolarHBondContact O-N 3.07Å; S242-A245 VanDerWaalsContact O-N 3.11Å; S242-Q246 PolarHBondContact O-N 3.22Å
243	V	93.4	Very high	94.6	Very high	59 Å²	59	35.8 Å²	35.8	36%	0.358	19%	0.192	S	C	.	.	H	α-helix	trans	-56.9	-37.7	173	179.8	0	0	0	0	111.1	A88 D241 N247	A88-V243 HydrophobicContact CB-CG2 4.01Å; D241-V243 VanDerWaalsContact C-N 3.35Å; D241-V243 PolarHBondContact O-N 2.85Å; V243-N247 WeakPolarHBondContact O-CB 3.46Å; V243-N247 PolarHBondContact O-N 2.92Å
244	V	93.1	Very high	94.6	Very high	17 Å²	17	39.7 Å²	39.7	10%	0.103	20%	0.204	C	C	.	.	H	α-helix	trans	-72.2	-40.2	177.4	-174.7	0	0	0	0	110.6	A239 D241 S242 N247 I248	A239-V244 HydrophobicContact CB-CB 4.23Å; A239-V244 HydrophobicContact CB-CG1 4.12Å; D241-V244 HydrophobicContact CB-CG2 4.32Å; D241-V244 WeakPolarHBondContact O-CB 3.28Å; D241-V244 PolarHBondContact O-N 3.33Å; D241-V244 VanDerWaalsContact O-N 3.11Å; S242-V244 PolarHBondContact O-N 2.9Å; V244-N247 PolarHBondContact O-N 3.47Å; V244-I248 HydrophobicContact CG1-CD1 3.97Å; V244-I248 HydrophobicContact CG1-CG1 4.48Å; V244-I248 WeakPolarHBondContact O-CB 3.15Å; V244-I248 WeakPolarHBondContact O-CD1 3.4Å; V244-I248 WeakPolarHBondContact O-CG1 3.38Å; V244-I248 PolarHBondContact O-N 2.88Å
245	A	95.6	Very high	94.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.4	-39.5	174.8	0	0	0	0	0	112.5	H215 F220 A239 D241 S242 H249	H215-A245 HydrophobicContact CB-CB 4.07Å; F220-A245 HydrophobicContact CB-CB 4.49Å; A239-A245 HydrophobicContact CB-CB 4.17Å; D241-A245 PolarHBondContact O-N 3.06Å; D241-A245 VanDerWaalsContact O-N 3.16Å; S242-A245 PolarHBondContact O-N 3.07Å; S242-A245 VanDerWaalsContact O-N 3.11Å; A245-H249 WeakPolarHBondContact O-CB 3.37Å; A245-H249 PolarHBondContact O-N 3.01Å; A245-H249 VanDerWaalsContact O-N 3.08Å
246	Q	95.2	Very high	94.4	Very high	83 Å²	83	39.6 Å²	39.6	39%	0.388	21%	0.207	S	C	.	.	H	α-helix	trans	-63.5	-48.8	172.8	-178.4	177.9	-5.3	0	0	111.6	S242 I248 H249 E250	S242-Q246 PolarHBondContact O-N 3.22Å; Q246-I248 VanDerWaalsContact C-N 3.34Å; Q246-I248 PolarHBondContact O-N 3.32Å; Q246-H249 WeakPolarHBondContact O-CB 3.43Å; Q246-H249 PolarHBondContact O-N 2.75Å; Q246-H249 VanDerWaalsContact O-N 3.16Å; Q246-E250 HydrophobicContact CG-CG 4.42Å; Q246-E250 VanDerWaalsContact CG-OE1 3.25Å; Q246-E250 WeakPolarHBondContact CG-OE1 3.21Å; Q246-E250 PolarHBondContact NE2-OE1 3.02Å; Q246-E250 WeakPolarHBondContact O-CG 3.5Å; Q246-E250 PolarHBondContact O-N 2.83Å
247	N	94	Very high	94.1	Very high	50 Å²	50	44.5 Å²	44.5	27%	0.267	23%	0.229	S	C	.	.	H	α-helix	trans	-58.1	-45.2	176.4	-173.4	134.9	0	0	0	111.4	V243 V244 H249 E250 T251	V243-N247 WeakPolarHBondContact O-CB 3.46Å; V243-N247 PolarHBondContact O-N 2.92Å; V244-N247 PolarHBondContact O-N 3.47Å; N247-H249 VanDerWaalsContact C-N 3.28Å; N247-H249 PolarHBondContact O-N 3.12Å; N247-E250 PolarHBondContact O-N 3.04Å; N247-T251 PolarHBondContact ND2-OG1 3.47Å; N247-T251 VanDerWaalsContact ND2-OG1 3.17Å; N247-T251 WeakPolarHBondContact O-CB 3.46Å; N247-T251 PolarHBondContact O-N 2.85Å; N247-T251 PolarHBondContact O-OG1 2.81Å; N247-T251 VanDerWaalsContact O-OG1 3.07Å
248	I	95	Very high	93.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-58.4	-44.7	177.8	-70.5	163.4	0	0	0	110.1	W163 V165 L184 F220 A239 V244 Q246 I252	W163-I248 HydrophobicContact CB-CD1 4.09Å; W163-I248 HydrophobicContact CB-CG1 4.3Å; W163-I248 VanDerWaalsContact CD1-CG1 3.43Å; W163-I248 HydrophobicContact CD2-CD1 4.49Å; W163-I248 HydrophobicContact CD2-CG1 3.75Å; W163-I248 HydrophobicContact CG-CD1 3.92Å; W163-I248 HydrophobicContact CG-CG1 3.61Å; W163-I248 HydrophobicContact CZ2-CG1 4.38Å; V165-I248 HydrophobicContact CG1-CD1 4.08Å; L184-I248 HydrophobicContact CD2-CG2 3.65Å; F220-I248 HydrophobicContact CB-CG2 4.48Å; F220-I248 HydrophobicContact CD1-CG2 3.4Å; F220-I248 HydrophobicContact CD2-CG2 4Å; F220-I248 HydrophobicContact CE1-CG2 3.46Å; F220-I248 VanDerWaalsContact CE1-CG2 3.46Å; F220-I248 HydrophobicContact CE2-CG2 4.09Å; F220-I248 HydrophobicContact CG-CB 4.4Å; F220-I248 HydrophobicContact CG-CG2 3.69Å; F220-I248 HydrophobicContact CZ-CG2 3.83Å; A239-I248 HydrophobicContact CB-CD1 4.06Å; V244-I248 HydrophobicContact CG1-CD1 3.97Å; V244-I248 HydrophobicContact CG1-CG1 4.48Å; V244-I248 WeakPolarHBondContact O-CB 3.15Å; V244-I248 WeakPolarHBondContact O-CD1 3.4Å; V244-I248 WeakPolarHBondContact O-CG1 3.38Å; V244-I248 PolarHBondContact O-N 2.88Å; Q246-I248 VanDerWaalsContact C-N 3.34Å; Q246-I248 PolarHBondContact O-N 3.32Å; I248-I252 HydrophobicContact CG2-CD1 3.71Å; I248-I252 WeakPolarHBondContact O-CB 3.34Å; I248-I252 WeakPolarHBondContact O-CD1 3.48Å; I248-I252 VanDerWaalsContact O-CG1 3.3Å; I248-I252 WeakPolarHBondContact O-CG1 3.2Å; I248-I252 PolarHBondContact O-N 3.18Å; I248-I252 VanDerWaalsContact O-N 3.11Å
249	H	95.5	Very high	93.4	Very high	35 Å²	35	45 Å²	45	16%	0.162	24%	0.239	C	C	.	.	H	α-helix	trans	-61.7	-49.4	176.8	165.7	-117.7	0	0	0	112.8	G214 H215 F220 A245 Q246 N247 I252 L253	G214-H249 VanDerWaalsContact CA-CD2 3.48Å; G214-H249 WeakPolarHBondContact CA-CD2 3.21Å; H215-H249 HydrophobicContact CB-CB 4.29Å; H215-H249 AromaticContact CE1-ND1 3.82Å; H215-H249 AromaticContact ND1-CG 3.66Å; H215-H249 AromaticContact ND1-ND1 3.31Å; H215-H249 PolarHBondContact ND1-ND1 2.77Å; F220-H249 HydrophobicContact CD2-CB 3.92Å; F220-H249 HydrophobicContact CE2-CB 3.82Å; A245-H249 WeakPolarHBondContact O-CB 3.37Å; A245-H249 PolarHBondContact O-N 3.01Å; A245-H249 VanDerWaalsContact O-N 3.08Å; Q246-H249 WeakPolarHBondContact O-CB 3.43Å; Q246-H249 PolarHBondContact O-N 2.75Å; Q246-H249 VanDerWaalsContact O-N 3.16Å; N247-H249 VanDerWaalsContact C-N 3.28Å; N247-H249 PolarHBondContact O-N 3.12Å; H249-I252 PolarHBondContact O-N 2.91Å; H249-L253 WeakPolarHBondContact O-CB 3.3Å; H249-L253 PolarHBondContact O-N 2.86Å
250	E	94.9	Very high	92.9	Very high	100 Å²	100	50.8 Å²	50.8	47%	0.467	26%	0.263	S	S	.	.	H	α-helix	trans	-65.5	-46.9	-177	-73	173.7	-171.4	0	0	111.9	Q246 N247 I252 L253 E254	Q246-E250 HydrophobicContact CG-CG 4.42Å; Q246-E250 VanDerWaalsContact CG-OE1 3.25Å; Q246-E250 WeakPolarHBondContact CG-OE1 3.21Å; Q246-E250 PolarHBondContact NE2-OE1 3.02Å; Q246-E250 WeakPolarHBondContact O-CG 3.5Å; Q246-E250 PolarHBondContact O-N 2.83Å; N247-E250 PolarHBondContact O-N 3.04Å; E250-I252 PolarHBondContact O-N 3.44Å; E250-L253 PolarHBondContact O-N 3.31Å; E250-E254 WeakPolarHBondContact O-CB 3.32Å; E250-E254 PolarHBondContact O-N 2.71Å
251	T	94.6	Very high	92.4	Very high	11 Å²	11	52.2 Å²	52.2	7%	0.067	27%	0.267	C	S	.	.	H	α-helix	trans	-59.8	-44.1	176	-60.3	0	0	0	0	112.4	E161 W163 L186 N247 E254 A255	E161-T251 HydrophobicContact CG-CG2 4.49Å; E161-T251 WeakPolarHBondContact OE1-CG2 3.43Å; W163-T251 HydrophobicContact CH2-CG2 3.68Å; W163-T251 HydrophobicContact CZ2-CG2 3.91Å; L186-T251 HydrophobicContact CD2-CG2 3.69Å; N247-T251 PolarHBondContact ND2-OG1 3.47Å; N247-T251 VanDerWaalsContact ND2-OG1 3.17Å; N247-T251 WeakPolarHBondContact O-CB 3.46Å; N247-T251 PolarHBondContact O-N 2.85Å; N247-T251 PolarHBondContact O-OG1 2.81Å; N247-T251 VanDerWaalsContact O-OG1 3.07Å; T251-E254 PolarHBondContact O-N 3.3Å; T251-A255 PolarHBondContact O-N 2.77Å
252	I	95.2	Very high	91.2	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-70.1	-38.3	-179.8	-71.9	169	0	0	0	110.6	L184 L186 I191 L207 F220 I248 H249 E250 A255 M256	L184-I252 HydrophobicContact CD2-CD1 4.02Å; L186-I252 HydrophobicContact CD2-CG1 4.19Å; I191-I252 HydrophobicContact CD1-CD1 3.83Å; I191-I252 HydrophobicContact CD1-CG1 4.06Å; I191-I252 HydrophobicContact CD1-CG2 3.86Å; L207-I252 HydrophobicContact CD2-CG2 4.47Å; F220-I252 HydrophobicContact CE1-CD1 3.73Å; F220-I252 HydrophobicContact CZ-CD1 3.62Å; I248-I252 HydrophobicContact CG2-CD1 3.71Å; I248-I252 WeakPolarHBondContact O-CB 3.34Å; I248-I252 WeakPolarHBondContact O-CD1 3.48Å; I248-I252 VanDerWaalsContact O-CG1 3.3Å; I248-I252 WeakPolarHBondContact O-CG1 3.2Å; I248-I252 PolarHBondContact O-N 3.18Å; I248-I252 VanDerWaalsContact O-N 3.11Å; H249-I252 PolarHBondContact O-N 2.91Å; E250-I252 PolarHBondContact O-N 3.44Å; I252-A255 PolarHBondContact O-N 3.46Å; I252-M256 HydrophobicContact CG2-SD 4.27Å; I252-M256 WeakPolarHBondContact O-CB 3.43Å; I252-M256 WeakPolarHBondContact O-CG 3.43Å; I252-M256 PolarHBondContact O-N 3.46Å
253	L	94.5	Very high	89.8	Confident	56 Å²	56	58 Å²	58	29%	0.293	30%	0.299	S	S	.	.	H	α-helix	trans	-66.5	-37.2	175.8	-177.1	61.8	0	0	0	112	H249 E250 K257	H249-L253 WeakPolarHBondContact O-CB 3.3Å; H249-L253 PolarHBondContact O-N 2.86Å; E250-L253 PolarHBondContact O-N 3.31Å; L253-K257 HydrophobicContact CG-CD 4.47Å; L253-K257 WeakPolarHBondContact O-CD 3.5Å; L253-K257 VanDerWaalsContact O-CG 3.24Å; L253-K257 WeakPolarHBondContact O-CG 3.4Å; L253-K257 PolarHBondContact O-N 2.81Å
254	E	93.9	Very high	88.1	Confident	104 Å²	104	61.8 Å²	61.8	49%	0.486	31%	0.312	S	S	.	.	H	α-helix	trans	-60.5	-50.3	169.9	-174.5	-155.1	122.8	0	0	111	K160 E250 T251 M256 K257 A258	K160-E254 IonicContact NZ-OE1 3.14Å; K160-E254 PolarHBondContact NZ-OE1 3.21Å; E250-E254 WeakPolarHBondContact O-CB 3.32Å; E250-E254 PolarHBondContact O-N 2.71Å; T251-E254 PolarHBondContact O-N 3.3Å; E254-M256 VanDerWaalsContact C-N 3.31Å; E254-M256 PolarHBondContact O-N 3.33Å; E254-K257 WeakPolarHBondContact O-CB 3.25Å; E254-K257 PolarHBondContact O-N 3.21Å; E254-K257 VanDerWaalsContact O-N 3.09Å; E254-A258 PolarHBondContact O-N 2.88Å
255	A	93.4	Very high	86.2	Confident	13 Å²	13	67.8 Å²	67.8	11%	0.107	34%	0.337	C	S	.	.	H	α-helix	trans	-60.9	-38.5	178.2	0	0	0	0	0	112.5	L186 L207 T251 I252 M259	L186-A255 HydrophobicContact CD1-CB 4.19Å; L186-A255 HydrophobicContact CD2-CB 4.15Å; L207-A255 HydrophobicContact CD1-CB 3.95Å; T251-A255 PolarHBondContact O-N 2.77Å; I252-A255 PolarHBondContact O-N 3.46Å; A255-M259 VanDerWaalsContact O-CB 3.28Å; A255-M259 WeakPolarHBondContact O-CB 3.45Å; A255-M259 PolarHBondContact O-N 3.36Å
256	M	92.3	Very high	84.4	Confident	31 Å²	31	77.8 Å²	77.8	15%	0.153	38%	0.375	C	S	.	.	H	α-helix	trans	-64.1	-41	172.7	-74.1	178.4	64.6	0	0	112.5	L207 I210 I252 E254 K260	L207-M256 HydrophobicContact CB-CG 4.41Å; L207-M256 HydrophobicContact CD2-CG 4.05Å; I210-M256 HydrophobicContact CB-CE 3.71Å; I210-M256 HydrophobicContact CB-SD 3.87Å; I210-M256 HydrophobicContact CD1-SD 4.16Å; I210-M256 HydrophobicContact CG2-CE 3.66Å; I210-M256 HydrophobicContact CG2-SD 3.62Å; I210-M256 WeakPolarHBondContact O-CE 3.41Å; I252-M256 HydrophobicContact CG2-SD 4.27Å; I252-M256 WeakPolarHBondContact O-CB 3.43Å; I252-M256 WeakPolarHBondContact O-CG 3.43Å; I252-M256 PolarHBondContact O-N 3.46Å; E254-M256 VanDerWaalsContact C-N 3.31Å; E254-M256 PolarHBondContact O-N 3.33Å; M256-K260 WeakPolarHBondContact O-CB 3.28Å; M256-K260 PolarHBondContact O-N 3.09Å
257	K	91.3	Very high	82.1	Confident	132 Å²	132	79.3 Å²	79.3	57%	0.574	39%	0.392	S	S	*	.	H	α-helix	trans	-64.2	-51	176.2	-74	163.6	178.7	172	0	111.4	L253 E254 M259 K260 E261	L253-K257 HydrophobicContact CG-CD 4.47Å; L253-K257 WeakPolarHBondContact O-CD 3.5Å; L253-K257 VanDerWaalsContact O-CG 3.24Å; L253-K257 WeakPolarHBondContact O-CG 3.4Å; L253-K257 PolarHBondContact O-N 2.81Å; E254-K257 WeakPolarHBondContact O-CB 3.25Å; E254-K257 PolarHBondContact O-N 3.21Å; E254-K257 VanDerWaalsContact O-N 3.09Å; K257-M259 VanDerWaalsContact C-N 3.35Å; K257-M259 PolarHBondContact O-N 3.18Å; K257-K260 WeakPolarHBondContact O-CB 3.23Å; K257-K260 PolarHBondContact O-N 2.99Å; K257-E261 PolarHBondContact O-N 2.99Å
258	A	90.4	Very high	79.8	Confident	44 Å²	44	85.8 Å²	85.8	36%	0.364	41%	0.413	S	S	.	.	H	α-helix	trans	-61.4	-41.1	179.7	0	0	0	0	0	112.1	E254 K260 E261 L262	E254-A258 PolarHBondContact O-N 2.88Å; A258-K260 PolarHBondContact O-N 3.36Å; A258-E261 WeakPolarHBondContact O-CB 3.16Å; A258-E261 PolarHBondContact O-N 2.89Å; A258-L262 WeakPolarHBondContact O-CG 3.38Å; A258-L262 PolarHBondContact O-N 2.68Å
259	M	86.3	Confident	77.4	Confident	31 Å²	31	89.1 Å²	89.1	15%	0.153	44%	0.436	C	S	.	.	H	α-helix	trans	-64.6	-37.1	173.1	177.2	-147	56.4	0	0	112.1	L207 M208 A255 K257 L262 S263	L207-M259 HydrophobicContact CB-CE 3.95Å; L207-M259 HydrophobicContact CB-SD 3.45Å; L207-M259 WeakPolarHBondContact CB-SD 3.48Å; M208-M259 HydrophobicContact CB-CE 4.03Å; M208-M259 HydrophobicContact CB-SD 3.94Å; M208-M259 PolarHBondContact N-SD 3.43Å; M208-M259 VanDerWaalsContact N-SD 3.36Å; A255-M259 VanDerWaalsContact O-CB 3.28Å; A255-M259 WeakPolarHBondContact O-CB 3.45Å; A255-M259 PolarHBondContact O-N 3.36Å; K257-M259 VanDerWaalsContact C-N 3.35Å; K257-M259 PolarHBondContact O-N 3.18Å; M259-L262 PolarHBondContact O-N 3.12Å; M259-S263 PolarHBondContact O-N 3.12Å
260	K	83.9	Confident	75	Confident	129 Å²	129	95.5 Å²	95.5	56%	0.561	46%	0.464	S	S	*	.	H	α-helix	trans	-62.4	-46.3	174.1	-170.5	-160.6	169.6	-150.2	0	110.7	M256 K257 A258 L262 S263 E264	M256-K260 WeakPolarHBondContact O-CB 3.28Å; M256-K260 PolarHBondContact O-N 3.09Å; K257-K260 WeakPolarHBondContact O-CB 3.23Å; K257-K260 PolarHBondContact O-N 2.99Å; A258-K260 PolarHBondContact O-N 3.36Å; K260-L262 VanDerWaalsContact C-N 3.35Å; K260-L262 PolarHBondContact O-N 2.72Å; K260-S263 WeakPolarHBondContact O-CA 3.42Å; K260-S263 WeakPolarHBondContact O-CB 3.45Å; K260-S263 PolarHBondContact O-N 3.06Å; K260-S263 PolarHBondContact O-OG 3.41Å; K260-E264 IonicContact NZ-OE2 2.65Å; K260-E264 PolarHBondContact O-N 2.96Å
261	E	80.3	Confident	72.3	Confident	116 Å²	116	94.2 Å²	94.2	54%	0.542	47%	0.466	S	S	.	.	H	α-helix	trans	-57.4	-46.8	176.1	-164.3	-175.2	158.3	0	0	111.3	K257 A258 S263 E264 F265	K257-E261 PolarHBondContact O-N 2.99Å; A258-E261 WeakPolarHBondContact O-CB 3.16Å; A258-E261 PolarHBondContact O-N 2.89Å; E261-S263 PolarHBondContact O-N 3.21Å; E261-E264 WeakPolarHBondContact O-CA 3.48Å; E261-E264 WeakPolarHBondContact O-CB 3.24Å; E261-E264 PolarHBondContact O-N 3.46Å; E261-F265 HydrophobicContact CG-CE2 3.92Å; E261-F265 WeakPolarHBondContact O-CD2 3.35Å; E261-F265 PolarHBondContact O-N 3.34Å; E261-F265 VanDerWaalsContact O-N 3.16Å
262	L	69.2	Low	69.7	Low	126 Å²	126	100.4 Å²	100.4	66%	0.66	49%	0.494	S	S	*	.	H	α-helix	trans	-57.9	-30.5	173.3	-71.1	172.4	0	0	0	113.8	A258 M259 K260	A258-L262 WeakPolarHBondContact O-CG 3.38Å; A258-L262 PolarHBondContact O-N 2.68Å; M259-L262 PolarHBondContact O-N 3.12Å; K260-L262 VanDerWaalsContact C-N 3.35Å; K260-L262 PolarHBondContact O-N 2.72Å
263	S	64.1	Low	67.1	Low	81 Å²	81	106 Å²	106	57%	0.566	53%	0.533	S	S	*	.	H	α-helix	trans	-78.6	-26.3	173.5	77.5	0	0	0	0	113.7	M259 K260 E261 R266	M259-S263 PolarHBondContact O-N 3.12Å; K260-S263 WeakPolarHBondContact O-CA 3.42Å; K260-S263 WeakPolarHBondContact O-CB 3.45Å; K260-S263 PolarHBondContact O-N 3.06Å; K260-S263 PolarHBondContact O-OG 3.41Å; E261-S263 PolarHBondContact O-N 3.21Å; S263-R266 PolarHBondContact O-N 3.03Å
264	E	57.5	Low	64.6	Low	138 Å²	138	108.5 Å²	108.5	65%	0.645	56%	0.555	S	S	*	*	H	α-helix	trans	-78.3	-22.4	179.9	-164.6	153.2	-175.9	0	0	111.9	K260 E261 R266	K260-E264 IonicContact NZ-OE2 2.65Å; K260-E264 PolarHBondContact O-N 2.96Å; E261-E264 WeakPolarHBondContact O-CA 3.48Å; E261-E264 WeakPolarHBondContact O-CB 3.24Å; E261-E264 PolarHBondContact O-N 3.46Å; E264-R266 PolarHBondContact O-N 2.96Å; E264-R266 VanDerWaalsContact O-N 3.12Å
265	F	52.9	Low	62.3	Low	144 Å²	144	108.5 Å²	108.5	63%	0.632	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-1	168.2	-77	-68.6	0	0	0	115.3	E261 P267	E261-F265 HydrophobicContact CG-CE2 3.92Å; E261-F265 WeakPolarHBondContact O-CD2 3.35Å; E261-F265 PolarHBondContact O-N 3.34Å; E261-F265 VanDerWaalsContact O-N 3.16Å; F265-P267 WeakPolarHBondContact O-CD 3.47Å
266	R	58.6	Low	60	Low	210 Å²	210	114.7 Å²	114.7	79%	0.792	60%	0.603	S	S	*	*	S	Bend	trans	-59.2	113.4	163.6	-176.1	-173.9	-171.1	95.9	1.3	107.6	S263 E264 R268	S263-R266 PolarHBondContact O-N 3.03Å; E264-R266 PolarHBondContact O-N 2.96Å; E264-R266 VanDerWaalsContact O-N 3.12Å; R266-R268 PolarHBondContact O-N 3.06Å
267	P	45.5	Very low	57.8	Low	114 Å²	114	120.1 Å²	120.1	74%	0.74	63%	0.633	S	S	*	*			trans	-65.4	107	-177.1	-18.6	32.7	0	0	0	108.1	F265 S269	F265-P267 WeakPolarHBondContact O-CD 3.47Å; P267-S269 PolarHBondContact O-N 3.49Å
268	R	46.5	Very low	55.6	Low	186 Å²	186	119.6 Å²	119.6	70%	0.702	64%	0.643	S	S	*	*			trans	-65.6	91.8	168.7	-174.6	-177.2	-173.1	103	4.9	105.7	R266 K270 S411	R266-R268 PolarHBondContact O-N 3.06Å; R268-K270 PolarHBondContact O-N 3.02Å; R268-S411 PolarHBondContact NE-OG 3.42Å; R268-S411 PolarHBondContact NH2-OG 3Å
269	S	45	Very low	53.2	Low	71 Å²	71	124.9 Å²	124.9	50%	0.497	66%	0.664	S	S	.	*			trans	-49.6	100.8	-171.3	59.5	0	0	0	0	109.3	P267 S271 S409	P267-S269 PolarHBondContact O-N 3.49Å; S269-S271 PolarHBondContact O-N 3.12Å; S269-S409 PolarHBondContact OG-OG 2.81Å
270	K	44.6	Very low	51.1	Low	169 Å²	169	128.4 Å²	128.4	74%	0.735	69%	0.691	S	S	*	*			trans	-72.4	83.9	-179.4	-81.1	-176.6	177.7	177.4	0	108.2	R268 Q272	R268-K270 PolarHBondContact O-N 3.02Å; K270-Q272 HydrophobicContact CB-CG 4.22Å; K270-Q272 HydrophobicContact CD-CG 4.42Å; K270-Q272 PolarHBondContact O-N 3.43Å
271	S	38.8	Very low	49	Very low	73 Å²	73	128 Å²	128	51%	0.51	70%	0.699	S	S	.	*			trans	-64.2	62.1	147.9	42.5	0	0	0	0	108.9	S269 S273 S409	S269-S271 PolarHBondContact O-N 3.12Å; S271-S273 VanDerWaalsContact C-N 3.27Å; S271-S273 PolarHBondContact O-N 3.16Å; S271-S409 PolarHBondContact OG-O 2.84Å
272	Q	38.6	Very low	47.2	Very low	140 Å²	140	128 Å²	128	65%	0.654	71%	0.71	S	S	*	*			trans	-71.2	91.7	162	-84.9	-176	-52.4	0	0	106.8	K270 S274	K270-Q272 HydrophobicContact CB-CG 4.22Å; K270-Q272 HydrophobicContact CD-CG 4.42Å; K270-Q272 PolarHBondContact O-N 3.43Å; Q272-S274 VanDerWaalsContact C-N 3.34Å; Q272-S274 PolarHBondContact O-N 2.65Å
273	S	42	Very low	45.8	Very low	117 Å²	117	128.8 Å²	128.8	82%	0.818	72%	0.719	S	S	*	*			trans	-66.1	95.6	161.9	51.7	0	0	0	0	108.4	S271 S275	S271-S273 VanDerWaalsContact C-N 3.27Å; S271-S273 PolarHBondContact O-N 3.16Å; S273-S275 PolarHBondContact O-N 2.96Å; S273-S275 VanDerWaalsContact O-N 3.13Å
274	S	41.8	Very low	44.7	Very low	109 Å²	109	135.8 Å²	135.8	76%	0.762	73%	0.734	S	S	*	*			trans	-70.9	98.9	-177.1	-60.4	0	0	0	0	112.6	Q272	Q272-S274 VanDerWaalsContact C-N 3.34Å; Q272-S274 PolarHBondContact O-N 2.65Å
275	S	46.1	Very low	44	Very low	105 Å²	105	139.8 Å²	139.8	73%	0.734	74%	0.743	S	S	*	*			trans	-177.9	93.4	148.1	47.6	0	0	0	0	114.4	S273	S273-S275 PolarHBondContact O-N 2.96Å; S273-S275 VanDerWaalsContact O-N 3.13Å
276	T	44.2	Very low	43.2	Very low	142 Å²	142	141 Å²	141	87%	0.871	75%	0.75	S	S	*	*			trans	-137.3	116.8	152.3	50.6	0	0	0	0	108.4
277	N	45.6	Very low	42.2	Very low	145 Å²	145	137.9 Å²	137.9	78%	0.775	75%	0.748	S	S	*	*			trans	-75.3	146	-167.1	-55.8	-48.4	0	0	0	112.5
278	P	44.9	Very low	41.5	Very low	121 Å²	121	137.8 Å²	137.8	79%	0.786	74%	0.741	S	S	*	*			trans	-69	128.9	160.7	30.6	-32.2	0	0	0	109.3	S280	P278-S280 PolarHBondContact O-N 2.77Å; P278-S280 VanDerWaalsContact O-N 3.11Å
279	I	41.5	Very low	40.8	Very low	156 Å²	156	136.3 Å²	136.3	80%	0.8	75%	0.747	S	S	*	*			trans	-77.4	99.7	177.5	-62.4	176.5	0	0	0	109.1	V281	I279-V281 PolarHBondContact O-N 3.03Å
280	S	40.9	Very low	40.4	Very low	104 Å²	104	140.9 Å²	140.9	73%	0.727	77%	0.765	S	S	*	*			trans	-78.5	108.4	167.2	55.9	0	0	0	0	110.1	P278 P282	P278-S280 PolarHBondContact O-N 2.77Å; P278-S280 VanDerWaalsContact O-N 3.11Å; S280-P282 WeakPolarHBondContact O-CD 3.49Å
281	V	40.3	Very low	41.3	Very low	121 Å²	121	138.4 Å²	138.4	73%	0.733	77%	0.767	S	S	*	*			trans	-67.7	122.5	176.9	-177.7	0	0	0	0	110.2	I279 T283	I279-V281 PolarHBondContact O-N 3.03Å; V281-T283 PolarHBondContact O-N 2.83Å
282	P	42.5	Very low	41.7	Very low	117 Å²	117	140.1 Å²	140.1	76%	0.76	78%	0.776	S	S	*	*			trans	-81.3	109.3	-178.9	-13.4	30.3	0	0	0	112.7	S280 R284	S280-P282 WeakPolarHBondContact O-CD 3.49Å; P282-R284 PolarHBondContact O-N 3.21Å; P282-R284 VanDerWaalsContact O-N 3.13Å
283	T	39.6	Very low	41.4	Very low	141 Å²	141	138.4 Å²	138.4	87%	0.865	78%	0.779	S	S	*	*			trans	-73.7	99.7	172.2	-51.6	0	0	0	0	111	V281	V281-T283 PolarHBondContact O-N 2.83Å
284	R	42.1	Very low	41.3	Very low	229 Å²	229	141.4 Å²	141.4	86%	0.864	78%	0.78	S	S	*	*			trans	-128.6	86.2	174	-154.7	178.4	-160.6	-88.6	5.2	114.5	P282	P282-R284 PolarHBondContact O-N 3.21Å; P282-R284 VanDerWaalsContact O-N 3.13Å
285	R	41.1	Very low	41	Very low	222 Å²	222	143 Å²	143	84%	0.838	79%	0.786	S	S	*	*			trans	26.8	103	140.3	-58.6	178.6	-174.1	162.9	1.9	117.5
286	H	37.8	Very low	40.5	Very low	169 Å²	169	141.7 Å²	141.7	78%	0.782	79%	0.789	S	S	*	*				11	119.5	127.9	-175.8	-79.3	0	0	0	117.8
287	L	36.8	Very low	40.5	Very low	145 Å²	145	143.1 Å²	143.1	76%	0.759	79%	0.79	S	S	*	*			trans	-162	117.3	146.2	-105.2	171.2	0	0	0	111.1
288	N	30.3	Very low	40.3	Very low	111 Å²	111	141.2 Å²	141.2	59%	0.594	79%	0.786	S	S	*	*			trans	41.6	107	146.6	-56.1	4.6	0	0	0	120.4
289	N	32.3	Very low	39.7	Very low	155 Å²	155	146.5 Å²	146.5	83%	0.829	79%	0.79	S	S	*	*				171.9	151.3	98.5	-84.1	-36.5	0	0	0	112.3
290	L	36.1	Very low	39.3	Very low	167 Å²	167	151 Å²	151	87%	0.874	80%	0.797	S	S	*	*			trans	-106.1	-162.4	168.8	-59.8	172.5	0	0	0	110.1
291	P	64.4	Low	38.8	Very low	117 Å²	117	150.4 Å²	150.4	76%	0.76	79%	0.793	S	S	*	*			trans	-95.8	-162.2	-134.7	31.4	-8.4	0	0	0	111.8
292	P	47.3	Very low	38.5	Very low	110 Å²	110	155.6 Å²	155.6	71%	0.714	80%	0.799	S	S	*	*				-154.3	164	97	39.9	-23.1	0	0	0	117.4
293	S	32.8	Very low	38	Very low	103 Å²	103	155.1 Å²	155.1	72%	0.72	80%	0.795	S	S	*	*			trans	74.6	154.6	147.5	84.7	0	0	0	0	118.4
294	Q	39.2	Very low	37.4	Very low	180 Å²	180	155.2 Å²	155.2	84%	0.841	79%	0.79	S	S	*	*			cis	-121.2	145.1	6.6	-73.2	179.9	8.7	0	0	114.2
295	T	35.7	Very low	36.9	Very low	144 Å²	144	150.1 Å²	150.1	88%	0.883	79%	0.789	S	S	*	*			trans	-62.2	142.8	162.9	44.6	0	0	0	0	112
296	G	36.2	Very low	36.5	Very low	76 Å²	76	146.4 Å²	146.4	78%	0.784	79%	0.791	S	S	*	*			trans	-159.1	27.2	-175	0	0	0	0	0	118.2
297	L	42.5	Very low	36.1	Very low	173 Å²	173	143.9 Å²	143.9	91%	0.906	79%	0.791	S	S	*	*			trans	-76.2	134.9	165.4	-66.9	177.4	0	0	0	109.2
298	P	42.7	Very low	35.7	Very low	105 Å²	105	140.6 Å²	140.6	68%	0.682	79%	0.785	S	S	*	*				-147.4	148.1	96.3	36.8	-20.7	0	0	0	117
299	R	32.3	Very low	35.6	Very low	232 Å²	232	141.3 Å²	141.3	88%	0.875	79%	0.794	S	S	*	*			trans	48.4	114.1	144.4	-64	-179.7	170.1	113.3	-1.6	120.5
300	R	31.6	Very low	35.5	Very low	249 Å²	249	139.7 Å²	139.7	94%	0.94	80%	0.795	S	S	*	*				37.1	138.2	123.4	-81.4	-173.9	179.6	-137.6	-0.2	119.3
301	S	30.8	Very low	36.2	Very low	93 Å²	93	136.6 Å²	136.6	65%	0.65	79%	0.785	S	S	*	*			cis	-171.4	159.7	19.3	52.1	0	0	0	0	114.8
302	R	34.5	Very low	34.7	Very low	230 Å²	230	137.4 Å²	137.4	87%	0.868	79%	0.787	S	S	*	*			trans	70.1	145.7	159.9	-72.2	178.2	169.1	158.4	-5.3	115.8
303	T	31.4	Very low	34	Very low	107 Å²	107	138 Å²	138	66%	0.656	79%	0.793	S	S	*	*			cis	-151.7	143.9	1.6	-0.7	0	0	0	0	111.7
304	D	28.1	Very low	33.9	Very low	143 Å²	143	137.6 Å²	137.6	77%	0.765	79%	0.791	S	S	*	*			trans	57.3	159.5	146.2	-56	-28.4	0	0	0	124.8
305	S	30.1	Very low	33.6	Very low	122 Å²	122	138 Å²	138	85%	0.853	79%	0.79	S	S	*	*			trans	74.8	114.5	171.4	69.7	0	0	0	0	118
306	T	32.5	Very low	33.2	Very low	143 Å²	143	136.1 Å²	136.1	88%	0.877	78%	0.782	S	S	*	*			trans	-104.6	121.8	-174.5	46	0	0	0	0	113.8
307	C	29.7	Very low	33	Very low	117 Å²	117	140.4 Å²	140.4	79%	0.791	79%	0.785	S	S	*	*			trans	-52	153.6	152.3	-111.6	0	0	0	0	110.9
308	A	28.3	Very low	32.3	Very low	76 Å²	76	137.5 Å²	137.5	63%	0.628	78%	0.78	S	S	*	*			cis	74.4	115.1	26.1	0	0	0	0	0	116.7
309	T	30	Very low	31.7	Very low	125 Å²	125	138 Å²	138	77%	0.767	78%	0.784	S	S	*	*			trans	40.1	112.9	145.9	59.1	0	0	0	0	122.9
310	S	28.6	Very low	31.4	Very low	122 Å²	122	137.4 Å²	137.4	85%	0.853	78%	0.782	S	S	*	*			trans	58.6	-160.4	131.7	-124.8	0	0	0	0	117.6
311	P	52.1	Low	31.3	Very low	102 Å²	102	132.4 Å²	132.4	66%	0.662	77%	0.772	S	S	*	*			cis	-132.5	179.7	-38.3	35.6	-18.3	0	0	0	115.3
312	V	32	Very low	31.3	Very low	133 Å²	133	138.4 Å²	138.4	81%	0.806	78%	0.781	S	S	*	*			trans	69.8	142.5	142	157.7	0	0	0	0	123.3
313	S	32.4	Very low	31.2	Very low	122 Å²	122	133.5 Å²	133.5	85%	0.853	78%	0.777	S	S	*	*			trans	-163.8	165.1	161.7	-80.6	0	0	0	0	112
314	S	31.3	Very low	31.2	Very low	95 Å²	95	133 Å²	133	66%	0.664	78%	0.783	S	S	*	*			trans	-168.8	174.5	-175.6	61.4	0	0	0	0	116.8
315	K	32.4	Very low	31.3	Very low	189 Å²	189	130.3 Å²	130.3	82%	0.822	78%	0.776	S	S	*	*			trans	87.9	156.7	160.8	-63.5	165.5	-173.4	177.6	0	117.8
316	C	28.3	Very low	31.3	Very low	105 Å²	105	133.2 Å²	133.2	71%	0.709	78%	0.776	S	S	*	*			cis	-162.1	164.5	3	-130.8	0	0	0	0	115.6
317	L	31.2	Very low	31.3	Very low	165 Å²	165	130.1 Å²	130.1	86%	0.864	77%	0.773	S	S	*	*			trans	65.2	176.2	159.6	-61.3	175.6	0	0	0	117.9
318	S	28.2	Very low	31.4	Very low	112 Å²	112	132.8 Å²	132.8	78%	0.783	78%	0.779	S	S	*	*			cis	-151.8	-163.9	11.4	-160.1	0	0	0	0	114.2
319	C	29.2	Very low	31.7	Very low	116 Å²	116	131.1 Å²	131.1	78%	0.784	77%	0.77	S	S	*	*			trans	-149.7	173.2	-178.2	69.5	0	0	0	0	115.8
320	R	27.5	Very low	31.9	Very low	220 Å²	220	131.4 Å²	131.4	83%	0.83	77%	0.771	S	S	*	*			trans	120.2	125.3	144.4	-162.7	174	-178.8	142.8	1.8	121.7
321	I	27.8	Very low	32.1	Very low	143 Å²	143	133 Å²	133	73%	0.733	77%	0.767	S	S	*	*			trans	78.2	172.8	148.6	-74.4	175.4	0	0	0	122.2
322	R	32.4	Very low	31.2	Very low	219 Å²	219	133.6 Å²	133.6	83%	0.826	77%	0.769	S	S	*	*			trans	-105.1	178.4	-155.1	-52.4	169.3	167.9	168.7	-6.3	115.3
323	T	32.8	Very low	31.4	Very low	127 Å²	127	136.8 Å²	136.8	78%	0.779	77%	0.767	S	S	*	*			trans	84.1	129.7	140	31.5	0	0	0	0	122.9
324	A	29.7	Very low	31.7	Very low	97 Å²	97	136.9 Å²	136.9	80%	0.802	77%	0.765	S	S	*	*			trans	65	172.7	152.7	0	0	0	0	0	116.8
325	S	30.6	Very low	31.4	Very low	87 Å²	87	138.2 Å²	138.2	61%	0.608	76%	0.762	S	S	*	*			cis	-157.1	167.7	-1.4	-153.9	0	0	0	0	111
326	E	30.3	Very low	31.2	Very low	182 Å²	182	134.1 Å²	134.1	85%	0.85	76%	0.757	S	S	*	*			trans	52.9	144.3	160.9	-74.2	138.4	112.4	0	0	118.4
327	G	32.3	Very low	31.2	Very low	79 Å²	79	136.1 Å²	136.1	81%	0.814	77%	0.766	S	S	*	*				117.8	148.3	56.3	0	0	0	0	0	106
328	D	32.3	Very low	31	Very low	172 Å²	172	135.2 Å²	135.2	92%	0.92	77%	0.767	S	S	*	*			cis	-152.6	164.5	5	-169.7	28.8	0	0	0	104.3
329	G	35.3	Very low	31	Very low	42 Å²	42	133.5 Å²	133.5	43%	0.433	77%	0.767	S	S	.	*			cis	156.6	169.9	21.3	0	0	0	0	0	108.1
330	T	33.6	Very low	31.2	Very low	130 Å²	130	133.7 Å²	133.7	80%	0.798	77%	0.769	S	S	*	*			trans	76.4	133.7	177.4	72.3	0	0	0	0	118
331	M	32.7	Very low	31.8	Very low	155 Å²	155	128.6 Å²	128.6	76%	0.764	77%	0.765	S	S	*	*			cis	-151.4	153.1	-7.2	-110.4	-53.1	137.7	0	0	114.1
332	T	33.8	Very low	31.9	Very low	116 Å²	116	129 Å²	129	71%	0.712	77%	0.768	S	S	*	*			trans	43.4	107.5	156.5	50.7	0	0	0	0	124.2
333	R	35.6	Very low	31.8	Very low	200 Å²	200	122.9 Å²	122.9	76%	0.755	76%	0.759	S	S	*	*				28.1	150	107.1	-70.7	-176.4	179.4	-175.6	0.8	120.1
334	P	38.1	Very low	31.9	Very low	124 Å²	124	121 Å²	121	81%	0.805	75%	0.749	S	S	*	*			cis	-91.7	161.4	40.5	-14.8	34.5	0	0	0	115.2
335	M	24.9	Very low	31.8	Very low	123 Å²	123	118.1 Å²	118.1	61%	0.606	73%	0.728	S	S	*	*			cis	67.1	117.3	41.4	-69.5	-68.5	-172.2	0	0	113.9
336	S	28.2	Very low	31.6	Very low	103 Å²	103	120 Å²	120	72%	0.72	74%	0.735	S	S	*	*			cis	109.7	109.3	20.9	-72.2	0	0	0	0	112.2
337	V	28.8	Very low	32.5	Very low	147 Å²	147	120.9 Å²	120.9	89%	0.891	74%	0.739	S	S	*	*			trans	-139.5	118.6	154	179.3	0	0	0	0	109.6
338	T	27.4	Very low	32.1	Very low	146 Å²	146	124.4 Å²	124.4	90%	0.896	73%	0.728	S	S	*	*			trans	-112.6	151.5	157	45.9	0	0	0	0	107.3
339	G	27.9	Very low	31.6	Very low	76 Å²	76	121 Å²	121	78%	0.784	71%	0.714	S	S	*	*			trans	-177.8	87.4	-178	0	0	0	0	0	114.7
340	S	33.6	Very low	31.4	Very low	119 Å²	119	127.1 Å²	127.1	83%	0.832	74%	0.735	S	S	*	*			trans	-72.4	168.2	164.4	-43.7	0	0	0	0	110.6
341	P	40.5	Very low	31.1	Very low	114 Å²	114	129.2 Å²	129.2	74%	0.74	74%	0.741	S	S	*	*				-160	-177.1	87.1	45.6	-26.2	0	0	0	117.7
342	L	29.8	Very low	30.8	Very low	152 Å²	152	126.8 Å²	126.8	80%	0.796	74%	0.739	S	S	*	*			trans	66.4	112.9	156	-58.9	-172.3	0	0	0	123.6
343	S	28.9	Very low	30.6	Very low	90 Å²	90	131.9 Å²	131.9	63%	0.629	75%	0.745	S	S	*	*				78.3	157.6	118.1	-59	0	0	0	0	123.7
344	P	35.3	Very low	30.2	Very low	88 Å²	88	126 Å²	126	57%	0.571	73%	0.734	S	S	*	*			trans	-113.4	-178.8	-156.9	43.1	-34.3	0	0	0	116.8	R348 T349	P344-R348 PolarHBondContact O-NH1 2.9Å; P344-R348 VanDerWaalsContact O-NH1 3.11Å; P344-T349 HydrophobicContact CB-CG2 3.41Å; P344-T349 VanDerWaalsContact CB-CG2 3.41Å
345	G	28.1	Very low	29.7	Very low	36 Å²	36	128 Å²	128	37%	0.371	73%	0.733	S	S	.	*			trans	111.4	124.5	164.8	0	0	0	0	0	116.3	R348	G345-R348 VanDerWaalsContact N-CD 3.33Å; G345-R348 WeakPolarHBondContact O-CD 3.34Å; G345-R348 PolarHBondContact O-NH1 2.91Å
346	V	26.8	Very low	29.9	Very low	125 Å²	125	128.1 Å²	128.1	76%	0.758	74%	0.741	S	S	*	*	S	Bend	trans	66	129.2	-173.2	-168.6	0	0	0	0	113.9	R348	V346-R348 WeakPolarHBondContact O-CB 3.5Å; V346-R348 WeakPolarHBondContact O-CG 3.37Å; V346-R348 PolarHBondContact O-N 2.81Å
347	H	48	Very low	30.2	Very low	201 Å²	201	130.2 Å²	130.2	93%	0.931	74%	0.743	S	S	*	*	S	Bend	trans	49.4	33.7	173.5	-83.6	-124.5	0	0	0	114.5
348	R	25.6	Very low	30.3	Very low	154 Å²	154	129.6 Å²	129.6	58%	0.581	74%	0.739	S	S	*	*			trans	-142.3	-176	-161.7	-92.2	178.9	176.7	154.8	-22.3	112.2	P344 G345 V346	P344-R348 PolarHBondContact O-NH1 2.9Å; P344-R348 VanDerWaalsContact O-NH1 3.11Å; G345-R348 VanDerWaalsContact N-CD 3.33Å; G345-R348 WeakPolarHBondContact O-CD 3.34Å; G345-R348 PolarHBondContact O-NH1 2.91Å; V346-R348 WeakPolarHBondContact O-CB 3.5Å; V346-R348 WeakPolarHBondContact O-CG 3.37Å; V346-R348 PolarHBondContact O-N 2.81Å
349	T	21.8	Very low	30.6	Very low	100 Å²	100	127.5 Å²	127.5	61%	0.613	74%	0.737	S	S	*	*			trans	72.3	82.8	162.2	34	0	0	0	0	116.5	P344	P344-T349 HydrophobicContact CB-CG2 3.41Å; P344-T349 VanDerWaalsContact CB-CG2 3.41Å
350	L	29.6	Very low	30.8	Very low	170 Å²	170	135.4 Å²	135.4	89%	0.89	74%	0.743	S	S	*	*				-6.4	135.6	128.9	-60.3	168.5	0	0	0	115.4
351	L	28.3	Very low	31.5	Very low	174 Å²	174	135 Å²	135	91%	0.911	74%	0.737	S	S	*	*			trans	-137.7	150.4	135.6	-110.6	175.6	0	0	0	110.2
352	S	25.6	Very low	30.9	Very low	104 Å²	104	134.5 Å²	134.5	73%	0.727	74%	0.737	S	S	*	*			trans	-106.8	179.7	173	-176.5	0	0	0	0	109
353	R	28.9	Very low	31.1	Very low	224 Å²	224	134.5 Å²	134.5	85%	0.845	74%	0.737	S	S	*	*			trans	78.1	131.8	160.6	-107.8	-171	163.9	-171.3	-5.8	119.4
354	S	27.1	Very low	31.3	Very low	75 Å²	75	136.1 Å²	136.1	52%	0.524	74%	0.743	S	S	.	*			trans	77	112.4	131.4	-65.6	0	0	0	0	121.4
355	H	28.5	Very low	31	Very low	166 Å²	166	140.8 Å²	140.8	77%	0.769	75%	0.754	S	S	*	*			trans	31.7	118.7	130.2	-30.8	-72.1	0	0	0	119
356	T	28.8	Very low	30.9	Very low	127 Å²	127	146.8 Å²	146.8	78%	0.779	77%	0.773	S	S	*	*				-175.2	140	91.9	25.3	0	0	0	0	114.1
357	I	35.1	Very low	31.1	Very low	147 Å²	147	145.2 Å²	145.2	75%	0.754	77%	0.767	S	S	*	*			trans	19.1	116.1	145	-42.4	166.4	0	0	0	118.7
358	T	31.3	Very low	30.2	Very low	134 Å²	134	140.2 Å²	140.2	82%	0.822	76%	0.755	S	S	*	*				177	147	117.1	27.3	0	0	0	0	114.1
359	A	32.8	Very low	30.5	Very low	102 Å²	102	139 Å²	139	84%	0.843	76%	0.764	S	S	*	*			trans	53.1	149.7	153.3	0	0	0	0	0	123.7
360	R	32.7	Very low	31	Very low	242 Å²	242	141.4 Å²	141.4	91%	0.913	77%	0.773	S	S	*	*			trans	-85	177.1	165.7	-71.4	-175.2	171.7	-169.3	-0.4	110.4
361	P	47.6	Very low	31.2	Very low	110 Å²	110	140 Å²	140	71%	0.714	76%	0.762	S	S	*	*			cis	-140.5	177	7.8	42.6	-24.3	0	0	0	118.7
362	S	28.8	Very low	31.4	Very low	104 Å²	104	139.5 Å²	139.5	73%	0.727	75%	0.754	S	S	*	*			trans	91.2	138.6	140.1	75.6	0	0	0	0	122.9
363	L	34	Very low	31.6	Very low	152 Å²	152	139 Å²	139	80%	0.796	75%	0.751	S	S	*	*			trans	72.5	122.5	158.1	-65.7	174.4	0	0	0	122.7
364	T	32.4	Very low	32	Very low	123 Å²	123	137.4 Å²	137.4	76%	0.755	75%	0.75	S	S	*	*			trans	75.8	154.5	150.6	58.5	0	0	0	0	122.2
365	F	28.6	Very low	32.3	Very low	187 Å²	187	138.6 Å²	138.6	82%	0.82	76%	0.758	S	S	*	*			trans	82.7	134.3	169.3	-82.4	-88.2	0	0	0	122.5
366	E	27.2	Very low	32.3	Very low	162 Å²	162	139 Å²	139	76%	0.757	76%	0.763	S	S	*	*			trans	51	136.6	151.3	-87	-176.6	-163.1	0	0	127.1
367	S	30.9	Very low	32.3	Very low	91 Å²	91	138.6 Å²	138.6	64%	0.636	77%	0.765	S	S	*	*			trans	51.7	115.2	130	-54.9	0	0	0	0	123.8
368	S	29.1	Very low	32.3	Very low	97 Å²	97	139.7 Å²	139.7	68%	0.678	77%	0.769	S	S	*	*				63.5	107.7	129.6	69	0	0	0	0	122.7
369	T	30.5	Very low	32.9	Very low	127 Å²	127	137.9 Å²	137.9	78%	0.779	76%	0.76	S	S	*	*				73.7	145.4	124	60.6	0	0	0	0	124.4
370	L	33.7	Very low	32.8	Very low	152 Å²	152	140.7 Å²	140.7	80%	0.796	76%	0.76	S	S	*	*			trans	88	94.3	147.3	-101.6	84.9	0	0	0	122.4
371	Q	32.5	Very low	32.6	Very low	141 Å²	141	133.7 Å²	133.7	66%	0.659	75%	0.748	S	S	*	*				85.4	144.7	113	-77.9	-70.1	12.5	0	0	125.1
372	H	33.5	Very low	31.7	Very low	162 Å²	162	138 Å²	138	75%	0.75	76%	0.758	S	S	*	*			trans	66.1	154.6	160.6	-51.4	-37	0	0	0	117.5
373	S	30.6	Very low	32.4	Very low	93 Å²	93	138.4 Å²	138.4	65%	0.65	76%	0.761	S	S	*	*			cis	-159.1	161.6	17.9	70	0	0	0	0	113.6
374	K	37	Very low	32.7	Very low	192 Å²	192	137.1 Å²	137.1	84%	0.835	76%	0.761	S	S	*	*			trans	44.7	151	140.1	-63.9	167.8	-171	177	0	121.8
375	S	32.2	Very low	33.4	Very low	99 Å²	99	136.8 Å²	136.8	69%	0.692	76%	0.762	S	S	*	*			cis	-179.4	146.8	-20.4	55.4	0	0	0	0	111.5
376	M	28.9	Very low	33.8	Very low	174 Å²	174	134.9 Å²	134.9	86%	0.857	77%	0.765	S	S	*	*			trans	64.7	121.5	158.9	-51.1	-153.6	76.8	0	0	121.6
377	S	29.5	Very low	34.1	Very low	120 Å²	120	131.6 Å²	131.6	84%	0.839	77%	0.765	S	S	*	*				-174.3	178.9	114.2	37.2	0	0	0	0	111.3
378	M	34.2	Very low	34.3	Very low	169 Å²	169	134 Å²	134	83%	0.833	78%	0.776	S	S	*	*			trans	-151.1	174.4	-155.6	-80.9	-78.7	-85.2	0	0	109.1
379	P	43.1	Very low	35.3	Very low	96 Å²	96	134.6 Å²	134.6	62%	0.623	78%	0.778	S	S	*	*			cis	-139.7	-160.2	-25.6	34.7	-12.5	0	0	0	113.5
380	L	31	Very low	35.3	Very low	162 Å²	162	134.5 Å²	134.5	85%	0.848	78%	0.781	S	S	*	*			trans	82	164.3	155.3	-72.2	170.9	0	0	0	119.6
381	S	28.6	Very low	35.5	Very low	95 Å²	95	133.5 Å²	133.5	66%	0.664	78%	0.784	S	S	*	*			trans	-160.3	153.5	-144.6	52.1	0	0	0	0	113.6
382	H	29.1	Very low	35.4	Very low	201 Å²	201	130 Å²	130	93%	0.931	79%	0.786	S	S	*	*			trans	-134.7	163.4	164.9	-73.7	-77.9	0	0	0	110.9
383	S	42.8	Very low	35.2	Very low	111 Å²	111	130.4 Å²	130.4	78%	0.776	79%	0.788	S	S	*	*			trans	-100.2	169.9	-159	52	0	0	0	0	115.6
384	P	40.3	Very low	35.2	Very low	125 Å²	125	131.1 Å²	131.1	81%	0.812	79%	0.788	S	S	*	*			trans	-136.7	162.6	137.9	39.1	-28.6	0	0	0	114.2
385	P	47.4	Very low	34.8	Very low	117 Å²	117	126.6 Å²	126.6	76%	0.76	78%	0.78	S	S	*	*			trans	-120.2	150.4	-178.8	39.6	-28.8	0	0	0	117.7
386	V	38.4	Very low	34.5	Very low	146 Å²	146	129.7 Å²	129.7	89%	0.885	79%	0.789	S	S	*	*			trans	85.2	140.3	141	164.8	0	0	0	0	122.9
387	A	31.8	Very low	34.5	Very low	93 Å²	93	126.9 Å²	126.9	77%	0.769	79%	0.785	S	S	*	*			trans	106.6	142.2	159.8	0	0	0	0	0	120.2
388	T	35.3	Very low	34.5	Very low	141 Å²	141	127.7 Å²	127.7	87%	0.865	79%	0.785	S	S	*	*			trans	-150.3	179.5	-170.5	37.2	0	0	0	0	109.3
389	P	50.2	Low	34.2	Very low	111 Å²	111	126.7 Å²	126.7	72%	0.721	78%	0.783	S	S	*	*			cis	-140.9	176.2	13.4	43.4	-24	0	0	0	119
390	C	30.1	Very low	33.4	Very low	124 Å²	124	127.3 Å²	127.3	84%	0.838	79%	0.79	S	S	*	*			trans	31.6	155.8	147.6	-61	0	0	0	0	123.5
391	P	39	Very low	33.2	Very low	132 Å²	132	125.1 Å²	125.1	86%	0.857	79%	0.788	S	S	*	*			cis	-140.8	-164.1	23.5	42.9	-22	0	0	0	116.9
392	G	29.3	Very low	33.7	Very low	68 Å²	68	126.7 Å²	126.7	70%	0.701	79%	0.793	S	S	*	*			trans	-142.4	158.8	172.1	0	0	0	0	0	112.6
393	H	30.6	Very low	34.1	Very low	170 Å²	170	123.3 Å²	123.3	79%	0.787	79%	0.789	S	S	*	*			cis	86.7	115.4	45	-154.2	-64.9	0	0	0	112.1
394	V	30.8	Very low	33.7	Very low	108 Å²	108	129.1 Å²	129.1	66%	0.655	79%	0.794	S	S	*	*			cis	102	122.1	27.8	-46.4	0	0	0	0	117.7
395	S	28.1	Very low	33.7	Very low	97 Å²	97	128.8 Å²	128.8	68%	0.678	79%	0.792	S	S	*	*			trans	46.6	122.7	147.2	63.5	0	0	0	0	125.8
396	N	27	Very low	32.9	Very low	164 Å²	164	128.3 Å²	128.3	88%	0.877	79%	0.791	S	S	*	*			trans	67.6	179.2	133.3	-64	19.3	0	0	0	121.4
397	C	28.6	Very low	32.7	Very low	114 Å²	114	126.9 Å²	126.9	77%	0.77	79%	0.788	S	S	*	*			trans	-143.5	169.3	-136.3	55.4	0	0	0	0	116.2
398	V	29.2	Very low	32.6	Very low	138 Å²	138	128.4 Å²	128.4	84%	0.836	79%	0.791	S	S	*	*			trans	178.2	161	138.3	146	0	0	0	0	111.7
399	D	27.7	Very low	32.5	Very low	148 Å²	148	124.7 Å²	124.7	79%	0.791	77%	0.771	S	S	*	*			trans	-56.6	158.4	-167.4	-65	-70.3	0	0	0	120.8
400	S	26.7	Very low	31.5	Very low	109 Å²	109	123.6 Å²	123.6	76%	0.762	77%	0.772	S	S	*	*				154.1	150.7	93.4	-150.8	0	0	0	0	117.1
401	S	26.7	Very low	31.7	Very low	116 Å²	116	121 Å²	121	81%	0.811	75%	0.754	S	S	*	*			trans	74.7	151	163.8	78.9	0	0	0	0	120.9
402	V	38.7	Very low	31.3	Very low	127 Å²	127	124.9 Å²	124.9	77%	0.77	76%	0.758	S	S	*	*			trans	-146.4	141	-168	172	0	0	0	0	111
403	P	36.8	Very low	31.7	Very low	131 Å²	131	127.2 Å²	127.2	85%	0.851	76%	0.764	S	S	*	*				-133.7	157.4	124.3	9	13.4	0	0	0	115.1
404	R	36	Very low	31.7	Very low	233 Å²	233	122.4 Å²	122.4	88%	0.879	76%	0.76	S	S	*	*			trans	-100.4	161.7	176.5	-101.6	-178.1	-177.6	150.3	1.9	111.6
405	P	39.1	Very low	31.8	Very low	117 Å²	117	123.1 Å²	123.1	76%	0.76	77%	0.77	S	S	*	*				-148.7	150.8	94.8	34.9	-15.9	0	0	0	118.3
406	S	29.9	Very low	32.9	Very low	107 Å²	107	124.7 Å²	124.7	75%	0.748	78%	0.778	S	S	*	*			trans	24.9	142.4	135.5	-50.7	0	0	0	0	121.9
407	S	35.6	Very low	33.3	Very low	116 Å²	116	121.9 Å²	121.9	81%	0.811	77%	0.771	S	S	*	*			cis	-162.2	-157.1	2.6	-83.9	0	0	0	0	108.7
408	C	29	Very low	33.5	Very low	126 Å²	126	124 Å²	124	85%	0.851	78%	0.775	S	S	*	*			cis	-155.6	-150.8	11.9	66.8	0	0	0	0	113.2
409	S	34.4	Very low	33.8	Very low	62 Å²	62	122 Å²	122	43%	0.434	77%	0.773	S	S	.	*			trans	-146.5	145	-162.3	-56.1	0	0	0	0	116.8	S269 S271	S269-S409 PolarHBondContact OG-OG 2.81Å; S271-S409 PolarHBondContact OG-O 2.84Å
410	A	29.2	Very low	34.1	Very low	89 Å²	89	118.2 Å²	118.2	74%	0.736	77%	0.769	S	S	*	*			trans	-140.8	170.8	169.9	0	0	0	0	0	113.1
411	S	33.9	Very low	34.2	Very low	68 Å²	68	122.5 Å²	122.5	48%	0.476	77%	0.774	S	S	.	*			trans	-164.9	169.5	-171.8	-65.1	0	0	0	0	114.4	R268	R268-S411 PolarHBondContact NE-OG 3.42Å; R268-S411 PolarHBondContact NH2-OG 3Å
412	F	30.8	Very low	34.5	Very low	214 Å²	214	124.1 Å²	124.1	94%	0.939	77%	0.772	S	S	*	*			trans	-179.6	-178.2	143.1	-96.4	-58.2	0	0	0	115
413	S	37.7	Very low	33.9	Very low	117 Å²	117	122.4 Å²	122.4	82%	0.818	77%	0.766	S	S	*	*			trans	-137.7	-175.6	-160.5	55.3	0	0	0	0	113.2
414	G	29.8	Very low	33.5	Very low	69 Å²	69	120.5 Å²	120.5	71%	0.711	76%	0.755	S	S	*	*			cis	-176.7	-160.1	10.8	0	0	0	0	0	113.2
415	S	32.5	Very low	33.1	Very low	123 Å²	123	117.6 Å²	117.6	86%	0.86	75%	0.751	S	S	*	*			trans	-140.4	164.7	-170.3	-44.6	0	0	0	0	115.4
416	P	52.3	Low	32.6	Very low	131 Å²	131	118.8 Å²	118.8	85%	0.851	75%	0.747	S	S	*	*			trans	-145.9	-169.3	140.1	37.7	-18.9	0	0	0	116.2
417	S	35.3	Very low	32.7	Very low	104 Å²	104	123.5 Å²	123.5	73%	0.727	75%	0.749	S	S	*	*			trans	-143.1	171.7	-161.7	-37.4	0	0	0	0	114.7
418	D	32.2	Very low	32.4	Very low	160 Å²	160	121.1 Å²	121.1	86%	0.856	74%	0.743	S	S	*	*			trans	-171.9	-178.1	132.7	-145.6	-7.9	0	0	0	115.6
419	A	35.7	Very low	32.5	Very low	95 Å²	95	120.9 Å²	120.9	79%	0.785	74%	0.743	S	S	*	*			trans	-101.6	-172.9	-168.3	0	0	0	0	0	116.3
420	G	34.5	Very low	32.4	Very low	69 Å²	69	123.6 Å²	123.6	71%	0.711	76%	0.762	S	S	*	*			cis	173.5	-162.3	2.1	0	0	0	0	0	114.5
421	F	29.2	Very low	33.3	Very low	198 Å²	198	125.1 Å²	125.1	87%	0.868	76%	0.764	S	S	*	*			trans	87.3	124.1	163.9	-98.6	-101.4	0	0	0	123.8
422	I	32.8	Very low	33.1	Very low	150 Å²	150	126.6 Å²	126.6	77%	0.769	78%	0.781	S	S	*	*			trans	50.6	153.7	154	60.3	167.5	0	0	0	122.6
423	S	25.7	Very low	32.9	Very low	92 Å²	92	123.6 Å²	123.6	64%	0.643	77%	0.774	S	S	*	*			cis	-168	-176.6	-18.4	53.4	0	0	0	0	110.5
424	C	28	Very low	32.8	Very low	91 Å²	91	122.6 Å²	122.6	62%	0.615	77%	0.773	S	S	*	*			trans	76.6	119.7	166	-59.3	0	0	0	0	115.6
425	E	27.6	Very low	33.1	Very low	172 Å²	172	129 Å²	129	80%	0.804	78%	0.776	S	S	*	*				83.6	143.6	73.4	-76	158	173.1	0	0	112.5
426	E	29	Very low	32.9	Very low	142 Å²	142	128.1 Å²	128.1	66%	0.664	76%	0.761	S	S	*	*			cis	-162.6	175.7	-8	-163.7	-170.7	162.8	0	0	108.3
427	Y	32.3	Very low	31.9	Very low	205 Å²	205	128.3 Å²	128.3	80%	0.804	76%	0.755	S	S	*	*			trans	66.6	151.3	175.4	-66.8	-89.2	0	0	0	117.6
428	G	28.6	Very low	31.6	Very low	66 Å²	66	133.5 Å²	133.5	68%	0.68	76%	0.758	S	S	*	*			cis	-169.5	161	-3.9	0	0	0	0	0	111.5
429	S	30.4	Very low	31.5	Very low	121 Å²	121	133.7 Å²	133.7	85%	0.846	76%	0.758	S	S	*	*			trans	-115.3	136.9	-159.5	-57.5	0	0	0	0	116.3
430	S	34.1	Very low	31.7	Very low	120 Å²	120	134 Å²	134	84%	0.839	75%	0.752	S	S	*	*			trans	64.7	177.6	153.7	-103.4	0	0	0	0	117.5
431	P	46.7	Very low	31.6	Very low	121 Å²	121	138 Å²	138	79%	0.786	76%	0.757	S	S	*	*			cis	-122.9	-164.6	-4.6	39.7	-23	0	0	0	113.7
432	A	30.4	Very low	31.5	Very low	99 Å²	99	133.2 Å²	133.2	82%	0.818	75%	0.748	S	S	*	*			trans	-85.7	159.1	174.1	0	0	0	0	0	113.5
433	D	27.1	Very low	31.4	Very low	150 Å²	150	133.4 Å²	133.4	80%	0.802	75%	0.75	S	S	*	*			trans	-92.5	140.9	175.2	175.3	24.2	0	0	0	112.3	R435	D433-R435 PolarHBondContact OD1-N 2.82Å
434	A	34.1	Very low	31.6	Very low	96 Å²	96	139.5 Å²	139.5	79%	0.793	76%	0.759	S	S	*	*			trans	-148.8	65.2	167.1	0	0	0	0	0	112.5
435	R	35.9	Very low	31.7	Very low	204 Å²	204	140.3 Å²	140.3	77%	0.77	77%	0.765	S	S	*	*			trans	76.7	132.5	159	-69.3	-63.8	-149.1	103.6	0.7	119.9	D433	D433-R435 PolarHBondContact OD1-N 2.82Å
436	D	28.2	Very low	31.7	Very low	104 Å²	104	140 Å²	140	56%	0.556	77%	0.769	S	S	*	*			trans	65.7	82.4	143	-67.6	-54.8	0	0	0	121.4
437	L	31.4	Very low	31.9	Very low	136 Å²	136	140.1 Å²	140.1	71%	0.712	78%	0.779	S	S	*	*				73.4	124.4	118	-75.7	171.5	0	0	0	123
438	R	30.1	Very low	32.7	Very low	212 Å²	212	136 Å²	136	80%	0.8	78%	0.778	S	S	*	*			trans	90.3	89.3	148.7	-64.9	166.9	-179	160.6	1.5	120.1
439	L	30.4	Very low	32.7	Very low	164 Å²	164	141.7 Å²	141.7	86%	0.859	79%	0.787	S	S	*	*				47	152.8	106.7	-67.7	176.1	0	0	0	121.1
440	P	40.3	Very low	32.6	Very low	101 Å²	101	140.1 Å²	140.1	66%	0.656	78%	0.776	S	S	*	*			cis	-139.7	171.1	-0.5	33	-10.5	0	0	0	118.5
441	L	30.4	Very low	32.5	Very low	154 Å²	154	141.4 Å²	141.4	81%	0.806	77%	0.772	S	S	*	*			trans	68.5	103.8	144	-75.5	163.4	0	0	0	123.6
442	S	29.1	Very low	31.8	Very low	98 Å²	98	145.3 Å²	145.3	69%	0.685	78%	0.777	S	S	*	*				110.2	127.7	107.5	74.9	0	0	0	0	122.9
443	L	30.2	Very low	31.9	Very low	153 Å²	153	144.6 Å²	144.6	80%	0.801	77%	0.771	S	S	*	*			trans	76	126.5	148	-99.5	72.5	0	0	0	124.2
444	R	30.3	Very low	32.2	Very low	221 Å²	221	144.4 Å²	144.4	83%	0.834	77%	0.77	S	S	*	*			trans	89.1	106.6	137.6	-90.7	-173.1	176.8	-173.8	-1.2	123.2
445	S	29.9	Very low	32.2	Very low	108 Å²	108	146.1 Å²	146.1	76%	0.755	77%	0.771	S	S	*	*				62.3	133.2	126.7	58.3	0	0	0	0	121.9
446	N	27.4	Very low	32.5	Very low	165 Å²	165	141.9 Å²	141.9	88%	0.882	77%	0.77	S	S	*	*			trans	-104.6	147.8	-179.2	-55.2	-45	0	0	0	113.8
447	T	32.6	Very low	33.5	Very low	144 Å²	144	142.7 Å²	142.7	88%	0.883	78%	0.78	S	S	*	*			trans	-143.5	159.4	146.8	24	0	0	0	0	108.8
448	P	49.2	Very low	33.5	Very low	118 Å²	118	141.7 Å²	141.7	77%	0.766	79%	0.785	S	S	*	*			trans	-109.1	150.4	-151.5	38.5	-33.5	0	0	0	116.2
449	E	27.8	Very low	33.7	Very low	187 Å²	187	142 Å²	142	87%	0.874	79%	0.786	S	S	*	*			trans	-159	133.2	156.5	-158.8	82.6	-106	0	0	113.6
450	S	28.3	Very low	33.7	Very low	87 Å²	87	140.6 Å²	140.6	61%	0.608	78%	0.78	S	S	*	*			trans	15.5	128.3	147	-146	0	0	0	0	125.1
451	L	32.5	Very low	33.4	Very low	147 Å²	147	139.7 Å²	139.7	77%	0.77	79%	0.788	S	S	*	*			trans	56.3	110.9	133.9	-69.1	176.3	0	0	0	123.1
452	K	31.2	Very low	33.5	Very low	204 Å²	204	137 Å²	137	89%	0.887	78%	0.783	S	S	*	*				168.7	166.2	108.3	-95.9	161.7	-174.7	173.4	0	114.5
453	A	34.6	Very low	33.8	Very low	83 Å²	83	140.8 Å²	140.8	69%	0.686	79%	0.789	S	S	*	*			trans	-116.5	159	163.8	0	0	0	0	0	110.4
454	D	32.2	Very low	33.9	Very low	146 Å²	146	140.7 Å²	140.7	78%	0.781	79%	0.789	S	S	*	*			trans	31.6	128.9	154.6	-59.9	-37.1	0	0	0	119.5
455	T	34.3	Very low	34	Very low	133 Å²	133	137.5 Å²	137.5	82%	0.816	79%	0.788	S	S	*	*			cis	-159.3	174.6	35.3	5.9	0	0	0	0	111.3
456	P	42.9	Very low	34.1	Very low	115 Å²	115	134.9 Å²	134.9	75%	0.747	78%	0.778	S	S	*	*			trans	-101.9	-160.2	-158.1	43.3	-39.5	0	0	0	115.2
457	P	47.5	Very low	34.3	Very low	120 Å²	120	136.4 Å²	136.4	78%	0.779	77%	0.773	S	S	*	*				-132	164.2	-80.1	41.3	-25.8	0	0	0	115.3
458	S	32.3	Very low	34.3	Very low	116 Å²	116	137.6 Å²	137.6	81%	0.811	77%	0.77	S	S	*	*			trans	-156.8	94	165	64.8	0	0	0	0	116.3
459	R	34	Very low	33.5	Very low	219 Å²	219	137.7 Å²	137.7	83%	0.826	77%	0.768	S	S	*	*				43.7	124.5	129.7	-163.8	171.3	-176.8	170.7	3.2	122.8
460	D	30.2	Very low	33.9	Very low	134 Å²	134	135.6 Å²	135.6	72%	0.717	76%	0.76	S	S	*	*			trans	50.3	135.8	149.6	-49.8	-9.2	0	0	0	122.4
461	G	34	Very low	34.3	Very low	81 Å²	81	136.1 Å²	136.1	84%	0.835	75%	0.753	S	S	*	*			trans	159.2	103.2	164.4	0	0	0	0	0	115
462	S	33.7	Very low	34.5	Very low	99 Å²	99	136.3 Å²	136.3	69%	0.692	74%	0.744	S	S	*	*			trans	-75.1	160.6	-169.3	-42.8	0	0	0	0	117.5
463	E	33.6	Very low	34.8	Very low	177 Å²	177	131.5 Å²	131.5	83%	0.827	72%	0.724	S	S	*	*			trans	63	155.9	148.9	-67.6	149.8	-120.2	0	0	120
464	L	33.9	Very low	34.9	Very low	150 Å²	150	133.4 Å²	133.4	79%	0.785	72%	0.723	S	S	*	*			cis	-166.4	152.4	-38.7	-164.4	71.7	0	0	0	107.7
465	D	31.6	Very low	35.1	Very low	155 Å²	155	134.7 Å²	134.7	83%	0.829	72%	0.724	S	S	*	*			trans	62.3	160.6	167.4	-93.3	-12.5	0	0	0	121.2
466	G	33	Very low	35	Very low	52 Å²	52	136 Å²	136	54%	0.536	73%	0.727	S	S	.	*			trans	141.3	43.6	153.8	0	0	0	0	0	124.2
467	Y	31.6	Very low	34.4	Very low	198 Å²	198	134.3 Å²	134.3	78%	0.776	73%	0.73	S	S	*	*			trans	29.1	134.9	146.2	42.8	-102	0	0	0	125.2
468	M	31.5	Very low	33.3	Very low	168 Å²	168	139.3 Å²	139.3	83%	0.828	74%	0.735	S	S	*	*			trans	71.4	151.3	152.9	-65.7	-168.3	-82.6	0	0	120.1
469	V	32.8	Very low	33.1	Very low	120 Å²	120	144.4 Å²	144.4	73%	0.727	74%	0.736	S	S	*	*			cis	93.3	137.1	11.4	104.9	0	0	0	0	115.6
470	M	36.5	Very low	32.8	Very low	143 Å²	143	143.5 Å²	143.5	70%	0.704	73%	0.733	S	S	*	*			cis	-141.8	-176.4	20.3	-47.7	-173.6	-66.7	0	0	116.6
471	E	36.8	Very low	32.5	Very low	99 Å²	99	143.3 Å²	143.3	46%	0.463	73%	0.731	S	S	.	*			trans	94.8	139.7	136.2	-96.2	-166.6	117.9	0	0	126.7	P505	E471-P505 VanDerWaalsContact O-CG 3.3Å; E471-P505 WeakPolarHBondContact O-CG 3.49Å
472	R	35.6	Very low	32.1	Very low	151 Å²	151	143.6 Å²	143.6	57%	0.57	72%	0.721	S	S	*	*			trans	52.1	150.7	150.5	-68.9	-167.5	-167.8	-125.6	8	125.3	P505	R472-P505 WeakPolarHBondContact O-CD 3.5Å; R472-P505 WeakPolarHBondContact O-CG 3.47Å
473	Q	39	Very low	31.8	Very low	102 Å²	102	146.4 Å²	146.4	48%	0.477	72%	0.723	S	S	.	*			cis	175.5	129.4	-19	170.9	175	17.5	0	0	109.7
474	N	36.1	Very low	31.6	Very low	123 Å²	123	144.9 Å²	144.9	66%	0.658	72%	0.719	S	S	*	*			trans	59.4	162.4	164.9	-66.6	-21.4	0	0	0	117.7
475	Q	35.5	Very low	31.1	Very low	173 Å²	173	143.7 Å²	143.7	81%	0.808	71%	0.714	S	S	*	*			cis	-154.7	179.1	20.7	-149.6	167.7	87.8	0	0	113.4
476	N	32.6	Very low	31.2	Very low	161 Å²	161	144.3 Å²	144.3	86%	0.861	71%	0.709	S	S	*	*			trans	-60.6	167	-175.7	-53.6	-25.5	0	0	0	117.1
477	G	30.2	Very low	30.9	Very low	79 Å²	79	147.4 Å²	147.4	81%	0.814	72%	0.717	S	S	*	*			trans	169	105.1	154.6	0	0	0	0	0	117.2
478	Y	25.3	Very low	30.8	Very low	226 Å²	226	147 Å²	147	89%	0.886	72%	0.716	S	S	*	*			trans	-92.6	159.7	178.8	-101	-90.5	0	0	0	114
479	R	28.6	Very low	31.1	Very low	223 Å²	223	148.1 Å²	148.1	84%	0.842	71%	0.711	S	S	*	*			trans	71.7	159.9	159.2	-72.9	-177.1	-176.9	-150.7	2.9	117.9
480	R	26.1	Very low	31.2	Very low	199 Å²	199	151.4 Å²	151.4	75%	0.751	72%	0.715	S	S	*	*			cis	-177.6	163.1	-28.2	-161.3	-165.7	-170.8	-159	5.5	107.7
481	L	25	Very low	31.2	Very low	130 Å²	130	155.3 Å²	155.3	68%	0.681	72%	0.722	S	S	*	*			trans	73	128.5	166.6	-70.6	166.6	0	0	0	114.3
482	S	26	Very low	31	Very low	88 Å²	88	155.3 Å²	155.3	62%	0.615	73%	0.729	S	S	*	*				72.2	143	87.1	-70.1	0	0	0	0	113.2
483	E	26.2	Very low	30.8	Very low	158 Å²	158	158.3 Å²	158.3	74%	0.738	74%	0.742	S	S	*	*			cis	-161	-177.6	10.1	-130.3	148.9	-122.9	0	0	113.6
484	L	28.9	Very low	30.4	Very low	144 Å²	144	157.7 Å²	157.7	75%	0.754	75%	0.748	S	S	*	*			trans	63.2	105.6	158.9	-98	71.5	0	0	0	121.5
485	D	25.3	Very low	30.2	Very low	125 Å²	125	159.4 Å²	159.4	67%	0.668	76%	0.757	S	S	*	*				84.4	156.8	114.1	-161.8	30.4	0	0	0	121.3
486	K	31.9	Very low	30.3	Very low	168 Å²	168	157.6 Å²	157.6	73%	0.73	76%	0.758	S	S	*	*			trans	87.3	91.6	163.8	-50.9	-170.2	-176.7	170.8	0	119.3
487	V	27.6	Very low	30.4	Very low	118 Å²	118	155.6 Å²	155.6	72%	0.715	75%	0.752	S	S	*	*				36.1	119	128.1	-162.3	0	0	0	0	117.6
488	Y	29.9	Very low	30.7	Very low	188 Å²	188	158.2 Å²	158.2	74%	0.737	75%	0.754	S	S	*	*				-168.2	175.6	111.6	-116.6	-91.2	0	0	0	114.8
489	R	36.3	Very low	30.8	Very low	193 Å²	193	159.2 Å²	159.2	73%	0.728	76%	0.756	S	S	*	*			trans	-79.3	140.2	-157	-65.3	168.8	172	144	0	116
490	K	35.9	Very low	30.8	Very low	188 Å²	188	157.4 Å²	157.4	82%	0.817	76%	0.757	S	S	*	*			trans	49.5	152.6	131.1	-65.7	-172	170.7	-176.5	0	121.5
491	R	36.6	Very low	31	Very low	226 Å²	226	156.8 Å²	156.8	85%	0.853	76%	0.763	S	S	*	*			trans	75.6	146.9	159.5	-62.8	-159.4	175.7	132.8	-6.9	115.2
492	T	32.2	Very low	31.1	Very low	98 Å²	98	161.1 Å²	161.1	60%	0.601	77%	0.77	S	S	*	*			cis	-168.5	144.7	-18.6	24.6	0	0	0	0	107.4
493	Y	31.2	Very low	31.2	Very low	215 Å²	215	166.7 Å²	166.7	84%	0.843	78%	0.778	S	S	*	*			trans	53.6	141.1	142.6	-68.9	-132.1	0	0	0	117.8
494	S	32.1	Very low	31.6	Very low	88 Å²	88	164.8 Å²	164.8	62%	0.615	78%	0.779	S	S	*	*			cis	-163.6	166.9	-3.1	-95.9	0	0	0	0	108.7
495	L	31.2	Very low	32.1	Very low	160 Å²	160	161 Å²	161	84%	0.838	76%	0.764	S	S	*	*			trans	19.2	110.8	147.8	-58.7	167.6	0	0	0	118.6
496	T	36.8	Very low	32.1	Very low	134 Å²	134	160.5 Å²	160.5	82%	0.822	76%	0.757	S	S	*	*				-178.7	144	118.3	24.4	0	0	0	0	114
497	T	36.3	Very low	32	Very low	120 Å²	120	157.8 Å²	157.8	74%	0.736	75%	0.754	S	S	*	*			trans	18.6	125	155.9	57.2	0	0	0	0	121.3
498	P	34.9	Very low	32.1	Very low	133 Å²	133	157.6 Å²	157.6	86%	0.864	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-76.9	138.1	168.9	32.3	-33.7	0	0	0	113
499	R	28	Very low	32.1	Very low	248 Å²	248	154.8 Å²	154.8	94%	0.936	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-95.3	158.6	165.7	-88.3	-174.4	167.1	-169.9	-3.3	111.4
500	Q	29.5	Very low	31.7	Very low	184 Å²	184	150.4 Å²	150.4	86%	0.86	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-93.1	144.4	174	-63.4	-174.4	0.8	0	0	113.1
501	Q	28.7	Very low	31.4	Very low	187 Å²	187	146.9 Å²	146.9	87%	0.874	77%	0.77	S	S	*	*			trans	-167.5	123	136.8	-102	165.4	-63.3	0	0	106.5
502	R	28.2	Very low	31.2	Very low	221 Å²	221	143.5 Å²	143.5	83%	0.834	77%	0.768	S	S	*	*				77.6	85.9	55	-161.7	176.6	-166.6	160.3	2	110.9
503	R	26.7	Very low	31.1	Very low	204 Å²	204	145.6 Å²	145.6	77%	0.77	78%	0.776	S	S	*	*				88.2	138	95.6	-150.6	-167.4	-155.9	-177.4	11.5	112.2
504	P	34.8	Very low	31	Very low	118 Å²	118	143.8 Å²	143.8	77%	0.766	78%	0.775	S	S	*	*				-137.3	-162.4	107.8	46.6	-34.3	0	0	0	110.8
505	P	39.8	Very low	31.1	Very low	66 Å²	66	149.5 Å²	149.5	43%	0.429	79%	0.785	S	S	.	*				-136.7	-146.5	-106.7	42.6	-19.3	0	0	0	114.9	E471 R472	E471-P505 VanDerWaalsContact O-CG 3.3Å; E471-P505 WeakPolarHBondContact O-CG 3.49Å; R472-P505 WeakPolarHBondContact O-CD 3.5Å; R472-P505 WeakPolarHBondContact O-CG 3.47Å
506	Q	26.6	Very low	31.4	Very low	114 Å²	114	147.3 Å²	147.3	53%	0.533	78%	0.778	S	S	.	*			trans	-79.1	159.1	-163.2	-55.7	164.8	-92.1	0	0	115.2
507	V	28.2	Very low	31.4	Very low	111 Å²	111	149.1 Å²	149.1	67%	0.673	78%	0.782	S	S	*	*				-150.7	149.3	116.3	-99.6	0	0	0	0	109.9
508	S	29.5	Very low	31.2	Very low	114 Å²	114	151.1 Å²	151.1	80%	0.797	79%	0.785	S	S	*	*			trans	-121.3	135.5	173.1	-58	0	0	0	0	110.2
509	S	29.9	Very low	31.2	Very low	129 Å²	129	156 Å²	156	90%	0.902	79%	0.786	S	S	*	*			trans	-152.6	155.1	161.5	51.9	0	0	0	0	108.8
510	A	28.1	Very low	31.3	Very low	101 Å²	101	149 Å²	149	84%	0.835	78%	0.781	S	S	*	*			trans	-122.4	144.1	-159.3	0	0	0	0	0	115
511	S	31	Very low	31.3	Very low	114 Å²	114	146.6 Å²	146.6	80%	0.797	78%	0.779	S	S	*	*			trans	177.9	129.4	163.1	21.5	0	0	0	0	105.8
512	L	32.1	Very low	31.1	Very low	154 Å²	154	147.9 Å²	147.9	81%	0.806	78%	0.778	S	S	*	*			cis	63.1	110.4	24.5	-147.1	73.7	0	0	0	111.2
513	D	29.8	Very low	31.1	Very low	142 Å²	142	143.5 Å²	143.5	76%	0.759	78%	0.775	S	S	*	*			cis	-154.1	-160.6	14.2	-142	-34.3	0	0	0	112.7
514	E	29.2	Very low	31	Very low	177 Å²	177	139.9 Å²	139.9	83%	0.827	78%	0.781	S	S	*	*			trans	98.1	73.9	153.9	-158.6	160	-131.4	0	0	120
515	Y	32.9	Very low	30.7	Very low	209 Å²	209	137.5 Å²	137.5	82%	0.82	78%	0.779	S	S	*	*				28.1	143.8	111.6	-130.3	-120.4	0	0	0	123
516	T	38.3	Very low	30.1	Very low	114 Å²	114	139.9 Å²	139.9	70%	0.699	80%	0.797	S	S	*	*			trans	85.8	131.2	153.3	-14.8	0	0	0	0	120.8
517	L	37	Very low	30.2	Very low	171 Å²	171	145.4 Å²	145.4	90%	0.895	81%	0.813	S	S	*	*			trans	-102.3	133.2	155.5	-83.2	170.5	0	0	0	110.7
518	M	32.1	Very low	30.2	Very low	163 Å²	163	144.8 Å²	144.8	80%	0.803	81%	0.813	S	S	*	*			trans	-46.7	149.9	-176.7	-62.5	159.7	48.5	0	0	116.7
519	R	34.9	Very low	30.1	Very low	235 Å²	235	144 Å²	144	89%	0.887	81%	0.808	S	S	*	*				-176.3	113.2	97.5	-98.7	-176.9	179.7	-166.2	0.4	115.3
520	A	29.5	Very low	30.1	Very low	102 Å²	102	145.6 Å²	145.6	84%	0.843	81%	0.805	S	S	*	*			trans	-147.7	152.1	138	0	0	0	0	0	107.2
521	T	29.8	Very low	30	Very low	132 Å²	132	151.3 Å²	151.3	81%	0.81	81%	0.805	S	S	*	*			trans	-97.1	159.3	-168.2	43.5	0	0	0	0	114.5
522	Y	25.5	Very low	29.6	Very low	215 Å²	215	149.9 Å²	149.9	84%	0.843	79%	0.794	S	S	*	*			trans	-13.2	140.2	155.4	-62.7	-97.7	0	0	0	115.6
523	T	27.3	Very low	29.3	Very low	129 Å²	129	150 Å²	150	79%	0.791	79%	0.791	S	S	*	*			cis	-145.4	149.7	45.7	48.1	0	0	0	0	116.3
524	S	25.1	Very low	29.2	Very low	127 Å²	127	149.6 Å²	149.6	89%	0.888	79%	0.793	S	S	*	*			trans	40.1	128.9	145.1	-151.4	0	0	0	0	121.3
525	G	27.9	Very low	29.2	Very low	69 Å²	69	146.3 Å²	146.3	71%	0.711	80%	0.796	S	S	*	*			trans	-162	-40.9	176.8	0	0	0	0	0	118.7
526	S	27.9	Very low	29.2	Very low	116 Å²	116	141.5 Å²	141.5	81%	0.811	79%	0.793	S	S	*	*			trans	67.6	133.9	168.2	-138.6	0	0	0	0	120.4
527	R	28.8	Very low	29.1	Very low	229 Å²	229	141.8 Å²	141.8	86%	0.864	80%	0.797	S	S	*	*			trans	79.3	105.3	157.4	-53.8	-178.5	77	164.6	2.1	121.8
528	S	27.6	Very low	28.5	Very low	99 Å²	99	141.8 Å²	141.8	69%	0.692	79%	0.79	S	S	*	*				91.8	96.3	113.6	-169	0	0	0	0	122.6
529	S	28.5	Very low	28.4	Very low	97 Å²	97	137.8 Å²	137.8	68%	0.678	79%	0.791	S	S	*	*				76.8	116.6	118.4	-46.4	0	0	0	0	123.1
530	L	29.5	Very low	27.9	Very low	162 Å²	162	132.5 Å²	132.5	85%	0.848	79%	0.79	S	S	*	*				67.4	109.3	126.3	-73.2	167.9	0	0	0	122.1
531	R	24.6	Very low	27.7	Very low	221 Å²	221	130.7 Å²	130.7	83%	0.834	78%	0.781	S	S	*	*				116.1	121.9	106.1	-170.1	172.5	-169.3	-173.4	5.9	119.7
532	C	24.4	Very low	27.7	Very low	84 Å²	84	131.5 Å²	131.5	57%	0.568	78%	0.78	S	S	*	*			trans	76.6	129.1	150.6	-76.2	0	0	0	0	123
533	H	25.3	Very low	27.9	Very low	158 Å²	158	128.1 Å²	128.1	73%	0.731	77%	0.772	S	S	*	*			trans	49.8	110.4	137.1	-55.1	-55	0	0	0	122.7
534	T	28	Very low	28.1	Very low	132 Å²	132	126.9 Å²	126.9	81%	0.81	76%	0.76	S	S	*	*				56.5	138.5	129.4	59.7	0	0	0	0	121.8
535	A	28.1	Very low	28.4	Very low	108 Å²	108	128.8 Å²	128.8	89%	0.893	75%	0.749	S	S	*	*			trans	80.8	150.3	175	0	0	0	0	0	116
536	S	34.1	Very low	28.4	Very low	109 Å²	109	132.4 Å²	132.4	76%	0.762	75%	0.745	S	S	*	*			trans	-98	156.4	-171.4	-178.6	0	0	0	0	111.4
537	P	35.2	Very low	28.6	Very low	120 Å²	120	132.8 Å²	132.8	78%	0.779	74%	0.738	S	S	*	*				-139.3	-177.5	111.3	39.5	-28.9	0	0	0	114.5
538	K	24.9	Very low	29	Very low	170 Å²	170	127.4 Å²	127.4	74%	0.739	73%	0.73	S	S	*	*			trans	-68	158.8	168.7	-61.6	175.1	179.6	178.3	0	110.8	M565	K538-M565 PolarHBondContact NZ-SD 3.02Å
539	G	30.6	Very low	29	Very low	80 Å²	80	129.7 Å²	129.7	83%	0.825	73%	0.73	S	S	*	*			trans	-96.6	169.6	-176.7	0	0	0	0	0	116.4
540	S	24.2	Very low	29.2	Very low	124 Å²	124	131.4 Å²	131.4	87%	0.867	73%	0.73	S	S	*	*			trans	-138	149.8	157	51.8	0	0	0	0	105.8
541	G	25.1	Very low	29.1	Very low	64 Å²	64	128.9 Å²	128.9	66%	0.66	73%	0.726	S	S	*	*			cis	115.5	128.3	13.1	0	0	0	0	0	109.6
542	L	28.4	Very low	29.4	Very low	149 Å²	149	123 Å²	123	78%	0.78	72%	0.719	S	S	*	*			trans	67.5	161.4	170.3	-94.7	33.8	0	0	0	116.3
543	E	30.8	Very low	29.8	Very low	144 Å²	144	126 Å²	126	67%	0.673	73%	0.729	S	S	*	*			cis	-147.8	149.4	16.2	-145.1	113.3	-154.2	0	0	112.4
544	D	32	Very low	30.3	Very low	103 Å²	103	122.5 Å²	122.5	55%	0.551	72%	0.722	S	S	*	*			trans	59.4	154.8	137.9	-77	2.6	0	0	0	123.8
545	Y	31.1	Very low	30.8	Very low	166 Å²	166	123.2 Å²	123.2	65%	0.651	72%	0.72	S	S	*	*			cis	-158.1	156.5	-0.2	-126.6	165.6	0	0	0	113.9
546	K	28	Very low	31.2	Very low	145 Å²	145	126.4 Å²	126.4	63%	0.63	72%	0.717	S	S	*	*			trans	60.7	147.6	142.7	-74.5	169.8	-179.9	160.3	0	121
547	D	30.5	Very low	31.2	Very low	124 Å²	124	124.7 Å²	124.7	66%	0.663	72%	0.716	S	S	*	*			cis	-140.9	-141.7	1.7	-134.6	-58.5	0	0	0	109.4
548	V	37.4	Very low	31	Very low	116 Å²	116	126.2 Å²	126.2	70%	0.703	72%	0.718	S	S	*	*			cis	-151.5	134	8.7	82.4	0	0	0	0	113.6
549	H	29.3	Very low	31.6	Very low	148 Å²	148	123.7 Å²	123.7	69%	0.685	72%	0.722	S	S	*	*			trans	54.6	127.2	145.6	-78.9	-149.5	0	0	0	125.2
550	I	31.5	Very low	31.8	Very low	133 Å²	133	123.1 Å²	123.1	68%	0.682	72%	0.716	S	S	*	*			trans	81.4	98.5	130.9	-63.1	173.2	0	0	0	119.8
551	S	27.2	Very low	32.3	Very low	109 Å²	109	128.1 Å²	128.1	76%	0.762	72%	0.718	S	S	*	*				54.3	126.6	125.3	-52.2	0	0	0	0	120.7
552	S	31.7	Very low	32.8	Very low	98 Å²	98	132.8 Å²	132.8	69%	0.685	72%	0.724	S	S	*	*			cis	-166.8	-166.1	2.9	59.4	0	0	0	0	108.6
553	N	33	Very low	34.1	Very low	145 Å²	145	130.6 Å²	130.6	78%	0.775	72%	0.719	S	S	*	*			cis	-166.6	177.7	8.4	-124.2	-3.5	0	0	0	105
554	S	35.5	Very low	34.3	Very low	85 Å²	85	132.7 Å²	132.7	59%	0.594	73%	0.731	S	S	*	*			cis	-177.6	164.8	-25.1	50.2	0	0	0	0	105.9
555	L	37.8	Very low	34.7	Very low	147 Å²	147	134.6 Å²	134.6	77%	0.77	74%	0.738	S	S	*	*			cis	-134.3	170.8	-1.2	-78.5	92.4	0	0	0	107.7
556	Q	36.1	Very low	35.5	Very low	175 Å²	175	132.4 Å²	132.4	82%	0.818	75%	0.745	S	S	*	*			cis	-176.9	130.7	-32.4	175.5	174.8	-20.2	0	0	107.8
557	G	35.6	Very low	35.6	Very low	73 Å²	73	129 Å²	129	75%	0.753	75%	0.751	S	S	*	*			trans	88.1	159.2	165.7	0	0	0	0	0	117.1
558	D	31.1	Very low	35.8	Very low	153 Å²	153	129.9 Å²	129.9	82%	0.818	76%	0.76	S	S	*	*			cis	-161.1	151.2	-13.8	-164.4	10.8	0	0	0	111.7
559	S	35.9	Very low	35.4	Very low	116 Å²	116	129.1 Å²	129.1	81%	0.811	77%	0.766	S	S	*	*			trans	59.6	162	171.8	77	0	0	0	0	117.8
560	G	35.3	Very low	35.6	Very low	69 Å²	69	127.2 Å²	127.2	71%	0.711	77%	0.767	S	S	*	*			cis	164.8	137.3	-12	0	0	0	0	0	114.1
561	Y	34.8	Very low	35.4	Very low	228 Å²	228	129.8 Å²	129.8	89%	0.894	77%	0.773	S	S	*	*			trans	60.1	108.4	155.8	-108.3	-105.7	0	0	0	122.7
562	M	36.7	Very low	36	Very low	163 Å²	163	131 Å²	131	80%	0.803	78%	0.776	S	S	*	*				41.9	153.1	126.1	-73.5	-72.3	103.7	0	0	124.2
563	P	54.4	Low	36.5	Very low	103 Å²	103	132.3 Å²	132.3	67%	0.669	78%	0.782	S	S	*	*			trans	-102.2	171.9	-166.3	41.6	-37.6	0	0	0	115.5
564	M	36.3	Very low	36.4	Very low	188 Å²	188	129 Å²	129	93%	0.926	78%	0.783	S	S	*	*			trans	-127	147.6	165	-76.9	-65.9	-74.3	0	0	112.2
565	M	39.9	Very low	36.1	Very low	142 Å²	142	130.7 Å²	130.7	70%	0.7	79%	0.794	S	S	*	*			trans	-97.3	171.3	177.9	-109.6	-173.7	79.4	0	0	111.4	K538	K538-M565 PolarHBondContact NZ-SD 3.02Å
566	P	46.8	Very low	35.9	Very low	121 Å²	121	131.5 Å²	131.5	79%	0.786	79%	0.791	S	S	*	*			trans	-74.8	143.1	-150.9	29.5	-37	0	0	0	115
567	G	31.2	Very low	35.7	Very low	73 Å²	73	129.1 Å²	129.1	75%	0.753	78%	0.784	S	S	*	*			trans	-121.1	136	171.2	0	0	0	0	0	112
568	V	33.6	Very low	35.7	Very low	143 Å²	143	133.1 Å²	133.1	87%	0.867	79%	0.789	S	S	*	*			trans	-70.9	140.9	170	178.4	0	0	0	0	109.2	P570	V568-P570 WeakPolarHBondContact O-CD 3.2Å
569	A	29.4	Very low	36.3	Very low	100 Å²	100	131.1 Å²	131.1	83%	0.826	78%	0.784	S	S	*	*			trans	-111.9	89.5	-177.2	0	0	0	0	0	113.6
570	P	33.9	Very low	36.1	Very low	107 Å²	107	135.5 Å²	135.5	70%	0.695	78%	0.784	S	S	*	*			trans	-91.2	108.6	166.1	33.6	-29	0	0	0	111.9	V568	V568-P570 WeakPolarHBondContact O-CD 3.2Å
571	K	27.4	Very low	36.6	Very low	188 Å²	188	139.9 Å²	139.9	82%	0.817	79%	0.788	S	S	*	*			trans	46.2	106.6	144.8	-60.5	-176.4	176.7	-177.5	0	120.8
572	T	40.3	Very low	36.9	Very low	134 Å²	134	134.1 Å²	134.1	82%	0.822	78%	0.779	S	S	*	*			trans	65.3	178.8	130.8	63	0	0	0	0	117.7
573	P	41.9	Very low	36.8	Very low	126 Å²	126	134.4 Å²	134.4	82%	0.818	78%	0.78	S	S	*	*			cis	-132.6	-172.8	-2.6	43.8	-27.7	0	0	0	115.5
574	G	30.5	Very low	36	Very low	76 Å²	76	134 Å²	134	78%	0.784	78%	0.78	S	S	*	*			trans	134.7	85.7	139.8	0	0	0	0	0	119
575	S	28.2	Very low	36.3	Very low	120 Å²	120	131.2 Å²	131.2	84%	0.839	78%	0.775	S	S	*	*			trans	159.7	128.3	147.7	179.7	0	0	0	0	110.8
576	K	33.7	Very low	35.8	Very low	163 Å²	163	132.5 Å²	132.5	71%	0.709	78%	0.782	S	S	*	*			cis	-163.5	158.1	-23.3	-138	177.9	155.8	-92	0	110
577	D	33.5	Very low	35.1	Very low	126 Å²	126	131.9 Å²	131.9	67%	0.674	78%	0.779	S	S	*	*			trans	66.8	102.9	158.1	-53.1	-33.6	0	0	0	119.8
578	D	34.2	Very low	35.1	Very low	157 Å²	157	135 Å²	135	84%	0.84	78%	0.784	S	S	*	*			trans	-49.9	175.9	158.5	-101.1	-60.9	0	0	0	115.1
579	P	43.4	Very low	34.9	Very low	111 Å²	111	132.9 Å²	132.9	72%	0.721	78%	0.775	S	S	*	*			cis	-144.7	178.4	28.2	42	-21.5	0	0	0	120.1
580	Y	31.9	Very low	35.6	Very low	207 Å²	207	132.4 Å²	132.4	81%	0.812	77%	0.771	S	S	*	*			trans	97.5	119.8	143.6	-133.6	-98.2	0	0	0	119.2
581	M	45.8	Very low	35.6	Very low	161 Å²	161	133.6 Å²	133.6	79%	0.793	78%	0.779	S	S	*	*			trans	-85.5	146.5	166.2	-68.1	-94	90	0	0	109.7
582	P	42.1	Very low	36	Very low	108 Å²	108	134.1 Å²	134.1	70%	0.701	78%	0.781	S	S	*	*				-156.5	155	89.1	39	-19.3	0	0	0	118.7
583	M	33.8	Very low	35.7	Very low	168 Å²	168	136 Å²	136	83%	0.828	78%	0.78	S	S	*	*			trans	50.1	135.1	135.2	-55.8	-61.4	-77.3	0	0	124.1
584	S	39.3	Very low	35.3	Very low	95 Å²	95	137 Å²	137	66%	0.664	78%	0.777	S	S	*	*			trans	-47	161.3	157.2	58.6	0	0	0	0	116.4
585	P	42.1	Very low	35.4	Very low	129 Å²	129	141.4 Å²	141.4	84%	0.838	78%	0.781	S	S	*	*				-149.6	-162.5	91.5	41.7	-23.7	0	0	0	116.3
586	M	29.7	Very low	35.6	Very low	169 Å²	169	142 Å²	142	83%	0.833	78%	0.775	S	S	*	*			trans	-101.3	179.9	-167.3	-55.1	160.5	58.9	0	0	114.9
587	C	31	Very low	36.1	Very low	108 Å²	108	139.9 Å²	139.9	73%	0.73	78%	0.778	S	S	*	*			trans	75.1	167.4	160	-57.5	0	0	0	0	116
588	V	31.2	Very low	36.1	Very low	140 Å²	140	144.4 Å²	144.4	85%	0.848	79%	0.785	S	S	*	*			cis	-142.1	178.1	9.8	-139.7	0	0	0	0	112.3
589	S	30.1	Very low	35.9	Very low	98 Å²	98	140.6 Å²	140.6	69%	0.685	77%	0.771	S	S	*	*			trans	-69.8	150.9	-177.3	55.4	0	0	0	0	118.8
590	A	42.7	Very low	35.2	Very low	90 Å²	90	144 Å²	144	74%	0.744	78%	0.777	S	S	*	*			trans	57.3	148.7	137	0	0	0	0	0	121.7
591	P	34.5	Very low	35	Very low	132 Å²	132	139.9 Å²	139.9	86%	0.857	78%	0.779	S	S	*	*				-138.2	168.8	111	38.9	-29.2	0	0	0	115.4
592	K	35.7	Very low	34.1	Very low	199 Å²	199	138.2 Å²	138.2	87%	0.865	78%	0.781	S	S	*	*			trans	-93.7	155.8	169.8	-59.8	170.9	178.1	173.5	0	110.2
593	Q	35.2	Very low	33.2	Very low	173 Å²	173	139.3 Å²	139.3	81%	0.808	79%	0.787	S	S	*	*				178.8	122.8	109.7	-95.9	178.6	5.5	0	0	115.1
594	I	33.7	Very low	33	Very low	147 Å²	147	136.4 Å²	136.4	75%	0.754	79%	0.789	S	S	*	*				34.8	118.7	129.7	-45	168.5	0	0	0	119.3
595	I	31.9	Very low	32.4	Very low	168 Å²	168	135.1 Å²	135.1	86%	0.862	79%	0.791	S	S	*	*				-167.7	154.7	120.7	-99.2	160.5	0	0	0	110.1
596	N	32.3	Very low	31.9	Very low	134 Å²	134	137.3 Å²	137.3	72%	0.717	80%	0.795	S	S	*	*			trans	-122.1	146.5	-174.2	-169.3	4.6	0	0	0	108.4	R598	N596-R598 PolarHBondContact OD1-N 3.03Å
597	P	43.2	Very low	31.9	Very low	117 Å²	117	133.8 Å²	133.8	76%	0.76	79%	0.793	S	S	*	*				-148.3	147.3	99.7	36.4	-19.1	0	0	0	117.1
598	R	34.5	Very low	32.6	Very low	221 Å²	221	134.4 Å²	134.4	83%	0.834	80%	0.795	S	S	*	*			trans	10.5	144.8	135.3	-74.1	-177.3	175.2	156	-1.9	119.6	N596	N596-R598 PolarHBondContact OD1-N 3.03Å
599	S	30.5	Very low	32.5	Very low	78 Å²	78	138.6 Å²	138.6	55%	0.545	80%	0.796	S	S	.	*			cis	177.4	158.9	-0.3	47.6	0	0	0	0	114.1
600	H	28.6	Very low	32.4	Very low	181 Å²	181	139.4 Å²	139.4	84%	0.838	80%	0.797	S	S	*	*			trans	69.1	146.1	161.1	-49.8	-56.3	0	0	0	117.4
601	S	26.6	Very low	31.8	Very low	122 Å²	122	142 Å²	142	85%	0.853	80%	0.798	S	S	*	*			cis	-152.3	171.4	-18.9	61.6	0	0	0	0	109.1
602	C	26.9	Very low	31.6	Very low	125 Å²	125	141.2 Å²	141.2	85%	0.845	80%	0.795	S	S	*	*			trans	-131.6	145.6	-163.5	-173.7	0	0	0	0	114.7
603	T	24	Very low	31.9	Very low	132 Å²	132	138.1 Å²	138.1	81%	0.81	80%	0.796	S	S	*	*			trans	-162.9	130.1	171.2	-66.9	0	0	0	0	112
604	A	29.5	Very low	31.5	Very low	106 Å²	106	133.6 Å²	133.6	88%	0.876	80%	0.795	S	S	*	*			trans	56.7	165.4	163.6	0	0	0	0	0	119
605	G	26.2	Very low	31.2	Very low	69 Å²	69	132.1 Å²	132.1	71%	0.711	80%	0.798	S	S	*	*			cis	165.2	147.3	-15.1	0	0	0	0	0	114.7
606	L	31.5	Very low	31	Very low	174 Å²	174	132.1 Å²	132.1	91%	0.911	80%	0.798	S	S	*	*			trans	66.8	114.4	159.5	-62.1	170.6	0	0	0	122.9
607	A	31.2	Very low	30.9	Very low	96 Å²	96	130.7 Å²	130.7	79%	0.793	80%	0.799	S	S	*	*			trans	67.8	167.8	139.6	0	0	0	0	0	119.3
608	P	44.1	Very low	30.3	Very low	121 Å²	121	133.1 Å²	133.1	79%	0.786	81%	0.805	S	S	*	*			cis	-132.4	-151.1	6.8	44.9	-26	0	0	0	116
609	R	29.4	Very low	30	Very low	228 Å²	228	131.3 Å²	131.3	86%	0.86	81%	0.806	S	S	*	*			trans	-38.7	159.6	-178.8	-43.3	-65.3	-179.4	160.6	-1.2	115.9
610	T	28.6	Very low	29.9	Very low	114 Å²	114	134.3 Å²	134.3	70%	0.699	82%	0.815	S	S	*	*			cis	-155.9	-176.5	43.2	46.2	0	0	0	0	114.8
611	D	29.9	Very low	29.9	Very low	146 Å²	146	132.6 Å²	132.6	78%	0.781	81%	0.812	S	S	*	*			trans	81.3	152.3	149.9	-55.9	-42.6	0	0	0	123.6
612	S	30.5	Very low	30.1	Very low	114 Å²	114	130 Å²	130	80%	0.797	81%	0.805	S	S	*	*			trans	-123.8	168.3	170.2	-61.1	0	0	0	0	106.8
613	P	42.5	Very low	30.5	Very low	135 Å²	135	135.1 Å²	135.1	88%	0.877	81%	0.808	S	S	*	*			cis	-141	-159.9	21.8	43.8	-24	0	0	0	113.8
614	G	26.1	Very low	31.4	Very low	77 Å²	77	136.2 Å²	136.2	79%	0.794	81%	0.806	S	S	*	*			trans	131.6	133.3	158.5	0	0	0	0	0	114.6
615	S	27.3	Very low	32.3	Very low	116 Å²	116	136.3 Å²	136.3	81%	0.811	80%	0.798	S	S	*	*			trans	-106.8	118.4	-175.5	54.6	0	0	0	0	113.4
616	I	28.8	Very low	32.9	Very low	168 Å²	168	139.7 Å²	139.7	86%	0.862	80%	0.797	S	S	*	*			trans	-161.6	143.6	146.2	40.4	172.8	0	0	0	106.3
617	S	29.8	Very low	33	Very low	104 Å²	104	141.7 Å²	141.7	73%	0.727	79%	0.793	S	S	*	*			cis	100.3	111.3	23.1	-171	0	0	0	0	114.1
618	L	29.2	Very low	32.9	Very low	169 Å²	169	141.5 Å²	141.5	89%	0.885	79%	0.785	S	S	*	*			trans	80	157.7	166	-138.9	124.4	0	0	0	118.5
619	E	29.4	Very low	32.2	Very low	183 Å²	183	138.8 Å²	138.8	86%	0.855	78%	0.779	S	S	*	*			trans	-91.9	157.2	-164	-49.8	179	139.7	0	0	113.5
620	D	27.3	Very low	32.2	Very low	140 Å²	140	136.3 Å²	136.3	75%	0.749	78%	0.776	S	S	*	*				-177.2	168	118.4	-169.5	21.9	0	0	0	110.6
621	N	28.7	Very low	32.3	Very low	145 Å²	145	140 Å²	140	78%	0.775	78%	0.783	S	S	*	*			trans	89.8	126.1	170	-59.6	-90.7	0	0	0	118.2
622	G	31.3	Very low	32.4	Very low	69 Å²	69	141.4 Å²	141.4	71%	0.711	79%	0.787	S	S	*	*				130.7	59.7	117	0	0	0	0	0	119.7
623	Y	36.5	Very low	32.2	Very low	231 Å²	231	141.2 Å²	141.2	91%	0.906	79%	0.786	S	S	*	*			trans	59.4	119.4	149.8	-104.9	-102.2	0	0	0	120.5
624	M	41.8	Very low	31.5	Very low	155 Å²	155	141.5 Å²	141.5	76%	0.764	79%	0.785	S	S	*	*			trans	-61.3	153.4	157.1	-61.6	-85.3	92.4	0	0	111.2
625	P	47.9	Very low	31.5	Very low	109 Å²	109	145.8 Å²	145.8	71%	0.708	78%	0.784	S	S	*	*				-134.2	126.7	97.1	23.7	-5.5	0	0	0	112.6
626	M	39.6	Very low	31.6	Very low	140 Å²	140	144.8 Å²	144.8	69%	0.69	78%	0.777	S	S	*	*				78.8	145.7	90.1	-72.4	171	-179	0	0	114.7
627	W	33	Very low	31.6	Very low	215 Å²	215	142.6 Å²	142.6	81%	0.814	78%	0.776	S	S	*	*			cis	-138.3	170.2	-3.6	-104.3	112.1	0	0	0	110.4
628	C	30.3	Very low	31.5	Very low	93 Å²	93	145.6 Å²	145.6	63%	0.628	78%	0.784	S	S	*	*			trans	-49.1	164.7	177.1	-59.8	0	0	0	0	116.4
629	G	27.7	Very low	31.6	Very low	64 Å²	64	141 Å²	141	66%	0.66	78%	0.778	S	S	*	*			cis	144.2	-141	1.7	0	0	0	0	0	112.1
630	H	29.5	Very low	31.8	Very low	175 Å²	175	141.7 Å²	141.7	81%	0.81	78%	0.778	S	S	*	*			trans	73.8	101.5	173.9	-48.4	101.6	0	0	0	118.1
631	K	30.7	Very low	32.8	Very low	192 Å²	192	140.3 Å²	140.3	84%	0.835	78%	0.777	S	S	*	*				-110.3	136.6	122.6	-54.9	-170.9	-178.3	-170.7	0	104
632	M	31.9	Very low	32.9	Very low	175 Å²	175	138.1 Å²	138.1	86%	0.862	77%	0.773	S	S	*	*				-142.4	-177	53.6	-38.7	-63.1	-171.6	0	0	112.3
633	S	26.2	Very low	32.9	Very low	111 Å²	111	141.4 Å²	141.4	78%	0.776	77%	0.774	S	S	*	*				124.6	146.5	126.2	-147.4	0	0	0	0	117.8
634	V	28.2	Very low	33.1	Very low	141 Å²	141	133.2 Å²	133.2	86%	0.855	76%	0.761	S	S	*	*			trans	74.8	148.6	159.4	165.3	0	0	0	0	119.5
635	E	26.6	Very low	32.8	Very low	166 Å²	166	132 Å²	132	78%	0.776	75%	0.753	S	S	*	*			trans	-114.1	153.4	-173.4	167.4	63.4	-92.5	0	0	109.4
636	S	28.9	Very low	32	Very low	95 Å²	95	135.5 Å²	135.5	66%	0.664	75%	0.754	S	S	*	*			trans	54.3	114.7	166.2	-171.4	0	0	0	0	119.7
637	S	30.1	Very low	32.2	Very low	122 Å²	122	135.7 Å²	135.7	85%	0.853	76%	0.757	S	S	*	*				-158.8	152.8	111.8	0.8	0	0	0	0	113.4
638	D	27.4	Very low	32.1	Very low	167 Å²	167	133.2 Å²	133.2	89%	0.893	75%	0.748	S	S	*	*			trans	-43.6	154.8	177.8	-160.8	0.1	0	0	0	117.3
639	G	30.8	Very low	33	Very low	74 Å²	74	137.2 Å²	137.2	76%	0.763	76%	0.76	S	S	*	*			trans	156.5	68.2	176.4	0	0	0	0	0	118.7
640	K	33.6	Very low	33.2	Very low	196 Å²	196	137.1 Å²	137.1	85%	0.852	75%	0.749	S	S	*	*			trans	-90.7	156.2	160.9	-175.5	176.7	179.1	179.8	0	108.6
641	P	47.8	Very low	33.8	Very low	111 Å²	111	134.7 Å²	134.7	72%	0.721	75%	0.749	S	S	*	*			cis	-113.7	-161.2	10.8	39.9	-21.2	0	0	0	112
642	S	31.7	Very low	33.8	Very low	100 Å²	100	130.2 Å²	130.2	70%	0.699	74%	0.737	S	S	*	*			cis	-163	152.9	22.4	52.8	0	0	0	0	115.3
643	N	30.7	Very low	33.6	Very low	137 Å²	137	129.2 Å²	129.2	73%	0.733	74%	0.735	S	S	*	*			trans	19.8	150.5	138	-53.3	16.6	0	0	0	121.1
644	G	40.4	Very low	33.7	Very low	60 Å²	60	127.3 Å²	127.3	62%	0.619	73%	0.727	S	S	*	*			cis	-153.4	163.1	12.5	0	0	0	0	0	114
645	E	35.3	Very low	33.8	Very low	130 Å²	130	128.7 Å²	128.7	61%	0.607	73%	0.728	S	S	*	*				94.2	145.2	77.7	-75.1	177.4	165	0	0	111
646	Y	32.6	Very low	34	Very low	182 Å²	182	126.8 Å²	126.8	71%	0.714	73%	0.728	S	S	*	*			cis	-161.8	153.6	-4.3	-100.8	-41.7	0	0	0	106.3
647	L	43.1	Very low	33.9	Very low	144 Å²	144	126.9 Å²	126.9	75%	0.754	73%	0.729	S	S	*	*			cis	-134.9	163.4	-7.6	-82.5	163.6	0	0	0	105.6
648	Y	30.1	Very low	33.9	Very low	163 Å²	163	128.1 Å²	128.1	64%	0.639	73%	0.725	S	S	*	*			cis	80.6	107.5	36.4	-154.6	-80.8	0	0	0	117
649	M	50.4	Low	34	Very low	176 Å²	176	125.5 Å²	125.5	87%	0.867	72%	0.715	S	S	*	*			trans	-146.8	137	148.4	-92.1	-65.6	102.4	0	0	108.9
650	S	31.6	Very low	34.5	Very low	62 Å²	62	128.1 Å²	128.1	43%	0.434	72%	0.719	S	S	.	*			trans	-150.8	149.3	178.7	-169.7	0	0	0	0	108.8	V652	S650-V652 PolarHBondContact OG-N 3.13Å
651	P	42.4	Very low	34.5	Very low	124 Å²	124	123.9 Å²	123.9	81%	0.805	71%	0.711	S	S	*	*				-122.6	150.7	102.6	34.8	-31.3	0	0	0	111.2
652	V	29.1	Very low	33.7	Very low	99 Å²	99	126.7 Å²	126.7	60%	0.6	71%	0.714	S	S	*	*			cis	124.8	143.7	14.4	155.2	0	0	0	0	107.7	S650	S650-V652 PolarHBondContact OG-N 3.13Å
653	D	28.9	Very low	33.5	Very low	153 Å²	153	131.6 Å²	131.6	82%	0.818	72%	0.719	S	S	*	*			trans	70.1	139.9	-179.6	-62.8	-27	0	0	0	118.4
654	A	29.1	Very low	33.5	Very low	72 Å²	72	131.4 Å²	131.4	60%	0.595	72%	0.717	S	S	*	*			cis	-164.7	130.2	-15.7	0	0	0	0	0	112.5
655	L	29.9	Very low	33	Very low	169 Å²	169	135.5 Å²	135.5	89%	0.885	72%	0.724	S	S	*	*			trans	63.3	159.9	150.2	-53.2	173.7	0	0	0	117.7
656	V	29.7	Very low	32.6	Very low	127 Å²	127	133.7 Å²	133.7	77%	0.77	73%	0.726	S	S	*	*			cis	-145.1	167.7	-8.9	97.9	0	0	0	0	110.6
657	S	27.7	Very low	32.3	Very low	97 Å²	97	133.2 Å²	133.2	68%	0.678	74%	0.735	S	S	*	*			trans	-130.2	163.7	162.9	-172.3	0	0	0	0	110.1
658	L	29.9	Very low	31.5	Very low	147 Å²	147	132 Å²	132	77%	0.77	74%	0.738	S	S	*	*			trans	78	146.3	169.1	-67	148.9	0	0	0	119.9
659	T	28.5	Very low	31.3	Very low	112 Å²	112	127.7 Å²	127.7	69%	0.687	74%	0.743	S	S	*	*			trans	60.6	133.1	155.1	46.3	0	0	0	0	121.4
660	P	41.8	Very low	30.3	Very low	130 Å²	130	125.6 Å²	125.6	84%	0.844	74%	0.736	S	S	*	*			trans	-91.5	121.7	143.3	33.7	-25.5	0	0	0	111
661	P	34.1	Very low	30.5	Very low	106 Å²	106	128.5 Å²	128.5	69%	0.688	75%	0.753	S	S	*	*			trans	-114.2	161.7	161.2	10.9	11.3	0	0	0	112.4
662	E	30.4	Very low	29.8	Very low	170 Å²	170	129.8 Å²	129.8	79%	0.794	75%	0.748	S	S	*	*			trans	-90.4	-152	177.3	-53.2	-173.5	145.1	0	0	112.5
663	Y	28.2	Very low	30.6	Very low	203 Å²	203	129 Å²	129	80%	0.796	75%	0.745	S	S	*	*			trans	87.8	140.6	169.7	-57.9	-55.5	0	0	0	116.6
664	L	29.8	Very low	30.5	Very low	134 Å²	134	129.9 Å²	129.9	70%	0.702	74%	0.744	S	S	*	*			cis	-147.7	170.1	-3.9	-106	158.6	0	0	0	107.4
665	L	30.8	Very low	30.6	Very low	146 Å²	146	134.2 Å²	134.2	76%	0.764	75%	0.751	S	S	*	*			cis	-154.6	142.9	49.6	-75.1	162.7	0	0	0	109.4
666	S	26.8	Very low	30.6	Very low	92 Å²	92	136 Å²	136	64%	0.643	75%	0.746	S	S	*	*				58	137.9	102.5	-41.1	0	0	0	0	115.9
667	L	26.8	Very low	30.3	Very low	172 Å²	172	138.3 Å²	138.3	90%	0.901	75%	0.749	S	S	*	*			cis	-148.4	170.3	27.9	-165.9	66.3	0	0	0	112.4
668	S	25.7	Very low	31.1	Very low	118 Å²	118	138.3 Å²	138.3	83%	0.825	75%	0.746	S	S	*	*			trans	-97.6	148.6	173.2	179.6	0	0	0	0	112.2
669	G	26.8	Very low	31.1	Very low	72 Å²	72	141.4 Å²	141.4	74%	0.742	75%	0.749	S	S	*	*			trans	165.4	118.5	169.5	0	0	0	0	0	116
670	D	28.3	Very low	31	Very low	132 Å²	132	140.8 Å²	140.8	71%	0.706	75%	0.748	S	S	*	*			trans	-57.9	157.6	175.5	-146	7.3	0	0	0	113.2	H672	D670-H672 PolarHBondContact OD1-N 3.46Å; D670-H672 IonicContact OD2-ND1 3.92Å
671	P	36.3	Very low	30.3	Very low	124 Å²	124	145 Å²	145	81%	0.805	75%	0.749	S	S	*	*				-141.6	127.9	70.5	34.3	-14.9	0	0	0	117.7
672	H	28.2	Very low	30	Very low	151 Å²	151	145 Å²	145	70%	0.699	75%	0.751	S	S	*	*				15.8	149.3	127	-118.5	57.7	0	0	0	120.7	D670	D670-H672 PolarHBondContact OD1-N 3.46Å; D670-H672 IonicContact OD2-ND1 3.92Å
673	P	44.4	Very low	29.9	Very low	81 Å²	81	141.8 Å²	141.8	53%	0.526	75%	0.748	S	S	.	*			cis	-132.2	-175.1	-19.4	33.9	-13.7	0	0	0	114.1
674	H	28.5	Very low	30.7	Very low	173 Å²	173	140 Å²	140	80%	0.801	75%	0.751	S	S	*	*				166.3	119.8	121.8	-85.5	-64.1	0	0	0	115.4
675	H	30.4	Very low	30.9	Very low	162 Å²	162	139.9 Å²	139.9	75%	0.75	76%	0.758	S	S	*	*			trans	50.9	120	146.3	-112.2	-12.7	0	0	0	126
676	R	28.9	Very low	31.3	Very low	207 Å²	207	145 Å²	145	78%	0.781	77%	0.768	S	S	*	*			trans	81.8	154.1	134.2	-100.7	179.2	-175.8	-158	2.1	122.3
677	Q	23.2	Very low	31.6	Very low	175 Å²	175	145.9 Å²	145.9	82%	0.818	77%	0.773	S	S	*	*			trans	-116.8	-169.5	173.6	-41	170.1	-45.2	0	0	108.3
678	P	45.4	Very low	31.7	Very low	97 Å²	97	143.7 Å²	143.7	63%	0.63	77%	0.767	S	S	*	*			cis	-134.9	-176	-28.9	22.2	2.3	0	0	0	114.7
679	Y	30.2	Very low	32.1	Very low	213 Å²	213	147.7 Å²	147.7	84%	0.835	77%	0.77	S	S	*	*			trans	86	116	148.5	-76	-57.3	0	0	0	124.9
680	C	25.3	Very low	32.1	Very low	98 Å²	98	147.4 Å²	147.4	66%	0.662	77%	0.766	S	S	*	*			trans	68.4	112.2	131.8	-77.8	0	0	0	0	125.6
681	Y	27.6	Very low	32.1	Very low	220 Å²	220	150.4 Å²	150.4	86%	0.863	78%	0.776	S	S	*	*			trans	67.7	127.1	130.6	-87.1	-92.6	0	0	0	123.5
682	S	27.9	Very low	31.8	Very low	105 Å²	105	151.3 Å²	151.3	73%	0.734	77%	0.773	S	S	*	*			trans	122.5	108	134.9	73.1	0	0	0	0	120.1
683	S	29.1	Very low	31.8	Very low	103 Å²	103	151 Å²	151	72%	0.72	77%	0.772	S	S	*	*			trans	60.8	118.6	141.8	50.9	0	0	0	0	124.6
684	L	44.9	Very low	31	Very low	165 Å²	165	156.9 Å²	156.9	86%	0.864	78%	0.784	S	S	*	*			trans	74.5	147.7	146.4	-61.2	174.4	0	0	0	120.1
685	P	34.1	Very low	30.9	Very low	132 Å²	132	155.2 Å²	155.2	86%	0.857	79%	0.786	S	S	*	*				-139.9	174.9	112.8	40.1	-29.5	0	0	0	114.7
686	R	38.5	Very low	30.7	Very low	254 Å²	254	150.4 Å²	150.4	96%	0.958	78%	0.781	S	S	*	*			trans	-159.1	124.8	175.3	-163.6	-169.6	-153.3	-144.6	9.6	114
687	S	32.6	Very low	30.6	Very low	109 Å²	109	146.4 Å²	146.4	76%	0.762	78%	0.784	S	S	*	*			trans	-169.9	171	165.1	-152.8	0	0	0	0	108.1
688	V	30	Very low	31.1	Very low	127 Å²	127	142.8 Å²	142.8	77%	0.77	78%	0.784	S	S	*	*			cis	-137.6	171	1.9	-136.8	0	0	0	0	105.6
689	K	33	Very low	30.3	Very low	202 Å²	202	145.4 Å²	145.4	88%	0.878	79%	0.793	S	S	*	*			cis	69.5	127	22.6	-112.5	-172.2	176.3	-172.4	0	116.5
690	G	27.7	Very low	30.4	Very low	65 Å²	65	140.3 Å²	140.3	67%	0.67	78%	0.784	S	S	*	*			cis	162.6	-167.6	-6	0	0	0	0	0	111.4
691	Q	28.2	Very low	30.8	Very low	196 Å²	196	141.9 Å²	141.9	92%	0.916	79%	0.786	S	S	*	*			trans	74.5	173.3	160.1	-158.2	167.8	-25.8	0	0	117.1
692	L	29	Very low	31.1	Very low	142 Å²	142	138.1 Å²	138.1	74%	0.743	78%	0.776	S	S	*	*				-158.6	140.5	-69.1	176.3	64.7	0	0	0	111.5
693	Q	28.3	Very low	31.3	Very low	145 Å²	145	143 Å²	143	68%	0.678	78%	0.78	S	S	*	*			trans	21.9	128	156.2	-122.2	-172.7	82.5	0	0	124
694	R	28	Very low	31.4	Very low	205 Å²	205	143.8 Å²	143.8	77%	0.774	78%	0.78	S	S	*	*				93.3	128.5	123.7	-119.6	-170.8	-131	-120.3	1.1	124
695	T	25.6	Very low	30.7	Very low	137 Å²	137	141.9 Å²	141.9	84%	0.84	78%	0.775	S	S	*	*			trans	87.1	135.9	145.2	-27.7	0	0	0	0	119
696	G	26.8	Very low	30.3	Very low	62 Å²	62	144.3 Å²	144.3	64%	0.639	78%	0.777	S	S	*	*			trans	-179.2	-15.2	175.3	0	0	0	0	0	125
697	S	28.2	Very low	30.2	Very low	123 Å²	123	137.9 Å²	137.9	86%	0.86	77%	0.771	S	S	*	*			trans	61.8	152.5	171.6	64.3	0	0	0	0	122
698	A	32	Very low	30.1	Very low	99 Å²	99	141 Å²	141	82%	0.818	78%	0.778	S	S	*	*			trans	69.2	143.5	165	0	0	0	0	0	119.5
699	D	29.7	Very low	30.4	Very low	152 Å²	152	143.5 Å²	143.5	81%	0.813	78%	0.782	S	S	*	*			cis	-162.6	166.1	-25.1	-161.1	2.7	0	0	0	110.5
700	T	31.6	Very low	30.3	Very low	105 Å²	105	145.3 Å²	145.3	64%	0.644	78%	0.783	S	S	*	*			trans	71.7	107	162.6	-50.5	0	0	0	0	120
701	D	35	Very low	30.7	Very low	131 Å²	131	150.7 Å²	150.7	70%	0.701	79%	0.791	S	S	*	*			trans	57.5	145.3	142.5	-68.4	13.6	0	0	0	122.3
702	Q	33	Very low	30.7	Very low	142 Å²	142	151.3 Å²	151.3	66%	0.664	78%	0.784	S	S	*	*			cis	-159.7	171.6	2.8	-126.6	173.4	60.1	0	0	112.3
703	Y	31.3	Very low	30.6	Very low	208 Å²	208	150.3 Å²	150.3	82%	0.816	78%	0.779	S	S	*	*			trans	76.6	168.8	170.3	-77.9	-76.1	0	0	0	120.4
704	V	31.7	Very low	30.4	Very low	118 Å²	118	151 Å²	151	72%	0.715	78%	0.782	S	S	*	*				-139.5	129.3	-128.2	159.7	0	0	0	0	115.4
705	V	29.7	Very low	30.3	Very low	125 Å²	125	149.5 Å²	149.5	76%	0.758	78%	0.784	S	S	*	*			trans	39.3	127.2	134.5	-174.2	0	0	0	0	118.3
706	M	26	Very low	30.5	Very low	184 Å²	184	150.6 Å²	150.6	91%	0.906	78%	0.779	S	S	*	*			cis	-142	145.5	48.1	-79.7	-169.5	163.8	0	0	116
707	S	36	Very low	30.7	Very low	119 Å²	119	151.4 Å²	151.4	83%	0.832	78%	0.775	S	S	*	*			trans	-163.8	157.5	138	63.7	0	0	0	0	109.6
708	L	30.9	Very low	30.7	Very low	173 Å²	173	152.2 Å²	152.2	91%	0.906	77%	0.77	S	S	*	*			trans	-163.8	147.1	162.3	-115	173.4	0	0	0	112.3
709	Q	37	Very low	30.4	Very low	181 Å²	181	151.4 Å²	151.4	85%	0.846	77%	0.771	S	S	*	*			trans	-154	134.2	179.7	174.9	-178.1	-3	0	0	109.2
710	R	29.7	Very low	30.1	Very low	240 Å²	240	147.9 Å²	147.9	91%	0.906	77%	0.77	S	S	*	*			trans	-166.2	177.9	163.1	-117.1	167.3	-160.4	-79.3	-3.7	114.8
711	Q	36.7	Very low	30.7	Very low	177 Å²	177	148.3 Å²	148.3	83%	0.827	78%	0.775	S	S	*	*			trans	-153.4	123	-166.8	169.6	-163.2	28.9	0	0	108.5
712	R	28.4	Very low	30.4	Very low	209 Å²	209	149.8 Å²	149.8	79%	0.789	78%	0.781	S	S	*	*			trans	164.3	133.3	152.2	-100.4	-166.7	177.2	-144.6	1.1	114.8
713	I	26.1	Very low	30.2	Very low	121 Å²	121	147.9 Å²	147.9	62%	0.621	78%	0.784	S	S	*	*				49.6	142	111.1	-56.8	178	0	0	0	121.8
714	E	24.2	Very low	30.9	Very low	159 Å²	159	144.1 Å²	144.1	74%	0.743	79%	0.785	S	S	*	*			trans	85	110.3	154.7	-85.5	143.9	-163.1	0	0	123.2
715	E	27.2	Very low	30.7	Very low	175 Å²	175	142.1 Å²	142.1	82%	0.818	79%	0.788	S	S	*	*				71.1	138.8	109.3	-144.6	156.8	115.3	0	0	125.4
716	E	29.8	Very low	30.8	Very low	159 Å²	159	144.9 Å²	144.9	74%	0.743	79%	0.793	S	S	*	*			trans	39.4	115.3	162.1	-86.4	-146	62.2	0	0	127
717	S	30.3	Very low	31.1	Very low	79 Å²	79	141.9 Å²	141.9	55%	0.552	79%	0.79	S	S	*	*				75.5	145.1	112.6	87	0	0	0	0	126
718	N	28.6	Very low	30.7	Very low	141 Å²	141	140 Å²	140	75%	0.754	79%	0.789	S	S	*	*			trans	79.4	125.4	160.2	-61.4	-67	0	0	0	121.6
719	G	26.2	Very low	30.7	Very low	82 Å²	82	139 Å²	139	85%	0.845	79%	0.79	S	S	*	*			trans	151.2	121.3	164	0	0	0	0	0	115.3
720	G	23.3	Very low	30.3	Very low	77 Å²	77	133.5 Å²	133.5	79%	0.794	78%	0.782	S	S	*	*			trans	-104.3	-152	167.6	0	0	0	0	0	111.9
721	P	44.4	Very low	30.3	Very low	115 Å²	115	127.7 Å²	127.7	75%	0.747	78%	0.778	S	S	*	*			cis	-143.2	-162.8	-0.8	42.4	-21.8	0	0	0	115
722	I	27.9	Very low	29.7	Very low	161 Å²	161	124.7 Å²	124.7	83%	0.826	78%	0.777	S	S	*	*			trans	78.9	136.7	157.9	-67.1	166.4	0	0	0	119.3
723	S	29.2	Very low	30.7	Very low	103 Å²	103	121 Å²	121	72%	0.72	78%	0.78	S	S	*	*			trans	-105	177.4	173.9	-44.8	0	0	0	0	112.1
724	P	45.2	Very low	30.7	Very low	129 Å²	129	118.7 Å²	118.7	84%	0.838	79%	0.786	S	S	*	*				-149.9	151.6	111.9	37.4	-21.8	0	0	0	117.1
725	G	27.9	Very low	30.7	Very low	76 Å²	76	117.2 Å²	117.2	78%	0.784	79%	0.788	S	S	*	*			trans	80.4	153.2	154.7	0	0	0	0	0	119
726	E	31.1	Very low	31.5	Very low	182 Å²	182	112.6 Å²	112.6	85%	0.85	77%	0.773	S	S	*	*			cis	-164.5	138.2	-17	-162	171.8	-167.5	0	0	112.3
727	S	32.6	Very low	31.3	Very low	122 Å²	122	108.9 Å²	108.9	85%	0.853	76%	0.761	S	S	*	*			trans	60.9	148.1	159.6	73.1	0	0	0	0	121.9
728	G	28.7	Very low	31.4	Very low	78 Å²	78	108.5 Å²	108.5	80%	0.804	76%	0.756	S	S	*	*			trans	144.2	93.4	158.3	0	0	0	0	0	118.7
729	T	30.2	Very low	32.2	Very low	153 Å²	153	105.4 Å²	105.4	94%	0.939	74%	0.744	S	S	*	*			trans	-56.1	158.3	166.5	48.5	0	0	0	0	115
730	G	28	Very low	32.2	Very low	66 Å²	66	106.5 Å²	106.5	68%	0.68	74%	0.738	S	S	*	*			cis	162.4	161.2	-2.5	0	0	0	0	0	113.6
731	S	30.1	Very low	32.5	Very low	117 Å²	117	107.9 Å²	107.9	82%	0.818	74%	0.735	S	S	*	*			trans	54.2	118.2	161.2	58.7	0	0	0	0	123.9
732	S	25.3	Very low	31.9	Very low	115 Å²	115	110.5 Å²	110.5	80%	0.804	74%	0.742	S	S	*	*				27.3	166.4	120.6	-62.1	0	0	0	0	123.8
733	P	47.6	Very low	32.4	Very low	132 Å²	132	108.5 Å²	108.5	86%	0.857	74%	0.74	S	S	*	*			cis	-139.2	-174.7	-30.7	38.2	-19.5	0	0	0	114.4
734	G	27	Very low	32.6	Very low	71 Å²	71	108.7 Å²	108.7	73%	0.732	74%	0.741	S	S	*	*			trans	159.5	148.3	160.4	0	0	0	0	0	119.3
735	T	25	Very low	32.5	Very low	129 Å²	129	108.3 Å²	108.3	79%	0.791	74%	0.739	S	S	*	*			trans	-139.6	-169.2	-178.1	53	0	0	0	0	110.7
736	P	44.3	Very low	32.6	Very low	77 Å²	77	111.8 Å²	111.8	50%	0.5	74%	0.739	S	S	.	*			cis	-140.8	-176.3	-22.8	27.4	-1.8	0	0	0	118.2	P1096 Y1097	P736-P1096 CarbonylContact O-C 3.53Å; P736-P1096 VanDerWaalsContact O-C 3.29Å; P736-Y1097 CarbonylContact C-O 3.6Å; P736-Y1097 WeakPolarHBondContact CA-O 3.16Å
737	T	25.5	Very low	32.7	Very low	81 Å²	81	111.5 Å²	111.5	50%	0.497	74%	0.735	S	S	.	*			trans	106.4	43.6	139.4	-21.2	0	0	0	0	125.4	P739 S1095 P1096 Y1097	T737-P739 WeakPolarHBondContact O-CD 3.09Å; T737-S1095 CarbonylContact O-C 3.56Å; T737-S1095 WeakPolarHBondContact O-CA 3.17Å; T737-S1095 PolarHBondContact O-N 3.11Å; T737-P1096 VanDerWaalsContact O-CA 3.31Å; T737-P1096 WeakPolarHBondContact O-CA 3.34Å; T737-Y1097 PolarHBondContact N-O 3.11Å
738	T	32.1	Very low	32.6	Very low	72 Å²	72	112.6 Å²	112.6	44%	0.442	73%	0.73	S	S	.	*			trans	-57.3	130.5	-171.6	-52.1	0	0	0	0	121.5	Y1097	T738-Y1097 HydrophobicContact CG2-CD1 4.27Å; T738-Y1097 HydrophobicContact CG2-CD2 3.91Å; T738-Y1097 HydrophobicContact CG2-CE1 3.89Å; T738-Y1097 HydrophobicContact CG2-CE2 3.49Å; T738-Y1097 VanDerWaalsContact CG2-CE2 3.49Å; T738-Y1097 HydrophobicContact CG2-CG 4.28Å; T738-Y1097 VanDerWaalsContact CG2-CZ 3.48Å; T738-Y1097 VanDerWaalsContact N-N 3.1Å; T738-Y1097 WeakPolarHBondContact OG1-CA 3.34Å; T738-Y1097 WeakPolarHBondContact OG1-CD1 3.18Å; T738-Y1097 PolarHBondContact OG1-N 3.13Å
739	P	45.3	Very low	32.5	Very low	76 Å²	76	113.7 Å²	113.7	49%	0.494	72%	0.721	S	S	.	*			trans	-155.2	175.8	137.1	42.3	-25.2	0	0	0	119.6	T737 S1095	T737-P739 WeakPolarHBondContact O-CD 3.09Å; P739-S1095 VanDerWaalsContact CD-CA 3.49Å
740	S	26.8	Very low	32.5	Very low	104 Å²	104	117.6 Å²	117.6	73%	0.727	72%	0.719	S	S	*	*			trans	86.3	93.8	149.1	67.6	0	0	0	0	126.1
741	S	27.8	Very low	32.5	Very low	106 Å²	106	118.9 Å²	118.9	74%	0.741	72%	0.718	S	S	*	*				56.5	121.4	127.5	64.3	0	0	0	0	126.8
742	L	31.8	Very low	32.5	Very low	170 Å²	170	121.5 Å²	121.5	89%	0.89	72%	0.722	S	S	*	*			trans	66.3	164	149	-70	171.4	0	0	0	118.6
743	P	38.9	Very low	32.6	Very low	119 Å²	119	119.2 Å²	119.2	77%	0.773	72%	0.717	S	S	*	*			cis	-122.4	-161.5	1.2	43.8	-29.4	0	0	0	114.4
744	S	34	Very low	31.6	Very low	107 Å²	107	116.4 Å²	116.4	75%	0.748	71%	0.712	S	S	*	*			trans	-104.3	162.3	174.9	61.5	0	0	0	0	113.6
745	P	42.9	Very low	31.7	Very low	122 Å²	122	120.7 Å²	120.7	79%	0.792	72%	0.717	S	S	*	*				-144	177.5	128.1	37.8	-24.5	0	0	0	113.3
746	L	30.3	Very low	31.8	Very low	149 Å²	149	121.8 Å²	121.8	78%	0.78	72%	0.718	S	S	*	*			cis	179	158.1	-43.4	-139.7	179.6	0	0	0	106.6
747	K	32.6	Very low	31.1	Very low	176 Å²	176	124.6 Å²	124.6	77%	0.765	72%	0.724	S	S	*	*			trans	78.1	148.2	171	-50.9	-177.5	-179.8	175.5	0	115.1
748	L	29.8	Very low	31.3	Very low	144 Å²	144	130.8 Å²	130.8	75%	0.754	74%	0.738	S	S	*	*			cis	-165.4	173.7	-7.1	-135.8	64.4	0	0	0	107.9
749	T	28.1	Very low	31.2	Very low	102 Å²	102	132.3 Å²	132.3	63%	0.626	75%	0.751	S	S	*	*			cis	-158.3	144.1	0.1	-28.5	0	0	0	0	109.4
750	R	29.2	Very low	30.7	Very low	235 Å²	235	140.2 Å²	140.2	89%	0.887	77%	0.771	S	S	*	*			trans	54.4	164.7	148.9	-86.9	179.6	165	173.8	-6.4	119.7
751	S	28.2	Very low	30.9	Very low	93 Å²	93	142.5 Å²	142.5	65%	0.65	78%	0.78	S	S	*	*			cis	-163.1	124.4	-16.1	40.7	0	0	0	0	106.6
752	D	29.9	Very low	31.1	Very low	172 Å²	172	142.6 Å²	142.6	92%	0.92	78%	0.78	S	S	*	*				79.2	149.4	88.2	-163.1	17.3	0	0	0	114.7
753	G	27.3	Very low	31.1	Very low	66 Å²	66	146 Å²	146	68%	0.68	78%	0.781	S	S	*	*			trans	101	65	161	0	0	0	0	0	120.6
754	G	26.3	Very low	31.2	Very low	74 Å²	74	145.8 Å²	145.8	76%	0.763	78%	0.779	S	S	*	*			trans	31	157.1	138.3	0	0	0	0	0	127
755	L	28.8	Very low	31	Very low	160 Å²	160	146.9 Å²	146.9	84%	0.838	78%	0.782	S	S	*	*			trans	76.7	138	144.8	-88.7	164	0	0	0	121.8
756	L	28.6	Very low	30.6	Very low	153 Å²	153	151.8 Å²	151.8	80%	0.801	78%	0.784	S	S	*	*			trans	67.8	162.8	160.2	-59	173.4	0	0	0	117.8
757	H	29.7	Very low	31.1	Very low	136 Å²	136	151.9 Å²	151.9	63%	0.63	79%	0.785	S	S	*	*			cis	-168.7	122.9	-35.8	176.8	82.5	0	0	0	111.2
758	R	29.3	Very low	30.9	Very low	211 Å²	211	147.7 Å²	147.7	80%	0.796	78%	0.783	S	S	*	*			trans	67.7	170.3	152.5	-166.2	174.5	177.1	-159.2	2.9	118.1
759	S	30.3	Very low	31.2	Very low	103 Å²	103	148.5 Å²	148.5	72%	0.72	79%	0.787	S	S	*	*			trans	68.8	123.9	-178.2	1.2	0	0	0	0	114.4
760	R	34.1	Very low	31.4	Very low	243 Å²	243	152.7 Å²	152.7	92%	0.917	80%	0.8	S	S	*	*			cis	65.8	109.4	46	-62.6	-169.4	-178	-167.3	2.2	114.4
761	V	31.7	Very low	31.6	Very low	151 Å²	151	147 Å²	147	92%	0.915	80%	0.796	S	S	*	*				-168.1	170.7	123.9	145.6	0	0	0	0	107.1
762	C	30.7	Very low	32	Very low	108 Å²	108	149.7 Å²	149.7	73%	0.73	80%	0.802	S	S	*	*			trans	-123.9	148.2	-149.5	-53	0	0	0	0	116.4
763	R	31.5	Very low	31.9	Very low	243 Å²	243	152.4 Å²	152.4	92%	0.917	80%	0.8	S	S	*	*			trans	67.6	172.4	161.5	-64.7	176.3	176.7	177	-1.6	114.8
764	P	41.6	Very low	31.9	Very low	113 Å²	113	156.2 Å²	156.2	73%	0.734	81%	0.81	S	S	*	*			cis	-128.5	167.3	-1.5	23.1	1.3	0	0	0	117.7
765	T	30.3	Very low	32.6	Very low	130 Å²	130	160.5 Å²	160.5	80%	0.798	81%	0.814	S	S	*	*			trans	6.7	148.2	146.5	-24.2	0	0	0	0	123.2
766	R	33.7	Very low	32.6	Very low	225 Å²	225	158.8 Å²	158.8	85%	0.849	81%	0.812	S	S	*	*			trans	81	156.6	162.8	-71.2	-163.1	157.9	179.8	-7.2	117.6
767	L	41.5	Very low	32.5	Very low	152 Å²	152	156.4 Å²	156.4	80%	0.796	81%	0.807	S	S	*	*			cis	-179.9	116.5	-42.5	-115	179.6	0	0	0	108.1
768	A	27.9	Very low	32.2	Very low	87 Å²	87	159.2 Å²	159.2	72%	0.719	82%	0.823	S	S	*	*			trans	-161.4	127	160.3	0	0	0	0	0	106
769	L	35.6	Very low	32.1	Very low	162 Å²	162	153.5 Å²	153.5	85%	0.848	82%	0.816	S	S	*	*				59	100.8	59.6	-64.5	-178.4	0	0	0	113.1
770	E	32.5	Very low	32.1	Very low	190 Å²	190	156.4 Å²	156.4	89%	0.888	82%	0.818	S	S	*	*				-165.3	149.9	114.7	-112.9	-174.3	135.4	0	0	115.2
771	S	35.1	Very low	31.8	Very low	114 Å²	114	152.4 Å²	152.4	80%	0.797	81%	0.809	S	S	*	*			trans	55.1	155	152	-147.7	0	0	0	0	122.6
772	L	34.8	Very low	32.6	Very low	151 Å²	151	150.1 Å²	150.1	79%	0.791	80%	0.798	S	S	*	*			trans	-128	135.7	-178.2	-79.9	168.6	0	0	0	111.3
773	R	29.1	Very low	32.6	Very low	229 Å²	229	152 Å²	152	86%	0.864	80%	0.799	S	S	*	*			trans	47.3	114.7	152.2	-60.9	-176.5	177	-155.8	-0.1	118.9
774	T	28	Very low	32.6	Very low	146 Å²	146	146.3 Å²	146.3	90%	0.896	79%	0.794	S	S	*	*				-148.8	157.7	97.2	18.8	0	0	0	0	110.5
775	L	40.1	Very low	32.2	Very low	164 Å²	164	145.7 Å²	145.7	86%	0.859	79%	0.793	S	S	*	*			trans	-85.3	166.2	-178.5	-54.5	170.9	0	0	0	110.6
776	P	29.6	Very low	32.9	Very low	123 Å²	123	146.1 Å²	146.1	80%	0.799	79%	0.785	S	S	*	*				-141.5	148.5	82.7	37.3	-22.2	0	0	0	116.5
777	C	26.1	Very low	33.2	Very low	103 Å²	103	141 Å²	141	70%	0.696	78%	0.782	S	S	*	*			trans	27.2	127.3	138.4	-141.1	0	0	0	0	121.4	S779	C777-S779 PolarHBondContact SG-N 3.43Å; C777-S779 VanDerWaalsContact SG-N 3.39Å
778	M	23.3	Very low	32.9	Very low	196 Å²	196	143.6 Å²	143.6	97%	0.966	78%	0.781	S	S	*	*				-102	115.9	129.5	-81.4	-173.3	67.9	0	0	108
779	S	26.6	Very low	33.2	Very low	91 Å²	91	144 Å²	144	64%	0.636	78%	0.779	S	S	*	*			trans	-93.7	171.2	166.2	57.8	0	0	0	0	110.3	C777	C777-S779 PolarHBondContact SG-N 3.43Å; C777-S779 VanDerWaalsContact SG-N 3.39Å
780	E	30.8	Very low	33.9	Very low	163 Å²	163	142.5 Å²	142.5	76%	0.762	78%	0.778	S	S	*	*			trans	-65.8	177.9	170	-54.2	177.6	126.9	0	0	112.6
781	H	26.8	Very low	33.9	Very low	160 Å²	160	137.1 Å²	137.1	74%	0.741	77%	0.774	S	S	*	*			trans	135.9	159.2	153.1	-64.6	-19.4	0	0	0	113.7
782	P	48.9	Very low	33.9	Very low	103 Å²	103	141 Å²	141	67%	0.669	78%	0.779	S	S	*	*				-146.3	-154.5	-91.5	33.8	-7.1	0	0	0	115.4
783	L	30.9	Very low	33.8	Very low	146 Å²	146	143.8 Å²	143.8	76%	0.764	78%	0.781	S	S	*	*			trans	110.1	152.3	149.4	-61.7	-176.4	0	0	0	118.2
784	P	31.1	Very low	34.1	Very low	124 Å²	124	140.8 Å²	140.8	81%	0.805	78%	0.78	S	S	*	*			cis	-130.3	155.2	9.3	39.9	-24.3	0	0	0	118.8
785	S	32.8	Very low	34.2	Very low	101 Å²	101	139.7 Å²	139.7	71%	0.706	77%	0.769	S	S	*	*			trans	-108.7	175.7	135.3	54.3	0	0	0	0	107.3
786	E	46.3	Very low	34	Very low	138 Å²	138	139 Å²	139	65%	0.645	76%	0.764	S	S	*	*			cis	-163.8	177.4	24.4	-152	-166.3	132.6	0	0	108	R788	E786-R788 PolarHBondContact OE1-N 3.02Å; E786-R788 VanDerWaalsContact OE1-N 3.09Å
787	P	39.2	Very low	34.1	Very low	118 Å²	118	140 Å²	140	77%	0.766	76%	0.763	S	S	*	*				-144.7	150	84.9	33.9	-14.4	0	0	0	115
788	R	34.8	Very low	34.7	Very low	206 Å²	206	145 Å²	145	78%	0.777	77%	0.773	S	S	*	*				63.8	135.8	66.9	-112.1	-174.8	-175.6	-166	-0.3	113.8	E786	E786-R788 PolarHBondContact OE1-N 3.02Å; E786-R788 VanDerWaalsContact OE1-N 3.09Å
789	S	35	Very low	35.1	Very low	97 Å²	97	139.5 Å²	139.5	68%	0.678	77%	0.767	S	S	*	*			cis	-159.4	-155.3	16.7	-42.9	0	0	0	0	108.6
790	P	50.8	Low	35.4	Very low	129 Å²	129	141.3 Å²	141.3	84%	0.838	78%	0.78	S	S	*	*			cis	-136.6	-177.1	-16.1	41.4	-23.1	0	0	0	116.2
791	G	32.9	Very low	35.4	Very low	77 Å²	77	138.4 Å²	138.4	79%	0.794	78%	0.784	S	S	*	*			trans	102.3	145.4	158	0	0	0	0	0	116.4
792	E	33	Very low	35.8	Very low	195 Å²	195	135 Å²	135	91%	0.911	78%	0.784	S	S	*	*			cis	-157.7	161	-14.9	-162.4	158.2	-127.4	0	0	109.1
793	Y	32.9	Very low	34.8	Very low	211 Å²	211	137.9 Å²	137.9	83%	0.827	79%	0.793	S	S	*	*			trans	-114.6	139.9	-170.6	-92.3	-95.8	0	0	0	113.7
794	I	36.2	Very low	35.1	Very low	166 Å²	166	137.6 Å²	137.6	85%	0.851	80%	0.797	S	S	*	*			trans	-141.8	137.5	156.1	-53.8	-179.2	0	0	0	109.1
795	N	30.1	Very low	35.4	Very low	123 Å²	123	137.4 Å²	137.4	66%	0.658	80%	0.796	S	S	*	*			trans	-97.7	157.2	176.2	-64.5	-10.2	0	0	0	111.7
796	I	35.2	Very low	35.1	Very low	148 Å²	148	139.8 Å²	139.8	76%	0.759	80%	0.8	S	S	*	*			trans	-137.9	118	159.1	-55.9	-179.9	0	0	0	108.8
797	D	32.8	Very low	34.4	Very low	146 Å²	146	140.1 Å²	140.1	78%	0.781	81%	0.805	S	S	*	*			trans	-95.3	155.1	170.6	-69.3	-63.6	0	0	0	111
798	F	39	Very low	33.7	Very low	207 Å²	207	142.9 Å²	142.9	91%	0.908	81%	0.808	S	S	*	*			trans	-105.5	131.5	177.6	-75.7	-90.4	0	0	0	111.9
799	G	30.8	Very low	33.5	Very low	81 Å²	81	137.7 Å²	137.7	84%	0.835	80%	0.803	S	S	*	*			trans	-140.9	152.2	172.9	0	0	0	0	0	111.3
800	S	32.9	Very low	33.2	Very low	129 Å²	129	137.9 Å²	137.9	90%	0.902	80%	0.804	S	S	*	*			trans	-128.1	119.4	-173	178.1	0	0	0	0	111.7
801	A	31.1	Very low	32.2	Very low	102 Å²	102	140 Å²	140	84%	0.843	80%	0.803	S	S	*	*			trans	-154.2	162.5	164.4	0	0	0	0	0	109
802	A	35.6	Very low	32	Very low	89 Å²	89	141.6 Å²	141.6	74%	0.736	81%	0.809	S	S	*	*			trans	-98.2	156.7	-175.5	0	0	0	0	0	112.8
803	D	28.1	Very low	31.6	Very low	162 Å²	162	135.4 Å²	135.4	87%	0.866	80%	0.798	S	S	*	*				-169.1	165.7	124.5	-100.8	-25.8	0	0	0	111.8
804	V	35.9	Very low	31.2	Very low	140 Å²	140	131.2 Å²	131.2	85%	0.848	80%	0.799	S	S	*	*			trans	-138.6	119.9	-177.9	175.9	0	0	0	0	111.6
805	P	37.7	Very low	30.8	Very low	121 Å²	121	129.2 Å²	129.2	79%	0.786	79%	0.794	S	S	*	*			trans	-142.4	175.2	130.1	26.8	-7.2	0	0	0	112.1
806	L	27.1	Very low	30.6	Very low	150 Å²	150	130.5 Å²	130.5	79%	0.785	80%	0.798	S	S	*	*			cis	-176.6	119.4	-29.9	170.3	67.6	0	0	0	107.7
807	L	31.6	Very low	30.2	Very low	146 Å²	146	128.1 Å²	128.1	76%	0.764	79%	0.793	S	S	*	*			trans	54.6	165.1	151.2	-143.8	68.4	0	0	0	122.1
808	E	24.9	Very low	29.9	Very low	176 Å²	176	127.1 Å²	127.1	82%	0.822	79%	0.793	S	S	*	*			trans	74.1	159.5	162.8	-54.8	-167.2	145.9	0	0	119.6
809	S	29	Very low	29.3	Very low	97 Å²	97	125.8 Å²	125.8	68%	0.678	79%	0.789	S	S	*	*				170.6	144.8	-60.8	-178	0	0	0	0	108.6
810	S	30	Very low	29.3	Very low	100 Å²	100	131.2 Å²	131.2	70%	0.699	79%	0.793	S	S	*	*			trans	64.3	166.4	161.1	-56.4	0	0	0	0	116.4
811	E	29	Very low	29.1	Very low	175 Å²	175	127.7 Å²	127.7	82%	0.818	78%	0.777	S	S	*	*			cis	-158	162.6	-27.4	-113.4	-179.5	177.3	0	0	109.4
812	A	29.1	Very low	29	Very low	109 Å²	109	128.3 Å²	128.3	90%	0.901	78%	0.776	S	S	*	*			trans	61.3	159.2	162	0	0	0	0	0	117.7
813	G	24.7	Very low	28.6	Very low	66 Å²	66	132.1 Å²	132.1	68%	0.68	78%	0.782	S	S	*	*			cis	161.3	179.6	-6.1	0	0	0	0	0	110.8
814	S	25.1	Very low	28.6	Very low	122 Å²	122	129.1 Å²	129.1	85%	0.853	77%	0.774	S	S	*	*			trans	74	150.8	176.4	-158.8	0	0	0	0	116.6
815	V	26.7	Very low	28.2	Very low	124 Å²	124	129.6 Å²	129.6	75%	0.752	77%	0.771	S	S	*	*				-166	145.5	-52.2	117.6	0	0	0	0	109.3
816	M	25.7	Very low	27.9	Very low	151 Å²	151	128 Å²	128	74%	0.744	76%	0.763	S	S	*	*			trans	42.9	117.8	157.8	-61	-82.7	91.6	0	0	122.2
817	C	26.8	Very low	28.1	Very low	97 Å²	97	126.7 Å²	126.7	66%	0.655	76%	0.757	S	S	*	*				68.5	156.8	113.9	-60.3	0	0	0	0	121.3
818	T	27.1	Very low	27.9	Very low	126 Å²	126	130 Å²	130	77%	0.773	76%	0.761	S	S	*	*			cis	-158.9	-174.2	-3.1	7.8	0	0	0	0	111.4
819	E	25.9	Very low	28.3	Very low	178 Å²	178	125.6 Å²	125.6	83%	0.832	75%	0.754	S	S	*	*			trans	90.4	109.3	174.6	-55.6	-168.9	152.2	0	0	113.8
820	E	30.8	Very low	28.5	Very low	195 Å²	195	127.3 Å²	127.3	91%	0.911	76%	0.756	S	S	*	*			cis	84.6	139.7	47.9	-66.6	-147.6	133	0	0	114.1
821	G	29.1	Very low	28.8	Very low	56 Å²	56	130.6 Å²	130.6	58%	0.577	76%	0.764	S	S	*	*			cis	-174.7	-147.9	1.8	0	0	0	0	0	113.5
822	S	29.3	Very low	28.8	Very low	115 Å²	115	128.2 Å²	128.2	80%	0.804	76%	0.757	S	S	*	*			trans	78.4	139.4	-174.4	79.9	0	0	0	0	116
823	L	27.6	Very low	28.9	Very low	168 Å²	168	131.2 Å²	131.2	88%	0.88	76%	0.756	S	S	*	*			cis	-154.1	170.3	-5.1	-122.3	171.4	0	0	0	111.4
824	S	28	Very low	29	Very low	100 Å²	100	135 Å²	135	70%	0.699	76%	0.761	S	S	*	*			trans	-148.2	152.7	-176.8	-178.3	0	0	0	0	112
825	L	28.1	Very low	29.2	Very low	149 Å²	149	134.7 Å²	134.7	78%	0.78	76%	0.758	S	S	*	*			trans	-164.1	124.7	164.2	-125.2	91.3	0	0	0	105.6
826	S	31.1	Very low	29.1	Very low	88 Å²	88	134.3 Å²	134.3	62%	0.615	76%	0.762	S	S	*	*			cis	99.1	155.6	20.4	87.8	0	0	0	0	116.2
827	D	29.8	Very low	29.1	Very low	123 Å²	123	133.3 Å²	133.3	66%	0.658	76%	0.764	S	S	*	*			trans	106.7	136.9	163.7	-56.3	6.6	0	0	0	116.7
828	Y	29	Very low	29.1	Very low	214 Å²	214	136.2 Å²	136.2	84%	0.839	77%	0.767	S	S	*	*			cis	-159.1	164	-26	-122.5	-92.5	0	0	0	104.5
829	A	32.9	Very low	29.1	Very low	84 Å²	84	136.9 Å²	136.9	69%	0.694	77%	0.765	S	S	*	*			cis	-154.8	161.4	21.2	0	0	0	0	0	113.4
830	N	32.7	Very low	28.9	Very low	133 Å²	133	137.3 Å²	137.3	71%	0.711	77%	0.767	S	S	*	*			trans	-94.6	160.6	168.5	-81.6	13.2	0	0	0	112.4	D832	N830-D832 PolarHBondContact ND2-OD2 3.24Å
831	I	35.6	Very low	28.8	Very low	170 Å²	170	132.2 Å²	132.2	87%	0.872	75%	0.753	S	S	*	*			trans	-135.9	121.5	134.2	-61.1	-175.3	0	0	0	108.8
832	D	29.8	Very low	28.7	Very low	125 Å²	125	137.9 Å²	137.9	67%	0.668	76%	0.764	S	S	*	*			trans	-100.1	156.7	163.3	-69.8	-72.7	0	0	0	109.7	N830	N830-D832 PolarHBondContact ND2-OD2 3.24Å
833	I	30.5	Very low	28.6	Very low	171 Å²	171	140.8 Å²	140.8	88%	0.877	77%	0.765	S	S	*	*			trans	-168.2	148.9	146.3	-105.2	153.2	0	0	0	111.3
834	N	27.7	Very low	28.4	Very low	146 Å²	146	135.7 Å²	135.7	78%	0.781	75%	0.753	S	S	*	*			trans	-85.8	154.1	-174.1	-72.4	-53.3	0	0	0	114.5
835	S	28.6	Very low	28.3	Very low	115 Å²	115	139.6 Å²	139.6	80%	0.804	76%	0.76	S	S	*	*			trans	44	125.1	141	65.9	0	0	0	0	121
836	S	24.1	Very low	28.1	Very low	117 Å²	117	138.1 Å²	138.1	82%	0.818	76%	0.762	S	S	*	*			trans	-147.8	151.6	134.4	-169	0	0	0	0	111.4
837	V	27.5	Very low	27.9	Very low	130 Å²	130	139.2 Å²	139.2	79%	0.788	77%	0.77	S	S	*	*			trans	-137.3	151.8	170.2	175.1	0	0	0	0	107
838	H	25.2	Very low	27.9	Very low	158 Å²	158	142 Å²	142	73%	0.731	78%	0.779	S	S	*	*			trans	91.9	118.3	165.6	-120.5	-96.1	0	0	0	118.6
839	L	28.3	Very low	28.5	Very low	140 Å²	140	137.1 Å²	137.1	73%	0.733	77%	0.773	S	S	*	*			trans	58	128.2	143.9	-121.4	69.4	0	0	0	122.3
840	E	22.3	Very low	28.2	Very low	186 Å²	186	140.2 Å²	140.2	87%	0.869	78%	0.783	S	S	*	*				-151.3	162.4	116.1	-136.9	178.2	171.7	0	0	111
841	S	27.2	Very low	27.9	Very low	88 Å²	88	137.1 Å²	137.1	62%	0.615	78%	0.782	S	S	*	*			trans	-158.3	109.2	-171.8	58.9	0	0	0	0	114.8
842	H	27.6	Very low	27.5	Very low	176 Å²	176	139.9 Å²	139.9	82%	0.815	78%	0.782	S	S	*	*			trans	-163.4	156.6	173.9	-92.4	-51.4	0	0	0	110.5
843	Q	26.5	Very low	27.3	Very low	176 Å²	176	140.1 Å²	140.1	82%	0.822	78%	0.782	S	S	*	*			cis	-107.6	-129.5	-11.3	-56.8	-175.5	3.1	0	0	109.2
844	G	24.8	Very low	27	Very low	60 Å²	60	139.9 Å²	139.9	62%	0.619	78%	0.775	S	S	*	*			cis	88.6	139.3	2	0	0	0	0	0	115.6
845	E	24.2	Very low	26.8	Very low	183 Å²	183	139.4 Å²	139.4	86%	0.855	77%	0.773	S	S	*	*			cis	-150.7	154.3	-17.1	-83.6	-163.2	98.4	0	0	110.7
846	S	25.2	Very low	26.6	Very low	118 Å²	118	139.7 Å²	139.7	83%	0.825	77%	0.769	S	S	*	*			trans	66.5	144	165.4	80.4	0	0	0	0	118.5
847	S	26.9	Very low	27.2	Very low	111 Å²	111	139.5 Å²	139.5	78%	0.776	77%	0.768	S	S	*	*			cis	-152.6	168.3	-17.5	49.9	0	0	0	0	111.9
848	H	28.6	Very low	27.2	Very low	181 Å²	181	142 Å²	142	84%	0.838	77%	0.772	S	S	*	*			trans	-51.5	165.8	-176.6	-61.3	-65.8	0	0	0	116.2
849	P	41.5	Very low	27.5	Very low	111 Å²	111	140 Å²	140	72%	0.721	77%	0.77	S	S	*	*			cis	-152.1	161.6	31	43.2	-21.6	0	0	0	121.9
850	V	27.7	Very low	27.9	Very low	150 Å²	150	140.4 Å²	140.4	91%	0.909	77%	0.772	S	S	*	*			trans	57	142.2	134	176	0	0	0	0	123.2
851	G	25.7	Very low	28.3	Very low	67 Å²	67	139.1 Å²	139.1	69%	0.691	77%	0.768	S	S	*	*			trans	110.5	136.8	154.1	0	0	0	0	0	113.9
852	R	27.3	Very low	28.3	Very low	228 Å²	228	140.1 Å²	140.1	86%	0.86	77%	0.774	S	S	*	*			cis	71	99.9	5.7	-156	-177.8	-164.5	-140.8	4	119
853	L	26.7	Very low	28.2	Very low	130 Å²	130	136.8 Å²	136.8	68%	0.681	77%	0.77	S	S	*	*			trans	72.8	155.8	154.7	-103.6	78.3	0	0	0	119.5
854	K	23.2	Very low	28.3	Very low	167 Å²	167	132.5 Å²	132.5	73%	0.726	76%	0.76	S	S	*	*			trans	76.8	136.2	155	-80.5	172.8	177.1	-176.2	0	115.6
855	N	23.6	Very low	28.5	Very low	136 Å²	136	137.9 Å²	137.9	73%	0.727	77%	0.771	S	S	*	*				62.9	137	71	-57	34.1	0	0	0	111.2
856	T	24	Very low	28.6	Very low	120 Å²	120	135.4 Å²	135.4	74%	0.736	77%	0.768	S	S	*	*			cis	-153.8	170.3	13.9	-14.1	0	0	0	0	112.1
857	S	37.4	Very low	28.7	Very low	114 Å²	114	134.8 Å²	134.8	80%	0.797	76%	0.763	S	S	*	*			trans	-28.6	129.1	164.2	-41.1	0	0	0	0	116.7
858	E	28.1	Very low	28.6	Very low	183 Å²	183	136.1 Å²	136.1	86%	0.855	76%	0.762	S	S	*	*			trans	-136.2	147.4	155	-80.4	-161.9	165.8	0	0	109.6
859	V	31.7	Very low	28.5	Very low	114 Å²	114	135.8 Å²	135.8	69%	0.691	76%	0.761	S	S	*	*			cis	-162.1	173.1	-26.7	82.4	0	0	0	0	108.7
860	L	36	Very low	27.8	Very low	150 Å²	150	138.1 Å²	138.1	79%	0.785	76%	0.762	S	S	*	*			trans	73	137.6	178.3	-64.1	136.8	0	0	0	117.4
861	M	30.5	Very low	27.6	Very low	159 Å²	159	137.5 Å²	137.5	78%	0.783	75%	0.754	S	S	*	*			cis	-166.5	176	-27	-125.9	-55.9	168.4	0	0	111.2
862	C	26.5	Very low	27.6	Very low	109 Å²	109	139.8 Å²	139.8	74%	0.736	75%	0.754	S	S	*	*			trans	74.4	135.4	171.6	-54.7	0	0	0	0	116
863	S	27.2	Very low	27.5	Very low	105 Å²	105	138 Å²	138	73%	0.734	76%	0.756	S	S	*	*			cis	-173.8	163.4	-8.9	-98.3	0	0	0	0	108.4
864	S	27.7	Very low	27.4	Very low	87 Å²	87	141.2 Å²	141.2	61%	0.608	76%	0.759	S	S	*	*			cis	-177.9	163.7	-15.7	53.8	0	0	0	0	109.3
865	M	29.1	Very low	27.5	Very low	173 Å²	173	138.5 Å²	138.5	85%	0.852	76%	0.756	S	S	*	*			trans	71.6	156.2	171.9	-48.3	-60.1	178.3	0	0	115.4
866	V	27	Very low	27.6	Very low	131 Å²	131	139.9 Å²	139.9	79%	0.794	76%	0.758	S	S	*	*			cis	-172.6	152.6	-13.3	129.4	0	0	0	0	105.9
867	S	25.5	Very low	27.8	Very low	104 Å²	104	137.3 Å²	137.3	73%	0.727	76%	0.755	S	S	*	*			cis	-164.4	-167.5	-20.1	-170.1	0	0	0	0	108.3
868	N	24.7	Very low	27.2	Very low	140 Å²	140	140 Å²	140	75%	0.749	75%	0.753	S	S	*	*			trans	-98.9	153.3	-176.1	-52.7	-73.2	0	0	0	115.1
869	Q	27.7	Very low	27.1	Very low	173 Å²	173	138.2 Å²	138.2	81%	0.808	74%	0.744	S	S	*	*			trans	176.3	125	143.5	-98.9	150.4	111.1	0	0	108.7
870	Q	26	Very low	27.1	Very low	161 Å²	161	139 Å²	139	75%	0.752	74%	0.744	S	S	*	*				92.2	145.3	76	-83.7	-173.9	-19.9	0	0	114.4
871	D	23.8	Very low	26.9	Very low	137 Å²	137	139 Å²	139	73%	0.733	74%	0.74	S	S	*	*			trans	59.1	132.4	170.8	-67.6	-28	0	0	0	119.6
872	T	25.5	Very low	27	Very low	115 Å²	115	139 Å²	139	71%	0.706	74%	0.736	S	S	*	*			cis	98.4	99.4	30.4	72.5	0	0	0	0	115.9
873	Q	25.9	Very low	27.2	Very low	191 Å²	191	142.3 Å²	142.3	89%	0.893	73%	0.733	S	S	*	*			trans	177.1	160.6	139.8	-97.1	168.8	43.4	0	0	107.8
874	R	23.8	Very low	27.5	Very low	197 Å²	197	144.9 Å²	144.9	74%	0.743	74%	0.735	S	S	*	*			cis	155.5	166.8	-17.2	-169.3	177.5	-167	-77.2	2	104.7
875	V	26.7	Very low	27.6	Very low	109 Å²	109	146.9 Å²	146.9	66%	0.661	74%	0.735	S	S	*	*			trans	77.4	120.2	175.8	-167.6	0	0	0	0	111.1
876	E	24.3	Very low	27.7	Very low	166 Å²	166	141.8 Å²	141.8	78%	0.776	73%	0.727	S	S	*	*				65.7	146.4	67.1	-52.5	160.1	105.2	0	0	112.6
877	G	28.1	Very low	27.9	Very low	65 Å²	65	143.6 Å²	143.6	67%	0.67	73%	0.726	S	S	*	*			cis	-128.4	-168.9	0.5	0	0	0	0	0	112.6
878	K	24.7	Very low	28.2	Very low	172 Å²	172	143.1 Å²	143.1	75%	0.748	72%	0.72	S	S	*	*			cis	62.5	138.9	43.3	-70.3	176.4	149	-90.6	0	113.5
879	E	27.8	Very low	28.9	Very low	145 Å²	145	145 Å²	145	68%	0.678	72%	0.721	S	S	*	*			cis	-168.7	162.5	-6.3	-112	161.5	173.1	0	0	108.4
880	D	30.8	Very low	29.3	Very low	130 Å²	130	142.7 Å²	142.7	70%	0.695	72%	0.719	S	S	*	*			cis	-128.5	-95.4	-12.5	-179	47.9	0	0	0	109.4	K882	D880-K882 PolarHBondContact OD2-N 3.35Å
881	E	31.8	Very low	29.7	Very low	149 Å²	149	143.7 Å²	143.7	70%	0.696	73%	0.726	S	S	*	*			cis	-124.2	130	-14.6	-152.7	-154.7	171.9	0	0	111.8
882	K	33.3	Very low	29.9	Very low	159 Å²	159	140.5 Å²	140.5	69%	0.691	73%	0.725	S	S	*	*			trans	70.8	96.6	160.2	-85.8	166.2	-175.9	141.6	0	119.1	D880	D880-K882 PolarHBondContact OD2-N 3.35Å
883	R	30.7	Very low	30.2	Very low	180 Å²	180	144 Å²	144	68%	0.679	73%	0.734	S	S	*	*				-42.4	161.8	128.3	-67	178	167.9	-141.7	7.2	112.3	E885	R883-E885 IonicContact CZ-OE2 3.98Å; R883-E885 IonicContact NE-OE2 2.71Å; R883-E885 IonicContact NH1-OE2 3.75Å; R883-E885 PolarHBondContact NH1-OE2 2.77Å
884	M	32.9	Very low	30.4	Very low	158 Å²	158	144.7 Å²	144.7	78%	0.778	73%	0.734	S	S	*	*				-173.2	158.8	59.5	-115.4	110.2	175.4	0	0	109.3
885	E	29.6	Very low	30.6	Very low	130 Å²	130	139.3 Å²	139.3	61%	0.607	74%	0.739	S	S	*	*			cis	-166.4	157.5	-15.2	-158.7	60.8	-83.1	0	0	109.2	R883	R883-E885 IonicContact CZ-OE2 3.98Å; R883-E885 IonicContact NE-OE2 2.71Å; R883-E885 IonicContact NH1-OE2 3.75Å; R883-E885 PolarHBondContact NH1-OE2 2.77Å
886	G	30.6	Very low	30.6	Very low	66 Å²	66	139.9 Å²	139.9	68%	0.68	75%	0.748	S	S	*	*			trans	89	143.1	159.5	0	0	0	0	0	118
887	E	31.6	Very low	31.8	Very low	168 Å²	168	137.2 Å²	137.2	79%	0.785	75%	0.745	S	S	*	*			cis	-155.4	152.1	-9	-128	-152.2	97.5	0	0	113
888	T	32.8	Very low	31.7	Very low	95 Å²	95	140.4 Å²	140.4	58%	0.583	75%	0.751	S	S	*	*			trans	27.4	143.8	151.6	51.8	0	0	0	0	123.2
889	K	37.8	Very low	31.7	Very low	178 Å²	178	138.2 Å²	138.2	77%	0.774	76%	0.756	S	S	*	*			cis	-171.3	139.3	-12.5	-119.8	172.5	-173.3	170.8	0	112.5
890	T	36.1	Very low	32	Very low	126 Å²	126	140 Å²	140	77%	0.773	77%	0.765	S	S	*	*			trans	31.6	148	137.2	60.2	0	0	0	0	122.9
891	M	35.4	Very low	32.4	Very low	181 Å²	181	139.2 Å²	139.2	89%	0.892	77%	0.767	S	S	*	*			cis	-166.7	155.6	13.2	-151.9	-172.7	176	0	0	114.3
892	G	28.4	Very low	32.1	Very low	70 Å²	70	136.2 Å²	136.2	72%	0.722	77%	0.767	S	S	*	*			trans	82.8	160	151.6	0	0	0	0	0	118.8
893	Q	31.8	Very low	31.9	Very low	189 Å²	189	135.9 Å²	135.9	88%	0.883	77%	0.771	S	S	*	*			cis	-154.9	-176.8	-14.6	-128.5	-167.6	55.1	0	0	111.8
894	K	30	Very low	32	Very low	206 Å²	206	132.4 Å²	132.4	90%	0.896	77%	0.77	S	S	*	*			trans	-67.2	160.1	-167.2	-59.4	173.7	175.3	177.8	0	116.9
895	G	27.4	Very low	32	Very low	83 Å²	83	133.9 Å²	133.9	86%	0.856	77%	0.772	S	S	*	*			trans	163.7	121.1	146.7	0	0	0	0	0	118.6
896	S	26.7	Very low	32.2	Very low	121 Å²	121	132.4 Å²	132.4	85%	0.846	78%	0.776	S	S	*	*			trans	-109.4	177.6	169.1	-112.5	0	0	0	0	110.3
897	P	48.7	Very low	32.4	Very low	110 Å²	110	136.5 Å²	136.5	71%	0.714	78%	0.783	S	S	*	*			cis	-137	177.4	-29.1	38.2	-20	0	0	0	114.6
898	V	27.3	Very low	32.5	Very low	132 Å²	132	138.3 Å²	138.3	80%	0.8	78%	0.784	S	S	*	*			trans	19.5	120	152	-176.9	0	0	0	0	121
899	C	24.1	Very low	33	Very low	126 Å²	126	140.1 Å²	140.1	85%	0.851	80%	0.795	S	S	*	*				-175.4	153.9	126.1	-95.1	0	0	0	0	112.9
900	E	34.1	Very low	33	Very low	184 Å²	184	138.9 Å²	138.9	86%	0.86	79%	0.791	S	S	*	*			trans	-91.1	154.4	154.1	-101.9	-170.9	-146.1	0	0	108.1
901	P	38.9	Very low	33.1	Very low	113 Å²	113	139.4 Å²	139.4	73%	0.734	79%	0.787	S	S	*	*				-156.9	168.3	60.4	43	-22.1	0	0	0	119.5
902	A	26.8	Very low	32.8	Very low	85 Å²	85	135.7 Å²	135.7	70%	0.702	78%	0.775	S	S	*	*			trans	44.9	162.9	136.6	0	0	0	0	0	126
903	I	29.3	Very low	33	Very low	153 Å²	153	142.3 Å²	142.3	79%	0.785	78%	0.784	S	S	*	*			trans	106.8	109.1	138.6	-92.4	166.8	0	0	0	122.3
904	T	30.7	Very low	32.9	Very low	106 Å²	106	136.9 Å²	136.9	65%	0.65	78%	0.779	S	S	*	*			trans	83	131.9	140.2	56.7	0	0	0	0	126.8
905	K	33.2	Very low	34.3	Very low	190 Å²	190	133 Å²	133	83%	0.826	78%	0.775	S	S	*	*			trans	73.4	145.5	133.6	-76.1	174.1	-178.1	-176.8	0	119.5
906	S	34	Very low	35.5	Very low	98 Å²	98	135.1 Å²	135.1	69%	0.685	77%	0.773	S	S	*	*			cis	-130.1	-146	0.8	-62	0	0	0	0	110.4
907	D	35.3	Very low	36.1	Very low	153 Å²	153	133.7 Å²	133.7	82%	0.818	77%	0.769	S	S	*	*			cis	-157.3	-165.6	-1.8	-136.6	-58.5	0	0	0	112.8
908	Y	32.8	Very low	36	Very low	206 Å²	206	133.7 Å²	133.7	81%	0.808	77%	0.769	S	S	*	*			trans	-118.2	149.4	-167	-148.6	-102.1	0	0	0	114.5
909	T	44.5	Very low	36.4	Very low	132 Å²	132	134.6 Å²	134.6	81%	0.81	77%	0.768	S	S	*	*			trans	176.3	113.5	145	-73	0	0	0	0	113.5
910	E	38.3	Very low	36.7	Very low	152 Å²	152	133.6 Å²	133.6	71%	0.71	76%	0.763	S	S	*	*			trans	24.3	157.1	141.3	-122.6	178	174.6	0	0	127.9
911	M	37.3	Very low	36.6	Very low	138 Å²	138	129.9 Å²	129.9	68%	0.68	75%	0.752	S	S	*	*			trans	86.1	90.6	153.9	-64.1	-56.7	-174.6	0	0	124.9
912	T	30	Very low	36.2	Very low	103 Å²	103	131.7 Å²	131.7	63%	0.632	76%	0.755	S	S	*	*				61.3	123.8	101.9	-53.9	0	0	0	0	124.8
913	F	32.5	Very low	36.4	Very low	208 Å²	208	132.1 Å²	132.1	91%	0.912	75%	0.752	S	S	*	*			trans	50.7	139	155	-60.9	-42.5	0	0	0	124.6
914	G	30.1	Very low	36.4	Very low	75 Å²	75	130.6 Å²	130.6	77%	0.773	75%	0.75	S	S	*	*			trans	130.5	132.4	140.3	0	0	0	0	0	120
915	P	57.6	Low	36.4	Very low	125 Å²	125	131.3 Å²	131.3	81%	0.812	75%	0.754	S	S	*	*			trans	-114.4	-168.5	165.9	44.2	-34.5	0	0	0	111.9
916	P	53.3	Low	36.2	Very low	127 Å²	127	129.3 Å²	129.3	83%	0.825	75%	0.753	S	S	*	*			cis	-126.9	-153	-11.7	39.5	-19.3	0	0	0	113.5
917	A	38.6	Very low	36.3	Very low	92 Å²	92	129 Å²	129	76%	0.76	76%	0.756	S	S	*	*			trans	-87.9	171.3	-173.2	0	0	0	0	0	116.6
918	P	48	Very low	36.6	Very low	110 Å²	110	128 Å²	128	71%	0.714	76%	0.755	S	S	*	*			trans	-146.9	140.1	142.4	36	-18.8	0	0	0	118.3
919	L	34.2	Very low	37.3	Very low	150 Å²	150	123.2 Å²	123.2	79%	0.785	75%	0.75	S	S	*	*			trans	62.4	162.6	136.4	-54.6	177.9	0	0	0	119.4	V921	L919-V921 HydrophobicContact CD2-CG2 3.98Å
920	S	30.8	Very low	36.9	Very low	106 Å²	106	123.3 Å²	123.3	74%	0.741	75%	0.75	S	S	*	*			cis	-146.1	148.8	28.5	-64.5	0	0	0	0	112.2
921	V	32.1	Very low	37.3	Very low	105 Å²	105	121.3 Å²	121.3	64%	0.636	75%	0.75	S	S	*	*			cis	70.4	120.6	48.1	171.3	0	0	0	0	110.6	L919	L919-V921 HydrophobicContact CD2-CG2 3.98Å
922	L	30.8	Very low	37	Very low	152 Å²	152	120.5 Å²	120.5	80%	0.796	75%	0.753	S	S	*	*			cis	-151.7	-166.7	2.5	-145	53.2	0	0	0	107.6
923	C	31.1	Very low	37.2	Very low	94 Å²	94	121 Å²	121	64%	0.635	76%	0.761	S	S	*	*			cis	-161.4	-160.7	7.5	-158.2	0	0	0	0	110.4
924	T	30.1	Very low	37.7	Very low	121 Å²	121	117.1 Å²	117.1	74%	0.742	76%	0.756	S	S	*	*			trans	72.4	151.7	166.8	69.6	0	0	0	0	116.7
925	T	29.1	Very low	38.1	Very low	121 Å²	121	120.1 Å²	120.1	74%	0.742	76%	0.76	S	S	*	*			cis	-171.8	152.1	-14.1	25.9	0	0	0	0	106.5
926	D	30.5	Very low	37	Very low	148 Å²	148	118.7 Å²	118.7	79%	0.791	76%	0.759	S	S	*	*			cis	-165.8	-159.6	-16.4	-146	-88.7	0	0	0	109.8
927	A	34.3	Very low	35.8	Very low	92 Å²	92	118 Å²	118	76%	0.76	76%	0.756	S	S	*	*			trans	74.9	139.5	175.5	0	0	0	0	0	117.4
928	T	42.1	Very low	35.6	Very low	130 Å²	130	119.4 Å²	119.4	80%	0.798	75%	0.754	S	S	*	*			trans	-120.5	-178.8	-165.1	56.8	0	0	0	0	111.3
929	P	47.6	Very low	34.8	Very low	106 Å²	106	123.2 Å²	123.2	69%	0.688	76%	0.76	S	S	*	*			cis	-135.6	155.2	-8.4	21.8	3.2	0	0	0	117.1
930	V	37.1	Very low	34.6	Very low	135 Å²	135	126.7 Å²	126.7	82%	0.818	76%	0.762	S	S	*	*				57.4	141	129	175.8	0	0	0	0	121.4
931	P	46.3	Very low	34.6	Very low	110 Å²	110	128.7 Å²	128.7	71%	0.714	76%	0.764	S	S	*	*			cis	-142.9	179.1	-24.5	41.3	-20.8	0	0	0	117.7
932	T	30.8	Very low	34.5	Very low	121 Å²	121	128.3 Å²	128.3	74%	0.742	77%	0.766	S	S	*	*			trans	-15.9	154.9	162.7	57.2	0	0	0	0	124.5
933	S	34.1	Very low	34.7	Very low	114 Å²	114	128.4 Å²	128.4	80%	0.797	77%	0.767	S	S	*	*			trans	84	144.5	152.4	-57.5	0	0	0	0	116.4
934	P	43.9	Very low	34.6	Very low	125 Å²	125	131.7 Å²	131.7	81%	0.812	77%	0.773	S	S	*	*				-147.1	178.2	67.8	42.5	-24.2	0	0	0	117.8
935	T	38.3	Very low	34.7	Very low	138 Å²	138	131 Å²	131	85%	0.847	77%	0.773	S	S	*	*			trans	-126.1	146.8	164.5	-55.8	0	0	0	0	109.6
936	A	33.1	Very low	34.6	Very low	95 Å²	95	130 Å²	130	79%	0.785	77%	0.77	S	S	*	*			trans	79.5	156.5	163.1	0	0	0	0	0	121.8
937	C	28.5	Very low	34.8	Very low	113 Å²	113	129.9 Å²	129.9	76%	0.764	77%	0.769	S	S	*	*			trans	95.6	100.9	136.5	-168.6	0	0	0	0	122.8
938	V	33.6	Very low	34.6	Very low	121 Å²	121	131 Å²	131	73%	0.733	77%	0.767	S	S	*	*			trans	70.7	122.5	130.9	-179.1	0	0	0	0	123.9
939	K	33.1	Very low	34	Very low	191 Å²	191	131.8 Å²	131.8	83%	0.83	77%	0.766	S	S	*	*			trans	22.4	125.4	145.9	-55.3	172.4	-178.8	175.1	0	122.3
940	R	29.6	Very low	33.2	Very low	222 Å²	222	132.7 Å²	132.7	84%	0.838	77%	0.769	S	S	*	*				171.2	139.8	115.6	-97	-175.4	161.1	171.7	-6	111.6
941	L	31.1	Very low	32.9	Very low	148 Å²	148	132.3 Å²	132.3	78%	0.775	77%	0.767	S	S	*	*				55.1	137.3	97.5	-59.2	179.8	0	0	0	115.3
942	S	29.4	Very low	32.8	Very low	98 Å²	98	132.5 Å²	132.5	69%	0.685	77%	0.768	S	S	*	*			cis	-168	177.3	-5.8	-161.2	0	0	0	0	111.9
943	L	35.3	Very low	33.5	Very low	153 Å²	153	132 Å²	132	80%	0.801	77%	0.767	S	S	*	*			trans	72.3	160	161.9	-72.3	155.4	0	0	0	117.5
944	E	28.4	Very low	33.6	Very low	164 Å²	164	132.4 Å²	132.4	77%	0.766	76%	0.764	S	S	*	*			cis	-150.3	142.1	21.5	-165.8	168	157.6	0	0	117.2
945	S	32.5	Very low	33.4	Very low	106 Å²	106	131.7 Å²	131.7	74%	0.741	76%	0.759	S	S	*	*			trans	57.3	159.5	161.6	76.8	0	0	0	0	119.7
946	S	27.4	Very low	33	Very low	99 Å²	99	131.1 Å²	131.1	69%	0.692	76%	0.755	S	S	*	*			cis	-142.7	130.2	6.8	177.8	0	0	0	0	108.3
947	L	33.8	Very low	32.7	Very low	147 Å²	147	133.3 Å²	133.3	77%	0.77	75%	0.754	S	S	*	*				56.9	128.2	82.4	-85.9	166.5	0	0	0	113.3
948	V	31.3	Very low	32.7	Very low	116 Å²	116	132 Å²	132	70%	0.703	75%	0.746	S	S	*	*			cis	-150.3	152.3	18.4	-145.4	0	0	0	0	114.4
949	D	29.7	Very low	32.4	Very low	146 Å²	146	135 Å²	135	78%	0.781	75%	0.75	S	S	*	*			trans	73.4	157.5	135	-113.6	-36.7	0	0	0	128.7
950	V	30.2	Very low	32.2	Very low	124 Å²	124	132.6 Å²	132.6	75%	0.752	75%	0.745	S	S	*	*			trans	80.3	141.8	154.6	171.4	0	0	0	0	121.7
951	V	29.5	Very low	32.2	Very low	127 Å²	127	129.3 Å²	129.3	77%	0.77	74%	0.743	S	S	*	*			trans	-146.3	156.8	-172	161.3	0	0	0	0	106
952	P	46	Very low	32	Very low	115 Å²	115	125.4 Å²	125.4	75%	0.747	74%	0.739	S	S	*	*			cis	-122.3	-133.2	8.6	30	-3	0	0	0	109.6
953	P	45.3	Very low	31.9	Very low	110 Å²	110	125.5 Å²	125.5	71%	0.714	75%	0.746	S	S	*	*			cis	-136.1	-167.3	-16.9	43.1	-23.6	0	0	0	116.1
954	V	34.8	Very low	32.3	Very low	122 Å²	122	123.6 Å²	123.6	74%	0.739	74%	0.742	S	S	*	*			trans	-86.3	141.5	166.8	174.9	0	0	0	0	110.8	V956	V954-V956 HydrophobicContact CG1-CG2 4.34Å
955	P	40	Very low	32.4	Very low	110 Å²	110	120.5 Å²	120.5	71%	0.714	74%	0.739	S	S	*	*				-120.2	151.9	125.6	-3	24.3	0	0	0	110.7
956	V	29.5	Very low	32.4	Very low	126 Å²	126	122.6 Å²	122.6	76%	0.764	74%	0.741	S	S	*	*			cis	75.4	130.5	36.8	-177.3	0	0	0	0	113.3	V954	V954-V956 HydrophobicContact CG1-CG2 4.34Å
957	D	28.3	Very low	32.5	Very low	142 Å²	142	123.7 Å²	123.7	76%	0.759	75%	0.749	S	S	*	*			trans	-61.2	161.5	-176.8	-50.2	-98	0	0	0	114.2
958	S	28	Very low	32.4	Very low	85 Å²	85	123.8 Å²	123.8	59%	0.594	75%	0.749	S	S	*	*				157.5	161	108	-66.5	0	0	0	0	113.4
959	F	26.3	Very low	32.4	Very low	185 Å²	185	124.1 Å²	124.1	81%	0.811	75%	0.752	S	S	*	*			trans	69.7	156.8	152.7	-58	-39.7	0	0	0	117.9
960	L	29.8	Very low	32.4	Very low	139 Å²	139	123 Å²	123	73%	0.728	75%	0.75	S	S	*	*			cis	-159.2	166.8	-10.9	-115.5	169.7	0	0	0	109.4
961	L	29.4	Very low	32.5	Very low	153 Å²	153	122.9 Å²	122.9	80%	0.801	75%	0.749	S	S	*	*			trans	59.9	172.4	169.3	-90.2	56.1	0	0	0	115.2
962	G	26.8	Very low	32.6	Very low	67 Å²	67	123.7 Å²	123.7	69%	0.691	75%	0.749	S	S	*	*			cis	-169.6	154	-9	0	0	0	0	0	111.2
963	A	26.8	Very low	33.2	Very low	100 Å²	100	122.4 Å²	122.4	83%	0.826	74%	0.741	S	S	*	*			trans	-86.7	177.6	167.4	0	0	0	0	0	109.7
964	P	45.3	Very low	32.6	Very low	112 Å²	112	122.4 Å²	122.4	73%	0.727	74%	0.735	S	S	*	*			cis	-127.9	-174.9	11.7	36.7	-13.3	0	0	0	113.1
965	S	30.3	Very low	32.5	Very low	99 Å²	99	127.2 Å²	127.2	69%	0.692	74%	0.74	S	S	*	*				-169.8	123.6	64.8	-68	0	0	0	0	111
966	L	32	Very low	32.2	Very low	151 Å²	151	125.9 Å²	125.9	79%	0.791	75%	0.746	S	S	*	*				72.8	104.9	96.8	-68.7	176.3	0	0	0	117.6
967	S	30.3	Very low	32.8	Very low	121 Å²	121	124.4 Å²	124.4	85%	0.846	75%	0.747	S	S	*	*				-152.2	141.9	129.8	53.1	0	0	0	0	110.4
968	L	31.1	Very low	33.3	Very low	149 Å²	149	127 Å²	127	78%	0.78	75%	0.751	S	S	*	*			trans	-91.4	172.4	170.6	-66.6	73.9	0	0	0	108.1
969	T	31	Very low	33.8	Very low	124 Å²	124	129.3 Å²	129.3	76%	0.761	76%	0.762	S	S	*	*			cis	-150.5	175.4	27.7	49.2	0	0	0	0	108
970	V	30.3	Very low	34.3	Very low	121 Å²	121	127.1 Å²	127.1	73%	0.733	76%	0.757	S	S	*	*			cis	-149.3	147.2	27	171.9	0	0	0	0	110.2
971	V	30.9	Very low	34.5	Very low	122 Å²	122	131.4 Å²	131.4	74%	0.739	76%	0.763	S	S	*	*			trans	2.1	123.6	153	-174.3	0	0	0	0	116.7
972	D	33.3	Very low	34.8	Very low	144 Å²	144	128.3 Å²	128.3	77%	0.77	76%	0.76	S	S	*	*			cis	74.1	173.9	49.2	-146.3	36.7	0	0	0	113.1
973	P	56.9	Low	35.2	Very low	88 Å²	88	132.4 Å²	132.4	57%	0.571	77%	0.766	S	S	*	*				-106.5	-163.7	-102.8	41.4	-27.1	0	0	0	112.7
974	D	32.9	Very low	36.5	Very low	111 Å²	111	131.6 Å²	131.6	59%	0.594	75%	0.752	S	S	*	*				-175.2	161.1	73.2	-145.6	-9.4	0	0	0	114.2
975	R	33.7	Very low	36.1	Very low	223 Å²	223	135.1 Å²	135.1	84%	0.842	76%	0.759	S	S	*	*			trans	22.5	135.9	159.5	-68	146.4	-146	-114	0.8	122
976	G	34.1	Very low	36.1	Very low	82 Å²	82	134 Å²	134	85%	0.845	76%	0.764	S	S	*	*			trans	-160.7	35.2	169.3	0	0	0	0	0	118.9
977	A	40.2	Very low	36.4	Very low	94 Å²	94	137.9 Å²	137.9	78%	0.777	77%	0.768	S	S	*	*			trans	-87.8	118.8	-178.2	0	0	0	0	0	114.7
978	K	39.4	Very low	36.8	Very low	196 Å²	196	142.2 Å²	142.2	85%	0.852	77%	0.765	S	S	*	*			trans	-179.8	131.9	148	-92.9	142.4	-169.1	177.5	0	108
979	V	38.8	Very low	37.7	Very low	135 Å²	135	145.4 Å²	145.4	82%	0.818	77%	0.767	S	S	*	*				69.4	137	58	-166.7	0	0	0	0	113.4
980	I	36.6	Very low	38.1	Very low	139 Å²	139	146.5 Å²	146.5	71%	0.713	76%	0.763	S	S	*	*			trans	110.7	95.9	164.9	-54.9	-172	0	0	0	118.2
981	R	34.4	Very low	38.2	Very low	228 Å²	228	145.8 Å²	145.8	86%	0.86	76%	0.763	S	S	*	*				55.3	134.1	129	-63.3	-178.5	170.7	151.4	-4.1	124.8
982	A	34.8	Very low	38.3	Very low	88 Å²	88	144.7 Å²	144.7	73%	0.727	76%	0.761	S	S	*	*				70.6	119.1	128.1	0	0	0	0	0	122.6
983	D	36.9	Very low	38.3	Very low	153 Å²	153	147 Å²	147	82%	0.818	77%	0.768	S	S	*	*				50.3	154.9	103	-145.8	43	0	0	0	120.1
984	P	52.8	Low	37.4	Very low	83 Å²	83	149 Å²	149	54%	0.539	78%	0.778	S	S	.	*			cis	-127.1	-161.6	-13.8	21.7	3.9	0	0	0	113.4
985	Q	36.4	Very low	37.4	Very low	187 Å²	187	152.7 Å²	152.7	87%	0.874	79%	0.789	S	S	*	*			trans	70.3	105.8	148.8	-79.6	168.6	-11.3	0	0	121.1
986	G	32	Very low	37.2	Very low	76 Å²	76	147.1 Å²	147.1	78%	0.784	78%	0.784	S	S	*	*				112.1	104.1	84.8	0	0	0	0	0	120.6
987	R	37.8	Very low	37.1	Very low	232 Å²	232	148.5 Å²	148.5	88%	0.875	78%	0.781	S	S	*	*			trans	-160.7	124.5	144.8	-112.1	177.4	-177.2	-153	2.1	108.2
988	R	37.9	Very low	36.7	Very low	211 Å²	211	151 Å²	151	80%	0.796	79%	0.787	S	S	*	*				42.1	121.9	79.7	-85.9	-173.2	165.1	-175.5	-1.3	111.8
989	R	49.4	Very low	36.4	Very low	217 Å²	217	147.7 Å²	147.7	82%	0.819	78%	0.784	S	S	*	*			cis	-136.8	150.7	39.2	-61.3	172	-177.9	-160.1	-3.5	110.2
990	H	40.7	Very low	36.1	Very low	147 Å²	147	147.6 Å²	147.6	68%	0.681	78%	0.783	S	S	*	*				43.3	132.5	82	-39.4	-68.3	0	0	0	113.4
991	S	33	Very low	35.8	Very low	105 Å²	105	147.6 Å²	147.6	73%	0.734	79%	0.79	S	S	*	*			cis	-155.8	156.1	22.1	49.7	0	0	0	0	114.8
992	S	31.7	Very low	35.6	Very low	100 Å²	100	142.5 Å²	142.5	70%	0.699	78%	0.784	S	S	*	*			trans	33.7	127.2	146.4	60.1	0	0	0	0	122
993	E	34.7	Very low	35.6	Very low	193 Å²	193	144.5 Å²	144.5	90%	0.902	79%	0.789	S	S	*	*				-160.2	174.8	107.7	-114.2	-178.5	117.2	0	0	113.7
994	T	37.4	Very low	35.3	Very low	130 Å²	130	142.8 Å²	142.8	80%	0.798	78%	0.784	S	S	*	*			trans	-96.4	154.7	-150	-41.2	0	0	0	0	114.8
995	F	33.1	Very low	34.2	Very low	188 Å²	188	144.7 Å²	144.7	83%	0.825	80%	0.798	S	S	*	*			trans	-66	156.7	164.2	-65.8	-91.4	0	0	0	110.7
996	S	29.5	Very low	34.2	Very low	105 Å²	105	140.4 Å²	140.4	73%	0.734	79%	0.787	S	S	*	*				-168.2	147.8	53.5	-56.8	0	0	0	0	115.1
997	S	31.1	Very low	33.8	Very low	112 Å²	112	142.7 Å²	142.7	78%	0.783	79%	0.791	S	S	*	*			trans	7.9	142.6	141.3	-46	0	0	0	0	122
998	T	31.4	Very low	33.5	Very low	146 Å²	146	140.3 Å²	140.3	90%	0.896	79%	0.787	S	S	*	*			trans	-147.6	154.2	156.3	-77.1	0	0	0	0	111.1
999	T	33.3	Very low	33.1	Very low	127 Å²	127	134.6 Å²	134.6	78%	0.779	79%	0.785	S	S	*	*			trans	-98.2	153.3	-161.2	-59.6	0	0	0	0	114.7
1000	T	33	Very low	32.1	Very low	133 Å²	133	133.1 Å²	133.1	82%	0.816	79%	0.787	S	S	*	*			trans	-70.8	140.3	176.9	52.5	0	0	0	0	115.1
1001	V	30.3	Very low	31.5	Very low	139 Å²	139	133.4 Å²	133.4	84%	0.842	79%	0.793	S	S	*	*			trans	-138.1	146.2	162.7	-178.5	0	0	0	0	110.1
1002	T	30.5	Very low	31.4	Very low	120 Å²	120	134.6 Å²	134.6	74%	0.736	80%	0.796	S	S	*	*			trans	-99.6	140.9	-178.5	50.5	0	0	0	0	113.1
1003	P	35.5	Very low	31.4	Very low	130 Å²	130	138.4 Å²	138.4	84%	0.844	80%	0.8	S	S	*	*			trans	-80.1	152.1	173.9	33.3	-34.9	0	0	0	113.1
1004	V	29.1	Very low	31.5	Very low	118 Å²	118	138.5 Å²	138.5	72%	0.715	79%	0.793	S	S	*	*			trans	-135.4	139.2	171.3	175.8	0	0	0	0	108.7
1005	C	30.4	Very low	31.4	Very low	122 Å²	122	140.3 Å²	140.3	82%	0.824	79%	0.792	S	S	*	*			trans	-70.7	138	-174.6	-48.7	0	0	0	0	113.1
1006	P	35.9	Very low	31.2	Very low	98 Å²	98	136.8 Å²	136.8	64%	0.636	79%	0.79	S	S	*	*			trans	-90.9	137.7	163.8	34	-30	0	0	0	111.6	F1008	P1006-F1008 HydrophobicContact CB-CD2 4.16Å; P1006-F1008 HydrophobicContact CB-CE2 4.28Å
1007	S	24.6	Very low	31.2	Very low	124 Å²	124	137.7 Å²	137.7	87%	0.867	80%	0.796	S	S	*	*			trans	-128.4	122	156.5	-177.2	0	0	0	0	106.5
1008	F	31.1	Very low	31.1	Very low	181 Å²	181	137 Å²	137	79%	0.794	80%	0.798	S	S	*	*			trans	-122.9	130.5	-176.7	-90.4	-73.4	0	0	0	110.9	P1006	P1006-F1008 HydrophobicContact CB-CD2 4.16Å; P1006-F1008 HydrophobicContact CB-CE2 4.28Å
1009	A	29.2	Very low	31	Very low	91 Å²	91	135.5 Å²	135.5	75%	0.752	79%	0.793	S	S	*	*			trans	-136	126.3	157.2	0	0	0	0	0	107.4
1010	H	29.6	Very low	30.8	Very low	186 Å²	186	135.8 Å²	135.8	86%	0.861	79%	0.794	S	S	*	*			trans	-141.3	155.9	168.6	-92.2	-41.4	0	0	0	110.3
1011	D	28	Very low	30.5	Very low	154 Å²	154	137.1 Å²	137.1	82%	0.824	79%	0.791	S	S	*	*			trans	-139.9	149.7	-155.7	170.3	33.9	0	0	0	109.8
1012	T	30.7	Very low	30.7	Very low	130 Å²	130	138 Å²	138	80%	0.798	79%	0.791	S	S	*	*			trans	-135.6	106.9	-171.7	53.6	0	0	0	0	114
1013	K	31.5	Very low	30.6	Very low	180 Å²	180	139.3 Å²	139.3	78%	0.783	80%	0.799	S	S	*	*			trans	-34.5	155.2	156.5	-68.3	174.1	180	167.8	0	113.9
1014	R	36.4	Very low	30.5	Very low	195 Å²	195	137.6 Å²	137.6	74%	0.736	79%	0.79	S	S	*	*			cis	-165.2	169.6	0.9	-115.6	173	-179.7	-160.6	-4	107.9
1015	H	34.9	Very low	30.4	Very low	168 Å²	168	143.6 Å²	143.6	78%	0.778	80%	0.8	S	S	*	*				177.3	165.1	85.4	-101.2	-88.1	0	0	0	113.6
1016	S	30	Very low	30.4	Very low	113 Å²	113	142.6 Å²	142.6	79%	0.79	79%	0.794	S	S	*	*			trans	79.4	160.1	162.7	-58.7	0	0	0	0	118.8
1017	S	29.4	Very low	30.1	Very low	124 Å²	124	143.8 Å²	143.8	87%	0.867	80%	0.799	S	S	*	*			trans	-151.9	133.9	-149.1	-41.5	0	0	0	0	115.4
1018	A	27.5	Very low	30.2	Very low	99 Å²	99	147.2 Å²	147.2	82%	0.818	80%	0.801	S	S	*	*			trans	-178.7	135.4	147.6	0	0	0	0	0	107
1019	S	29.4	Very low	30.1	Very low	113 Å²	113	143.9 Å²	143.9	79%	0.79	80%	0.8	S	S	*	*			cis	91.4	92.7	30.5	-176.1	0	0	0	0	114.7
1020	V	29.3	Very low	30.2	Very low	134 Å²	134	144.1 Å²	144.1	81%	0.812	80%	0.796	S	S	*	*			trans	-166	160.1	142.8	-98.5	0	0	0	0	111.7
1021	E	26.7	Very low	30.1	Very low	161 Å²	161	143.9 Å²	143.9	75%	0.752	80%	0.796	S	S	*	*			trans	46.5	124.4	160.3	-95.4	45.5	-125.7	0	0	124
1022	N	34.7	Very low	30.1	Very low	157 Å²	157	144.7 Å²	144.7	84%	0.84	80%	0.795	S	S	*	*			trans	-100.2	136	141.6	-83.1	-45.2	0	0	0	108.4
1023	V	29.6	Very low	30.7	Very low	148 Å²	148	143.9 Å²	143.9	90%	0.897	79%	0.791	S	S	*	*			trans	-173.8	156	140.5	134.6	0	0	0	0	110.3
1024	S	31.5	Very low	30.5	Very low	93 Å²	93	138.6 Å²	138.6	65%	0.65	79%	0.788	S	S	*	*			trans	-102.9	146.9	-179.2	56.1	0	0	0	0	112.8
1025	R	26.9	Very low	30.1	Very low	245 Å²	245	138.2 Å²	138.2	93%	0.925	80%	0.795	S	S	*	*				176.7	178.4	117.9	-99.2	175.1	175	167.9	0	113.7
1026	S	31.6	Very low	29.8	Very low	100 Å²	100	136.4 Å²	136.4	70%	0.699	79%	0.791	S	S	*	*			trans	-106.1	175.2	-174.3	53	0	0	0	0	113.1
1027	V	29.6	Very low	29.8	Very low	124 Å²	124	138.5 Å²	138.5	75%	0.752	79%	0.788	S	S	*	*			trans	88.6	128.6	166.3	-177.7	0	0	0	0	115.9
1028	H	25.7	Very low	29.7	Very low	196 Å²	196	138.2 Å²	138.2	91%	0.907	79%	0.786	S	S	*	*			trans	-94.8	129.5	155.3	-97.3	-75.4	0	0	0	109.1
1029	S	29.2	Very low	29.8	Very low	110 Å²	110	138.9 Å²	138.9	77%	0.769	79%	0.785	S	S	*	*			trans	-141.2	148.2	154.4	53.5	0	0	0	0	107.5
1030	S	32.4	Very low	31.1	Very low	97 Å²	97	139 Å²	139	68%	0.678	78%	0.783	S	S	*	*			trans	-82.2	145	-172	46.9	0	0	0	0	113.6
1031	E	28.2	Very low	30.9	Very low	180 Å²	180	140.9 Å²	140.9	84%	0.841	78%	0.784	S	S	*	*			trans	45.6	134.6	135.8	-62.6	161.6	142.4	0	0	118.9
1032	E	26.8	Very low	31.6	Very low	172 Å²	172	138.9 Å²	138.9	80%	0.804	79%	0.787	S	S	*	*			cis	-168.8	-161.7	-0.8	-134.8	-155.7	152.9	0	0	106.9
1033	P	44.4	Very low	31.6	Very low	112 Å²	112	142.4 Å²	142.4	73%	0.727	79%	0.789	S	S	*	*				-113.4	-176.9	-68	32	-14.2	0	0	0	112.8
1034	G	26.1	Very low	31.8	Very low	70 Å²	70	143.1 Å²	143.1	72%	0.722	78%	0.782	S	S	*	*			trans	144.2	112.7	154.5	0	0	0	0	0	119.5
1035	E	28.3	Very low	31.9	Very low	186 Å²	186	145.6 Å²	145.6	87%	0.869	79%	0.794	S	S	*	*			trans	55.9	103.6	138.4	-61.7	179.8	170.4	0	0	122.5
1036	D	28.5	Very low	32.3	Very low	131 Å²	131	140 Å²	140	70%	0.701	79%	0.792	S	S	*	*				88.9	121.5	117.4	-79.8	-25.6	0	0	0	127.1
1037	H	29.2	Very low	32.3	Very low	157 Å²	157	140.5 Å²	140.5	73%	0.727	80%	0.802	S	S	*	*				97.3	114.5	126.7	-79.6	31	0	0	0	123.7
1038	S	27.3	Very low	32.5	Very low	117 Å²	117	137.7 Å²	137.7	82%	0.818	80%	0.798	S	S	*	*			trans	81.4	124.5	135.3	67.9	0	0	0	0	123.2
1039	S	31.1	Very low	32.8	Very low	114 Å²	114	139.6 Å²	139.6	80%	0.797	80%	0.799	S	S	*	*			trans	-88.9	172.6	160.5	-30.1	0	0	0	0	110.3
1040	P	55.9	Low	33	Very low	115 Å²	115	143.9 Å²	143.9	75%	0.747	81%	0.807	S	S	*	*				-161	170	68.7	42.6	-20.4	0	0	0	120.5
1041	M	25.8	Very low	33.3	Very low	173 Å²	173	147.5 Å²	147.5	85%	0.852	82%	0.819	S	S	*	*			trans	58.3	112.7	141.6	-74.2	175.3	58.4	0	0	125.5
1042	C	40.2	Very low	33.6	Very low	120 Å²	120	142 Å²	142	81%	0.811	81%	0.81	S	S	*	*			trans	15.4	136.3	132.7	-49.1	0	0	0	0	124.1
1043	R	34.8	Very low	34.3	Very low	230 Å²	230	141 Å²	141	87%	0.868	81%	0.809	S	S	*	*				-168.3	118.2	125.2	-109.5	178	-168.5	-136	2.6	116.4
1044	E	33.4	Very low	33.7	Very low	164 Å²	164	143.4 Å²	143.4	77%	0.766	82%	0.816	S	S	*	*				27.9	126.3	126.1	-167.9	170.1	-131.9	0	0	122.8
1045	T	34.6	Very low	34.1	Very low	145 Å²	145	150.3 Å²	150.3	89%	0.89	82%	0.822	S	S	*	*				173	172	129.6	29.5	0	0	0	0	112.7
1046	S	35.4	Very low	34.7	Very low	126 Å²	126	148.8 Å²	148.8	88%	0.881	82%	0.818	S	S	*	*			trans	-143.9	132.6	-171.3	4.9	0	0	0	0	116
1047	A	32.4	Very low	35.1	Very low	111 Å²	111	146.6 Å²	146.6	92%	0.917	82%	0.818	S	S	*	*			trans	-175	160.5	158.8	0	0	0	0	0	108.2
1048	G	32.4	Very low	35.8	Very low	65 Å²	65	146.7 Å²	146.7	67%	0.67	82%	0.823	S	S	*	*			cis	164	136.3	-6.9	0	0	0	0	0	110.2
1049	Y	33.5	Very low	36.2	Very low	236 Å²	236	148.3 Å²	148.3	93%	0.925	82%	0.823	S	S	*	*			trans	48.8	114.7	174.5	-73.8	-87.5	0	0	0	119.7
1050	Q	33.3	Very low	36.6	Very low	201 Å²	201	151 Å²	151	94%	0.939	83%	0.827	S	S	*	*			trans	-140.9	146	138.8	-79.7	-158.1	-11.6	0	0	111
1051	N	37.1	Very low	35.5	Very low	173 Å²	173	154.7 Å²	154.7	93%	0.925	84%	0.837	S	S	*	*			trans	-153.1	131.5	176.4	-157.6	9.9	0	0	0	107.9
1052	G	34.9	Very low	35.8	Very low	63 Å²	63	156.1 Å²	156.1	65%	0.649	84%	0.841	S	S	*	*			trans	109.4	91.1	173.4	0	0	0	0	0	117.1
1053	L	41.9	Very low	35.3	Very low	151 Å²	151	153.6 Å²	153.6	79%	0.791	84%	0.836	S	S	*	*			trans	48.3	121.1	139.8	-54.4	175.5	0	0	0	120.4
1054	N	31.6	Very low	35.1	Very low	163 Å²	163	150.4 Å²	150.4	87%	0.872	84%	0.836	S	S	*	*				-153.9	145	124.8	-107.2	-44.6	0	0	0	111.5
1055	Y	34.2	Very low	34.9	Very low	216 Å²	216	151.2 Å²	151.2	85%	0.847	85%	0.845	S	S	*	*			trans	-90.6	135.8	170.8	-72.9	-99.6	0	0	0	108.9
1056	I	41.4	Very low	34.5	Very low	153 Å²	153	147.9 Å²	147.9	79%	0.785	84%	0.84	S	S	*	*			trans	-106.8	116.7	171.3	-61.5	178.4	0	0	0	108.1
1057	A	37.2	Very low	34.1	Very low	85 Å²	85	146 Å²	146	70%	0.702	84%	0.84	S	S	*	*			trans	-80	136.9	167.8	0	0	0	0	0	109.7
1058	L	42.8	Very low	34	Very low	160 Å²	160	143.9 Å²	143.9	84%	0.838	83%	0.829	S	S	*	*			trans	-93.8	100.5	171.9	-66.2	177.1	0	0	0	109.1
1059	N	36.5	Very low	33.7	Very low	151 Å²	151	152.7 Å²	152.7	81%	0.807	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-75.2	128.9	166.8	-72	-13	0	0	0	109.2
1060	L	40	Very low	33.4	Very low	170 Å²	170	149.9 Å²	149.9	89%	0.89	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-73.5	153.2	156.5	-84.7	81.2	0	0	0	109.3
1061	M	33	Very low	33.2	Very low	193 Å²	193	143.5 Å²	143.5	95%	0.951	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-86	132.2	178.2	-69.3	167.3	51.8	0	0	111.5
1062	E	31.2	Very low	32.7	Very low	202 Å²	202	140.8 Å²	140.8	94%	0.944	82%	0.824	S	S	*	*			trans	-134.3	149.6	147.7	-165.9	157.1	-143.3	0	0	108.1
1063	G	31	Very low	32.3	Very low	68 Å²	68	144 Å²	144	70%	0.701	84%	0.836	S	S	*	*			trans	-100.9	143.2	-148.8	0	0	0	0	0	117.7
1064	N	28.6	Very low	31.6	Very low	162 Å²	162	142.7 Å²	142.7	87%	0.866	83%	0.829	S	S	*	*			trans	44.5	115.4	149	-76.2	-18.9	0	0	0	120.7
1065	L	29.7	Very low	31.6	Very low	181 Å²	181	142 Å²	142	95%	0.948	82%	0.819	S	S	*	*				-162.8	114.5	128.7	-110.8	163.4	0	0	0	111.8
1066	G	27.6	Very low	31.4	Very low	76 Å²	76	140.4 Å²	140.4	78%	0.784	82%	0.817	S	S	*	*			trans	74.4	132.1	178.9	0	0	0	0	0	114.5
1067	G	26.9	Very low	30.9	Very low	87 Å²	87	140.3 Å²	140.3	90%	0.897	82%	0.817	S	S	*	*			cis	82.6	115.9	11.3	0	0	0	0	0	111.6
1068	G	28.8	Very low	30.3	Very low	65 Å²	65	145.6 Å²	145.6	67%	0.67	82%	0.819	S	S	*	*			cis	162.4	175.2	-0.5	0	0	0	0	0	109.2
1069	R	26.6	Very low	29.5	Very low	250 Å²	250	145.7 Å²	145.7	94%	0.943	81%	0.813	S	S	*	*			trans	-172.8	130.8	162	-125.7	177.3	-84.9	-99.4	4.2	114.7
1070	L	28.2	Very low	29.1	Very low	177 Å²	177	147.6 Å²	147.6	93%	0.927	81%	0.814	S	S	*	*				162.1	137	117	-169.5	68.1	0	0	0	109
1071	G	27.2	Very low	28.4	Very low	67 Å²	67	144.9 Å²	144.9	69%	0.691	80%	0.804	S	S	*	*			cis	-127.3	-149.3	-11.4	0	0	0	0	0	110.3
1072	S	27.3	Very low	27.9	Very low	116 Å²	116	141.5 Å²	141.5	81%	0.811	80%	0.795	S	S	*	*			cis	-161.2	135.4	-0.3	-178.8	0	0	0	0	110.2
1073	C	27.4	Very low	27.7	Very low	132 Å²	132	138.2 Å²	138.2	89%	0.892	79%	0.792	S	S	*	*			trans	-170.3	175.6	146	-108	0	0	0	0	113.6
1074	D	27.6	Very low	27.5	Very low	122 Å²	122	137.9 Å²	137.9	65%	0.652	79%	0.789	S	S	*	*			trans	-63.8	138.7	-144.6	-104.9	-23.9	0	0	0	122.6
1075	K	30	Very low	27.7	Very low	149 Å²	149	136 Å²	136	65%	0.648	79%	0.787	S	S	*	*				56.8	129.2	127.4	-77.5	173.9	-167	93.5	0	124.7
1076	F	30.2	Very low	28	Very low	183 Å²	183	136.6 Å²	136.6	80%	0.803	78%	0.782	S	S	*	*			trans	83	103.3	142.2	-67.3	-51.6	0	0	0	122.1
1077	L	31	Very low	28	Very low	151 Å²	151	136.4 Å²	136.4	79%	0.791	78%	0.78	S	S	*	*			trans	-25.4	153.7	145.1	-59.9	161.7	0	0	0	115
1078	R	25.1	Very low	28.1	Very low	195 Å²	195	135.5 Å²	135.5	74%	0.736	77%	0.771	S	S	*	*			cis	-168.6	156.3	37.6	-144.5	171.2	-165.4	179.2	7.7	113.7
1079	F	26.7	Very low	28.3	Very low	163 Å²	163	140.5 Å²	140.5	72%	0.715	78%	0.781	S	S	*	*			trans	68.8	100.9	156	-67.6	-46.9	0	0	0	123.2
1080	K	27.4	Very low	28.5	Very low	191 Å²	191	136.2 Å²	136.2	83%	0.83	78%	0.777	S	S	*	*				82.3	157.6	115.4	-142.4	-180	-174.5	-174	0	120.1
1081	T	24	Very low	28.6	Very low	113 Å²	113	130.6 Å²	130.6	69%	0.693	76%	0.762	S	S	*	*			trans	83.5	107.4	161.5	5.2	0	0	0	0	119.7
1082	T	24.1	Very low	28.9	Very low	122 Å²	122	137.7 Å²	137.7	75%	0.748	77%	0.774	S	S	*	*			trans	51.2	129.1	134.1	53.8	0	0	0	0	123.4
1083	C	26.5	Very low	28.9	Very low	132 Å²	132	137.4 Å²	137.4	89%	0.892	77%	0.772	S	S	*	*			trans	72.9	141.8	131.7	-165.2	0	0	0	0	120
1084	G	26.8	Very low	29	Very low	62 Å²	62	134.6 Å²	134.6	64%	0.639	76%	0.759	S	S	*	*			trans	84.4	176.7	167.6	0	0	0	0	0	114.5
1085	C	33.3	Very low	29	Very low	121 Å²	121	131.6 Å²	131.6	82%	0.818	75%	0.747	S	S	*	*			cis	-168.2	172.3	0.6	-104.8	0	0	0	0	107.3
1086	K	35.3	Very low	29.9	Very low	195 Å²	195	128.2 Å²	128.2	85%	0.848	74%	0.74	S	S	*	*			cis	177.9	143.2	-21.9	166.6	179.8	176.2	-177.8	0	109.2
1087	G	27.2	Very low	29.9	Very low	72 Å²	72	126.3 Å²	126.3	74%	0.742	73%	0.729	S	S	*	*			trans	-161.7	123	156.4	0	0	0	0	0	105.6
1088	G	29	Very low	29.8	Very low	68 Å²	68	123.8 Å²	123.8	70%	0.701	72%	0.72	S	S	*	*				88.7	104.5	54	0	0	0	0	0	106
1089	L	32.5	Very low	30	Very low	169 Å²	169	119.3 Å²	119.3	89%	0.885	72%	0.718	S	S	*	*				-149.2	-174	63.1	-77.1	149	0	0	0	113.5
1090	N	31.8	Very low	30.1	Very low	160 Å²	160	119.3 Å²	119.3	86%	0.856	73%	0.725	S	S	*	*			trans	-73.6	166.5	179.3	-43.9	-41.7	0	0	0	112.1
1091	G	30.6	Very low	30.4	Very low	60 Å²	60	113 Å²	113	62%	0.619	71%	0.714	S	S	*	*			cis	148.4	146	-4.8	0	0	0	0	0	112.7
1092	F	32.2	Very low	30.7	Very low	215 Å²	215	116.9 Å²	116.9	94%	0.943	72%	0.722	S	S	*	*			trans	70.3	152.7	175.2	-52.4	-76.1	0	0	0	116.4
1093	S	28.4	Very low	31	Very low	110 Å²	110	119.5 Å²	119.5	77%	0.769	72%	0.723	S	S	*	*			cis	-170.3	167	-9.2	43.3	0	0	0	0	112.9
1094	A	28.5	Very low	31.4	Very low	73 Å²	73	120.6 Å²	120.6	60%	0.603	72%	0.715	S	S	*	*			trans	74.2	143.6	166.9	0	0	0	0	0	118.5
1095	S	28.3	Very low	31.8	Very low	59 Å²	59	123 Å²	123	41%	0.413	72%	0.717	S	S	.	*			cis	88.1	139.7	21.3	84.2	0	0	0	0	117	T737 P739	T737-S1095 CarbonylContact O-C 3.56Å; T737-S1095 WeakPolarHBondContact O-CA 3.17Å; T737-S1095 PolarHBondContact O-N 3.11Å; P739-S1095 VanDerWaalsContact CD-CA 3.49Å
1096	P	47.9	Very low	31.9	Very low	78 Å²	78	123 Å²	123	51%	0.506	71%	0.714	S	S	.	*			cis	-141.3	151.5	-22.9	38.6	-18.2	0	0	0	118.9	P736 T737	P736-P1096 CarbonylContact O-C 3.53Å; P736-P1096 VanDerWaalsContact O-C 3.29Å; T737-P1096 VanDerWaalsContact O-CA 3.31Å; T737-P1096 WeakPolarHBondContact O-CA 3.34Å
1097	Y	31.4	Very low	31.8	Very low	143 Å²	143	120.7 Å²	120.7	56%	0.561	72%	0.716	S	S	*	*			trans	62.9	173.5	162.5	-79.9	-69.7	0	0	0	119.6	P736 T737 T738	P736-Y1097 CarbonylContact C-O 3.6Å; P736-Y1097 WeakPolarHBondContact CA-O 3.16Å; T737-Y1097 PolarHBondContact N-O 3.11Å; T738-Y1097 HydrophobicContact CG2-CD1 4.27Å; T738-Y1097 HydrophobicContact CG2-CD2 3.91Å; T738-Y1097 HydrophobicContact CG2-CE1 3.89Å; T738-Y1097 HydrophobicContact CG2-CE2 3.49Å; T738-Y1097 VanDerWaalsContact CG2-CE2 3.49Å; T738-Y1097 HydrophobicContact CG2-CG 4.28Å; T738-Y1097 VanDerWaalsContact CG2-CZ 3.48Å; T738-Y1097 VanDerWaalsContact N-N 3.1Å; T738-Y1097 WeakPolarHBondContact OG1-CA 3.34Å; T738-Y1097 WeakPolarHBondContact OG1-CD1 3.18Å; T738-Y1097 PolarHBondContact OG1-N 3.13Å
1098	T	29	Very low	32.5	Very low	99 Å²	99	121.6 Å²	121.6	61%	0.607	72%	0.717	S	S	*	*			cis	-152.8	129.8	4.3	-10.3	0	0	0	0	109.2
1099	S	29.5	Very low	33.1	Very low	100 Å²	100	123 Å²	123	70%	0.699	72%	0.721	S	S	*	*				75.9	154.5	106.8	71.8	0	0	0	0	121.5
1100	L	28.1	Very low	33.5	Very low	164 Å²	164	120.6 Å²	120.6	86%	0.859	71%	0.714	S	S	*	*			trans	88.9	143.1	-177	-67.4	152.5	0	0	0	115.5	F1102	L1100-F1102 HydrophobicContact CD2-CE2 4.4Å
1101	G	34	Very low	33.8	Very low	58 Å²	58	121.6 Å²	121.6	60%	0.598	71%	0.71	S	S	*	*			cis	162.9	165.1	-8.5	0	0	0	0	0	113.8
1102	F	29.7	Very low	33.9	Very low	195 Å²	195	130.8 Å²	130.8	86%	0.855	74%	0.737	S	S	*	*			trans	67.5	170.2	174.2	-58.9	-93.1	0	0	0	118.2	L1100	L1100-F1102 HydrophobicContact CD2-CE2 4.4Å
1103	K	31.8	Very low	34	Very low	177 Å²	177	126.6 Å²	126.6	77%	0.77	73%	0.727	S	S	*	*				-164	160.3	-58.6	-150.9	-178.3	176.9	-172	0	110
1104	E	34.9	Very low	34.3	Very low	155 Å²	155	127.5 Å²	127.5	72%	0.724	73%	0.725	S	S	*	*			trans	-50.8	159.4	162.2	-67.1	177.4	108.1	0	0	114.6
1105	T	34.5	Very low	34.6	Very low	111 Å²	111	130.5 Å²	130.5	68%	0.681	73%	0.732	S	S	*	*			cis	-160.3	164.9	3.2	6.9	0	0	0	0	112.9
1106	T	35.6	Very low	35	Very low	122 Å²	122	134.7 Å²	134.7	75%	0.748	75%	0.75	S	S	*	*			trans	38.7	127.4	139.3	-52.2	0	0	0	0	122.2
1107	T	32.4	Very low	34.2	Very low	146 Å²	146	138.3 Å²	138.3	90%	0.896	77%	0.766	S	S	*	*			trans	-160.7	163.8	132.5	-2.4	0	0	0	0	112.2
1108	A	41.6	Very low	34.3	Very low	92 Å²	92	137.9 Å²	137.9	76%	0.76	78%	0.779	S	S	*	*			trans	-136.3	145.4	171.3	0	0	0	0	0	111
1109	A	43	Very low	34.7	Very low	96 Å²	96	140.7 Å²	140.7	79%	0.793	79%	0.791	S	S	*	*			trans	3.4	150.4	154.1	0	0	0	0	0	120.2
1110	V	40.8	Very low	35.1	Very low	120 Å²	120	143.8 Å²	143.8	73%	0.727	80%	0.799	S	S	*	*			cis	-151.3	145.6	18.8	176.5	0	0	0	0	110.6
1111	K	37.7	Very low	35.7	Very low	181 Å²	181	142.2 Å²	142.2	79%	0.787	79%	0.794	S	S	*	*			trans	-179.3	139.6	137.7	-104.2	175.7	-176.8	178.3	0	109.7
1112	E	32.6	Very low	35.9	Very low	253 Å²	253	149.8 Å²	149.8	100%	1.182	81%	0.811	S	S	*	*			cis	-97.3	0	-6.4	-65.5	-176.4	114	0	0	112.4

Retrieved 1,112 of 1,112 residues in 283.8 ms (Link to these results)

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