A0A3Q0KP78_SCHMA Loading...

Putative tripartite motif protein

AlphaFold DB , UniProt , Accession A0A3Q0KP78, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,686 aa.

						>A0A3Q0KP78_SCHMA|A0A3Q0KP78
MAQSRRDKKLDGVDTFESLSEVFRCFICMEKLNNARLCPHCSKLCCYKCIRKWITETRSQCPHCRASLHIYELINCRWADEVTQQLDNLQSQATSSRSGSGQNNSLGGASVNNTLSTSSTEVCELHNERLSVFCTTCGYAICHQCALFDNNHEQHSFRPLDDVYDEHVKQIKNEMDQFKRRHLELISLLQDVEKNVQAVKQAKEERVRELRNAVELMVARLDSQLKSKLVTLMSQRSQLFQEIESLENLLHDVQYAVDVAKPSEMVERSSEILALLSDVHCKPMASFVSAPVPADFVSEIVPPYESSTFTLQPYSIMKQRADPVYSQPLHVGGLSWRLKVYPDGNGVVRGNYLSVFLELSAGLLEASKYEYRVEMVHQQSRDPSRNIVREFASHFEVGECWGYNRFFRLDLLVNEGYLNSETDSILLKFQVRAPTYFQKCRDQNWHILQLEANQGHCFTQLAELKERLSMEVARQTNIISVATTNTATAASPITDIFNSTVVTTISSTSVVCQQSTDSLKPSTSLSDPTSTISQSTCIMTTSPSPLELQPSLSLPAQSINEEFIDNSTNESNKYVASVPEMKNKDCINMDRNDCTSQCCLINSTNNTSIRNHLTNSENHTQSLRGVSNNNNNNNNNNNNSENLTNEEVDDCLTTVNVLNSRTTDVDNEYAEQLNELQTNSIAQLSIDISEPLLNLILTANQQEQPVINSSILSSLDISQLTVSYSNEDNNHNNNNVNSEEDGFFIDSSRYFNTSEQLMPHEDVDVESTHFSEPISYGGDDEGEFGDGDSENNNNNDDGGGGDADEVEKIDDDDDQVGEDGGDVGEDDDEEQTDNDEDNEDDRQQNFISKFHNYTKSNNDMDNSLSDDNDDVEQIRQTIHDYDIVSQTSEILSDHDSLQSSIDSNKLLLLKNRFMNKPKKSLNIIDSIKALKNQKPTIAATTTITTPNTNNGIIPMIEYECNLMTDVGSDINSTYDDYEYHTRNRNTIEELLKLPVLRSTNDSISNNSNTNNNNISNKRKVNQISRHPLWFKLSTKDKSKLQFSEASTSRFNHDSKLQCNFKEQKPFSVIQTQTIDITHNNSSNNCNNNINGLDIDSSPRSIFSEKLNGCQSSSNYQPGLVSEANWERITKVPNVCSDTTLIHPKLCASSSSSLSSSHSSSYGKTISESYLLRNKSSKSLSNRRLTDFSHHHEHSQRSQCSKLKHLPRYHKDNIKPLSLVTTDQVPSCSNHTSSYVSYKCKQSNELSGNDLQKELVTNRPIPINCNKNDNSNQLGKNNNSANSPLSSSITAVKTTTKCSDHFQPDKLYHFSSICNDPINLMMKTTTKITPSGQIIKNEIQHLENDIDEKTMTGDRDVSEHVLNNRRFWEDSNLKANNDSNNNSNKSNNNDGEKLFNSSCLLLNNHDNGIFVNQPKHVCNSPHTATVKSKSAMRMMSTIFQNNKTCHPLTSDENSTPSKSILSDEINSRDMCIKRSSHTEHIHDNLECDRLNYEPMYNCKPNLCHVSLEHQKEAINSRLKPDLDTMSSGEVVPSHSDVSSLPSQSIGLSVHNKESNILGIDYLTETQQLIAEPTDLSLAMLCHRISRLQTEAEAVAKAISANNHNNSACTRNKQSTSNLPIINQQFASPVDEAQSFRTDSNSHTINEMQIRHSPGKFDEGLSRSVNKNEQSSQLDTGDDNNIYDQGDT
					

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(Predicted Aligned Error values between residue pairs)

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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	29.7	Very low	30.5	Very low	242 Å²	242	173 Å²	173	100%	1.192	84%	0.84	S	S	*	*				0	83	0	-71.4	174.2	168.8	0	0	108.8
2	A	28.3	Very low	31.1	Very low	87 Å²	87	163.8 Å²	163.8	72%	0.719	82%	0.823	S	S	*	*			trans	-161.7	6.8	177.7	0	0	0	0	0	115.1
3	Q	26.5	Very low	32.2	Very low	178 Å²	178	157.8 Å²	157.8	83%	0.832	80%	0.8	S	S	*	*	S	Bend	trans	-136	161.6	179.8	-88.9	82.5	9	0	0	111
4	S	29.2	Very low	33.6	Very low	118 Å²	118	153.6 Å²	153.6	83%	0.825	78%	0.781	S	S	*	*			trans	65.3	62.8	-178.8	-155	0	0	0	0	115.9
5	R	29	Very low	35.3	Very low	251 Å²	251	148.9 Å²	148.9	95%	0.947	76%	0.763	S	S	*	*			trans	-147	56.7	153.3	-90.4	-156.2	176.3	-171.3	-0.3	111.5
6	R	30.2	Very low	37.2	Very low	231 Å²	231	143.1 Å²	143.1	87%	0.872	73%	0.73	S	S	*	*			trans	-126.3	170.1	152.5	-67.6	-175.2	-177.3	164.9	0.1	106.6
7	D	30.9	Very low	39	Very low	159 Å²	159	139.2 Å²	139.2	85%	0.85	71%	0.709	S	S	*	*			trans	78.8	64.6	-174.5	-48	-24.5	0	0	0	115.8
8	K	32.7	Very low	40.7	Very low	190 Å²	190	135 Å²	135	83%	0.826	69%	0.694	S	S	*	*			trans	-141.9	73.5	149.7	-79.1	-156.3	173.7	-167	0	109.9
9	K	28.6	Very low	42.3	Very low	200 Å²	200	132.4 Å²	132.4	87%	0.87	68%	0.681	S	S	*	*			trans	-158.6	46.5	176.4	-154.3	-176.5	179.5	-177.7	0	114
10	L	34	Very low	43.9	Very low	110 Å²	110	126.5 Å²	126.5	58%	0.576	65%	0.652	S	S	*	*			trans	-148.6	29	177.4	-110.1	168.7	0	0	0	115	G12 V13	L10-G12 PolarHBondContact O-N 3.44Å; L10-V13 HydrophobicContact CD2-CB 3.93Å; L10-V13 HydrophobicContact CD2-CG2 3.5Å; L10-V13 PolarHBondContact O-N 3.42Å
11	D	36.5	Very low	45.5	Very low	137 Å²	137	126.5 Å²	126.5	73%	0.733	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57	0.3	-177.4	-56.9	-72.6	0	0	0	116.2
12	G	37.9	Very low	48	Very low	62 Å²	62	118.7 Å²	118.7	64%	0.639	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-13.7	174.6	0	0	0	0	0	116	L10	L10-G12 PolarHBondContact O-N 3.44Å
13	V	45	Very low	50.6	Low	86 Å²	86	115.6 Å²	115.6	52%	0.521	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.9	-39.1	-178.4	178.7	0	0	0	0	111.7	L10 T15 F16 E17	L10-V13 HydrophobicContact CD2-CB 3.93Å; L10-V13 HydrophobicContact CD2-CG2 3.5Å; L10-V13 PolarHBondContact O-N 3.42Å; V13-T15 PolarHBondContact O-N 2.87Å; V13-F16 PolarHBondContact O-N 3.44Å; V13-E17 PolarHBondContact O-N 2.74Å
14	D	52.3	Low	53.5	Low	99 Å²	99	111.3 Å²	111.3	53%	0.529	56%	0.562	S	S	.	*	H	α-helix	trans	-56.4	-27.4	179.1	-60.1	-18.2	0	0	0	112.8	S18	D14-S18 VanDerWaalsContact O-CB 3.25Å; D14-S18 WeakPolarHBondContact O-CB 3.15Å; D14-S18 PolarHBondContact O-N 3.24Å; D14-S18 PolarHBondContact O-OG 3.4Å
15	T	58.9	Low	56.5	Low	83 Å²	83	105.7 Å²	105.7	51%	0.509	52%	0.522	S	S	.	.	H	α-helix	trans	-71.6	-29.7	176.9	53.6	0	0	0	0	113.7	V13 L19	V13-T15 PolarHBondContact O-N 2.87Å; T15-L19 WeakPolarHBondContact O-CB 3.49Å; T15-L19 PolarHBondContact O-N 3.09Å
16	F	64.7	Low	59.4	Low	56 Å²	56	95.2 Å²	95.2	25%	0.246	48%	0.483	C	S	.	.	H	α-helix	trans	-78.5	-44.3	173.6	-174.9	-89.3	0	0	0	111	V13 L19 S20 L86 L89 Q90	V13-F16 PolarHBondContact O-N 3.44Å; F16-L19 WeakPolarHBondContact O-CB 3.29Å; F16-L19 PolarHBondContact O-N 2.71Å; F16-S20 PolarHBondContact O-N 3.24Å; F16-L86 HydrophobicContact CE2-CD2 3.98Å; F16-L86 HydrophobicContact CZ-CD2 4.48Å; F16-L89 HydrophobicContact CE2-CB 4.43Å; F16-Q90 HydrophobicContact CE1-CB 4.11Å; F16-Q90 HydrophobicContact CE1-CG 3.84Å; F16-Q90 HydrophobicContact CZ-CB 3.73Å; F16-Q90 HydrophobicContact CZ-CG 4.01Å
17	E	68.3	Low	62.2	Low	78 Å²	78	86.8 Å²	86.8	36%	0.364	46%	0.455	S	S	.	.	H	α-helix	trans	-69.7	-37.4	-176.9	-159.4	56.5	-138.1	0	0	112	V13 L19 S20 E21 R24	V13-E17 PolarHBondContact O-N 2.74Å; E17-L19 VanDerWaalsContact C-N 3.34Å; E17-L19 PolarHBondContact O-N 3.25Å; E17-S20 PolarHBondContact O-N 2.99Å; E17-S20 PolarHBondContact O-OG 3.44Å; E17-S20 PolarHBondContact OE1-OG 3.01Å; E17-S20 VanDerWaalsContact OE1-OG 3.11Å; E17-E21 WeakPolarHBondContact O-CB 3.28Å; E17-E21 PolarHBondContact O-N 2.81Å; E17-R24 IonicContact OE1-CZ 3.01Å; E17-R24 IonicContact OE1-NH1 2.98Å; E17-R24 PolarHBondContact OE1-NH1 3.05Å; E17-R24 IonicContact OE1-NH2 3.75Å; E17-R24 PolarHBondContact OE1-NH2 3.06Å
18	S	69	Low	65.1	Low	63 Å²	63	81.3 Å²	81.3	44%	0.441	43%	0.429	S	S	.	.	H	α-helix	trans	-67.9	-31	171.6	58.4	0	0	0	0	113.2	D14 V22	D14-S18 VanDerWaalsContact O-CB 3.25Å; D14-S18 WeakPolarHBondContact O-CB 3.15Å; D14-S18 PolarHBondContact O-N 3.24Å; D14-S18 PolarHBondContact O-OG 3.4Å; S18-V22 WeakPolarHBondContact O-CG2 3.5Å; S18-V22 PolarHBondContact O-N 3.34Å; S18-V22 VanDerWaalsContact O-N 3.15Å
19	L	72.7	Confident	67.7	Low	86 Å²	86	78.3 Å²	78.3	45%	0.45	42%	0.42	S	S	.	.	H	α-helix	trans	-68.7	-44.4	170.3	-94.7	167.1	0	0	0	111.7	T15 F16 E17 E21 V22 F23	T15-L19 WeakPolarHBondContact O-CB 3.49Å; T15-L19 PolarHBondContact O-N 3.09Å; F16-L19 WeakPolarHBondContact O-CB 3.29Å; F16-L19 PolarHBondContact O-N 2.71Å; E17-L19 VanDerWaalsContact C-N 3.34Å; E17-L19 PolarHBondContact O-N 3.25Å; L19-E21 VanDerWaalsContact C-N 3.29Å; L19-E21 PolarHBondContact O-N 3.21Å; L19-V22 PolarHBondContact O-N 3.21Å; L19-F23 HydrophobicContact CD2-CE2 4.47Å; L19-F23 WeakPolarHBondContact O-CD2 3.42Å; L19-F23 PolarHBondContact O-N 2.85Å
20	S	73.8	Confident	70.5	Confident	14 Å²	14	74.9 Å²	74.9	10%	0.098	41%	0.407	C	S	.	.	H	α-helix	trans	-63	-38	177.6	82.7	0	0	0	0	111.1	F16 E17 V22 F23 R24	F16-S20 PolarHBondContact O-N 3.24Å; E17-S20 PolarHBondContact O-N 2.99Å; E17-S20 PolarHBondContact O-OG 3.44Å; E17-S20 PolarHBondContact OE1-OG 3.01Å; E17-S20 VanDerWaalsContact OE1-OG 3.11Å; S20-V22 PolarHBondContact O-N 3.31Å; S20-F23 CarbonylContact O-C 3.51Å; S20-F23 VanDerWaalsContact O-C 3.28Å; S20-F23 WeakPolarHBondContact O-CA 3.48Å; S20-F23 PolarHBondContact O-N 2.98Å; S20-R24 PolarHBondContact O-N 2.84Å; S20-R24 VanDerWaalsContact O-N 3.09Å; S20-R24 PolarHBondContact OG-NH1 3.06Å; S20-R24 VanDerWaalsContact OG-NH1 3.1Å; S20-R24 PolarHBondContact OG-NH2 3.25Å
21	E	77.6	Confident	72.9	Confident	126 Å²	126	73.8 Å²	73.8	59%	0.589	40%	0.397	S	S	*	.	H	α-helix	trans	-66.3	-33.4	175.4	-166.9	-179.5	-165.7	0	0	113.7	E17 L19 F23 R24	E17-E21 WeakPolarHBondContact O-CB 3.28Å; E17-E21 PolarHBondContact O-N 2.81Å; L19-E21 VanDerWaalsContact C-N 3.29Å; L19-E21 PolarHBondContact O-N 3.21Å; E21-F23 PolarHBondContact O-N 3.1Å; E21-R24 PolarHBondContact O-N 3.2Å
22	V	81.6	Confident	75.3	Confident	79 Å²	79	67.7 Å²	67.7	48%	0.479	37%	0.365	S	S	.	.	H	α-helix	trans	-62.3	-28.5	170	167.2	0	0	0	0	111.9	S18 L19 S20	S18-V22 WeakPolarHBondContact O-CG2 3.5Å; S18-V22 PolarHBondContact O-N 3.34Å; S18-V22 VanDerWaalsContact O-N 3.15Å; L19-V22 PolarHBondContact O-N 3.21Å; S20-V22 PolarHBondContact O-N 3.31Å
23	F	83.9	Confident	77.5	Confident	21 Å²	21	69.8 Å²	69.8	9%	0.092	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	15.7	176.6	-68	-74.7	0	0	0	114.6	L19 S20 E21 L32 L44 W78 V82 T83 L86	L19-F23 HydrophobicContact CD2-CE2 4.47Å; L19-F23 WeakPolarHBondContact O-CD2 3.42Å; L19-F23 PolarHBondContact O-N 2.85Å; S20-F23 CarbonylContact O-C 3.51Å; S20-F23 VanDerWaalsContact O-C 3.28Å; S20-F23 WeakPolarHBondContact O-CA 3.48Å; S20-F23 PolarHBondContact O-N 2.98Å; E21-F23 PolarHBondContact O-N 3.1Å; F23-L32 HydrophobicContact CB-CD1 4.32Å; F23-L32 HydrophobicContact CD1-CD1 4.2Å; F23-L32 VanDerWaalsContact O-CD1 3.25Å; F23-L32 WeakPolarHBondContact O-CD1 3.29Å; F23-L32 VanDerWaalsContact O-CG 3.23Å; F23-L32 WeakPolarHBondContact O-CG 3.3Å; F23-L44 HydrophobicContact CD1-CD1 3.83Å; F23-L44 HydrophobicContact CE1-CD1 3.92Å; F23-W78 AromaticContact CE1-CH2 3.7Å; F23-W78 HydrophobicContact CE1-CH2 3.7Å; F23-W78 AromaticContact CE1-CZ3 3.52Å; F23-W78 HydrophobicContact CE1-CZ3 3.52Å; F23-W78 HydrophobicContact CZ-CH2 4.07Å; F23-W78 AromaticContact CZ-CZ3 3.83Å; F23-W78 HydrophobicContact CZ-CZ3 3.83Å; F23-V82 HydrophobicContact CE1-CG1 4.07Å; F23-V82 HydrophobicContact CE2-CG1 4Å; F23-V82 HydrophobicContact CZ-CG1 3.72Å; F23-T83 HydrophobicContact CB-CG2 3.91Å; F23-L86 HydrophobicContact CB-CD1 4.25Å; F23-L86 HydrophobicContact CD2-CD1 3.41Å; F23-L86 VanDerWaalsContact CD2-CD1 3.41Å; F23-L86 HydrophobicContact CE2-CD1 4.01Å; F23-L86 HydrophobicContact CG-CD1 3.99Å
24	R	87.4	Confident	79.7	Confident	89 Å²	89	68.5 Å²	68.5	34%	0.336	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-89.4	147.8	165.2	-75.3	173.9	-179.5	124	-0.9	111.2	E17 S20 E21 F26 M29 E30	E17-R24 IonicContact OE1-CZ 3.01Å; E17-R24 IonicContact OE1-NH1 2.98Å; E17-R24 PolarHBondContact OE1-NH1 3.05Å; E17-R24 IonicContact OE1-NH2 3.75Å; E17-R24 PolarHBondContact OE1-NH2 3.06Å; S20-R24 PolarHBondContact O-N 2.84Å; S20-R24 VanDerWaalsContact O-N 3.09Å; S20-R24 PolarHBondContact OG-NH1 3.06Å; S20-R24 VanDerWaalsContact OG-NH1 3.1Å; S20-R24 PolarHBondContact OG-NH2 3.25Å; E21-R24 PolarHBondContact O-N 3.2Å; R24-F26 PolarHBondContact O-N 2.96Å; R24-M29 VanDerWaalsContact CD-O 3.31Å; R24-M29 WeakPolarHBondContact CD-O 3.31Å; R24-M29 WeakPolarHBondContact CG-O 3.45Å; R24-E30 WeakPolarHBondContact CA-O 3.26Å
25	C	91.6	Very high	81.5	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.326	C	S	.	.			trans	-73.4	114.1	175.5	174.3	0	0	0	0	110.3	I27 C28 M29 E30 L32 C46	C25-I27 PolarHBondContact O-N 2.64Å; C25-C28 PolarHBondContact O-N 2.91Å; C25-M29 VanDerWaalsContact O-CA 3.24Å; C25-M29 WeakPolarHBondContact O-CA 3.49Å; C25-M29 PolarHBondContact O-N 3.19Å; C25-E30 PolarHBondContact N-O 3.5Å; C25-L32 HydrophobicContact CB-CD2 4.04Å; C25-C46 VanDerWaalsContact CB-SG 3.57Å; C25-C46 PolarHBondContact SG-N 2.99Å
26	F	89.1	Confident	83.1	Confident	30 Å²	30	61.7 Å²	61.7	13%	0.132	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	6.7	-177.4	71.2	-95.3	0	0	0	116.3	R24 K43 L44 C45 P62 H63	R24-F26 PolarHBondContact O-N 2.96Å; F26-K43 HydrophobicContact CD1-CB 3.66Å; F26-K43 HydrophobicContact CE1-CB 3.72Å; F26-L44 WeakPolarHBondContact CD1-O 3.26Å; F26-L44 PolarHBondContact N-O 3.04Å; F26-C45 HydrophobicContact CD1-CB 3.97Å; F26-C45 HydrophobicContact CE1-CB 3.56Å; F26-C45 HydrophobicContact CZ-CB 4.09Å; F26-P62 HydrophobicContact CE2-CB 3.89Å; F26-P62 HydrophobicContact CE2-CG 3.69Å; F26-P62 HydrophobicContact CZ-CG 4.44Å; F26-H63 HydrophobicContact CD2-CB 3.96Å; F26-H63 HydrophobicContact CE2-CB 3.74Å; F26-H63 HydrophobicContact CZ-CB 4.18Å
27	I	89.3	Confident	84.4	Confident	54 Å²	54	60.6 Å²	60.6	28%	0.277	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.2	-36.8	-179.7	-53.3	177.2	0	0	0	112.3	C25 C45 C49 I50 P62	C25-I27 PolarHBondContact O-N 2.64Å; I27-C45 HydrophobicContact CD1-CB 4.04Å; I27-C45 HydrophobicContact CG1-CB 4.37Å; I27-C49 HydrophobicContact CB-CB 3.88Å; I27-C49 HydrophobicContact CD1-CB 4.01Å; I27-C49 HydrophobicContact CG2-CB 3.86Å; I27-I50 HydrophobicContact CD1-CB 3.9Å; I27-I50 HydrophobicContact CD1-CD1 3.94Å; I27-I50 HydrophobicContact CD1-CG1 4.5Å; I27-P62 HydrophobicContact CD1-CG 3.96Å; I27-P62 HydrophobicContact CG1-CG 4.16Å
28	C	92.3	Very high	85.5	Confident	45 Å²	45	56.9 Å²	56.9	30%	0.304	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	-6.2	175.6	55.7	0	0	0	0	113.7	C25 E30	C25-C28 PolarHBondContact O-N 2.91Å; C28-E30 HydrophobicContact CB-CG 4.1Å; C28-E30 PolarHBondContact O-N 3.18Å; C28-E30 PolarHBondContact SG-OE2 2.8Å
29	M	88.3	Confident	86.5	Confident	127 Å²	127	56.6 Å²	56.6	63%	0.626	28%	0.284	S	S	*	.			trans	59.2	0.3	-172.7	-49.7	-50.3	-177.8	0	0	115.7	R24 C25	R24-M29 VanDerWaalsContact CD-O 3.31Å; R24-M29 WeakPolarHBondContact CD-O 3.31Å; R24-M29 WeakPolarHBondContact CG-O 3.45Å; C25-M29 VanDerWaalsContact O-CA 3.24Å; C25-M29 WeakPolarHBondContact O-CA 3.49Å; C25-M29 PolarHBondContact O-N 3.19Å
30	E	87.1	Confident	87.3	Confident	128 Å²	128	57.4 Å²	57.4	60%	0.598	29%	0.286	S	S	*	.	S	Bend	trans	-73.4	171.5	173.1	-55.5	170.7	135.3	0	0	112.8	R24 C25 C28	R24-E30 WeakPolarHBondContact CA-O 3.26Å; C25-E30 PolarHBondContact N-O 3.5Å; C28-E30 HydrophobicContact CB-CG 4.1Å; C28-E30 PolarHBondContact O-N 3.18Å; C28-E30 PolarHBondContact SG-OE2 2.8Å
31	K	83.8	Confident	88.2	Confident	86 Å²	86	58.4 Å²	58.4	37%	0.374	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-55	140.1	168.8	-163.9	-177	-171.9	-179.2	0	111.8	T83 D87	K31-T83 HydrophobicContact CD-CG2 4.26Å; K31-T83 WeakPolarHBondContact CE-O 3.49Å; K31-T83 HydrophobicContact CG-CG2 3.8Å; K31-T83 PolarHBondContact NZ-O 2.9Å; K31-D87 WeakPolarHBondContact CE-OD1 3.36Å; K31-D87 IonicContact NZ-OD1 3.68Å; K31-D87 PolarHBondContact NZ-OD1 2.78Å; K31-D87 IonicContact NZ-OD2 3.61Å; K31-D87 PolarHBondContact NZ-OD2 3.39Å
32	L	87	Confident	88.8	Confident	10 Å²	10	56.4 Å²	56.4	5%	0.052	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-60.6	140.1	176.4	-71.8	163.2	0	0	0	112.8	F23 C25 A35 L44	F23-L32 HydrophobicContact CB-CD1 4.32Å; F23-L32 HydrophobicContact CD1-CD1 4.2Å; F23-L32 VanDerWaalsContact O-CD1 3.25Å; F23-L32 WeakPolarHBondContact O-CD1 3.29Å; F23-L32 VanDerWaalsContact O-CG 3.23Å; F23-L32 WeakPolarHBondContact O-CG 3.3Å; C25-L32 HydrophobicContact CB-CD2 4.04Å; L32-A35 HydrophobicContact CB-CB 4.18Å; L32-A35 HydrophobicContact CD1-CB 4.38Å; L32-A35 HydrophobicContact CD2-CB 4.33Å; L32-L44 HydrophobicContact CD1-CB 3.6Å; L32-L44 HydrophobicContact CD1-CD1 3.79Å; L32-L44 HydrophobicContact CD1-CG 4.22Å; L32-L44 HydrophobicContact CD2-CB 3.87Å; L32-L44 HydrophobicContact CG-CB 4.38Å
33	N	85	Confident	89.2	Confident	105 Å²	105	56.4 Å²	56.4	56%	0.561	29%	0.286	S	S	*	.	S	Bend	trans	-143.5	115.9	178.1	-177.9	-33.2	0	0	0	108.9	C46	N33-C46 PolarHBondContact N-SG 2.87Å; N33-C46 WeakPolarHBondContact O-CA 3.42Å; N33-C46 WeakPolarHBondContact O-CB 3.46Å
34	N	89.9	Confident	89.6	Confident	59 Å²	59	55.9 Å²	55.9	32%	0.316	28%	0.284	S	S	.	.	S	Bend	trans	54.3	62.5	-169.1	-177.3	-7.8	0	0	0	109.5	R36 Y47 D80	N34-R36 PolarHBondContact OD1-NE 3.41Å; N34-R36 PolarHBondContact OD1-NH2 2.73Å; N34-Y47 WeakPolarHBondContact O-CB 3.27Å; N34-Y47 PolarHBondContact O-N 3.32Å; N34-D80 PolarHBondContact N-OD1 3.3Å
35	A	91.4	Very high	89.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	136.6	-168.7	0	0	0	0	0	113.4	L32 C76 A79	L32-A35 HydrophobicContact CB-CB 4.18Å; L32-A35 HydrophobicContact CD1-CB 4.38Å; L32-A35 HydrophobicContact CD2-CB 4.33Å; A35-C76 HydrophobicContact CB-CB 3.98Å; A35-C76 PolarHBondContact O-N 3.28Å; A35-A79 HydrophobicContact CB-CB 3.67Å
36	R	91.9	Very high	89.9	Confident	40 Å²	40	52 Å²	52	15%	0.151	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	137.2	177.3	-61.9	-66	155.5	145.5	-0.9	111.2	N34 L44 C45 Y47 I50 L73 I74 N75	N34-R36 PolarHBondContact OD1-NE 3.41Å; N34-R36 PolarHBondContact OD1-NH2 2.73Å; R36-L44 CarbonylContact O-C 3.58Å; R36-L44 WeakPolarHBondContact O-CA 3.49Å; R36-C45 PolarHBondContact N-O 2.92Å; R36-C45 PolarHBondContact O-N 3.45Å; R36-C45 PolarHBondContact O-SG 3.06Å; R36-Y47 HydrophobicContact CG-CD2 3.94Å; R36-Y47 HydrophobicContact CG-CG 4.33Å; R36-I50 HydrophobicContact CB-CG2 4.24Å; R36-I50 HydrophobicContact CG-CG2 4.4Å; R36-L73 HydrophobicContact CB-CB 4.26Å; R36-L73 HydrophobicContact CB-CD2 4.4Å; R36-L73 HydrophobicContact CG-CB 4.37Å; R36-I74 VanDerWaalsContact CA-O 3.3Å; R36-I74 WeakPolarHBondContact CA-O 3.23Å; R36-N75 VanDerWaalsContact CZ-OD1 3.29Å; R36-N75 PolarHBondContact NE-OD1 2.68Å; R36-N75 PolarHBondContact NH2-OD1 3.42Å; R36-N75 VanDerWaalsContact NH2-OD1 3.14Å
37	L	92.1	Very high	90.1	Very high	32 Å²	32	54 Å²	54	17%	0.168	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	131.7	177.5	178.7	143.9	0	0	0	110.3	S42 L44 I74 C76	L37-S42 VanDerWaalsContact CD1-O 3.28Å; L37-S42 WeakPolarHBondContact CD1-O 3.45Å; L37-L44 HydrophobicContact CB-CD2 4.02Å; L37-L44 HydrophobicContact CD1-CD2 4.29Å; L37-I74 HydrophobicContact CB-CB 4.31Å; L37-I74 HydrophobicContact CD2-CB 4.28Å; L37-I74 HydrophobicContact CD2-CD1 3.92Å; L37-I74 PolarHBondContact N-O 3.26Å; L37-I74 PolarHBondContact O-N 2.96Å; L37-C76 WeakPolarHBondContact CB-SG 3.3Å
38	C	91.1	Very high	90.3	Very high	1 Å²	1	59.3 Å²	59.3	1%	0.007	30%	0.299	C	S	.	.			trans	-72.5	120.6	171.1	175.8	0	0	0	0	109.9	H40 C41 S42 K43 L68	C38-H40 PolarHBondContact O-N 3.31Å; C38-H40 VanDerWaalsContact O-N 3.1Å; C38-C41 PolarHBondContact O-N 2.89Å; C38-S42 WeakPolarHBondContact O-CA 3.43Å; C38-S42 PolarHBondContact O-N 3.12Å; C38-K43 PolarHBondContact N-O 2.79Å; C38-L68 HydrophobicContact CB-CD2 4.36Å
39	P	89.6	Confident	90.4	Very high	56 Å²	56	58.5 Å²	58.5	36%	0.364	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-16	-178.2	28	-36.4	0	0	0	113.8	L68 I74	P39-L68 HydrophobicContact CG-CD1 3.97Å; P39-I74 HydrophobicContact CB-CD1 4.22Å
40	H	90	Very high	90.6	Very high	104 Å²	104	52.5 Å²	52.5	48%	0.481	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-18.2	-178.9	-57.3	-63.3	0	0	0	114.8	C38 A66 S67	C38-H40 PolarHBondContact O-N 3.31Å; C38-H40 VanDerWaalsContact O-N 3.1Å; H40-A66 HydrophobicContact CB-CB 3.87Å; H40-S67 PolarHBondContact NE2-O 3.01Å
41	C	93	Very high	90.9	Very high	34 Å²	34	52.4 Å²	52.4	23%	0.23	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-149.4	11.3	-176.2	74.6	0	0	0	0	115.4	C38 K43 C64	C38-C41 PolarHBondContact O-N 2.89Å; C41-K43 PolarHBondContact O-N 3.14Å; C41-C64 HydrophobicContact CB-CB 3.6Å
42	S	89.6	Confident	91.3	Very high	85 Å²	85	54.3 Å²	54.3	59%	0.594	27%	0.266	S	S	*	.			trans	57.2	3.6	172.9	-54.5	0	0	0	0	117.7	L37 C38	L37-S42 VanDerWaalsContact CD1-O 3.28Å; L37-S42 WeakPolarHBondContact CD1-O 3.45Å; C38-S42 WeakPolarHBondContact O-CA 3.43Å; C38-S42 PolarHBondContact O-N 3.12Å
43	K	89.3	Confident	91.6	Very high	78 Å²	78	58.2 Å²	58.2	34%	0.339	28%	0.28	S	S	.	.			trans	-73.1	142.5	177.3	-84.4	-78.9	-171.5	175.6	0	111.8	F26 C38 C41	F26-K43 HydrophobicContact CD1-CB 3.66Å; F26-K43 HydrophobicContact CE1-CB 3.72Å; C38-K43 PolarHBondContact N-O 2.79Å; C41-K43 PolarHBondContact O-N 3.14Å
44	L	92.1	Very high	91.9	Very high	11 Å²	11	54 Å²	54	6%	0.058	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	137.9	-174.5	-67.6	165.8	0	0	0	112.3	F23 F26 L32 R36 L37 C76	F23-L44 HydrophobicContact CD1-CD1 3.83Å; F23-L44 HydrophobicContact CE1-CD1 3.92Å; F26-L44 WeakPolarHBondContact CD1-O 3.26Å; F26-L44 PolarHBondContact N-O 3.04Å; L32-L44 HydrophobicContact CD1-CB 3.6Å; L32-L44 HydrophobicContact CD1-CD1 3.79Å; L32-L44 HydrophobicContact CD1-CG 4.22Å; L32-L44 HydrophobicContact CD2-CB 3.87Å; L32-L44 HydrophobicContact CG-CB 4.38Å; R36-L44 CarbonylContact O-C 3.58Å; R36-L44 WeakPolarHBondContact O-CA 3.49Å; L37-L44 HydrophobicContact CB-CD2 4.02Å; L37-L44 HydrophobicContact CD1-CD2 4.29Å; L44-C76 HydrophobicContact CD2-CB 4.07Å
45	C	91.7	Very high	91.8	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.007	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	152.4	179.9	52.4	0	0	0	0	111.7	F26 I27 R36 I50	F26-C45 HydrophobicContact CD1-CB 3.97Å; F26-C45 HydrophobicContact CE1-CB 3.56Å; F26-C45 HydrophobicContact CZ-CB 4.09Å; I27-C45 HydrophobicContact CD1-CB 4.04Å; I27-C45 HydrophobicContact CG1-CB 4.37Å; R36-C45 PolarHBondContact N-O 2.92Å; R36-C45 PolarHBondContact O-N 3.45Å; R36-C45 PolarHBondContact O-SG 3.06Å; C45-I50 HydrophobicContact CB-CB 4.34Å; C45-I50 VanDerWaalsContact SG-CB 3.54Å
46	C	94	Very high	91.8	Very high	6 Å²	6	61.6 Å²	61.6	4%	0.041	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	133.9	174.7	-56.8	0	0	0	0	110.2	C25 N33 K48 C49 I50	C25-C46 VanDerWaalsContact CB-SG 3.57Å; C25-C46 PolarHBondContact SG-N 2.99Å; N33-C46 PolarHBondContact N-SG 2.87Å; N33-C46 WeakPolarHBondContact O-CA 3.42Å; N33-C46 WeakPolarHBondContact O-CB 3.46Å; C46-K48 PolarHBondContact O-N 3.44Å; C46-K48 VanDerWaalsContact O-N 3.09Å; C46-C49 HydrophobicContact CB-CB 4.4Å; C46-C49 PolarHBondContact O-N 2.75Å; C46-I50 PolarHBondContact O-N 3.44Å; C46-I50 VanDerWaalsContact O-N 3.16Å
47	Y	94.1	Very high	91.5	Very high	72 Å²	72	63.6 Å²	63.6	28%	0.282	31%	0.314	S	S	.	.	H	α-helix	trans	-51.4	-38.2	-179.6	176	-112.3	0	0	0	113.1	N34 R36 R51 I70	N34-Y47 WeakPolarHBondContact O-CB 3.27Å; N34-Y47 PolarHBondContact O-N 3.32Å; R36-Y47 HydrophobicContact CG-CD2 3.94Å; R36-Y47 HydrophobicContact CG-CG 4.33Å; Y47-R51 WeakPolarHBondContact O-CB 3.49Å; Y47-R51 PolarHBondContact O-N 3.13Å; Y47-I70 HydrophobicContact CE2-CG2 3.93Å
48	K	93.1	Very high	91.1	Very high	165 Å²	165	70.4 Å²	70.4	72%	0.717	34%	0.337	S	S	*	.	H	α-helix	trans	-59	-50.3	175.6	-68.1	-176.4	-179.9	177	0	111.9	C46 K52	C46-K48 PolarHBondContact O-N 3.44Å; C46-K48 VanDerWaalsContact O-N 3.09Å; K48-K52 WeakPolarHBondContact O-CB 3.45Å; K48-K52 PolarHBondContact O-N 2.8Å
49	C	95.3	Very high	91.1	Very high	29 Å²	29	73.1 Å²	73.1	20%	0.196	36%	0.356	C	S	.	.	H	α-helix	trans	-66	-47.7	-175	-54.5	0	0	0	0	111.9	I27 C46 K52 W53	I27-C49 HydrophobicContact CB-CB 3.88Å; I27-C49 HydrophobicContact CD1-CB 4.01Å; I27-C49 HydrophobicContact CG2-CB 3.86Å; C46-C49 HydrophobicContact CB-CB 4.4Å; C46-C49 PolarHBondContact O-N 2.75Å; C49-K52 WeakPolarHBondContact O-CB 3.38Å; C49-K52 PolarHBondContact O-N 3.23Å; C49-W53 PolarHBondContact O-N 3.05Å
50	I	92.5	Very high	91.3	Very high	1 Å²	1	74 Å²	74	1%	0.005	36%	0.356	C	S	.	.	H	α-helix	trans	-72.5	-32.6	-179.6	-170.1	60.6	0	0	0	112.3	I27 R36 C45 C46 I54 P62 L73	I27-I50 HydrophobicContact CD1-CB 3.9Å; I27-I50 HydrophobicContact CD1-CD1 3.94Å; I27-I50 HydrophobicContact CD1-CG1 4.5Å; R36-I50 HydrophobicContact CB-CG2 4.24Å; R36-I50 HydrophobicContact CG-CG2 4.4Å; C45-I50 HydrophobicContact CB-CB 4.34Å; C45-I50 VanDerWaalsContact SG-CB 3.54Å; C46-I50 PolarHBondContact O-N 3.44Å; C46-I50 VanDerWaalsContact O-N 3.16Å; I50-I54 HydrophobicContact CD1-CD1 4.03Å; I50-I54 HydrophobicContact CD1-CG1 4.19Å; I50-I54 HydrophobicContact CG1-CD1 3.8Å; I50-I54 HydrophobicContact CG1-CG1 4.36Å; I50-I54 WeakPolarHBondContact O-CB 3.43Å; I50-I54 VanDerWaalsContact O-CG1 3.32Å; I50-I54 WeakPolarHBondContact O-CG1 3.29Å; I50-I54 PolarHBondContact O-N 3.19Å; I50-P62 HydrophobicContact CD1-CG 4.17Å; I50-L73 HydrophobicContact CB-CD1 4.46Å; I50-L73 HydrophobicContact CG1-CD1 4.04Å; I50-L73 HydrophobicContact CG1-CD2 3.81Å; I50-L73 HydrophobicContact CG2-CD1 3.58Å; I50-L73 HydrophobicContact CG2-CD2 4.29Å
51	R	92.6	Very high	91.4	Very high	126 Å²	126	69.1 Å²	69.1	48%	0.475	33%	0.333	S	S	.	.	H	α-helix	trans	-64.4	-44.6	169.9	-178.9	177.2	-179.8	-84.2	-0.6	111.1	Y47 T55 I70	Y47-R51 WeakPolarHBondContact O-CB 3.49Å; Y47-R51 PolarHBondContact O-N 3.13Å; R51-T55 WeakPolarHBondContact O-CB 3.36Å; R51-T55 PolarHBondContact O-N 2.92Å; R51-T55 VanDerWaalsContact O-N 3.07Å; R51-T55 PolarHBondContact O-OG1 2.85Å; R51-I70 HydrophobicContact CG-CD1 4.03Å; R51-I70 HydrophobicContact CG-CG1 4.42Å
52	K	92.9	Very high	91.2	Very high	126 Å²	126	69.4 Å²	69.4	55%	0.548	33%	0.334	S	S	.	.	H	α-helix	trans	-56	-53.4	176.2	-164.3	-179.8	-179.4	-179.6	0	109.7	K48 C49 I54 T55 E56	K48-K52 WeakPolarHBondContact O-CB 3.45Å; K48-K52 PolarHBondContact O-N 2.8Å; C49-K52 WeakPolarHBondContact O-CB 3.38Å; C49-K52 PolarHBondContact O-N 3.23Å; K52-I54 PolarHBondContact O-N 3.43Å; K52-T55 PolarHBondContact O-N 3.46Å; K52-E56 WeakPolarHBondContact CE-OE2 3.38Å; K52-E56 VanDerWaalsContact CG-CD 3.41Å; K52-E56 HydrophobicContact CG-CG 4.37Å; K52-E56 WeakPolarHBondContact CG-OE1 3.31Å; K52-E56 VanDerWaalsContact CG-OE2 3.28Å; K52-E56 WeakPolarHBondContact CG-OE2 3.17Å; K52-E56 IonicContact NZ-OE2 3.21Å; K52-E56 VanDerWaalsContact O-CB 3.28Å; K52-E56 WeakPolarHBondContact O-CB 3.46Å; K52-E56 PolarHBondContact O-N 3.18Å
53	W	92.2	Very high	91.2	Very high	92 Å²	92	70 Å²	70	35%	0.348	33%	0.327	S	S	.	.	H	α-helix	trans	-55.6	-54.6	177.6	-173.1	-86.6	0	0	0	113.9	C49 T55 E56 T57 R58 Q60 P62	C49-W53 PolarHBondContact O-N 3.05Å; W53-T55 PolarHBondContact O-N 3.44Å; W53-E56 PolarHBondContact O-N 3.49Å; W53-T57 HydrophobicContact CE3-CG2 4.24Å; W53-T57 HydrophobicContact CZ3-CG2 4.38Å; W53-T57 PolarHBondContact O-N 3.12Å; W53-T57 PolarHBondContact O-OG1 3.11Å; W53-R58 PolarHBondContact O-N 2.89Å; W53-Q60 VanDerWaalsContact CD1-O 3.29Å; W53-Q60 PolarHBondContact NE1-O 3.15Å; W53-Q60 VanDerWaalsContact NE1-O 3.11Å; W53-P62 HydrophobicContact CB-CG 4.5Å; W53-P62 HydrophobicContact CD2-CB 4.21Å; W53-P62 HydrophobicContact CD2-CG 3.71Å; W53-P62 HydrophobicContact CE3-CG 4.44Å; W53-P62 HydrophobicContact CG-CG 3.71Å; W53-P62 HydrophobicContact CZ2-CB 3.99Å; W53-P62 HydrophobicContact CZ2-CG 4.35Å
54	I	91	Very high	91.4	Very high	15 Å²	15	68.5 Å²	68.5	8%	0.077	33%	0.326	C	S	.	.	H	α-helix	trans	-62.5	-28.1	-177.3	-69.3	170.5	0	0	0	112.2	I50 K52 R58 L68 I70 L73	I50-I54 HydrophobicContact CD1-CD1 4.03Å; I50-I54 HydrophobicContact CD1-CG1 4.19Å; I50-I54 HydrophobicContact CG1-CD1 3.8Å; I50-I54 HydrophobicContact CG1-CG1 4.36Å; I50-I54 WeakPolarHBondContact O-CB 3.43Å; I50-I54 VanDerWaalsContact O-CG1 3.32Å; I50-I54 WeakPolarHBondContact O-CG1 3.29Å; I50-I54 PolarHBondContact O-N 3.19Å; K52-I54 PolarHBondContact O-N 3.43Å; I54-R58 WeakPolarHBondContact CA-O 3.46Å; I54-L68 HydrophobicContact CD1-CB 4.39Å; I54-L68 HydrophobicContact CD1-CD2 4.07Å; I54-L68 HydrophobicContact CD1-CG 3.92Å; I54-L68 WeakPolarHBondContact CG2-O 3.5Å; I54-I70 HydrophobicContact CB-CG1 4.15Å; I54-I70 HydrophobicContact CG2-CD1 4.37Å; I54-I70 HydrophobicContact CG2-CG1 3.7Å; I54-L73 HydrophobicContact CD1-CD1 4.23Å
55	T	89.4	Confident	91.4	Very high	85 Å²	85	77.4 Å²	77.4	52%	0.521	36%	0.359	S	S	.	.	H	α-helix	trans	-90.3	-35.2	-179	-41.1	0	0	0	0	113.1	R51 K52 W53	R51-T55 WeakPolarHBondContact O-CB 3.36Å; R51-T55 PolarHBondContact O-N 2.92Å; R51-T55 VanDerWaalsContact O-N 3.07Å; R51-T55 PolarHBondContact O-OG1 2.85Å; K52-T55 PolarHBondContact O-N 3.46Å; W53-T55 PolarHBondContact O-N 3.44Å
56	E	90.1	Very high	91.5	Very high	135 Å²	135	78.8 Å²	78.8	63%	0.631	37%	0.371	S	S	*	.	H	α-helix	trans	-108.5	-24.6	-167.2	-63.2	174.4	-158.6	0	0	114.3	K52 W53	K52-E56 WeakPolarHBondContact CE-OE2 3.38Å; K52-E56 VanDerWaalsContact CG-CD 3.41Å; K52-E56 HydrophobicContact CG-CG 4.37Å; K52-E56 WeakPolarHBondContact CG-OE1 3.31Å; K52-E56 VanDerWaalsContact CG-OE2 3.28Å; K52-E56 WeakPolarHBondContact CG-OE2 3.17Å; K52-E56 IonicContact NZ-OE2 3.21Å; K52-E56 VanDerWaalsContact O-CB 3.28Å; K52-E56 WeakPolarHBondContact O-CB 3.46Å; K52-E56 PolarHBondContact O-N 3.18Å; W53-E56 PolarHBondContact O-N 3.49Å
57	T	85.4	Confident	91.3	Very high	81 Å²	81	82.3 Å²	82.3	50%	0.497	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-69.5	179.7	63.6	0	0	0	0	112.3	W53	W53-T57 HydrophobicContact CE3-CG2 4.24Å; W53-T57 HydrophobicContact CZ3-CG2 4.38Å; W53-T57 PolarHBondContact O-N 3.12Å; W53-T57 PolarHBondContact O-OG1 3.11Å
58	R	84.9	Confident	91.1	Very high	176 Å²	176	78.9 Å²	78.9	66%	0.664	38%	0.382	S	S	*	.			trans	-152.7	143.1	177.9	-67.8	-170.2	177.1	155	3.4	111.6	W53 I54 Q60	W53-R58 PolarHBondContact O-N 2.89Å; I54-R58 WeakPolarHBondContact CA-O 3.46Å; R58-Q60 HydrophobicContact CB-CB 4.44Å; R58-Q60 PolarHBondContact O-N 3.32Å
59	S	90.9	Very high	90.9	Very high	57 Å²	57	74.9 Å²	74.9	40%	0.399	37%	0.366	S	S	.	.	S	Bend	trans	-74.1	53.8	170.5	61.6	0	0	0	0	112.7	S67 L68	S59-S67 WeakPolarHBondContact O-CA 3.28Å; S59-L68 CarbonylContact C-O 3.57Å; S59-L68 PolarHBondContact O-N 2.91Å
60	Q	92.6	Very high	90.6	Very high	76 Å²	76	76.1 Å²	76.1	36%	0.355	37%	0.37	S	S	.	.	B	Isolated β-bridge	trans	-140.7	145.2	179.4	-72.7	175.4	-11.3	0	0	108.8	W53 R58 R65 A66	W53-Q60 VanDerWaalsContact CD1-O 3.29Å; W53-Q60 PolarHBondContact NE1-O 3.15Å; W53-Q60 VanDerWaalsContact NE1-O 3.11Å; R58-Q60 HydrophobicContact CB-CB 4.44Å; R58-Q60 PolarHBondContact O-N 3.32Å; Q60-R65 WeakPolarHBondContact CG-O 3.45Å; Q60-A66 CarbonylContact C-O 3.58Å; Q60-A66 WeakPolarHBondContact CA-O 3.38Å
61	C	92.9	Very high	90.4	Very high	1 Å²	1	84.5 Å²	84.5	1%	0.007	40%	0.403	C	S	.	.			trans	-61.9	128.4	172.2	-176	0	0	0	0	110.3	H63 C64 R65 A66 L68	C61-H63 PolarHBondContact O-N 3.48Å; C61-C64 VanDerWaalsContact CB-SG 3.52Å; C61-R65 VanDerWaalsContact O-CA 3.25Å; C61-R65 WeakPolarHBondContact O-CA 3.38Å; C61-R65 PolarHBondContact O-N 3.49Å; C61-A66 PolarHBondContact N-O 2.85Å; C61-L68 HydrophobicContact CB-CD2 3.9Å
62	P	89.3	Confident	90.3	Very high	39 Å²	39	81.6 Å²	81.6	25%	0.253	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-34.2	178.8	-12.1	16.4	0	0	0	113	F26 I27 I50 W53	F26-P62 HydrophobicContact CE2-CB 3.89Å; F26-P62 HydrophobicContact CE2-CG 3.69Å; F26-P62 HydrophobicContact CZ-CG 4.44Å; I27-P62 HydrophobicContact CD1-CG 3.96Å; I27-P62 HydrophobicContact CG1-CG 4.16Å; I50-P62 HydrophobicContact CD1-CG 4.17Å; W53-P62 HydrophobicContact CB-CG 4.5Å; W53-P62 HydrophobicContact CD2-CB 4.21Å; W53-P62 HydrophobicContact CD2-CG 3.71Å; W53-P62 HydrophobicContact CE3-CG 4.44Å; W53-P62 HydrophobicContact CG-CG 3.71Å; W53-P62 HydrophobicContact CZ2-CB 3.99Å; W53-P62 HydrophobicContact CZ2-CG 4.35Å
63	H	89.8	Confident	90.1	Very high	98 Å²	98	76.1 Å²	76.1	45%	0.454	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-56	-176.5	-175.2	-86.6	0	0	0	113	F26 C61	F26-H63 HydrophobicContact CD2-CB 3.96Å; F26-H63 HydrophobicContact CE2-CB 3.74Å; F26-H63 HydrophobicContact CZ-CB 4.18Å; C61-H63 PolarHBondContact O-N 3.48Å
64	C	93	Very high	90	Very high	46 Å²	46	76 Å²	76	31%	0.311	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-2	-174.1	67.3	0	0	0	0	115.5	C41 C61 A66	C41-C64 HydrophobicContact CB-CB 3.6Å; C61-C64 VanDerWaalsContact CB-SG 3.52Å; C64-A66 PolarHBondContact O-N 2.97Å
65	R	92.3	Very high	90.1	Very high	198 Å²	198	78.6 Å²	78.6	75%	0.747	39%	0.39	S	S	*	.			trans	60.5	-1.1	-179.9	-53.2	178.4	-178.4	176.3	-0.3	116.2	Q60 C61	Q60-R65 WeakPolarHBondContact CG-O 3.45Å; C61-R65 VanDerWaalsContact O-CA 3.25Å; C61-R65 WeakPolarHBondContact O-CA 3.38Å; C61-R65 PolarHBondContact O-N 3.49Å
66	A	92.7	Very high	89.9	Confident	31 Å²	31	74.7 Å²	74.7	26%	0.256	37%	0.367	S	S	.	.			trans	-58.8	142.5	170	0	0	0	0	0	110.8	H40 Q60 C61 C64 L68	H40-A66 HydrophobicContact CB-CB 3.87Å; Q60-A66 CarbonylContact C-O 3.58Å; Q60-A66 WeakPolarHBondContact CA-O 3.38Å; C61-A66 PolarHBondContact N-O 2.85Å; C64-A66 PolarHBondContact O-N 2.97Å; A66-L68 PolarHBondContact O-N 3.47Å
67	S	91.4	Very high	89.4	Confident	80 Å²	80	77.8 Å²	77.8	56%	0.559	37%	0.372	S	S	*	.	B	Isolated β-bridge	trans	-53.9	132.9	172.3	49.7	0	0	0	0	110.6	H40 S59	H40-S67 PolarHBondContact NE2-O 3.01Å; S59-S67 WeakPolarHBondContact O-CA 3.28Å
68	L	89.2	Confident	89.3	Confident	0 Å²	0	80 Å²	80	0%	0	37%	0.372	C	S	.	.			trans	-152	126.6	-175.4	-173.7	64	0	0	0	111.3	C38 P39 I54 S59 C61 A66 E72 L73	C38-L68 HydrophobicContact CB-CD2 4.36Å; P39-L68 HydrophobicContact CG-CD1 3.97Å; I54-L68 HydrophobicContact CD1-CB 4.39Å; I54-L68 HydrophobicContact CD1-CD2 4.07Å; I54-L68 HydrophobicContact CD1-CG 3.92Å; I54-L68 WeakPolarHBondContact CG2-O 3.5Å; S59-L68 CarbonylContact C-O 3.57Å; S59-L68 PolarHBondContact O-N 2.91Å; C61-L68 HydrophobicContact CB-CD2 3.9Å; A66-L68 PolarHBondContact O-N 3.47Å; L68-E72 WeakPolarHBondContact CA-OE2 3.46Å; L68-E72 HydrophobicContact CD1-CB 3.87Å; L68-L73 HydrophobicContact CD2-CD2 3.82Å; L68-L73 HydrophobicContact CG-CD2 4.35Å
69	H	89.1	Confident	89	Confident	81 Å²	81	71.7 Å²	71.7	38%	0.375	34%	0.34	S	S	.	.			trans	-105.7	157.8	173.4	-67.1	-80.4	0	0	0	112.3	Y71 E72	H69-Y71 HydrophobicContact CB-CD1 3.87Å; H69-Y71 HydrophobicContact CB-CE1 3.33Å; H69-Y71 HydrophobicContact CB-CE2 4.31Å; H69-Y71 PolarHBondContact CD2-OH 3Å; H69-Y71 AromaticContact CG-CE1 3.84Å; H69-Y71 AromaticContact CG-CZ 3.96Å; H69-Y71 PolarHBondContact O-N 2.8Å; H69-Y71 VanDerWaalsContact O-N 3.17Å; H69-E72 HydrophobicContact CB-CG 4.29Å; H69-E72 IonicContact CD2-OE1 2.7Å; H69-E72 IonicContact CD2-OE2 3.19Å; H69-E72 PolarHBondContact N-OE2 3.23Å; H69-E72 WeakPolarHBondContact O-CB 3.34Å; H69-E72 PolarHBondContact O-N 3.13Å
70	I	88.8	Confident	88.3	Confident	54 Å²	54	72.3 Å²	72.3	28%	0.277	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-60	-31.7	-173.6	-59.1	160.2	0	0	0	112.4	Y47 R51 I54 E72	Y47-I70 HydrophobicContact CE2-CG2 3.93Å; R51-I70 HydrophobicContact CG-CD1 4.03Å; R51-I70 HydrophobicContact CG-CG1 4.42Å; I54-I70 HydrophobicContact CB-CG1 4.15Å; I54-I70 HydrophobicContact CG2-CD1 4.37Å; I54-I70 HydrophobicContact CG2-CG1 3.7Å; I70-E72 VanDerWaalsContact C-N 3.28Å; I70-E72 PolarHBondContact O-N 3.18Å
71	Y	88.4	Confident	87.7	Confident	178 Å²	178	74.7 Å²	74.7	70%	0.698	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-77.5	-10.5	-179.9	61.3	-100.2	0	0	0	113.7	H69	H69-Y71 HydrophobicContact CB-CD1 3.87Å; H69-Y71 HydrophobicContact CB-CE1 3.33Å; H69-Y71 HydrophobicContact CB-CE2 4.31Å; H69-Y71 PolarHBondContact CD2-OH 3Å; H69-Y71 AromaticContact CG-CE1 3.84Å; H69-Y71 AromaticContact CG-CZ 3.96Å; H69-Y71 PolarHBondContact O-N 2.8Å; H69-Y71 VanDerWaalsContact O-N 3.17Å
72	E	89.5	Confident	87	Confident	65 Å²	65	76.7 Å²	76.7	30%	0.304	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-92.5	-6.1	-178.6	-57.5	167.9	167.2	0	0	111.7	L68 H69 I70 I74	L68-E72 WeakPolarHBondContact CA-OE2 3.46Å; L68-E72 HydrophobicContact CD1-CB 3.87Å; H69-E72 HydrophobicContact CB-CG 4.29Å; H69-E72 IonicContact CD2-OE1 2.7Å; H69-E72 IonicContact CD2-OE2 3.19Å; H69-E72 PolarHBondContact N-OE2 3.23Å; H69-E72 WeakPolarHBondContact O-CB 3.34Å; H69-E72 PolarHBondContact O-N 3.13Å; I70-E72 VanDerWaalsContact C-N 3.28Å; I70-E72 PolarHBondContact O-N 3.18Å; E72-I74 PolarHBondContact O-N 2.71Å
73	L	89.6	Confident	86.4	Confident	10 Å²	10	75.2 Å²	75.2	5%	0.052	35%	0.353	C	S	.	.			trans	-76.4	108.5	-178.8	-68.1	171	0	0	0	112.3	R36 I50 I54 L68 N75	R36-L73 HydrophobicContact CB-CB 4.26Å; R36-L73 HydrophobicContact CB-CD2 4.4Å; R36-L73 HydrophobicContact CG-CB 4.37Å; I50-L73 HydrophobicContact CB-CD1 4.46Å; I50-L73 HydrophobicContact CG1-CD1 4.04Å; I50-L73 HydrophobicContact CG1-CD2 3.81Å; I50-L73 HydrophobicContact CG2-CD1 3.58Å; I50-L73 HydrophobicContact CG2-CD2 4.29Å; I54-L73 HydrophobicContact CD1-CD1 4.23Å; L68-L73 HydrophobicContact CD2-CD2 3.82Å; L68-L73 HydrophobicContact CG-CD2 4.35Å; L73-N75 PolarHBondContact O-N 2.93Å
74	I	90.4	Very high	85.8	Confident	90 Å²	90	76.3 Å²	76.3	46%	0.462	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	131.6	176.8	-62.2	175.2	0	0	0	109.5	R36 L37 P39 E72	R36-I74 VanDerWaalsContact CA-O 3.3Å; R36-I74 WeakPolarHBondContact CA-O 3.23Å; L37-I74 HydrophobicContact CB-CB 4.31Å; L37-I74 HydrophobicContact CD2-CB 4.28Å; L37-I74 HydrophobicContact CD2-CD1 3.92Å; L37-I74 PolarHBondContact N-O 3.26Å; L37-I74 PolarHBondContact O-N 2.96Å; P39-I74 HydrophobicContact CB-CD1 4.22Å; E72-I74 PolarHBondContact O-N 2.71Å
75	N	91.6	Very high	85.1	Confident	69 Å²	69	79.9 Å²	79.9	37%	0.369	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	108	-176.6	-172.5	26	0	0	0	111.6	R36 L73 R77	R36-N75 VanDerWaalsContact CZ-OD1 3.29Å; R36-N75 PolarHBondContact NE-OD1 2.68Å; R36-N75 PolarHBondContact NH2-OD1 3.42Å; R36-N75 VanDerWaalsContact NH2-OD1 3.14Å; L73-N75 PolarHBondContact O-N 2.93Å; N75-R77 PolarHBondContact O-N 3.48Å; N75-R77 VanDerWaalsContact O-N 3.12Å
76	C	87.1	Confident	84.3	Confident	4 Å²	4	71.4 Å²	71.4	3%	0.027	34%	0.34	C	S	.	.			trans	-90.3	67.4	-174.4	-70.3	0	0	0	0	111.9	A35 L37 L44 W78 A79	A35-C76 HydrophobicContact CB-CB 3.98Å; A35-C76 PolarHBondContact O-N 3.28Å; L37-C76 WeakPolarHBondContact CB-SG 3.3Å; L44-C76 HydrophobicContact CD2-CB 4.07Å; C76-W78 PolarHBondContact O-N 3.4Å; C76-W78 VanDerWaalsContact O-N 3.12Å; C76-A79 HydrophobicContact CB-CB 4Å; C76-A79 WeakPolarHBondContact O-CB 3.24Å; C76-A79 PolarHBondContact O-N 3.03Å
77	R	79.2	Confident	83.5	Confident	200 Å²	200	73.2 Å²	73.2	76%	0.755	35%	0.345	S	S	*	.	H	α-helix	trans	-51.9	-33.6	179.7	-79.9	-179.4	153.4	163.2	-7.1	114.8	N75 A79	N75-R77 PolarHBondContact O-N 3.48Å; N75-R77 VanDerWaalsContact O-N 3.12Å; R77-A79 VanDerWaalsContact C-N 3.3Å; R77-A79 PolarHBondContact O-N 3.09Å
78	W	82.1	Confident	82.8	Confident	128 Å²	128	73.1 Å²	73.1	49%	0.485	34%	0.338	S	S	.	.	H	α-helix	trans	-72.4	-20.4	178.7	62.8	-98	0	0	0	113.5	F23 C76 D80 E81 V82	F23-W78 AromaticContact CE1-CH2 3.7Å; F23-W78 HydrophobicContact CE1-CH2 3.7Å; F23-W78 AromaticContact CE1-CZ3 3.52Å; F23-W78 HydrophobicContact CE1-CZ3 3.52Å; F23-W78 HydrophobicContact CZ-CH2 4.07Å; F23-W78 AromaticContact CZ-CZ3 3.83Å; F23-W78 HydrophobicContact CZ-CZ3 3.83Å; C76-W78 PolarHBondContact O-N 3.4Å; C76-W78 VanDerWaalsContact O-N 3.12Å; W78-D80 VanDerWaalsContact C-N 3.35Å; W78-E81 PolarHBondContact O-N 2.89Å; W78-V82 HydrophobicContact CE3-CB 4.12Å; W78-V82 HydrophobicContact CE3-CG2 3.71Å; W78-V82 HydrophobicContact CZ3-CB 4.19Å; W78-V82 HydrophobicContact CZ3-CG1 4.43Å; W78-V82 HydrophobicContact CZ3-CG2 4.05Å; W78-V82 PolarHBondContact O-N 2.9Å
79	A	79.9	Confident	81.9	Confident	0 Å²	0	77.8 Å²	77.8	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-72	-31.7	-175.3	0	0	0	0	0	111.7	A35 C76 R77 E81 V82 T83	A35-A79 HydrophobicContact CB-CB 3.67Å; C76-A79 HydrophobicContact CB-CB 4Å; C76-A79 WeakPolarHBondContact O-CB 3.24Å; C76-A79 PolarHBondContact O-N 3.03Å; R77-A79 VanDerWaalsContact C-N 3.3Å; R77-A79 PolarHBondContact O-N 3.09Å; A79-E81 VanDerWaalsContact C-N 3.29Å; A79-E81 PolarHBondContact O-N 3.48Å; A79-V82 PolarHBondContact O-N 3.32Å; A79-T83 WeakPolarHBondContact O-CB 2.93Å; A79-T83 PolarHBondContact O-N 3.12Å; A79-T83 PolarHBondContact O-OG1 3.34Å
80	D	76.4	Confident	80.9	Confident	71 Å²	71	78 Å²	78	38%	0.38	36%	0.364	S	S	.	.	H	α-helix	trans	-63.2	-38.4	174.5	-60	-33.2	0	0	0	110.2	N34 W78 Q84	N34-D80 PolarHBondContact N-OD1 3.3Å; W78-D80 VanDerWaalsContact C-N 3.35Å; D80-Q84 WeakPolarHBondContact O-CB 3.23Å; D80-Q84 PolarHBondContact O-N 3.33Å; D80-Q84 VanDerWaalsContact O-N 3.1Å
81	E	79.6	Confident	79.7	Confident	126 Å²	126	78.1 Å²	78.1	59%	0.589	37%	0.369	S	S	*	.	H	α-helix	trans	-69.6	-48.2	174.4	-64.1	176.9	155.4	0	0	112.6	W78 A79 T83 Q84 Q85	W78-E81 PolarHBondContact O-N 2.89Å; A79-E81 VanDerWaalsContact C-N 3.29Å; A79-E81 PolarHBondContact O-N 3.48Å; E81-T83 PolarHBondContact O-N 2.87Å; E81-Q84 CarbonylContact O-C 3.57Å; E81-Q84 WeakPolarHBondContact O-CA 2.99Å; E81-Q84 WeakPolarHBondContact O-CB 3.5Å; E81-Q84 PolarHBondContact O-N 3.48Å; E81-Q84 VanDerWaalsContact O-N 3.08Å; E81-Q85 WeakPolarHBondContact O-CG 3.36Å; E81-Q85 PolarHBondContact O-N 2.92Å
82	V	77.8	Confident	78.4	Confident	42 Å²	42	76.1 Å²	76.1	26%	0.255	37%	0.366	S	S	.	.	H	α-helix	trans	-65.2	-39.7	180	169.4	0	0	0	0	111.4	F23 W78 A79 Q84 Q85 L86	F23-V82 HydrophobicContact CE1-CG1 4.07Å; F23-V82 HydrophobicContact CE2-CG1 4Å; F23-V82 HydrophobicContact CZ-CG1 3.72Å; W78-V82 HydrophobicContact CE3-CB 4.12Å; W78-V82 HydrophobicContact CE3-CG2 3.71Å; W78-V82 HydrophobicContact CZ3-CB 4.19Å; W78-V82 HydrophobicContact CZ3-CG1 4.43Å; W78-V82 HydrophobicContact CZ3-CG2 4.05Å; W78-V82 PolarHBondContact O-N 2.9Å; A79-V82 PolarHBondContact O-N 3.32Å; V82-Q84 PolarHBondContact O-N 2.78Å; V82-Q85 PolarHBondContact O-N 2.85Å; V82-L86 HydrophobicContact CG1-CD1 4.33Å; V82-L86 WeakPolarHBondContact O-CG 3.35Å; V82-L86 PolarHBondContact O-N 3.1Å
83	T	77.3	Confident	76.7	Confident	8 Å²	8	76.1 Å²	76.1	5%	0.049	38%	0.378	C	S	.	.	H	α-helix	trans	-74.2	-16.1	175.3	-28.2	0	0	0	0	111.8	F23 K31 A79 E81 D87	F23-T83 HydrophobicContact CB-CG2 3.91Å; K31-T83 HydrophobicContact CD-CG2 4.26Å; K31-T83 WeakPolarHBondContact CE-O 3.49Å; K31-T83 HydrophobicContact CG-CG2 3.8Å; K31-T83 PolarHBondContact NZ-O 2.9Å; A79-T83 WeakPolarHBondContact O-CB 2.93Å; A79-T83 PolarHBondContact O-N 3.12Å; A79-T83 PolarHBondContact O-OG1 3.34Å; E81-T83 PolarHBondContact O-N 2.87Å; T83-D87 PolarHBondContact O-N 3.39Å
84	Q	76	Confident	74.8	Confident	122 Å²	122	80.7 Å²	80.7	57%	0.57	41%	0.406	S	S	*	.	H	α-helix	trans	-79.9	-34.6	166.5	-171.9	170.4	59.2	0	0	111.8	D80 E81 V82 N88	D80-Q84 WeakPolarHBondContact O-CB 3.23Å; D80-Q84 PolarHBondContact O-N 3.33Å; D80-Q84 VanDerWaalsContact O-N 3.1Å; E81-Q84 CarbonylContact O-C 3.57Å; E81-Q84 WeakPolarHBondContact O-CA 2.99Å; E81-Q84 WeakPolarHBondContact O-CB 3.5Å; E81-Q84 PolarHBondContact O-N 3.48Å; E81-Q84 VanDerWaalsContact O-N 3.08Å; V82-Q84 PolarHBondContact O-N 2.78Å; Q84-N88 WeakPolarHBondContact O-CB 3.46Å; Q84-N88 PolarHBondContact O-N 3.27Å; Q84-N88 PolarHBondContact O-ND2 2.9Å
85	Q	78.2	Confident	72.7	Confident	120 Å²	120	81 Å²	81	56%	0.561	42%	0.416	S	S	*	.	H	α-helix	trans	-66.9	-36.3	172.1	-69.2	176.6	16.7	0	0	112.2	E81 V82 N88 L89	E81-Q85 WeakPolarHBondContact O-CG 3.36Å; E81-Q85 PolarHBondContact O-N 2.92Å; V82-Q85 PolarHBondContact O-N 2.85Å; Q85-N88 PolarHBondContact O-N 2.85Å; Q85-L89 WeakPolarHBondContact O-CG 3.35Å; Q85-L89 PolarHBondContact O-N 2.96Å
86	L	76	Confident	70.5	Confident	21 Å²	21	82 Å²	82	11%	0.11	43%	0.428	C	S	.	.	H	α-helix	trans	-64.2	-46.6	173.5	-73.6	167.6	0	0	0	112.2	F16 F23 V82 N88 L89 Q90	F16-L86 HydrophobicContact CE2-CD2 3.98Å; F16-L86 HydrophobicContact CZ-CD2 4.48Å; F23-L86 HydrophobicContact CB-CD1 4.25Å; F23-L86 HydrophobicContact CD2-CD1 3.41Å; F23-L86 VanDerWaalsContact CD2-CD1 3.41Å; F23-L86 HydrophobicContact CE2-CD1 4.01Å; F23-L86 HydrophobicContact CG-CD1 3.99Å; V82-L86 HydrophobicContact CG1-CD1 4.33Å; V82-L86 WeakPolarHBondContact O-CG 3.35Å; V82-L86 PolarHBondContact O-N 3.1Å; L86-N88 VanDerWaalsContact C-N 3.3Å; L86-N88 PolarHBondContact O-N 2.8Å; L86-L89 PolarHBondContact O-N 3.15Å; L86-Q90 WeakPolarHBondContact O-CB 3.21Å; L86-Q90 PolarHBondContact O-N 3.34Å
87	D	75	Confident	68.1	Low	68 Å²	68	92.5 Å²	92.5	36%	0.364	47%	0.467	S	S	.	.	H	α-helix	trans	-58.4	-40.2	172	-75.2	36	0	0	0	112.3	K31 T83 L89 Q90 S91	K31-D87 WeakPolarHBondContact CE-OD1 3.36Å; K31-D87 IonicContact NZ-OD1 3.68Å; K31-D87 PolarHBondContact NZ-OD1 2.78Å; K31-D87 IonicContact NZ-OD2 3.61Å; K31-D87 PolarHBondContact NZ-OD2 3.39Å; T83-D87 PolarHBondContact O-N 3.39Å; D87-L89 VanDerWaalsContact C-N 3.34Å; D87-Q90 PolarHBondContact O-N 3.05Å; D87-S91 WeakPolarHBondContact O-CB 3.35Å; D87-S91 PolarHBondContact O-N 2.85Å; D87-S91 PolarHBondContact O-OG 3.1Å
88	N	78	Confident	65.9	Low	79 Å²	79	88.9 Å²	88.9	42%	0.422	47%	0.473	S	S	.	.	H	α-helix	trans	-66	-35.3	177.4	-72.1	-19	0	0	0	112.1	Q84 Q85 L86 S91 Q92	Q84-N88 WeakPolarHBondContact O-CB 3.46Å; Q84-N88 PolarHBondContact O-N 3.27Å; Q84-N88 PolarHBondContact O-ND2 2.9Å; Q85-N88 PolarHBondContact O-N 2.85Å; L86-N88 VanDerWaalsContact C-N 3.3Å; L86-N88 PolarHBondContact O-N 2.8Å; N88-S91 WeakPolarHBondContact CA-OG 3.45Å; N88-S91 PolarHBondContact O-OG 2.82Å; N88-Q92 WeakPolarHBondContact O-CB 3.29Å; N88-Q92 WeakPolarHBondContact O-CG 3.39Å; N88-Q92 PolarHBondContact O-N 3.47Å; N88-Q92 PolarHBondContact O-NE2 2.75Å
89	L	70.7	Confident	63.6	Low	98 Å²	98	86.1 Å²	86.1	51%	0.513	48%	0.484	S	S	.	.	H	α-helix	trans	-71.7	-39.5	172.9	-73.4	165.2	0	0	0	111.6	F16 Q85 L86 D87 Q92 A93	F16-L89 HydrophobicContact CE2-CB 4.43Å; Q85-L89 WeakPolarHBondContact O-CG 3.35Å; Q85-L89 PolarHBondContact O-N 2.96Å; L86-L89 PolarHBondContact O-N 3.15Å; D87-L89 VanDerWaalsContact C-N 3.34Å; L89-Q92 PolarHBondContact O-N 2.97Å; L89-A93 PolarHBondContact O-N 3.13Å
90	Q	67.5	Low	61.5	Low	86 Å²	86	92 Å²	92	40%	0.402	53%	0.525	S	S	.	.	H	α-helix	trans	-65	-42.7	177.5	-159.6	168.9	9	0	0	111.7	F16 L86 D87 A93 T94	F16-Q90 HydrophobicContact CE1-CB 4.11Å; F16-Q90 HydrophobicContact CE1-CG 3.84Å; F16-Q90 HydrophobicContact CZ-CB 3.73Å; F16-Q90 HydrophobicContact CZ-CG 4.01Å; L86-Q90 WeakPolarHBondContact O-CB 3.21Å; L86-Q90 PolarHBondContact O-N 3.34Å; D87-Q90 PolarHBondContact O-N 3.05Å; Q90-A93 WeakPolarHBondContact O-CB 3.34Å; Q90-A93 PolarHBondContact O-N 3.45Å; Q90-T94 PolarHBondContact O-N 2.89Å; Q90-T94 PolarHBondContact O-OG1 3.47Å
91	S	63.4	Low	59.3	Low	55 Å²	55	92 Å²	92	39%	0.385	54%	0.542	S	S	.	.	H	α-helix	trans	-71.4	-30.2	175.2	50.8	0	0	0	0	113.5	D87 N88 T94 S95	D87-S91 WeakPolarHBondContact O-CB 3.35Å; D87-S91 PolarHBondContact O-N 2.85Å; D87-S91 PolarHBondContact O-OG 3.1Å; N88-S91 WeakPolarHBondContact CA-OG 3.45Å; N88-S91 PolarHBondContact O-OG 2.82Å; S91-T94 WeakPolarHBondContact CA-OG1 3.48Å; S91-T94 PolarHBondContact O-OG1 3.03Å; S91-S95 VanDerWaalsContact O-CB 3.24Å; S91-S95 WeakPolarHBondContact O-CB 3.21Å; S91-S95 PolarHBondContact O-N 2.75Å; S91-S95 PolarHBondContact O-OG 3.17Å
92	Q	60.1	Low	57.4	Low	136 Å²	136	94.6 Å²	94.6	64%	0.636	55%	0.554	S	S	*	*	H	α-helix	trans	-68.3	-36.5	168.5	-77.9	171.4	42.7	0	0	112.2	N88 L89	N88-Q92 WeakPolarHBondContact O-CB 3.29Å; N88-Q92 WeakPolarHBondContact O-CG 3.39Å; N88-Q92 PolarHBondContact O-N 3.47Å; N88-Q92 PolarHBondContact O-NE2 2.75Å; L89-Q92 PolarHBondContact O-N 2.97Å
93	A	54.6	Low	55.2	Low	66 Å²	66	99.5 Å²	99.5	55%	0.545	58%	0.579	S	S	.	*	H	α-helix	trans	-64.3	-44.6	174.1	0	0	0	0	0	112	L89 Q90 S96	L89-A93 PolarHBondContact O-N 3.13Å; Q90-A93 WeakPolarHBondContact O-CB 3.34Å; Q90-A93 PolarHBondContact O-N 3.45Å; A93-S96 PolarHBondContact O-OG 3.48Å
94	T	48.9	Very low	53.3	Low	105 Å²	105	107 Å²	107	64%	0.644	62%	0.619	S	S	*	*	H	α-helix	trans	-74.7	-28.7	179.5	56.3	0	0	0	0	113.9	Q90 S91 S96	Q90-T94 PolarHBondContact O-N 2.89Å; Q90-T94 PolarHBondContact O-OG1 3.47Å; S91-T94 WeakPolarHBondContact CA-OG1 3.48Å; S91-T94 PolarHBondContact O-OG1 3.03Å; T94-S96 PolarHBondContact O-N 2.97Å
95	S	46.9	Very low	51.3	Low	96 Å²	96	107 Å²	107	67%	0.671	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	2.4	177.7	-61.2	0	0	0	0	114.7	S91	S91-S95 VanDerWaalsContact O-CB 3.24Å; S91-S95 WeakPolarHBondContact O-CB 3.21Å; S91-S95 PolarHBondContact O-N 2.75Å; S91-S95 PolarHBondContact O-OG 3.17Å
96	S	45.3	Very low	49.1	Very low	90 Å²	90	109.6 Å²	109.6	63%	0.629	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-2.6	-177.9	66.3	0	0	0	0	115.3	A93 T94	A93-S96 PolarHBondContact O-OG 3.48Å; T94-S96 PolarHBondContact O-N 2.97Å
97	R	37.2	Very low	46.8	Very low	226 Å²	226	112.6 Å²	112.6	85%	0.853	69%	0.685	S	S	*	*	S	Bend	trans	-121.8	51.7	-175.2	-73.1	177.4	66.5	177.6	-0.1	114.5
98	S	34	Very low	44.7	Very low	124 Å²	124	113.2 Å²	113.2	87%	0.867	71%	0.707	S	S	*	*	S	Bend	trans	-163.6	136.9	159.1	-85.1	0	0	0	0	112
99	G	33.6	Very low	42.4	Very low	70 Å²	70	114.9 Å²	114.9	72%	0.722	73%	0.732	S	S	*	*			trans	107	90.8	166.9	0	0	0	0	0	116.7
100	S	34.1	Very low	40.8	Very low	123 Å²	123	116 Å²	116	86%	0.86	75%	0.748	S	S	*	*			trans	31.6	119.1	144.1	60.9	0	0	0	0	121.3
101	G	30.9	Very low	39.6	Very low	71 Å²	71	117.7 Å²	117.7	73%	0.732	76%	0.764	S	S	*	*				103.7	121	104.3	0	0	0	0	0	119.4
102	Q	39.3	Very low	38.2	Very low	180 Å²	180	121.5 Å²	121.5	84%	0.841	78%	0.78	S	S	*	*			trans	61	100.6	146.5	-63.6	178.4	-10.1	0	0	118.9
103	N	32.4	Very low	36.9	Very low	146 Å²	146	122.2 Å²	122.2	78%	0.781	79%	0.788	S	S	*	*				36.7	119.7	118.8	-51.2	-2.2	0	0	0	118.3
104	N	37.4	Very low	36	Very low	166 Å²	166	126 Å²	126	89%	0.888	80%	0.804	S	S	*	*			trans	-160	114	132	-103.6	-40.9	0	0	0	112.8
105	S	33.9	Very low	35.5	Very low	121 Å²	121	128.4 Å²	128.4	85%	0.846	81%	0.812	S	S	*	*			trans	-111.7	79.9	166.3	-75.2	0	0	0	0	110
106	L	31.1	Very low	34.9	Very low	175 Å²	175	129.2 Å²	129.2	92%	0.916	82%	0.818	S	S	*	*			trans	-173.7	136.3	139.6	-126.5	66.5	0	0	0	113.2
107	G	28.6	Very low	34.3	Very low	84 Å²	84	130.8 Å²	130.8	87%	0.866	82%	0.824	S	S	*	*			trans	98.4	126	156.3	0	0	0	0	0	116.9
108	G	30	Very low	34.4	Very low	80 Å²	80	124.7 Å²	124.7	83%	0.825	82%	0.816	S	S	*	*			trans	118.8	91.3	169.1	0	0	0	0	0	113.9
109	A	30.5	Very low	35	Very low	114 Å²	114	124.4 Å²	124.4	94%	0.942	81%	0.814	S	S	*	*			trans	-80.5	130.1	171.8	0	0	0	0	0	111
110	S	36.6	Very low	35.9	Very low	123 Å²	123	125.9 Å²	125.9	86%	0.86	81%	0.809	S	S	*	*			trans	-151	158.7	156.9	-164.7	0	0	0	0	110.1
111	V	43	Very low	37.7	Very low	120 Å²	120	125.6 Å²	125.6	73%	0.727	79%	0.794	S	S	*	*			trans	-113	129.4	-164.4	173.9	0	0	0	0	111.5
112	N	33.4	Very low	40.1	Very low	136 Å²	136	124.6 Å²	124.6	73%	0.727	77%	0.774	S	S	*	*			trans	32.1	142.5	151.8	-53.2	-9.7	0	0	0	122.2
113	N	33.2	Very low	42.3	Very low	151 Å²	151	116.6 Å²	116.6	81%	0.807	74%	0.738	S	S	*	*			trans	69.5	109.4	150.1	-66.5	-1.5	0	0	0	119.5
114	T	35.1	Very low	44.7	Very low	144 Å²	144	119 Å²	119	88%	0.883	75%	0.745	S	S	*	*			trans	-143.7	80.1	147.7	-48.7	0	0	0	0	110.2
115	L	39.5	Very low	46.7	Very low	156 Å²	156	117.1 Å²	117.1	82%	0.817	73%	0.734	S	S	*	*			trans	-124.2	97.5	163.2	-173.4	65.6	0	0	0	108.4	T117	L115-T117 PolarHBondContact O-N 2.88Å; L115-T117 VanDerWaalsContact O-N 3.13Å
116	S	34.6	Very low	48.9	Very low	114 Å²	114	114.3 Å²	114.3	80%	0.797	71%	0.707	S	S	*	*			trans	-88.8	70.1	-167.9	56.2	0	0	0	0	112.7
117	T	32.8	Very low	51.3	Low	123 Å²	123	112.2 Å²	112.2	76%	0.755	70%	0.697	S	S	*	*			trans	-132.4	80.4	168.7	54	0	0	0	0	111.4	L115	L115-T117 PolarHBondContact O-N 2.88Å; L115-T117 VanDerWaalsContact O-N 3.13Å
118	S	39.5	Very low	53.5	Low	97 Å²	97	111.6 Å²	111.6	68%	0.678	67%	0.671	S	S	*	*			trans	-136	128.6	150.8	57.5	0	0	0	0	109.5	T120	S118-T120 PolarHBondContact O-N 2.93Å; S118-T120 VanDerWaalsContact O-N 3.12Å
119	S	46.2	Very low	56.2	Low	119 Å²	119	114.7 Å²	114.7	83%	0.832	66%	0.658	S	S	*	*			trans	-59.2	109.1	148.2	47.8	0	0	0	0	105.5	E121	S119-E121 PolarHBondContact O-N 3.21Å; S119-E121 VanDerWaalsContact O-N 3.16Å
120	T	52	Low	59	Low	100 Å²	100	110.7 Å²	110.7	61%	0.613	62%	0.621	S	S	*	*			trans	-53.7	124.6	-174	48	0	0	0	0	109.6	S118 V122	S118-T120 PolarHBondContact O-N 2.93Å; S118-T120 VanDerWaalsContact O-N 3.12Å; T120-V122 VanDerWaalsContact C-N 3.32Å; T120-V122 PolarHBondContact O-N 3.25Å
121	E	71.1	Confident	61.4	Low	117 Å²	117	106.7 Å²	106.7	55%	0.547	59%	0.593	S	S	.	*			trans	-63.3	92.2	177.3	-68.2	-175.4	150.9	0	0	109.3	S119 R129 L130	S119-E121 PolarHBondContact O-N 3.21Å; S119-E121 VanDerWaalsContact O-N 3.16Å; E121-R129 CarbonylContact O-C 3.58Å; E121-R129 VanDerWaalsContact O-CA 3.29Å; E121-R129 WeakPolarHBondContact O-CA 3.26Å; E121-L130 HydrophobicContact CB-CB 4.21Å; E121-L130 HydrophobicContact CB-CD1 4.15Å; E121-L130 HydrophobicContact CB-CG 4.26Å; E121-L130 PolarHBondContact O-N 2.95Å
122	V	83	Confident	63.5	Low	50 Å²	50	102 Å²	102	30%	0.303	57%	0.565	S	S	.	*	B	Isolated β-bridge	trans	-119.1	143.7	-178.6	-65.1	0	0	0	0	111.1	T120 E124 E128	T120-V122 VanDerWaalsContact C-N 3.32Å; T120-V122 PolarHBondContact O-N 3.25Å; V122-E124 PolarHBondContact O-N 3.3Å; V122-E128 CarbonylContact C-O 3.51Å; V122-E128 VanDerWaalsContact CA-O 3.27Å; V122-E128 WeakPolarHBondContact CA-O 3.35Å
123	C	85.2	Confident	66.3	Low	12 Å²	12	97.3 Å²	97.3	8%	0.081	54%	0.537	C	S	.	.			trans	-70.5	123.7	174.9	175.8	0	0	0	0	110.6	L125 H126 N127 E128 L130 C142 C145	C123-L125 PolarHBondContact O-N 2.57Å; C123-H126 PolarHBondContact O-N 3.07Å; C123-H126 VanDerWaalsContact O-N 3.17Å; C123-N127 WeakPolarHBondContact O-CA 3.3Å; C123-N127 PolarHBondContact O-N 3.23Å; C123-E128 PolarHBondContact N-O 3.12Å; C123-L130 HydrophobicContact CB-CD2 3.78Å; C123-C142 HydrophobicContact CB-CB 3.68Å; C123-C142 WeakPolarHBondContact CB-SG 3.37Å; C123-C145 PolarHBondContact SG-SG 2.98Å
124	E	81.3	Confident	69.1	Low	198 Å²	198	90.1 Å²	90.1	93%	0.925	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-27.7	179.6	-58.5	-177.5	166.8	0	0	114.2	V122	V122-E124 PolarHBondContact O-N 3.3Å
125	L	80.1	Confident	71.6	Confident	126 Å²	126	86 Å²	86	66%	0.66	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-31.4	-178.2	-61.7	177.9	0	0	0	114.1	C123	C123-L125 PolarHBondContact O-N 2.57Å
126	H	80.4	Confident	74	Confident	61 Å²	61	82.4 Å²	82.4	28%	0.282	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.5	-9.5	-169.7	-62.7	106.1	0	0	0	113.5	C123 E128 Q144 C145	C123-H126 PolarHBondContact O-N 3.07Å; C123-H126 VanDerWaalsContact O-N 3.17Å; H126-E128 HydrophobicContact CB-CB 4.15Å; H126-E128 HydrophobicContact CB-CG 4.37Å; H126-E128 PolarHBondContact O-N 3.01Å; H126-E128 VanDerWaalsContact O-N 3.14Å; H126-Q144 HydrophobicContact CB-CB 4.21Å; H126-Q144 PolarHBondContact CD2-OE1 3.35Å; H126-Q144 VanDerWaalsContact CD2-OE1 3.24Å; H126-C145 PolarHBondContact CE1-SG 3.49Å; H126-C145 PolarHBondContact ND1-SG 2.67Å
127	N	81	Confident	76.6	Confident	131 Å²	131	79 Å²	79	70%	0.701	43%	0.434	S	S	*	.			trans	52.5	27.2	-171.6	-157.3	81.5	0	0	0	113.9	C123	C123-N127 WeakPolarHBondContact O-CA 3.3Å; C123-N127 PolarHBondContact O-N 3.23Å
128	E	75.7	Confident	79.3	Confident	71 Å²	71	75.6 Å²	75.6	33%	0.332	42%	0.424	S	S	.	.			trans	-105.8	149.8	-178	-88.1	-67.9	179.1	0	0	111.4	V122 C123 H126 L130 C142 H143 Q144	V122-E128 CarbonylContact C-O 3.51Å; V122-E128 VanDerWaalsContact CA-O 3.27Å; V122-E128 WeakPolarHBondContact CA-O 3.35Å; C123-E128 PolarHBondContact N-O 3.12Å; H126-E128 HydrophobicContact CB-CB 4.15Å; H126-E128 HydrophobicContact CB-CG 4.37Å; H126-E128 PolarHBondContact O-N 3.01Å; H126-E128 VanDerWaalsContact O-N 3.14Å; E128-L130 PolarHBondContact O-N 2.91Å; E128-C142 HydrophobicContact CB-CB 3.72Å; E128-C142 WeakPolarHBondContact O-CB 3.14Å; E128-H143 IonicContact OE2-CE1 2.67Å; E128-Q144 HydrophobicContact CG-CG 4.2Å
129	R	86.4	Confident	81.6	Confident	145 Å²	145	76.7 Å²	76.7	55%	0.547	41%	0.414	S	S	.	.	B	Isolated β-bridge	trans	-58.1	134	-177.3	177.9	173.7	171.4	-156	-9.8	111.7	E121 S131 C142 D161	E121-R129 CarbonylContact O-C 3.58Å; E121-R129 VanDerWaalsContact O-CA 3.29Å; E121-R129 WeakPolarHBondContact O-CA 3.26Å; R129-S131 PolarHBondContact O-N 2.88Å; R129-C142 WeakPolarHBondContact O-CA 3.39Å; R129-C142 WeakPolarHBondContact O-CB 3.44Å; R129-D161 IonicContact NH2-OD1 2.71Å
130	L	89.5	Confident	83.8	Confident	31 Å²	31	72.6 Å²	72.6	16%	0.162	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	122.7	168.4	-59.2	-176.7	0	0	0	109	E121 C123 E128 A140 L160	E121-L130 HydrophobicContact CB-CB 4.21Å; E121-L130 HydrophobicContact CB-CD1 4.15Å; E121-L130 HydrophobicContact CB-CG 4.26Å; E121-L130 PolarHBondContact O-N 2.95Å; C123-L130 HydrophobicContact CB-CD2 3.78Å; E128-L130 PolarHBondContact O-N 2.91Å; L130-A140 HydrophobicContact CB-CB 4.42Å; L130-A140 HydrophobicContact CD1-CB 4.13Å; L130-L160 HydrophobicContact CB-CD2 3.91Å
131	S	86.6	Confident	85.5	Confident	39 Å²	39	68.1 Å²	68.1	27%	0.273	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	-9.7	-168.3	68.7	0	0	0	0	113.7	R129 I141 H143 L160	R129-S131 PolarHBondContact O-N 2.88Å; S131-I141 PolarHBondContact N-O 3.01Å; S131-H143 PolarHBondContact OG-N 2.97Å; S131-L160 PolarHBondContact O-N 3.36Å
132	V	87.4	Confident	86.4	Confident	22 Å²	22	62.5 Å²	62.5	13%	0.133	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	130.9	-177.9	-180	0	0	0	0	108.5	I141 A146 F157 R158	V132-I141 HydrophobicContact CB-CG1 4.05Å; V132-I141 HydrophobicContact CG1-CG1 4.31Å; V132-I141 PolarHBondContact N-O 2.78Å; V132-I141 WeakPolarHBondContact O-CG1 3.3Å; V132-I141 PolarHBondContact O-N 2.74Å; V132-I141 VanDerWaalsContact O-O 3.05Å; V132-A146 HydrophobicContact CB-CB 4.37Å; V132-A146 HydrophobicContact CG1-CB 4.12Å; V132-A146 HydrophobicContact CG2-CB 4.25Å; V132-F157 HydrophobicContact CG1-CB 3.64Å; V132-F157 HydrophobicContact CG1-CD1 3.71Å; V132-F157 HydrophobicContact CG1-CG 3.92Å; V132-R158 CarbonylContact C-O 3.56Å; V132-R158 WeakPolarHBondContact CA-O 3.39Å; V132-R158 WeakPolarHBondContact CG1-O 3.38Å
133	F	91.5	Very high	86.5	Confident	36 Å²	36	63.5 Å²	63.5	16%	0.158	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	123.5	167.8	-172.7	-97.1	0	0	0	109.9	T135 F157 R158 L160 V163	F133-T135 HydrophobicContact CD1-CG2 3.94Å; F133-T135 HydrophobicContact CE1-CG2 4.34Å; F133-T135 PolarHBondContact O-N 3.04Å; F133-F157 WeakPolarHBondContact O-CA 3.2Å; F133-R158 PolarHBondContact N-O 2.96Å; F133-R158 PolarHBondContact O-N 2.85Å; F133-L160 HydrophobicContact CB-CD1 4.14Å; F133-L160 HydrophobicContact CD2-CD1 4.27Å; F133-V163 HydrophobicContact CB-CB 4.04Å; F133-V163 HydrophobicContact CB-CG1 4.18Å; F133-V163 HydrophobicContact CB-CG2 4.01Å; F133-V163 HydrophobicContact CD1-CB 4.41Å; F133-V163 HydrophobicContact CD1-CG1 3.77Å; F133-V163 HydrophobicContact CD1-CG2 4.22Å; F133-V163 HydrophobicContact CD2-CG1 4.18Å; F133-V163 HydrophobicContact CE1-CG1 4.13Å; F133-V163 HydrophobicContact CG-CB 4.2Å; F133-V163 HydrophobicContact CG-CG1 3.78Å; F133-V163 HydrophobicContact CG-CG2 4.33Å; F133-V163 HydrophobicContact CZ-CG1 4.48Å
134	C	92.2	Very high	86.3	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	95.7	177	-176.1	0	0	0	0	109.7	T136 C137 G138 Y139 I141 H152 H155 S156 F157	C134-T136 PolarHBondContact O-N 3.48Å; C134-T136 VanDerWaalsContact O-N 3.16Å; C134-C137 HydrophobicContact CB-CB 4.15Å; C134-C137 PolarHBondContact O-N 2.7Å; C134-G138 PolarHBondContact O-N 2.88Å; C134-Y139 PolarHBondContact N-O 2.9Å; C134-I141 HydrophobicContact CB-CD1 3.95Å; C134-I141 HydrophobicContact CB-CG1 4.34Å; C134-H152 PolarHBondContact SG-ND1 2.72Å; C134-H155 VanDerWaalsContact SG-CB 3.58Å; C134-S156 CarbonylContact C-O 3.57Å; C134-F157 HydrophobicContact CB-CD1 4.21Å; C134-F157 HydrophobicContact CB-CE1 4.25Å
135	T	88.6	Confident	86.5	Confident	58 Å²	58	56.3 Å²	56.3	36%	0.356	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-27.6	-174.9	59.7	0	0	0	0	112.9	F133 C137 S156 R158	F133-T135 HydrophobicContact CD1-CG2 3.94Å; F133-T135 HydrophobicContact CE1-CG2 4.34Å; F133-T135 PolarHBondContact O-N 3.04Å; T135-C137 VanDerWaalsContact C-N 3.33Å; T135-S156 PolarHBondContact N-O 3Å; T135-S156 WeakPolarHBondContact OG1-CB 3.16Å; T135-S156 PolarHBondContact OG1-O 3.14Å; T135-S156 PolarHBondContact OG1-OG 2.73Å; T135-R158 HydrophobicContact CG2-CG 4.37Å
136	T	89.2	Confident	86.6	Confident	80 Å²	80	51.1 Å²	51.1	49%	0.491	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-19.4	175	-44.5	0	0	0	0	113.6	C134 H155 S156	C134-T136 PolarHBondContact O-N 3.48Å; C134-T136 VanDerWaalsContact O-N 3.16Å; T136-H155 HydrophobicContact CG2-CB 4.43Å; T136-H155 VanDerWaalsContact CG2-CD2 3.49Å; T136-H155 WeakPolarHBondContact CG2-CD2 3.24Å; T136-S156 PolarHBondContact OG1-N 3.02Å
137	C	88.9	Confident	86.5	Confident	43 Å²	43	54 Å²	54	29%	0.291	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-18.1	-177.5	-65.2	0	0	0	0	114.1	C134 T135 Y139 H155	C134-C137 HydrophobicContact CB-CB 4.15Å; C134-C137 PolarHBondContact O-N 2.7Å; T135-C137 VanDerWaalsContact C-N 3.33Å; C137-Y139 HydrophobicContact CB-CD1 3.81Å; C137-Y139 HydrophobicContact CB-CE1 3.5Å; C137-Y139 VanDerWaalsContact CB-CE1 3.5Å; C137-Y139 HydrophobicContact CB-CE2 4.45Å; C137-Y139 HydrophobicContact CB-CG 4.44Å; C137-Y139 WeakPolarHBondContact O-CD1 3.27Å; C137-H155 PolarHBondContact SG-CE1 2.84Å; C137-H155 PolarHBondContact SG-ND1 3.42Å
138	G	89.4	Confident	86.1	Confident	52 Å²	52	55 Å²	55	54%	0.536	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	15.2	178.7	0	0	0	0	0	115.1	C134	C134-G138 PolarHBondContact O-N 2.88Å
139	Y	88.7	Confident	86	Confident	120 Å²	120	53 Å²	53	47%	0.471	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	158.5	178.2	58.6	-102.4	0	0	0	113.7	C134 C137 I141 H152	C134-Y139 PolarHBondContact N-O 2.9Å; C137-Y139 HydrophobicContact CB-CD1 3.81Å; C137-Y139 HydrophobicContact CB-CE1 3.5Å; C137-Y139 VanDerWaalsContact CB-CE1 3.5Å; C137-Y139 HydrophobicContact CB-CE2 4.45Å; C137-Y139 HydrophobicContact CB-CG 4.44Å; C137-Y139 WeakPolarHBondContact O-CD1 3.27Å; Y139-I141 HydrophobicContact CD2-CG2 3.56Å; Y139-I141 HydrophobicContact CE2-CG2 3.45Å; Y139-I141 VanDerWaalsContact CE2-CG2 3.45Å; Y139-H152 AromaticContact CE2-CE1 3.78Å; Y139-H152 AromaticContact CE2-NE2 3.93Å; Y139-H152 AromaticContact CZ-CE1 3.82Å; Y139-H152 AromaticContact CZ-NE2 3.99Å; Y139-H152 PolarHBondContact OH-CE1 2.95Å; Y139-H152 PolarHBondContact OH-NE2 2.73Å
140	A	90.7	Very high	85.4	Confident	33 Å²	33	52.5 Å²	52.5	27%	0.273	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	140.1	175.8	0	0	0	0	0	111.5	L130 L160	L130-A140 HydrophobicContact CB-CB 4.42Å; L130-A140 HydrophobicContact CD1-CB 4.13Å; A140-L160 HydrophobicContact CB-CD1 3.61Å; A140-L160 HydrophobicContact CB-CD2 3.93Å; A140-L160 HydrophobicContact CB-CG 4.43Å
141	I	89.3	Confident	84.8	Confident	5 Å²	5	54.9 Å²	54.9	3%	0.026	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	163.1	179.2	62.1	173.3	0	0	0	110.2	S131 V132 C134 Y139 C145 A146 F157	S131-I141 PolarHBondContact N-O 3.01Å; V132-I141 HydrophobicContact CB-CG1 4.05Å; V132-I141 HydrophobicContact CG1-CG1 4.31Å; V132-I141 PolarHBondContact N-O 2.78Å; V132-I141 WeakPolarHBondContact O-CG1 3.3Å; V132-I141 PolarHBondContact O-N 2.74Å; V132-I141 VanDerWaalsContact O-O 3.05Å; C134-I141 HydrophobicContact CB-CD1 3.95Å; C134-I141 HydrophobicContact CB-CG1 4.34Å; Y139-I141 HydrophobicContact CD2-CG2 3.56Å; Y139-I141 HydrophobicContact CE2-CG2 3.45Å; Y139-I141 VanDerWaalsContact CE2-CG2 3.45Å; I141-C145 HydrophobicContact CB-CB 3.78Å; I141-C145 HydrophobicContact CD1-CB 3.82Å; I141-C145 HydrophobicContact CG1-CB 4.21Å; I141-C145 HydrophobicContact CG2-CB 4.32Å; I141-A146 HydrophobicContact CD1-CB 3.95Å; I141-F157 HydrophobicContact CD1-CD1 4.19Å; I141-F157 HydrophobicContact CD1-CE1 3.73Å
142	C	89.8	Confident	84.4	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	165.2	169.4	68.7	0	0	0	0	111.3	C123 E128 R129 Q144 C145 A146	C123-C142 HydrophobicContact CB-CB 3.68Å; C123-C142 WeakPolarHBondContact CB-SG 3.37Å; E128-C142 HydrophobicContact CB-CB 3.72Å; E128-C142 WeakPolarHBondContact O-CB 3.14Å; R129-C142 WeakPolarHBondContact O-CA 3.39Å; R129-C142 WeakPolarHBondContact O-CB 3.44Å; C142-Q144 PolarHBondContact O-N 2.92Å; C142-C145 PolarHBondContact O-N 2.83Å; C142-A146 PolarHBondContact O-N 3.01Å
143	H	84.9	Confident	83.7	Confident	71 Å²	71	59.2 Å²	59.2	33%	0.329	32%	0.317	S	S	.	.	H	α-helix	trans	-56.8	-30.5	175.7	66.5	-88.2	0	0	0	113.7	E128 S131 A146 L147	E128-H143 IonicContact OE2-CE1 2.67Å; S131-H143 PolarHBondContact OG-N 2.97Å; H143-A146 PolarHBondContact O-N 3.26Å; H143-L147 WeakPolarHBondContact O-CB 3.25Å; H143-L147 WeakPolarHBondContact O-CG 3.42Å; H143-L147 PolarHBondContact O-N 2.78Å; H143-L147 VanDerWaalsContact O-N 3.11Å
144	Q	80.6	Confident	83.1	Confident	56 Å²	56	66 Å²	66	26%	0.262	35%	0.35	S	S	.	.	H	α-helix	trans	-69	-40.1	177.7	-60.4	-168.6	10.9	0	0	112.3	H126 E128 C142 A146 L147 F148	H126-Q144 HydrophobicContact CB-CB 4.21Å; H126-Q144 PolarHBondContact CD2-OE1 3.35Å; H126-Q144 VanDerWaalsContact CD2-OE1 3.24Å; E128-Q144 HydrophobicContact CG-CG 4.2Å; C142-Q144 PolarHBondContact O-N 2.92Å; Q144-A146 VanDerWaalsContact C-N 3.29Å; Q144-A146 PolarHBondContact O-N 3.09Å; Q144-L147 PolarHBondContact O-N 3.02Å; Q144-F148 HydrophobicContact CB-CD2 4.4Å; Q144-F148 PolarHBondContact O-N 2.75Å
145	C	85.1	Confident	82.9	Confident	3 Å²	3	68 Å²	68	2%	0.02	36%	0.359	C	S	.	.	H	α-helix	trans	-59.9	-40.1	170.3	-72.2	0	0	0	0	112.1	C123 H126 I141 C142 L147 D149	C123-C145 PolarHBondContact SG-SG 2.98Å; H126-C145 PolarHBondContact CE1-SG 3.49Å; H126-C145 PolarHBondContact ND1-SG 2.67Å; I141-C145 HydrophobicContact CB-CB 3.78Å; I141-C145 HydrophobicContact CD1-CB 3.82Å; I141-C145 HydrophobicContact CG1-CB 4.21Å; I141-C145 HydrophobicContact CG2-CB 4.32Å; C142-C145 PolarHBondContact O-N 2.83Å; C145-L147 VanDerWaalsContact C-N 3.3Å; C145-L147 PolarHBondContact O-N 2.79Å; C145-D149 WeakPolarHBondContact O-CB 3.38Å; C145-D149 PolarHBondContact O-N 2.88Å
146	A	82	Confident	82.9	Confident	16 Å²	16	68.4 Å²	68.4	13%	0.132	36%	0.364	C	S	.	.	H	α-helix	trans	-71	-24.4	-178.1	0	0	0	0	0	113.6	V132 I141 C142 H143 Q144 F157	V132-A146 HydrophobicContact CB-CB 4.37Å; V132-A146 HydrophobicContact CG1-CB 4.12Å; V132-A146 HydrophobicContact CG2-CB 4.25Å; I141-A146 HydrophobicContact CD1-CB 3.95Å; C142-A146 PolarHBondContact O-N 3.01Å; H143-A146 PolarHBondContact O-N 3.26Å; Q144-A146 VanDerWaalsContact C-N 3.29Å; Q144-A146 PolarHBondContact O-N 3.09Å; A146-F157 HydrophobicContact CB-CD1 4.17Å; A146-F157 HydrophobicContact CB-CD2 4.48Å; A146-F157 HydrophobicContact CB-CE1 3.91Å; A146-F157 HydrophobicContact CB-CE2 4.22Å; A146-F157 HydrophobicContact CB-CG 4.45Å; A146-F157 HydrophobicContact CB-CZ 3.93Å; A146-F157 WeakPolarHBondContact O-CE2 3.44Å; A146-F157 WeakPolarHBondContact O-CZ 3.38Å
147	L	78.2	Confident	82.8	Confident	121 Å²	121	68 Å²	68	63%	0.634	36%	0.355	S	S	*	.	H	α-helix	trans	-107.2	-29.2	-174.4	-67.5	172.9	0	0	0	114.6	H143 Q144 C145	H143-L147 WeakPolarHBondContact O-CB 3.25Å; H143-L147 WeakPolarHBondContact O-CG 3.42Å; H143-L147 PolarHBondContact O-N 2.78Å; H143-L147 VanDerWaalsContact O-N 3.11Å; Q144-L147 PolarHBondContact O-N 3.02Å; C145-L147 VanDerWaalsContact C-N 3.3Å; C145-L147 PolarHBondContact O-N 2.79Å
148	F	74.4	Confident	82.9	Confident	152 Å²	152	70.4 Å²	70.4	67%	0.667	36%	0.359	S	S	*	.	H	α-helix	trans	-132.3	-6.7	-167.4	-53.9	-62.3	0	0	0	114.8	Q144	Q144-F148 HydrophobicContact CB-CD2 4.4Å; Q144-F148 PolarHBondContact O-N 2.75Å
149	D	73.6	Confident	82.9	Confident	29 Å²	29	70.9 Å²	70.9	16%	0.155	35%	0.352	C	S	.	.			trans	-87.8	116.9	171.9	-172.2	0.9	0	0	0	111.3	C145 N151 H152 E153	C145-D149 WeakPolarHBondContact O-CB 3.38Å; C145-D149 PolarHBondContact O-N 2.88Å; D149-N151 VanDerWaalsContact CG-ND2 3.32Å; D149-N151 PolarHBondContact O-N 3.49Å; D149-N151 WeakPolarHBondContact OD1-CB 3.37Å; D149-N151 PolarHBondContact OD1-N 3.28Å; D149-N151 PolarHBondContact OD1-ND2 3.49Å; D149-N151 WeakPolarHBondContact OD2-CB 3.49Å; D149-N151 PolarHBondContact OD2-ND2 3.46Å; D149-H152 PolarHBondContact O-N 3Å; D149-H152 IonicContact OD2-CD2 2.87Å; D149-E153 PolarHBondContact O-N 3.17Å
150	N	73.6	Confident	82.9	Confident	136 Å²	136	66.2 Å²	66.2	73%	0.727	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-20.7	172.5	-57.1	-31.3	0	0	0	113.3	H152	N150-H152 VanDerWaalsContact C-N 3.27Å; N150-H152 PolarHBondContact O-N 2.91Å
151	N	75.3	Confident	82.8	Confident	80 Å²	80	69 Å²	69	43%	0.428	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-19.4	173.8	-61.1	-57.4	0	0	0	113.6	D149 H155	D149-N151 VanDerWaalsContact CG-ND2 3.32Å; D149-N151 PolarHBondContact O-N 3.49Å; D149-N151 WeakPolarHBondContact OD1-CB 3.37Å; D149-N151 PolarHBondContact OD1-N 3.28Å; D149-N151 PolarHBondContact OD1-ND2 3.49Å; D149-N151 WeakPolarHBondContact OD2-CB 3.49Å; D149-N151 PolarHBondContact OD2-ND2 3.46Å; N151-H155 PolarHBondContact O-CE1 3.06Å; N151-H155 PolarHBondContact O-ND1 3.46Å
152	H	78.3	Confident	82.9	Confident	6 Å²	6	72.6 Å²	72.6	3%	0.028	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.5	-4.5	-175.2	-69.4	-90.6	0	0	0	114.7	C134 Y139 D149 N150 Q154 H155 F157	C134-H152 PolarHBondContact SG-ND1 2.72Å; Y139-H152 AromaticContact CE2-CE1 3.78Å; Y139-H152 AromaticContact CE2-NE2 3.93Å; Y139-H152 AromaticContact CZ-CE1 3.82Å; Y139-H152 AromaticContact CZ-NE2 3.99Å; Y139-H152 PolarHBondContact OH-CE1 2.95Å; Y139-H152 PolarHBondContact OH-NE2 2.73Å; D149-H152 PolarHBondContact O-N 3Å; D149-H152 IonicContact OD2-CD2 2.87Å; N150-H152 VanDerWaalsContact C-N 3.27Å; N150-H152 PolarHBondContact O-N 2.91Å; H152-Q154 PolarHBondContact O-N 3.06Å; H152-H155 AromaticContact CG-ND1 3.98Å; H152-H155 AromaticContact ND1-ND1 3.52Å; H152-H155 WeakPolarHBondContact O-CB 3.38Å; H152-H155 PolarHBondContact O-N 3.5Å; H152-F157 HydrophobicContact CB-CE1 4.11Å; H152-F157 HydrophobicContact CB-CZ 3.93Å; H152-F157 WeakPolarHBondContact O-CZ 3.29Å
153	E	72.7	Confident	83	Confident	146 Å²	146	73 Å²	73	68%	0.682	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.6	-26.9	-177.1	-168.5	-174.3	-167.4	0	0	115.8	D149	D149-E153 PolarHBondContact O-N 3.17Å
154	Q	78.7	Confident	83.4	Confident	180 Å²	180	76.4 Å²	76.4	84%	0.841	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.4	16.4	179.6	-61.3	-173	-1.1	0	0	113.8	H152	H152-Q154 PolarHBondContact O-N 3.06Å
155	H	89.8	Confident	84	Confident	41 Å²	41	78.9 Å²	78.9	19%	0.19	39%	0.393	C	S	.	.			trans	-95.8	158.4	-178.4	-65.9	164.2	0	0	0	112.6	C134 T136 C137 N151 H152 F157	C134-H155 VanDerWaalsContact SG-CB 3.58Å; T136-H155 HydrophobicContact CG2-CB 4.43Å; T136-H155 VanDerWaalsContact CG2-CD2 3.49Å; T136-H155 WeakPolarHBondContact CG2-CD2 3.24Å; C137-H155 PolarHBondContact SG-CE1 2.84Å; C137-H155 PolarHBondContact SG-ND1 3.42Å; N151-H155 PolarHBondContact O-CE1 3.06Å; N151-H155 PolarHBondContact O-ND1 3.46Å; H152-H155 AromaticContact CG-ND1 3.98Å; H152-H155 AromaticContact ND1-ND1 3.52Å; H152-H155 WeakPolarHBondContact O-CB 3.38Å; H152-H155 PolarHBondContact O-N 3.5Å; H155-F157 HydrophobicContact CB-CE1 4.35Å; H155-F157 HydrophobicContact CB-CZ 4.4Å; H155-F157 WeakPolarHBondContact O-CE2 3.4Å
156	S	87	Confident	84.4	Confident	67 Å²	67	82.5 Å²	82.5	47%	0.469	41%	0.41	S	S	.	.			trans	-89.3	141.4	175.9	172	0	0	0	0	110.4	C134 T135 T136	C134-S156 CarbonylContact C-O 3.57Å; T135-S156 PolarHBondContact N-O 3Å; T135-S156 WeakPolarHBondContact OG1-CB 3.16Å; T135-S156 PolarHBondContact OG1-O 3.14Å; T135-S156 PolarHBondContact OG1-OG 2.73Å; T136-S156 PolarHBondContact OG1-N 3.02Å
157	F	87.7	Confident	84.9	Confident	70 Å²	70	85.9 Å²	85.9	31%	0.307	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	147.6	-173.3	-57	-60.1	0	0	0	111.1	V132 F133 C134 I141 A146 H152 H155	V132-F157 HydrophobicContact CG1-CB 3.64Å; V132-F157 HydrophobicContact CG1-CD1 3.71Å; V132-F157 HydrophobicContact CG1-CG 3.92Å; F133-F157 WeakPolarHBondContact O-CA 3.2Å; C134-F157 HydrophobicContact CB-CD1 4.21Å; C134-F157 HydrophobicContact CB-CE1 4.25Å; I141-F157 HydrophobicContact CD1-CD1 4.19Å; I141-F157 HydrophobicContact CD1-CE1 3.73Å; A146-F157 HydrophobicContact CB-CD1 4.17Å; A146-F157 HydrophobicContact CB-CD2 4.48Å; A146-F157 HydrophobicContact CB-CE1 3.91Å; A146-F157 HydrophobicContact CB-CE2 4.22Å; A146-F157 HydrophobicContact CB-CG 4.45Å; A146-F157 HydrophobicContact CB-CZ 3.93Å; A146-F157 WeakPolarHBondContact O-CE2 3.44Å; A146-F157 WeakPolarHBondContact O-CZ 3.38Å; H152-F157 HydrophobicContact CB-CE1 4.11Å; H152-F157 HydrophobicContact CB-CZ 3.93Å; H152-F157 WeakPolarHBondContact O-CZ 3.29Å; H155-F157 HydrophobicContact CB-CE1 4.35Å; H155-F157 HydrophobicContact CB-CZ 4.4Å; H155-F157 WeakPolarHBondContact O-CE2 3.4Å
158	R	90.3	Very high	85.8	Confident	95 Å²	95	81.7 Å²	81.7	36%	0.358	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	159.1	162.2	-74.7	-179.7	65.5	-172.7	-5.5	109.1	V132 F133 T135 V163 E166	V132-R158 CarbonylContact C-O 3.56Å; V132-R158 WeakPolarHBondContact CA-O 3.39Å; V132-R158 WeakPolarHBondContact CG1-O 3.38Å; F133-R158 PolarHBondContact N-O 2.96Å; F133-R158 PolarHBondContact O-N 2.85Å; T135-R158 HydrophobicContact CG2-CG 4.37Å; R158-V163 HydrophobicContact CB-CG2 3.61Å; R158-V163 HydrophobicContact CG-CG2 4.41Å; R158-E166 IonicContact CZ-OE2 2.71Å; R158-E166 IonicContact NH1-OE1 2.79Å; R158-E166 IonicContact NH1-OE2 3.09Å; R158-E166 PolarHBondContact NH1-OE2 3.46Å; R158-E166 IonicContact NH2-OE2 2.66Å; R158-E166 PolarHBondContact NH2-OE2 3.26Å
159	P	90.8	Very high	86.9	Confident	62 Å²	62	81.2 Å²	81.2	40%	0.403	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52	141.4	167.1	-23.6	34.4	0	0	0	110.3	D161 D162 V163	P159-D161 VanDerWaalsContact C-N 3.31Å; P159-D162 HydrophobicContact CB-CB 4.15Å; P159-D162 WeakPolarHBondContact CD-OD2 3.31Å; P159-D162 HydrophobicContact CG-CB 4.47Å; P159-D162 WeakPolarHBondContact CG-OD2 3.39Å; P159-V163 PolarHBondContact O-N 3.03Å
160	L	88.8	Confident	87.9	Confident	22 Å²	22	83.9 Å²	83.9	12%	0.115	41%	0.412	C	S	.	.	H	α-helix	trans	-64.1	-41.7	179.1	179.9	59	0	0	0	111	L130 S131 F133 A140 D162 V163 Y164	L130-L160 HydrophobicContact CB-CD2 3.91Å; S131-L160 PolarHBondContact O-N 3.36Å; F133-L160 HydrophobicContact CB-CD1 4.14Å; F133-L160 HydrophobicContact CD2-CD1 4.27Å; A140-L160 HydrophobicContact CB-CD1 3.61Å; A140-L160 HydrophobicContact CB-CD2 3.93Å; A140-L160 HydrophobicContact CB-CG 4.43Å; L160-D162 PolarHBondContact O-N 2.88Å; L160-V163 PolarHBondContact O-N 3.44Å; L160-Y164 WeakPolarHBondContact O-CB 3.39Å; L160-Y164 PolarHBondContact O-N 3.3Å
161	D	89	Confident	89	Confident	90 Å²	90	82.9 Å²	82.9	48%	0.481	41%	0.405	S	S	.	.	H	α-helix	trans	-60.9	-44.5	-179.2	-52.3	-50.9	0	0	0	111.5	R129 P159 V163 Y164 D165	R129-D161 IonicContact NH2-OD1 2.71Å; P159-D161 VanDerWaalsContact C-N 3.31Å; D161-V163 VanDerWaalsContact C-N 3.33Å; D161-V163 PolarHBondContact O-N 3.41Å; D161-Y164 PolarHBondContact O-N 2.88Å; D161-D165 PolarHBondContact O-N 3.41Å
162	D	90.6	Very high	90	Very high	81 Å²	81	84.4 Å²	84.4	43%	0.433	41%	0.408	S	S	.	.	H	α-helix	trans	-55.2	-44.9	174.6	-74.2	11.6	0	0	0	112.9	P159 L160 E166	P159-D162 HydrophobicContact CB-CB 4.15Å; P159-D162 WeakPolarHBondContact CD-OD2 3.31Å; P159-D162 HydrophobicContact CG-CB 4.47Å; P159-D162 WeakPolarHBondContact CG-OD2 3.39Å; L160-D162 PolarHBondContact O-N 2.88Å; D162-E166 WeakPolarHBondContact O-CB 3.37Å; D162-E166 PolarHBondContact O-N 3.43Å
163	V	92.6	Very high	90.8	Very high	9 Å²	9	88.3 Å²	88.3	6%	0.055	43%	0.429	C	S	.	.	H	α-helix	trans	-78.3	-34.4	-175.7	173.6	0	0	0	0	110.9	F133 R158 P159 L160 D161 H167	F133-V163 HydrophobicContact CB-CB 4.04Å; F133-V163 HydrophobicContact CB-CG1 4.18Å; F133-V163 HydrophobicContact CB-CG2 4.01Å; F133-V163 HydrophobicContact CD1-CB 4.41Å; F133-V163 HydrophobicContact CD1-CG1 3.77Å; F133-V163 HydrophobicContact CD1-CG2 4.22Å; F133-V163 HydrophobicContact CD2-CG1 4.18Å; F133-V163 HydrophobicContact CE1-CG1 4.13Å; F133-V163 HydrophobicContact CG-CB 4.2Å; F133-V163 HydrophobicContact CG-CG1 3.78Å; F133-V163 HydrophobicContact CG-CG2 4.33Å; F133-V163 HydrophobicContact CZ-CG1 4.48Å; R158-V163 HydrophobicContact CB-CG2 3.61Å; R158-V163 HydrophobicContact CG-CG2 4.41Å; P159-V163 PolarHBondContact O-N 3.03Å; L160-V163 PolarHBondContact O-N 3.44Å; D161-V163 VanDerWaalsContact C-N 3.33Å; D161-V163 PolarHBondContact O-N 3.41Å; V163-H167 WeakPolarHBondContact O-CB 3.47Å; V163-H167 PolarHBondContact O-CD2 3.07Å; V163-H167 PolarHBondContact O-N 3.34Å
164	Y	91.9	Very high	92	Very high	143 Å²	143	86 Å²	86	56%	0.561	42%	0.418	S	S	*	.	H	α-helix	trans	-60.3	-52.1	169.9	171.3	-94.6	0	0	0	110.8	L160 D161 E166 H167 V168	L160-Y164 WeakPolarHBondContact O-CB 3.39Å; L160-Y164 PolarHBondContact O-N 3.3Å; D161-Y164 PolarHBondContact O-N 2.88Å; Y164-E166 VanDerWaalsContact C-N 3.32Å; Y164-E166 PolarHBondContact O-N 3.32Å; Y164-H167 PolarHBondContact O-N 3.06Å; Y164-V168 HydrophobicContact CD1-CG2 4.29Å; Y164-V168 HydrophobicContact CD2-CG2 4Å; Y164-V168 HydrophobicContact CE1-CG2 4.01Å; Y164-V168 HydrophobicContact CE2-CG2 3.69Å; Y164-V168 HydrophobicContact CG-CG2 4.3Å; Y164-V168 VanDerWaalsContact O-CB 3.25Å; Y164-V168 WeakPolarHBondContact O-CB 3.26Å; Y164-V168 VanDerWaalsContact O-CG2 3.24Å; Y164-V168 WeakPolarHBondContact O-CG2 3.25Å; Y164-V168 PolarHBondContact O-N 3.34Å
165	D	92.9	Very high	92.9	Very high	107 Å²	107	81.5 Å²	81.5	57%	0.572	40%	0.398	S	S	*	.	H	α-helix	trans	-62.4	-38.4	178.6	-88.9	-9.3	0	0	0	112	D161 K169	D161-D165 PolarHBondContact O-N 3.41Å; D165-K169 WeakPolarHBondContact O-CB 3.34Å; D165-K169 PolarHBondContact O-N 3Å
166	E	94.6	Very high	93.2	Very high	80 Å²	80	82.3 Å²	82.3	37%	0.374	40%	0.404	S	S	.	.	H	α-helix	trans	-64.1	-48.4	175.9	-167.3	177.3	145.9	0	0	112.2	R158 D162 Y164 K169 Q170	R158-E166 IonicContact CZ-OE2 2.71Å; R158-E166 IonicContact NH1-OE1 2.79Å; R158-E166 IonicContact NH1-OE2 3.09Å; R158-E166 PolarHBondContact NH1-OE2 3.46Å; R158-E166 IonicContact NH2-OE2 2.66Å; R158-E166 PolarHBondContact NH2-OE2 3.26Å; D162-E166 WeakPolarHBondContact O-CB 3.37Å; D162-E166 PolarHBondContact O-N 3.43Å; Y164-E166 VanDerWaalsContact C-N 3.32Å; Y164-E166 PolarHBondContact O-N 3.32Å; E166-K169 PolarHBondContact O-N 3.5Å; E166-Q170 VanDerWaalsContact O-CG 3.29Å; E166-Q170 WeakPolarHBondContact O-CG 3.48Å; E166-Q170 PolarHBondContact O-N 2.93Å
167	H	93.3	Very high	93.7	Very high	86 Å²	86	83.2 Å²	83.2	40%	0.398	40%	0.401	S	S	.	.	H	α-helix	trans	-70	-38.8	177.7	-76.6	-46.2	0	0	0	113	V163 Y164 K169 Q170 I171	V163-H167 WeakPolarHBondContact O-CB 3.47Å; V163-H167 PolarHBondContact O-CD2 3.07Å; V163-H167 PolarHBondContact O-N 3.34Å; Y164-H167 PolarHBondContact O-N 3.06Å; H167-K169 VanDerWaalsContact C-N 3.28Å; H167-K169 PolarHBondContact O-N 3.13Å; H167-Q170 PolarHBondContact ND1-OE1 3.28Å; H167-Q170 PolarHBondContact O-N 3.21Å; H167-I171 WeakPolarHBondContact O-CB 3.3Å; H167-I171 VanDerWaalsContact O-CG1 3.28Å; H167-I171 WeakPolarHBondContact O-CG1 3.4Å; H167-I171 PolarHBondContact O-N 2.78Å
168	V	96.4	Very high	94.1	Very high	34 Å²	34	86.3 Å²	86.3	21%	0.206	41%	0.414	C	S	.	.	H	α-helix	trans	-62.9	-37.3	174.5	167.1	0	0	0	0	110.7	Y164 K172	Y164-V168 HydrophobicContact CD1-CG2 4.29Å; Y164-V168 HydrophobicContact CD2-CG2 4Å; Y164-V168 HydrophobicContact CE1-CG2 4.01Å; Y164-V168 HydrophobicContact CE2-CG2 3.69Å; Y164-V168 HydrophobicContact CG-CG2 4.3Å; Y164-V168 VanDerWaalsContact O-CB 3.25Å; Y164-V168 WeakPolarHBondContact O-CB 3.26Å; Y164-V168 VanDerWaalsContact O-CG2 3.24Å; Y164-V168 WeakPolarHBondContact O-CG2 3.25Å; Y164-V168 PolarHBondContact O-N 3.34Å; V168-K172 HydrophobicContact CG1-CD 3.89Å; V168-K172 VanDerWaalsContact CG1-CE 3.49Å; V168-K172 VanDerWaalsContact O-CB 3.32Å; V168-K172 WeakPolarHBondContact O-CB 3.29Å; V168-K172 WeakPolarHBondContact O-CD 3.4Å; V168-K172 WeakPolarHBondContact O-CG 3.45Å; V168-K172 PolarHBondContact O-N 2.82Å
169	K	96.1	Very high	94.4	Very high	141 Å²	141	86.7 Å²	86.7	61%	0.613	42%	0.418	S	S	*	.	H	α-helix	trans	-67.2	-43.2	173.3	-175	176.6	-178	178.4	0	112.1	D165 E166 H167 K172 N173	D165-K169 WeakPolarHBondContact O-CB 3.34Å; D165-K169 PolarHBondContact O-N 3Å; E166-K169 PolarHBondContact O-N 3.5Å; H167-K169 VanDerWaalsContact C-N 3.28Å; H167-K169 PolarHBondContact O-N 3.13Å; K169-K172 PolarHBondContact O-N 2.92Å; K169-N173 WeakPolarHBondContact O-CB 3.22Å; K169-N173 PolarHBondContact O-N 2.77Å; K169-N173 PolarHBondContact O-ND2 2.9Å; K169-N173 PolarHBondContact O-OD1 2.81Å
170	Q	95.8	Very high	94.8	Very high	86 Å²	86	90.9 Å²	90.9	40%	0.402	43%	0.426	S	S	.	.	H	α-helix	trans	-59.2	-51.2	173.5	-71.4	165.4	5.5	0	0	111.4	E166 H167 K172 N173 E174	E166-Q170 VanDerWaalsContact O-CG 3.29Å; E166-Q170 WeakPolarHBondContact O-CG 3.48Å; E166-Q170 PolarHBondContact O-N 2.93Å; H167-Q170 PolarHBondContact ND1-OE1 3.28Å; H167-Q170 PolarHBondContact O-N 3.21Å; Q170-K172 VanDerWaalsContact C-N 3.33Å; Q170-K172 PolarHBondContact O-N 2.82Å; Q170-N173 WeakPolarHBondContact O-CB 3.45Å; Q170-N173 PolarHBondContact O-N 3.45Å; Q170-E174 PolarHBondContact O-N 2.82Å
171	I	96.2	Very high	95.2	Very high	115 Å²	115	97.2 Å²	97.2	59%	0.59	45%	0.448	S	S	*	.	H	α-helix	trans	-62.8	-38.3	-179.6	-67.7	165.5	0	0	0	111.4	H167 M175	H167-I171 WeakPolarHBondContact O-CB 3.3Å; H167-I171 VanDerWaalsContact O-CG1 3.28Å; H167-I171 WeakPolarHBondContact O-CG1 3.4Å; H167-I171 PolarHBondContact O-N 2.78Å; I171-M175 VanDerWaalsContact O-CB 3.24Å; I171-M175 WeakPolarHBondContact O-CB 3.43Å; I171-M175 PolarHBondContact O-N 2.64Å
172	K	96.6	Very high	95.6	Very high	112 Å²	112	98.6 Å²	98.6	49%	0.487	45%	0.452	S	S	.	.	H	α-helix	trans	-64.1	-45.1	173.2	-76.6	169	179.9	170.9	0	112	V168 K169 Q170 E174 M175 D176	V168-K172 HydrophobicContact CG1-CD 3.89Å; V168-K172 VanDerWaalsContact CG1-CE 3.49Å; V168-K172 VanDerWaalsContact O-CB 3.32Å; V168-K172 WeakPolarHBondContact O-CB 3.29Å; V168-K172 WeakPolarHBondContact O-CD 3.4Å; V168-K172 WeakPolarHBondContact O-CG 3.45Å; V168-K172 PolarHBondContact O-N 2.82Å; K169-K172 PolarHBondContact O-N 2.92Å; Q170-K172 VanDerWaalsContact C-N 3.33Å; Q170-K172 PolarHBondContact O-N 2.82Å; K172-E174 VanDerWaalsContact C-N 3.34Å; K172-E174 PolarHBondContact O-N 3.07Å; K172-M175 HydrophobicContact CB-CE 4.47Å; K172-M175 HydrophobicContact CG-CE 4.09Å; K172-M175 PolarHBondContact O-N 3.16Å; K172-D176 WeakPolarHBondContact O-CB 3.29Å; K172-D176 VanDerWaalsContact O-CG 3.28Å; K172-D176 PolarHBondContact O-N 2.8Å
173	N	96	Very high	96	Very high	87 Å²	87	100.1 Å²	100.1	47%	0.465	46%	0.46	S	S	.	.	H	α-helix	trans	-60.8	-40.3	177	-70.1	-12.1	0	0	0	112.6	K169 Q170 Q177	K169-N173 WeakPolarHBondContact O-CB 3.22Å; K169-N173 PolarHBondContact O-N 2.77Å; K169-N173 PolarHBondContact O-ND2 2.9Å; K169-N173 PolarHBondContact O-OD1 2.81Å; Q170-N173 WeakPolarHBondContact O-CB 3.45Å; Q170-N173 PolarHBondContact O-N 3.45Å; N173-Q177 WeakPolarHBondContact O-CG 3.33Å; N173-Q177 PolarHBondContact O-N 2.86Å; N173-Q177 VanDerWaalsContact O-N 3.15Å; N173-Q177 PolarHBondContact O-NE2 2.83Å; N173-Q177 VanDerWaalsContact O-NE2 3.17Å
174	E	97.2	Very high	96.3	Very high	97 Å²	97	105.4 Å²	105.4	45%	0.453	48%	0.483	S	S	.	.	H	α-helix	trans	-69.4	-46.8	174.6	-69.1	-53.5	127	0	0	111.7	Q170 K172 D176 Q177 F178	Q170-E174 PolarHBondContact O-N 2.82Å; K172-E174 VanDerWaalsContact C-N 3.34Å; K172-E174 PolarHBondContact O-N 3.07Å; E174-D176 PolarHBondContact O-N 3.06Å; E174-Q177 WeakPolarHBondContact O-CA 3.17Å; E174-Q177 WeakPolarHBondContact O-CB 3.27Å; E174-Q177 PolarHBondContact O-N 3.21Å; E174-Q177 PolarHBondContact OE1-NE2 2.87Å; E174-Q177 PolarHBondContact OE2-NE2 3.18Å; E174-F178 WeakPolarHBondContact O-CD2 3.17Å; E174-F178 PolarHBondContact O-N 3.38Å
175	M	96.6	Very high	96.6	Very high	86 Å²	86	103.1 Å²	103.1	42%	0.424	48%	0.481	S	S	.	.	H	α-helix	trans	-54.5	-41.1	174.3	174.7	-177.5	51.3	0	0	111.6	I171 K172 F178 K179	I171-M175 VanDerWaalsContact O-CB 3.24Å; I171-M175 WeakPolarHBondContact O-CB 3.43Å; I171-M175 PolarHBondContact O-N 2.64Å; K172-M175 HydrophobicContact CB-CE 4.47Å; K172-M175 HydrophobicContact CG-CE 4.09Å; K172-M175 PolarHBondContact O-N 3.16Å; M175-F178 PolarHBondContact O-N 3.01Å; M175-K179 WeakPolarHBondContact O-CG 3.48Å; M175-K179 PolarHBondContact O-N 3.24Å
176	D	97.1	Very high	96.8	Very high	58 Å²	58	101.1 Å²	101.1	31%	0.31	47%	0.469	S	S	.	.	H	α-helix	trans	-74.6	-25.2	179.8	-67.2	-21	0	0	0	112.7	K172 E174 K179 R180	K172-D176 WeakPolarHBondContact O-CB 3.29Å; K172-D176 VanDerWaalsContact O-CG 3.28Å; K172-D176 PolarHBondContact O-N 2.8Å; E174-D176 PolarHBondContact O-N 3.06Å; D176-K179 WeakPolarHBondContact OD1-CD 3.32Å; D176-K179 WeakPolarHBondContact OD1-CE 3.34Å; D176-K179 IonicContact OD1-NZ 2.71Å; D176-K179 PolarHBondContact OD1-NZ 2.88Å; D176-R180 WeakPolarHBondContact O-CG 3.4Å; D176-R180 PolarHBondContact O-N 2.78Å; D176-R180 VanDerWaalsContact O-N 3.13Å; D176-R180 PolarHBondContact O-NH1 3.26Å
177	Q	96.8	Very high	97	Very high	87 Å²	87	100 Å²	100	41%	0.407	47%	0.47	S	S	.	.	H	α-helix	trans	-66.4	-45.6	164.6	-74.2	169.9	89.6	0	0	111.3	N173 E174 K179 R180 R181	N173-Q177 WeakPolarHBondContact O-CG 3.33Å; N173-Q177 PolarHBondContact O-N 2.86Å; N173-Q177 VanDerWaalsContact O-N 3.15Å; N173-Q177 PolarHBondContact O-NE2 2.83Å; N173-Q177 VanDerWaalsContact O-NE2 3.17Å; E174-Q177 WeakPolarHBondContact O-CA 3.17Å; E174-Q177 WeakPolarHBondContact O-CB 3.27Å; E174-Q177 PolarHBondContact O-N 3.21Å; E174-Q177 PolarHBondContact OE1-NE2 2.87Å; E174-Q177 PolarHBondContact OE2-NE2 3.18Å; Q177-K179 VanDerWaalsContact C-N 3.35Å; Q177-K179 PolarHBondContact O-N 3.37Å; Q177-R180 PolarHBondContact O-N 3.13Å; Q177-R181 PolarHBondContact O-N 3.44Å
178	F	95.9	Very high	97.3	Very high	135 Å²	135	100.5 Å²	100.5	59%	0.592	48%	0.475	S	S	*	.	H	α-helix	trans	-60.8	-40.2	175	-83.9	-77.2	0	0	0	112.4	E174 M175 R181 H182	E174-F178 WeakPolarHBondContact O-CD2 3.17Å; E174-F178 PolarHBondContact O-N 3.38Å; M175-F178 PolarHBondContact O-N 3.01Å; F178-R181 PolarHBondContact O-N 2.86Å; F178-H182 WeakPolarHBondContact O-CB 3.44Å; F178-H182 PolarHBondContact O-N 3.4Å
179	K	97.8	Very high	97.4	Very high	103 Å²	103	103.9 Å²	103.9	45%	0.448	49%	0.492	S	S	.	.	H	α-helix	trans	-60.8	-45.1	173.1	-72	173.3	-167.9	156.1	0	112.3	M175 D176 Q177 H182 L183	M175-K179 WeakPolarHBondContact O-CG 3.48Å; M175-K179 PolarHBondContact O-N 3.24Å; D176-K179 WeakPolarHBondContact OD1-CD 3.32Å; D176-K179 WeakPolarHBondContact OD1-CE 3.34Å; D176-K179 IonicContact OD1-NZ 2.71Å; D176-K179 PolarHBondContact OD1-NZ 2.88Å; Q177-K179 VanDerWaalsContact C-N 3.35Å; Q177-K179 PolarHBondContact O-N 3.37Å; K179-H182 WeakPolarHBondContact O-CB 3.4Å; K179-H182 PolarHBondContact O-N 2.82Å; K179-L183 WeakPolarHBondContact O-CG 3.48Å; K179-L183 PolarHBondContact O-N 2.83Å
180	R	98.2	Very high	97.5	Very high	150 Å²	150	100.7 Å²	100.7	57%	0.566	48%	0.479	S	S	*	.	H	α-helix	trans	-60.4	-46.8	176.4	-74.3	-171.5	-61.6	-84.6	13.2	111.4	D176 Q177 H182 L183 E184	D176-R180 WeakPolarHBondContact O-CG 3.4Å; D176-R180 PolarHBondContact O-N 2.78Å; D176-R180 VanDerWaalsContact O-N 3.13Å; D176-R180 PolarHBondContact O-NH1 3.26Å; Q177-R180 PolarHBondContact O-N 3.13Å; R180-H182 VanDerWaalsContact C-N 3.31Å; R180-H182 PolarHBondContact O-N 2.89Å; R180-L183 PolarHBondContact O-N 2.93Å; R180-E184 WeakPolarHBondContact O-CB 3.49Å; R180-E184 PolarHBondContact O-N 3.39Å
181	R	97.9	Very high	97.6	Very high	154 Å²	154	100 Å²	100	58%	0.581	48%	0.478	S	S	*	.	H	α-helix	trans	-62.5	-35.2	175.8	-175.9	176.2	176.3	175.6	-0.2	112.9	Q177 F178 E184 L185	Q177-R181 PolarHBondContact O-N 3.44Å; F178-R181 PolarHBondContact O-N 2.86Å; R181-E184 PolarHBondContact O-N 3.07Å; R181-L185 HydrophobicContact CG-CD1 4.22Å; R181-L185 WeakPolarHBondContact O-CB 3.18Å; R181-L185 VanDerWaalsContact O-CG 3.27Å; R181-L185 WeakPolarHBondContact O-CG 3.37Å; R181-L185 PolarHBondContact O-N 2.89Å
182	H	97.8	Very high	97.7	Very high	119 Å²	119	98.8 Å²	98.8	55%	0.551	48%	0.476	S	S	*	.	H	α-helix	trans	-65	-44.6	175.4	-178.6	-111.4	0	0	0	111.7	F178 K179 R180 L185 I186	F178-H182 WeakPolarHBondContact O-CB 3.44Å; F178-H182 PolarHBondContact O-N 3.4Å; K179-H182 WeakPolarHBondContact O-CB 3.4Å; K179-H182 PolarHBondContact O-N 2.82Å; R180-H182 VanDerWaalsContact C-N 3.31Å; R180-H182 PolarHBondContact O-N 2.89Å; H182-L185 PolarHBondContact O-N 2.92Å; H182-I186 VanDerWaalsContact CE1-CD1 3.49Å; H182-I186 WeakPolarHBondContact CE1-CD1 3.31Å; H182-I186 WeakPolarHBondContact O-CG1 3.4Å; H182-I186 PolarHBondContact O-N 2.84Å
183	L	98.1	Very high	97.8	Very high	114 Å²	114	98.5 Å²	98.5	60%	0.597	48%	0.476	S	S	*	.	H	α-helix	trans	-65.2	-39.6	175.2	-66.7	171.2	0	0	0	112.4	K179 R180 I186 S187	K179-L183 WeakPolarHBondContact O-CG 3.48Å; K179-L183 PolarHBondContact O-N 2.83Å; R180-L183 PolarHBondContact O-N 2.93Å; L183-I186 PolarHBondContact O-N 2.96Å; L183-S187 PolarHBondContact O-N 3.49Å
184	E	98.4	Very high	98	Very high	119 Å²	119	100 Å²	100	56%	0.556	48%	0.478	S	S	*	.	H	α-helix	trans	-59.5	-47.3	173.4	-177.9	-178.2	-160	0	0	111.7	R180 R181 I186 S187 L188	R180-E184 WeakPolarHBondContact O-CB 3.49Å; R180-E184 PolarHBondContact O-N 3.39Å; R181-E184 PolarHBondContact O-N 3.07Å; E184-I186 VanDerWaalsContact C-N 3.32Å; E184-I186 PolarHBondContact O-N 3.49Å; E184-S187 WeakPolarHBondContact O-CB 3.33Å; E184-S187 PolarHBondContact O-N 3.09Å; E184-S187 VanDerWaalsContact O-N 3.15Å; E184-L188 HydrophobicContact CG-CD1 4.33Å; E184-L188 WeakPolarHBondContact O-CG 3.42Å; E184-L188 PolarHBondContact O-N 3.19Å
185	L	98.4	Very high	98	Very high	96 Å²	96	100.1 Å²	100.1	50%	0.503	48%	0.482	S	S	.	.	H	α-helix	trans	-63.2	-35.4	176	-72.6	169.2	0	0	0	112.6	R181 H182 L188 L189	R181-L185 HydrophobicContact CG-CD1 4.22Å; R181-L185 WeakPolarHBondContact O-CB 3.18Å; R181-L185 VanDerWaalsContact O-CG 3.27Å; R181-L185 WeakPolarHBondContact O-CG 3.37Å; R181-L185 PolarHBondContact O-N 2.89Å; H182-L185 PolarHBondContact O-N 2.92Å; L185-L188 PolarHBondContact O-N 2.96Å; L185-L189 WeakPolarHBondContact O-CB 3.25Å; L185-L189 PolarHBondContact O-N 3.37Å
186	I	98.4	Very high	98.1	Very high	64 Å²	64	99.5 Å²	99.5	33%	0.328	48%	0.483	S	S	.	.	H	α-helix	trans	-65.9	-39.5	172.9	-72.7	167.9	0	0	0	111.3	H182 L183 E184 L189 Q190	H182-I186 VanDerWaalsContact CE1-CD1 3.49Å; H182-I186 WeakPolarHBondContact CE1-CD1 3.31Å; H182-I186 WeakPolarHBondContact O-CG1 3.4Å; H182-I186 PolarHBondContact O-N 2.84Å; L183-I186 PolarHBondContact O-N 2.96Å; E184-I186 VanDerWaalsContact C-N 3.32Å; E184-I186 PolarHBondContact O-N 3.49Å; I186-L189 PolarHBondContact O-N 2.87Å; I186-Q190 WeakPolarHBondContact O-CG 3.36Å; I186-Q190 PolarHBondContact O-N 3.28Å; I186-Q190 VanDerWaalsContact O-N 3.12Å
187	S	98.3	Very high	98.2	Very high	57 Å²	57	102.3 Å²	102.3	40%	0.399	50%	0.495	S	S	.	.	H	α-helix	trans	-62.9	-48.7	174.2	-166.4	0	0	0	0	111.1	L183 E184 L189 Q190 D191	L183-S187 PolarHBondContact O-N 3.49Å; E184-S187 WeakPolarHBondContact O-CB 3.33Å; E184-S187 PolarHBondContact O-N 3.09Å; E184-S187 VanDerWaalsContact O-N 3.15Å; S187-L189 VanDerWaalsContact C-N 3.29Å; S187-L189 PolarHBondContact O-N 2.85Å; S187-Q190 WeakPolarHBondContact O-CB 3.5Å; S187-Q190 PolarHBondContact O-N 2.88Å; S187-Q190 VanDerWaalsContact O-N 3.1Å; S187-D191 PolarHBondContact O-N 2.98Å; S187-D191 VanDerWaalsContact O-OD2 3.13Å
188	L	98.6	Very high	98.3	Very high	97 Å²	97	100.6 Å²	100.6	51%	0.508	50%	0.495	S	S	.	.	H	α-helix	trans	-61	-36.5	179.1	-68.6	171.3	0	0	0	112.4	E184 L185 D191 V192	E184-L188 HydrophobicContact CG-CD1 4.33Å; E184-L188 WeakPolarHBondContact O-CG 3.42Å; E184-L188 PolarHBondContact O-N 3.19Å; L185-L188 PolarHBondContact O-N 2.96Å; L188-D191 PolarHBondContact O-N 3.25Å; L188-V192 WeakPolarHBondContact O-CG2 3.36Å; L188-V192 PolarHBondContact O-N 3.38Å
189	L	98.5	Very high	98.4	Very high	104 Å²	104	98.7 Å²	98.7	55%	0.545	49%	0.494	S	S	.	.	H	α-helix	trans	-60.7	-50.4	172.3	-172.8	75.9	0	0	0	111.1	L185 I186 S187 D191 V192 E193	L185-L189 WeakPolarHBondContact O-CB 3.25Å; L185-L189 PolarHBondContact O-N 3.37Å; I186-L189 PolarHBondContact O-N 2.87Å; S187-L189 VanDerWaalsContact C-N 3.29Å; S187-L189 PolarHBondContact O-N 2.85Å; L189-D191 VanDerWaalsContact C-N 3.27Å; L189-D191 PolarHBondContact O-N 3.02Å; L189-V192 PolarHBondContact O-N 3.12Å; L189-E193 WeakPolarHBondContact O-CG 3.03Å; L189-E193 PolarHBondContact O-N 2.99Å
190	Q	98.6	Very high	98.4	Very high	75 Å²	75	99.8 Å²	99.8	35%	0.35	50%	0.499	S	S	.	.	H	α-helix	trans	-62.1	-33.6	178	-68.6	175.1	31.7	0	0	112.4	I186 S187 E193 K194	I186-Q190 WeakPolarHBondContact O-CG 3.36Å; I186-Q190 PolarHBondContact O-N 3.28Å; I186-Q190 VanDerWaalsContact O-N 3.12Å; S187-Q190 WeakPolarHBondContact O-CB 3.5Å; S187-Q190 PolarHBondContact O-N 2.88Å; S187-Q190 VanDerWaalsContact O-N 3.1Å; Q190-E193 PolarHBondContact O-N 3.27Å; Q190-K194 WeakPolarHBondContact O-CB 3.3Å; Q190-K194 WeakPolarHBondContact O-CD 3.45Å; Q190-K194 WeakPolarHBondContact O-CE 3.41Å; Q190-K194 WeakPolarHBondContact O-CG 3.48Å; Q190-K194 PolarHBondContact O-N 3.27Å
191	D	98.6	Very high	98.5	Very high	70 Å²	70	98.8 Å²	98.8	37%	0.374	50%	0.501	S	S	.	.	H	α-helix	trans	-72.7	-34.9	176.9	-67.2	-37.7	0	0	0	112.3	S187 L188 L189 K194 N195	S187-D191 PolarHBondContact O-N 2.98Å; S187-D191 VanDerWaalsContact O-OD2 3.13Å; L188-D191 PolarHBondContact O-N 3.25Å; L189-D191 VanDerWaalsContact C-N 3.27Å; L189-D191 PolarHBondContact O-N 3.02Å; D191-K194 IonicContact OD1-NZ 3.94Å; D191-K194 PolarHBondContact OD1-NZ 3.42Å; D191-N195 WeakPolarHBondContact O-CB 3.1Å; D191-N195 PolarHBondContact O-N 2.93Å
192	V	98.7	Very high	98.5	Very high	90 Å²	90	94.1 Å²	94.1	55%	0.545	50%	0.495	S	S	.	.	H	α-helix	trans	-65.2	-42.5	168.7	171.2	0	0	0	0	111.1	L188 L189 N195 V196	L188-V192 WeakPolarHBondContact O-CG2 3.36Å; L188-V192 PolarHBondContact O-N 3.38Å; L189-V192 PolarHBondContact O-N 3.12Å; V192-N195 PolarHBondContact O-N 3.18Å; V192-V196 WeakPolarHBondContact O-CG2 3.37Å; V192-V196 PolarHBondContact O-N 3.41Å
193	E	98.7	Very high	98.5	Very high	106 Å²	106	95.2 Å²	95.2	50%	0.495	50%	0.498	S	S	.	.	H	α-helix	trans	-61.1	-46.1	175.4	-72.3	171	-175.4	0	0	112.1	L189 Q190 N195 V196 Q197	L189-E193 WeakPolarHBondContact O-CG 3.03Å; L189-E193 PolarHBondContact O-N 2.99Å; Q190-E193 PolarHBondContact O-N 3.27Å; E193-N195 VanDerWaalsContact C-N 3.31Å; E193-N195 PolarHBondContact O-N 3.45Å; E193-V196 PolarHBondContact O-N 2.87Å; E193-Q197 WeakPolarHBondContact O-CG 3.32Å; E193-Q197 PolarHBondContact O-N 3.09Å
194	K	98.6	Very high	98.5	Very high	118 Å²	118	93.7 Å²	93.7	51%	0.513	49%	0.488	S	S	.	.	H	α-helix	trans	-56.2	-45.6	173	-70.9	163.1	-147.1	165.2	0	110.9	Q190 D191 Q197 A198	Q190-K194 WeakPolarHBondContact O-CB 3.3Å; Q190-K194 WeakPolarHBondContact O-CD 3.45Å; Q190-K194 WeakPolarHBondContact O-CE 3.41Å; Q190-K194 WeakPolarHBondContact O-CG 3.48Å; Q190-K194 PolarHBondContact O-N 3.27Å; D191-K194 IonicContact OD1-NZ 3.94Å; D191-K194 PolarHBondContact OD1-NZ 3.42Å; K194-Q197 PolarHBondContact O-N 3.4Å; K194-A198 WeakPolarHBondContact O-CB 3.46Å; K194-A198 PolarHBondContact O-N 3.07Å
195	N	98.5	Very high	98.5	Very high	101 Å²	101	91.3 Å²	91.3	54%	0.54	48%	0.477	S	S	.	.	H	α-helix	trans	-65.5	-41.2	179.2	-169.7	17.8	0	0	0	112.4	D191 V192 E193 Q197 A198 V199	D191-N195 WeakPolarHBondContact O-CB 3.1Å; D191-N195 PolarHBondContact O-N 2.93Å; V192-N195 PolarHBondContact O-N 3.18Å; E193-N195 VanDerWaalsContact C-N 3.31Å; E193-N195 PolarHBondContact O-N 3.45Å; N195-Q197 VanDerWaalsContact C-N 3.3Å; N195-Q197 PolarHBondContact O-N 3.03Å; N195-A198 PolarHBondContact O-N 3.14Å; N195-V199 WeakPolarHBondContact O-CG2 3.38Å; N195-V199 PolarHBondContact O-N 3.12Å
196	V	98.7	Very high	98.5	Very high	72 Å²	72	94.2 Å²	94.2	44%	0.436	48%	0.482	S	S	.	.	H	α-helix	trans	-58.7	-41.8	173.8	167.5	0	0	0	0	111.2	V192 E193 K200	V192-V196 WeakPolarHBondContact O-CG2 3.37Å; V192-V196 PolarHBondContact O-N 3.41Å; E193-V196 PolarHBondContact O-N 2.87Å; V196-K200 HydrophobicContact CG1-CD 4.36Å; V196-K200 WeakPolarHBondContact O-CG 3.32Å; V196-K200 PolarHBondContact O-N 3.46Å
197	Q	98.6	Very high	98.5	Very high	118 Å²	118	92.9 Å²	92.9	55%	0.551	48%	0.476	S	S	*	.	H	α-helix	trans	-70.4	-38	175.8	-61.2	-66.7	14.5	0	0	112.4	E193 K194 N195 V199 K200 Q201	E193-Q197 WeakPolarHBondContact O-CG 3.32Å; E193-Q197 PolarHBondContact O-N 3.09Å; K194-Q197 PolarHBondContact O-N 3.4Å; N195-Q197 VanDerWaalsContact C-N 3.3Å; N195-Q197 PolarHBondContact O-N 3.03Å; Q197-V199 PolarHBondContact O-N 3.33Å; Q197-K200 PolarHBondContact O-N 3.13Å; Q197-Q201 WeakPolarHBondContact O-CB 3.37Å; Q197-Q201 PolarHBondContact O-N 3.25Å
198	A	98.7	Very high	98.5	Very high	51 Å²	51	95.9 Å²	95.9	42%	0.421	48%	0.479	S	S	.	.	H	α-helix	trans	-61.5	-42.3	175	0	0	0	0	0	112.2	K194 N195 Q201 A202	K194-A198 WeakPolarHBondContact O-CB 3.46Å; K194-A198 PolarHBondContact O-N 3.07Å; N195-A198 PolarHBondContact O-N 3.14Å; A198-Q201 PolarHBondContact O-N 2.89Å; A198-A202 WeakPolarHBondContact O-CB 3.42Å; A198-A202 PolarHBondContact O-N 3.38Å
199	V	98.7	Very high	98.5	Very high	94 Å²	94	95.6 Å²	95.6	57%	0.57	48%	0.475	S	S	*	.	H	α-helix	trans	-66.3	-41.3	175.1	172.2	0	0	0	0	111.6	N195 Q197 A202 K203	N195-V199 WeakPolarHBondContact O-CG2 3.38Å; N195-V199 PolarHBondContact O-N 3.12Å; Q197-V199 PolarHBondContact O-N 3.33Å; V199-A202 PolarHBondContact O-N 3.14Å; V199-K203 PolarHBondContact O-N 3.2Å
200	K	98.6	Very high	98.4	Very high	127 Å²	127	96.2 Å²	96.2	55%	0.552	48%	0.478	S	S	*	.	H	α-helix	trans	-60.6	-44.6	173.2	-75.9	175.7	177.4	-175.7	0	111.7	V196 Q197 K203 E204	V196-K200 HydrophobicContact CG1-CD 4.36Å; V196-K200 WeakPolarHBondContact O-CG 3.32Å; V196-K200 PolarHBondContact O-N 3.46Å; Q197-K200 PolarHBondContact O-N 3.13Å; K200-K203 PolarHBondContact O-N 2.99Å; K200-E204 PolarHBondContact O-N 3.22Å; K200-E204 VanDerWaalsContact O-N 3.12Å
201	Q	98.5	Very high	98.4	Very high	128 Å²	128	99 Å²	99	60%	0.598	49%	0.485	S	S	*	.	H	α-helix	trans	-65.3	-43.9	177.7	-174.7	176.2	3.5	0	0	111.8	Q197 A198 K203 E204 E205	Q197-Q201 WeakPolarHBondContact O-CB 3.37Å; Q197-Q201 PolarHBondContact O-N 3.25Å; A198-Q201 PolarHBondContact O-N 2.89Å; Q201-K203 VanDerWaalsContact C-N 3.3Å; Q201-K203 PolarHBondContact O-N 3.49Å; Q201-E204 PolarHBondContact O-N 2.99Å; Q201-E204 VanDerWaalsContact O-N 3.16Å; Q201-E205 PolarHBondContact O-N 2.76Å
202	A	98.6	Very high	98.3	Very high	57 Å²	57	100.2 Å²	100.2	47%	0.471	49%	0.492	S	S	.	.	H	α-helix	trans	-61.3	-37.6	177.3	0	0	0	0	0	112.3	A198 V199 E205 R206	A198-A202 WeakPolarHBondContact O-CB 3.42Å; A198-A202 PolarHBondContact O-N 3.38Å; V199-A202 PolarHBondContact O-N 3.14Å; A202-E205 WeakPolarHBondContact O-CB 3.38Å; A202-R206 PolarHBondContact O-N 3.15Å
203	K	98.3	Very high	98.2	Very high	141 Å²	141	98.2 Å²	98.2	61%	0.613	49%	0.485	S	S	*	.	H	α-helix	trans	-61.9	-49.2	171.6	-175.2	-139.9	170.5	-161.9	0	111.4	V199 K200 Q201 E205 R206 V207	V199-K203 PolarHBondContact O-N 3.2Å; K200-K203 PolarHBondContact O-N 2.99Å; Q201-K203 VanDerWaalsContact C-N 3.3Å; Q201-K203 PolarHBondContact O-N 3.49Å; K203-E205 VanDerWaalsContact C-N 3.28Å; K203-E205 PolarHBondContact O-N 2.91Å; K203-R206 PolarHBondContact O-N 2.98Å; K203-V207 WeakPolarHBondContact O-CG2 3.45Å; K203-V207 PolarHBondContact O-N 3.42Å
204	E	98.5	Very high	98.1	Very high	82 Å²	82	96.5 Å²	96.5	38%	0.383	48%	0.482	S	S	.	.	H	α-helix	trans	-69.1	-27.6	-177.2	-162.7	59.4	-153.9	0	0	112.7	K200 Q201 R208 R211	K200-E204 PolarHBondContact O-N 3.22Å; K200-E204 VanDerWaalsContact O-N 3.12Å; Q201-E204 PolarHBondContact O-N 2.99Å; Q201-E204 VanDerWaalsContact O-N 3.16Å; E204-R208 WeakPolarHBondContact O-CB 3.28Å; E204-R208 PolarHBondContact O-N 3.46Å; E204-R211 IonicContact OE1-NH1 3.86Å; E204-R211 PolarHBondContact OE1-NH1 2.85Å
205	E	98.5	Very high	98	Very high	70 Å²	70	96.7 Å²	96.7	33%	0.327	48%	0.484	S	S	.	.	H	α-helix	trans	-56.8	-54.3	167.9	-157.9	65.3	-145.9	0	0	110.7	Q201 A202 K203 V207 R208 E209	Q201-E205 PolarHBondContact O-N 2.76Å; A202-E205 WeakPolarHBondContact O-CB 3.38Å; K203-E205 VanDerWaalsContact C-N 3.28Å; K203-E205 PolarHBondContact O-N 2.91Å; E205-V207 PolarHBondContact O-N 2.95Å; E205-R208 WeakPolarHBondContact O-CB 3.29Å; E205-R208 PolarHBondContact O-N 2.68Å; E205-R208 IonicContact OE1-CZ 3.15Å; E205-R208 IonicContact OE1-NH1 2.63Å; E205-R208 PolarHBondContact OE1-NH1 2.66Å; E205-R208 IonicContact OE1-NH2 2.64Å; E205-R208 IonicContact OE2-CZ 2.74Å; E205-R208 IonicContact OE2-NH1 2.72Å; E205-R208 PolarHBondContact OE2-NH1 2.8Å; E205-R208 IonicContact OE2-NH2 2.71Å; E205-R208 PolarHBondContact OE2-NH2 3.22Å; E205-E209 WeakPolarHBondContact O-CG 3.39Å; E205-E209 PolarHBondContact O-N 3.43Å
206	R	98.1	Very high	98	Very high	157 Å²	157	96.9 Å²	96.9	59%	0.592	49%	0.485	S	S	*	.	H	α-helix	trans	-67.2	-33.1	-179.8	-58.3	-48.6	173.5	96.7	-9.8	113.5	A202 K203 R208 E209 L210	A202-R206 PolarHBondContact O-N 3.15Å; K203-R206 PolarHBondContact O-N 2.98Å; R206-R208 VanDerWaalsContact C-N 3.29Å; R206-R208 PolarHBondContact O-N 2.86Å; R206-E209 VanDerWaalsContact CD-OE1 3.32Å; R206-E209 WeakPolarHBondContact CD-OE1 3.42Å; R206-E209 WeakPolarHBondContact CD-OE2 3.49Å; R206-E209 IonicContact CZ-OE2 3.06Å; R206-E209 IonicContact NE-OE1 2.68Å; R206-E209 PolarHBondContact NE-OE1 2.81Å; R206-E209 IonicContact NE-OE2 2.66Å; R206-E209 PolarHBondContact NE-OE2 3.26Å; R206-L210 WeakPolarHBondContact O-CB 3.37Å; R206-L210 WeakPolarHBondContact O-CD1 3.07Å; R206-L210 WeakPolarHBondContact O-CG 2.82Å; R206-L210 PolarHBondContact O-N 3.34Å
207	V	98.4	Very high	97.8	Very high	36 Å²	36	94.5 Å²	94.5	22%	0.218	47%	0.469	C	S	.	.	H	α-helix	trans	-63.7	-36.3	171.2	171.2	0	0	0	0	111.3	K203 E205 R211	K203-V207 WeakPolarHBondContact O-CG2 3.45Å; K203-V207 PolarHBondContact O-N 3.42Å; E205-V207 PolarHBondContact O-N 2.95Å; V207-R211 VanDerWaalsContact CG1-CZ 3.43Å; V207-R211 VanDerWaalsContact O-CG 3.32Å; V207-R211 WeakPolarHBondContact O-CG 3.48Å; V207-R211 PolarHBondContact O-N 3.26Å; V207-R211 VanDerWaalsContact O-N 3.13Å
208	R	98.3	Very high	97.7	Very high	120 Å²	120	92.3 Å²	92.3	45%	0.453	46%	0.464	S	S	.	.	H	α-helix	trans	-75.3	-42	177.8	-155.7	-168.1	-33.2	105.3	8.2	112.7	E204 E205 R206 L210 R211 N212	E204-R208 WeakPolarHBondContact O-CB 3.28Å; E204-R208 PolarHBondContact O-N 3.46Å; E205-R208 WeakPolarHBondContact O-CB 3.29Å; E205-R208 PolarHBondContact O-N 2.68Å; E205-R208 IonicContact OE1-CZ 3.15Å; E205-R208 IonicContact OE1-NH1 2.63Å; E205-R208 PolarHBondContact OE1-NH1 2.66Å; E205-R208 IonicContact OE1-NH2 2.64Å; E205-R208 IonicContact OE2-CZ 2.74Å; E205-R208 IonicContact OE2-NH1 2.72Å; E205-R208 PolarHBondContact OE2-NH1 2.8Å; E205-R208 IonicContact OE2-NH2 2.71Å; E205-R208 PolarHBondContact OE2-NH2 3.22Å; R206-R208 VanDerWaalsContact C-N 3.29Å; R206-R208 PolarHBondContact O-N 2.86Å; R208-L210 VanDerWaalsContact C-N 3.33Å; R208-L210 PolarHBondContact O-N 2.85Å; R208-R211 PolarHBondContact O-N 3.01Å; R208-N212 PolarHBondContact O-N 2.84Å
209	E	97.5	Very high	97.6	Very high	91 Å²	91	92.6 Å²	92.6	43%	0.425	47%	0.466	S	S	.	.	H	α-helix	trans	-54.7	-49.7	171.9	-71	169.4	-155.4	0	0	110.6	E205 R206 R211 N212 A213	E205-E209 WeakPolarHBondContact O-CG 3.39Å; E205-E209 PolarHBondContact O-N 3.43Å; R206-E209 VanDerWaalsContact CD-OE1 3.32Å; R206-E209 WeakPolarHBondContact CD-OE1 3.42Å; R206-E209 WeakPolarHBondContact CD-OE2 3.49Å; R206-E209 IonicContact CZ-OE2 3.06Å; R206-E209 IonicContact NE-OE1 2.68Å; R206-E209 PolarHBondContact NE-OE1 2.81Å; R206-E209 IonicContact NE-OE2 2.66Å; R206-E209 PolarHBondContact NE-OE2 3.26Å; E209-R211 PolarHBondContact O-N 3.05Å; E209-N212 PolarHBondContact O-N 2.74Å; E209-A213 WeakPolarHBondContact O-CB 3.5Å; E209-A213 PolarHBondContact O-N 2.71Å
210	L	96.8	Very high	97.5	Very high	116 Å²	116	93.8 Å²	93.8	61%	0.607	46%	0.46	S	S	*	.	H	α-helix	trans	-63.4	-39.7	178.8	-72.8	169.2	0	0	0	113.3	R206 R208 V214	R206-L210 WeakPolarHBondContact O-CB 3.37Å; R206-L210 WeakPolarHBondContact O-CD1 3.07Å; R206-L210 WeakPolarHBondContact O-CG 2.82Å; R206-L210 PolarHBondContact O-N 3.34Å; R208-L210 VanDerWaalsContact C-N 3.33Å; R208-L210 PolarHBondContact O-N 2.85Å; L210-V214 WeakPolarHBondContact O-CG2 3.33Å; L210-V214 PolarHBondContact O-N 2.87Å
211	R	97.7	Very high	97.4	Very high	134 Å²	134	90.5 Å²	90.5	51%	0.506	45%	0.448	S	S	.	.	H	α-helix	trans	-62.1	-50.4	175.6	-77.1	172.8	-175.9	149.4	3.9	111.5	E204 V207 R208 E209 A213 V214 E215	E204-R211 IonicContact OE1-NH1 3.86Å; E204-R211 PolarHBondContact OE1-NH1 2.85Å; V207-R211 VanDerWaalsContact CG1-CZ 3.43Å; V207-R211 VanDerWaalsContact O-CG 3.32Å; V207-R211 WeakPolarHBondContact O-CG 3.48Å; V207-R211 PolarHBondContact O-N 3.26Å; V207-R211 VanDerWaalsContact O-N 3.13Å; R208-R211 PolarHBondContact O-N 3.01Å; E209-R211 PolarHBondContact O-N 3.05Å; R211-A213 VanDerWaalsContact C-N 3.34Å; R211-A213 PolarHBondContact O-N 3.4Å; R211-V214 PolarHBondContact O-N 2.85Å; R211-E215 WeakPolarHBondContact O-CB 3.37Å; R211-E215 VanDerWaalsContact O-CG 3.28Å; R211-E215 WeakPolarHBondContact O-CG 3.4Å; R211-E215 PolarHBondContact O-N 3.06Å
212	N	97.6	Very high	97.4	Very high	95 Å²	95	88 Å²	88	51%	0.508	44%	0.44	S	S	.	.	H	α-helix	trans	-59.5	-43.5	178.7	-174.6	23.9	0	0	0	111.6	R208 E209 V214 E215 L216	R208-N212 PolarHBondContact O-N 2.84Å; E209-N212 PolarHBondContact O-N 2.74Å; N212-V214 PolarHBondContact O-N 3.4Å; N212-E215 PolarHBondContact O-N 2.87Å; N212-L216 WeakPolarHBondContact O-CG 3.43Å; N212-L216 PolarHBondContact O-N 3.1Å
213	A	96.4	Very high	97.3	Very high	49 Å²	49	88.8 Å²	88.8	41%	0.405	44%	0.441	S	S	.	.	H	α-helix	trans	-59.8	-46.8	175.3	0	0	0	0	0	112.2	E209 R211 E215 L216 M217	E209-A213 WeakPolarHBondContact O-CB 3.5Å; E209-A213 PolarHBondContact O-N 2.71Å; R211-A213 VanDerWaalsContact C-N 3.34Å; R211-A213 PolarHBondContact O-N 3.4Å; A213-E215 PolarHBondContact O-N 2.85Å; A213-L216 PolarHBondContact O-N 2.99Å; A213-M217 VanDerWaalsContact O-CG 3.3Å; A213-M217 WeakPolarHBondContact O-CG 3.38Å; A213-M217 PolarHBondContact O-N 2.88Å
214	V	96.4	Very high	97.2	Very high	70 Å²	70	84.8 Å²	84.8	42%	0.424	43%	0.425	S	S	.	.	H	α-helix	trans	-66.2	-36.9	177.7	170.9	0	0	0	0	112	L210 R211 N212 M217 V218	L210-V214 WeakPolarHBondContact O-CG2 3.33Å; L210-V214 PolarHBondContact O-N 2.87Å; R211-V214 PolarHBondContact O-N 2.85Å; N212-V214 PolarHBondContact O-N 3.4Å; V214-M217 WeakPolarHBondContact O-CB 3.45Å; V214-M217 PolarHBondContact O-N 2.88Å; V214-V218 HydrophobicContact CG1-CG2 4.48Å; V214-V218 WeakPolarHBondContact O-CG2 3.47Å; V214-V218 PolarHBondContact O-N 3.09Å
215	E	97.1	Very high	97.1	Very high	122 Å²	122	84.6 Å²	84.6	57%	0.57	43%	0.426	S	S	*	.	H	α-helix	trans	-62.8	-41.3	175.4	-74.1	159.2	-165.3	0	0	111.4	R211 N212 A213 M217 V218 A219	R211-E215 WeakPolarHBondContact O-CB 3.37Å; R211-E215 VanDerWaalsContact O-CG 3.28Å; R211-E215 WeakPolarHBondContact O-CG 3.4Å; R211-E215 PolarHBondContact O-N 3.06Å; N212-E215 PolarHBondContact O-N 2.87Å; A213-E215 PolarHBondContact O-N 2.85Å; E215-M217 VanDerWaalsContact C-N 3.35Å; E215-M217 PolarHBondContact O-N 3.41Å; E215-V218 PolarHBondContact O-N 3.36Å; E215-A219 PolarHBondContact O-N 2.91Å; E215-A219 VanDerWaalsContact O-N 3.12Å
216	L	97.1	Very high	97.1	Very high	105 Å²	105	88 Å²	88	55%	0.55	44%	0.44	S	S	.	.	H	α-helix	trans	-67.9	-29.4	173.3	-68.8	170.5	0	0	0	113.6	N212 A213 R220	N212-L216 WeakPolarHBondContact O-CG 3.43Å; N212-L216 PolarHBondContact O-N 3.1Å; A213-L216 PolarHBondContact O-N 2.99Å; L216-R220 PolarHBondContact O-N 2.97Å
217	M	96.5	Very high	97	Very high	22 Å²	22	84.1 Å²	84.1	11%	0.108	44%	0.437	C	S	.	.	H	α-helix	trans	-71.8	-44.9	173.1	-69.2	174.5	54.2	0	0	112	A213 V214 E215 A219 R220 L221 E299 I300	A213-M217 VanDerWaalsContact O-CG 3.3Å; A213-M217 WeakPolarHBondContact O-CG 3.38Å; A213-M217 PolarHBondContact O-N 2.88Å; V214-M217 WeakPolarHBondContact O-CB 3.45Å; V214-M217 PolarHBondContact O-N 2.88Å; E215-M217 VanDerWaalsContact C-N 3.35Å; E215-M217 PolarHBondContact O-N 3.41Å; M217-A219 VanDerWaalsContact C-N 3.34Å; M217-A219 PolarHBondContact O-N 3.42Å; M217-R220 WeakPolarHBondContact O-CB 3.49Å; M217-R220 PolarHBondContact O-N 3.45Å; M217-L221 PolarHBondContact O-N 2.92Å; M217-E299 HydrophobicContact CE-CB 3.63Å; M217-E299 HydrophobicContact CE-CG 4.16Å; M217-E299 HydrophobicContact CG-CB 4.48Å; M217-E299 WeakPolarHBondContact CG-OE1 3.15Å; M217-E299 HydrophobicContact SD-CB 4.18Å; M217-I300 HydrophobicContact CE-CB 4.2Å; M217-I300 HydrophobicContact CE-CD1 4.16Å; M217-I300 HydrophobicContact CE-CG1 3.8Å; M217-I300 HydrophobicContact CE-CG2 3.74Å; M217-I300 HydrophobicContact SD-CG2 3.65Å
218	V	96.4	Very high	97	Very high	72 Å²	72	84.4 Å²	84.4	44%	0.436	44%	0.435	S	S	.	.	H	α-helix	trans	-59.4	-46.5	177.4	171	0	0	0	0	110.4	V214 E215 R220 L221 D222	V214-V218 HydrophobicContact CG1-CG2 4.48Å; V214-V218 WeakPolarHBondContact O-CG2 3.47Å; V214-V218 PolarHBondContact O-N 3.09Å; E215-V218 PolarHBondContact O-N 3.36Å; V218-R220 PolarHBondContact O-N 3.21Å; V218-R220 VanDerWaalsContact O-N 3.14Å; V218-L221 PolarHBondContact O-N 2.85Å; V218-L221 VanDerWaalsContact O-N 3.07Å; V218-D222 PolarHBondContact O-N 3.31Å
219	A	96.7	Very high	96.9	Very high	57 Å²	57	82.5 Å²	82.5	47%	0.471	43%	0.433	S	S	.	.	H	α-helix	trans	-58.4	-28.8	175.7	0	0	0	0	0	113.5	E215 M217 S223	E215-A219 PolarHBondContact O-N 2.91Å; E215-A219 VanDerWaalsContact O-N 3.12Å; M217-A219 VanDerWaalsContact C-N 3.34Å; M217-A219 PolarHBondContact O-N 3.42Å; A219-S223 PolarHBondContact O-N 2.96Å
220	R	96.6	Very high	96.9	Very high	118 Å²	118	83 Å²	83	45%	0.445	44%	0.442	S	S	.	.	H	α-helix	trans	-78.5	-37.3	175.9	-153.6	-178.6	-47.8	149.5	32.5	112.5	L216 M217 V218 S223 Q224 E299	L216-R220 PolarHBondContact O-N 2.97Å; M217-R220 WeakPolarHBondContact O-CB 3.49Å; M217-R220 PolarHBondContact O-N 3.45Å; V218-R220 PolarHBondContact O-N 3.21Å; V218-R220 VanDerWaalsContact O-N 3.14Å; R220-S223 WeakPolarHBondContact O-CB 3.22Å; R220-S223 PolarHBondContact O-N 3.49Å; R220-Q224 WeakPolarHBondContact O-CG 3.22Å; R220-Q224 PolarHBondContact O-N 2.64Å; R220-E299 IonicContact CZ-OE1 3.5Å; R220-E299 IonicContact CZ-OE2 2.98Å; R220-E299 IonicContact NE-OE1 3.75Å; R220-E299 IonicContact NH1-OE1 2.73Å; R220-E299 PolarHBondContact NH1-OE1 3.36Å; R220-E299 VanDerWaalsContact NH1-OE1 3.15Å; R220-E299 IonicContact NH1-OE2 3.09Å; R220-E299 PolarHBondContact NH1-OE2 3.43Å; R220-E299 VanDerWaalsContact NH2-CD 3.27Å; R220-E299 IonicContact NH2-OE1 3.99Å; R220-E299 PolarHBondContact NH2-OE1 3.39Å; R220-E299 IonicContact NH2-OE2 2.63Å; R220-E299 PolarHBondContact NH2-OE2 2.93Å
221	L	96.5	Very high	96.8	Very high	58 Å²	58	80.4 Å²	80.4	30%	0.304	43%	0.431	S	S	.	.	H	α-helix	trans	-64.1	-41.6	171.9	-67.8	170.1	0	0	0	111.2	M217 V218 S223 Q224 L225 F296	M217-L221 PolarHBondContact O-N 2.92Å; V218-L221 PolarHBondContact O-N 2.85Å; V218-L221 VanDerWaalsContact O-N 3.07Å; L221-S223 VanDerWaalsContact C-N 3.26Å; L221-S223 PolarHBondContact O-N 3.24Å; L221-Q224 PolarHBondContact O-N 2.93Å; L221-L225 WeakPolarHBondContact O-CB 3.38Å; L221-L225 PolarHBondContact O-N 3.3Å; L221-F296 HydrophobicContact CD2-CB 4.04Å; L221-F296 HydrophobicContact CD2-CD1 4.21Å
222	D	96.8	Very high	96.7	Very high	77 Å²	77	77.8 Å²	77.8	41%	0.412	43%	0.427	S	S	.	.	H	α-helix	trans	-60.3	-36.6	172.7	-69.5	-29.3	0	0	0	112.1	V218 K226	V218-D222 PolarHBondContact O-N 3.31Å; D222-K226 WeakPolarHBondContact O-CD 3.31Å; D222-K226 VanDerWaalsContact O-CG 3.26Å; D222-K226 WeakPolarHBondContact O-CG 3.26Å; D222-K226 PolarHBondContact O-N 2.93Å
223	S	96.6	Very high	96.6	Very high	72 Å²	72	78.8 Å²	78.8	50%	0.503	43%	0.43	S	S	.	.	H	α-helix	trans	-69.8	-42.7	175.4	-173.8	0	0	0	0	112.2	A219 R220 L221 L225 K226 S227	A219-S223 PolarHBondContact O-N 2.96Å; R220-S223 WeakPolarHBondContact O-CB 3.22Å; R220-S223 PolarHBondContact O-N 3.49Å; L221-S223 VanDerWaalsContact C-N 3.26Å; L221-S223 PolarHBondContact O-N 3.24Å; S223-L225 VanDerWaalsContact C-N 3.33Å; S223-L225 PolarHBondContact O-N 2.89Å; S223-K226 PolarHBondContact O-N 3.33Å; S223-S227 PolarHBondContact O-N 3.08Å
224	Q	96.7	Very high	96.5	Very high	58 Å²	58	79.3 Å²	79.3	27%	0.271	43%	0.431	S	S	.	.	H	α-helix	trans	-60.1	-42.5	172.4	-71.6	176.3	14.5	0	0	111.7	R220 L221 S227 K228 F296	R220-Q224 WeakPolarHBondContact O-CG 3.22Å; R220-Q224 PolarHBondContact O-N 2.64Å; L221-Q224 PolarHBondContact O-N 2.93Å; Q224-S227 PolarHBondContact O-N 2.88Å; Q224-K228 WeakPolarHBondContact O-CG 3.49Å; Q224-K228 PolarHBondContact O-N 3.44Å; Q224-F296 HydrophobicContact CB-CD1 4.09Å; Q224-F296 HydrophobicContact CB-CE1 4.04Å
225	L	96.7	Very high	96.4	Very high	78 Å²	78	77.9 Å²	77.9	41%	0.408	42%	0.419	S	S	.	.	H	α-helix	trans	-62.2	-48.1	177.6	176.4	61.8	0	0	0	111	L221 S223 S227 K228 L229 F296	L221-L225 WeakPolarHBondContact O-CB 3.38Å; L221-L225 PolarHBondContact O-N 3.3Å; S223-L225 VanDerWaalsContact C-N 3.33Å; S223-L225 PolarHBondContact O-N 2.89Å; L225-S227 VanDerWaalsContact C-N 3.34Å; L225-S227 PolarHBondContact O-N 3.34Å; L225-K228 PolarHBondContact O-N 2.72Å; L225-L229 HydrophobicContact CD1-CD1 3.87Å; L225-L229 HydrophobicContact CD1-CG 4.05Å; L225-L229 HydrophobicContact CG-CD1 3.91Å; L225-L229 HydrophobicContact CG-CG 4.47Å; L225-L229 WeakPolarHBondContact O-CB 3.49Å; L225-L229 VanDerWaalsContact O-CG 3.28Å; L225-L229 WeakPolarHBondContact O-CG 3.46Å; L225-L229 PolarHBondContact O-N 2.63Å; L225-F296 HydrophobicContact CB-CE1 3.99Å; L225-F296 HydrophobicContact CB-CZ 4.2Å; L225-F296 HydrophobicContact CD1-CZ 3.98Å
226	K	97.8	Very high	96.2	Very high	142 Å²	142	79 Å²	79	62%	0.617	42%	0.419	S	S	*	.	H	α-helix	trans	-58.4	-44.1	175.8	-73.5	165.9	-175.4	173	0	112	D222 S223 L229 V230	D222-K226 WeakPolarHBondContact O-CD 3.31Å; D222-K226 VanDerWaalsContact O-CG 3.26Å; D222-K226 WeakPolarHBondContact O-CG 3.26Å; D222-K226 PolarHBondContact O-N 2.93Å; S223-K226 PolarHBondContact O-N 3.33Å; K226-L229 PolarHBondContact O-N 3.25Å; K226-V230 WeakPolarHBondContact O-CG2 3.31Å; K226-V230 PolarHBondContact O-N 2.86Å
227	S	96.8	Very high	96.1	Very high	75 Å²	75	77.4 Å²	77.4	52%	0.524	42%	0.416	S	S	.	.	H	α-helix	trans	-60.9	-52.4	177	174.2	0	0	0	0	112.1	S223 Q224 L225 L229 V230 T231	S223-S227 PolarHBondContact O-N 3.08Å; Q224-S227 PolarHBondContact O-N 2.88Å; L225-S227 VanDerWaalsContact C-N 3.34Å; L225-S227 PolarHBondContact O-N 3.34Å; S227-L229 VanDerWaalsContact C-N 3.3Å; S227-L229 PolarHBondContact O-N 3.17Å; S227-V230 PolarHBondContact O-N 3.44Å; S227-T231 PolarHBondContact O-N 2.89Å; S227-T231 VanDerWaalsContact O-N 3.14Å; S227-T231 PolarHBondContact O-OG1 2.81Å
228	K	97.5	Very high	95.9	Very high	41 Å²	41	81.1 Å²	81.1	18%	0.178	43%	0.433	C	S	.	.	H	α-helix	trans	-56.9	-42.5	176.6	-69	171.1	-171	-83.3	0	111.9	Q224 L225 T231 L232 V292 P293 D295 F296	Q224-K228 WeakPolarHBondContact O-CG 3.49Å; Q224-K228 PolarHBondContact O-N 3.44Å; L225-K228 PolarHBondContact O-N 2.72Å; K228-T231 PolarHBondContact O-N 2.72Å; K228-L232 WeakPolarHBondContact O-CG 3.25Å; K228-L232 PolarHBondContact O-N 3.48Å; K228-V292 HydrophobicContact CB-CG1 3.93Å; K228-V292 HydrophobicContact CG-CG1 3.94Å; K228-P293 PolarHBondContact NZ-O 3.46Å; K228-D295 VanDerWaalsContact CE-O 3.31Å; K228-D295 WeakPolarHBondContact CE-O 3.33Å; K228-D295 PolarHBondContact NZ-O 3.24Å; K228-F296 HydrophobicContact CD-CE1 3.98Å; K228-F296 HydrophobicContact CD-CE2 4.29Å; K228-F296 HydrophobicContact CD-CZ 3.71Å
229	L	96.9	Very high	95.8	Very high	80 Å²	80	81.6 Å²	81.6	42%	0.419	43%	0.433	S	S	.	.	H	α-helix	trans	-67.5	-37.9	178.9	-73.2	174.3	0	0	0	113.1	L225 K226 S227 L232 M233	L225-L229 HydrophobicContact CD1-CD1 3.87Å; L225-L229 HydrophobicContact CD1-CG 4.05Å; L225-L229 HydrophobicContact CG-CD1 3.91Å; L225-L229 HydrophobicContact CG-CG 4.47Å; L225-L229 WeakPolarHBondContact O-CB 3.49Å; L225-L229 VanDerWaalsContact O-CG 3.28Å; L225-L229 WeakPolarHBondContact O-CG 3.46Å; L225-L229 PolarHBondContact O-N 2.63Å; K226-L229 PolarHBondContact O-N 3.25Å; S227-L229 VanDerWaalsContact C-N 3.3Å; S227-L229 PolarHBondContact O-N 3.17Å; L229-L232 PolarHBondContact O-N 3.04Å; L229-M233 WeakPolarHBondContact O-CB 3.24Å; L229-M233 WeakPolarHBondContact O-CG 3.36Å; L229-M233 PolarHBondContact O-N 2.88Å
230	V	97	Very high	95.7	Very high	101 Å²	101	83 Å²	83	61%	0.612	43%	0.428	S	S	*	.	H	α-helix	trans	-64.5	-42.3	175.4	167.7	0	0	0	0	111	K226 S227 M233 S234	K226-V230 WeakPolarHBondContact O-CG2 3.31Å; K226-V230 PolarHBondContact O-N 2.86Å; S227-V230 PolarHBondContact O-N 3.44Å; V230-M233 PolarHBondContact O-N 3.1Å; V230-S234 WeakPolarHBondContact O-CB 3.38Å; V230-S234 PolarHBondContact O-N 2.81Å
231	T	95.7	Very high	95.5	Very high	63 Å²	63	83.9 Å²	83.9	39%	0.387	44%	0.437	S	S	.	.	H	α-helix	trans	-59.6	-48.6	173.6	-55.7	0	0	0	0	111.6	S227 K228 M233 S234 Q235 V292	S227-T231 PolarHBondContact O-N 2.89Å; S227-T231 VanDerWaalsContact O-N 3.14Å; S227-T231 PolarHBondContact O-OG1 2.81Å; K228-T231 PolarHBondContact O-N 2.72Å; T231-M233 PolarHBondContact O-N 3.46Å; T231-S234 PolarHBondContact O-N 2.83Å; T231-Q235 WeakPolarHBondContact O-CG 3.49Å; T231-Q235 PolarHBondContact O-N 2.94Å; T231-V292 HydrophobicContact CG2-CG2 3.86Å
232	L	95.6	Very high	95.3	Very high	79 Å²	79	82.8 Å²	82.8	41%	0.414	43%	0.431	S	S	.	.	H	α-helix	trans	-63.3	-39.2	177.9	-72.5	168.5	0	0	0	112.7	K228 L229 R236 V292	K228-L232 WeakPolarHBondContact O-CG 3.25Å; K228-L232 PolarHBondContact O-N 3.48Å; L229-L232 PolarHBondContact O-N 3.04Å; L232-R236 VanDerWaalsContact O-CB 3.25Å; L232-R236 WeakPolarHBondContact O-CB 3.31Å; L232-R236 PolarHBondContact O-N 2.85Å; L232-V292 HydrophobicContact CD1-CB 4.49Å; L232-V292 HydrophobicContact CD2-CB 3.97Å; L232-V292 HydrophobicContact CD2-CG2 3.73Å; L232-V292 HydrophobicContact CG-CB 4.13Å; L232-V292 HydrophobicContact CG-CG2 3.93Å
233	M	95.6	Very high	95.2	Very high	115 Å²	115	82 Å²	82	57%	0.567	43%	0.426	S	S	*	.	H	α-helix	trans	-67.6	-36.2	176	-77.7	-175.2	169.8	0	0	112.4	L229 V230 T231 S237	L229-M233 WeakPolarHBondContact O-CB 3.24Å; L229-M233 WeakPolarHBondContact O-CG 3.36Å; L229-M233 PolarHBondContact O-N 2.88Å; V230-M233 PolarHBondContact O-N 3.1Å; T231-M233 PolarHBondContact O-N 3.46Å; M233-S237 WeakPolarHBondContact O-CB 3.27Å; M233-S237 PolarHBondContact O-N 2.94Å
234	S	93.7	Very high	95.2	Very high	61 Å²	61	84.2 Å²	84.2	43%	0.427	43%	0.428	S	S	.	.	H	α-helix	trans	-65.4	-49.4	174.7	-178.5	0	0	0	0	111.4	V230 T231 R236 S237 Q238	V230-S234 WeakPolarHBondContact O-CB 3.38Å; V230-S234 PolarHBondContact O-N 2.81Å; T231-S234 PolarHBondContact O-N 2.83Å; S234-R236 VanDerWaalsContact C-N 3.34Å; S234-R236 PolarHBondContact O-N 2.93Å; S234-S237 WeakPolarHBondContact O-CB 3.48Å; S234-S237 PolarHBondContact O-N 2.69Å; S234-S237 VanDerWaalsContact O-N 3.09Å; S234-Q238 WeakPolarHBondContact O-CG 3.34Å; S234-Q238 PolarHBondContact O-N 2.77Å
235	Q	93.5	Very high	94.9	Very high	39 Å²	39	84 Å²	84	18%	0.182	43%	0.433	C	S	.	.	H	α-helix	trans	-56.6	-46.3	174	-70.9	168.5	-17.4	0	0	111.6	T231 S237 Q238 L239 S289	T231-Q235 WeakPolarHBondContact O-CG 3.49Å; T231-Q235 PolarHBondContact O-N 2.94Å; Q235-S237 VanDerWaalsContact C-N 3.31Å; Q235-S237 PolarHBondContact O-N 2.83Å; Q235-Q238 PolarHBondContact O-N 3.02Å; Q235-L239 WeakPolarHBondContact O-CG 3.47Å; Q235-L239 PolarHBondContact O-N 3.22Å; Q235-L239 VanDerWaalsContact O-N 3.1Å; Q235-S289 PolarHBondContact NE2-OG 3.02Å
236	R	94.2	Very high	94.7	Very high	147 Å²	147	82.9 Å²	82.9	56%	0.555	43%	0.428	S	S	*	.	H	α-helix	trans	-59.3	-41.1	175.6	-167.4	-162.1	71.5	159.8	5.2	111.9	L232 S234 L239 F240	L232-R236 VanDerWaalsContact O-CB 3.25Å; L232-R236 WeakPolarHBondContact O-CB 3.31Å; L232-R236 PolarHBondContact O-N 2.85Å; S234-R236 VanDerWaalsContact C-N 3.34Å; S234-R236 PolarHBondContact O-N 2.93Å; R236-L239 PolarHBondContact O-N 3.05Å; R236-F240 HydrophobicContact CG-CD2 3.92Å; R236-F240 HydrophobicContact CG-CE2 3.84Å; R236-F240 WeakPolarHBondContact O-CD2 3.49Å; R236-F240 PolarHBondContact O-N 2.86Å
237	S	94.3	Very high	94.7	Very high	71 Å²	71	80.6 Å²	80.6	50%	0.497	42%	0.419	S	S	.	.	H	α-helix	trans	-68.1	-39.1	-179.8	-158.3	0	0	0	0	112.6	M233 S234 Q235 F240 Q241	M233-S237 WeakPolarHBondContact O-CB 3.27Å; M233-S237 PolarHBondContact O-N 2.94Å; S234-S237 WeakPolarHBondContact O-CB 3.48Å; S234-S237 PolarHBondContact O-N 2.69Å; S234-S237 VanDerWaalsContact O-N 3.09Å; Q235-S237 VanDerWaalsContact C-N 3.31Å; Q235-S237 PolarHBondContact O-N 2.83Å; S237-F240 PolarHBondContact O-N 3.45Å; S237-Q241 WeakPolarHBondContact O-CB 3.21Å; S237-Q241 PolarHBondContact O-N 3.32Å
238	Q	92.1	Very high	94.6	Very high	100 Å²	100	81.4 Å²	81.4	47%	0.467	42%	0.418	S	S	.	.	H	α-helix	trans	-63.9	-42	175.5	-69.9	168.5	-9.8	0	0	111.4	S234 Q235 Q241 E242	S234-Q238 WeakPolarHBondContact O-CG 3.34Å; S234-Q238 PolarHBondContact O-N 2.77Å; Q235-Q238 PolarHBondContact O-N 3.02Å; Q238-Q241 PolarHBondContact O-N 3.13Å; Q238-E242 PolarHBondContact O-N 3.02Å; Q238-E242 VanDerWaalsContact O-N 3.15Å
239	L	93.6	Very high	94.3	Very high	81 Å²	81	81.1 Å²	81.1	42%	0.424	42%	0.418	S	S	.	.	H	α-helix	trans	-64.3	-45.6	176.1	-71.1	168.8	0	0	0	112.2	Q235 R236 Q241 E242 I243 F287	Q235-L239 WeakPolarHBondContact O-CG 3.47Å; Q235-L239 PolarHBondContact O-N 3.22Å; Q235-L239 VanDerWaalsContact O-N 3.1Å; R236-L239 PolarHBondContact O-N 3.05Å; L239-Q241 PolarHBondContact O-N 3.19Å; L239-E242 PolarHBondContact O-N 2.75Å; L239-I243 WeakPolarHBondContact O-CD1 3.39Å; L239-I243 VanDerWaalsContact O-CG1 3.25Å; L239-I243 WeakPolarHBondContact O-CG1 3.37Å; L239-I243 PolarHBondContact O-N 3.48Å; L239-F287 HydrophobicContact CD2-CB 3.93Å; L239-F287 HydrophobicContact CD2-CD1 4.38Å; L239-F287 HydrophobicContact CD2-CG 4.45Å
240	F	95.3	Very high	94.2	Very high	86 Å²	86	82.6 Å²	82.6	38%	0.377	43%	0.425	S	S	.	.	H	α-helix	trans	-61.2	-42.1	176.5	-90.7	-67.5	0	0	0	112.7	R236 S237 E242 I243 E244 I890	R236-F240 HydrophobicContact CG-CD2 3.92Å; R236-F240 HydrophobicContact CG-CE2 3.84Å; R236-F240 WeakPolarHBondContact O-CD2 3.49Å; R236-F240 PolarHBondContact O-N 2.86Å; S237-F240 PolarHBondContact O-N 3.45Å; F240-E242 PolarHBondContact O-N 3.41Å; F240-I243 PolarHBondContact O-N 3.04Å; F240-E244 WeakPolarHBondContact O-CB 3.3Å; F240-E244 PolarHBondContact O-N 2.72Å; F240-I890 HydrophobicContact CE1-CD1 4.17Å; F240-I890 HydrophobicContact CZ-CD1 4.04Å
241	Q	93.7	Very high	94.1	Very high	137 Å²	137	83.9 Å²	83.9	64%	0.64	43%	0.425	S	S	*	.	H	α-helix	trans	-65.8	-37.8	179.9	-172	176.9	15.6	0	0	112.6	S237 Q238 L239 S245	S237-Q241 WeakPolarHBondContact O-CB 3.21Å; S237-Q241 PolarHBondContact O-N 3.32Å; Q238-Q241 PolarHBondContact O-N 3.13Å; L239-Q241 PolarHBondContact O-N 3.19Å; Q241-S245 WeakPolarHBondContact O-CB 3.42Å; Q241-S245 PolarHBondContact O-N 3.01Å; Q241-S245 VanDerWaalsContact O-N 3.07Å
242	E	92	Very high	94	Very high	35 Å²	35	86 Å²	86	16%	0.164	43%	0.433	C	S	.	.	H	α-helix	trans	-67.9	-44	174.3	-174.4	69.2	-156.3	0	0	110.8	Q238 L239 F240 S245 L246 K282 F287	Q238-E242 PolarHBondContact O-N 3.02Å; Q238-E242 VanDerWaalsContact O-N 3.15Å; L239-E242 PolarHBondContact O-N 2.75Å; F240-E242 PolarHBondContact O-N 3.41Å; E242-S245 PolarHBondContact O-N 3.27Å; E242-S245 PolarHBondContact O-OG 3.06Å; E242-L246 HydrophobicContact CG-CD1 4.13Å; E242-L246 VanDerWaalsContact O-CG 3.3Å; E242-L246 WeakPolarHBondContact O-CG 3.21Å; E242-L246 PolarHBondContact O-N 3.18Å; E242-K282 WeakPolarHBondContact OE1-CD 3.47Å; E242-K282 WeakPolarHBondContact OE1-CE 3.31Å; E242-K282 IonicContact OE1-NZ 3.92Å; E242-K282 PolarHBondContact OE1-NZ 3.49Å; E242-K282 IonicContact OE2-NZ 3.79Å; E242-K282 PolarHBondContact OE2-NZ 2.91Å; E242-F287 HydrophobicContact CB-CE1 3.91Å; E242-F287 HydrophobicContact CB-CZ 4.05Å; E242-F287 HydrophobicContact CG-CE1 3.96Å; E242-F287 HydrophobicContact CG-CE2 4.12Å; E242-F287 HydrophobicContact CG-CZ 3.57Å; E242-F287 WeakPolarHBondContact OE2-CZ 3.4Å
243	I	94.3	Very high	93.8	Very high	62 Å²	62	83.4 Å²	83.4	32%	0.318	42%	0.421	S	S	.	.	H	α-helix	trans	-55.8	-53.3	175.4	-70.2	164.1	0	0	0	110.8	L239 F240 S245 L246 E247	L239-I243 WeakPolarHBondContact O-CD1 3.39Å; L239-I243 VanDerWaalsContact O-CG1 3.25Å; L239-I243 WeakPolarHBondContact O-CG1 3.37Å; L239-I243 PolarHBondContact O-N 3.48Å; F240-I243 PolarHBondContact O-N 3.04Å; I243-S245 VanDerWaalsContact C-N 3.26Å; I243-S245 PolarHBondContact O-N 3.47Å; I243-L246 PolarHBondContact O-N 3.4Å; I243-E247 HydrophobicContact CG2-CG 4.24Å; I243-E247 WeakPolarHBondContact CG2-OE1 3.46Å; I243-E247 WeakPolarHBondContact O-CG 3.36Å; I243-E247 PolarHBondContact O-N 3.37Å
244	E	96.2	Very high	93.7	Very high	117 Å²	117	82.9 Å²	82.9	55%	0.547	42%	0.417	S	S	.	.	H	α-helix	trans	-56.8	-39.6	177.7	-178.7	179.9	-168.7	0	0	111.6	F240 L246 N248	F240-E244 WeakPolarHBondContact O-CB 3.3Å; F240-E244 PolarHBondContact O-N 2.72Å; E244-L246 VanDerWaalsContact C-N 3.34Å; E244-L246 PolarHBondContact O-N 3.47Å; E244-N248 WeakPolarHBondContact O-CB 3.39Å; E244-N248 PolarHBondContact O-N 2.77Å; E244-N248 VanDerWaalsContact O-N 3.09Å; E244-N248 PolarHBondContact O-ND2 3.09Å
245	S	91.6	Very high	93.6	Very high	53 Å²	53	86.7 Å²	86.7	37%	0.371	42%	0.423	S	S	.	.	H	α-helix	trans	-67.8	-32	176.9	79.2	0	0	0	0	113.6	Q241 E242 I243 L249	Q241-S245 WeakPolarHBondContact O-CB 3.42Å; Q241-S245 PolarHBondContact O-N 3.01Å; Q241-S245 VanDerWaalsContact O-N 3.07Å; E242-S245 PolarHBondContact O-N 3.27Å; E242-S245 PolarHBondContact O-OG 3.06Å; I243-S245 VanDerWaalsContact C-N 3.26Å; I243-S245 PolarHBondContact O-N 3.47Å; S245-L249 WeakPolarHBondContact O-CB 3.37Å; S245-L249 PolarHBondContact O-N 3.02Å
246	L	92.5	Very high	93.5	Very high	56 Å²	56	85.6 Å²	85.6	29%	0.293	42%	0.42	S	S	.	.	H	α-helix	trans	-78.5	-40.6	178	-67.6	171.1	0	0	0	111.5	E242 I243 E244 L249 L250 V279	E242-L246 HydrophobicContact CG-CD1 4.13Å; E242-L246 VanDerWaalsContact O-CG 3.3Å; E242-L246 WeakPolarHBondContact O-CG 3.21Å; E242-L246 PolarHBondContact O-N 3.18Å; I243-L246 PolarHBondContact O-N 3.4Å; E244-L246 VanDerWaalsContact C-N 3.34Å; E244-L246 PolarHBondContact O-N 3.47Å; L246-L249 PolarHBondContact O-N 3.37Å; L246-L250 WeakPolarHBondContact O-CB 3.43Å; L246-L250 VanDerWaalsContact O-CG 3.24Å; L246-L250 WeakPolarHBondContact O-CG 3.29Å; L246-L250 PolarHBondContact O-N 3.01Å; L246-V279 HydrophobicContact CD2-CB 4.5Å; L246-V279 HydrophobicContact CD2-CG1 3.44Å; L246-V279 VanDerWaalsContact CD2-CG1 3.44Å; L246-V279 HydrophobicContact CD2-CG2 4.21Å
247	E	96	Very high	93.3	Very high	94 Å²	94	82.3 Å²	82.3	44%	0.439	42%	0.417	S	S	.	.	H	α-helix	trans	-61.8	-44.9	175.8	-71.8	172.7	160.4	0	0	111.2	I243 L250 H251	I243-E247 HydrophobicContact CG2-CG 4.24Å; I243-E247 WeakPolarHBondContact CG2-OE1 3.46Å; I243-E247 WeakPolarHBondContact O-CG 3.36Å; I243-E247 PolarHBondContact O-N 3.37Å; E247-L250 PolarHBondContact O-N 3.49Å; E247-H251 WeakPolarHBondContact O-CB 3.33Å; E247-H251 PolarHBondContact O-N 2.86Å
248	N	94.8	Very high	93.2	Very high	92 Å²	92	84.3 Å²	84.3	49%	0.492	42%	0.422	S	S	.	.	H	α-helix	trans	-62.9	-45.5	174.4	-77	-62.9	0	0	0	112.3	E244 L250 H251 D252	E244-N248 WeakPolarHBondContact O-CB 3.39Å; E244-N248 PolarHBondContact O-N 2.77Å; E244-N248 VanDerWaalsContact O-N 3.09Å; E244-N248 PolarHBondContact O-ND2 3.09Å; N248-L250 VanDerWaalsContact C-N 3.35Å; N248-L250 PolarHBondContact O-N 3.34Å; N248-H251 PolarHBondContact O-N 2.95Å; N248-D252 PolarHBondContact O-N 3.34Å
249	L	92.6	Very high	93.2	Very high	34 Å²	34	83.8 Å²	83.8	18%	0.178	43%	0.425	C	S	.	.	H	α-helix	trans	-63.3	-40.3	177.2	179.6	64.6	0	0	0	112.1	S245 L246 H251 D252 V253 L275 L276 V279	S245-L249 WeakPolarHBondContact O-CB 3.37Å; S245-L249 PolarHBondContact O-N 3.02Å; L246-L249 PolarHBondContact O-N 3.37Å; L249-H251 VanDerWaalsContact C-N 3.34Å; L249-D252 PolarHBondContact O-N 3.29Å; L249-V253 HydrophobicContact CD1-CG2 4.07Å; L249-V253 HydrophobicContact CG-CG2 4.41Å; L249-V253 WeakPolarHBondContact O-CB 3.29Å; L249-V253 VanDerWaalsContact O-CG2 3.25Å; L249-V253 WeakPolarHBondContact O-CG2 3.07Å; L249-V253 PolarHBondContact O-N 3.1Å; L249-L275 HydrophobicContact CD1-CB 4.3Å; L249-L275 HydrophobicContact CD1-CD1 4.38Å; L249-L276 HydrophobicContact CD2-CD2 4.5Å; L249-V279 HydrophobicContact CD2-CG2 3.63Å
250	L	94	Very high	93	Very high	111 Å²	111	81.3 Å²	81.3	58%	0.581	42%	0.416	S	S	*	.	H	α-helix	trans	-63.9	-40.2	175.6	-74.5	169	0	0	0	111.3	L246 E247 N248 Q254	L246-L250 WeakPolarHBondContact O-CB 3.43Å; L246-L250 VanDerWaalsContact O-CG 3.24Å; L246-L250 WeakPolarHBondContact O-CG 3.29Å; L246-L250 PolarHBondContact O-N 3.01Å; E247-L250 PolarHBondContact O-N 3.49Å; N248-L250 VanDerWaalsContact C-N 3.35Å; N248-L250 PolarHBondContact O-N 3.34Å; L250-Q254 WeakPolarHBondContact O-CB 3.47Å; L250-Q254 PolarHBondContact O-N 3.49Å
251	H	95.5	Very high	92.8	Very high	129 Å²	129	83.9 Å²	83.9	60%	0.597	43%	0.427	S	S	*	.	H	α-helix	trans	-63.4	-49.6	175.1	-171.8	85.9	0	0	0	112	E247 N248 L249 V253 Q254 Y255	E247-H251 WeakPolarHBondContact O-CB 3.33Å; E247-H251 PolarHBondContact O-N 2.86Å; N248-H251 PolarHBondContact O-N 2.95Å; L249-H251 VanDerWaalsContact C-N 3.34Å; H251-V253 VanDerWaalsContact C-N 3.34Å; H251-V253 PolarHBondContact O-N 3.35Å; H251-Q254 PolarHBondContact O-N 3Å; H251-Y255 VanDerWaalsContact O-CB 3.31Å; H251-Y255 WeakPolarHBondContact O-CB 3.1Å; H251-Y255 PolarHBondContact O-N 3.41Å
252	D	92.5	Very high	92.7	Very high	107 Å²	107	82.7 Å²	82.7	57%	0.572	43%	0.432	S	S	*	.	H	α-helix	trans	-60	-42.4	178.3	-84.8	-16.7	0	0	0	112.2	N248 L249 A256	N248-D252 PolarHBondContact O-N 3.34Å; L249-D252 PolarHBondContact O-N 3.29Å; D252-A256 VanDerWaalsContact O-CB 3.27Å; D252-A256 WeakPolarHBondContact O-CB 3.45Å; D252-A256 PolarHBondContact O-N 3.07Å
253	V	91.2	Very high	92.7	Very high	24 Å²	24	85.4 Å²	85.4	15%	0.145	46%	0.455	C	S	.	.	H	α-helix	trans	-68.5	-43.3	177.8	170.4	0	0	0	0	111.3	L249 H251 A256 V257 I272	L249-V253 HydrophobicContact CD1-CG2 4.07Å; L249-V253 HydrophobicContact CG-CG2 4.41Å; L249-V253 WeakPolarHBondContact O-CB 3.29Å; L249-V253 VanDerWaalsContact O-CG2 3.25Å; L249-V253 WeakPolarHBondContact O-CG2 3.07Å; L249-V253 PolarHBondContact O-N 3.1Å; H251-V253 VanDerWaalsContact C-N 3.34Å; H251-V253 PolarHBondContact O-N 3.35Å; V253-A256 PolarHBondContact O-N 3.15Å; V253-V257 VanDerWaalsContact O-CG2 3.32Å; V253-V257 WeakPolarHBondContact O-CG2 3.45Å; V253-V257 PolarHBondContact O-N 3.41Å; V253-I272 HydrophobicContact CG1-CG2 3.86Å; V253-I272 HydrophobicContact CG2-CG2 3.94Å
254	Q	93.8	Very high	92.5	Very high	105 Å²	105	86.5 Å²	86.5	49%	0.491	46%	0.458	S	S	.	.	H	α-helix	trans	-64.3	-47	177.5	-175.3	59.7	47	0	0	111.3	L250 H251 A256 V257 D258	L250-Q254 WeakPolarHBondContact O-CB 3.47Å; L250-Q254 PolarHBondContact O-N 3.49Å; H251-Q254 PolarHBondContact O-N 3Å; Q254-A256 VanDerWaalsContact C-N 3.32Å; Q254-A256 PolarHBondContact O-N 2.73Å; Q254-V257 WeakPolarHBondContact O-CB 3.42Å; Q254-V257 PolarHBondContact O-N 3.18Å; Q254-V257 VanDerWaalsContact O-N 3.09Å; Q254-D258 PolarHBondContact NE2-OD1 3.2Å; Q254-D258 VanDerWaalsContact NE2-OD1 3.13Å; Q254-D258 PolarHBondContact NE2-OD2 2.68Å; Q254-D258 PolarHBondContact O-N 3.31Å
255	Y	93.2	Very high	92.3	Very high	140 Å²	140	82.9 Å²	82.9	55%	0.549	44%	0.442	S	S	.	.	H	α-helix	trans	-59.8	-41.7	175.8	178.5	-95.2	0	0	0	112	H251 V257 D258 V259	H251-Y255 VanDerWaalsContact O-CB 3.31Å; H251-Y255 WeakPolarHBondContact O-CB 3.1Å; H251-Y255 PolarHBondContact O-N 3.41Å; Y255-V257 VanDerWaalsContact C-N 3.35Å; Y255-V257 PolarHBondContact O-N 3.42Å; Y255-D258 PolarHBondContact O-N 3.08Å; Y255-V259 HydrophobicContact CD2-CG2 3.97Å; Y255-V259 HydrophobicContact CE1-CG2 4.44Å; Y255-V259 HydrophobicContact CE2-CG2 3.66Å; Y255-V259 HydrophobicContact CG-CG2 4.48Å; Y255-V259 WeakPolarHBondContact O-CB 3.06Å; Y255-V259 WeakPolarHBondContact O-CG2 3.25Å; Y255-V259 PolarHBondContact O-N 3.13Å
256	A	90.1	Very high	92.2	Very high	16 Å²	16	85.4 Å²	85.4	13%	0.132	46%	0.455	C	S	.	.	H	α-helix	trans	-61.8	-41.7	174	0	0	0	0	0	111.9	D252 V253 Q254 A260 M265 I272	D252-A256 VanDerWaalsContact O-CB 3.27Å; D252-A256 WeakPolarHBondContact O-CB 3.45Å; D252-A256 PolarHBondContact O-N 3.07Å; V253-A256 PolarHBondContact O-N 3.15Å; Q254-A256 VanDerWaalsContact C-N 3.32Å; Q254-A256 PolarHBondContact O-N 2.73Å; A256-A260 WeakPolarHBondContact O-CB 3.4Å; A256-A260 PolarHBondContact O-N 3.06Å; A256-M265 VanDerWaalsContact C-CE 3.43Å; A256-M265 HydrophobicContact CB-CE 4.14Å; A256-M265 WeakPolarHBondContact O-CE 3.42Å; A256-I272 HydrophobicContact CB-CD1 4.14Å
257	V	90.5	Very high	92.1	Very high	78 Å²	78	90.4 Å²	90.4	47%	0.473	48%	0.477	S	S	.	.	H	α-helix	trans	-64.4	-42.7	177.5	166.3	0	0	0	0	112.3	V253 Q254 Y255 M265	V253-V257 VanDerWaalsContact O-CG2 3.32Å; V253-V257 WeakPolarHBondContact O-CG2 3.45Å; V253-V257 PolarHBondContact O-N 3.41Å; Q254-V257 WeakPolarHBondContact O-CB 3.42Å; Q254-V257 PolarHBondContact O-N 3.18Å; Q254-V257 VanDerWaalsContact O-N 3.09Å; Y255-V257 VanDerWaalsContact C-N 3.35Å; Y255-V257 PolarHBondContact O-N 3.42Å; V257-M265 HydrophobicContact CG2-CE 4.17Å; V257-M265 HydrophobicContact CG2-SD 4.41Å
258	D	92.7	Very high	91.9	Very high	114 Å²	114	91.5 Å²	91.5	61%	0.61	48%	0.477	S	S	*	.	H	α-helix	trans	-77.8	-29.7	-175.7	-69	-32.7	0	0	0	113.7	Q254 Y255	Q254-D258 PolarHBondContact NE2-OD1 3.2Å; Q254-D258 VanDerWaalsContact NE2-OD1 3.13Å; Q254-D258 PolarHBondContact NE2-OD2 2.68Å; Q254-D258 PolarHBondContact O-N 3.31Å; Y255-D258 PolarHBondContact O-N 3.08Å
259	V	91.8	Very high	91.7	Very high	89 Å²	89	89.3 Å²	89.3	54%	0.539	47%	0.468	S	S	.	.	H	α-helix	trans	-104.7	-28.2	-172	-178.4	0	0	0	0	113.8	Y255	Y255-V259 HydrophobicContact CD2-CG2 3.97Å; Y255-V259 HydrophobicContact CE1-CG2 4.44Å; Y255-V259 HydrophobicContact CE2-CG2 3.66Å; Y255-V259 HydrophobicContact CG-CG2 4.48Å; Y255-V259 WeakPolarHBondContact O-CB 3.06Å; Y255-V259 WeakPolarHBondContact O-CG2 3.25Å; Y255-V259 PolarHBondContact O-N 3.13Å
260	A	88.8	Confident	91.7	Very high	28 Å²	28	91.7 Å²	91.7	23%	0.231	49%	0.488	C	S	.	.	S	Bend	trans	-72.1	145.4	-175.6	0	0	0	0	0	113	A256 E264 M265	A256-A260 WeakPolarHBondContact O-CB 3.4Å; A256-A260 PolarHBondContact O-N 3.06Å; A260-E264 HydrophobicContact CB-CG 4.38Å; A260-M265 HydrophobicContact CB-CB 4.18Å; A260-M265 HydrophobicContact CB-CE 3.88Å
261	K	90.9	Very high	91.6	Very high	140 Å²	140	91 Å²	91	61%	0.609	48%	0.482	S	S	*	.			trans	-70.2	149.3	174.6	-67	165.4	-165.2	114.7	0	109.9	S263 E264 M265	K261-S263 PolarHBondContact O-N 3.02Å; K261-E264 HydrophobicContact CB-CB 4.28Å; K261-E264 PolarHBondContact N-OE2 3.35Å; K261-E264 WeakPolarHBondContact O-CA 3.45Å; K261-E264 WeakPolarHBondContact O-CB 3.45Å; K261-E264 PolarHBondContact O-N 3.18Å; K261-M265 PolarHBondContact O-N 3.1Å
262	P	92.3	Very high	91.4	Very high	113 Å²	113	85.6 Å²	85.6	73%	0.734	46%	0.457	S	S	*	.	H	α-helix	trans	-53.5	-32.9	-176.6	-30.9	36.2	0	0	0	115.7	V266	P262-V266 VanDerWaalsContact O-CG2 3.25Å; P262-V266 WeakPolarHBondContact O-CG2 3.36Å; P262-V266 PolarHBondContact O-N 3.28Å; P262-V266 VanDerWaalsContact O-N 3.17Å
263	S	90.9	Very high	91.4	Very high	92 Å²	92	85.9 Å²	85.9	64%	0.643	46%	0.458	S	S	*	.	H	α-helix	trans	-71.4	-38.3	174.6	53.1	0	0	0	0	113.4	K261 V266 E267	K261-S263 PolarHBondContact O-N 3.02Å; S263-V266 PolarHBondContact O-N 3.39Å; S263-E267 PolarHBondContact O-N 3.36Å
264	E	90	Very high	91.4	Very high	84 Å²	84	87 Å²	87	39%	0.393	47%	0.47	S	S	.	.	H	α-helix	trans	-74.1	-40	-178.7	-179.7	176.6	-170.8	0	0	110.7	A260 K261 E267 R268	A260-E264 HydrophobicContact CB-CG 4.38Å; K261-E264 HydrophobicContact CB-CB 4.28Å; K261-E264 PolarHBondContact N-OE2 3.35Å; K261-E264 WeakPolarHBondContact O-CA 3.45Å; K261-E264 WeakPolarHBondContact O-CB 3.45Å; K261-E264 PolarHBondContact O-N 3.18Å; E264-E267 PolarHBondContact O-N 3.28Å; E264-R268 PolarHBondContact O-N 3Å
265	M	92	Very high	91.2	Very high	41 Å²	41	86 Å²	86	20%	0.202	47%	0.468	C	S	.	.	H	α-helix	trans	-62.4	-42.6	170.2	178.5	47.7	52.8	0	0	112	A256 V257 A260 K261 E267 R268 S269 I272	A256-M265 VanDerWaalsContact C-CE 3.43Å; A256-M265 HydrophobicContact CB-CE 4.14Å; A256-M265 WeakPolarHBondContact O-CE 3.42Å; V257-M265 HydrophobicContact CG2-CE 4.17Å; V257-M265 HydrophobicContact CG2-SD 4.41Å; A260-M265 HydrophobicContact CB-CB 4.18Å; A260-M265 HydrophobicContact CB-CE 3.88Å; K261-M265 PolarHBondContact O-N 3.1Å; M265-E267 VanDerWaalsContact C-N 3.33Å; M265-E267 PolarHBondContact O-N 3.17Å; M265-R268 PolarHBondContact O-N 3.43Å; M265-S269 WeakPolarHBondContact O-CA 3.24Å; M265-S269 VanDerWaalsContact O-CB 3.29Å; M265-S269 WeakPolarHBondContact O-CB 3.37Å; M265-S269 PolarHBondContact O-N 2.97Å; M265-I272 HydrophobicContact CE-CD1 4.08Å; M265-I272 HydrophobicContact SD-CD1 4.19Å
266	V	90.7	Very high	91	Very high	106 Å²	106	81.7 Å²	81.7	64%	0.642	45%	0.454	S	S	*	.	H	α-helix	trans	-63	-39.6	174.3	167.1	0	0	0	0	111.6	P262 S263 S269	P262-V266 VanDerWaalsContact O-CG2 3.25Å; P262-V266 WeakPolarHBondContact O-CG2 3.36Å; P262-V266 PolarHBondContact O-N 3.28Å; P262-V266 VanDerWaalsContact O-N 3.17Å; S263-V266 PolarHBondContact O-N 3.39Å; V266-S269 PolarHBondContact O-N 2.75Å; V266-S269 PolarHBondContact O-OG 3.41Å
267	E	90.7	Very high	90.9	Very high	162 Å²	162	83.9 Å²	83.9	76%	0.757	47%	0.468	S	S	*	.	H	α-helix	trans	-67.6	-39.2	177.7	-170.4	164.6	-163.1	0	0	112.9	S263 E264 M265	S263-E267 PolarHBondContact O-N 3.36Å; E264-E267 PolarHBondContact O-N 3.28Å; M265-E267 VanDerWaalsContact C-N 3.33Å; M265-E267 PolarHBondContact O-N 3.17Å
268	R	90.4	Very high	90.7	Very high	117 Å²	117	85.3 Å²	85.3	44%	0.442	47%	0.473	S	S	.	.	H	α-helix	trans	-84.6	-9.5	175.6	-64.8	-166.5	70.2	-164.1	-0.5	115	E264 M265 S270 E271 I272	E264-R268 PolarHBondContact O-N 3Å; M265-R268 PolarHBondContact O-N 3.43Å; R268-S270 PolarHBondContact O-N 3.47Å; R268-S270 VanDerWaalsContact O-N 3.14Å; R268-E271 IonicContact CZ-OE2 3.58Å; R268-E271 IonicContact NE-OE2 3.95Å; R268-E271 PolarHBondContact NE-OE2 2.84Å; R268-E271 IonicContact NH2-OE1 2.93Å; R268-E271 IonicContact NH2-OE2 2.66Å; R268-E271 PolarHBondContact NH2-OE2 3.09Å; R268-E271 WeakPolarHBondContact O-CB 3.43Å; R268-E271 PolarHBondContact O-N 3.37Å; R268-I272 PolarHBondContact O-N 3.4Å; R268-I272 VanDerWaalsContact O-N 3.13Å
269	S	92.1	Very high	90.4	Very high	45 Å²	45	81.7 Å²	81.7	32%	0.315	46%	0.455	S	S	.	.	H	α-helix	trans	-56.6	-35	-174.2	63.4	0	0	0	0	113.7	M265 V266 L273	M265-S269 WeakPolarHBondContact O-CA 3.24Å; M265-S269 VanDerWaalsContact O-CB 3.29Å; M265-S269 WeakPolarHBondContact O-CB 3.37Å; M265-S269 PolarHBondContact O-N 2.97Å; V266-S269 PolarHBondContact O-N 2.75Å; V266-S269 PolarHBondContact O-OG 3.41Å; S269-L273 VanDerWaalsContact O-CB 3.27Å; S269-L273 WeakPolarHBondContact O-CB 3.34Å; S269-L273 WeakPolarHBondContact O-CD1 3.4Å; S269-L273 WeakPolarHBondContact O-CG 3.34Å; S269-L273 PolarHBondContact O-N 2.92Å
270	S	91	Very high	90.1	Very high	85 Å²	85	85 Å²	85	59%	0.594	47%	0.465	S	S	*	.	H	α-helix	trans	-72.3	-28.5	177.5	50.1	0	0	0	0	114	R268 A274	R268-S270 PolarHBondContact O-N 3.47Å; R268-S270 VanDerWaalsContact O-N 3.14Å; S270-A274 WeakPolarHBondContact O-CB 3.46Å; S270-A274 PolarHBondContact O-N 2.84Å
271	E	92.2	Very high	89.7	Confident	95 Å²	95	88.1 Å²	88.1	44%	0.444	48%	0.484	S	S	.	.	H	α-helix	trans	-71.7	-50.1	173.2	176.6	-175.3	-128	0	0	110.1	R268 L273 A274 L275	R268-E271 IonicContact CZ-OE2 3.58Å; R268-E271 IonicContact NE-OE2 3.95Å; R268-E271 PolarHBondContact NE-OE2 2.84Å; R268-E271 IonicContact NH2-OE1 2.93Å; R268-E271 IonicContact NH2-OE2 2.66Å; R268-E271 PolarHBondContact NH2-OE2 3.09Å; R268-E271 WeakPolarHBondContact O-CB 3.43Å; R268-E271 PolarHBondContact O-N 3.37Å; E271-L273 PolarHBondContact O-N 2.93Å; E271-A274 WeakPolarHBondContact O-CB 3.46Å; E271-A274 PolarHBondContact O-N 3.25Å; E271-A274 VanDerWaalsContact O-N 3.14Å; E271-L275 PolarHBondContact O-N 3.32Å
272	I	91.3	Very high	89.3	Confident	17 Å²	17	85.8 Å²	85.8	9%	0.087	47%	0.473	C	S	.	.	H	α-helix	trans	-61.1	-45.1	178.5	-68.7	170.6	0	0	0	111.1	V253 A256 M265 R268 A274 L275 L276	V253-I272 HydrophobicContact CG1-CG2 3.86Å; V253-I272 HydrophobicContact CG2-CG2 3.94Å; A256-I272 HydrophobicContact CB-CD1 4.14Å; M265-I272 HydrophobicContact CE-CD1 4.08Å; M265-I272 HydrophobicContact SD-CD1 4.19Å; R268-I272 PolarHBondContact O-N 3.4Å; R268-I272 VanDerWaalsContact O-N 3.13Å; I272-A274 VanDerWaalsContact C-N 3.28Å; I272-A274 PolarHBondContact O-N 3.06Å; I272-L275 PolarHBondContact O-N 3.46Å; I272-L276 HydrophobicContact CG2-CD1 3.99Å; I272-L276 WeakPolarHBondContact O-CG 3.42Å; I272-L276 PolarHBondContact O-N 3.14Å
273	L	92.2	Very high	88.8	Confident	112 Å²	112	84.5 Å²	84.5	59%	0.586	47%	0.465	S	S	*	.	H	α-helix	trans	-66.3	-27.8	177.1	-72.3	169.9	0	0	0	113.1	S269 E271 S277	S269-L273 VanDerWaalsContact O-CB 3.27Å; S269-L273 WeakPolarHBondContact O-CB 3.34Å; S269-L273 WeakPolarHBondContact O-CD1 3.4Å; S269-L273 WeakPolarHBondContact O-CG 3.34Å; S269-L273 PolarHBondContact O-N 2.92Å; E271-L273 PolarHBondContact O-N 2.93Å; L273-S277 VanDerWaalsContact O-CB 3.22Å; L273-S277 WeakPolarHBondContact O-CB 3.37Å; L273-S277 PolarHBondContact O-N 3.47Å
274	A	91.6	Very high	88.4	Confident	48 Å²	48	87.3 Å²	87.3	40%	0.397	47%	0.47	S	S	.	.	H	α-helix	trans	-69.9	-47.9	172.8	0	0	0	0	0	111.3	S270 E271 I272 L276 S277 D278	S270-A274 WeakPolarHBondContact O-CB 3.46Å; S270-A274 PolarHBondContact O-N 2.84Å; E271-A274 WeakPolarHBondContact O-CB 3.46Å; E271-A274 PolarHBondContact O-N 3.25Å; E271-A274 VanDerWaalsContact O-N 3.14Å; I272-A274 VanDerWaalsContact C-N 3.28Å; I272-A274 PolarHBondContact O-N 3.06Å; A274-L276 VanDerWaalsContact C-N 3.34Å; A274-L276 PolarHBondContact O-N 3Å; A274-S277 WeakPolarHBondContact O-CB 3.49Å; A274-S277 PolarHBondContact O-N 3.27Å; A274-S277 VanDerWaalsContact O-N 3.09Å; A274-D278 PolarHBondContact O-N 3.01Å
275	L	89.6	Confident	87.9	Confident	84 Å²	84	87 Å²	87	44%	0.44	48%	0.482	S	S	.	.	H	α-helix	trans	-59	-43.7	177.3	-66.7	171.6	0	0	0	112.2	L249 E271 I272 D278 V279	L249-L275 HydrophobicContact CD1-CB 4.3Å; L249-L275 HydrophobicContact CD1-CD1 4.38Å; E271-L275 PolarHBondContact O-N 3.32Å; I272-L275 PolarHBondContact O-N 3.46Å; L275-D278 PolarHBondContact O-N 3.07Å; L275-V279 PolarHBondContact O-N 2.92Å; L275-V279 VanDerWaalsContact O-N 3.14Å
276	L	90.1	Very high	87.4	Confident	49 Å²	49	88.8 Å²	88.8	26%	0.257	50%	0.498	S	S	.	.	H	α-helix	trans	-64.8	-39.8	174.3	-67.6	171.7	0	0	0	111.8	L249 I272 A274 V279 H280	L249-L276 HydrophobicContact CD2-CD2 4.5Å; I272-L276 HydrophobicContact CG2-CD1 3.99Å; I272-L276 WeakPolarHBondContact O-CG 3.42Å; I272-L276 PolarHBondContact O-N 3.14Å; A274-L276 VanDerWaalsContact C-N 3.34Å; A274-L276 PolarHBondContact O-N 3Å; L276-V279 PolarHBondContact O-N 3.46Å; L276-H280 WeakPolarHBondContact O-CB 3.29Å; L276-H280 PolarHBondContact O-CD2 2.55Å; L276-H280 PolarHBondContact O-N 3.34Å
277	S	88.3	Confident	87	Confident	63 Å²	63	86.4 Å²	86.4	44%	0.441	48%	0.479	S	S	.	.	H	α-helix	trans	-63.5	-41.2	175.6	-174.7	0	0	0	0	112.5	L273 A274 H280 C281	L273-S277 VanDerWaalsContact O-CB 3.22Å; L273-S277 WeakPolarHBondContact O-CB 3.37Å; L273-S277 PolarHBondContact O-N 3.47Å; A274-S277 WeakPolarHBondContact O-CB 3.49Å; A274-S277 PolarHBondContact O-N 3.27Å; A274-S277 VanDerWaalsContact O-N 3.09Å; S277-H280 CarbonylContact O-C 3.5Å; S277-H280 PolarHBondContact O-N 2.72Å; S277-C281 PolarHBondContact O-N 2.91Å; S277-C281 PolarHBondContact O-SG 2.93Å
278	D	86.2	Confident	86.5	Confident	108 Å²	108	84 Å²	84	58%	0.578	48%	0.475	S	S	*	.	H	α-helix	trans	-65.3	-40.6	178.5	-75.7	-15.3	0	0	0	111.5	A274 L275 C281 K282	A274-D278 PolarHBondContact O-N 3.01Å; L275-D278 PolarHBondContact O-N 3.07Å; D278-C281 PolarHBondContact O-N 3.45Å; D278-K282 PolarHBondContact O-N 2.89Å
279	V	86.3	Confident	86.2	Confident	38 Å²	38	81 Å²	81	23%	0.23	47%	0.472	C	S	.	.	H	α-helix	trans	-61.7	-46.4	170.4	165.1	0	0	0	0	111.5	L246 L249 L275 L276 C281 K282	L246-V279 HydrophobicContact CD2-CB 4.5Å; L246-V279 HydrophobicContact CD2-CG1 3.44Å; L246-V279 VanDerWaalsContact CD2-CG1 3.44Å; L246-V279 HydrophobicContact CD2-CG2 4.21Å; L249-V279 HydrophobicContact CD2-CG2 3.63Å; L275-V279 PolarHBondContact O-N 2.92Å; L275-V279 VanDerWaalsContact O-N 3.14Å; L276-V279 PolarHBondContact O-N 3.46Å; V279-C281 PolarHBondContact O-N 3Å; V279-C281 VanDerWaalsContact O-N 3.12Å; V279-K282 WeakPolarHBondContact O-CB 3.42Å; V279-K282 PolarHBondContact O-N 2.71Å
280	H	83.7	Confident	85.9	Confident	159 Å²	159	82.8 Å²	82.8	74%	0.736	49%	0.49	S	S	*	.	H	α-helix	trans	-62.8	-17.6	176.2	-80.1	-135	0	0	0	113.4	L276 S277	L276-H280 WeakPolarHBondContact O-CB 3.29Å; L276-H280 PolarHBondContact O-CD2 2.55Å; L276-H280 PolarHBondContact O-N 3.34Å; S277-H280 CarbonylContact O-C 3.5Å; S277-H280 PolarHBondContact O-N 2.72Å
281	C	82.4	Confident	85.8	Confident	93 Å²	93	84.5 Å²	84.5	63%	0.628	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-10.9	174.8	-68.4	0	0	0	0	113.9	S277 D278 V279 P283	S277-C281 PolarHBondContact O-N 2.91Å; S277-C281 PolarHBondContact O-SG 2.93Å; D278-C281 PolarHBondContact O-N 3.45Å; V279-C281 PolarHBondContact O-N 3Å; V279-C281 VanDerWaalsContact O-N 3.12Å; C281-P283 VanDerWaalsContact O-CD 3.32Å; C281-P283 WeakPolarHBondContact O-CD 3.31Å
282	K	81.5	Confident	85.8	Confident	90 Å²	90	81.8 Å²	81.8	39%	0.391	49%	0.489	S	S	.	.	S	Bend	trans	-68.3	116.1	168.7	-67.6	-175.3	-176.8	177.6	0	109.2	E242 D278 V279 M284	E242-K282 WeakPolarHBondContact OE1-CD 3.47Å; E242-K282 WeakPolarHBondContact OE1-CE 3.31Å; E242-K282 IonicContact OE1-NZ 3.92Å; E242-K282 PolarHBondContact OE1-NZ 3.49Å; E242-K282 IonicContact OE2-NZ 3.79Å; E242-K282 PolarHBondContact OE2-NZ 2.91Å; D278-K282 PolarHBondContact O-N 2.89Å; V279-K282 WeakPolarHBondContact O-CB 3.42Å; V279-K282 PolarHBondContact O-N 2.71Å; K282-M284 PolarHBondContact O-N 2.87Å
283	P	81.3	Confident	85.8	Confident	87 Å²	87	84.7 Å²	84.7	57%	0.565	51%	0.509	S	S	*	.			trans	-75.3	117.9	-177.8	29.9	-32.9	0	0	0	110.2	C281 A285 S286	C281-P283 VanDerWaalsContact O-CD 3.32Å; C281-P283 WeakPolarHBondContact O-CD 3.31Å; P283-A285 PolarHBondContact O-N 3.42Å; P283-S286 PolarHBondContact O-N 3.29Å; P283-S286 PolarHBondContact O-OG 3.3Å
284	M	82.3	Confident	85.7	Confident	151 Å²	151	83.7 Å²	83.7	74%	0.744	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-46.2	-30.6	177.8	-163.5	67.3	68.9	0	0	113.8	K282 S286 F287	K282-M284 PolarHBondContact O-N 2.87Å; M284-S286 PolarHBondContact O-N 3.26Å; M284-F287 PolarHBondContact O-N 2.99Å; M284-F287 VanDerWaalsContact O-N 3.09Å
285	A	79.5	Confident	85.6	Confident	77 Å²	77	86.4 Å²	86.4	64%	0.636	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-56.7	-23.7	174.8	0	0	0	0	0	115.4	P283 F287 V288	P283-A285 PolarHBondContact O-N 3.42Å; A285-F287 PolarHBondContact O-N 3.22Å; A285-V288 PolarHBondContact O-N 2.8Å
286	S	81.6	Confident	85.8	Confident	78 Å²	78	86.6 Å²	86.6	55%	0.545	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-67.3	-24.1	174.9	58.3	0	0	0	0	113.1	P283 M284	P283-S286 PolarHBondContact O-N 3.29Å; P283-S286 PolarHBondContact O-OG 3.3Å; M284-S286 PolarHBondContact O-N 3.26Å
287	F	82.8	Confident	85.7	Confident	56 Å²	56	88.7 Å²	88.7	25%	0.246	54%	0.536	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-15.7	178	-56.3	-75.7	0	0	0	112.7	L239 E242 M284 A285 S289	L239-F287 HydrophobicContact CD2-CB 3.93Å; L239-F287 HydrophobicContact CD2-CD1 4.38Å; L239-F287 HydrophobicContact CD2-CG 4.45Å; E242-F287 HydrophobicContact CB-CE1 3.91Å; E242-F287 HydrophobicContact CB-CZ 4.05Å; E242-F287 HydrophobicContact CG-CE1 3.96Å; E242-F287 HydrophobicContact CG-CE2 4.12Å; E242-F287 HydrophobicContact CG-CZ 3.57Å; E242-F287 WeakPolarHBondContact OE2-CZ 3.4Å; M284-F287 PolarHBondContact O-N 2.99Å; M284-F287 VanDerWaalsContact O-N 3.09Å; A285-F287 PolarHBondContact O-N 3.22Å; F287-S289 PolarHBondContact O-N 3.12Å
288	V	80.2	Confident	85.9	Confident	111 Å²	111	87.9 Å²	87.9	67%	0.673	53%	0.531	S	S	*	.			trans	-78.4	75	177.2	-174.9	0	0	0	0	110.1	A285	A285-V288 PolarHBondContact O-N 2.8Å
289	S	84.1	Confident	86.1	Confident	55 Å²	55	86 Å²	86	39%	0.385	52%	0.519	S	S	.	.	P	Polyproline II helix	trans	-64.1	147.9	170.1	-79	0	0	0	0	112.2	Q235 F287	Q235-S289 PolarHBondContact NE2-OG 3.02Å; F287-S289 PolarHBondContact O-N 3.12Å
290	A	85.3	Confident	86.5	Confident	83 Å²	83	88.3 Å²	88.3	69%	0.686	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-61.1	135	168.6	0	0	0	0	0	110.6	V292	A290-V292 PolarHBondContact O-N 2.88Å
291	P	88.5	Confident	87	Confident	121 Å²	121	82.4 Å²	82.4	79%	0.786	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-58.4	127.3	178.7	-26	34.8	0	0	0	112.1	P293	P291-P293 WeakPolarHBondContact O-CD 3.39Å
292	V	92.6	Very high	87.6	Confident	37 Å²	37	78.1 Å²	78.1	22%	0.224	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-65	121	176.4	179.5	0	0	0	0	109	K228 T231 L232 A290 A294	K228-V292 HydrophobicContact CB-CG1 3.93Å; K228-V292 HydrophobicContact CG-CG1 3.94Å; T231-V292 HydrophobicContact CG2-CG2 3.86Å; L232-V292 HydrophobicContact CD1-CB 4.49Å; L232-V292 HydrophobicContact CD2-CB 3.97Å; L232-V292 HydrophobicContact CD2-CG2 3.73Å; L232-V292 HydrophobicContact CG-CB 4.13Å; L232-V292 HydrophobicContact CG-CG2 3.93Å; A290-V292 PolarHBondContact O-N 2.88Å; V292-A294 PolarHBondContact O-N 3.36Å
293	P	91.2	Very high	88.2	Confident	78 Å²	78	77.4 Å²	77.4	51%	0.506	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-62	133.9	-174.6	-24.5	34.2	0	0	0	112.3	K228 P291 D295	K228-P293 PolarHBondContact NZ-O 3.46Å; P291-P293 WeakPolarHBondContact O-CD 3.39Å; P293-D295 VanDerWaalsContact C-N 3.33Å; P293-D295 WeakPolarHBondContact CB-OD1 3.2Å
294	A	90.8	Very high	88.9	Confident	92 Å²	92	76.1 Å²	76.1	76%	0.76	46%	0.464	S	S	*	.			trans	-82.7	-7.9	-176.5	0	0	0	0	0	114	V292 F296	V292-A294 PolarHBondContact O-N 3.36Å; A294-F296 WeakPolarHBondContact O-CD2 3.25Å
295	D	90	Very high	89.6	Confident	104 Å²	104	72 Å²	72	56%	0.556	44%	0.443	S	S	*	.			trans	-79.1	154.5	-180	63.6	-65.4	0	0	0	113.1	K228 P293	K228-D295 VanDerWaalsContact CE-O 3.31Å; K228-D295 WeakPolarHBondContact CE-O 3.33Å; K228-D295 PolarHBondContact NZ-O 3.24Å; P293-D295 VanDerWaalsContact C-N 3.33Å; P293-D295 WeakPolarHBondContact CB-OD1 3.2Å
296	F	93.8	Very high	90.4	Very high	89 Å²	89	71 Å²	71	39%	0.39	43%	0.431	S	S	.	.			trans	-130.3	134.1	177.9	-72.2	-97.5	0	0	0	109.2	L221 Q224 L225 K228 A294 S298	L221-F296 HydrophobicContact CD2-CB 4.04Å; L221-F296 HydrophobicContact CD2-CD1 4.21Å; Q224-F296 HydrophobicContact CB-CD1 4.09Å; Q224-F296 HydrophobicContact CB-CE1 4.04Å; L225-F296 HydrophobicContact CB-CE1 3.99Å; L225-F296 HydrophobicContact CB-CZ 4.2Å; L225-F296 HydrophobicContact CD1-CZ 3.98Å; K228-F296 HydrophobicContact CD-CE1 3.98Å; K228-F296 HydrophobicContact CD-CE2 4.29Å; K228-F296 HydrophobicContact CD-CZ 3.71Å; A294-F296 WeakPolarHBondContact O-CD2 3.25Å; F296-S298 PolarHBondContact O-N 3.04Å
297	V	88.1	Confident	91.1	Very high	92 Å²	92	68.8 Å²	68.8	56%	0.558	42%	0.416	S	S	*	.			trans	-78.1	118.7	-175.9	-178.2	0	0	0	0	109.9
298	S	91.6	Very high	91.8	Very high	46 Å²	46	70.1 Å²	70.1	32%	0.322	43%	0.428	S	S	.	.			trans	-86.5	128	171.6	-171	0	0	0	0	111	F296 V301	F296-S298 PolarHBondContact O-N 3.04Å; S298-V301 WeakPolarHBondContact CB-O 3.4Å; S298-V301 PolarHBondContact OG-N 3.39Å
299	E	91.8	Very high	92.6	Very high	69 Å²	69	66 Å²	66	32%	0.322	40%	0.402	S	S	.	.	S	Bend	trans	-86.2	-13.1	179.3	-47.4	172.8	-130.5	0	0	113	M217 R220 Y436	M217-E299 HydrophobicContact CE-CB 3.63Å; M217-E299 HydrophobicContact CE-CG 4.16Å; M217-E299 HydrophobicContact CG-CB 4.48Å; M217-E299 WeakPolarHBondContact CG-OE1 3.15Å; M217-E299 HydrophobicContact SD-CB 4.18Å; R220-E299 IonicContact CZ-OE1 3.5Å; R220-E299 IonicContact CZ-OE2 2.98Å; R220-E299 IonicContact NE-OE1 3.75Å; R220-E299 IonicContact NH1-OE1 2.73Å; R220-E299 PolarHBondContact NH1-OE1 3.36Å; R220-E299 VanDerWaalsContact NH1-OE1 3.15Å; R220-E299 IonicContact NH1-OE2 3.09Å; R220-E299 PolarHBondContact NH1-OE2 3.43Å; R220-E299 VanDerWaalsContact NH2-CD 3.27Å; R220-E299 IonicContact NH2-OE1 3.99Å; R220-E299 PolarHBondContact NH2-OE1 3.39Å; R220-E299 IonicContact NH2-OE2 2.63Å; R220-E299 PolarHBondContact NH2-OE2 2.93Å; E299-Y436 VanDerWaalsContact O-CD2 3.28Å; E299-Y436 WeakPolarHBondContact O-CD2 3.49Å
300	I	93.3	Very high	93.2	Very high	87 Å²	87	66.5 Å²	66.5	45%	0.446	40%	0.402	S	S	.	.	S	Bend	trans	-111.5	-28.6	-179	56.7	177.4	0	0	0	113.8	M217 T435 Y436	M217-I300 HydrophobicContact CE-CB 4.2Å; M217-I300 HydrophobicContact CE-CD1 4.16Å; M217-I300 HydrophobicContact CE-CG1 3.8Å; M217-I300 HydrophobicContact CE-CG2 3.74Å; M217-I300 HydrophobicContact SD-CG2 3.65Å; I300-T435 CarbonylContact O-C 3.57Å; I300-T435 VanDerWaalsContact O-CA 3.29Å; I300-T435 WeakPolarHBondContact O-CA 3.46Å; I300-Y436 PolarHBondContact O-N 2.92Å
301	V	94.7	Very high	93.8	Very high	35 Å²	35	62.6 Å²	62.6	21%	0.212	37%	0.37	C	S	.	.	S	Bend	trans	-108.6	126.3	176.1	-168.2	0	0	0	0	109	S298 R432	S298-V301 WeakPolarHBondContact CB-O 3.4Å; S298-V301 PolarHBondContact OG-N 3.39Å; V301-R432 VanDerWaalsContact CG1-CZ 3.42Å
302	P	95.1	Very high	94	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.013	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-67.9	159.4	176.2	28.7	-35.1	0	0	0	112.3	R432 A433 Y436 K439	P302-R432 HydrophobicContact CG-CB 4.47Å; P302-R432 VanDerWaalsContact O-CD 3.29Å; P302-R432 WeakPolarHBondContact O-CD 3.27Å; P302-R432 PolarHBondContact O-NH1 3.19Å; P302-A433 VanDerWaalsContact CD-O 3.29Å; P302-A433 WeakPolarHBondContact CD-O 3.44Å; P302-A433 HydrophobicContact CG-CB 4.29Å; P302-A433 WeakPolarHBondContact CG-O 3.46Å; P302-Y436 HydrophobicContact CB-CD1 4.22Å; P302-Y436 HydrophobicContact CB-CE1 3.85Å; P302-Y436 HydrophobicContact CB-CE2 4.36Å; P302-K439 HydrophobicContact CB-CD 3.82Å; P302-K439 HydrophobicContact CG-CD 4.25Å
303	P	94.3	Very high	94.1	Very high	76 Å²	76	62.9 Å²	62.9	49%	0.494	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-62.6	161.5	169.2	28.7	-35.7	0	0	0	111.4
304	Y	95.2	Very high	94.4	Very high	59 Å²	59	59.4 Å²	59.4	23%	0.231	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-74.4	128.9	169.2	-80.3	-72.9	0	0	0	110.8	E370 Q430 R432	Y304-E370 HydrophobicContact CE1-CB 4.34Å; Y304-Q430 HydrophobicContact CD1-CB 4.06Å; Y304-Q430 HydrophobicContact CG-CB 4.18Å; Y304-R432 HydrophobicContact CD1-CB 4.01Å; Y304-R432 HydrophobicContact CD1-CG 3.75Å; Y304-R432 HydrophobicContact CE1-CB 4.37Å; Y304-R432 HydrophobicContact CE1-CG 3.64Å; Y304-R432 HydrophobicContact CG-CG 4.42Å
305	E	96.4	Very high	94.5	Very high	65 Å²	65	57.6 Å²	57.6	30%	0.304	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	131.6	168.7	-52.3	-76.6	-173.2	0	0	107.1	V331 Q430 V431 K439	E305-V331 HydrophobicContact CB-CG1 4.27Å; E305-V331 HydrophobicContact CB-CG2 3.61Å; E305-V331 HydrophobicContact CG-CG1 3.73Å; E305-V331 HydrophobicContact CG-CG2 3.92Å; E305-Q430 CarbonylContact O-C 3.49Å; E305-Q430 VanDerWaalsContact O-CA 3.25Å; E305-Q430 WeakPolarHBondContact O-CA 3.47Å; E305-V431 PolarHBondContact N-O 3.44Å; E305-V431 PolarHBondContact O-N 3.39Å; E305-K439 IonicContact OE1-NZ 2.7Å; E305-K439 PolarHBondContact OE1-NZ 3.34Å
306	S	96.5	Very high	94.7	Very high	57 Å²	57	56.2 Å²	56.2	40%	0.399	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	155.2	-168.9	76.6	0	0	0	0	115	F429	S306-F429 CarbonylContact C-O 3.59Å; S306-F429 VanDerWaalsContact CA-O 3.3Å; S306-F429 WeakPolarHBondContact CA-O 3.46Å; S306-F429 WeakPolarHBondContact CB-O 3.32Å
307	S	97.4	Very high	94.8	Very high	31 Å²	31	53.2 Å²	53.2	22%	0.217	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	152.6	176.8	-178.6	0	0	0	0	110.4	F429	S307-F429 PolarHBondContact N-O 3Å; S307-F429 WeakPolarHBondContact O-CD1 3.42Å; S307-F429 PolarHBondContact O-N 3.41Å; S307-F429 VanDerWaalsContact O-O 3.13Å
308	T	97	Very high	95.1	Very high	83 Å²	83	51.8 Å²	51.8	51%	0.509	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	137	-175.9	-57.4	0	0	0	0	109.5	L426 L427	T308-L426 HydrophobicContact CG2-CD1 3.44Å; T308-L426 VanDerWaalsContact CG2-CD1 3.44Å; T308-L426 HydrophobicContact CG2-CG 4.12Å; T308-L427 CarbonylContact C-O 3.55Å
309	F	97.4	Very high	95.1	Very high	26 Å²	26	57.4 Å²	57.4	11%	0.114	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	110	-175.5	179.9	-145.1	0	0	0	110.7	L311 V324 Y325 L338 V340 L427	F309-L311 HydrophobicContact CD1-CD2 4.26Å; F309-L311 HydrophobicContact CE1-CD2 3.52Å; F309-L311 HydrophobicContact CE1-CG 4.25Å; F309-L311 HydrophobicContact CE2-CD2 4.4Å; F309-L311 HydrophobicContact CZ-CD2 3.6Å; F309-L311 HydrophobicContact CZ-CG 4.49Å; F309-V324 HydrophobicContact CZ-CG1 3.89Å; F309-Y325 VanDerWaalsContact CZ-O 3.3Å; F309-Y325 WeakPolarHBondContact CZ-O 3.28Å; F309-L338 HydrophobicContact CB-CD1 4.4Å; F309-L338 HydrophobicContact CD1-CB 4.18Å; F309-L338 HydrophobicContact CD1-CD1 4.1Å; F309-V340 HydrophobicContact CD1-CG2 4.24Å; F309-V340 HydrophobicContact CE1-CG2 3.87Å; F309-L427 PolarHBondContact N-O 2.71Å; F309-L427 PolarHBondContact O-N 3.34Å
310	T	97.2	Very high	95.2	Very high	65 Å²	65	62.4 Å²	62.4	40%	0.399	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	119.1	174.8	-47.2	0	0	0	0	109.9	Q312 L426	T310-Q312 HydrophobicContact CG2-CB 4.25Å; T310-Q312 PolarHBondContact O-N 3.15Å; T310-L426 WeakPolarHBondContact OG1-CD1 3.46Å
311	L	96.2	Very high	95	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	101.3	172.7	-65.9	162.8	0	0	0	108.5	F309 Y314 M317 V324 V340 S424 I425 L427	F309-L311 HydrophobicContact CD1-CD2 4.26Å; F309-L311 HydrophobicContact CE1-CD2 3.52Å; F309-L311 HydrophobicContact CE1-CG 4.25Å; F309-L311 HydrophobicContact CE2-CD2 4.4Å; F309-L311 HydrophobicContact CZ-CD2 3.6Å; F309-L311 HydrophobicContact CZ-CG 4.49Å; L311-Y314 HydrophobicContact CB-CD2 4.43Å; L311-M317 HydrophobicContact CB-CE 4.14Å; L311-M317 HydrophobicContact CD2-CE 3.64Å; L311-V324 HydrophobicContact CD2-CB 4.49Å; L311-V324 HydrophobicContact CD2-CG1 4.47Å; L311-V340 HydrophobicContact CD1-CG1 3.91Å; L311-V340 HydrophobicContact CD1-CG2 4.47Å; L311-V340 HydrophobicContact CD2-CB 4.26Å; L311-V340 HydrophobicContact CD2-CG1 4.24Å; L311-V340 HydrophobicContact CD2-CG2 4.37Å; L311-S424 VanDerWaalsContact O-CA 3.28Å; L311-S424 WeakPolarHBondContact O-CA 3.49Å; L311-I425 HydrophobicContact CB-CB 4.34Å; L311-I425 HydrophobicContact CD1-CB 4.26Å; L311-I425 PolarHBondContact N-O 2.79Å; L311-I425 PolarHBondContact O-N 2.92Å; L311-L427 HydrophobicContact CD1-CD1 3.8Å; L311-L427 HydrophobicContact CD1-CG 4.24Å
312	Q	94.5	Very high	95	Very high	105 Å²	105	61.6 Å²	61.6	49%	0.491	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.5	138.7	-177.9	-169.7	-179.7	15.6	0	0	111.1	T310 M317 T422	T310-Q312 HydrophobicContact CG2-CB 4.25Å; T310-Q312 PolarHBondContact O-N 3.15Å; Q312-M317 VanDerWaalsContact C-SD 3.51Å; Q312-M317 PolarHBondContact N-SD 2.84Å; Q312-T422 WeakPolarHBondContact CG-O 3.45Å; Q312-T422 PolarHBondContact NE2-O 2.72Å
313	P	94.7	Very high	95	Very high	60 Å²	60	64 Å²	64	39%	0.39	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	cis	-75.5	112.7	-11.9	29.4	-32.1	0	0	0	111.4	S315 I316 M317 D423	P313-S315 VanDerWaalsContact C-N 3.34Å; P313-S315 PolarHBondContact O-N 3.24Å; P313-I316 HydrophobicContact CB-CD1 4.41Å; P313-I316 HydrophobicContact CB-CG1 4.42Å; P313-I316 HydrophobicContact CG-CB 4.18Å; P313-I316 HydrophobicContact CG-CD1 3.84Å; P313-I316 HydrophobicContact CG-CG1 4.15Å; P313-I316 PolarHBondContact O-N 2.96Å; P313-M317 VanDerWaalsContact O-CG 3.26Å; P313-M317 WeakPolarHBondContact O-CG 3.36Å; P313-M317 PolarHBondContact O-N 2.95Å; P313-M317 VanDerWaalsContact O-SD 3.4Å; P313-D423 WeakPolarHBondContact CA-OD2 3.37Å; P313-D423 VanDerWaalsContact CB-OD2 3.26Å; P313-D423 WeakPolarHBondContact CB-OD2 3.46Å
314	Y	95.8	Very high	95.1	Very high	5 Å²	5	62 Å²	62	2%	0.02	32%	0.323	C	S	.	.	H	α-helix	trans	-57.5	-40.5	-171.7	172	-103.6	0	0	0	113.3	L311 I316 M317 K318 P342 L409 L412 L418 D423 I425	L311-Y314 HydrophobicContact CB-CD2 4.43Å; Y314-I316 VanDerWaalsContact C-N 3.3Å; Y314-I316 PolarHBondContact O-N 3.22Å; Y314-M317 WeakPolarHBondContact O-CB 3.4Å; Y314-M317 PolarHBondContact O-N 3.34Å; Y314-M317 VanDerWaalsContact O-N 3.1Å; Y314-K318 HydrophobicContact CE1-CB 4.48Å; Y314-K318 HydrophobicContact CE1-CD 4.21Å; Y314-K318 WeakPolarHBondContact O-CB 3.43Å; Y314-K318 PolarHBondContact O-N 3.02Å; Y314-P342 HydrophobicContact CD2-CB 4.29Å; Y314-P342 HydrophobicContact CE2-CB 3.81Å; Y314-P342 PolarHBondContact OH-O 3.44Å; Y314-P342 VanDerWaalsContact OH-O 3.05Å; Y314-L409 VanDerWaalsContact OH-CD2 3.31Å; Y314-L409 WeakPolarHBondContact OH-CD2 3.47Å; Y314-L412 HydrophobicContact CE1-CD1 4.11Å; Y314-L412 WeakPolarHBondContact OH-CD1 3.5Å; Y314-L418 HydrophobicContact CD1-CD1 3.84Å; Y314-L418 HydrophobicContact CD1-CD2 3.64Å; Y314-L418 HydrophobicContact CD1-CG 4.38Å; Y314-L418 HydrophobicContact CE1-CD2 3.92Å; Y314-L418 HydrophobicContact CG-CD1 4.22Å; Y314-D423 WeakPolarHBondContact CB-O 3.43Å; Y314-D423 PolarHBondContact N-O 2.98Å; Y314-D423 PolarHBondContact N-OD2 2.92Å; Y314-I425 HydrophobicContact CD1-CD1 4.03Å; Y314-I425 HydrophobicContact CD1-CG1 4.4Å; Y314-I425 HydrophobicContact CD2-CD1 3.54Å; Y314-I425 HydrophobicContact CD2-CG1 4.08Å; Y314-I425 HydrophobicContact CE1-CD1 3.9Å; Y314-I425 HydrophobicContact CE2-CD1 3.42Å; Y314-I425 VanDerWaalsContact CE2-CD1 3.42Å; Y314-I425 HydrophobicContact CE2-CG1 4.43Å; Y314-I425 HydrophobicContact CG-CD1 3.85Å; Y314-I425 HydrophobicContact CG-CG1 4.05Å
315	S	93.5	Very high	95.2	Very high	53 Å²	53	63.7 Å²	63.7	37%	0.371	33%	0.33	S	S	.	.	H	α-helix	trans	-62.5	-36.4	-178.8	-67.4	0	0	0	0	112.5	P313 Q319 D423	P313-S315 VanDerWaalsContact C-N 3.34Å; P313-S315 PolarHBondContact O-N 3.24Å; S315-Q319 VanDerWaalsContact O-CG 3.29Å; S315-Q319 WeakPolarHBondContact O-CG 3.1Å; S315-Q319 PolarHBondContact O-N 2.84Å; S315-D423 VanDerWaalsContact CB-OD1 3.3Å; S315-D423 WeakPolarHBondContact CB-OD1 3.41Å; S315-D423 VanDerWaalsContact CB-OD2 3.31Å; S315-D423 WeakPolarHBondContact CB-OD2 3.17Å; S315-D423 VanDerWaalsContact N-CG 3.3Å; S315-D423 PolarHBondContact N-OD1 2.97Å; S315-D423 PolarHBondContact N-OD2 3.36Å; S315-D423 PolarHBondContact OG-OD1 3.3Å
316	I	94	Very high	95.2	Very high	76 Å²	76	61 Å²	61	39%	0.39	32%	0.318	S	S	.	.	H	α-helix	trans	-72.2	-39.3	174.5	-58.3	-175.3	0	0	0	110.5	P313 Y314 K318 Q319 R320	P313-I316 HydrophobicContact CB-CD1 4.41Å; P313-I316 HydrophobicContact CB-CG1 4.42Å; P313-I316 HydrophobicContact CG-CB 4.18Å; P313-I316 HydrophobicContact CG-CD1 3.84Å; P313-I316 HydrophobicContact CG-CG1 4.15Å; P313-I316 PolarHBondContact O-N 2.96Å; Y314-I316 VanDerWaalsContact C-N 3.3Å; Y314-I316 PolarHBondContact O-N 3.22Å; I316-K318 VanDerWaalsContact C-N 3.34Å; I316-Q319 PolarHBondContact O-N 3.4Å; I316-R320 WeakPolarHBondContact O-CG 3.12Å; I316-R320 PolarHBondContact O-N 3.46Å
317	M	95.4	Very high	95.2	Very high	26 Å²	26	65.9 Å²	65.9	13%	0.128	34%	0.335	C	S	.	.	H	α-helix	trans	-65.7	-38.6	179.3	-60.9	158.4	78.2	0	0	111.1	L311 Q312 P313 Y314 A321 V324 P342	L311-M317 HydrophobicContact CB-CE 4.14Å; L311-M317 HydrophobicContact CD2-CE 3.64Å; Q312-M317 VanDerWaalsContact C-SD 3.51Å; Q312-M317 PolarHBondContact N-SD 2.84Å; P313-M317 VanDerWaalsContact O-CG 3.26Å; P313-M317 WeakPolarHBondContact O-CG 3.36Å; P313-M317 PolarHBondContact O-N 2.95Å; P313-M317 VanDerWaalsContact O-SD 3.4Å; Y314-M317 WeakPolarHBondContact O-CB 3.4Å; Y314-M317 PolarHBondContact O-N 3.34Å; Y314-M317 VanDerWaalsContact O-N 3.1Å; M317-A321 PolarHBondContact O-N 3.23Å; M317-V324 HydrophobicContact CE-CB 4.16Å; M317-V324 HydrophobicContact CE-CG1 3.58Å; M317-V324 HydrophobicContact CE-CG2 3.88Å; M317-P342 HydrophobicContact CB-CB 4.27Å; M317-P342 HydrophobicContact CB-CG 3.99Å
318	K	94.4	Very high	95.2	Very high	62 Å²	62	66.6 Å²	66.6	27%	0.27	34%	0.339	S	S	.	.	H	α-helix	trans	-64.8	-42.6	170.4	-174.1	178.5	177	178.3	0	112.4	Y314 I316 R320 A321 P342 D343	Y314-K318 HydrophobicContact CE1-CB 4.48Å; Y314-K318 HydrophobicContact CE1-CD 4.21Å; Y314-K318 WeakPolarHBondContact O-CB 3.43Å; Y314-K318 PolarHBondContact O-N 3.02Å; I316-K318 VanDerWaalsContact C-N 3.34Å; K318-R320 VanDerWaalsContact C-N 3.34Å; K318-R320 PolarHBondContact O-N 2.8Å; K318-A321 WeakPolarHBondContact O-CB 3.37Å; K318-A321 PolarHBondContact O-N 3.47Å; K318-P342 HydrophobicContact CB-CB 4.34Å; K318-D343 VanDerWaalsContact CE-OD1 3.29Å; K318-D343 WeakPolarHBondContact CE-OD1 3.33Å; K318-D343 HydrophobicContact CG-CB 3.96Å
319	Q	92.7	Very high	95.2	Very high	164 Å²	164	63.9 Å²	63.9	77%	0.766	32%	0.321	S	S	*	.	H	α-helix	trans	-65.2	-33.7	177.3	-75.9	173.5	20.7	0	0	113.7	S315 I316	S315-Q319 VanDerWaalsContact O-CG 3.29Å; S315-Q319 WeakPolarHBondContact O-CG 3.1Å; S315-Q319 PolarHBondContact O-N 2.84Å; I316-Q319 PolarHBondContact O-N 3.4Å
320	R	92.9	Very high	95.1	Very high	173 Å²	173	69.3 Å²	69.3	65%	0.653	35%	0.346	S	S	*	.	H	α-helix	trans	-71	-41.4	171.9	-68.2	177.8	-170.9	176.2	4.3	111.5	I316 K318 D322	I316-R320 WeakPolarHBondContact O-CG 3.12Å; I316-R320 PolarHBondContact O-N 3.46Å; K318-R320 VanDerWaalsContact C-N 3.34Å; K318-R320 PolarHBondContact O-N 2.8Å; R320-D322 PolarHBondContact O-N 3.42Å
321	A	90.6	Very high	94.7	Very high	9 Å²	9	67.3 Å²	67.3	7%	0.074	33%	0.334	C	S	.	.			trans	55.8	31.1	-179.7	0	0	0	0	0	113.6	M317 K318 D343 R349	M317-A321 PolarHBondContact O-N 3.23Å; K318-A321 WeakPolarHBondContact O-CB 3.37Å; K318-A321 PolarHBondContact O-N 3.47Å; A321-D343 HydrophobicContact CB-CB 3.48Å; A321-D343 VanDerWaalsContact CB-CB 3.48Å; A321-R349 VanDerWaalsContact CB-CZ 3.47Å; A321-R349 PolarHBondContact O-NH1 3.48Å; A321-R349 PolarHBondContact O-NH2 3.49Å; A321-R349 VanDerWaalsContact O-NH2 3.13Å
322	D	93.1	Very high	94.1	Very high	97 Å²	97	68.7 Å²	68.7	52%	0.519	35%	0.348	S	S	.	.			trans	-83.2	155.5	164.9	-66.8	-51.2	0	0	0	110.2	R320 P342	R320-D322 PolarHBondContact O-N 3.42Å; D322-P342 WeakPolarHBondContact O-CD 3.44Å
323	P	94.9	Very high	93.9	Very high	51 Å²	51	64.7 Å²	64.7	33%	0.331	34%	0.335	S	S	.	.			trans	-67.8	134.9	169.5	28.4	-33.4	0	0	0	111.2	Y325 K339 V340 Y341	P323-Y325 HydrophobicContact CB-CE2 4.46Å; P323-K339 HydrophobicContact CB-CG 4.41Å; P323-V340 CarbonylContact C-O 3.57Å; P323-V340 WeakPolarHBondContact CA-O 3.43Å; P323-Y341 HydrophobicContact CB-CD1 4.06Å; P323-Y341 HydrophobicContact CB-CE1 3.85Å; P323-Y341 HydrophobicContact CG-CE1 4.35Å
324	V	96.8	Very high	93.9	Very high	35 Å²	35	62.2 Å²	62.2	21%	0.212	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	133.6	178.1	-167.5	0	0	0	0	109.4	F309 L311 M317 V340 P342	F309-V324 HydrophobicContact CZ-CG1 3.89Å; L311-V324 HydrophobicContact CD2-CB 4.49Å; L311-V324 HydrophobicContact CD2-CG1 4.47Å; M317-V324 HydrophobicContact CE-CB 4.16Å; M317-V324 HydrophobicContact CE-CG1 3.58Å; M317-V324 HydrophobicContact CE-CG2 3.88Å; V324-V340 PolarHBondContact N-O 3Å; V324-V340 PolarHBondContact O-N 3.07Å; V324-P342 HydrophobicContact CG2-CG 3.71Å
325	Y	97.3	Very high	94	Very high	94 Å²	94	62.4 Å²	62.4	37%	0.369	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	145.5	-178.9	-62.8	-90.3	0	0	0	111.7	F309 P323 R337 L338 K339 E358	F309-Y325 VanDerWaalsContact CZ-O 3.3Å; F309-Y325 WeakPolarHBondContact CZ-O 3.28Å; P323-Y325 HydrophobicContact CB-CE2 4.46Å; Y325-R337 HydrophobicContact CD1-CG 4.32Å; Y325-L338 CarbonylContact C-O 3.45Å; Y325-L338 VanDerWaalsContact CA-O 3.26Å; Y325-L338 WeakPolarHBondContact CA-O 3.45Å; Y325-K339 HydrophobicContact CD1-CB 3.93Å; Y325-K339 HydrophobicContact CD1-CG 4.1Å; Y325-K339 HydrophobicContact CE1-CB 3.76Å; Y325-K339 HydrophobicContact CE1-CD 3.79Å; Y325-K339 HydrophobicContact CE1-CG 3.54Å; Y325-K339 WeakPolarHBondContact OH-CE 3.38Å; Y325-E358 WeakPolarHBondContact CE1-OE2 3.45Å
326	S	97.4	Very high	94.1	Very high	9 Å²	9	60 Å²	60	6%	0.063	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-73.2	169.2	166.7	73.6	0	0	0	0	111.3	R337 L338	S326-R337 WeakPolarHBondContact OG-CA 3.28Å; S326-L338 PolarHBondContact N-O 3.5Å; S326-L338 PolarHBondContact OG-N 3.34Å
327	Q	96.6	Very high	94.3	Very high	159 Å²	159	59.6 Å²	59.6	74%	0.743	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-61.5	150	159.6	-63.3	-60.5	-13.9	0	0	110.2
328	P	95.9	Very high	94.4	Very high	47 Å²	47	58.3 Å²	58.3	31%	0.305	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-81.9	125.1	-177.9	-7.9	25.9	0	0	0	112.4	H330 S335 W336	P328-H330 PolarHBondContact O-CE1 3.28Å; P328-H330 PolarHBondContact O-N 2.81Å; P328-H330 PolarHBondContact O-ND1 2.88Å; P328-S335 VanDerWaalsContact CB-OG 3.26Å; P328-S335 WeakPolarHBondContact CB-OG 3.49Å; P328-W336 CarbonylContact C-O 3.59Å; P328-W336 VanDerWaalsContact CA-O 3.3Å; P328-W336 WeakPolarHBondContact CA-O 3.47Å
329	L	96.9	Very high	94.5	Very high	26 Å²	26	56.5 Å²	56.5	14%	0.136	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	109.2	170.7	170.3	59.3	0	0	0	109.3	V331 W336 F429 V431	L329-V331 HydrophobicContact CD1-CG2 3.81Å; L329-V331 HydrophobicContact CD2-CG2 4.4Å; L329-V331 HydrophobicContact CG-CG2 3.81Å; L329-W336 HydrophobicContact CB-CB 4.32Å; L329-W336 PolarHBondContact N-O 3.04Å; L329-W336 PolarHBondContact O-N 3.21Å; L329-F429 HydrophobicContact CB-CE2 3.94Å; L329-F429 HydrophobicContact CB-CZ 3.94Å; L329-F429 HydrophobicContact CD2-CD2 4.41Å; L329-F429 HydrophobicContact CD2-CE2 3.9Å; L329-F429 HydrophobicContact CD2-CZ 4.47Å; L329-V431 HydrophobicContact CD2-CG1 4.05Å
330	H	95.2	Very high	94.8	Very high	139 Å²	139	48.7 Å²	48.7	64%	0.644	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93	116.4	-179	-67.4	88.2	0	0	0	110.9	P328 L334 S335	P328-H330 PolarHBondContact O-CE1 3.28Å; P328-H330 PolarHBondContact O-N 2.81Å; P328-H330 PolarHBondContact O-ND1 2.88Å; H330-L334 CarbonylContact C-O 3.51Å; H330-L334 WeakPolarHBondContact CA-O 3.45Å; H330-S335 PolarHBondContact CD2-OG 2.86Å; H330-S335 VanDerWaalsContact CD2-OG 3.28Å; H330-S335 PolarHBondContact CE1-OG 3.47Å; H330-S335 PolarHBondContact NE2-OG 3.03Å
331	V	90.8	Very high	95	Very high	24 Å²	24	41.2 Å²	41.2	15%	0.145	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	113.6	-172	167.5	0	0	0	0	109.5	E305 L329 G333 L334	E305-V331 HydrophobicContact CB-CG1 4.27Å; E305-V331 HydrophobicContact CB-CG2 3.61Å; E305-V331 HydrophobicContact CG-CG1 3.73Å; E305-V331 HydrophobicContact CG-CG2 3.92Å; L329-V331 HydrophobicContact CD1-CG2 3.81Å; L329-V331 HydrophobicContact CD2-CG2 4.4Å; L329-V331 HydrophobicContact CG-CG2 3.81Å; V331-G333 PolarHBondContact O-N 3.45Å; V331-G333 VanDerWaalsContact O-N 3.1Å; V331-L334 PolarHBondContact N-O 2.98Å; V331-L334 WeakPolarHBondContact O-CA 3.41Å; V331-L334 VanDerWaalsContact O-CB 3.31Å; V331-L334 WeakPolarHBondContact O-CB 3.29Å; V331-L334 PolarHBondContact O-N 2.95Å
332	G	83.1	Confident	95.3	Very high	29 Å²	29	40.8 Å²	40.8	30%	0.299	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	59	25.4	171.7	0	0	0	0	0	115.5
333	G	89.6	Confident	95.4	Very high	21 Å²	21	37.5 Å²	37.5	22%	0.216	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	90	-2.5	-173.7	0	0	0	0	0	115.3	V331 H446	V331-G333 PolarHBondContact O-N 3.45Å; V331-G333 VanDerWaalsContact O-N 3.1Å; G333-H446 WeakPolarHBondContact CA-CD2 3.14Å
334	L	95.4	Very high	95.4	Very high	8 Å²	8	35.1 Å²	35.1	4%	0.042	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	145.9	171.3	-47.3	178	0	0	0	109.3	H330 V331 W336 L359 A361 L363 Y369	H330-L334 CarbonylContact C-O 3.51Å; H330-L334 WeakPolarHBondContact CA-O 3.45Å; V331-L334 PolarHBondContact N-O 2.98Å; V331-L334 WeakPolarHBondContact O-CA 3.41Å; V331-L334 VanDerWaalsContact O-CB 3.31Å; V331-L334 WeakPolarHBondContact O-CB 3.29Å; V331-L334 PolarHBondContact O-N 2.95Å; L334-W336 HydrophobicContact CD1-CZ2 4.03Å; L334-L359 HydrophobicContact CB-CD1 4.03Å; L334-A361 CarbonylContact C-O 3.59Å; L334-A361 WeakPolarHBondContact CA-O 3.34Å; L334-L363 HydrophobicContact CD2-CB 4.45Å; L334-Y369 HydrophobicContact CD1-CD1 4.47Å; L334-Y369 HydrophobicContact CD1-CE1 3.54Å; L334-Y369 WeakPolarHBondContact CD1-OH 3.3Å
335	S	96.6	Very high	95.3	Very high	8 Å²	8	34.3 Å²	34.3	6%	0.056	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	107.6	178.3	-168.5	0	0	0	0	110.6	P328 H330 S360 A361	P328-S335 VanDerWaalsContact CB-OG 3.26Å; P328-S335 WeakPolarHBondContact CB-OG 3.49Å; H330-S335 PolarHBondContact CD2-OG 2.86Å; H330-S335 VanDerWaalsContact CD2-OG 3.28Å; H330-S335 PolarHBondContact CE1-OG 3.47Å; H330-S335 PolarHBondContact NE2-OG 3.03Å; S335-S360 PolarHBondContact O-N 2.87Å; S335-S360 PolarHBondContact O-OG 2.86Å; S335-A361 PolarHBondContact N-O 3.01Å; S335-A361 PolarHBondContact O-N 3.41Å
336	W	97.5	Very high	95	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.008	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	140.1	-170.6	-64.1	96.3	0	0	0	111.7	P328 L329 L334 L357 E358 L359 Y369 F395 F429 V431	P328-W336 CarbonylContact C-O 3.59Å; P328-W336 VanDerWaalsContact CA-O 3.3Å; P328-W336 WeakPolarHBondContact CA-O 3.47Å; L329-W336 HydrophobicContact CB-CB 4.32Å; L329-W336 PolarHBondContact N-O 3.04Å; L329-W336 PolarHBondContact O-N 3.21Å; L334-W336 HydrophobicContact CD1-CZ2 4.03Å; W336-L357 HydrophobicContact CB-CD1 4.44Å; W336-L357 HydrophobicContact CE3-CD1 4.28Å; W336-L357 HydrophobicContact CE3-CD2 3.88Å; W336-L357 HydrophobicContact CE3-CG 3.92Å; W336-L357 HydrophobicContact CZ3-CD2 4.03Å; W336-L357 HydrophobicContact CZ3-CG 4.31Å; W336-E358 WeakPolarHBondContact CA-O 3.46Å; W336-L359 HydrophobicContact CD2-CD1 4.03Å; W336-L359 HydrophobicContact CE3-CB 4.09Å; W336-L359 HydrophobicContact CE3-CD1 4.22Å; W336-L359 HydrophobicContact CH2-CB 4.12Å; W336-L359 HydrophobicContact CH2-CD1 4.07Å; W336-L359 HydrophobicContact CH2-CD2 4.35Å; W336-L359 HydrophobicContact CH2-CG 4.41Å; W336-L359 HydrophobicContact CZ2-CD1 3.87Å; W336-L359 HydrophobicContact CZ3-CB 3.76Å; W336-L359 HydrophobicContact CZ3-CD1 4.25Å; W336-L359 HydrophobicContact CZ3-CG 4.47Å; W336-Y369 HydrophobicContact CH2-CD1 4.32Å; W336-Y369 AromaticContact CH2-CD2 3.46Å; W336-Y369 HydrophobicContact CH2-CD2 3.46Å; W336-Y369 VanDerWaalsContact CH2-CD2 3.46Å; W336-Y369 HydrophobicContact CH2-CE2 4.01Å; W336-Y369 AromaticContact CH2-CG 3.61Å; W336-Y369 HydrophobicContact CH2-CG 3.61Å; W336-Y369 AromaticContact CZ2-CD1 3.86Å; W336-Y369 HydrophobicContact CZ2-CD1 3.86Å; W336-Y369 AromaticContact CZ2-CD2 3.73Å; W336-Y369 HydrophobicContact CZ2-CD2 3.73Å; W336-Y369 HydrophobicContact CZ2-CE1 4.16Å; W336-Y369 AromaticContact CZ2-CE2 3.99Å; W336-Y369 HydrophobicContact CZ2-CE2 3.99Å; W336-Y369 AromaticContact CZ2-CG 3.64Å; W336-Y369 HydrophobicContact CZ2-CG 3.64Å; W336-F395 HydrophobicContact CH2-CB 4.27Å; W336-F395 HydrophobicContact CH2-CD1 4.25Å; W336-F395 AromaticContact CH2-CD2 3.93Å; W336-F395 HydrophobicContact CH2-CD2 3.93Å; W336-F395 HydrophobicContact CH2-CE2 4.27Å; W336-F395 AromaticContact CH2-CG 3.92Å; W336-F395 HydrophobicContact CH2-CG 3.92Å; W336-F395 AromaticContact CZ3-CD1 3.7Å; W336-F395 HydrophobicContact CZ3-CD1 3.7Å; W336-F395 HydrophobicContact CZ3-CD2 4.06Å; W336-F395 AromaticContact CZ3-CE1 3.76Å; W336-F395 HydrophobicContact CZ3-CE1 3.76Å; W336-F395 HydrophobicContact CZ3-CE2 4.1Å; W336-F395 AromaticContact CZ3-CG 3.86Å; W336-F395 HydrophobicContact CZ3-CG 3.86Å; W336-F395 AromaticContact CZ3-CZ 3.96Å; W336-F395 HydrophobicContact CZ3-CZ 3.96Å; W336-F429 HydrophobicContact CB-CE2 4.37Å; W336-V431 HydrophobicContact CB-CG1 4.46Å; W336-V431 HydrophobicContact CD2-CG1 4.17Å; W336-V431 HydrophobicContact CD2-CG2 3.97Å; W336-V431 HydrophobicContact CE3-CG2 4.21Å; W336-V431 HydrophobicContact CG-CG1 3.91Å; W336-V431 HydrophobicContact CH2-CG2 4.06Å; W336-V431 HydrophobicContact CZ2-CG2 3.81Å; W336-V431 HydrophobicContact CZ3-CG2 4.25Å
337	R	97.3	Very high	94.6	Very high	68 Å²	68	39 Å²	39	26%	0.257	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	150.4	173.3	64.8	-174	-179.2	-156.6	-5.6	112.5	Y325 S326 E358	Y325-R337 HydrophobicContact CD1-CG 4.32Å; S326-R337 WeakPolarHBondContact OG-CA 3.28Å; R337-E358 HydrophobicContact CG-CB 4.08Å; R337-E358 IonicContact CZ-OE1 2.75Å; R337-E358 IonicContact CZ-OE2 3.67Å; R337-E358 VanDerWaalsContact CZ-OE2 3.29Å; R337-E358 PolarHBondContact N-O 3.49Å; R337-E358 IonicContact NE-OE1 3.48Å; R337-E358 IonicContact NE-OE2 3.48Å; R337-E358 PolarHBondContact NE-OE2 2.88Å; R337-E358 IonicContact NH2-OE1 3.18Å; R337-E358 PolarHBondContact NH2-OE1 3.35Å; R337-E358 IonicContact NH2-OE2 3.6Å; R337-E358 PolarHBondContact NH2-OE2 2.84Å; R337-E358 PolarHBondContact O-N 2.94Å
338	L	97.6	Very high	94.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	146.2	162.7	-73.7	179.3	0	0	0	110.3	F309 Y325 S326 V340 V355 F356 L357 V373 L427 F429	F309-L338 HydrophobicContact CB-CD1 4.4Å; F309-L338 HydrophobicContact CD1-CB 4.18Å; F309-L338 HydrophobicContact CD1-CD1 4.1Å; Y325-L338 CarbonylContact C-O 3.45Å; Y325-L338 VanDerWaalsContact CA-O 3.26Å; Y325-L338 WeakPolarHBondContact CA-O 3.45Å; S326-L338 PolarHBondContact N-O 3.5Å; S326-L338 PolarHBondContact OG-N 3.34Å; L338-V340 HydrophobicContact CB-CG2 4.36Å; L338-V355 HydrophobicContact CD1-CG1 4.44Å; L338-V355 HydrophobicContact CD2-CG1 3.82Å; L338-F356 CarbonylContact C-O 3.46Å; L338-F356 VanDerWaalsContact CA-O 3.31Å; L338-F356 WeakPolarHBondContact CA-O 3.46Å; L338-F356 WeakPolarHBondContact CD2-O 3.41Å; L338-L357 HydrophobicContact CD2-CD1 4.45Å; L338-V373 HydrophobicContact CD2-CG2 4.27Å; L338-L427 HydrophobicContact CD1-CB 4.06Å; L338-L427 HydrophobicContact CD1-CD1 4.12Å; L338-F429 HydrophobicContact CD1-CB 3.99Å; L338-F429 HydrophobicContact CD1-CD1 3.61Å; L338-F429 HydrophobicContact CD1-CE1 4.34Å; L338-F429 HydrophobicContact CD1-CG 4.05Å; L338-F429 HydrophobicContact CD2-CB 3.9Å; L338-F429 HydrophobicContact CD2-CD1 4.46Å; L338-F429 HydrophobicContact CD2-CG 4.14Å; L338-F429 HydrophobicContact CG-CB 3.89Å; L338-F429 HydrophobicContact CG-CD1 3.54Å; L338-F429 HydrophobicContact CG-CD2 4.36Å; L338-F429 HydrophobicContact CG-CE1 4.06Å; L338-F429 HydrophobicContact CG-CG 3.69Å
339	K	97.1	Very high	94.3	Very high	23 Å²	23	35.1 Å²	35.1	10%	0.1	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	105.1	168	178.8	-174.2	-175.9	-169.6	0	107.2	P323 Y325 Y341 F356 D1355	P323-K339 HydrophobicContact CB-CG 4.41Å; Y325-K339 HydrophobicContact CD1-CB 3.93Å; Y325-K339 HydrophobicContact CD1-CG 4.1Å; Y325-K339 HydrophobicContact CE1-CB 3.76Å; Y325-K339 HydrophobicContact CE1-CD 3.79Å; Y325-K339 HydrophobicContact CE1-CG 3.54Å; Y325-K339 WeakPolarHBondContact OH-CE 3.38Å; K339-Y341 HydrophobicContact CD-CE2 4.41Å; K339-Y341 WeakPolarHBondContact CE-OH 3.36Å; K339-Y341 HydrophobicContact CG-CE2 4.35Å; K339-Y341 PolarHBondContact NZ-OH 3.14Å; K339-Y341 VanDerWaalsContact NZ-OH 3.1Å; K339-F356 HydrophobicContact CB-CB 4.41Å; K339-F356 PolarHBondContact N-O 2.8Å; K339-F356 PolarHBondContact O-N 3.48Å; K339-D1355 IonicContact NZ-OD2 2.73Å; K339-D1355 PolarHBondContact NZ-OD2 3.34Å
340	V	97.6	Very high	94.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	140.1	-176.6	-179.2	0	0	0	0	109.4	F309 L311 P323 V324 L338 P342 L353 S354 V355 L427	F309-V340 HydrophobicContact CD1-CG2 4.24Å; F309-V340 HydrophobicContact CE1-CG2 3.87Å; L311-V340 HydrophobicContact CD1-CG1 3.91Å; L311-V340 HydrophobicContact CD1-CG2 4.47Å; L311-V340 HydrophobicContact CD2-CB 4.26Å; L311-V340 HydrophobicContact CD2-CG1 4.24Å; L311-V340 HydrophobicContact CD2-CG2 4.37Å; P323-V340 CarbonylContact C-O 3.57Å; P323-V340 WeakPolarHBondContact CA-O 3.43Å; V324-V340 PolarHBondContact N-O 3Å; V324-V340 PolarHBondContact O-N 3.07Å; L338-V340 HydrophobicContact CB-CG2 4.36Å; V340-P342 HydrophobicContact CG1-CG 4.45Å; V340-L353 HydrophobicContact CG1-CD1 3.8Å; V340-S354 WeakPolarHBondContact CA-O 3.33Å; V340-V355 HydrophobicContact CG1-CG2 4.35Å; V340-V355 HydrophobicContact CG2-CG1 4.24Å; V340-V355 HydrophobicContact CG2-CG2 4.39Å; V340-L427 HydrophobicContact CG2-CD1 3.68Å
341	Y	97.4	Very high	94.2	Very high	16 Å²	16	34.1 Å²	34.1	6%	0.063	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	101.5	165.1	-61	-103.2	0	0	0	107.5	P323 K339 D343 G344 N345 S354 F356 D1355 S1357	P323-Y341 HydrophobicContact CB-CD1 4.06Å; P323-Y341 HydrophobicContact CB-CE1 3.85Å; P323-Y341 HydrophobicContact CG-CE1 4.35Å; K339-Y341 HydrophobicContact CD-CE2 4.41Å; K339-Y341 WeakPolarHBondContact CE-OH 3.36Å; K339-Y341 HydrophobicContact CG-CE2 4.35Å; K339-Y341 PolarHBondContact NZ-OH 3.14Å; K339-Y341 VanDerWaalsContact NZ-OH 3.1Å; Y341-D343 PolarHBondContact O-N 3.05Å; Y341-G344 WeakPolarHBondContact O-CA 3.27Å; Y341-G344 PolarHBondContact O-N 3.4Å; Y341-N345 HydrophobicContact CD1-CB 4.08Å; Y341-N345 HydrophobicContact CD2-CB 3.83Å; Y341-N345 HydrophobicContact CE1-CB 4.27Å; Y341-N345 HydrophobicContact CE2-CB 4.02Å; Y341-N345 HydrophobicContact CG-CB 3.84Å; Y341-S354 PolarHBondContact N-O 3.46Å; Y341-S354 PolarHBondContact O-N 3.12Å; Y341-F356 AromaticContact CD2-CD2 3.97Å; Y341-F356 HydrophobicContact CD2-CD2 3.97Å; Y341-F356 AromaticContact CD2-CE2 3.82Å; Y341-F356 HydrophobicContact CD2-CE2 3.82Å; Y341-F356 AromaticContact CE2-CD2 3.75Å; Y341-F356 HydrophobicContact CE2-CD2 3.75Å; Y341-F356 AromaticContact CE2-CE2 3.67Å; Y341-F356 HydrophobicContact CE2-CE2 3.67Å; Y341-D1355 PolarHBondContact OH-OD2 2.92Å; Y341-S1357 PolarHBondContact OH-OG 3.43Å
342	P	96.6	Very high	94.4	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-27.9	-172.9	-26.5	36.7	0	0	0	114.4	Y314 M317 K318 D322 V324 V340 L409	Y314-P342 HydrophobicContact CD2-CB 4.29Å; Y314-P342 HydrophobicContact CE2-CB 3.81Å; Y314-P342 PolarHBondContact OH-O 3.44Å; Y314-P342 VanDerWaalsContact OH-O 3.05Å; M317-P342 HydrophobicContact CB-CB 4.27Å; M317-P342 HydrophobicContact CB-CG 3.99Å; K318-P342 HydrophobicContact CB-CB 4.34Å; D322-P342 WeakPolarHBondContact O-CD 3.44Å; V324-P342 HydrophobicContact CG2-CG 3.71Å; V340-P342 HydrophobicContact CG1-CG 4.45Å; P342-L409 WeakPolarHBondContact O-CD2 3.45Å
343	D	96	Very high	95.1	Very high	29 Å²	29	33.2 Å²	33.2	16%	0.155	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	7.6	172.8	-166	56.4	0	0	0	112.7	K318 A321 Y341 R349 G350	K318-D343 VanDerWaalsContact CE-OD1 3.29Å; K318-D343 WeakPolarHBondContact CE-OD1 3.33Å; K318-D343 HydrophobicContact CG-CB 3.96Å; A321-D343 HydrophobicContact CB-CB 3.48Å; A321-D343 VanDerWaalsContact CB-CB 3.48Å; Y341-D343 PolarHBondContact O-N 3.05Å; D343-R349 CarbonylContact O-C 3.59Å; D343-R349 VanDerWaalsContact O-CA 3.23Å; D343-R349 WeakPolarHBondContact O-CA 3.39Å; D343-R349 WeakPolarHBondContact OD2-CG 3.4Å; D343-R349 IonicContact OD2-NE 3.97Å; D343-G350 PolarHBondContact O-N 2.82Å; D343-G350 PolarHBondContact OD2-N 3.22Å
344	G	95.2	Very high	95.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.183	C	C	.	.			trans	87.9	162.2	-178.8	0	0	0	0	0	115.9	Y341 Y352 S354	Y341-G344 WeakPolarHBondContact O-CA 3.27Å; Y341-G344 PolarHBondContact O-N 3.4Å; G344-Y352 WeakPolarHBondContact CA-O 3.5Å; G344-Y352 PolarHBondContact N-O 3.38Å; G344-S354 WeakPolarHBondContact CA-OG 3.23Å
345	N	94	Very high	95.5	Very high	18 Å²	18	31.9 Å²	31.9	10%	0.096	18%	0.181	C	C	.	.	S	Bend	trans	-106.8	154.4	-179.1	-161.8	13.6	0	0	0	112.7	Y341 V347 V348 R349 S354 F356 D1355 S1357	Y341-N345 HydrophobicContact CD1-CB 4.08Å; Y341-N345 HydrophobicContact CD2-CB 3.83Å; Y341-N345 HydrophobicContact CE1-CB 4.27Å; Y341-N345 HydrophobicContact CE2-CB 4.02Å; Y341-N345 HydrophobicContact CG-CB 3.84Å; N345-V347 PolarHBondContact O-N 3.48Å; N345-V348 VanDerWaalsContact O-CG2 3.24Å; N345-V348 WeakPolarHBondContact O-CG2 3.3Å; N345-V348 PolarHBondContact O-N 2.61Å; N345-V348 VanDerWaalsContact O-N 3.12Å; N345-R349 PolarHBondContact O-N 2.79Å; N345-S354 PolarHBondContact N-OG 3.19Å; N345-F356 HydrophobicContact CB-CE2 4.41Å; N345-D1355 PolarHBondContact ND2-OD1 2.89Å; N345-S1357 PolarHBondContact ND2-OG 2.92Å; N345-S1357 VanDerWaalsContact ND2-OG 3.07Å; N345-S1357 PolarHBondContact OD1-OG 3.48Å
346	G	90.6	Very high	95.5	Very high	55 Å²	55	31.5 Å²	31.5	57%	0.567	18%	0.178	S	C	*	.	G	3₁₀ helix	trans	47.1	-127.5	171.4	0	0	0	0	0	114.3	V348 R349	G346-V348 PolarHBondContact O-N 2.86Å; G346-R349 PolarHBondContact O-N 3.13Å
347	V	90	Very high	95.5	Very high	148 Å²	148	31.5 Å²	31.5	90%	0.897	18%	0.178	S	C	*	.	G	3₁₀ helix	trans	-74.1	-3.9	-175.4	-58.3	0	0	0	0	115	N345	N345-V347 PolarHBondContact O-N 3.48Å
348	V	92.1	Very high	95.5	Very high	7 Å²	7	29.1 Å²	29.1	4%	0.042	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-113.2	6.2	179.1	-58.3	0	0	0	0	113.8	N345 G346 N351 Y352 N404 R405	N345-V348 VanDerWaalsContact O-CG2 3.24Å; N345-V348 WeakPolarHBondContact O-CG2 3.3Å; N345-V348 PolarHBondContact O-N 2.61Å; N345-V348 VanDerWaalsContact O-N 3.12Å; G346-V348 PolarHBondContact O-N 2.86Å; V348-N351 WeakPolarHBondContact O-CB 3.34Å; V348-N351 PolarHBondContact O-N 3.42Å; V348-N351 VanDerWaalsContact O-N 3.09Å; V348-Y352 HydrophobicContact CB-CD2 3.99Å; V348-Y352 HydrophobicContact CG1-CD2 4.38Å; V348-Y352 PolarHBondContact O-N 3.2Å; V348-N404 HydrophobicContact CG2-CB 3.88Å; V348-N404 WeakPolarHBondContact CG2-O 3.17Å; V348-R405 HydrophobicContact CG1-CG 3.92Å
349	R	93.4	Very high	95.4	Very high	117 Å²	117	29.2 Å²	29.2	44%	0.442	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	145.7	172.2	-170.5	176.6	179	107.3	-15	111.5	A321 D343 N345 G346 N351	A321-R349 VanDerWaalsContact CB-CZ 3.47Å; A321-R349 PolarHBondContact O-NH1 3.48Å; A321-R349 PolarHBondContact O-NH2 3.49Å; A321-R349 VanDerWaalsContact O-NH2 3.13Å; D343-R349 CarbonylContact O-C 3.59Å; D343-R349 VanDerWaalsContact O-CA 3.23Å; D343-R349 WeakPolarHBondContact O-CA 3.39Å; D343-R349 WeakPolarHBondContact OD2-CG 3.4Å; D343-R349 IonicContact OD2-NE 3.97Å; N345-R349 PolarHBondContact O-N 2.79Å; G346-R349 PolarHBondContact O-N 3.13Å; R349-N351 PolarHBondContact O-N 3.32Å; R349-N351 PolarHBondContact O-ND2 2.85Å
350	G	94.2	Very high	95.3	Very high	42 Å²	42	29.6 Å²	29.6	43%	0.433	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	-9.3	-171.3	0	0	0	0	0	115.3	D343	D343-G350 PolarHBondContact O-N 2.82Å; D343-G350 PolarHBondContact OD2-N 3.22Å
351	N	95.1	Very high	95.2	Very high	101 Å²	101	31.8 Å²	31.8	54%	0.54	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.6	-41.6	-172.5	-63.6	-89.9	0	0	0	113.9	V348 R349 L409	V348-N351 WeakPolarHBondContact O-CB 3.34Å; V348-N351 PolarHBondContact O-N 3.42Å; V348-N351 VanDerWaalsContact O-N 3.09Å; R349-N351 PolarHBondContact O-N 3.32Å; R349-N351 PolarHBondContact O-ND2 2.85Å; N351-L409 PolarHBondContact O-N 3.4Å
352	Y	96.7	Very high	94.9	Very high	35 Å²	35	31.5 Å²	31.5	14%	0.137	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	142.8	-178.7	-67.3	-103	0	0	0	112.2	G344 V348 R405 F407 R408 L409	G344-Y352 WeakPolarHBondContact CA-O 3.5Å; G344-Y352 PolarHBondContact N-O 3.38Å; V348-Y352 HydrophobicContact CB-CD2 3.99Å; V348-Y352 HydrophobicContact CG1-CD2 4.38Å; V348-Y352 PolarHBondContact O-N 3.2Å; Y352-R405 HydrophobicContact CD1-CB 3.73Å; Y352-R405 HydrophobicContact CD1-CG 4.04Å; Y352-R405 HydrophobicContact CD2-CG 4.21Å; Y352-R405 HydrophobicContact CE1-CB 3.99Å; Y352-R405 HydrophobicContact CE1-CG 4.17Å; Y352-R405 HydrophobicContact CE2-CG 4.35Å; Y352-R405 VanDerWaalsContact CE2-NH1 3.28Å; Y352-R405 HydrophobicContact CG-CB 4.14Å; Y352-R405 HydrophobicContact CG-CG 4.05Å; Y352-R405 PolarHBondContact OH-NH1 3.03Å; Y352-F407 CarbonylContact C-O 3.56Å; Y352-F407 VanDerWaalsContact CA-O 3.23Å; Y352-F407 WeakPolarHBondContact CA-O 3.3Å; Y352-R408 HydrophobicContact CD1-CG 4.22Å; Y352-R408 HydrophobicContact CE1-CG 3.8Å; Y352-L409 VanDerWaalsContact C-CG 3.48Å
353	L	96.9	Very high	94.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	134.8	161.4	-179	65	0	0	0	108.1	V340 V355 M375 F406 F407 L409	V340-L353 HydrophobicContact CG1-CD1 3.8Å; L353-V355 HydrophobicContact CD2-CG2 4.25Å; L353-V355 HydrophobicContact CG-CG2 4.07Å; L353-M375 HydrophobicContact CD2-SD 3.93Å; L353-F406 HydrophobicContact CD2-CD1 4.28Å; L353-F406 WeakPolarHBondContact O-CA 3.44Å; L353-F406 WeakPolarHBondContact O-CB 3.39Å; L353-F406 PolarHBondContact O-N 3.42Å; L353-F407 PolarHBondContact N-O 3.16Å; L353-L409 HydrophobicContact CB-CD2 3.86Å; L353-L409 VanDerWaalsContact N-CD2 3.32Å
354	S	96.9	Very high	94	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	136	174	-47.5	0	0	0	0	110.6	V340 Y341 G344 N345 Y403 N404	V340-S354 WeakPolarHBondContact CA-O 3.33Å; Y341-S354 PolarHBondContact N-O 3.46Å; Y341-S354 PolarHBondContact O-N 3.12Å; G344-S354 WeakPolarHBondContact CA-OG 3.23Å; N345-S354 PolarHBondContact N-OG 3.19Å; S354-Y403 CarbonylContact C-O 3.54Å; S354-Y403 WeakPolarHBondContact CA-O 3.47Å; S354-Y403 VanDerWaalsContact CB-O 3.24Å; S354-Y403 WeakPolarHBondContact CB-O 3.43Å; S354-N404 WeakPolarHBondContact CB-O 3.31Å; S354-N404 PolarHBondContact OG-O 3.39Å
355	V	97.1	Very high	93.6	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	123.7	-173.6	-176.5	0	0	0	0	109.8	L338 V340 L353 V373 G402 Y403 F406 L427	L338-V355 HydrophobicContact CD1-CG1 4.44Å; L338-V355 HydrophobicContact CD2-CG1 3.82Å; V340-V355 HydrophobicContact CG1-CG2 4.35Å; V340-V355 HydrophobicContact CG2-CG1 4.24Å; V340-V355 HydrophobicContact CG2-CG2 4.39Å; L353-V355 HydrophobicContact CD2-CG2 4.25Å; L353-V355 HydrophobicContact CG-CG2 4.07Å; V355-V373 HydrophobicContact CG1-CG1 3.85Å; V355-G402 CarbonylContact O-C 3.58Å; V355-G402 WeakPolarHBondContact O-CA 3.32Å; V355-Y403 PolarHBondContact N-O 2.89Å; V355-Y403 PolarHBondContact O-N 3.48Å; V355-F406 HydrophobicContact CB-CB 4.33Å; V355-F406 HydrophobicContact CB-CD2 4.01Å; V355-F406 HydrophobicContact CB-CG 4.14Å; V355-F406 HydrophobicContact CG2-CB 4.01Å; V355-F406 HydrophobicContact CG2-CD1 4.13Å; V355-F406 HydrophobicContact CG2-CD2 4.16Å; V355-F406 HydrophobicContact CG2-CG 3.81Å; V355-L427 HydrophobicContact CG1-CD1 4.29Å; V355-L427 HydrophobicContact CG2-CD1 4.14Å
356	F	96.5	Very high	93.6	Very high	0 Å²	0	45 Å²	45	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	149	178.4	-57.5	-94.7	0	0	0	110.7	L338 K339 Y341 N345 C400 D1353 D1355	L338-F356 CarbonylContact C-O 3.46Å; L338-F356 VanDerWaalsContact CA-O 3.31Å; L338-F356 WeakPolarHBondContact CA-O 3.46Å; L338-F356 WeakPolarHBondContact CD2-O 3.41Å; K339-F356 HydrophobicContact CB-CB 4.41Å; K339-F356 PolarHBondContact N-O 2.8Å; K339-F356 PolarHBondContact O-N 3.48Å; Y341-F356 AromaticContact CD2-CD2 3.97Å; Y341-F356 HydrophobicContact CD2-CD2 3.97Å; Y341-F356 AromaticContact CD2-CE2 3.82Å; Y341-F356 HydrophobicContact CD2-CE2 3.82Å; Y341-F356 AromaticContact CE2-CD2 3.75Å; Y341-F356 HydrophobicContact CE2-CD2 3.75Å; Y341-F356 AromaticContact CE2-CE2 3.67Å; Y341-F356 HydrophobicContact CE2-CE2 3.67Å; N345-F356 HydrophobicContact CB-CE2 4.41Å; F356-C400 HydrophobicContact CB-CB 4.45Å; F356-D1353 HydrophobicContact CE1-CB 4.19Å; F356-D1355 HydrophobicContact CD1-CB 4.07Å; F356-D1355 HydrophobicContact CE1-CB 4.09Å
357	L	97.3	Very high	93.8	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	138	166.1	-176.8	67.4	0	0	0	108.6	W336 L338 Y371 F395 C400 W401 F429 V431	W336-L357 HydrophobicContact CB-CD1 4.44Å; W336-L357 HydrophobicContact CE3-CD1 4.28Å; W336-L357 HydrophobicContact CE3-CD2 3.88Å; W336-L357 HydrophobicContact CE3-CG 3.92Å; W336-L357 HydrophobicContact CZ3-CD2 4.03Å; W336-L357 HydrophobicContact CZ3-CG 4.31Å; L338-L357 HydrophobicContact CD2-CD1 4.45Å; L357-Y371 HydrophobicContact CB-CD2 4.26Å; L357-Y371 HydrophobicContact CB-CE2 4.4Å; L357-Y371 HydrophobicContact CD2-CD1 4.27Å; L357-Y371 HydrophobicContact CD2-CD2 3.87Å; L357-Y371 HydrophobicContact CD2-CG 3.64Å; L357-F395 HydrophobicContact CD2-CZ 4.09Å; L357-F395 HydrophobicContact CG-CE1 4.47Å; L357-F395 HydrophobicContact CG-CZ 4.44Å; L357-C400 CarbonylContact O-C 3.57Å; L357-C400 VanDerWaalsContact O-CA 3.31Å; L357-C400 WeakPolarHBondContact O-CA 3.42Å; L357-W401 PolarHBondContact N-O 3.41Å; L357-W401 PolarHBondContact O-N 3.16Å; L357-F429 HydrophobicContact CD1-CD2 3.62Å; L357-F429 HydrophobicContact CD1-CE2 3.96Å; L357-V431 HydrophobicContact CD2-CB 4.46Å; L357-V431 HydrophobicContact CD2-CG2 4.27Å
358	E	96.4	Very high	94	Very high	19 Å²	19	39.7 Å²	39.7	9%	0.089	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	133.3	179.3	-178.1	-176.1	173	0	0	110.8	Y325 W336 R337 S360 E399 C400	Y325-E358 WeakPolarHBondContact CE1-OE2 3.45Å; W336-E358 WeakPolarHBondContact CA-O 3.46Å; R337-E358 HydrophobicContact CG-CB 4.08Å; R337-E358 IonicContact CZ-OE1 2.75Å; R337-E358 IonicContact CZ-OE2 3.67Å; R337-E358 VanDerWaalsContact CZ-OE2 3.29Å; R337-E358 PolarHBondContact N-O 3.49Å; R337-E358 IonicContact NE-OE1 3.48Å; R337-E358 IonicContact NE-OE2 3.48Å; R337-E358 PolarHBondContact NE-OE2 2.88Å; R337-E358 IonicContact NH2-OE1 3.18Å; R337-E358 PolarHBondContact NH2-OE1 3.35Å; R337-E358 IonicContact NH2-OE2 3.6Å; R337-E358 PolarHBondContact NH2-OE2 2.84Å; R337-E358 PolarHBondContact O-N 2.94Å; E358-S360 PolarHBondContact O-N 3.24Å; E358-E399 WeakPolarHBondContact CA-O 3.44Å; E358-C400 VanDerWaalsContact CG-SG 3.58Å
359	L	96.7	Very high	94.2	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	90.2	166.5	178.3	57.7	0	0	0	108.6	L334 W336 A361 Y369 F395 V397 G398 E399	L334-L359 HydrophobicContact CB-CD1 4.03Å; W336-L359 HydrophobicContact CD2-CD1 4.03Å; W336-L359 HydrophobicContact CE3-CB 4.09Å; W336-L359 HydrophobicContact CE3-CD1 4.22Å; W336-L359 HydrophobicContact CH2-CB 4.12Å; W336-L359 HydrophobicContact CH2-CD1 4.07Å; W336-L359 HydrophobicContact CH2-CD2 4.35Å; W336-L359 HydrophobicContact CH2-CG 4.41Å; W336-L359 HydrophobicContact CZ2-CD1 3.87Å; W336-L359 HydrophobicContact CZ3-CB 3.76Å; W336-L359 HydrophobicContact CZ3-CD1 4.25Å; W336-L359 HydrophobicContact CZ3-CG 4.47Å; L359-A361 VanDerWaalsContact CD1-O 3.22Å; L359-A361 WeakPolarHBondContact CD1-O 3.26Å; L359-Y369 HydrophobicContact CD2-CE2 4.39Å; L359-F395 HydrophobicContact CB-CB 4Å; L359-F395 HydrophobicContact CB-CD1 3.98Å; L359-F395 HydrophobicContact CB-CG 4.34Å; L359-F395 HydrophobicContact CD2-CB 3.75Å; L359-V397 WeakPolarHBondContact O-CA 3.45Å; L359-G398 PolarHBondContact O-N 2.73Å; L359-E399 PolarHBondContact N-O 3.04Å
360	S	95.1	Very high	94.4	Very high	32 Å²	32	35.8 Å²	35.8	22%	0.224	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-24.9	-171	68.8	0	0	0	0	114.5	S335 E358	S335-S360 PolarHBondContact O-N 2.87Å; S335-S360 PolarHBondContact O-OG 2.86Å; E358-S360 PolarHBondContact O-N 3.24Å
361	A	94.2	Very high	94.5	Very high	45 Å²	45	34 Å²	34	37%	0.372	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	154.5	170	0	0	0	0	0	110.2	L334 S335 L359	L334-A361 CarbonylContact C-O 3.59Å; L334-A361 WeakPolarHBondContact CA-O 3.34Å; S335-A361 PolarHBondContact N-O 3.01Å; S335-A361 PolarHBondContact O-N 3.41Å; L359-A361 VanDerWaalsContact CD1-O 3.22Å; L359-A361 WeakPolarHBondContact CD1-O 3.26Å
362	G	92.1	Very high	94.5	Very high	11 Å²	11	32.5 Å²	32.5	11%	0.113	17%	0.174	C	C	.	.	S	Bend	trans	154.5	-158.7	178.5	0	0	0	0	0	113.1	W445	G362-W445 VanDerWaalsContact O-CH2 3.26Å; G362-W445 WeakPolarHBondContact O-CH2 3.47Å
363	L	88.7	Confident	94.6	Very high	22 Å²	22	31.1 Å²	31.1	12%	0.115	17%	0.169	C	C	.	.			trans	-60.3	135.4	175.8	-179.1	71.8	0	0	0	111.2	L334 E365 V397 W445	L334-L363 HydrophobicContact CD2-CB 4.45Å; L363-E365 VanDerWaalsContact C-N 3.32Å; L363-E365 HydrophobicContact CD2-CB 4.16Å; L363-E365 HydrophobicContact CG-CB 4.25Å; L363-E365 PolarHBondContact O-N 3.34Å; L363-V397 WeakPolarHBondContact O-CG2 3.5Å; L363-W445 HydrophobicContact CB-CD2 4.2Å; L363-W445 HydrophobicContact CB-CE3 4.18Å; L363-W445 HydrophobicContact CD1-CB 4.12Å; L363-W445 VanDerWaalsContact CD1-CD1 3.46Å; L363-W445 HydrophobicContact CD1-CD2 3.72Å; L363-W445 HydrophobicContact CD1-CG 3.47Å; L363-W445 VanDerWaalsContact CD1-CG 3.47Å
364	L	84.8	Confident	94.5	Very high	145 Å²	145	32.2 Å²	32.2	76%	0.759	17%	0.174	S	C	*	.	S	Bend	trans	-72.5	-17.5	-177.4	-62.8	174.6	0	0	0	114.7
365	E	87.5	Confident	94.5	Very high	116 Å²	116	32.2 Å²	32.2	54%	0.542	17%	0.174	S	C	.	.	S	Bend	trans	-83.7	125	-179.1	-175.2	-175.8	-137.6	0	0	111.3	L363 S367 R441	L363-E365 VanDerWaalsContact C-N 3.32Å; L363-E365 HydrophobicContact CD2-CB 4.16Å; L363-E365 HydrophobicContact CG-CB 4.25Å; L363-E365 PolarHBondContact O-N 3.34Å; E365-S367 WeakPolarHBondContact O-CB 3.25Å; E365-S367 PolarHBondContact O-N 3.47Å; E365-S367 PolarHBondContact O-OG 3.01Å; E365-R441 IonicContact OE2-CZ 3.22Å; E365-R441 IonicContact OE2-NH1 3.01Å; E365-R441 PolarHBondContact OE2-NH1 3.4Å
366	A	92.8	Very high	94.5	Very high	48 Å²	48	33.6 Å²	33.6	40%	0.397	18%	0.183	S	C	.	.			trans	-48.3	109	175.4	0	0	0	0	0	112	E396	A366-E396 HydrophobicContact CB-CG 3.51Å
367	S	94.6	Very high	94.4	Very high	6 Å²	6	34.3 Å²	34.3	4%	0.042	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	141.3	-168.7	-65.7	0	0	0	0	111.7	E365 Y369 H394 F395 R441	E365-S367 WeakPolarHBondContact O-CB 3.25Å; E365-S367 PolarHBondContact O-N 3.47Å; E365-S367 PolarHBondContact O-OG 3.01Å; S367-Y369 WeakPolarHBondContact O-CD2 3.44Å; S367-Y369 WeakPolarHBondContact O-CE2 3.43Å; S367-H394 CarbonylContact O-C 3.53Å; S367-H394 WeakPolarHBondContact O-CA 3.14Å; S367-F395 PolarHBondContact N-O 3.06Å; S367-F395 PolarHBondContact O-N 3.28Å; S367-R441 PolarHBondContact OG-NH2 2.98Å
368	K	95.7	Very high	94.1	Very high	85 Å²	85	36.9 Å²	36.9	37%	0.37	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	125.9	-179.2	-170.2	-170.5	169.9	-162	0	110.8	S393 P434	K368-S393 WeakPolarHBondContact CA-O 3.36Å; K368-P434 HydrophobicContact CD-CG 4.45Å; K368-P434 HydrophobicContact CG-CG 4.42Å; K368-P434 WeakPolarHBondContact O-CD 3.26Å; K368-P434 WeakPolarHBondContact O-CG 3.28Å
369	Y	96.1	Very high	93.6	Very high	5 Å²	5	42.3 Å²	42.3	2%	0.02	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	151.2	172.8	-59.6	-83.2	0	0	0	111.1	L334 W336 L359 S367 A392 S393 F395 D442	L334-Y369 HydrophobicContact CD1-CD1 4.47Å; L334-Y369 HydrophobicContact CD1-CE1 3.54Å; L334-Y369 WeakPolarHBondContact CD1-OH 3.3Å; W336-Y369 HydrophobicContact CH2-CD1 4.32Å; W336-Y369 AromaticContact CH2-CD2 3.46Å; W336-Y369 HydrophobicContact CH2-CD2 3.46Å; W336-Y369 VanDerWaalsContact CH2-CD2 3.46Å; W336-Y369 HydrophobicContact CH2-CE2 4.01Å; W336-Y369 AromaticContact CH2-CG 3.61Å; W336-Y369 HydrophobicContact CH2-CG 3.61Å; W336-Y369 AromaticContact CZ2-CD1 3.86Å; W336-Y369 HydrophobicContact CZ2-CD1 3.86Å; W336-Y369 AromaticContact CZ2-CD2 3.73Å; W336-Y369 HydrophobicContact CZ2-CD2 3.73Å; W336-Y369 HydrophobicContact CZ2-CE1 4.16Å; W336-Y369 AromaticContact CZ2-CE2 3.99Å; W336-Y369 HydrophobicContact CZ2-CE2 3.99Å; W336-Y369 AromaticContact CZ2-CG 3.64Å; W336-Y369 HydrophobicContact CZ2-CG 3.64Å; L359-Y369 HydrophobicContact CD2-CE2 4.39Å; S367-Y369 WeakPolarHBondContact O-CD2 3.44Å; S367-Y369 WeakPolarHBondContact O-CE2 3.43Å; Y369-A392 WeakPolarHBondContact O-CA 3.45Å; Y369-S393 PolarHBondContact N-O 2.93Å; Y369-S393 PolarHBondContact O-N 3.23Å; Y369-F395 HydrophobicContact CD2-CB 4.19Å; Y369-F395 AromaticContact CD2-CD2 3.99Å; Y369-F395 HydrophobicContact CD2-CD2 3.99Å; Y369-F395 HydrophobicContact CD2-CG 4.46Å; Y369-F395 HydrophobicContact CE2-CB 4.5Å; Y369-D442 PolarHBondContact OH-OD2 3.41Å
370	E	96.6	Very high	93.2	Very high	37 Å²	37	44 Å²	44	17%	0.173	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	137.5	172.9	-77.4	166.6	-159.6	0	0	109.2	Y304 F391 A392 V431 R432 P434	Y304-E370 HydrophobicContact CE1-CB 4.34Å; E370-F391 CarbonylContact C-O 3.59Å; E370-F391 WeakPolarHBondContact CA-O 3.45Å; E370-A392 HydrophobicContact CG-CB 3.76Å; E370-V431 CarbonylContact O-C 3.36Å; E370-V431 WeakPolarHBondContact O-CA 3.5Å; E370-R432 HydrophobicContact CB-CG 3.89Å; E370-R432 PolarHBondContact N-O 3.41Å; E370-R432 PolarHBondContact O-N 2.92Å; E370-R432 IonicContact OE2-CZ 3.69Å; E370-R432 VanDerWaalsContact OE2-CZ 3.24Å; E370-R432 IonicContact OE2-NE 2.74Å; E370-R432 PolarHBondContact OE2-NE 3.24Å; E370-R432 IonicContact OE2-NH2 3.29Å; E370-R432 PolarHBondContact OE2-NH2 3.33Å; E370-P434 HydrophobicContact CG-CG 4.32Å
371	Y	96.5	Very high	92.7	Very high	3 Å²	3	54.6 Å²	54.6	1%	0.012	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	144	-178.7	64.3	-79.9	0	0	0	113.1	L357 V373 E390 F391 S393 F395 Q430	L357-Y371 HydrophobicContact CB-CD2 4.26Å; L357-Y371 HydrophobicContact CB-CE2 4.4Å; L357-Y371 HydrophobicContact CD2-CD1 4.27Å; L357-Y371 HydrophobicContact CD2-CD2 3.87Å; L357-Y371 HydrophobicContact CD2-CG 3.64Å; Y371-V373 HydrophobicContact CD2-CG2 4.25Å; Y371-E390 WeakPolarHBondContact O-CA 3.28Å; Y371-F391 HydrophobicContact CD1-CB 4.17Å; Y371-F391 WeakPolarHBondContact CD1-O 3.26Å; Y371-F391 HydrophobicContact CD2-CB 4.39Å; Y371-F391 HydrophobicContact CE1-CB 3.59Å; Y371-F391 HydrophobicContact CE2-CB 3.85Å; Y371-F391 VanDerWaalsContact CZ-CB 3.42Å; Y371-F391 PolarHBondContact N-O 3.05Å; Y371-F391 PolarHBondContact O-N 3.49Å; Y371-S393 PolarHBondContact OH-OG 3.02Å; Y371-F395 AromaticContact CD1-CE2 3.98Å; Y371-F395 HydrophobicContact CD1-CE2 3.98Å; Y371-F395 HydrophobicContact CD1-CZ 4Å; Y371-F395 AromaticContact CE1-CE2 3.91Å; Y371-F395 HydrophobicContact CE1-CE2 3.91Å; Y371-F395 AromaticContact CE1-CZ 3.81Å; Y371-F395 HydrophobicContact CE1-CZ 3.81Å; Y371-Q430 CarbonylContact C-O 3.59Å; Y371-Q430 WeakPolarHBondContact CA-O 3.34Å; Y371-Q430 WeakPolarHBondContact CB-O 3.49Å
372	R	96.1	Very high	92.3	Very high	70 Å²	70	55.5 Å²	55.5	26%	0.264	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	135.1	171.6	175.7	-174.9	-90.3	-137.9	1.4	108.9	V388 R389 E390 F429 Q430	R372-V388 HydrophobicContact CG-CG1 3.98Å; R372-V388 VanDerWaalsContact CZ-CG1 3.44Å; R372-R389 CarbonylContact C-O 3.52Å; R372-R389 WeakPolarHBondContact CA-O 3.46Å; R372-E390 HydrophobicContact CB-CG 4.16Å; R372-E390 HydrophobicContact CG-CG 4.1Å; R372-E390 IonicContact CZ-OE1 3.61Å; R372-E390 IonicContact NE-OE1 2.72Å; R372-E390 PolarHBondContact NE-OE1 3.21Å; R372-E390 IonicContact NH2-OE1 3.35Å; R372-E390 PolarHBondContact NH2-OE1 2.8Å; R372-F429 CarbonylContact O-C 3.48Å; R372-F429 WeakPolarHBondContact O-CA 3.36Å; R372-Q430 HydrophobicContact CB-CB 4.19Å; R372-Q430 HydrophobicContact CB-CG 4.11Å; R372-Q430 HydrophobicContact CG-CG 4.39Å; R372-Q430 PolarHBondContact N-O 3.48Å; R372-Q430 PolarHBondContact O-N 3.33Å
373	V	97	Very high	92.1	Very high	7 Å²	7	59.2 Å²	59.2	4%	0.042	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	132.3	165.6	-178.1	0	0	0	0	108.3	L338 V355 Y371 V388 R389 F406	L338-V373 HydrophobicContact CD2-CG2 4.27Å; V355-V373 HydrophobicContact CG1-CG1 3.85Å; Y371-V373 HydrophobicContact CD2-CG2 4.25Å; V373-V388 CarbonylContact O-C 3.56Å; V373-R389 PolarHBondContact N-O 3.36Å; V373-R389 PolarHBondContact O-N 3.03Å; V373-F406 HydrophobicContact CB-CE2 4.13Å; V373-F406 HydrophobicContact CG1-CE2 3.67Å; V373-F406 HydrophobicContact CG1-CZ 3.96Å
374	E	96.3	Very high	92.1	Very high	22 Å²	22	62.7 Å²	62.7	10%	0.103	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	126.9	-170.8	173.2	175.5	-174.3	0	0	108.9	N386 I387 V388 L427 K428 Q430	E374-N386 HydrophobicContact CG-CB 4.04Å; E374-N386 PolarHBondContact OE1-ND2 3.22Å; E374-I387 CarbonylContact C-O 3.53Å; E374-I387 WeakPolarHBondContact CA-O 3.37Å; E374-V388 HydrophobicContact CB-CG2 4.25Å; E374-V388 HydrophobicContact CG-CG2 3.93Å; E374-L427 CarbonylContact O-C 3.49Å; E374-L427 WeakPolarHBondContact O-CA 3.43Å; E374-K428 HydrophobicContact CB-CB 4.25Å; E374-K428 PolarHBondContact N-O 2.95Å; E374-K428 PolarHBondContact O-N 3.47Å; E374-Q430 PolarHBondContact OE2-NE2 3.49Å
375	M	96.7	Very high	92.5	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.7	171.3	-176.2	168	70.9	0	0	109.2	L353 N386 I387 F406 F407 L412 Y417 I425 L427	L353-M375 HydrophobicContact CD2-SD 3.93Å; M375-N386 CarbonylContact O-C 3.44Å; M375-N386 WeakPolarHBondContact O-CA 3.42Å; M375-I387 HydrophobicContact CB-CB 4.36Å; M375-I387 HydrophobicContact CE-CD1 3.63Å; M375-I387 PolarHBondContact N-O 3.01Å; M375-I387 PolarHBondContact O-N 3.33Å; M375-F406 HydrophobicContact CB-CE1 3.78Å; M375-F406 HydrophobicContact CB-CZ 4.26Å; M375-F406 HydrophobicContact CE-CE1 4.29Å; M375-F406 HydrophobicContact SD-CE1 4.27Å; M375-F407 HydrophobicContact CE-CB 3.8Å; M375-F407 HydrophobicContact CE-CD1 3.78Å; M375-F407 HydrophobicContact CE-CD2 4.48Å; M375-F407 HydrophobicContact CE-CE1 4.44Å; M375-F407 HydrophobicContact CE-CG 3.77Å; M375-L412 HydrophobicContact CE-CD2 3.95Å; M375-L412 HydrophobicContact SD-CD2 4.04Å; M375-Y417 HydrophobicContact CE-CD1 3.96Å; M375-Y417 HydrophobicContact CE-CD2 4.22Å; M375-Y417 HydrophobicContact CE-CG 3.76Å; M375-Y417 HydrophobicContact CG-CD1 4.23Å; M375-I425 HydrophobicContact CG-CG2 3.91Å; M375-I425 HydrophobicContact SD-CG2 3.69Å; M375-L427 HydrophobicContact CB-CD2 3.63Å; M375-L427 HydrophobicContact CG-CD2 3.75Å; M375-L427 HydrophobicContact SD-CD2 4.14Å
376	V	96.3	Very high	92.9	Very high	31 Å²	31	56.6 Å²	56.6	19%	0.188	28%	0.281	C	S	.	.			trans	-82.8	133.6	-170.7	-176.2	0	0	0	0	110.5	Q378 N386 L426	V376-Q378 PolarHBondContact O-N 2.86Å; V376-Q378 VanDerWaalsContact O-N 3.13Å; V376-N386 WeakPolarHBondContact CA-OD1 3.22Å; V376-L426 HydrophobicContact CB-CB 4.21Å; V376-L426 HydrophobicContact CB-CD2 4.08Å; V376-L426 HydrophobicContact CB-CG 4.35Å; V376-L426 HydrophobicContact CG1-CD2 4.32Å; V376-L426 HydrophobicContact CG2-CD2 4.06Å; V376-L426 HydrophobicContact CG2-CG 4.21Å; V376-L426 PolarHBondContact N-O 2.89Å
377	H	95	Very high	93	Very high	14 Å²	14	55.7 Å²	55.7	7%	0.065	27%	0.269	C	S	.	.			trans	-77.2	94	176.1	178.7	-64.4	0	0	0	110	Q379 S380 R385 N386 E415 Y417	H377-Q379 PolarHBondContact O-N 3.2Å; H377-S380 VanDerWaalsContact CE1-CB 3.48Å; H377-S380 WeakPolarHBondContact CE1-CB 3.27Å; H377-S380 WeakPolarHBondContact ND1-CB 3.34Å; H377-S380 PolarHBondContact ND1-N 3.49Å; H377-S380 VanDerWaalsContact ND1-N 3.15Å; H377-S380 PolarHBondContact O-N 3.31Å; H377-S380 VanDerWaalsContact O-O 3.08Å; H377-R385 HydrophobicContact CB-CB 3.86Å; H377-N386 PolarHBondContact N-OD1 2.82Å; H377-E415 PolarHBondContact CD2-O 2.87Å; H377-Y417 HydrophobicContact CB-CD1 4.11Å; H377-Y417 HydrophobicContact CB-CE1 3.78Å
378	Q	91.5	Very high	93	Very high	55 Å²	55	58 Å²	58	26%	0.257	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-30.9	-171	-60.2	-88	36.2	0	0	114.4	V376 G416 Y417 N419 S424	V376-Q378 PolarHBondContact O-N 2.86Å; V376-Q378 VanDerWaalsContact O-N 3.13Å; Q378-G416 WeakPolarHBondContact CB-O 3.41Å; Q378-G416 PolarHBondContact N-O 3.19Å; Q378-Y417 VanDerWaalsContact CG-O 3.29Å; Q378-Y417 WeakPolarHBondContact CG-O 3.37Å; Q378-N419 HydrophobicContact CB-CB 4.05Å; Q378-N419 HydrophobicContact CG-CB 3.97Å; Q378-S424 PolarHBondContact NE2-O 3.45Å; Q378-S424 PolarHBondContact NE2-OG 2.87Å
379	Q	85.2	Confident	92.9	Very high	133 Å²	133	56.5 Å²	56.5	62%	0.621	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	2.1	-176.8	-61.7	178.3	6.9	0	0	114.6	H377 G416	H377-Q379 PolarHBondContact O-N 3.2Å; Q379-G416 PolarHBondContact N-O 2.85Å
380	S	87.4	Confident	92.8	Very high	38 Å²	38	60.1 Å²	60.1	27%	0.266	29%	0.292	S	S	.	.			trans	-136	149.2	-177.9	-173.7	0	0	0	0	111.1	H377 D382	H377-S380 VanDerWaalsContact CE1-CB 3.48Å; H377-S380 WeakPolarHBondContact CE1-CB 3.27Å; H377-S380 WeakPolarHBondContact ND1-CB 3.34Å; H377-S380 PolarHBondContact ND1-N 3.49Å; H377-S380 VanDerWaalsContact ND1-N 3.15Å; H377-S380 PolarHBondContact O-N 3.31Å; H377-S380 VanDerWaalsContact O-O 3.08Å; S380-D382 WeakPolarHBondContact OG-CB 3.42Å; S380-D382 PolarHBondContact OG-N 3.39Å; S380-D382 VanDerWaalsContact OG-N 3.09Å
381	R	84.6	Confident	92.7	Very high	253 Å²	253	59.8 Å²	59.8	96%	0.955	29%	0.29	S	S	*	.	S	Bend	trans	-92.9	-5.5	169.3	-65.9	-173.4	177.9	-170.3	-0.1	113.1	P383	R381-P383 WeakPolarHBondContact O-CD 3.32Å
382	D	87.1	Confident	92.6	Very high	65 Å²	65	60.5 Å²	60.5	35%	0.348	30%	0.296	S	S	.	.			trans	-79	112.8	175.5	170.4	22.8	0	0	0	110.8	S380 S384 R385	S380-D382 WeakPolarHBondContact OG-CB 3.42Å; S380-D382 PolarHBondContact OG-N 3.39Å; S380-D382 VanDerWaalsContact OG-N 3.09Å; D382-S384 VanDerWaalsContact CG-OG 3.24Å; D382-S384 PolarHBondContact O-N 3.3Å; D382-S384 WeakPolarHBondContact OD1-CB 2.9Å; D382-S384 PolarHBondContact OD1-N 3.01Å; D382-S384 PolarHBondContact OD1-OG 2.93Å; D382-S384 PolarHBondContact OD2-OG 3.31Å; D382-R385 PolarHBondContact O-N 3.46Å
383	P	87.6	Confident	92.6	Very high	89 Å²	89	57.2 Å²	57.2	58%	0.578	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-70.5	-11.4	179.3	31.8	-36.4	0	0	0	113.4	R381 R385 N386	R381-P383 WeakPolarHBondContact O-CD 3.32Å; P383-R385 PolarHBondContact O-N 3.11Å; P383-N386 WeakPolarHBondContact O-CB 3.48Å; P383-N386 PolarHBondContact O-N 2.8Å
384	S	89.6	Confident	92.5	Very high	95 Å²	95	62 Å²	62	66%	0.664	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-62.2	-23.4	175.1	91.5	0	0	0	0	112.5	D382	D382-S384 VanDerWaalsContact CG-OG 3.24Å; D382-S384 PolarHBondContact O-N 3.3Å; D382-S384 WeakPolarHBondContact OD1-CB 2.9Å; D382-S384 PolarHBondContact OD1-N 3.01Å; D382-S384 PolarHBondContact OD1-OG 2.93Å; D382-S384 PolarHBondContact OD2-OG 3.31Å
385	R	92.9	Very high	92.5	Very high	110 Å²	110	60.9 Å²	60.9	42%	0.415	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-84.2	-3.2	175.9	-58.5	-168.2	-180	-149.9	-2.6	114.3	H377 D382 P383 Y417	H377-R385 HydrophobicContact CB-CB 3.86Å; D382-R385 PolarHBondContact O-N 3.46Å; P383-R385 PolarHBondContact O-N 3.11Å; R385-Y417 WeakPolarHBondContact O-CE1 3.42Å; R385-Y417 PolarHBondContact O-OH 3.38Å; R385-Y417 VanDerWaalsContact O-OH 3.04Å
386	N	94.8	Very high	92.3	Very high	22 Å²	22	65.3 Å²	65.3	12%	0.118	32%	0.321	C	S	.	.	S	Bend	trans	-75.1	135	178.9	-68.1	-7.7	0	0	0	110.7	E374 M375 V376 H377 P383 V388	E374-N386 HydrophobicContact CG-CB 4.04Å; E374-N386 PolarHBondContact OE1-ND2 3.22Å; M375-N386 CarbonylContact O-C 3.44Å; M375-N386 WeakPolarHBondContact O-CA 3.42Å; V376-N386 WeakPolarHBondContact CA-OD1 3.22Å; H377-N386 PolarHBondContact N-OD1 2.82Å; P383-N386 WeakPolarHBondContact O-CB 3.48Å; P383-N386 PolarHBondContact O-N 2.8Å; N386-V388 HydrophobicContact CB-CG2 4.38Å; N386-V388 PolarHBondContact O-N 2.89Å; N386-V388 VanDerWaalsContact O-N 3.07Å
387	I	94.7	Very high	92.2	Very high	30 Å²	30	66.6 Å²	66.6	15%	0.154	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	98.1	177.2	-67.4	162.9	0	0	0	108.7	E374 M375 F406 F407 Y417	E374-I387 CarbonylContact C-O 3.53Å; E374-I387 WeakPolarHBondContact CA-O 3.37Å; M375-I387 HydrophobicContact CB-CB 4.36Å; M375-I387 HydrophobicContact CE-CD1 3.63Å; M375-I387 PolarHBondContact N-O 3.01Å; M375-I387 PolarHBondContact O-N 3.33Å; I387-F406 HydrophobicContact CG2-CE1 4.09Å; I387-F406 HydrophobicContact CG2-CZ 4.18Å; I387-F407 HydrophobicContact CD1-CD2 3.39Å; I387-F407 HydrophobicContact CD1-CE2 3.4Å; I387-F407 VanDerWaalsContact CD1-CE2 3.4Å; I387-F407 HydrophobicContact CD1-CG 3.98Å; I387-F407 HydrophobicContact CD1-CZ 3.98Å; I387-Y417 HydrophobicContact CD1-CD1 4.2Å; I387-Y417 HydrophobicContact CD1-CD2 4.12Å; I387-Y417 HydrophobicContact CD1-CE1 3.63Å; I387-Y417 HydrophobicContact CD1-CE2 3.55Å; I387-Y417 HydrophobicContact CD1-CG 4.43Å; I387-Y417 HydrophobicContact CG1-CE1 3.84Å; I387-Y417 HydrophobicContact CG1-CE2 4.43Å
388	V	94.7	Very high	92.1	Very high	54 Å²	54	68.1 Å²	68.1	33%	0.327	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	138.9	-178.7	174.6	0	0	0	0	110.9	R372 V373 E374 N386 E390	R372-V388 HydrophobicContact CG-CG1 3.98Å; R372-V388 VanDerWaalsContact CZ-CG1 3.44Å; V373-V388 CarbonylContact O-C 3.56Å; E374-V388 HydrophobicContact CB-CG2 4.25Å; E374-V388 HydrophobicContact CG-CG2 3.93Å; N386-V388 HydrophobicContact CB-CG2 4.38Å; N386-V388 PolarHBondContact O-N 2.89Å; N386-V388 VanDerWaalsContact O-N 3.07Å; V388-E390 HydrophobicContact CG1-CG 4.14Å
389	R	94.7	Very high	92.1	Very high	54 Å²	54	66.4 Å²	66.4	20%	0.204	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	130.4	171.3	-74.4	-153.2	-176.8	83.5	-11.5	111.3	R372 V373 F391 Y403 R405 F406	R372-R389 CarbonylContact C-O 3.52Å; R372-R389 WeakPolarHBondContact CA-O 3.46Å; V373-R389 PolarHBondContact N-O 3.36Å; V373-R389 PolarHBondContact O-N 3.03Å; R389-F391 HydrophobicContact CB-CD2 4.28Å; R389-F391 HydrophobicContact CB-CE2 3.91Å; R389-Y403 HydrophobicContact CB-CE2 4.12Å; R389-Y403 HydrophobicContact CG-CE2 4.31Å; R389-R405 PolarHBondContact NH2-O 3.05Å; R389-F406 HydrophobicContact CG-CE2 4.47Å; R389-F406 VanDerWaalsContact CZ-O 3.22Å; R389-F406 VanDerWaalsContact NH1-CD2 3.32Å; R389-F406 PolarHBondContact NH1-O 2.89Å; R389-F406 PolarHBondContact NH2-O 2.81Å
390	E	93.9	Very high	92.5	Very high	80 Å²	80	60.7 Å²	60.7	37%	0.374	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	125.7	-173.7	-60.9	-167.9	147.2	0	0	112.7	Y371 R372 V388	Y371-E390 WeakPolarHBondContact O-CA 3.28Å; R372-E390 HydrophobicContact CB-CG 4.16Å; R372-E390 HydrophobicContact CG-CG 4.1Å; R372-E390 IonicContact CZ-OE1 3.61Å; R372-E390 IonicContact NE-OE1 2.72Å; R372-E390 PolarHBondContact NE-OE1 3.21Å; R372-E390 IonicContact NH2-OE1 3.35Å; R372-E390 PolarHBondContact NH2-OE1 2.8Å; V388-E390 HydrophobicContact CG1-CG 4.14Å
391	F	93.4	Very high	92.9	Very high	30 Å²	30	60.9 Å²	60.9	13%	0.132	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	157.6	-167.5	-77.8	-80.5	0	0	0	112.6	E370 Y371 R389 Y403 M1350	E370-F391 CarbonylContact C-O 3.59Å; E370-F391 WeakPolarHBondContact CA-O 3.45Å; Y371-F391 HydrophobicContact CD1-CB 4.17Å; Y371-F391 WeakPolarHBondContact CD1-O 3.26Å; Y371-F391 HydrophobicContact CD2-CB 4.39Å; Y371-F391 HydrophobicContact CE1-CB 3.59Å; Y371-F391 HydrophobicContact CE2-CB 3.85Å; Y371-F391 VanDerWaalsContact CZ-CB 3.42Å; Y371-F391 PolarHBondContact N-O 3.05Å; Y371-F391 PolarHBondContact O-N 3.49Å; R389-F391 HydrophobicContact CB-CD2 4.28Å; R389-F391 HydrophobicContact CB-CE2 3.91Å; F391-Y403 AromaticContact CD2-CE2 3.79Å; F391-Y403 HydrophobicContact CD2-CE2 3.79Å; F391-Y403 AromaticContact CE2-CE2 3.61Å; F391-Y403 HydrophobicContact CE2-CE2 3.61Å; F391-Y403 AromaticContact CE2-CZ 3.78Å; F391-Y403 WeakPolarHBondContact CE2-OH 3.44Å; F391-Y403 HydrophobicContact CZ-CE2 4.16Å; F391-Y403 AromaticContact CZ-CZ 3.88Å; F391-Y403 WeakPolarHBondContact CZ-OH 3.44Å; F391-M1350 VanDerWaalsContact CD1-C 3.48Å
392	A	95.3	Very high	93.3	Very high	18 Å²	18	48.9 Å²	48.9	15%	0.149	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	110.8	174.6	0	0	0	0	0	110.4	Y369 E370 M1350	Y369-A392 WeakPolarHBondContact O-CA 3.45Å; E370-A392 HydrophobicContact CG-CB 3.76Å; A392-M1350 PolarHBondContact N-O 2.99Å
393	S	96.1	Very high	93.6	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.007	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	157.1	-172.9	-59.9	0	0	0	0	110.9	K368 Y369 Y371 F395	K368-S393 WeakPolarHBondContact CA-O 3.36Å; Y369-S393 PolarHBondContact N-O 2.93Å; Y369-S393 PolarHBondContact O-N 3.23Å; Y371-S393 PolarHBondContact OH-OG 3.02Å; S393-F395 WeakPolarHBondContact O-CD2 3.49Å
394	H	94.9	Very high	93.8	Very high	107 Å²	107	45.8 Å²	45.8	50%	0.495	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	129.9	171	-61.3	80.8	0	0	0	108	S367 E399 W401	S367-H394 CarbonylContact O-C 3.53Å; S367-H394 WeakPolarHBondContact O-CA 3.14Å; H394-E399 VanDerWaalsContact O-OE2 3.05Å; H394-W401 PolarHBondContact O-NE1 2.97Å
395	F	95.5	Very high	94	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	127.6	179.2	-68.6	-102.7	0	0	0	110.1	W336 L357 L359 S367 Y369 Y371 S393 E399 W401	W336-F395 HydrophobicContact CH2-CB 4.27Å; W336-F395 HydrophobicContact CH2-CD1 4.25Å; W336-F395 AromaticContact CH2-CD2 3.93Å; W336-F395 HydrophobicContact CH2-CD2 3.93Å; W336-F395 HydrophobicContact CH2-CE2 4.27Å; W336-F395 AromaticContact CH2-CG 3.92Å; W336-F395 HydrophobicContact CH2-CG 3.92Å; W336-F395 AromaticContact CZ3-CD1 3.7Å; W336-F395 HydrophobicContact CZ3-CD1 3.7Å; W336-F395 HydrophobicContact CZ3-CD2 4.06Å; W336-F395 AromaticContact CZ3-CE1 3.76Å; W336-F395 HydrophobicContact CZ3-CE1 3.76Å; W336-F395 HydrophobicContact CZ3-CE2 4.1Å; W336-F395 AromaticContact CZ3-CG 3.86Å; W336-F395 HydrophobicContact CZ3-CG 3.86Å; W336-F395 AromaticContact CZ3-CZ 3.96Å; W336-F395 HydrophobicContact CZ3-CZ 3.96Å; L357-F395 HydrophobicContact CD2-CZ 4.09Å; L357-F395 HydrophobicContact CG-CE1 4.47Å; L357-F395 HydrophobicContact CG-CZ 4.44Å; L359-F395 HydrophobicContact CB-CB 4Å; L359-F395 HydrophobicContact CB-CD1 3.98Å; L359-F395 HydrophobicContact CB-CG 4.34Å; L359-F395 HydrophobicContact CD2-CB 3.75Å; S367-F395 PolarHBondContact N-O 3.06Å; S367-F395 PolarHBondContact O-N 3.28Å; Y369-F395 HydrophobicContact CD2-CB 4.19Å; Y369-F395 AromaticContact CD2-CD2 3.99Å; Y369-F395 HydrophobicContact CD2-CD2 3.99Å; Y369-F395 HydrophobicContact CD2-CG 4.46Å; Y369-F395 HydrophobicContact CE2-CB 4.5Å; Y371-F395 AromaticContact CD1-CE2 3.98Å; Y371-F395 HydrophobicContact CD1-CE2 3.98Å; Y371-F395 HydrophobicContact CD1-CZ 4Å; Y371-F395 AromaticContact CE1-CE2 3.91Å; Y371-F395 HydrophobicContact CE1-CE2 3.91Å; Y371-F395 AromaticContact CE1-CZ 3.81Å; Y371-F395 HydrophobicContact CE1-CZ 3.81Å; S393-F395 WeakPolarHBondContact O-CD2 3.49Å; F395-E399 WeakPolarHBondContact CA-OE2 3.27Å; F395-W401 AromaticContact CD1-CD1 3.64Å; F395-W401 HydrophobicContact CE1-CB 3.96Å; F395-W401 AromaticContact CE1-CD1 3.57Å; F395-W401 HydrophobicContact CE1-CG 4.15Å; F395-W401 HydrophobicContact CZ-CB 3.87Å; F395-W401 AromaticContact CZ-CD1 3.94Å; F395-W401 HydrophobicContact CZ-CG 4.23Å
396	E	93.8	Very high	94.2	Very high	92 Å²	92	42.2 Å²	42.2	43%	0.43	21%	0.213	S	C	.	.			trans	-93.4	163.8	154	-64.2	172	-173.7	0	0	110.1	A366 G398 E399	A366-E396 HydrophobicContact CB-CG 3.51Å; E396-G398 PolarHBondContact O-N 2.75Å; E396-E399 HydrophobicContact CB-CG 3.93Å; E396-E399 PolarHBondContact N-OE2 3.12Å; E396-E399 WeakPolarHBondContact O-CB 3.26Å; E396-E399 PolarHBondContact O-N 3.44Å
397	V	93.5	Very high	94.2	Very high	58 Å²	58	42 Å²	42	35%	0.352	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	120.9	176.8	179	0	0	0	0	110.4	L359 L363	L359-V397 WeakPolarHBondContact O-CA 3.45Å; L363-V397 WeakPolarHBondContact O-CG2 3.5Å
398	G	92.3	Very high	94.3	Very high	47 Å²	47	43.2 Å²	43.2	49%	0.485	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.1	-1.7	-173.3	0	0	0	0	0	114.7	L359 E396	L359-G398 PolarHBondContact O-N 2.73Å; E396-G398 PolarHBondContact O-N 2.75Å
399	E	92.1	Very high	94.3	Very high	19 Å²	19	41.3 Å²	41.3	9%	0.089	20%	0.201	C	C	.	.			trans	-78	142.3	172.9	-73.2	-169.6	154.2	0	0	112.8	E358 L359 H394 F395 E396 W401 R1354	E358-E399 WeakPolarHBondContact CA-O 3.44Å; L359-E399 PolarHBondContact N-O 3.04Å; H394-E399 VanDerWaalsContact O-OE2 3.05Å; F395-E399 WeakPolarHBondContact CA-OE2 3.27Å; E396-E399 HydrophobicContact CB-CG 3.93Å; E396-E399 PolarHBondContact N-OE2 3.12Å; E396-E399 WeakPolarHBondContact O-CB 3.26Å; E396-E399 PolarHBondContact O-N 3.44Å; E399-W401 PolarHBondContact OE2-NE1 3.21Å; E399-R1354 IonicContact OE1-CZ 3.84Å; E399-R1354 IonicContact OE1-NH1 2.7Å; E399-R1354 PolarHBondContact OE1-NH1 3.05Å; E399-R1354 IonicContact OE1-NH2 3.75Å; E399-R1354 PolarHBondContact OE1-NH2 3.04Å; E399-R1354 IonicContact OE2-NH1 2.73Å
400	C	93.7	Very high	94.3	Very high	13 Å²	13	43.1 Å²	43.1	9%	0.088	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	125.3	179.8	-65.8	0	0	0	0	109.9	F356 L357 E358 D1355	F356-C400 HydrophobicContact CB-CB 4.45Å; L357-C400 CarbonylContact O-C 3.57Å; L357-C400 VanDerWaalsContact O-CA 3.31Å; L357-C400 WeakPolarHBondContact O-CA 3.42Å; E358-C400 VanDerWaalsContact CG-SG 3.58Å; C400-D1355 HydrophobicContact CB-CB 3.66Å; C400-D1355 PolarHBondContact O-N 3.39Å
401	W	95.6	Very high	94.4	Very high	41 Å²	41	39.7 Å²	39.7	16%	0.155	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	139	-179.8	-68.2	95.8	0	0	0	111.4	L357 H394 F395 E399 G1352 D1353 R1354	L357-W401 PolarHBondContact N-O 3.41Å; L357-W401 PolarHBondContact O-N 3.16Å; H394-W401 PolarHBondContact O-NE1 2.97Å; F395-W401 AromaticContact CD1-CD1 3.64Å; F395-W401 HydrophobicContact CE1-CB 3.96Å; F395-W401 AromaticContact CE1-CD1 3.57Å; F395-W401 HydrophobicContact CE1-CG 4.15Å; F395-W401 HydrophobicContact CZ-CB 3.87Å; F395-W401 AromaticContact CZ-CD1 3.94Å; F395-W401 HydrophobicContact CZ-CG 4.23Å; E399-W401 PolarHBondContact OE2-NE1 3.21Å; W401-G1352 VanDerWaalsContact CE3-O 3.22Å; W401-G1352 WeakPolarHBondContact CZ3-O 3.41Å; W401-D1353 CarbonylContact C-O 3.52Å; W401-D1353 WeakPolarHBondContact CA-O 3.13Å; W401-R1354 HydrophobicContact CD2-CB 4.32Å; W401-R1354 HydrophobicContact CE3-CB 3.87Å; W401-R1354 HydrophobicContact CH2-CB 4.04Å; W401-R1354 HydrophobicContact CH2-CG 4.39Å; W401-R1354 HydrophobicContact CZ2-CB 4.45Å; W401-R1354 HydrophobicContact CZ2-CG 4.35Å; W401-R1354 HydrophobicContact CZ3-CB 3.72Å; W401-R1354 HydrophobicContact CZ3-CG 4.47Å
402	G	93.3	Very high	94.4	Very high	2 Å²	2	38.4 Å²	38.4	2%	0.021	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	165.8	-119.7	-177.9	0	0	0	0	0	113.9	V355 G1352 D1353	V355-G402 CarbonylContact O-C 3.58Å; V355-G402 WeakPolarHBondContact O-CA 3.32Å; G402-G1352 CarbonylContact O-C 3.58Å; G402-G1352 WeakPolarHBondContact O-CA 3.34Å; G402-D1353 PolarHBondContact N-O 2.95Å; G402-D1353 PolarHBondContact O-N 3.13Å
403	Y	92.4	Very high	94.3	Very high	48 Å²	48	40.7 Å²	40.7	19%	0.188	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	123.9	-165.1	-87.3	-75.1	0	0	0	114.1	S354 V355 R389 F391 F406	S354-Y403 CarbonylContact C-O 3.54Å; S354-Y403 WeakPolarHBondContact CA-O 3.47Å; S354-Y403 VanDerWaalsContact CB-O 3.24Å; S354-Y403 WeakPolarHBondContact CB-O 3.43Å; V355-Y403 PolarHBondContact N-O 2.89Å; V355-Y403 PolarHBondContact O-N 3.48Å; R389-Y403 HydrophobicContact CB-CE2 4.12Å; R389-Y403 HydrophobicContact CG-CE2 4.31Å; F391-Y403 AromaticContact CD2-CE2 3.79Å; F391-Y403 HydrophobicContact CD2-CE2 3.79Å; F391-Y403 AromaticContact CE2-CE2 3.61Å; F391-Y403 HydrophobicContact CE2-CE2 3.61Å; F391-Y403 AromaticContact CE2-CZ 3.78Å; F391-Y403 WeakPolarHBondContact CE2-OH 3.44Å; F391-Y403 HydrophobicContact CZ-CE2 4.16Å; F391-Y403 AromaticContact CZ-CZ 3.88Å; F391-Y403 WeakPolarHBondContact CZ-OH 3.44Å; Y403-F406 HydrophobicContact CD2-CD2 4.27Å; Y403-F406 HydrophobicContact CG-CD2 4.31Å
404	N	93	Very high	94	Very high	40 Å²	40	46.6 Å²	46.6	21%	0.214	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	-46	161.7	-68.3	-79.3	0	0	0	111.1	V348 S354 F406 D1353	V348-N404 HydrophobicContact CG2-CB 3.88Å; V348-N404 WeakPolarHBondContact CG2-O 3.17Å; S354-N404 WeakPolarHBondContact CB-O 3.31Å; S354-N404 PolarHBondContact OG-O 3.39Å; N404-F406 PolarHBondContact O-N 3.31Å; N404-D1353 WeakPolarHBondContact CB-OD2 3.4Å; N404-D1353 PolarHBondContact N-OD2 2.82Å; N404-D1353 WeakPolarHBondContact ND2-CB 3.3Å; N404-D1353 VanDerWaalsContact ND2-CG 3.31Å; N404-D1353 PolarHBondContact ND2-OD2 2.9Å
405	R	94.3	Very high	93.8	Very high	129 Å²	129	44.7 Å²	44.7	49%	0.487	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	61.4	-178.4	-63.6	179.9	-172.6	-105.9	2.8	112.2	V348 Y352 R389	V348-R405 HydrophobicContact CG1-CG 3.92Å; Y352-R405 HydrophobicContact CD1-CB 3.73Å; Y352-R405 HydrophobicContact CD1-CG 4.04Å; Y352-R405 HydrophobicContact CD2-CG 4.21Å; Y352-R405 HydrophobicContact CE1-CB 3.99Å; Y352-R405 HydrophobicContact CE1-CG 4.17Å; Y352-R405 HydrophobicContact CE2-CG 4.35Å; Y352-R405 VanDerWaalsContact CE2-NH1 3.28Å; Y352-R405 HydrophobicContact CG-CB 4.14Å; Y352-R405 HydrophobicContact CG-CG 4.05Å; Y352-R405 PolarHBondContact OH-NH1 3.03Å; R389-R405 PolarHBondContact NH2-O 3.05Å
406	F	95.4	Very high	93.7	Very high	1 Å²	1	44.7 Å²	44.7	0%	0.004	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	-51	-177.9	-170.8	-86.9	0	0	0	111.6	L353 V355 V373 M375 I387 R389 Y403 N404	L353-F406 HydrophobicContact CD2-CD1 4.28Å; L353-F406 WeakPolarHBondContact O-CA 3.44Å; L353-F406 WeakPolarHBondContact O-CB 3.39Å; L353-F406 PolarHBondContact O-N 3.42Å; V355-F406 HydrophobicContact CB-CB 4.33Å; V355-F406 HydrophobicContact CB-CD2 4.01Å; V355-F406 HydrophobicContact CB-CG 4.14Å; V355-F406 HydrophobicContact CG2-CB 4.01Å; V355-F406 HydrophobicContact CG2-CD1 4.13Å; V355-F406 HydrophobicContact CG2-CD2 4.16Å; V355-F406 HydrophobicContact CG2-CG 3.81Å; V373-F406 HydrophobicContact CB-CE2 4.13Å; V373-F406 HydrophobicContact CG1-CE2 3.67Å; V373-F406 HydrophobicContact CG1-CZ 3.96Å; M375-F406 HydrophobicContact CB-CE1 3.78Å; M375-F406 HydrophobicContact CB-CZ 4.26Å; M375-F406 HydrophobicContact CE-CE1 4.29Å; M375-F406 HydrophobicContact SD-CE1 4.27Å; I387-F406 HydrophobicContact CG2-CE1 4.09Å; I387-F406 HydrophobicContact CG2-CZ 4.18Å; R389-F406 HydrophobicContact CG-CE2 4.47Å; R389-F406 VanDerWaalsContact CZ-O 3.22Å; R389-F406 VanDerWaalsContact NH1-CD2 3.32Å; R389-F406 PolarHBondContact NH1-O 2.89Å; R389-F406 PolarHBondContact NH2-O 2.81Å; Y403-F406 HydrophobicContact CD2-CD2 4.27Å; Y403-F406 HydrophobicContact CG-CD2 4.31Å; N404-F406 PolarHBondContact O-N 3.31Å
407	F	96	Very high	93.8	Very high	17 Å²	17	41.5 Å²	41.5	8%	0.075	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	156.7	172.9	-167.8	-114	0	0	0	110.6	Y352 L353 M375 I387 L411 L412 E415 Y417	Y352-F407 CarbonylContact C-O 3.56Å; Y352-F407 VanDerWaalsContact CA-O 3.23Å; Y352-F407 WeakPolarHBondContact CA-O 3.3Å; L353-F407 PolarHBondContact N-O 3.16Å; M375-F407 HydrophobicContact CE-CB 3.8Å; M375-F407 HydrophobicContact CE-CD1 3.78Å; M375-F407 HydrophobicContact CE-CD2 4.48Å; M375-F407 HydrophobicContact CE-CE1 4.44Å; M375-F407 HydrophobicContact CE-CG 3.77Å; I387-F407 HydrophobicContact CD1-CD2 3.39Å; I387-F407 HydrophobicContact CD1-CE2 3.4Å; I387-F407 VanDerWaalsContact CD1-CE2 3.4Å; I387-F407 HydrophobicContact CD1-CG 3.98Å; I387-F407 HydrophobicContact CD1-CZ 3.98Å; F407-L411 HydrophobicContact CD1-CB 4.42Å; F407-L411 HydrophobicContact CE1-CB 3.46Å; F407-L411 VanDerWaalsContact CE1-CB 3.46Å; F407-L411 HydrophobicContact CE1-CD1 4.32Å; F407-L411 HydrophobicContact CE2-CD1 4.19Å; F407-L411 HydrophobicContact CZ-CB 3.63Å; F407-L411 HydrophobicContact CZ-CD1 3.82Å; F407-L411 HydrophobicContact CZ-CG 4.42Å; F407-L412 HydrophobicContact CD1-CD2 3.64Å; F407-L412 HydrophobicContact CD1-CG 4.02Å; F407-L412 HydrophobicContact CE1-CD2 4.15Å; F407-L412 HydrophobicContact CE1-CG 4.4Å; F407-E415 HydrophobicContact CZ-CB 4.39Å; F407-E415 HydrophobicContact CZ-CG 4.29Å; F407-Y417 AromaticContact CE1-CD2 3.75Å; F407-Y417 HydrophobicContact CE1-CD2 3.75Å; F407-Y417 HydrophobicContact CE1-CE2 4.11Å; F407-Y417 HydrophobicContact CE2-CE2 4.34Å; F407-Y417 AromaticContact CZ-CD2 3.87Å; F407-Y417 HydrophobicContact CZ-CD2 3.87Å; F407-Y417 AromaticContact CZ-CE2 3.72Å; F407-Y417 HydrophobicContact CZ-CE2 3.72Å
408	R	96.1	Very high	93.8	Very high	56 Å²	56	39.3 Å²	39.3	21%	0.211	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	142	179.7	-42.4	-156.5	-45.9	-131.5	3.9	111.5	Y352 D410 L411	Y352-R408 HydrophobicContact CD1-CG 4.22Å; Y352-R408 HydrophobicContact CE1-CG 3.8Å; R408-D410 VanDerWaalsContact C-N 3.34Å; R408-D410 WeakPolarHBondContact CB-OD1 3.34Å; R408-D410 IonicContact CZ-OD1 2.75Å; R408-D410 IonicContact CZ-OD2 3.39Å; R408-D410 IonicContact NE-OD1 2.96Å; R408-D410 PolarHBondContact NE-OD1 2.99Å; R408-D410 IonicContact NE-OD2 3.51Å; R408-D410 IonicContact NH2-OD1 2.71Å; R408-D410 IonicContact NH2-OD2 3.31Å; R408-D410 PolarHBondContact NH2-OD2 3.48Å; R408-D410 PolarHBondContact O-N 3.22Å; R408-L411 HydrophobicContact CB-CD1 3.92Å; R408-L411 HydrophobicContact CB-CG 4.2Å; R408-L411 HydrophobicContact CG-CD1 3.9Å
409	L	95.7	Very high	93.9	Very high	14 Å²	14	39 Å²	39	7%	0.073	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-16.6	-174.7	-65.6	176.4	0	0	0	114.4	Y314 P342 N351 Y352 L353 L412	Y314-L409 VanDerWaalsContact OH-CD2 3.31Å; Y314-L409 WeakPolarHBondContact OH-CD2 3.47Å; P342-L409 WeakPolarHBondContact O-CD2 3.45Å; N351-L409 PolarHBondContact O-N 3.4Å; Y352-L409 VanDerWaalsContact C-CG 3.48Å; L353-L409 HydrophobicContact CB-CD2 3.86Å; L353-L409 VanDerWaalsContact N-CD2 3.32Å; L409-L412 HydrophobicContact CD2-CD1 3.87Å
410	D	94	Very high	93.7	Very high	92 Å²	92	41.8 Å²	41.8	49%	0.492	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-28.3	177.4	64.5	-48.7	0	0	0	112.5	R408	R408-D410 VanDerWaalsContact C-N 3.34Å; R408-D410 WeakPolarHBondContact CB-OD1 3.34Å; R408-D410 IonicContact CZ-OD1 2.75Å; R408-D410 IonicContact CZ-OD2 3.39Å; R408-D410 IonicContact NE-OD1 2.96Å; R408-D410 PolarHBondContact NE-OD1 2.99Å; R408-D410 IonicContact NE-OD2 3.51Å; R408-D410 IonicContact NH2-OD1 2.71Å; R408-D410 IonicContact NH2-OD2 3.31Å; R408-D410 PolarHBondContact NH2-OD2 3.48Å; R408-D410 PolarHBondContact O-N 3.22Å
411	L	95.2	Very high	93.6	Very high	8 Å²	8	50 Å²	50	4%	0.042	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-20.6	-176.6	-67.5	173.9	0	0	0	114.3	F407 R408 V413 N414 E415 L1341	F407-L411 HydrophobicContact CD1-CB 4.42Å; F407-L411 HydrophobicContact CE1-CB 3.46Å; F407-L411 VanDerWaalsContact CE1-CB 3.46Å; F407-L411 HydrophobicContact CE1-CD1 4.32Å; F407-L411 HydrophobicContact CE2-CD1 4.19Å; F407-L411 HydrophobicContact CZ-CB 3.63Å; F407-L411 HydrophobicContact CZ-CD1 3.82Å; F407-L411 HydrophobicContact CZ-CG 4.42Å; R408-L411 HydrophobicContact CB-CD1 3.92Å; R408-L411 HydrophobicContact CB-CG 4.2Å; R408-L411 HydrophobicContact CG-CD1 3.9Å; L411-V413 VanDerWaalsContact C-N 3.26Å; L411-V413 PolarHBondContact O-N 3.38Å; L411-V413 VanDerWaalsContact O-N 3.12Å; L411-N414 PolarHBondContact O-N 3.29Å; L411-N414 VanDerWaalsContact O-N 3.11Å; L411-E415 HydrophobicContact CB-CG 3.91Å; L411-E415 HydrophobicContact CD2-CG 4.15Å; L411-E415 HydrophobicContact CG-CG 4.5Å; L411-E415 WeakPolarHBondContact O-CB 2.94Å; L411-E415 WeakPolarHBondContact O-CG 2.96Å; L411-E415 PolarHBondContact O-N 3.47Å; L411-L1341 HydrophobicContact CD1-CD1 3.81Å; L411-L1341 HydrophobicContact CD1-CD2 4.15Å; L411-L1341 HydrophobicContact CD1-CG 4.4Å; L411-L1341 HydrophobicContact CD2-CD1 3.84Å; L411-L1341 HydrophobicContact CD2-CD2 3.94Å; L411-L1341 HydrophobicContact CG-CD1 4.47Å
412	L	95	Very high	93.5	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.016	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-37.6	-168.7	-77.4	167.9	0	0	0	114.5	Y314 M375 F407 L409 Y417 L418 I425	Y314-L412 HydrophobicContact CE1-CD1 4.11Å; Y314-L412 WeakPolarHBondContact OH-CD1 3.5Å; M375-L412 HydrophobicContact CE-CD2 3.95Å; M375-L412 HydrophobicContact SD-CD2 4.04Å; F407-L412 HydrophobicContact CD1-CD2 3.64Å; F407-L412 HydrophobicContact CD1-CG 4.02Å; F407-L412 HydrophobicContact CE1-CD2 4.15Å; F407-L412 HydrophobicContact CE1-CG 4.4Å; L409-L412 HydrophobicContact CD2-CD1 3.87Å; L412-Y417 PolarHBondContact O-N 3.43Å; L412-Y417 VanDerWaalsContact O-N 3.1Å; L412-L418 HydrophobicContact CB-CB 4.06Å; L412-L418 PolarHBondContact O-N 3.3Å; L412-I425 HydrophobicContact CD1-CD1 3.88Å; L412-I425 HydrophobicContact CD2-CD1 3.95Å; L412-I425 HydrophobicContact CG-CD1 4.47Å
413	V	91.7	Very high	93.6	Very high	67 Å²	67	52.2 Å²	52.2	41%	0.406	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-50.3	176.5	176.4	0	0	0	0	111	L411 E415 G416 L418	L411-V413 VanDerWaalsContact C-N 3.26Å; L411-V413 PolarHBondContact O-N 3.38Å; L411-V413 VanDerWaalsContact O-N 3.12Å; V413-E415 PolarHBondContact O-N 3.06Å; V413-G416 PolarHBondContact O-N 3.29Å; V413-L418 HydrophobicContact CG2-CD2 3.83Å; V413-L418 HydrophobicContact CG2-CG 4.42Å
414	N	89.8	Confident	93.8	Very high	125 Å²	125	50.3 Å²	50.3	67%	0.668	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-36.9	-171.1	-61.1	-3.1	0	0	0	112.4	L411 G416	L411-N414 PolarHBondContact O-N 3.29Å; L411-N414 VanDerWaalsContact O-N 3.11Å; N414-G416 VanDerWaalsContact C-N 3.33Å
415	E	92.4	Very high	94	Very high	66 Å²	66	48.4 Å²	48.4	31%	0.308	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	12.5	178.9	-52.5	-63.8	152.6	0	0	112.6	H377 F407 L411 V413 Y417 L1341	H377-E415 PolarHBondContact CD2-O 2.87Å; F407-E415 HydrophobicContact CZ-CB 4.39Å; F407-E415 HydrophobicContact CZ-CG 4.29Å; L411-E415 HydrophobicContact CB-CG 3.91Å; L411-E415 HydrophobicContact CD2-CG 4.15Å; L411-E415 HydrophobicContact CG-CG 4.5Å; L411-E415 WeakPolarHBondContact O-CB 2.94Å; L411-E415 WeakPolarHBondContact O-CG 2.96Å; L411-E415 PolarHBondContact O-N 3.47Å; V413-E415 PolarHBondContact O-N 3.06Å; E415-Y417 HydrophobicContact CB-CD2 3.71Å; E415-Y417 HydrophobicContact CB-CE2 3.5Å; E415-Y417 WeakPolarHBondContact O-CD2 3.49Å; E415-Y417 WeakPolarHBondContact O-CE2 3.38Å; E415-Y417 PolarHBondContact O-N 2.9Å; E415-L1341 HydrophobicContact CG-CD1 4.44Å
416	G	92.4	Very high	94.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.2	14.1	168.6	0	0	0	0	0	117.7	Q378 Q379 V413 N414	Q378-G416 WeakPolarHBondContact CB-O 3.41Å; Q378-G416 PolarHBondContact N-O 3.19Å; Q379-G416 PolarHBondContact N-O 2.85Å; V413-G416 PolarHBondContact O-N 3.29Å; N414-G416 VanDerWaalsContact C-N 3.33Å
417	Y	95.4	Very high	94.2	Very high	25 Å²	25	44.1 Å²	44.1	10%	0.098	23%	0.232	C	C	.	.			trans	-85.1	-25.5	178	-60.4	-74.6	0	0	0	114.1	M375 H377 Q378 R385 I387 F407 L412 E415	M375-Y417 HydrophobicContact CE-CD1 3.96Å; M375-Y417 HydrophobicContact CE-CD2 4.22Å; M375-Y417 HydrophobicContact CE-CG 3.76Å; M375-Y417 HydrophobicContact CG-CD1 4.23Å; H377-Y417 HydrophobicContact CB-CD1 4.11Å; H377-Y417 HydrophobicContact CB-CE1 3.78Å; Q378-Y417 VanDerWaalsContact CG-O 3.29Å; Q378-Y417 WeakPolarHBondContact CG-O 3.37Å; R385-Y417 WeakPolarHBondContact O-CE1 3.42Å; R385-Y417 PolarHBondContact O-OH 3.38Å; R385-Y417 VanDerWaalsContact O-OH 3.04Å; I387-Y417 HydrophobicContact CD1-CD1 4.2Å; I387-Y417 HydrophobicContact CD1-CD2 4.12Å; I387-Y417 HydrophobicContact CD1-CE1 3.63Å; I387-Y417 HydrophobicContact CD1-CE2 3.55Å; I387-Y417 HydrophobicContact CD1-CG 4.43Å; I387-Y417 HydrophobicContact CG1-CE1 3.84Å; I387-Y417 HydrophobicContact CG1-CE2 4.43Å; F407-Y417 AromaticContact CE1-CD2 3.75Å; F407-Y417 HydrophobicContact CE1-CD2 3.75Å; F407-Y417 HydrophobicContact CE1-CE2 4.11Å; F407-Y417 HydrophobicContact CE2-CE2 4.34Å; F407-Y417 AromaticContact CZ-CD2 3.87Å; F407-Y417 HydrophobicContact CZ-CD2 3.87Å; F407-Y417 AromaticContact CZ-CE2 3.72Å; F407-Y417 HydrophobicContact CZ-CE2 3.72Å; L412-Y417 PolarHBondContact O-N 3.43Å; L412-Y417 VanDerWaalsContact O-N 3.1Å; E415-Y417 HydrophobicContact CB-CD2 3.71Å; E415-Y417 HydrophobicContact CB-CE2 3.5Å; E415-Y417 WeakPolarHBondContact O-CD2 3.49Å; E415-Y417 WeakPolarHBondContact O-CE2 3.38Å; E415-Y417 PolarHBondContact O-N 2.9Å
418	L	94.9	Very high	94.3	Very high	12 Å²	12	46.4 Å²	46.4	6%	0.063	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	113.8	169.5	172	56.5	0	0	0	108.9	Y314 L412 V413 S420 I425	Y314-L418 HydrophobicContact CD1-CD1 3.84Å; Y314-L418 HydrophobicContact CD1-CD2 3.64Å; Y314-L418 HydrophobicContact CD1-CG 4.38Å; Y314-L418 HydrophobicContact CE1-CD2 3.92Å; Y314-L418 HydrophobicContact CG-CD1 4.22Å; L412-L418 HydrophobicContact CB-CB 4.06Å; L412-L418 PolarHBondContact O-N 3.3Å; V413-L418 HydrophobicContact CG2-CD2 3.83Å; V413-L418 HydrophobicContact CG2-CG 4.42Å; L418-S420 PolarHBondContact O-N 3.42Å; L418-I425 HydrophobicContact CB-CG1 4.13Å; L418-I425 HydrophobicContact CD1-CG1 3.88Å
419	N	93.2	Very high	94.3	Very high	40 Å²	40	43.8 Å²	43.8	21%	0.214	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	114.9	169.8	-178.1	-25	0	0	0	108.2	Q378 E421 T422 D423 S424	Q378-N419 HydrophobicContact CB-CB 4.05Å; Q378-N419 HydrophobicContact CG-CB 3.97Å; N419-E421 WeakPolarHBondContact OD1-CB 3.19Å; N419-E421 PolarHBondContact OD1-N 2.87Å; N419-T422 VanDerWaalsContact CB-OG1 3.3Å; N419-T422 WeakPolarHBondContact CB-OG1 3.25Å; N419-T422 PolarHBondContact ND2-OG1 2.7Å; N419-T422 PolarHBondContact OD1-N 2.89Å; N419-T422 PolarHBondContact OD1-OG1 3.32Å; N419-D423 VanDerWaalsContact O-CA 3.29Å; N419-D423 WeakPolarHBondContact O-CA 3.43Å; N419-D423 PolarHBondContact O-N 3.06Å; N419-S424 PolarHBondContact N-O 3.3Å; N419-S424 PolarHBondContact O-N 3.48Å
420	S	89.2	Confident	94.4	Very high	78 Å²	78	44.2 Å²	44.2	55%	0.545	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-17	-175.4	-61.9	0	0	0	0	113.7	L418	L418-S420 PolarHBondContact O-N 3.42Å
421	E	91.3	Very high	94.5	Very high	185 Å²	185	40 Å²	40	86%	0.864	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-37.9	176.1	-57.1	-177	161.1	0	0	111.2	N419	N419-E421 WeakPolarHBondContact OD1-CB 3.19Å; N419-E421 PolarHBondContact OD1-N 2.87Å
422	T	93.3	Very high	94.6	Very high	56 Å²	56	42.4 Å²	42.4	34%	0.344	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-7.6	-178.3	55.3	0	0	0	0	114.1	Q312 N419 S424	Q312-T422 WeakPolarHBondContact CG-O 3.45Å; Q312-T422 PolarHBondContact NE2-O 2.72Å; N419-T422 VanDerWaalsContact CB-OG1 3.3Å; N419-T422 WeakPolarHBondContact CB-OG1 3.25Å; N419-T422 PolarHBondContact ND2-OG1 2.7Å; N419-T422 PolarHBondContact OD1-N 2.89Å; N419-T422 PolarHBondContact OD1-OG1 3.32Å; T422-S424 VanDerWaalsContact C-N 3.34Å; T422-S424 PolarHBondContact O-N 3.35Å; T422-S424 PolarHBondContact OG1-OG 2.93Å
423	D	95.9	Very high	94.6	Very high	34 Å²	34	42.8 Å²	42.8	18%	0.182	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	51.4	-169.4	-173.5	40.1	0	0	0	111.6	P313 Y314 S315 N419	P313-D423 WeakPolarHBondContact CA-OD2 3.37Å; P313-D423 VanDerWaalsContact CB-OD2 3.26Å; P313-D423 WeakPolarHBondContact CB-OD2 3.46Å; Y314-D423 WeakPolarHBondContact CB-O 3.43Å; Y314-D423 PolarHBondContact N-O 2.98Å; Y314-D423 PolarHBondContact N-OD2 2.92Å; S315-D423 VanDerWaalsContact CB-OD1 3.3Å; S315-D423 WeakPolarHBondContact CB-OD1 3.41Å; S315-D423 VanDerWaalsContact CB-OD2 3.31Å; S315-D423 WeakPolarHBondContact CB-OD2 3.17Å; S315-D423 VanDerWaalsContact N-CG 3.3Å; S315-D423 PolarHBondContact N-OD1 2.97Å; S315-D423 PolarHBondContact N-OD2 3.36Å; S315-D423 PolarHBondContact OG-OD1 3.3Å; N419-D423 VanDerWaalsContact O-CA 3.29Å; N419-D423 WeakPolarHBondContact O-CA 3.43Å; N419-D423 PolarHBondContact O-N 3.06Å
424	S	96.1	Very high	94.8	Very high	8 Å²	8	40.8 Å²	40.8	6%	0.056	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	139.9	-175.1	71.5	0	0	0	0	116.2	L311 Q378 N419 T422	L311-S424 VanDerWaalsContact O-CA 3.28Å; L311-S424 WeakPolarHBondContact O-CA 3.49Å; Q378-S424 PolarHBondContact NE2-O 3.45Å; Q378-S424 PolarHBondContact NE2-OG 2.87Å; N419-S424 PolarHBondContact N-O 3.3Å; N419-S424 PolarHBondContact O-N 3.48Å; T422-S424 VanDerWaalsContact C-N 3.34Å; T422-S424 PolarHBondContact O-N 3.35Å; T422-S424 PolarHBondContact OG1-OG 2.93Å
425	I	96.7	Very high	95.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	135.1	168.1	-56.3	179.1	0	0	0	108.2	L311 Y314 M375 L412 L418 L427	L311-I425 HydrophobicContact CB-CB 4.34Å; L311-I425 HydrophobicContact CD1-CB 4.26Å; L311-I425 PolarHBondContact N-O 2.79Å; L311-I425 PolarHBondContact O-N 2.92Å; Y314-I425 HydrophobicContact CD1-CD1 4.03Å; Y314-I425 HydrophobicContact CD1-CG1 4.4Å; Y314-I425 HydrophobicContact CD2-CD1 3.54Å; Y314-I425 HydrophobicContact CD2-CG1 4.08Å; Y314-I425 HydrophobicContact CE1-CD1 3.9Å; Y314-I425 HydrophobicContact CE2-CD1 3.42Å; Y314-I425 VanDerWaalsContact CE2-CD1 3.42Å; Y314-I425 HydrophobicContact CE2-CG1 4.43Å; Y314-I425 HydrophobicContact CG-CD1 3.85Å; Y314-I425 HydrophobicContact CG-CG1 4.05Å; M375-I425 HydrophobicContact CG-CG2 3.91Å; M375-I425 HydrophobicContact SD-CG2 3.69Å; L412-I425 HydrophobicContact CD1-CD1 3.88Å; L412-I425 HydrophobicContact CD2-CD1 3.95Å; L412-I425 HydrophobicContact CG-CD1 4.47Å; L418-I425 HydrophobicContact CB-CG1 4.13Å; L418-I425 HydrophobicContact CD1-CG1 3.88Å; I425-L427 HydrophobicContact CG2-CD2 4.41Å
426	L	96.9	Very high	95.2	Very high	40 Å²	40	38.5 Å²	38.5	21%	0.209	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	114.5	178.7	-170.1	65.8	0	0	0	110.5	T308 T310 V376	T308-L426 HydrophobicContact CG2-CD1 3.44Å; T308-L426 VanDerWaalsContact CG2-CD1 3.44Å; T308-L426 HydrophobicContact CG2-CG 4.12Å; T310-L426 WeakPolarHBondContact OG1-CD1 3.46Å; V376-L426 HydrophobicContact CB-CB 4.21Å; V376-L426 HydrophobicContact CB-CD2 4.08Å; V376-L426 HydrophobicContact CB-CG 4.35Å; V376-L426 HydrophobicContact CG1-CD2 4.32Å; V376-L426 HydrophobicContact CG2-CD2 4.06Å; V376-L426 HydrophobicContact CG2-CG 4.21Å; V376-L426 PolarHBondContact N-O 2.89Å
427	L	97.8	Very high	95.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	137.7	172.3	-62.5	179.2	0	0	0	109.9	T308 F309 L311 L338 V340 V355 E374 M375 I425	T308-L427 CarbonylContact C-O 3.55Å; F309-L427 PolarHBondContact N-O 2.71Å; F309-L427 PolarHBondContact O-N 3.34Å; L311-L427 HydrophobicContact CD1-CD1 3.8Å; L311-L427 HydrophobicContact CD1-CG 4.24Å; L338-L427 HydrophobicContact CD1-CB 4.06Å; L338-L427 HydrophobicContact CD1-CD1 4.12Å; V340-L427 HydrophobicContact CG2-CD1 3.68Å; V355-L427 HydrophobicContact CG1-CD1 4.29Å; V355-L427 HydrophobicContact CG2-CD1 4.14Å; E374-L427 CarbonylContact O-C 3.49Å; E374-L427 WeakPolarHBondContact O-CA 3.43Å; M375-L427 HydrophobicContact CB-CD2 3.63Å; M375-L427 HydrophobicContact CG-CD2 3.75Å; M375-L427 HydrophobicContact SD-CD2 4.14Å; I425-L427 HydrophobicContact CG2-CD2 4.41Å
428	K	97.2	Very high	95.4	Very high	65 Å²	65	46.5 Å²	46.5	28%	0.283	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	133.2	166.5	-177.4	178.1	178.5	-175.7	0	108.4	E374 Q430	E374-K428 HydrophobicContact CB-CB 4.25Å; E374-K428 PolarHBondContact N-O 2.95Å; E374-K428 PolarHBondContact O-N 3.47Å; K428-Q430 HydrophobicContact CG-CG 4.36Å
429	F	97.3	Very high	95.4	Very high	1 Å²	1	47.6 Å²	47.6	0%	0.004	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	147	172.5	70.8	-78.5	0	0	0	110.6	S306 S307 L329 W336 L338 L357 R372	S306-F429 CarbonylContact C-O 3.59Å; S306-F429 VanDerWaalsContact CA-O 3.3Å; S306-F429 WeakPolarHBondContact CA-O 3.46Å; S306-F429 WeakPolarHBondContact CB-O 3.32Å; S307-F429 PolarHBondContact N-O 3Å; S307-F429 WeakPolarHBondContact O-CD1 3.42Å; S307-F429 PolarHBondContact O-N 3.41Å; S307-F429 VanDerWaalsContact O-O 3.13Å; L329-F429 HydrophobicContact CB-CE2 3.94Å; L329-F429 HydrophobicContact CB-CZ 3.94Å; L329-F429 HydrophobicContact CD2-CD2 4.41Å; L329-F429 HydrophobicContact CD2-CE2 3.9Å; L329-F429 HydrophobicContact CD2-CZ 4.47Å; W336-F429 HydrophobicContact CB-CE2 4.37Å; L338-F429 HydrophobicContact CD1-CB 3.99Å; L338-F429 HydrophobicContact CD1-CD1 3.61Å; L338-F429 HydrophobicContact CD1-CE1 4.34Å; L338-F429 HydrophobicContact CD1-CG 4.05Å; L338-F429 HydrophobicContact CD2-CB 3.9Å; L338-F429 HydrophobicContact CD2-CD1 4.46Å; L338-F429 HydrophobicContact CD2-CG 4.14Å; L338-F429 HydrophobicContact CG-CB 3.89Å; L338-F429 HydrophobicContact CG-CD1 3.54Å; L338-F429 HydrophobicContact CG-CD2 4.36Å; L338-F429 HydrophobicContact CG-CE1 4.06Å; L338-F429 HydrophobicContact CG-CG 3.69Å; L357-F429 HydrophobicContact CD1-CD2 3.62Å; L357-F429 HydrophobicContact CD1-CE2 3.96Å; R372-F429 CarbonylContact O-C 3.48Å; R372-F429 WeakPolarHBondContact O-CA 3.36Å
430	Q	96.8	Very high	95.5	Very high	24 Å²	24	49 Å²	49	11%	0.112	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	139.1	-173.8	-25.2	-173.6	8.8	0	0	108.5	Y304 E305 Y371 R372 E374 K428	Y304-Q430 HydrophobicContact CD1-CB 4.06Å; Y304-Q430 HydrophobicContact CG-CB 4.18Å; E305-Q430 CarbonylContact O-C 3.49Å; E305-Q430 VanDerWaalsContact O-CA 3.25Å; E305-Q430 WeakPolarHBondContact O-CA 3.47Å; Y371-Q430 CarbonylContact C-O 3.59Å; Y371-Q430 WeakPolarHBondContact CA-O 3.34Å; Y371-Q430 WeakPolarHBondContact CB-O 3.49Å; R372-Q430 HydrophobicContact CB-CB 4.19Å; R372-Q430 HydrophobicContact CB-CG 4.11Å; R372-Q430 HydrophobicContact CG-CG 4.39Å; R372-Q430 PolarHBondContact N-O 3.48Å; R372-Q430 PolarHBondContact O-N 3.33Å; E374-Q430 PolarHBondContact OE2-NE2 3.49Å; K428-Q430 HydrophobicContact CG-CG 4.36Å
431	V	96.8	Very high	95.7	Very high	2 Å²	2	48.7 Å²	48.7	1%	0.012	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	146.8	-175.3	65.9	0	0	0	0	111.5	E305 L329 W336 L357 E370	E305-V431 PolarHBondContact N-O 3.44Å; E305-V431 PolarHBondContact O-N 3.39Å; L329-V431 HydrophobicContact CD2-CG1 4.05Å; W336-V431 HydrophobicContact CB-CG1 4.46Å; W336-V431 HydrophobicContact CD2-CG1 4.17Å; W336-V431 HydrophobicContact CD2-CG2 3.97Å; W336-V431 HydrophobicContact CE3-CG2 4.21Å; W336-V431 HydrophobicContact CG-CG1 3.91Å; W336-V431 HydrophobicContact CH2-CG2 4.06Å; W336-V431 HydrophobicContact CZ2-CG2 3.81Å; W336-V431 HydrophobicContact CZ3-CG2 4.25Å; L357-V431 HydrophobicContact CD2-CB 4.46Å; L357-V431 HydrophobicContact CD2-CG2 4.27Å; E370-V431 CarbonylContact O-C 3.36Å; E370-V431 WeakPolarHBondContact O-CA 3.5Å
432	R	96	Very high	95.9	Very high	60 Å²	60	40.1 Å²	40.1	23%	0.226	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	159.6	174	69.8	-180	-177.2	-170.2	-3.5	113.5	V301 P302 Y304 E370	V301-R432 VanDerWaalsContact CG1-CZ 3.42Å; P302-R432 HydrophobicContact CG-CB 4.47Å; P302-R432 VanDerWaalsContact O-CD 3.29Å; P302-R432 WeakPolarHBondContact O-CD 3.27Å; P302-R432 PolarHBondContact O-NH1 3.19Å; Y304-R432 HydrophobicContact CD1-CB 4.01Å; Y304-R432 HydrophobicContact CD1-CG 3.75Å; Y304-R432 HydrophobicContact CE1-CB 4.37Å; Y304-R432 HydrophobicContact CE1-CG 3.64Å; Y304-R432 HydrophobicContact CG-CG 4.42Å; E370-R432 HydrophobicContact CB-CG 3.89Å; E370-R432 PolarHBondContact N-O 3.41Å; E370-R432 PolarHBondContact O-N 2.92Å; E370-R432 IonicContact OE2-CZ 3.69Å; E370-R432 VanDerWaalsContact OE2-CZ 3.24Å; E370-R432 IonicContact OE2-NE 2.74Å; E370-R432 PolarHBondContact OE2-NE 3.24Å; E370-R432 IonicContact OE2-NH2 3.29Å; E370-R432 PolarHBondContact OE2-NH2 3.33Å
433	A	95.9	Very high	95.9	Very high	10 Å²	10	41.1 Å²	41.1	8%	0.083	20%	0.198	C	C	.	.			trans	-70.9	141	159.8	0	0	0	0	0	110.4	P302 T435 Q438 K439	P302-A433 VanDerWaalsContact CD-O 3.29Å; P302-A433 WeakPolarHBondContact CD-O 3.44Å; P302-A433 HydrophobicContact CG-CB 4.29Å; P302-A433 WeakPolarHBondContact CG-O 3.46Å; A433-T435 PolarHBondContact O-N 2.89Å; A433-Q438 HydrophobicContact CB-CB 3.9Å; A433-Q438 HydrophobicContact CB-CG 3.57Å; A433-K439 HydrophobicContact CB-CB 4.04Å
434	P	95.4	Very high	95.9	Very high	26 Å²	26	43.9 Å²	43.9	17%	0.169	21%	0.213	C	C	.	.	S	Bend	trans	-66.6	-14.6	178.6	-24.8	35.7	0	0	0	115.1	K368 E370	K368-P434 HydrophobicContact CD-CG 4.45Å; K368-P434 HydrophobicContact CG-CG 4.42Å; K368-P434 WeakPolarHBondContact O-CD 3.26Å; K368-P434 WeakPolarHBondContact O-CG 3.28Å; E370-P434 HydrophobicContact CG-CG 4.32Å
435	T	95.7	Very high	95.8	Very high	59 Å²	59	46.8 Å²	46.8	36%	0.362	22%	0.222	S	C	.	.	S	Bend	trans	-147	157.6	178	61.6	0	0	0	0	111.5	I300 A433 F437 Q438 K439	I300-T435 CarbonylContact O-C 3.57Å; I300-T435 VanDerWaalsContact O-CA 3.29Å; I300-T435 WeakPolarHBondContact O-CA 3.46Å; A433-T435 PolarHBondContact O-N 2.89Å; T435-F437 VanDerWaalsContact C-N 3.27Å; T435-F437 PolarHBondContact O-N 3.42Å; T435-Q438 WeakPolarHBondContact O-CB 3.49Å; T435-Q438 PolarHBondContact O-N 2.66Å; T435-Q438 PolarHBondContact OG1-N 3.12Å; T435-K439 PolarHBondContact O-N 3.01Å; T435-K439 VanDerWaalsContact O-N 3.1Å
436	Y	95.7	Very high	95.7	Very high	84 Å²	84	49.6 Å²	49.6	33%	0.329	24%	0.235	S	C	.	.	H	α-helix	trans	-62.6	-32.8	169.4	-82.2	-75.6	0	0	0	112.8	E299 I300 P302 Q438 K439 C440	E299-Y436 VanDerWaalsContact O-CD2 3.28Å; E299-Y436 WeakPolarHBondContact O-CD2 3.49Å; I300-Y436 PolarHBondContact O-N 2.92Å; P302-Y436 HydrophobicContact CB-CD1 4.22Å; P302-Y436 HydrophobicContact CB-CE1 3.85Å; P302-Y436 HydrophobicContact CB-CE2 4.36Å; Y436-Q438 VanDerWaalsContact C-N 3.29Å; Y436-Q438 PolarHBondContact O-N 3.17Å; Y436-K439 PolarHBondContact O-N 2.97Å; Y436-C440 WeakPolarHBondContact O-CB 3.36Å; Y436-C440 PolarHBondContact O-N 3.1Å; Y436-C440 PolarHBondContact O-SG 3.21Å
437	F	95.3	Very high	95.7	Very high	164 Å²	164	51.6 Å²	51.6	72%	0.719	25%	0.246	S	C	*	.	H	α-helix	trans	-55.8	-45.4	173.7	174.7	-95.9	0	0	0	111.8	T435 R441	T435-F437 VanDerWaalsContact C-N 3.27Å; T435-F437 PolarHBondContact O-N 3.42Å; F437-R441 WeakPolarHBondContact O-CB 3.49Å; F437-R441 PolarHBondContact O-N 3Å
438	Q	95.2	Very high	95.5	Very high	28 Å²	28	56.2 Å²	56.2	13%	0.131	27%	0.269	C	S	.	.	H	α-helix	trans	-63.4	-49.3	174	176.7	72.9	29.1	0	0	111.3	A433 T435 Y436 C440 R441 D442	A433-Q438 HydrophobicContact CB-CB 3.9Å; A433-Q438 HydrophobicContact CB-CG 3.57Å; T435-Q438 WeakPolarHBondContact O-CB 3.49Å; T435-Q438 PolarHBondContact O-N 2.66Å; T435-Q438 PolarHBondContact OG1-N 3.12Å; Y436-Q438 VanDerWaalsContact C-N 3.29Å; Y436-Q438 PolarHBondContact O-N 3.17Å; Q438-C440 VanDerWaalsContact C-N 3.34Å; Q438-C440 PolarHBondContact O-N 3.02Å; Q438-R441 WeakPolarHBondContact O-CB 3.37Å; Q438-R441 PolarHBondContact O-N 3.17Å; Q438-R441 VanDerWaalsContact O-N 3.13Å; Q438-D442 VanDerWaalsContact NE2-CG 3.34Å; Q438-D442 PolarHBondContact NE2-OD1 2.8Å; Q438-D442 VanDerWaalsContact NE2-OD1 3.13Å; Q438-D442 PolarHBondContact NE2-OD2 3.29Å; Q438-D442 PolarHBondContact O-N 2.79Å
439	K	95.1	Very high	95.3	Very high	36 Å²	36	57 Å²	57	16%	0.157	28%	0.275	C	S	.	.	H	α-helix	trans	-56.6	-46.5	179	-166.8	171	-174.3	171.4	0	111.7	P302 E305 A433 T435 Y436 D442 Q443	P302-K439 HydrophobicContact CB-CD 3.82Å; P302-K439 HydrophobicContact CG-CD 4.25Å; E305-K439 IonicContact OE1-NZ 2.7Å; E305-K439 PolarHBondContact OE1-NZ 3.34Å; A433-K439 HydrophobicContact CB-CB 4.04Å; T435-K439 PolarHBondContact O-N 3.01Å; T435-K439 VanDerWaalsContact O-N 3.1Å; Y436-K439 PolarHBondContact O-N 2.97Å; K439-D442 PolarHBondContact O-N 3.25Å; K439-Q443 WeakPolarHBondContact O-CB 2.8Å; K439-Q443 VanDerWaalsContact O-CG 3.24Å; K439-Q443 WeakPolarHBondContact O-CG 3.28Å; K439-Q443 PolarHBondContact O-N 3.38Å; K439-Q443 PolarHBondContact O-OE1 3.11Å
440	C	95.2	Very high	95.2	Very high	68 Å²	68	61.3 Å²	61.3	46%	0.459	30%	0.297	S	S	.	.	H	α-helix	trans	-65.6	-37.4	177.7	-65.2	0	0	0	0	112.7	Y436 Q438 N444	Y436-C440 WeakPolarHBondContact O-CB 3.36Å; Y436-C440 PolarHBondContact O-N 3.1Å; Y436-C440 PolarHBondContact O-SG 3.21Å; Q438-C440 VanDerWaalsContact C-N 3.34Å; Q438-C440 PolarHBondContact O-N 3.02Å; C440-N444 WeakPolarHBondContact O-CB 3.28Å; C440-N444 PolarHBondContact O-N 2.97Å
441	R	94.7	Very high	95.2	Very high	73 Å²	73	65.2 Å²	65.2	28%	0.275	32%	0.315	S	S	.	.	H	α-helix	trans	-61.7	-47.7	175.5	-174.8	-163.5	74	148.4	6.5	111.4	E365 S367 F437 Q438 N444 W445	E365-R441 IonicContact OE2-CZ 3.22Å; E365-R441 IonicContact OE2-NH1 3.01Å; E365-R441 PolarHBondContact OE2-NH1 3.4Å; S367-R441 PolarHBondContact OG-NH2 2.98Å; F437-R441 WeakPolarHBondContact O-CB 3.49Å; F437-R441 PolarHBondContact O-N 3Å; Q438-R441 WeakPolarHBondContact O-CB 3.37Å; Q438-R441 PolarHBondContact O-N 3.17Å; Q438-R441 VanDerWaalsContact O-N 3.13Å; R441-N444 PolarHBondContact O-N 2.83Å; R441-W445 PolarHBondContact O-N 2.96Å
442	D	94.5	Very high	95.1	Very high	5 Å²	5	68.1 Å²	68.1	3%	0.027	34%	0.34	C	S	.	.	H	α-helix	trans	-70.9	-39.6	-176.8	-54.6	-26.8	0	0	0	110.5	Y369 Q438 K439 W445 H446	Y369-D442 PolarHBondContact OH-OD2 3.41Å; Q438-D442 VanDerWaalsContact NE2-CG 3.34Å; Q438-D442 PolarHBondContact NE2-OD1 2.8Å; Q438-D442 VanDerWaalsContact NE2-OD1 3.13Å; Q438-D442 PolarHBondContact NE2-OD2 3.29Å; Q438-D442 PolarHBondContact O-N 2.79Å; K439-D442 PolarHBondContact O-N 3.25Å; D442-W445 PolarHBondContact O-N 3.15Å; D442-H446 PolarHBondContact O-N 2.97Å
443	Q	94.8	Very high	95	Very high	76 Å²	76	69.3 Å²	69.3	36%	0.355	35%	0.35	S	S	.	.	H	α-helix	trans	-60.4	-43.7	169.8	-75.1	173.5	-49.7	0	0	112.7	K439 W445 H446 I447	K439-Q443 WeakPolarHBondContact O-CB 2.8Å; K439-Q443 VanDerWaalsContact O-CG 3.24Å; K439-Q443 WeakPolarHBondContact O-CG 3.28Å; K439-Q443 PolarHBondContact O-N 3.38Å; K439-Q443 PolarHBondContact O-OE1 3.11Å; Q443-W445 VanDerWaalsContact C-N 3.34Å; Q443-W445 PolarHBondContact O-N 3.41Å; Q443-H446 WeakPolarHBondContact O-CB 3.49Å; Q443-H446 PolarHBondContact O-N 3.28Å; Q443-I447 WeakPolarHBondContact O-CG1 3.32Å; Q443-I447 PolarHBondContact O-N 3.01Å
444	N	94.9	Very high	95	Very high	93 Å²	93	74.3 Å²	74.3	50%	0.497	37%	0.372	S	S	.	.	H	α-helix	trans	-65.6	-37.4	178.7	-172.5	101.5	0	0	0	111.7	C440 R441 H446 I447 L448	C440-N444 WeakPolarHBondContact O-CB 3.28Å; C440-N444 PolarHBondContact O-N 2.97Å; R441-N444 PolarHBondContact O-N 2.83Å; N444-H446 VanDerWaalsContact C-N 3.35Å; N444-I447 PolarHBondContact O-N 3.48Å; N444-L448 WeakPolarHBondContact ND2-CD1 3.36Å; N444-L448 WeakPolarHBondContact O-CG 3.4Å; N444-L448 PolarHBondContact O-N 3.12Å
445	W	94.4	Very high	95	Very high	69 Å²	69	74.7 Å²	74.7	26%	0.261	38%	0.38	S	S	.	.	H	α-helix	trans	-60.7	-44	171	168	80.8	0	0	0	111.7	G362 L363 R441 D442 Q443 L448 Q449	G362-W445 VanDerWaalsContact O-CH2 3.26Å; G362-W445 WeakPolarHBondContact O-CH2 3.47Å; L363-W445 HydrophobicContact CB-CD2 4.2Å; L363-W445 HydrophobicContact CB-CE3 4.18Å; L363-W445 HydrophobicContact CD1-CB 4.12Å; L363-W445 VanDerWaalsContact CD1-CD1 3.46Å; L363-W445 HydrophobicContact CD1-CD2 3.72Å; L363-W445 HydrophobicContact CD1-CG 3.47Å; L363-W445 VanDerWaalsContact CD1-CG 3.47Å; R441-W445 PolarHBondContact O-N 2.96Å; D442-W445 PolarHBondContact O-N 3.15Å; Q443-W445 VanDerWaalsContact C-N 3.34Å; Q443-W445 PolarHBondContact O-N 3.41Å; W445-L448 PolarHBondContact O-N 3.49Å; W445-Q449 PolarHBondContact O-N 2.95Å
446	H	94.6	Very high	95	Very high	58 Å²	58	77.1 Å²	77.1	27%	0.269	39%	0.388	S	S	.	.	H	α-helix	trans	-64.7	-40.5	177.3	-176.6	-123.1	0	0	0	112.6	G333 D442 Q443 N444 Q449 L450	G333-H446 WeakPolarHBondContact CA-CD2 3.14Å; D442-H446 PolarHBondContact O-N 2.97Å; Q443-H446 WeakPolarHBondContact O-CB 3.49Å; Q443-H446 PolarHBondContact O-N 3.28Å; N444-H446 VanDerWaalsContact C-N 3.35Å; H446-Q449 WeakPolarHBondContact O-CB 3.48Å; H446-Q449 PolarHBondContact O-N 2.85Å; H446-L450 WeakPolarHBondContact O-CG 3.36Å; H446-L450 PolarHBondContact O-N 3.26Å
447	I	95.7	Very high	95	Very high	83 Å²	83	76.4 Å²	76.4	43%	0.426	39%	0.394	S	S	.	.	H	α-helix	trans	-58.2	-50.2	174.2	-70.2	163.4	0	0	0	110.3	Q443 N444 Q449 L450 E451	Q443-I447 WeakPolarHBondContact O-CG1 3.32Å; Q443-I447 PolarHBondContact O-N 3.01Å; N444-I447 PolarHBondContact O-N 3.48Å; I447-Q449 PolarHBondContact O-N 3.4Å; I447-L450 PolarHBondContact O-N 3.07Å; I447-L450 VanDerWaalsContact O-N 3.08Å; I447-E451 HydrophobicContact CG2-CG 4.33Å; I447-E451 WeakPolarHBondContact O-CG 3.28Å; I447-E451 PolarHBondContact O-N 3.1Å
448	L	95.2	Very high	95.1	Very high	96 Å²	96	74.8 Å²	74.8	50%	0.503	39%	0.387	S	S	.	.	H	α-helix	trans	-59.4	-33.8	176.6	-70.1	168.8	0	0	0	112.7	N444 W445 A452	N444-L448 WeakPolarHBondContact ND2-CD1 3.36Å; N444-L448 WeakPolarHBondContact O-CG 3.4Å; N444-L448 PolarHBondContact O-N 3.12Å; W445-L448 PolarHBondContact O-N 3.49Å; L448-A452 VanDerWaalsContact O-CB 3.31Å; L448-A452 WeakPolarHBondContact O-CB 3.49Å; L448-A452 PolarHBondContact O-N 3.4Å
449	Q	92.7	Very high	95.1	Very high	83 Å²	83	77.9 Å²	77.9	39%	0.388	41%	0.408	S	S	.	.	H	α-helix	trans	-70.8	-41.4	174.5	-169	-177.9	12.3	0	0	112	W445 H446 I447 A452 N453	W445-Q449 PolarHBondContact O-N 2.95Å; H446-Q449 WeakPolarHBondContact O-CB 3.48Å; H446-Q449 PolarHBondContact O-N 2.85Å; I447-Q449 PolarHBondContact O-N 3.4Å; Q449-A452 PolarHBondContact O-N 2.66Å; Q449-N453 WeakPolarHBondContact O-CB 3.47Å; Q449-N453 PolarHBondContact O-N 3.19Å; Q449-N453 PolarHBondContact O-ND2 2.97Å
450	L	94.6	Very high	95.1	Very high	90 Å²	90	80.5 Å²	80.5	47%	0.471	42%	0.421	S	S	.	.	H	α-helix	trans	-64	-43.8	175.3	-70.4	177.2	0	0	0	111.5	H446 I447 N453 Q454	H446-L450 WeakPolarHBondContact O-CG 3.36Å; H446-L450 PolarHBondContact O-N 3.26Å; I447-L450 PolarHBondContact O-N 3.07Å; I447-L450 VanDerWaalsContact O-N 3.08Å; L450-N453 PolarHBondContact O-N 3.46Å; L450-Q454 VanDerWaalsContact O-CB 3.29Å; L450-Q454 WeakPolarHBondContact O-CB 3.38Å; L450-Q454 PolarHBondContact O-N 3.5Å
451	E	96.4	Very high	95.1	Very high	106 Å²	106	81.6 Å²	81.6	50%	0.495	42%	0.421	S	S	.	.	H	α-helix	trans	-60.7	-44.5	175	-71.2	174.3	164.4	0	0	111.7	I447 Q454 G455	I447-E451 HydrophobicContact CG2-CG 4.33Å; I447-E451 WeakPolarHBondContact O-CG 3.28Å; I447-E451 PolarHBondContact O-N 3.1Å; E451-Q454 PolarHBondContact O-N 2.95Å; E451-G455 PolarHBondContact O-N 3.32Å
452	A	95.2	Very high	95.2	Very high	64 Å²	64	80.8 Å²	80.8	53%	0.529	43%	0.43	S	S	.	.	H	α-helix	trans	-63.4	-42.9	176	0	0	0	0	0	112.3	L448 Q449 G455 H456	L448-A452 VanDerWaalsContact O-CB 3.31Å; L448-A452 WeakPolarHBondContact O-CB 3.49Å; L448-A452 PolarHBondContact O-N 3.4Å; Q449-A452 PolarHBondContact O-N 2.66Å; A452-G455 PolarHBondContact O-N 3.25Å; A452-H456 WeakPolarHBondContact O-CB 3.41Å; A452-H456 PolarHBondContact O-N 3.31Å
453	N	94.5	Very high	95.2	Very high	85 Å²	85	85.3 Å²	85.3	46%	0.455	45%	0.451	S	S	.	.	H	α-helix	trans	-63.7	-43.2	174.9	-72.1	-16.3	0	0	0	111.3	Q449 L450 H456 C457	Q449-N453 WeakPolarHBondContact O-CB 3.47Å; Q449-N453 PolarHBondContact O-N 3.19Å; Q449-N453 PolarHBondContact O-ND2 2.97Å; L450-N453 PolarHBondContact O-N 3.46Å; N453-H456 PolarHBondContact O-N 3.19Å; N453-C457 PolarHBondContact O-N 3.24Å; N453-C457 PolarHBondContact O-SG 3.39Å; N453-C457 VanDerWaalsContact O-SG 3.36Å
454	Q	96.1	Very high	95.3	Very high	115 Å²	115	86 Å²	86	54%	0.537	46%	0.457	S	S	.	.	H	α-helix	trans	-62.3	-45.6	177.6	-167.7	-168.6	26.7	0	0	111.2	L450 E451 H456 C457 F458	L450-Q454 VanDerWaalsContact O-CB 3.29Å; L450-Q454 WeakPolarHBondContact O-CB 3.38Å; L450-Q454 PolarHBondContact O-N 3.5Å; E451-Q454 PolarHBondContact O-N 2.95Å; Q454-H456 VanDerWaalsContact C-N 3.3Å; Q454-H456 PolarHBondContact O-N 2.93Å; Q454-C457 PolarHBondContact O-N 2.92Å; Q454-F458 HydrophobicContact CG-CD2 3.94Å; Q454-F458 HydrophobicContact CG-CE2 3.64Å; Q454-F458 VanDerWaalsContact O-CD2 3.28Å; Q454-F458 WeakPolarHBondContact O-CD2 3.44Å; Q454-F458 PolarHBondContact O-N 2.98Å
455	G	95.8	Very high	95.4	Very high	33 Å²	33	88.8 Å²	88.8	34%	0.34	47%	0.465	S	S	.	.	H	α-helix	trans	-61.5	-36.5	174.1	0	0	0	0	0	112.9	E451 A452 T459	E451-G455 PolarHBondContact O-N 3.32Å; A452-G455 PolarHBondContact O-N 3.25Å; G455-T459 WeakPolarHBondContact O-CB 3.45Å; G455-T459 PolarHBondContact O-N 3.45Å; G455-T459 PolarHBondContact O-OG1 2.9Å
456	H	95	Very high	95.4	Very high	111 Å²	111	91.8 Å²	91.8	51%	0.514	48%	0.482	S	S	.	.	H	α-helix	trans	-67.2	-44.6	173.7	-166.5	58.3	0	0	0	111.9	A452 N453 Q454 F458 T459 Q460	A452-H456 WeakPolarHBondContact O-CB 3.41Å; A452-H456 PolarHBondContact O-N 3.31Å; N453-H456 PolarHBondContact O-N 3.19Å; Q454-H456 VanDerWaalsContact C-N 3.3Å; Q454-H456 PolarHBondContact O-N 2.93Å; H456-F458 PolarHBondContact O-N 3.22Å; H456-T459 WeakPolarHBondContact O-CB 3.35Å; H456-T459 PolarHBondContact O-N 3.24Å; H456-T459 VanDerWaalsContact O-N 3.15Å; H456-Q460 PolarHBondContact CD2-NE2 3.32Å; H456-Q460 PolarHBondContact NE2-NE2 2.86Å; H456-Q460 WeakPolarHBondContact O-CG 3.32Å; H456-Q460 PolarHBondContact O-N 2.86Å
457	C	95.6	Very high	95.4	Very high	69 Å²	69	95.8 Å²	95.8	47%	0.466	49%	0.494	S	S	.	.	H	α-helix	trans	-61	-42.6	174	-69.9	0	0	0	0	112.4	N453 Q454 T459 Q460 L461	N453-C457 PolarHBondContact O-N 3.24Å; N453-C457 PolarHBondContact O-SG 3.39Å; N453-C457 VanDerWaalsContact O-SG 3.36Å; Q454-C457 PolarHBondContact O-N 2.92Å; C457-T459 VanDerWaalsContact C-N 3.31Å; C457-T459 PolarHBondContact O-N 3.04Å; C457-Q460 PolarHBondContact O-N 2.76Å; C457-L461 WeakPolarHBondContact O-CB 3.49Å; C457-L461 VanDerWaalsContact O-CG 3.29Å; C457-L461 WeakPolarHBondContact O-CG 3.35Å; C457-L461 PolarHBondContact O-N 2.98Å
458	F	96.4	Very high	95.3	Very high	130 Å²	130	97.2 Å²	97.2	57%	0.57	50%	0.502	S	S	*	.	H	α-helix	trans	-61	-39.2	173	-80.7	-55.9	0	0	0	112.2	Q454 H456 L461 A462	Q454-F458 HydrophobicContact CG-CD2 3.94Å; Q454-F458 HydrophobicContact CG-CE2 3.64Å; Q454-F458 VanDerWaalsContact O-CD2 3.28Å; Q454-F458 WeakPolarHBondContact O-CD2 3.44Å; Q454-F458 PolarHBondContact O-N 2.98Å; H456-F458 PolarHBondContact O-N 3.22Å; F458-L461 PolarHBondContact O-N 3.42Å; F458-A462 PolarHBondContact O-N 2.86Å
459	T	95.7	Very high	95.3	Very high	92 Å²	92	96.5 Å²	96.5	56%	0.564	51%	0.505	S	S	*	.	H	α-helix	trans	-65	-44.9	176.3	-54.5	0	0	0	0	111.5	G455 H456 C457 A462 E463	G455-T459 WeakPolarHBondContact O-CB 3.45Å; G455-T459 PolarHBondContact O-N 3.45Å; G455-T459 PolarHBondContact O-OG1 2.9Å; H456-T459 WeakPolarHBondContact O-CB 3.35Å; H456-T459 PolarHBondContact O-N 3.24Å; H456-T459 VanDerWaalsContact O-N 3.15Å; C457-T459 VanDerWaalsContact C-N 3.31Å; C457-T459 PolarHBondContact O-N 3.04Å; T459-A462 WeakPolarHBondContact O-CB 3.08Å; T459-A462 PolarHBondContact O-N 3.41Å; T459-E463 PolarHBondContact O-N 3.15Å
460	Q	95.4	Very high	95.3	Very high	92 Å²	92	98.7 Å²	98.7	43%	0.43	52%	0.517	S	S	.	.	H	α-helix	trans	-63.3	-41.7	175	-68.8	-174.9	17.3	0	0	112	H456 C457 A462 E463 L464	H456-Q460 PolarHBondContact CD2-NE2 3.32Å; H456-Q460 PolarHBondContact NE2-NE2 2.86Å; H456-Q460 WeakPolarHBondContact O-CG 3.32Å; H456-Q460 PolarHBondContact O-N 2.86Å; C457-Q460 PolarHBondContact O-N 2.76Å; Q460-A462 VanDerWaalsContact C-N 3.29Å; Q460-A462 PolarHBondContact O-N 3.17Å; Q460-E463 PolarHBondContact O-N 2.98Å; Q460-L464 WeakPolarHBondContact O-CB 3.24Å; Q460-L464 VanDerWaalsContact O-CG 3.3Å; Q460-L464 WeakPolarHBondContact O-CG 3.46Å; Q460-L464 PolarHBondContact O-N 3.13Å
461	L	95.4	Very high	95	Very high	90 Å²	90	97.3 Å²	97.3	47%	0.471	51%	0.508	S	S	.	.	H	α-helix	trans	-64.1	-32.8	175.8	-74.1	170.1	0	0	0	112.3	C457 F458 K465	C457-L461 WeakPolarHBondContact O-CB 3.49Å; C457-L461 VanDerWaalsContact O-CG 3.29Å; C457-L461 WeakPolarHBondContact O-CG 3.35Å; C457-L461 PolarHBondContact O-N 2.98Å; F458-L461 PolarHBondContact O-N 3.42Å; L461-K465 WeakPolarHBondContact O-CB 3.47Å; L461-K465 WeakPolarHBondContact O-CD 3.3Å; L461-K465 WeakPolarHBondContact O-CG 3.35Å; L461-K465 PolarHBondContact O-N 3.45Å
462	A	95.7	Very high	94.8	Very high	57 Å²	57	96 Å²	96	47%	0.471	51%	0.507	S	S	.	.	H	α-helix	trans	-68	-48.3	172.3	0	0	0	0	0	111.7	F458 T459 Q460 L464 K465 E466	F458-A462 PolarHBondContact O-N 2.86Å; T459-A462 WeakPolarHBondContact O-CB 3.08Å; T459-A462 PolarHBondContact O-N 3.41Å; Q460-A462 VanDerWaalsContact C-N 3.29Å; Q460-A462 PolarHBondContact O-N 3.17Å; A462-L464 PolarHBondContact O-N 3.04Å; A462-K465 PolarHBondContact O-N 3.02Å; A462-E466 PolarHBondContact O-N 2.82Å
463	E	96.2	Very high	94.4	Very high	99 Å²	99	95.2 Å²	95.2	46%	0.463	50%	0.501	S	S	.	.	H	α-helix	trans	-59.9	-44.1	176.9	-166.2	-155.3	124.2	0	0	111.7	T459 Q460 K465 E466 R467	T459-E463 PolarHBondContact O-N 3.15Å; Q460-E463 PolarHBondContact O-N 2.98Å; E463-K465 PolarHBondContact O-N 3.26Å; E463-E466 PolarHBondContact O-N 3.23Å; E463-R467 WeakPolarHBondContact O-CB 3.49Å; E463-R467 VanDerWaalsContact O-CG 3.27Å; E463-R467 WeakPolarHBondContact O-CG 3.36Å; E463-R467 PolarHBondContact O-N 2.9Å; E463-R467 WeakPolarHBondContact OE1-CD 3.25Å; E463-R467 IonicContact OE1-CZ 3.52Å; E463-R467 IonicContact OE1-NE 3.69Å; E463-R467 IonicContact OE1-NH1 3.65Å; E463-R467 PolarHBondContact OE1-NH1 3.37Å
464	L	96.2	Very high	94.1	Very high	92 Å²	92	97.4 Å²	97.4	48%	0.482	50%	0.503	S	S	.	.	H	α-helix	trans	-66	-37.2	178.5	-71.5	172.6	0	0	0	112.2	Q460 A462 L468	Q460-L464 WeakPolarHBondContact O-CB 3.24Å; Q460-L464 VanDerWaalsContact O-CG 3.3Å; Q460-L464 WeakPolarHBondContact O-CG 3.46Å; Q460-L464 PolarHBondContact O-N 3.13Å; A462-L464 PolarHBondContact O-N 3.04Å; L464-L468 VanDerWaalsContact O-CB 3.25Å; L464-L468 WeakPolarHBondContact O-CB 3.48Å; L464-L468 PolarHBondContact O-N 3.32Å
465	K	96.2	Very high	93.2	Very high	151 Å²	151	96.7 Å²	96.7	66%	0.657	50%	0.499	S	S	*	.	H	α-helix	trans	-66.1	-41.6	172.8	-77.2	171.5	-179.2	-178.1	0	112.2	L461 A462 E463 L468 S469	L461-K465 WeakPolarHBondContact O-CB 3.47Å; L461-K465 WeakPolarHBondContact O-CD 3.3Å; L461-K465 WeakPolarHBondContact O-CG 3.35Å; L461-K465 PolarHBondContact O-N 3.45Å; A462-K465 PolarHBondContact O-N 3.02Å; E463-K465 PolarHBondContact O-N 3.26Å; K465-L468 PolarHBondContact O-N 2.95Å; K465-S469 WeakPolarHBondContact O-CB 3.37Å; K465-S469 PolarHBondContact O-N 3.14Å
466	E	95.5	Very high	92.3	Very high	131 Å²	131	99.1 Å²	99.1	61%	0.612	51%	0.508	S	S	*	.	H	α-helix	trans	-63.1	-47.8	175.3	-175.5	175.2	-167.5	0	0	111	A462 E463 L468 S469 M470	A462-E466 PolarHBondContact O-N 2.82Å; E463-E466 PolarHBondContact O-N 3.23Å; E466-L468 PolarHBondContact O-N 2.99Å; E466-S469 WeakPolarHBondContact O-CB 3.35Å; E466-S469 PolarHBondContact O-N 3.09Å; E466-M470 WeakPolarHBondContact O-CG 3.28Å; E466-M470 PolarHBondContact O-N 3.31Å
467	R	94.5	Very high	91.1	Very high	143 Å²	143	98.7 Å²	98.7	54%	0.54	51%	0.509	S	S	.	.	H	α-helix	trans	-62	-40.2	177.1	-73	169.7	58.8	174.7	-4.4	112.6	E463 M470 E471	E463-R467 WeakPolarHBondContact O-CB 3.49Å; E463-R467 VanDerWaalsContact O-CG 3.27Å; E463-R467 WeakPolarHBondContact O-CG 3.36Å; E463-R467 PolarHBondContact O-N 2.9Å; E463-R467 WeakPolarHBondContact OE1-CD 3.25Å; E463-R467 IonicContact OE1-CZ 3.52Å; E463-R467 IonicContact OE1-NE 3.69Å; E463-R467 IonicContact OE1-NH1 3.65Å; E463-R467 PolarHBondContact OE1-NH1 3.37Å; R467-M470 PolarHBondContact O-N 2.96Å; R467-E471 WeakPolarHBondContact O-CB 3.43Å; R467-E471 PolarHBondContact O-N 2.95Å
468	L	94	Very high	90	Very high	112 Å²	112	99.7 Å²	99.7	59%	0.586	51%	0.509	S	S	*	.	H	α-helix	trans	-65.3	-42.2	174.5	-178.5	61.3	0	0	0	111.4	L464 K465 E466 E471 V472	L464-L468 VanDerWaalsContact O-CB 3.25Å; L464-L468 WeakPolarHBondContact O-CB 3.48Å; L464-L468 PolarHBondContact O-N 3.32Å; K465-L468 PolarHBondContact O-N 2.95Å; E466-L468 PolarHBondContact O-N 2.99Å; L468-E471 PolarHBondContact O-N 3.24Å; L468-V472 HydrophobicContact CD1-CG2 4.24Å; L468-V472 HydrophobicContact CG-CG2 4.46Å; L468-V472 WeakPolarHBondContact O-CB 3.29Å; L468-V472 WeakPolarHBondContact O-CG2 3.24Å; L468-V472 PolarHBondContact O-N 2.63Å
469	S	94.3	Very high	88.3	Confident	82 Å²	82	98.8 Å²	98.8	57%	0.573	51%	0.509	S	S	*	.	H	α-helix	trans	-60.1	-45.3	175.2	-174.1	0	0	0	0	112	K465 E466 E471 A473	K465-S469 WeakPolarHBondContact O-CB 3.37Å; K465-S469 PolarHBondContact O-N 3.14Å; E466-S469 WeakPolarHBondContact O-CB 3.35Å; E466-S469 PolarHBondContact O-N 3.09Å; S469-E471 PolarHBondContact O-N 3.28Å; S469-A473 WeakPolarHBondContact O-CB 3.12Å; S469-A473 PolarHBondContact O-N 2.73Å
470	M	91.7	Very high	86.5	Confident	128 Å²	128	97.2 Å²	97.2	63%	0.631	50%	0.502	S	S	*	.	H	α-helix	trans	-60.4	-41.9	173.6	-72.1	177.6	60	0	0	112.6	E466 R467 A473 R474	E466-M470 WeakPolarHBondContact O-CG 3.28Å; E466-M470 PolarHBondContact O-N 3.31Å; R467-M470 PolarHBondContact O-N 2.96Å; M470-A473 PolarHBondContact O-N 3.16Å; M470-R474 WeakPolarHBondContact O-CB 3.46Å; M470-R474 PolarHBondContact O-N 2.84Å
471	E	89.2	Confident	84.8	Confident	62 Å²	62	97.2 Å²	97.2	29%	0.29	51%	0.508	S	S	.	.	H	α-helix	trans	-71.3	-41.4	-179	177.8	52.8	-153.6	0	0	112.3	R467 L468 S469 A473 R474 Q475	R467-E471 WeakPolarHBondContact O-CB 3.43Å; R467-E471 PolarHBondContact O-N 2.95Å; L468-E471 PolarHBondContact O-N 3.24Å; S469-E471 PolarHBondContact O-N 3.28Å; E471-A473 PolarHBondContact O-N 3.12Å; E471-R474 WeakPolarHBondContact O-CB 3.41Å; E471-R474 PolarHBondContact O-N 3.42Å; E471-R474 VanDerWaalsContact O-N 3.15Å; E471-R474 IonicContact OE1-CZ 3.45Å; E471-R474 IonicContact OE1-NE 3.42Å; E471-R474 PolarHBondContact OE1-NE 2.77Å; E471-R474 IonicContact OE1-NH2 2.68Å; E471-R474 PolarHBondContact OE1-NH2 3.31Å; E471-R474 IonicContact OE2-CZ 3.48Å; E471-R474 IonicContact OE2-NE 2.73Å; E471-R474 PolarHBondContact OE2-NE 3.21Å; E471-R474 IonicContact OE2-NH2 3.41Å; E471-R474 PolarHBondContact OE2-NH2 2.77Å; E471-Q475 WeakPolarHBondContact O-CG 3.47Å; E471-Q475 PolarHBondContact O-N 3.01Å; E471-Q475 WeakPolarHBondContact OE1-CG 3.46Å; E471-Q475 PolarHBondContact OE1-NE2 2.76Å
472	V	91.6	Very high	82.9	Confident	78 Å²	78	96.1 Å²	96.1	47%	0.473	51%	0.512	S	S	.	.	H	α-helix	trans	-59.2	-47.8	171.5	170.2	0	0	0	0	109.9	L468 R474 Q475 T476	L468-V472 HydrophobicContact CD1-CG2 4.24Å; L468-V472 HydrophobicContact CG-CG2 4.46Å; L468-V472 WeakPolarHBondContact O-CB 3.29Å; L468-V472 WeakPolarHBondContact O-CG2 3.24Å; L468-V472 PolarHBondContact O-N 2.63Å; V472-R474 VanDerWaalsContact C-N 3.28Å; V472-R474 PolarHBondContact O-N 3.36Å; V472-Q475 PolarHBondContact O-N 2.89Å; V472-Q475 VanDerWaalsContact O-N 3.12Å; V472-T476 PolarHBondContact O-N 3Å; V472-T476 PolarHBondContact O-OG1 3.43Å
473	A	88.5	Confident	80.9	Confident	48 Å²	48	98.4 Å²	98.4	40%	0.397	52%	0.52	S	S	.	.	H	α-helix	trans	-60.3	-35.7	175.6	0	0	0	0	0	112.6	S469 M470 E471 N477	S469-A473 WeakPolarHBondContact O-CB 3.12Å; S469-A473 PolarHBondContact O-N 2.73Å; M470-A473 PolarHBondContact O-N 3.16Å; E471-A473 PolarHBondContact O-N 3.12Å; A473-N477 PolarHBondContact O-N 3.15Å; A473-N477 VanDerWaalsContact O-N 3.13Å; A473-N477 PolarHBondContact O-ND2 2.99Å
474	R	86.5	Confident	78.7	Confident	131 Å²	131	98.6 Å²	98.6	49%	0.494	53%	0.528	S	S	.	.	H	α-helix	trans	-65.5	-43.4	173.6	-167.7	-171.2	71	87.1	5.6	111.6	M470 E471 V472 N477 I478	M470-R474 WeakPolarHBondContact O-CB 3.46Å; M470-R474 PolarHBondContact O-N 2.84Å; E471-R474 WeakPolarHBondContact O-CB 3.41Å; E471-R474 PolarHBondContact O-N 3.42Å; E471-R474 VanDerWaalsContact O-N 3.15Å; E471-R474 IonicContact OE1-CZ 3.45Å; E471-R474 IonicContact OE1-NE 3.42Å; E471-R474 PolarHBondContact OE1-NE 2.77Å; E471-R474 IonicContact OE1-NH2 2.68Å; E471-R474 PolarHBondContact OE1-NH2 3.31Å; E471-R474 IonicContact OE2-CZ 3.48Å; E471-R474 IonicContact OE2-NE 2.73Å; E471-R474 PolarHBondContact OE2-NE 3.21Å; E471-R474 IonicContact OE2-NH2 3.41Å; E471-R474 PolarHBondContact OE2-NH2 2.77Å; V472-R474 VanDerWaalsContact C-N 3.28Å; V472-R474 PolarHBondContact O-N 3.36Å; R474-N477 PolarHBondContact O-N 2.77Å; R474-I478 HydrophobicContact CG-CD1 4.48Å; R474-I478 WeakPolarHBondContact O-CG1 3.48Å; R474-I478 PolarHBondContact O-N 3.28Å
475	Q	78.1	Confident	76.2	Confident	99 Å²	99	100.8 Å²	100.8	46%	0.463	54%	0.54	S	S	.	.	H	α-helix	trans	-67.7	-41.7	178	-68.6	-178.4	25.4	0	0	112	E471 V472 N477 I478 I479	E471-Q475 WeakPolarHBondContact O-CG 3.47Å; E471-Q475 PolarHBondContact O-N 3.01Å; E471-Q475 WeakPolarHBondContact OE1-CG 3.46Å; E471-Q475 PolarHBondContact OE1-NE2 2.76Å; V472-Q475 PolarHBondContact O-N 2.89Å; V472-Q475 VanDerWaalsContact O-N 3.12Å; Q475-N477 VanDerWaalsContact C-N 3.26Å; Q475-N477 PolarHBondContact O-N 3.49Å; Q475-I478 PolarHBondContact O-N 3.44Å; Q475-I479 WeakPolarHBondContact O-CG1 3.48Å; Q475-I479 PolarHBondContact O-N 3.25Å
476	T	77.7	Confident	73.4	Confident	84 Å²	84	99.7 Å²	99.7	52%	0.515	55%	0.546	S	S	.	.	H	α-helix	trans	-57.3	-39.7	172.3	-49.9	0	0	0	0	111.7	V472 I479 S480	V472-T476 PolarHBondContact O-N 3Å; V472-T476 PolarHBondContact O-OG1 3.43Å; T476-I479 PolarHBondContact O-N 2.87Å; T476-S480 PolarHBondContact O-N 2.84Å; T476-S480 PolarHBondContact O-OG 3.3Å
477	N	69.8	Low	70.5	Confident	102 Å²	102	97.8 Å²	97.8	55%	0.545	55%	0.553	S	S	.	*	H	α-helix	trans	-71.1	-28.9	175.3	-79.9	-63.7	0	0	0	113.9	A473 R474 Q475 S480 V481	A473-N477 PolarHBondContact O-N 3.15Å; A473-N477 VanDerWaalsContact O-N 3.13Å; A473-N477 PolarHBondContact O-ND2 2.99Å; R474-N477 PolarHBondContact O-N 2.77Å; Q475-N477 VanDerWaalsContact C-N 3.26Å; Q475-N477 PolarHBondContact O-N 3.49Å; N477-S480 WeakPolarHBondContact CA-OG 3.45Å; N477-S480 PolarHBondContact O-OG 3.49Å; N477-V481 WeakPolarHBondContact O-CB 3.39Å; N477-V481 VanDerWaalsContact O-CG2 3.27Å; N477-V481 WeakPolarHBondContact O-CG2 3.4Å; N477-V481 PolarHBondContact O-N 3.24Å; N477-V481 VanDerWaalsContact O-N 3.14Å
478	I	71.4	Confident	68	Low	91 Å²	91	97.8 Å²	97.8	47%	0.467	57%	0.569	S	S	.	*	H	α-helix	trans	-73.1	-39.6	172.9	-72.7	171	0	0	0	110.8	R474 Q475 V481 A482	R474-I478 HydrophobicContact CG-CD1 4.48Å; R474-I478 WeakPolarHBondContact O-CG1 3.48Å; R474-I478 PolarHBondContact O-N 3.28Å; Q475-I478 PolarHBondContact O-N 3.44Å; I478-V481 PolarHBondContact O-N 3.31Å; I478-A482 VanDerWaalsContact O-CB 3.28Å; I478-A482 WeakPolarHBondContact O-CB 3.32Å; I478-A482 PolarHBondContact O-N 2.91Å
479	I	61.6	Low	65.4	Low	110 Å²	110	97 Å²	97	56%	0.564	58%	0.579	S	S	*	*	H	α-helix	trans	-63.8	-43.7	175.5	-66.7	164.9	0	0	0	110.6	Q475 T476 A482 T483	Q475-I479 WeakPolarHBondContact O-CG1 3.48Å; Q475-I479 PolarHBondContact O-N 3.25Å; T476-I479 PolarHBondContact O-N 2.87Å; I479-A482 PolarHBondContact O-N 3.18Å; I479-T483 WeakPolarHBondContact O-CB 3.25Å; I479-T483 PolarHBondContact O-N 2.87Å; I479-T483 VanDerWaalsContact O-N 3.09Å; I479-T483 PolarHBondContact O-OG1 3.01Å
480	S	58.2	Low	62.6	Low	59 Å²	59	98 Å²	98	41%	0.413	59%	0.592	S	S	.	*	H	α-helix	trans	-64.5	-42	177.3	68.1	0	0	0	0	112.2	T476 N477 T483 T484	T476-S480 PolarHBondContact O-N 2.84Å; T476-S480 PolarHBondContact O-OG 3.3Å; N477-S480 WeakPolarHBondContact CA-OG 3.45Å; N477-S480 PolarHBondContact O-OG 3.49Å; S480-T483 PolarHBondContact O-N 2.95Å; S480-T484 WeakPolarHBondContact O-CG2 3.23Å
481	V	59.4	Low	59.8	Low	92 Å²	92	97.3 Å²	97.3	56%	0.558	60%	0.6	S	S	*	*	H	α-helix	trans	-65.5	-44.8	174.8	170.4	0	0	0	0	111.8	N477 I478 T483 T484	N477-V481 WeakPolarHBondContact O-CB 3.39Å; N477-V481 VanDerWaalsContact O-CG2 3.27Å; N477-V481 WeakPolarHBondContact O-CG2 3.4Å; N477-V481 PolarHBondContact O-N 3.24Å; N477-V481 VanDerWaalsContact O-N 3.14Å; I478-V481 PolarHBondContact O-N 3.31Å; V481-T483 PolarHBondContact O-N 2.94Å; V481-T484 PolarHBondContact O-N 3.16Å; V481-T484 PolarHBondContact O-OG1 3.01Å
482	A	55	Low	57.5	Low	67 Å²	67	99.7 Å²	99.7	55%	0.554	62%	0.621	S	S	*	*	H	α-helix	trans	-58.7	-34.7	178.3	0	0	0	0	0	112.3	I478 I479 T484	I478-A482 VanDerWaalsContact O-CB 3.28Å; I478-A482 WeakPolarHBondContact O-CB 3.32Å; I478-A482 PolarHBondContact O-N 2.91Å; I479-A482 PolarHBondContact O-N 3.18Å; A482-T484 PolarHBondContact O-N 3.33Å
483	T	52.9	Low	54.9	Low	106 Å²	106	102.9 Å²	102.9	65%	0.65	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-9.3	179.3	-50.8	0	0	0	0	113.6	I479 S480 V481	I479-T483 WeakPolarHBondContact O-CB 3.25Å; I479-T483 PolarHBondContact O-N 2.87Å; I479-T483 VanDerWaalsContact O-N 3.09Å; I479-T483 PolarHBondContact O-OG1 3.01Å; S480-T483 PolarHBondContact O-N 2.95Å; V481-T483 PolarHBondContact O-N 2.94Å
484	T	51.3	Low	52.4	Low	102 Å²	102	105.7 Å²	105.7	63%	0.626	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-4	-176.6	60.2	0	0	0	0	116	S480 V481 A482	S480-T484 WeakPolarHBondContact O-CG2 3.23Å; V481-T484 PolarHBondContact O-N 3.16Å; V481-T484 PolarHBondContact O-OG1 3.01Å; A482-T484 PolarHBondContact O-N 3.33Å
485	N	42.4	Very low	50	Low	138 Å²	138	106.2 Å²	106.2	74%	0.738	66%	0.659	S	S	*	*	S	Bend	trans	-112.6	15.1	-171.1	-90.1	-33.4	0	0	0	116.4
486	T	38.9	Very low	48.3	Very low	128 Å²	128	107.9 Å²	107.9	79%	0.785	67%	0.669	S	S	*	*			trans	-134.6	88.5	174.1	52.6	0	0	0	0	112.3
487	A	34	Very low	46.5	Very low	92 Å²	92	111.8 Å²	111.8	76%	0.76	68%	0.68	S	S	*	*			trans	-144.6	67.8	179.2	0	0	0	0	0	113.4
488	T	42.1	Very low	44.9	Very low	143 Å²	143	113.5 Å²	113.5	88%	0.877	69%	0.689	S	S	*	*			trans	-155.1	133.2	167.2	18.3	0	0	0	0	113.9
489	A	38.9	Very low	43.1	Very low	96 Å²	96	114.2 Å²	114.2	79%	0.793	70%	0.702	S	S	*	*			trans	68.6	114	151.4	0	0	0	0	0	122.1
490	A	36.8	Very low	41.9	Very low	102 Å²	102	114.7 Å²	114.7	84%	0.843	71%	0.71	S	S	*	*			trans	74.1	134	136.2	0	0	0	0	0	122.3
491	S	31.3	Very low	40.7	Very low	114 Å²	114	117.8 Å²	117.8	80%	0.797	73%	0.726	S	S	*	*			trans	-86.8	179.6	165.2	-35.1	0	0	0	0	110.7
492	P	41.7	Very low	39.4	Very low	112 Å²	112	119.6 Å²	119.6	73%	0.727	74%	0.737	S	S	*	*			cis	-136.4	-167.3	4.3	32.8	-8.9	0	0	0	114.7
493	I	36.3	Very low	38.2	Very low	144 Å²	144	121.4 Å²	121.4	74%	0.738	74%	0.741	S	S	*	*			trans	131.3	112.7	146.3	-69.8	165.2	0	0	0	115.6
494	T	37	Very low	37.2	Very low	107 Å²	107	121.5 Å²	121.5	66%	0.656	74%	0.742	S	S	*	*			trans	52.9	123.8	155.9	55.8	0	0	0	0	123
495	D	35.2	Very low	36.4	Very low	142 Å²	142	124 Å²	124	76%	0.759	75%	0.75	S	S	*	*				65	131.8	127.5	-50.8	-13.8	0	0	0	119
496	I	43.2	Very low	35.8	Very low	134 Å²	134	121.9 Å²	121.9	69%	0.687	75%	0.746	S	S	*	*			cis	-158.9	159.6	8.3	-134.9	173.7	0	0	0	108
497	F	39.6	Very low	35.4	Very low	167 Å²	167	121.3 Å²	121.3	73%	0.732	75%	0.747	S	S	*	*			cis	-148.7	-159.2	16	-139.4	-24.4	0	0	0	112.3
498	N	35.7	Very low	35.3	Very low	137 Å²	137	122.9 Å²	122.9	73%	0.733	75%	0.748	S	S	*	*			trans	-103.2	175.8	172.4	-43.6	-48	0	0	0	109.3
499	S	34.8	Very low	34.8	Very low	106 Å²	106	121.4 Å²	121.4	74%	0.741	74%	0.743	S	S	*	*			cis	-166.8	165.7	10.2	-117	0	0	0	0	106.9
500	T	36.2	Very low	34.8	Very low	120 Å²	120	122.9 Å²	122.9	74%	0.736	74%	0.742	S	S	*	*			cis	-168.3	155.8	-18.1	-90.2	0	0	0	0	106.9
501	V	31.2	Very low	34.6	Very low	124 Å²	124	124 Å²	124	75%	0.752	74%	0.738	S	S	*	*			trans	-125.1	170	176.3	175.5	0	0	0	0	109.9
502	V	33.5	Very low	34.5	Very low	130 Å²	130	122.9 Å²	122.9	79%	0.788	73%	0.729	S	S	*	*			trans	109.6	112.4	174.3	-178.4	0	0	0	0	112.3
503	T	29.8	Very low	33.8	Very low	106 Å²	106	125 Å²	125	65%	0.65	73%	0.729	S	S	*	*			cis	107.8	144.3	15.3	-55.1	0	0	0	0	114.1
504	T	31	Very low	33.4	Very low	108 Å²	108	125.9 Å²	125.9	66%	0.663	73%	0.73	S	S	*	*			trans	78.5	119	159.1	36.2	0	0	0	0	123.6
505	I	33.8	Very low	32.8	Very low	154 Å²	154	125.5 Å²	125.5	79%	0.79	73%	0.732	S	S	*	*			trans	78	142.5	132.1	-65.5	166.3	0	0	0	119.7
506	S	31.5	Very low	32.5	Very low	94 Å²	94	124.1 Å²	124.1	66%	0.657	73%	0.729	S	S	*	*			cis	-178.4	173.5	-29.6	-85.2	0	0	0	0	109.8
507	S	28.9	Very low	31.9	Very low	116 Å²	116	123.8 Å²	123.8	81%	0.811	73%	0.729	S	S	*	*			trans	79.1	159	159	-37.7	0	0	0	0	116.5
508	T	33.7	Very low	31.4	Very low	125 Å²	125	118.3 Å²	118.3	77%	0.767	71%	0.711	S	S	*	*			cis	-137	160.3	2.6	47.5	0	0	0	0	109.3
509	S	31.3	Very low	31.2	Very low	112 Å²	112	116 Å²	116	78%	0.783	70%	0.698	S	S	*	*			cis	83	103.8	29.2	-170.6	0	0	0	0	117
510	V	37.5	Very low	31	Very low	127 Å²	127	114.9 Å²	114.9	77%	0.77	68%	0.68	S	S	*	*			trans	-154	107.8	173.4	175.8	0	0	0	0	107.1
511	V	33.6	Very low	30.8	Very low	125 Å²	125	113 Å²	113	76%	0.758	67%	0.67	S	S	*	*				74.5	131.5	85.2	159.8	0	0	0	0	112.9
512	C	28.5	Very low	30.5	Very low	91 Å²	91	111.6 Å²	111.6	62%	0.615	67%	0.665	S	S	*	*			cis	-166.5	165.1	-1.2	-117.3	0	0	0	0	114.5
513	Q	27.6	Very low	30.1	Very low	155 Å²	155	112.2 Å²	112.2	72%	0.724	67%	0.67	S	S	*	*			trans	68.8	127.4	138.8	-76.7	169.7	-31	0	0	124.5
514	Q	27	Very low	29.9	Very low	164 Å²	164	112.2 Å²	112.2	77%	0.766	67%	0.674	S	S	*	*			trans	82.1	131.5	132	-74.6	177.3	-12	0	0	122.4
515	S	25.6	Very low	29.6	Very low	98 Å²	98	115.8 Å²	115.8	69%	0.685	69%	0.688	S	S	*	*			trans	99.5	130.8	152	-37.3	0	0	0	0	118
516	T	27.7	Very low	29.4	Very low	114 Å²	114	112.7 Å²	112.7	70%	0.699	68%	0.68	S	S	*	*			trans	62.1	126.2	141.2	48.5	0	0	0	0	120.9
517	D	30.8	Very low	29.1	Very low	127 Å²	127	114.5 Å²	114.5	68%	0.679	68%	0.682	S	S	*	*			trans	76.9	121.2	130.3	-55.4	-4.6	0	0	0	120.2
518	S	29.5	Very low	29.6	Very low	51 Å²	51	113 Å²	113	36%	0.357	67%	0.669	S	S	.	*				82.2	128.5	121.2	-66.2	0	0	0	0	122.9	E959 N961	S518-E959 WeakPolarHBondContact CB-OE2 3.48Å; S518-E959 PolarHBondContact OG-OE2 2.83Å; S518-N961 WeakPolarHBondContact CA-O 3.45Å; S518-N961 PolarHBondContact N-O 3.49Å
519	L	32.2	Very low	29.3	Very low	90 Å²	90	111.1 Å²	111.1	47%	0.471	66%	0.658	S	S	.	*			trans	79.8	162.5	149.9	-60.8	158.8	0	0	0	119.5	E959 C960 N961	L519-E959 WeakPolarHBondContact CD1-OE1 3.46Å; L519-E959 HydrophobicContact CD2-CB 4.18Å; L519-E959 VanDerWaalsContact CD2-CD 3.49Å; L519-E959 HydrophobicContact CD2-CG 3.74Å; L519-E959 WeakPolarHBondContact CD2-OE1 3.43Å; L519-E959 HydrophobicContact CG-CG 4.4Å; L519-C960 WeakPolarHBondContact CA-O 3.43Å; L519-C960 PolarHBondContact N-O 3.12Å; L519-N961 PolarHBondContact O-ND2 2.85Å
520	K	29.8	Very low	29.2	Very low	82 Å²	82	110 Å²	110	36%	0.357	65%	0.651	S	S	.	*				-161	136.7	-53.1	-179.7	132.1	-170.8	159.1	0	108.1	E959 C960	K520-E959 PolarHBondContact NZ-O 3.15Å; K520-C960 HydrophobicContact CB-CB 4.25Å; K520-C960 HydrophobicContact CD-CB 3.9Å; K520-C960 WeakPolarHBondContact CE-SG 3.5Å; K520-C960 HydrophobicContact CG-CB 4.02Å; K520-C960 PolarHBondContact NZ-SG 2.93Å
521	P	32.3	Very low	28.8	Very low	81 Å²	81	108.3 Å²	108.3	53%	0.526	64%	0.641	S	S	.	*			trans	-82.7	-173.7	172.3	35.3	-39.2	0	0	0	112.8
522	S	24.5	Very low	28.6	Very low	94 Å²	94	109.3 Å²	109.3	66%	0.657	64%	0.64	S	S	*	*			trans	95.8	133.8	160.9	-49	0	0	0	0	117.6
523	T	24.7	Very low	28.7	Very low	143 Å²	143	109 Å²	109	88%	0.877	64%	0.639	S	S	*	*			trans	63.3	149.9	154.9	47.8	0	0	0	0	117.5
524	S	25.7	Very low	28.9	Very low	105 Å²	105	109.5 Å²	109.5	73%	0.734	64%	0.641	S	S	*	*			cis	-145.3	152.1	7.5	47.8	0	0	0	0	110.6
525	L	26	Very low	29.1	Very low	183 Å²	183	106.4 Å²	106.4	96%	0.958	64%	0.638	S	S	*	*			trans	-137.2	119.5	164.6	-98.8	165.2	0	0	0	109.6
526	S	28.9	Very low	29.5	Very low	89 Å²	89	107.6 Å²	107.6	62%	0.622	64%	0.641	S	S	*	*			trans	-159	103.7	173.6	53.4	0	0	0	0	107.9
527	D	25.9	Very low	29.5	Very low	132 Å²	132	107.2 Å²	107.2	71%	0.706	64%	0.642	S	S	*	*			trans	67.1	158.9	152.2	-44	-35.7	0	0	0	119.2
528	P	38.3	Very low	29.4	Very low	84 Å²	84	107.8 Å²	107.8	55%	0.545	64%	0.644	S	S	.	*			cis	-133.9	-149	-49.9	39.3	-25.3	0	0	0	111.4	E668	P528-E668 HydrophobicContact CB-CB 4.42Å
529	T	28.1	Very low	29.3	Very low	86 Å²	86	112.9 Å²	112.9	53%	0.528	66%	0.664	S	S	.	*			trans	99.4	134.7	157.3	-17.2	0	0	0	0	119.6	E668	T529-E668 PolarHBondContact N-OE2 2.92Å
530	S	29.2	Very low	29	Very low	90 Å²	90	113.6 Å²	113.6	63%	0.629	67%	0.672	S	S	*	*			trans	76.9	78.3	150.7	52.3	0	0	0	0	121.8
531	T	28.9	Very low	28.9	Very low	91 Å²	91	115.1 Å²	115.1	56%	0.558	69%	0.688	S	S	*	*				53.9	127.9	111.5	51.3	0	0	0	0	123.5
532	I	30.6	Very low	28.7	Very low	146 Å²	146	116.3 Å²	116.3	75%	0.749	70%	0.698	S	S	*	*			trans	69.5	115.8	131.8	-64.1	169.9	0	0	0	117
533	S	29.5	Very low	29.3	Very low	85 Å²	85	117 Å²	117	59%	0.594	70%	0.701	S	S	*	*				-178.7	147.3	72.9	-127.8	0	0	0	0	117.1
534	Q	32.6	Very low	29.4	Very low	164 Å²	164	115.9 Å²	115.9	77%	0.766	70%	0.699	S	S	*	*			trans	82.3	121	133.7	-80.5	171.3	69	0	0	125.9
535	S	31.3	Very low	29.8	Very low	99 Å²	99	116 Å²	116	69%	0.692	70%	0.697	S	S	*	*			trans	75.2	148	131.6	-53.3	0	0	0	0	119
536	T	32.7	Very low	29.7	Very low	124 Å²	124	115 Å²	115	76%	0.761	69%	0.692	S	S	*	*			cis	-149.8	133.7	20	-43.7	0	0	0	0	108.1
537	C	27.6	Very low	29.6	Very low	106 Å²	106	118.5 Å²	118.5	72%	0.716	70%	0.698	S	S	*	*			cis	90.6	144.5	45.3	-145.6	0	0	0	0	115.1
538	I	29.5	Very low	29.8	Very low	139 Å²	139	118.4 Å²	118.4	71%	0.713	70%	0.697	S	S	*	*			trans	78.2	143.4	162.7	-64.3	155.9	0	0	0	118.1
539	M	27.5	Very low	29.2	Very low	158 Å²	158	122.3 Å²	122.3	78%	0.778	71%	0.708	S	S	*	*			cis	-174.6	170.6	-19.5	-91.4	-168.4	175.9	0	0	108
540	T	25.2	Very low	29.5	Very low	104 Å²	104	124.7 Å²	124.7	64%	0.638	73%	0.725	S	S	*	*			cis	-171.2	178	-24.4	42.2	0	0	0	0	110.6
541	T	28.6	Very low	29.4	Very low	115 Å²	115	125 Å²	125	71%	0.706	73%	0.727	S	S	*	*			trans	68.2	98.8	145.7	42.6	0	0	0	0	123.3
542	S	26.9	Very low	29.2	Very low	105 Å²	105	128.7 Å²	128.7	73%	0.734	74%	0.743	S	S	*	*				38.1	169.5	109.1	64.7	0	0	0	0	123.4
543	P	37.1	Very low	29	Very low	109 Å²	109	127.5 Å²	127.5	71%	0.708	75%	0.747	S	S	*	*				-140.1	158.4	-54.3	40.4	-24.5	0	0	0	116.5
544	S	27.3	Very low	28.8	Very low	120 Å²	120	131.2 Å²	131.2	84%	0.839	76%	0.759	S	S	*	*			trans	49.9	168.2	149.9	-60.5	0	0	0	0	122.1
545	P	35.3	Very low	28.8	Very low	106 Å²	106	128.7 Å²	128.7	69%	0.688	76%	0.758	S	S	*	*			cis	-132	177	-1.1	43.8	-27.8	0	0	0	116.8
546	L	23.2	Very low	28.6	Very low	164 Å²	164	127.7 Å²	127.7	86%	0.859	76%	0.755	S	S	*	*			trans	45.4	135.9	150.2	-64.7	163.8	0	0	0	120.4
547	E	26.9	Very low	28.3	Very low	162 Å²	162	130.3 Å²	130.3	76%	0.757	76%	0.759	S	S	*	*				-177.7	172.8	58.7	-144.8	-169.9	168	0	0	112.8
548	L	28.9	Very low	28.3	Very low	130 Å²	130	129.8 Å²	129.8	68%	0.681	76%	0.756	S	S	*	*			trans	69.6	96.6	156.9	-65	169.9	0	0	0	123.3
549	Q	26.3	Very low	28.3	Very low	165 Å²	165	130.1 Å²	130.1	77%	0.771	76%	0.758	S	S	*	*			trans	50.9	146.4	132.8	-59	-167.8	4.2	0	0	123
550	P	34	Very low	28.2	Very low	136 Å²	136	128.2 Å²	128.2	88%	0.883	75%	0.751	S	S	*	*				-130.9	166	111.6	38.7	-33.3	0	0	0	114.1
551	S	27.9	Very low	28.3	Very low	98 Å²	98	130.9 Å²	130.9	69%	0.685	76%	0.756	S	S	*	*			trans	-119.7	139.8	-176.1	52	0	0	0	0	114.5
552	L	23.7	Very low	28.3	Very low	167 Å²	167	134.2 Å²	134.2	87%	0.874	76%	0.764	S	S	*	*			trans	4.4	125.6	158.2	-66.1	161.7	0	0	0	119.5
553	S	28	Very low	28.5	Very low	121 Å²	121	137.2 Å²	137.2	85%	0.846	76%	0.764	S	S	*	*				-168.7	143	116.3	26.1	0	0	0	0	114.3
554	L	23.9	Very low	28.2	Very low	163 Å²	163	138 Å²	138	85%	0.853	76%	0.761	S	S	*	*			trans	-84.9	169.7	164.7	-110.2	74.2	0	0	0	109.4
555	P	32.7	Very low	28.3	Very low	112 Å²	112	138 Å²	138	73%	0.727	75%	0.751	S	S	*	*			cis	-153.1	165	41.6	43.5	-22.5	0	0	0	120.7
556	A	27.2	Very low	28	Very low	78 Å²	78	139.1 Å²	139.1	65%	0.645	75%	0.752	S	S	*	*			trans	58.4	120.7	135.8	0	0	0	0	0	123.7
557	Q	27.7	Very low	28.2	Very low	178 Å²	178	135.1 Å²	135.1	83%	0.832	74%	0.737	S	S	*	*				75.3	98.2	127.1	-70.7	-178.3	-24.5	0	0	121.7
558	S	26.2	Very low	28.2	Very low	95 Å²	95	133.6 Å²	133.6	66%	0.664	74%	0.739	S	S	*	*				102.5	135.7	101	76.1	0	0	0	0	121.2
559	I	29.1	Very low	28.1	Very low	147 Å²	147	133.4 Å²	133.4	75%	0.754	74%	0.739	S	S	*	*			trans	82.8	107.5	144.9	-69.2	158.9	0	0	0	118.8
560	N	26	Very low	28.1	Very low	117 Å²	117	133 Å²	133	63%	0.626	74%	0.737	S	S	*	*			trans	84.8	122.3	140.5	-74.6	31.3	0	0	0	124.1
561	E	27.5	Very low	27.8	Very low	161 Å²	161	131.8 Å²	131.8	75%	0.752	73%	0.732	S	S	*	*				76.3	131.6	126	-67.2	168.8	144.9	0	0	121.9
562	E	28	Very low	27.7	Very low	184 Å²	184	133.4 Å²	133.4	86%	0.86	73%	0.733	S	S	*	*			trans	56.1	149.3	156.4	-66.4	-166.3	139.8	0	0	121
563	F	30.9	Very low	27.9	Very low	168 Å²	168	133 Å²	133	74%	0.737	72%	0.724	S	S	*	*			cis	-166.3	139.6	-38.3	-145.1	-125.8	0	0	0	107.6
564	I	32.2	Very low	27.8	Very low	127 Å²	127	136.9 Å²	136.9	65%	0.651	72%	0.722	S	S	*	*			trans	74.3	133.1	145.5	-99.2	-171.5	0	0	0	121.9
565	D	29.3	Very low	28	Very low	118 Å²	118	135.6 Å²	135.6	63%	0.631	72%	0.72	S	S	*	*			trans	67.2	153.6	145.1	-74.3	34.1	0	0	0	123.5
566	N	29.1	Very low	27.9	Very low	130 Å²	130	134.4 Å²	134.4	70%	0.695	72%	0.72	S	S	*	*			cis	-176	166.3	-29.9	-107	-22.4	0	0	0	107.9
567	S	27.2	Very low	28	Very low	80 Å²	80	136.2 Å²	136.2	56%	0.559	73%	0.728	S	S	*	*			cis	-169.6	143.5	-13.3	49.1	0	0	0	0	109.7
568	T	26.9	Very low	28	Very low	130 Å²	130	134 Å²	134	80%	0.798	73%	0.726	S	S	*	*			trans	62.9	167.5	167	73.3	0	0	0	0	116
569	N	27.6	Very low	28.7	Very low	126 Å²	126	134.3 Å²	134.3	67%	0.674	73%	0.726	S	S	*	*			cis	-146	178.1	1.7	-145.9	17.6	0	0	0	113.3
570	E	24.5	Very low	28.5	Very low	158 Å²	158	135 Å²	135	74%	0.738	73%	0.726	S	S	*	*			trans	-38.3	142.2	177.5	-52.5	164.3	108.5	0	0	118.2
571	S	27.9	Very low	28.6	Very low	110 Å²	110	135.2 Å²	135.2	77%	0.769	73%	0.725	S	S	*	*				-179.3	127.4	124.6	-88.7	0	0	0	0	116.8
572	N	26.7	Very low	28.7	Very low	131 Å²	131	135 Å²	135	70%	0.701	72%	0.721	S	S	*	*			trans	37.7	110.6	139.2	-75.5	-68.5	0	0	0	122.8
573	K	27.2	Very low	28.6	Very low	160 Å²	160	133 Å²	133	70%	0.696	72%	0.716	S	S	*	*				68.8	123.1	116.4	-71.4	-168.2	174.5	-177.8	0	123.1
574	Y	25.3	Very low	28.6	Very low	202 Å²	202	133.6 Å²	133.6	79%	0.792	72%	0.719	S	S	*	*				94.9	157	120.5	-92.8	-126.3	0	0	0	123.2
575	V	28.1	Very low	28.4	Very low	135 Å²	135	133.8 Å²	133.8	82%	0.818	72%	0.721	S	S	*	*			trans	94.5	135.5	157.9	-161.5	0	0	0	0	118.4
576	A	31.6	Very low	28.3	Very low	87 Å²	87	133 Å²	133	72%	0.719	72%	0.724	S	S	*	*			trans	96.7	112.1	167.8	0	0	0	0	0	116
577	S	29.5	Very low	28.4	Very low	117 Å²	117	133.5 Å²	133.5	82%	0.818	73%	0.725	S	S	*	*			cis	-148.2	156.3	2.7	-79.2	0	0	0	0	114.9
578	V	27.8	Very low	28.4	Very low	130 Å²	130	136.2 Å²	136.2	79%	0.788	73%	0.733	S	S	*	*			trans	-91.7	153	175.8	173.2	0	0	0	0	106.5
579	P	39.6	Very low	28.4	Very low	103 Å²	103	138.5 Å²	138.5	67%	0.669	74%	0.737	S	S	*	*				-159.8	157.3	69.6	44.2	-21.5	0	0	0	122.2
580	E	26.5	Very low	28.5	Very low	161 Å²	161	138.5 Å²	138.5	75%	0.752	74%	0.737	S	S	*	*			trans	59	156.7	133.9	-69.5	-173.5	129.9	0	0	122.8
581	M	28	Very low	28.8	Very low	122 Å²	122	140.5 Å²	140.5	60%	0.601	74%	0.738	S	S	*	*			cis	-171.8	168.4	-37.1	-139.2	173.2	12.2	0	0	110.8
582	K	28.3	Very low	29	Very low	156 Å²	156	141.3 Å²	141.3	68%	0.678	73%	0.733	S	S	*	*			trans	70.9	105.6	149.7	-78.2	171.7	-178.2	160.1	0	121.4
583	N	26.2	Very low	29.2	Very low	141 Å²	141	141.2 Å²	141.2	75%	0.754	73%	0.733	S	S	*	*				70.6	155.5	110.9	-70.7	18.1	0	0	0	123.3
584	K	30.3	Very low	29.3	Very low	181 Å²	181	138.3 Å²	138.3	79%	0.787	73%	0.732	S	S	*	*			trans	83.6	142.1	153.6	-76.6	-178.1	172.3	-161.9	0	118.3
585	D	28.4	Very low	29.6	Very low	132 Å²	132	134.4 Å²	134.4	71%	0.706	73%	0.729	S	S	*	*			cis	-174.2	175.5	-26.8	-124.6	-22.6	0	0	0	110.6
586	C	26.9	Very low	29.9	Very low	101 Å²	101	132.8 Å²	132.8	68%	0.682	72%	0.724	S	S	*	*			trans	78.8	126.8	142	-86.1	0	0	0	0	124.3
587	I	31.4	Very low	30	Very low	140 Å²	140	136 Å²	136	72%	0.718	72%	0.724	S	S	*	*				119.8	131	119	-81.8	165.8	0	0	0	120.8
588	N	28.4	Very low	30	Very low	137 Å²	137	135.4 Å²	135.4	73%	0.733	72%	0.718	S	S	*	*			trans	61.7	127.7	171.3	-63.2	-14.1	0	0	0	118.3
589	M	25.5	Very low	30.1	Very low	178 Å²	178	133.9 Å²	133.9	88%	0.877	71%	0.712	S	S	*	*			cis	78.2	111	42.3	-72.3	-167	140.3	0	0	115.6
590	D	31	Very low	29.6	Very low	126 Å²	126	135.3 Å²	135.3	67%	0.674	71%	0.714	S	S	*	*				-163.9	157.9	96.7	-144.7	-0.6	0	0	0	114
591	R	30.8	Very low	29.6	Very low	201 Å²	201	134.2 Å²	134.2	76%	0.758	71%	0.711	S	S	*	*			trans	61.6	111.5	152.2	-75.7	162.1	-154.2	-126	-5.3	125.9
592	N	31.3	Very low	29.5	Very low	126 Å²	126	135 Å²	135	67%	0.674	72%	0.718	S	S	*	*				85.6	131.8	114.6	-78.9	51.6	0	0	0	125.2
593	D	30.2	Very low	29.4	Very low	130 Å²	130	131.7 Å²	131.7	70%	0.695	71%	0.714	S	S	*	*			trans	65.8	140.3	139.6	-60.6	-32	0	0	0	121.7
594	C	29.8	Very low	29.4	Very low	99 Å²	99	130.3 Å²	130.3	67%	0.669	71%	0.711	S	S	*	*			cis	-166.1	157.1	-22.3	-121.4	0	0	0	0	110.5
595	T	32	Very low	29.3	Very low	120 Å²	120	129.2 Å²	129.2	74%	0.736	71%	0.714	S	S	*	*			trans	39	129.4	156.2	55.7	0	0	0	0	120.3
596	S	34.4	Very low	29.1	Very low	101 Å²	101	130.5 Å²	130.5	71%	0.706	72%	0.721	S	S	*	*			cis	-148.6	139.8	35.2	-108.2	0	0	0	0	110
597	Q	33.2	Very low	29.3	Very low	155 Å²	155	132.1 Å²	132.1	72%	0.724	73%	0.728	S	S	*	*				73.8	124.2	53.4	-164.7	170.7	10.2	0	0	111.7
598	C	30.3	Very low	29.2	Very low	103 Å²	103	129.8 Å²	129.8	70%	0.696	72%	0.724	S	S	*	*			cis	-122.8	154.7	7.5	-96.1	0	0	0	0	111
599	C	30.1	Very low	29.1	Very low	99 Å²	99	130.2 Å²	130.2	67%	0.669	73%	0.725	S	S	*	*			cis	74.3	142.5	44	-53.9	0	0	0	0	114.1
600	L	28.1	Very low	29.2	Very low	133 Å²	133	132.3 Å²	132.3	70%	0.696	72%	0.723	S	S	*	*			cis	-160.2	137.2	-13	-130.9	88.9	0	0	0	105.9
601	I	25.9	Very low	29	Very low	137 Å²	137	131.8 Å²	131.8	70%	0.703	72%	0.72	S	S	*	*				63.2	144.2	100.5	-69.1	-175.2	0	0	0	118.1
602	N	26.2	Very low	28.9	Very low	140 Å²	140	129.2 Å²	129.2	75%	0.749	72%	0.716	S	S	*	*			trans	93.6	107	155.7	-85.6	-3.3	0	0	0	122.3
603	S	26.2	Very low	28.5	Very low	85 Å²	85	129.9 Å²	129.9	59%	0.594	72%	0.719	S	S	*	*				86.6	120.3	109	-61.4	0	0	0	0	122.7
604	T	26.2	Very low	28.6	Very low	113 Å²	113	128.8 Å²	128.8	69%	0.693	72%	0.717	S	S	*	*			trans	50.6	124	132	65.9	0	0	0	0	119.8
605	N	29	Very low	28.3	Very low	157 Å²	157	130.3 Å²	130.3	84%	0.84	72%	0.719	S	S	*	*				-165.5	150.2	95.9	-96.2	-45.6	0	0	0	113.3
606	N	24.8	Very low	28.1	Very low	160 Å²	160	129.2 Å²	129.2	86%	0.856	72%	0.716	S	S	*	*			trans	-105.5	129.1	172.2	-104.8	-33.9	0	0	0	109.7
607	T	30.7	Very low	27.9	Very low	135 Å²	135	131.2 Å²	131.2	83%	0.828	71%	0.714	S	S	*	*			trans	-145.8	114	160	43.7	0	0	0	0	113.2
608	S	29	Very low	27.5	Very low	90 Å²	90	129.2 Å²	129.2	63%	0.629	71%	0.708	S	S	*	*			trans	58.9	104.1	130.1	-157	0	0	0	0	118.4
609	I	27.3	Very low	27.7	Very low	146 Å²	146	131.4 Å²	131.4	75%	0.749	71%	0.708	S	S	*	*				49.6	102.8	81.6	-53.3	165.3	0	0	0	112.6
610	R	27.6	Very low	27.6	Very low	222 Å²	222	131.2 Å²	131.2	84%	0.838	70%	0.704	S	S	*	*				-163.6	144.3	112.3	-130.7	-179.8	-164.5	84.3	1.3	114.1
611	N	26.7	Very low	27.6	Very low	115 Å²	115	132.7 Å²	132.7	62%	0.615	71%	0.707	S	S	*	*			trans	-44.5	157.2	152.4	-39	-2.9	0	0	0	110.2
612	H	27.7	Very low	27.7	Very low	147 Å²	147	130.7 Å²	130.7	68%	0.681	71%	0.705	S	S	*	*				178.3	151.6	58.3	-113.4	-62.8	0	0	0	109
613	L	24.1	Very low	27.7	Very low	141 Å²	141	130.7 Å²	130.7	74%	0.738	71%	0.705	S	S	*	*			trans	64.1	159.1	150.2	-62.1	163.5	0	0	0	115.2
614	T	30.4	Very low	27.7	Very low	106 Å²	106	137.5 Å²	137.5	65%	0.65	72%	0.717	S	S	*	*			cis	-144.5	174.3	7	-20.1	0	0	0	0	109
615	N	23.6	Very low	27.8	Very low	132 Å²	132	135.9 Å²	135.9	71%	0.706	72%	0.724	S	S	*	*			trans	-8.4	139.3	131.2	-45.1	4.9	0	0	0	113.1
616	S	29	Very low	27.9	Very low	96 Å²	96	133.9 Å²	133.9	67%	0.671	72%	0.717	S	S	*	*				-150.1	149.8	65.1	85.4	0	0	0	0	111.2
617	E	29.6	Very low	28.2	Very low	143 Å²	143	130.7 Å²	130.7	67%	0.668	71%	0.707	S	S	*	*				52.8	138.7	86.7	-54.2	-171.5	-139.3	0	0	113.9
618	N	26	Very low	28.1	Very low	113 Å²	113	130.3 Å²	130.3	60%	0.604	70%	0.7	S	S	*	*			cis	-164.3	-161.8	-3.7	-117.6	-35.2	0	0	0	107.7
619	H	32.8	Very low	27.9	Very low	150 Å²	150	132.1 Å²	132.1	69%	0.694	70%	0.703	S	S	*	*			trans	64.3	84.5	147.2	-77.8	-58	0	0	0	116
620	T	28	Very low	27.8	Very low	94 Å²	94	131.3 Å²	131.3	58%	0.577	70%	0.7	S	S	*	*				69.3	146.6	78.2	66.9	0	0	0	0	114.3
621	Q	27.9	Very low	27.7	Very low	164 Å²	164	127 Å²	127	77%	0.766	69%	0.693	S	S	*	*			trans	69.3	139.3	156.7	-67.5	156.2	35.8	0	0	114.4
622	S	28.8	Very low	27.7	Very low	95 Å²	95	127.2 Å²	127.2	66%	0.664	69%	0.694	S	S	*	*			cis	-136.3	140.8	4.5	-91.8	0	0	0	0	108.9
623	L	25.5	Very low	27.6	Very low	141 Å²	141	125.8 Å²	125.8	74%	0.738	69%	0.692	S	S	*	*				57.1	129.5	73.8	-84.4	165.5	0	0	0	113.4
624	R	26.5	Very low	27.7	Very low	227 Å²	227	125.3 Å²	125.3	86%	0.857	69%	0.69	S	S	*	*			trans	69.7	112.9	177.2	-51.3	149.8	-175.2	-104.3	-2.5	111.5	V626	R624-V626 HydrophobicContact CB-CG2 4.02Å
625	G	29.7	Very low	27.7	Very low	80 Å²	80	125.9 Å²	125.9	83%	0.825	69%	0.689	S	S	*	*			cis	136.1	-147.9	17.8	0	0	0	0	0	107.1
626	V	30.6	Very low	27.9	Very low	115 Å²	115	124.8 Å²	124.8	70%	0.697	68%	0.683	S	S	*	*			cis	-152.4	158.5	3.1	170.6	0	0	0	0	106.4	R624	R624-V626 HydrophobicContact CB-CG2 4.02Å
627	S	30.9	Very low	27.9	Very low	93 Å²	93	126.1 Å²	126.1	65%	0.65	68%	0.683	S	S	*	*			trans	74.6	135	173.8	-74.5	0	0	0	0	115.2
628	N	28.5	Very low	27.9	Very low	126 Å²	126	125.6 Å²	125.6	67%	0.674	68%	0.684	S	S	*	*			cis	78.3	125.4	43.7	-62.4	-44	0	0	0	113.4
629	N	24.8	Very low	28.2	Very low	129 Å²	129	126.3 Å²	126.3	69%	0.69	69%	0.688	S	S	*	*				53.5	127.9	128.7	-56.8	-8.5	0	0	0	120.3
630	N	24.9	Very low	28	Very low	129 Å²	129	123.1 Å²	123.1	69%	0.69	68%	0.683	S	S	*	*			trans	72	113.4	131.4	-63.9	4.3	0	0	0	118.4
631	N	25.1	Very low	27.9	Very low	130 Å²	130	126 Å²	126	70%	0.695	69%	0.69	S	S	*	*				85.7	136.8	120.7	-68.7	7	0	0	0	119.2
632	N	26.4	Very low	28.1	Very low	120 Å²	120	124 Å²	124	64%	0.642	68%	0.684	S	S	*	*			trans	78.7	99.7	140.5	-68.1	9.7	0	0	0	118
633	N	27	Very low	28.1	Very low	117 Å²	117	126.1 Å²	126.1	63%	0.626	69%	0.687	S	S	*	*				86.5	123.3	112.7	-66.1	-0	0	0	0	117
634	N	26.5	Very low	28.4	Very low	132 Å²	132	124.7 Å²	124.7	71%	0.706	69%	0.685	S	S	*	*			trans	75.4	135.1	132.1	-62.5	15.6	0	0	0	115.9
635	N	28.8	Very low	28.4	Very low	117 Å²	117	117.4 Å²	117.4	63%	0.626	66%	0.663	S	S	*	*			cis	-153.8	159.1	19.7	-126.2	8.6	0	0	0	112.8
636	N	28.6	Very low	28.4	Very low	109 Å²	109	119 Å²	119	58%	0.583	65%	0.649	S	S	*	*			trans	69.8	103.3	143.9	-66.4	4.2	0	0	0	120
637	N	28.4	Very low	28.5	Very low	125 Å²	125	122 Å²	122	67%	0.668	66%	0.655	S	S	*	*				88	133.2	105.7	-70.4	6.6	0	0	0	120.7
638	N	30.1	Very low	28.5	Very low	131 Å²	131	123.3 Å²	123.3	70%	0.701	66%	0.659	S	S	*	*			trans	75.1	143.8	140.4	-63.7	17.9	0	0	0	116.5
639	N	31.6	Very low	28.6	Very low	129 Å²	129	124.3 Å²	124.3	69%	0.69	67%	0.665	S	S	*	*			cis	-160.3	174	3.3	-124.7	26.7	0	0	0	110.7
640	S	29.3	Very low	28.8	Very low	83 Å²	83	124.7 Å²	124.7	58%	0.58	67%	0.667	S	S	*	*			trans	60.1	114.6	160.4	-86.1	0	0	0	0	117.4
641	E	27	Very low	28.8	Very low	154 Å²	154	123.3 Å²	123.3	72%	0.72	67%	0.666	S	S	*	*				77.4	154.6	56.2	-62.2	157.8	143.2	0	0	114.5
642	N	31	Very low	28.9	Very low	121 Å²	121	123.9 Å²	123.9	65%	0.647	67%	0.668	S	S	*	*			trans	83	111.4	157.4	-56.7	-36.2	0	0	0	117.2
643	L	28.8	Very low	28.9	Very low	140 Å²	140	123.3 Å²	123.3	73%	0.733	67%	0.669	S	S	*	*				85.2	144.4	79.6	-74.8	170.2	0	0	0	111.3
644	T	31.4	Very low	28.9	Very low	112 Å²	112	123.7 Å²	123.7	69%	0.687	68%	0.676	S	S	*	*			cis	-142.4	137.3	9.5	39.2	0	0	0	0	113.1
645	N	27.9	Very low	29	Very low	74 Å²	74	122.9 Å²	122.9	40%	0.396	68%	0.676	S	S	.	*				35.6	151.8	121.5	-50.7	23.7	0	0	0	125.3	F743	N645-F743 PolarHBondContact ND2-N 2.8Å; N645-F743 VanDerWaalsContact ND2-N 3.17Å
646	E	29.7	Very low	28.9	Very low	112 Å²	112	123.8 Å²	123.8	52%	0.523	68%	0.68	S	S	.	*			trans	82.6	113.3	137.5	-77.9	151.1	-127.7	0	0	121.6	F743	E646-F743 PolarHBondContact OE1-N 3.41Å; E646-F743 VanDerWaalsContact OE1-N 3.12Å
647	E	31	Very low	28.9	Very low	178 Å²	178	124.2 Å²	124.2	83%	0.832	69%	0.687	S	S	*	*			trans	4.8	165.5	135.4	-45	179.6	127.8	0	0	120.3
648	V	32.5	Very low	28.8	Very low	121 Å²	121	125.1 Å²	125.1	73%	0.733	69%	0.691	S	S	*	*			cis	-148.7	-172.1	25	-158	0	0	0	0	110.4
649	D	29.5	Very low	28.7	Very low	148 Å²	148	125 Å²	125	79%	0.791	69%	0.69	S	S	*	*			trans	-45.4	171	171.4	-49.7	-57.1	0	0	0	115.8
650	D	28.4	Very low	28.5	Very low	137 Å²	137	123.4 Å²	123.4	73%	0.733	69%	0.689	S	S	*	*			cis	-164.3	164	26.4	-168.3	5.5	0	0	0	111.6
651	C	26.8	Very low	28.5	Very low	99 Å²	99	130.4 Å²	130.4	67%	0.669	70%	0.703	S	S	*	*			trans	61.9	154.7	151.4	-91	0	0	0	0	120.2
652	L	26.2	Very low	28.6	Very low	143 Å²	143	128.6 Å²	128.6	75%	0.749	70%	0.702	S	S	*	*			cis	-161.9	125.5	-2.4	-178.5	69.2	0	0	0	110.9
653	T	25.6	Very low	28.7	Very low	107 Å²	107	127.9 Å²	127.9	66%	0.656	70%	0.702	S	S	*	*			trans	52.8	163.6	143.8	-45.8	0	0	0	0	122.9
654	T	28.1	Very low	28.7	Very low	125 Å²	125	128.2 Å²	128.2	77%	0.767	71%	0.705	S	S	*	*			trans	71.5	146.3	157.2	38	0	0	0	0	120.5
655	V	27.5	Very low	28.9	Very low	116 Å²	116	129.1 Å²	129.1	70%	0.703	71%	0.71	S	S	*	*			cis	-166.8	151.2	-33.4	101.8	0	0	0	0	110.8
656	N	28.2	Very low	29	Very low	135 Å²	135	130.5 Å²	130.5	72%	0.722	72%	0.717	S	S	*	*			trans	57.7	128.3	153.7	-72.2	-4.1	0	0	0	124.3
657	V	28.3	Very low	28.9	Very low	119 Å²	119	131.7 Å²	131.7	72%	0.721	73%	0.727	S	S	*	*				96.7	114.1	119.9	164.5	0	0	0	0	121.9
658	L	26.4	Very low	28.8	Very low	143 Å²	143	127.5 Å²	127.5	75%	0.749	71%	0.708	S	S	*	*			trans	82.6	141.4	145.2	-81.1	171.4	0	0	0	124.3
659	N	28	Very low	28.6	Very low	129 Å²	129	130.7 Å²	130.7	69%	0.69	71%	0.708	S	S	*	*			trans	79.5	83.8	148.3	-73.2	-28.8	0	0	0	122.5
660	S	27.3	Very low	28.4	Very low	95 Å²	95	127.7 Å²	127.7	66%	0.664	70%	0.704	S	S	*	*				88.6	132.4	110.3	78	0	0	0	0	121.3
661	R	29.9	Very low	28.2	Very low	231 Å²	231	129.7 Å²	129.7	87%	0.872	71%	0.708	S	S	*	*			trans	69.4	138.5	163.1	-63.5	178.2	172.1	163.8	-1.7	115.4
662	T	29.2	Very low	28.2	Very low	115 Å²	115	132.4 Å²	132.4	71%	0.706	71%	0.712	S	S	*	*			cis	-160.2	162.8	5.6	-2.1	0	0	0	0	110.5
663	T	32.2	Very low	28.2	Very low	106 Å²	106	132.6 Å²	132.6	65%	0.65	71%	0.713	S	S	*	*			trans	57.1	117.2	158.2	55.2	0	0	0	0	117
664	D	29.7	Very low	28.1	Very low	148 Å²	148	133.3 Å²	133.3	79%	0.791	71%	0.712	S	S	*	*				126.7	141.2	56.6	-84	-10.7	0	0	0	104
665	V	34.4	Very low	28	Very low	131 Å²	131	134.9 Å²	134.9	79%	0.794	71%	0.711	S	S	*	*			cis	-143.1	154.1	15.9	-172.2	0	0	0	0	110
666	D	29.9	Very low	28	Very low	103 Å²	103	136.3 Å²	136.3	55%	0.551	71%	0.714	S	S	*	*			trans	-72.6	165.9	172.7	-15.6	-130	0	0	0	113.8
667	N	29	Very low	27.9	Very low	137 Å²	137	138.8 Å²	138.8	73%	0.733	72%	0.721	S	S	*	*			cis	-150.2	-142.5	-8.5	-141.2	-47	0	0	0	107.5
668	E	27.6	Very low	27.8	Very low	89 Å²	89	137.5 Å²	137.5	42%	0.416	71%	0.713	S	S	.	*			cis	-162.2	157	5.9	-142.3	169.5	140.4	0	0	109.2	P528 T529	P528-E668 HydrophobicContact CB-CB 4.42Å; T529-E668 PolarHBondContact N-OE2 2.92Å
669	Y	27.6	Very low	27.7	Very low	188 Å²	188	137.8 Å²	137.8	74%	0.737	72%	0.716	S	S	*	*			trans	66.4	139.9	172.4	-70.2	-72.7	0	0	0	119.3
670	A	25.7	Very low	27.6	Very low	85 Å²	85	137 Å²	137	70%	0.702	72%	0.72	S	S	*	*			cis	-153.8	168.4	1.4	0	0	0	0	0	114.5
671	E	25.8	Very low	27.4	Very low	179 Å²	179	140.3 Å²	140.3	84%	0.836	73%	0.729	S	S	*	*			trans	90.7	146.4	152.7	-146	173.8	-111.5	0	0	120.6
672	Q	26.7	Very low	27.2	Very low	157 Å²	157	134.5 Å²	134.5	73%	0.734	73%	0.73	S	S	*	*			trans	89	125.3	168.9	-53.6	-163.3	16.9	0	0	121.3
673	L	26	Very low	27	Very low	147 Å²	147	137.1 Å²	137.1	77%	0.77	74%	0.735	S	S	*	*			trans	50.8	125.8	140.1	-74.8	159.5	0	0	0	123.2
674	N	23.4	Very low	26.7	Very low	121 Å²	121	139.4 Å²	139.4	65%	0.647	74%	0.742	S	S	*	*			trans	26.6	136.2	135.8	-76	36.5	0	0	0	122.2
675	E	26.1	Very low	26.4	Very low	158 Å²	158	137.4 Å²	137.4	74%	0.738	74%	0.74	S	S	*	*			trans	70.8	126.4	144.6	-66.6	160.1	-133.3	0	0	116
676	L	25.8	Very low	26	Very low	146 Å²	146	138.8 Å²	138.8	76%	0.764	74%	0.741	S	S	*	*			cis	-143.4	137.7	24.6	-68.4	164.8	0	0	0	113.4
677	Q	28.1	Very low	25.6	Very low	188 Å²	188	141 Å²	141	88%	0.879	75%	0.753	S	S	*	*			trans	-134.3	101.4	141.1	-78.9	-154.4	-86.5	0	0	107.5
678	T	25.4	Very low	25.5	Very low	91 Å²	91	142 Å²	142	56%	0.558	76%	0.757	S	S	*	*				65.1	93.5	87.2	65	0	0	0	0	115.5
679	N	24.4	Very low	25.3	Very low	150 Å²	150	143 Å²	143	80%	0.802	77%	0.773	S	S	*	*			trans	73.7	137.3	135.4	-55.1	-19.8	0	0	0	121.1
680	S	24.6	Very low	25.2	Very low	112 Å²	112	141 Å²	141	78%	0.783	77%	0.771	S	S	*	*			trans	58.3	101.1	161.7	-61.1	0	0	0	0	116
681	I	23.8	Very low	25.6	Very low	164 Å²	164	143.7 Å²	143.7	84%	0.841	78%	0.781	S	S	*	*				-156.1	131.7	62.8	-79.2	149.7	0	0	0	109.6
682	A	25.2	Very low	25.5	Very low	109 Å²	109	140.8 Å²	140.8	90%	0.901	77%	0.77	S	S	*	*			trans	-148.1	77.8	172.6	0	0	0	0	0	110.6
683	Q	25.3	Very low	25.5	Very low	171 Å²	171	141.1 Å²	141.1	80%	0.799	78%	0.776	S	S	*	*			trans	-137.4	138	176.8	-166	173.6	27	0	0	108.3
684	L	26.5	Very low	25.6	Very low	153 Å²	153	142.2 Å²	142.2	80%	0.801	78%	0.783	S	S	*	*			trans	69.3	119.8	-162.9	-44.2	175.4	0	0	0	110.6
685	S	22.6	Very low	25.8	Very low	107 Å²	107	143.5 Å²	143.5	75%	0.748	79%	0.789	S	S	*	*			cis	62.1	103.2	36.6	-46	0	0	0	0	113.7
686	I	25.9	Very low	25.8	Very low	160 Å²	160	143.8 Å²	143.8	82%	0.821	79%	0.794	S	S	*	*			trans	-172	138.4	141.5	-102	155.2	0	0	0	108
687	D	22.3	Very low	26	Very low	149 Å²	149	144.7 Å²	144.7	80%	0.797	80%	0.799	S	S	*	*			trans	-61.5	165.3	167.4	-68.1	-80.8	0	0	0	111
688	I	26.3	Very low	26.2	Very low	159 Å²	159	141.9 Å²	141.9	82%	0.815	79%	0.794	S	S	*	*				-177.1	134.3	126	-95.4	150.9	0	0	0	110
689	S	24.6	Very low	26.5	Very low	108 Å²	108	141.7 Å²	141.7	76%	0.755	80%	0.802	S	S	*	*			trans	-80.4	119.3	166.1	52.4	0	0	0	0	110.9
690	E	25.5	Very low	26.7	Very low	148 Å²	148	141.8 Å²	141.8	69%	0.692	80%	0.803	S	S	*	*			trans	-175.8	132.9	136.7	-111.7	176.4	-162.5	0	0	113.3	L692	E690-L692 HydrophobicContact CB-CB 4.05Å; E690-L692 HydrophobicContact CG-CB 4.15Å; E690-L692 PolarHBondContact O-N 3.39Å; E690-L692 VanDerWaalsContact O-N 3.17Å
691	P	32.7	Very low	27	Very low	141 Å²	141	145.3 Å²	145.3	92%	0.916	81%	0.807	S	S	*	*			trans	-85.4	59.5	164.8	36.4	-33.6	0	0	0	110.4
692	L	24.8	Very low	27.3	Very low	118 Å²	118	145.5 Å²	145.5	62%	0.618	80%	0.804	S	S	*	*			trans	-136.1	37	-169.1	-135	165.3	0	0	0	114.5	E690	E690-L692 HydrophobicContact CB-CB 4.05Å; E690-L692 HydrophobicContact CG-CB 4.15Å; E690-L692 PolarHBondContact O-N 3.39Å; E690-L692 VanDerWaalsContact O-N 3.17Å
693	L	26.4	Very low	27.5	Very low	164 Å²	164	147.5 Å²	147.5	86%	0.859	80%	0.795	S	S	*	*			trans	-142.7	58.9	166.2	-154.6	73.3	0	0	0	113.5
694	N	29.1	Very low	27.7	Very low	170 Å²	170	147 Å²	147	91%	0.909	79%	0.793	S	S	*	*	S	Bend	trans	-141.4	45.3	159.1	-140.6	-4.9	0	0	0	111.5
695	L	26.3	Very low	27.7	Very low	147 Å²	147	145 Å²	145	77%	0.77	79%	0.788	S	S	*	*	S	Bend	trans	-141.8	144.1	172.8	-158.7	73	0	0	0	107.4
696	I	26.7	Very low	28.1	Very low	164 Å²	164	145.8 Å²	145.8	84%	0.841	79%	0.788	S	S	*	*	S	Bend	trans	73.6	56.5	-175.1	-39	177.1	0	0	0	114.8
697	L	30.5	Very low	28.2	Very low	166 Å²	166	142.9 Å²	142.9	87%	0.869	77%	0.774	S	S	*	*	S	Bend	trans	-169.5	113	147	-99.1	172.7	0	0	0	105.5
698	T	32.2	Very low	28.5	Very low	128 Å²	128	142.3 Å²	142.3	79%	0.785	77%	0.771	S	S	*	*			cis	-131.9	168.1	4.9	41.3	0	0	0	0	111.4
699	A	30.2	Very low	28.5	Very low	87 Å²	87	139.3 Å²	139.3	72%	0.719	76%	0.764	S	S	*	*			trans	-124.1	152	168.8	0	0	0	0	0	110.6
700	N	29.5	Very low	28.6	Very low	153 Å²	153	139.8 Å²	139.8	82%	0.818	77%	0.767	S	S	*	*			trans	69.4	133.8	-162.5	-50.8	-50.2	0	0	0	112.7
701	Q	31.1	Very low	28.6	Very low	186 Å²	186	140.2 Å²	140.2	87%	0.869	77%	0.772	S	S	*	*			cis	-121.4	175.8	14.6	-67.9	176.4	-11.3	0	0	113.2
702	Q	29.5	Very low	28.2	Very low	167 Å²	167	140.5 Å²	140.5	78%	0.78	77%	0.765	S	S	*	*			trans	-64.4	163.9	177	-64.3	149.1	-96.7	0	0	111.2
703	E	29.6	Very low	28.4	Very low	152 Å²	152	140.5 Å²	140.5	71%	0.71	78%	0.775	S	S	*	*			cis	-160.9	173.3	31.4	-155.4	158.6	-106.4	0	0	112.8
704	Q	29.1	Very low	28.4	Very low	161 Å²	161	137.4 Å²	137.4	75%	0.752	77%	0.767	S	S	*	*			trans	73.9	133	176.3	-58.1	-62.6	-23.5	0	0	118
705	P	27.1	Very low	28.3	Very low	109 Å²	109	136.6 Å²	136.6	71%	0.708	76%	0.762	S	S	*	*			trans	-95.9	131.8	-177.9	35.8	-31.7	0	0	0	113.5
706	V	31.7	Very low	28.3	Very low	124 Å²	124	135.1 Å²	135.1	75%	0.752	76%	0.755	S	S	*	*			trans	-101.7	118.8	165.1	177	0	0	0	0	109.3	N708	V706-N708 PolarHBondContact O-N 3.42Å; V706-N708 VanDerWaalsContact O-N 3.1Å
707	I	28.1	Very low	28.3	Very low	100 Å²	100	135.6 Å²	135.6	51%	0.513	76%	0.757	S	S	.	*			trans	-81.4	87.8	-179.8	-54.2	176.6	0	0	0	109.3	S709 Y977	I707-S709 PolarHBondContact O-N 3.24Å; I707-Y977 HydrophobicContact CD1-CD2 3.7Å; I707-Y977 HydrophobicContact CD1-CE2 3.55Å; I707-Y977 HydrophobicContact CG2-CE2 4.04Å
708	N	28.8	Very low	27.9	Very low	137 Å²	137	131.7 Å²	131.7	73%	0.733	74%	0.744	S	S	*	*			trans	-92.1	90.8	172.6	-87.9	-9.2	0	0	0	111.5	V706 S710	V706-N708 PolarHBondContact O-N 3.42Å; V706-N708 VanDerWaalsContact O-N 3.1Å; N708-S710 PolarHBondContact O-N 2.84Å
709	S	24.4	Very low	27.6	Very low	96 Å²	96	133.8 Å²	133.8	67%	0.671	75%	0.745	S	S	*	*			trans	-65	121.1	158.1	53.9	0	0	0	0	109.8	I707	I707-S709 PolarHBondContact O-N 3.24Å
710	S	27.6	Very low	27.4	Very low	117 Å²	117	137.5 Å²	137.5	82%	0.818	75%	0.752	S	S	*	*			trans	-137.6	49	171.2	-66.5	0	0	0	0	111.1	N708	N708-S710 PolarHBondContact O-N 2.84Å
711	I	25	Very low	27.3	Very low	158 Å²	158	136.5 Å²	136.5	81%	0.81	75%	0.751	S	S	*	*			trans	-108.2	146	160.1	-56.3	175.9	0	0	0	105.5
712	L	25.1	Very low	27.2	Very low	146 Å²	146	132.9 Å²	132.9	76%	0.764	74%	0.742	S	S	*	*			trans	77	81.2	-171.9	-54.3	170.7	0	0	0	115.7
713	S	29.4	Very low	27	Very low	119 Å²	119	131 Å²	131	83%	0.832	75%	0.747	S	S	*	*			trans	-114.1	21.7	146.2	57.5	0	0	0	0	112.4	L715	S713-L715 PolarHBondContact O-N 3.39Å
714	S	25	Very low	26.9	Very low	98 Å²	98	133.4 Å²	133.4	69%	0.685	75%	0.751	S	S	*	*			trans	-73.1	69.5	160.8	59.2	0	0	0	0	109.6	D716	S714-D716 PolarHBondContact O-N 2.95Å
715	L	28.2	Very low	26.8	Very low	153 Å²	153	130.9 Å²	130.9	80%	0.801	75%	0.751	S	S	*	*			trans	-77.6	115.8	-178.5	-143.3	76.8	0	0	0	110.1	S713 I717	S713-L715 PolarHBondContact O-N 3.39Å; L715-I717 PolarHBondContact O-N 3.39Å; L715-I717 VanDerWaalsContact O-N 3.13Å
716	D	26.1	Very low	26.8	Very low	116 Å²	116	130.8 Å²	130.8	62%	0.62	75%	0.745	S	S	*	*			trans	-68.9	101.7	-177.8	-175.1	-6.6	0	0	0	110.9	S714 S718	S714-D716 PolarHBondContact O-N 2.95Å; D716-S718 VanDerWaalsContact CG-OG 3.3Å; D716-S718 PolarHBondContact O-N 3.46Å; D716-S718 WeakPolarHBondContact OD1-CB 3.39Å; D716-S718 PolarHBondContact OD1-N 2.94Å; D716-S718 PolarHBondContact OD1-OG 2.69Å; D716-S718 PolarHBondContact OD2-OG 2.7Å
717	I	25.9	Very low	26.4	Very low	174 Å²	174	132 Å²	132	89%	0.892	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	63.6	176.8	-48	-177.3	0	0	0	109.8	L715	L715-I717 PolarHBondContact O-N 3.39Å; L715-I717 VanDerWaalsContact O-N 3.13Å
718	S	23.3	Very low	26.4	Very low	84 Å²	84	133.6 Å²	133.6	59%	0.587	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.9	9.5	176.6	75.7	0	0	0	0	116.7	D716	D716-S718 VanDerWaalsContact CG-OG 3.3Å; D716-S718 PolarHBondContact O-N 3.46Å; D716-S718 WeakPolarHBondContact OD1-CB 3.39Å; D716-S718 PolarHBondContact OD1-N 2.94Å; D716-S718 PolarHBondContact OD1-OG 2.69Å; D716-S718 PolarHBondContact OD2-OG 2.7Å
719	Q	25.2	Very low	26.5	Very low	172 Å²	172	133.4 Å²	133.4	80%	0.804	75%	0.751	S	S	*	*			trans	-132.4	67.6	177.7	-74.2	-162.3	83.1	0	0	116.1
720	L	25.7	Very low	26.8	Very low	166 Å²	166	135.4 Å²	135.4	87%	0.869	75%	0.754	S	S	*	*			trans	-146.6	91.3	153.2	-87.9	-172.4	0	0	0	112.6
721	T	27.8	Very low	26.9	Very low	131 Å²	131	137 Å²	137	80%	0.804	75%	0.748	S	S	*	*			trans	162	134.5	145.4	33.5	0	0	0	0	107.5
722	V	28.6	Very low	27	Very low	110 Å²	110	134.9 Å²	134.9	67%	0.667	74%	0.739	S	S	*	*			cis	-150.6	139.1	43.8	165.8	0	0	0	0	110.3	Y724	V722-Y724 HydrophobicContact CG1-CD2 4.33Å
723	S	26.4	Very low	27.1	Very low	129 Å²	129	134.1 Å²	134.1	90%	0.902	74%	0.736	S	S	*	*			trans	-138.2	110.6	143.5	-78.6	0	0	0	0	106.6
724	Y	26.9	Very low	27	Very low	201 Å²	201	136.2 Å²	136.2	79%	0.788	74%	0.737	S	S	*	*			trans	-131	126.4	-176	-108.5	-71.3	0	0	0	110.3	V722	V722-Y724 HydrophobicContact CG1-CD2 4.33Å
725	S	27.3	Very low	27.1	Very low	108 Å²	108	138 Å²	138	76%	0.755	74%	0.739	S	S	*	*			trans	170.8	133.9	145.3	-93.2	0	0	0	0	107.6
726	N	25.8	Very low	27.1	Very low	107 Å²	107	135.9 Å²	135.9	57%	0.572	73%	0.732	S	S	*	*			cis	-151.2	171.8	-1.2	-111.8	25	0	0	0	109
727	E	24.1	Very low	27.2	Very low	150 Å²	150	136.7 Å²	136.7	70%	0.701	74%	0.736	S	S	*	*			trans	31.7	130.1	139.3	-66.7	143.2	-168.9	0	0	118.8
728	D	27.1	Very low	27.3	Very low	134 Å²	134	132.7 Å²	132.7	72%	0.717	72%	0.724	S	S	*	*			cis	-165.1	176.5	27.5	-104.4	-29.9	0	0	0	114
729	N	31.7	Very low	27.6	Very low	133 Å²	133	136.7 Å²	136.7	71%	0.711	73%	0.734	S	S	*	*			trans	87.5	111.4	155	-65	-58	0	0	0	121.8
730	N	30.1	Very low	27.6	Very low	137 Å²	137	137.3 Å²	137.3	73%	0.733	74%	0.737	S	S	*	*			trans	66.5	117.3	132.6	-65.1	-21.6	0	0	0	122.8
731	H	29.6	Very low	27.9	Very low	150 Å²	150	137 Å²	137	69%	0.694	74%	0.736	S	S	*	*				29.5	140.4	107	-72.2	-11.5	0	0	0	120.1
732	N	27.3	Very low	28	Very low	114 Å²	114	132.6 Å²	132.6	61%	0.61	72%	0.716	S	S	*	*			cis	-165.9	166.1	-7.9	-122.1	17.4	0	0	0	110.7
733	N	27.4	Very low	28.1	Very low	131 Å²	131	135.9 Å²	135.9	70%	0.701	72%	0.722	S	S	*	*			trans	39.4	118.6	146.6	-58.5	8	0	0	0	121
734	N	26.9	Very low	28.2	Very low	163 Å²	163	137.3 Å²	137.3	87%	0.872	71%	0.712	S	S	*	*				-70.7	144.5	128.2	-76.2	-6.8	0	0	0	108.1
735	N	27.1	Very low	28.3	Very low	136 Å²	136	134.7 Å²	134.7	73%	0.727	71%	0.71	S	S	*	*			cis	-161.1	172.1	-3.6	-167.6	13.2	0	0	0	109.2
736	V	29.9	Very low	28.2	Very low	107 Å²	107	135.3 Å²	135.3	65%	0.648	71%	0.705	S	S	*	*			trans	67.7	100.4	165.1	-173	0	0	0	0	114.5
737	N	28	Very low	28.4	Very low	133 Å²	133	135.2 Å²	135.2	71%	0.711	71%	0.713	S	S	*	*				72.5	106.8	85.9	-67.9	9.9	0	0	0	111.9
738	S	28	Very low	28.6	Very low	91 Å²	91	132.7 Å²	132.7	64%	0.636	71%	0.711	S	S	*	*				81	161.6	86.5	63.6	0	0	0	0	112.6
739	E	28	Very low	28.7	Very low	168 Å²	168	137.5 Å²	137.5	79%	0.785	72%	0.719	S	S	*	*			cis	-117.7	-177.7	3.2	-76.1	81.8	-119.9	0	0	112.9
740	E	26.8	Very low	28.6	Very low	185 Å²	185	141.1 Å²	141.1	86%	0.864	73%	0.725	S	S	*	*			trans	-159.2	165.6	146	-129.9	170.1	-154.2	0	0	110.8
741	D	31.6	Very low	28.6	Very low	160 Å²	160	143.8 Å²	143.8	86%	0.856	73%	0.73	S	S	*	*			trans	61.9	105.5	-176.9	-62	-27.7	0	0	0	116.7
742	G	30	Very low	28.5	Very low	37 Å²	37	142.3 Å²	142.3	38%	0.381	73%	0.727	S	S	.	*			cis	117.1	140.1	1.9	0	0	0	0	0	113.9
743	F	29.3	Very low	28.6	Very low	180 Å²	180	142.5 Å²	142.5	79%	0.789	73%	0.733	S	S	*	*			trans	170.7	106.8	157.5	-97	-64.1	0	0	0	109.8	N645 E646	N645-F743 PolarHBondContact ND2-N 2.8Å; N645-F743 VanDerWaalsContact ND2-N 3.17Å; E646-F743 PolarHBondContact OE1-N 3.41Å; E646-F743 VanDerWaalsContact OE1-N 3.12Å
744	F	29.4	Very low	28.6	Very low	159 Å²	159	140.9 Å²	140.9	70%	0.697	73%	0.732	S	S	*	*				51.8	140.4	71.6	-89.9	-128.5	0	0	0	116.6
745	I	28	Very low	28.7	Very low	145 Å²	145	140.7 Å²	140.7	74%	0.744	73%	0.725	S	S	*	*			cis	-170.9	172.1	-22.5	43.4	170.1	0	0	0	106.6
746	D	26.1	Very low	28.9	Very low	121 Å²	121	141 Å²	141	65%	0.647	72%	0.722	S	S	*	*			cis	-161	160	-17.6	157.5	62	0	0	0	107.6	S748	D746-S748 WeakPolarHBondContact OD2-CB 3.31Å
747	S	29.5	Very low	28.9	Very low	106 Å²	106	142.7 Å²	142.7	74%	0.741	73%	0.727	S	S	*	*			trans	-172.2	116.7	146.5	-78.9	0	0	0	0	110.3
748	S	28.1	Very low	29	Very low	96 Å²	96	144.5 Å²	144.5	67%	0.671	73%	0.733	S	S	*	*			cis	77.8	140.5	45	92.2	0	0	0	0	115	D746	D746-S748 WeakPolarHBondContact OD2-CB 3.31Å
749	R	30.2	Very low	29.6	Very low	235 Å²	235	144.1 Å²	144.1	89%	0.887	73%	0.729	S	S	*	*			trans	-124.4	89.4	-162.8	-160.3	-166.1	-62.5	-177	3.8	114.1
750	Y	29.7	Very low	29.9	Very low	209 Å²	209	143.4 Å²	143.4	82%	0.82	73%	0.725	S	S	*	*			trans	47.4	109.6	158.8	-82.8	-87.7	0	0	0	119.6
751	F	29.9	Very low	30.1	Very low	193 Å²	193	142.5 Å²	142.5	85%	0.846	72%	0.721	S	S	*	*				-159.9	120.4	108.9	-117	-76.7	0	0	0	113.5
752	N	27.6	Very low	30.2	Very low	120 Å²	120	142 Å²	142	64%	0.642	72%	0.718	S	S	*	*			trans	56	106.2	154.5	-75.2	4.1	0	0	0	124.8
753	T	28.6	Very low	30.4	Very low	117 Å²	117	146 Å²	146	72%	0.718	74%	0.735	S	S	*	*				75.1	102.9	121.4	59.1	0	0	0	0	123.7
754	S	29.2	Very low	30.6	Very low	97 Å²	97	144.4 Å²	144.4	68%	0.678	74%	0.735	S	S	*	*				102.1	123.4	106.6	-67	0	0	0	0	123.4
755	E	29	Very low	30.9	Very low	159 Å²	159	142.3 Å²	142.3	74%	0.743	74%	0.735	S	S	*	*			trans	73.6	144.4	137.2	-64.8	-175	136.2	0	0	121
756	Q	30.8	Very low	31.1	Very low	142 Å²	142	143.3 Å²	143.3	66%	0.664	74%	0.736	S	S	*	*			cis	-170.8	160.5	-17.5	-119	174.1	40.1	0	0	112.8
757	L	29.7	Very low	31.4	Very low	143 Å²	143	142.4 Å²	142.4	75%	0.749	74%	0.74	S	S	*	*			trans	67.4	101.4	148.1	-65.4	164.7	0	0	0	125.1
758	M	28.8	Very low	31.6	Very low	171 Å²	171	143.2 Å²	143.2	84%	0.842	74%	0.74	S	S	*	*				26.6	168.7	104.7	-69.7	-158.8	108.4	0	0	123.9
759	P	42.4	Very low	31.8	Very low	84 Å²	84	146.4 Å²	146.4	55%	0.545	74%	0.744	S	S	.	*			cis	-145.5	-143.5	-37.3	44.4	-25.1	0	0	0	115.7
760	H	32.8	Very low	31.9	Very low	152 Å²	152	143.8 Å²	143.8	70%	0.704	74%	0.74	S	S	*	*			trans	91.3	158.1	172.2	-51.2	-80.3	0	0	0	117.9
761	E	32.2	Very low	32	Very low	166 Å²	166	138.5 Å²	138.5	78%	0.776	73%	0.733	S	S	*	*			cis	-177.6	168	-22	-97.5	168.2	-155.6	0	0	108.2
762	D	33.3	Very low	31.9	Very low	149 Å²	149	138.3 Å²	138.3	80%	0.797	74%	0.735	S	S	*	*			cis	-172.2	-164.7	-34.7	-157.5	79.9	0	0	0	111.1
763	V	33.1	Very low	32.4	Very low	122 Å²	122	137.3 Å²	137.3	74%	0.739	74%	0.735	S	S	*	*			trans	94.6	107.5	156.6	-167.5	0	0	0	0	124.1
764	D	33.4	Very low	32.4	Very low	147 Å²	147	139.3 Å²	139.3	79%	0.786	74%	0.74	S	S	*	*				42.6	165.2	125.2	-128.5	11.8	0	0	0	123.7
765	V	36.3	Very low	32.3	Very low	115 Å²	115	139.3 Å²	139.3	70%	0.697	74%	0.74	S	S	*	*			cis	-158.1	-174	7.6	75.7	0	0	0	0	113.6
766	E	31.9	Very low	32.4	Very low	165 Å²	165	142.7 Å²	142.7	77%	0.771	75%	0.747	S	S	*	*			trans	-101.2	169	-169.4	-46	165.3	102.1	0	0	118.7
767	S	33.7	Very low	32.5	Very low	103 Å²	103	139.9 Å²	139.9	72%	0.72	76%	0.756	S	S	*	*				157.9	125.8	117.3	-76.5	0	0	0	0	120
768	T	33.9	Very low	32.6	Very low	123 Å²	123	135.9 Å²	135.9	76%	0.755	75%	0.75	S	S	*	*			trans	12.5	163.5	144.3	67.3	0	0	0	0	124.2
769	H	31.9	Very low	32.9	Very low	162 Å²	162	135.2 Å²	135.2	75%	0.75	75%	0.75	S	S	*	*			cis	-167.1	175.4	41.1	-139.4	-81.7	0	0	0	116.2
770	F	32.1	Very low	32.7	Very low	180 Å²	180	137.8 Å²	137.8	79%	0.789	76%	0.759	S	S	*	*			trans	-56.5	-176.1	178.6	-72.4	-122.1	0	0	0	118.5
771	S	30.7	Very low	32.9	Very low	98 Å²	98	134.7 Å²	134.7	69%	0.685	75%	0.745	S	S	*	*			cis	174.6	125.8	-41.5	-73.1	0	0	0	0	111.8
772	E	28	Very low	33.1	Very low	190 Å²	190	129.1 Å²	129.1	89%	0.888	73%	0.732	S	S	*	*			trans	58.3	168.1	164.6	-96.9	-174.8	-146	0	0	120.4
773	P	38.4	Very low	33.4	Very low	98 Å²	98	128.1 Å²	128.1	64%	0.636	72%	0.723	S	S	*	*			cis	-134.1	-169.4	-13.5	29.2	-4.9	0	0	0	115.8
774	I	27.8	Very low	33.7	Very low	159 Å²	159	130.4 Å²	130.4	82%	0.815	72%	0.723	S	S	*	*			trans	79	124.3	160.5	-30.7	-179.7	0	0	0	119.9
775	S	28.7	Very low	33.8	Very low	98 Å²	98	125.9 Å²	125.9	69%	0.685	71%	0.711	S	S	*	*			trans	127.1	110.2	130.9	-164.5	0	0	0	0	119.6
776	Y	30.5	Very low	33.9	Very low	229 Å²	229	125.3 Å²	125.3	90%	0.898	70%	0.704	S	S	*	*			trans	64.5	124.7	147	-89	-104.6	0	0	0	122.9
777	G	32.1	Very low	33.9	Very low	83 Å²	83	120.3 Å²	120.3	86%	0.856	70%	0.697	S	S	*	*			trans	85.3	138.2	155.7	0	0	0	0	0	116.1
778	G	32.1	Very low	33.9	Very low	60 Å²	60	119 Å²	119	62%	0.619	68%	0.682	S	S	*	*			cis	167.8	141.7	-8	0	0	0	0	0	111.5
779	D	35.2	Very low	33.7	Very low	156 Å²	156	118.2 Å²	118.2	83%	0.834	68%	0.682	S	S	*	*			trans	63.6	139.6	155.2	-34.5	-27.7	0	0	0	117.5
780	D	38.2	Very low	33.6	Very low	138 Å²	138	118.6 Å²	118.6	74%	0.738	68%	0.684	S	S	*	*			cis	-159.6	167.8	-4	-124.4	-19.8	0	0	0	111.8
781	E	37.3	Very low	33.4	Very low	88 Å²	88	115.7 Å²	115.7	41%	0.411	68%	0.676	S	S	.	*			trans	19.5	148.3	160.3	-45.6	-65.3	55.4	0	0	122.1	S1054 K1055	E781-S1054 VanDerWaalsContact OE2-CB 3.31Å; E781-S1054 WeakPolarHBondContact OE2-CB 3.42Å; E781-S1054 PolarHBondContact OE2-OG 3.47Å; E781-K1055 WeakPolarHBondContact OE1-CE 3.45Å; E781-K1055 IonicContact OE1-NZ 3.96Å; E781-K1055 PolarHBondContact OE1-NZ 3.09Å
782	G	37.6	Very low	33.5	Very low	49 Å²	49	117.8 Å²	117.8	51%	0.505	68%	0.68	S	S	.	*			cis	126.5	143.6	11.1	0	0	0	0	0	111.4
783	E	39.2	Very low	33.6	Very low	128 Å²	128	114.5 Å²	114.5	60%	0.598	67%	0.668	S	S	*	*			cis	-169.8	153.9	-10.9	-135.7	157.8	-89.9	0	0	111.2	K1055	E783-K1055 WeakPolarHBondContact OE1-CE 3.32Å; E783-K1055 IonicContact OE1-NZ 3.52Å; E783-K1055 PolarHBondContact OE1-NZ 3.17Å
784	F	39	Very low	33.4	Very low	169 Å²	169	116.4 Å²	116.4	74%	0.741	67%	0.673	S	S	*	*			trans	75	164.2	169.4	-68.8	-76	0	0	0	123.3	L1040	F784-L1040 HydrophobicContact CD1-CD1 4.35Å
785	G	36	Very low	33.6	Very low	53 Å²	53	115 Å²	115	55%	0.546	67%	0.667	S	S	.	*			trans	-159.8	-155.6	-177.8	0	0	0	0	0	112.6
786	D	36.9	Very low	33.8	Very low	102 Å²	102	116.6 Å²	116.6	55%	0.545	67%	0.668	S	S	.	*			trans	68.4	141.2	-161.9	-63.7	-7.8	0	0	0	113.2	K1039	D786-K1039 WeakPolarHBondContact OD2-CB 3.34Å; D786-K1039 PolarHBondContact OD2-N 3.38Å; D786-K1039 VanDerWaalsContact OD2-N 3.09Å
787	G	33.6	Very low	34.1	Very low	60 Å²	60	113.6 Å²	113.6	62%	0.619	67%	0.668	S	S	*	*			cis	176.5	174	-5.1	0	0	0	0	0	114.1	S1038	G787-S1038 WeakPolarHBondContact CA-OG 3.44Å
788	D	32.2	Very low	34.3	Very low	77 Å²	77	113.1 Å²	113.1	41%	0.412	66%	0.663	S	S	.	*			trans	54.9	106.9	160.8	-64.6	-32.2	0	0	0	123.8	K1037 S1038	D788-K1037 PolarHBondContact OD1-N 2.97Å; D788-K1037 VanDerWaalsContact OD2-C 3.32Å; D788-K1037 PolarHBondContact OD2-N 2.88Å; D788-S1038 WeakPolarHBondContact OD2-CB 3.36Å; D788-S1038 PolarHBondContact OD2-N 2.65Å; D788-S1038 PolarHBondContact OD2-OG 2.87Å
789	S	30.7	Very low	34.2	Very low	106 Å²	106	114.1 Å²	114.1	74%	0.741	67%	0.673	S	S	*	*				91.9	132	119.1	77	0	0	0	0	124
790	E	28.9	Very low	34.2	Very low	170 Å²	170	110.6 Å²	110.6	79%	0.794	67%	0.673	S	S	*	*			trans	66.6	134.1	149	-71.7	-158.1	-174.2	0	0	125
791	N	27.8	Very low	34.2	Very low	118 Å²	118	107.1 Å²	107.1	63%	0.631	67%	0.67	S	S	*	*			trans	62.4	93.9	148.4	-76.1	-55.1	0	0	0	120.2
792	N	32.9	Very low	34.2	Very low	143 Å²	143	110.6 Å²	110.6	77%	0.765	69%	0.692	S	S	*	*				-166.2	124	110.4	-93.8	-62.8	0	0	0	108
793	N	31.1	Very low	34.3	Very low	121 Å²	121	112 Å²	112	65%	0.647	70%	0.699	S	S	*	*				67.2	132.9	81.7	-75.2	-47.9	0	0	0	114.5
794	N	34.3	Very low	34.2	Very low	137 Å²	137	113.7 Å²	113.7	73%	0.733	71%	0.712	S	S	*	*			trans	78.6	123.3	166.3	-56.3	-11	0	0	0	114.1
795	N	31.9	Very low	34	Very low	130 Å²	130	114 Å²	114	70%	0.695	72%	0.716	S	S	*	*				70.4	130.1	68.5	-75	61.5	0	0	0	111.3
796	D	32.3	Very low	34.1	Very low	132 Å²	132	116.9 Å²	116.9	71%	0.706	72%	0.722	S	S	*	*			cis	-150.1	150.5	-1.3	-83.9	-45.7	0	0	0	110.2
797	D	36.5	Very low	34	Very low	165 Å²	165	121.4 Å²	121.4	88%	0.882	74%	0.74	S	S	*	*			trans	-160.9	131.9	140.8	-97.3	-32.2	0	0	0	105.6
798	G	36.5	Very low	34.1	Very low	74 Å²	74	126.7 Å²	126.7	76%	0.763	75%	0.746	S	S	*	*			cis	97.8	120.9	20.9	0	0	0	0	0	109.3
799	G	30.3	Very low	34.2	Very low	81 Å²	81	129.7 Å²	129.7	84%	0.835	76%	0.761	S	S	*	*			cis	168.7	150.5	-2.9	0	0	0	0	0	110
800	G	36	Very low	34.4	Very low	81 Å²	81	131.6 Å²	131.6	84%	0.835	76%	0.763	S	S	*	*			trans	114.3	133.2	-175.7	0	0	0	0	0	111.8
801	G	36.4	Very low	34.6	Very low	65 Å²	65	130.9 Å²	130.9	67%	0.67	76%	0.764	S	S	*	*			cis	123.3	150.3	8.8	0	0	0	0	0	110.8
802	D	37.7	Very low	35.1	Very low	161 Å²	161	133.1 Å²	133.1	86%	0.861	78%	0.776	S	S	*	*			cis	-150.6	172.6	-6.3	-57.9	-66.3	0	0	0	106.1
803	A	40.5	Very low	35.4	Very low	79 Å²	79	133.2 Å²	133.2	65%	0.653	78%	0.777	S	S	*	*			cis	-156.2	-169.6	8.7	0	0	0	0	0	107.7
804	D	36.2	Very low	35.6	Very low	163 Å²	163	131.8 Å²	131.8	87%	0.872	77%	0.769	S	S	*	*			cis	-155.2	172.5	-1.5	-122.3	-29.9	0	0	0	109.4
805	E	34.8	Very low	35.7	Very low	176 Å²	176	130.9 Å²	130.9	82%	0.822	76%	0.761	S	S	*	*			trans	-91.2	139.4	-169.7	-79.3	-165.9	111.3	0	0	117.8
806	V	38.1	Very low	35.9	Very low	113 Å²	113	127.4 Å²	127.4	69%	0.685	74%	0.744	S	S	*	*				44.2	121.2	128.1	-173.7	0	0	0	0	120.6
807	E	35.4	Very low	36.1	Very low	197 Å²	197	123.3 Å²	123.3	92%	0.921	73%	0.732	S	S	*	*				-139.4	-174.8	126.5	-138.8	164.7	-145.3	0	0	111
808	K	36.5	Very low	36	Very low	171 Å²	171	123.4 Å²	123.4	74%	0.743	73%	0.728	S	S	*	*			trans	-157.5	162.2	-147.1	-150.2	-173.2	-175.7	-177.8	0	112.1
809	I	34.2	Very low	35.9	Very low	140 Å²	140	125.8 Å²	125.8	72%	0.718	72%	0.723	S	S	*	*			trans	74.7	147.3	168.8	-58.3	161.2	0	0	0	111
810	D	34.2	Very low	36.2	Very low	147 Å²	147	125.6 Å²	125.6	79%	0.786	72%	0.721	S	S	*	*			cis	-136.3	-174.9	18	-126.3	-33.4	0	0	0	112.6
811	D	33.7	Very low	36.3	Very low	154 Å²	154	125.6 Å²	125.6	82%	0.824	72%	0.721	S	S	*	*			trans	-75.9	140.6	164.8	-65.2	-62.1	0	0	0	111.7
812	D	38.5	Very low	36	Very low	166 Å²	166	129.7 Å²	129.7	89%	0.888	73%	0.728	S	S	*	*			trans	-160.4	154.1	157.4	-131.4	-21.1	0	0	0	112.1
813	D	37.3	Very low	36.1	Very low	145 Å²	145	128.2 Å²	128.2	78%	0.775	72%	0.724	S	S	*	*			trans	-93.8	146.5	-172.5	-79.1	-55.5	0	0	0	114.4
814	D	35.9	Very low	35.7	Very low	90 Å²	90	127.5 Å²	127.5	48%	0.481	72%	0.724	S	S	.	*			trans	53.1	116.1	137.6	-73.6	-8.6	0	0	0	124.7	R1473	D814-R1473 IonicContact OD1-CZ 3.24Å; D814-R1473 IonicContact OD1-NE 3.15Å; D814-R1473 PolarHBondContact OD1-NE 2.79Å; D814-R1473 IonicContact OD1-NH1 3.66Å; D814-R1473 IonicContact OD1-NH2 2.86Å; D814-R1473 PolarHBondContact OD1-NH2 3.45Å; D814-R1473 IonicContact OD2-CZ 3.98Å; D814-R1473 IonicContact OD2-NE 2.8Å; D814-R1473 IonicContact OD2-NH1 2.68Å; D814-R1473 IonicContact OD2-NH2 2.75Å; D814-R1473 PolarHBondContact OD2-NH2 3.18Å
815	Q	35.8	Very low	35.7	Very low	119 Å²	119	128.7 Å²	128.7	56%	0.556	73%	0.725	S	S	*	*				105.7	119.2	114.2	-82.8	-158.2	-37.7	0	0	124.6
816	V	36.1	Very low	35.6	Very low	57 Å²	57	127.4 Å²	127.4	35%	0.345	72%	0.723	S	S	.	*				87	138.2	120.3	169.4	0	0	0	0	122.6	K1472	V816-K1472 HydrophobicContact CG2-CG 4.49Å
817	G	38.2	Very low	35.4	Very low	45 Å²	45	129.7 Å²	129.7	46%	0.464	73%	0.732	S	S	.	*			trans	131	81.6	158.3	0	0	0	0	0	111.8	I1471	G817-I1471 WeakPolarHBondContact O-CD1 3.39Å
818	E	33.1	Very low	35.1	Very low	167 Å²	167	127.9 Å²	127.9	78%	0.78	73%	0.728	S	S	*	*				-131.2	151.3	60.4	-61.3	162.2	171	0	0	111.2	K1472	E818-K1472 WeakPolarHBondContact O-CE 3.46Å; E818-K1472 PolarHBondContact O-NZ 3.07Å
819	D	35.7	Very low	34.9	Very low	124 Å²	124	128.5 Å²	128.5	66%	0.663	73%	0.734	S	S	*	*			cis	78.9	137.5	-19.6	-146.8	3.5	0	0	0	119.1
820	G	36.5	Very low	34.7	Very low	78 Å²	78	129 Å²	129	80%	0.804	73%	0.733	S	S	*	*			trans	141	73.2	-168.4	0	0	0	0	0	112.5
821	G	36.6	Very low	34.4	Very low	80 Å²	80	128.8 Å²	128.8	83%	0.825	73%	0.727	S	S	*	*			trans	174.9	38.5	178.5	0	0	0	0	0	117.2
822	D	30.5	Very low	34.2	Very low	152 Å²	152	126.7 Å²	126.7	81%	0.813	72%	0.72	S	S	*	*			trans	-103.4	113.6	175.4	174.8	36.4	0	0	0	111.9
823	V	39.4	Very low	33.9	Very low	129 Å²	129	125.6 Å²	125.6	78%	0.782	71%	0.714	S	S	*	*			trans	-156.4	128.2	158.5	-174	0	0	0	0	103.5
824	G	33.6	Very low	33.4	Very low	64 Å²	64	124.6 Å²	124.6	66%	0.66	71%	0.709	S	S	*	*				73.3	138.9	75.1	0	0	0	0	0	111.2
825	E	35.4	Very low	33.2	Very low	189 Å²	189	127 Å²	127	88%	0.883	72%	0.722	S	S	*	*			cis	-144.1	177.8	12.4	-64.8	175.5	133.3	0	0	110.6
826	D	32.7	Very low	32.9	Very low	149 Å²	149	129.1 Å²	129.1	80%	0.797	73%	0.732	S	S	*	*			trans	-87.4	-177.7	-176.2	-55.5	-90	0	0	0	114.6
827	D	33	Very low	32.7	Very low	161 Å²	161	132.3 Å²	132.3	86%	0.861	75%	0.747	S	S	*	*			trans	77.6	155.5	153.5	-65.6	-25.1	0	0	0	122.5
828	D	29.5	Very low	32.2	Very low	158 Å²	158	136 Å²	136	85%	0.845	76%	0.756	S	S	*	*			trans	-88.9	149.3	-177.5	-54.3	-82.1	0	0	0	113.5
829	E	32	Very low	32.1	Very low	184 Å²	184	136.3 Å²	136.3	86%	0.86	76%	0.758	S	S	*	*			trans	-174	116.7	140.3	-103.6	174.1	-163.5	0	0	107.9
830	E	30	Very low	31.9	Very low	152 Å²	152	135 Å²	135	71%	0.71	75%	0.751	S	S	*	*				78.3	139.6	86.8	-84.2	-135.5	107.4	0	0	117.3
831	Q	29.6	Very low	31.9	Very low	141 Å²	141	137.1 Å²	137.1	66%	0.659	74%	0.743	S	S	*	*			trans	61.3	101.1	149.2	-69.2	176.6	33.5	0	0	118.9
832	T	29	Very low	31.6	Very low	110 Å²	110	141.9 Å²	141.9	68%	0.675	74%	0.737	S	S	*	*				76.8	118.3	78	58.9	0	0	0	0	116.3
833	D	31.2	Very low	31.7	Very low	143 Å²	143	141.2 Å²	141.2	77%	0.765	73%	0.729	S	S	*	*			trans	-173.7	118.8	131.2	-90.9	-26.4	0	0	0	106.3
834	N	28.1	Very low	31.4	Very low	124 Å²	124	141.7 Å²	141.7	66%	0.663	72%	0.722	S	S	*	*				79.1	131.2	65.3	-70.8	-33.2	0	0	0	113.9
835	D	30.3	Very low	31.3	Very low	141 Å²	141	143 Å²	143	75%	0.754	72%	0.715	S	S	*	*			trans	63.7	145.3	161.5	-47.7	-24.4	0	0	0	117.9
836	E	30.4	Very low	31.1	Very low	163 Å²	163	142.2 Å²	142.2	76%	0.762	71%	0.708	S	S	*	*			cis	-159.7	-177.6	-12.4	-120.7	-179	160.1	0	0	108.6
837	D	31.7	Very low	30.9	Very low	125 Å²	125	140.6 Å²	140.6	67%	0.668	70%	0.698	S	S	*	*			trans	68.9	108.9	150.8	-86.6	1.4	0	0	0	123.8
838	N	28.2	Very low	30.8	Very low	123 Å²	123	138 Å²	138	66%	0.658	69%	0.693	S	S	*	*				80.9	140.5	120.5	-68.8	-41.5	0	0	0	125
839	E	31.4	Very low	31	Very low	173 Å²	173	137.8 Å²	137.8	81%	0.808	68%	0.684	S	S	*	*			trans	66.7	140.7	145.9	-76.9	-177.9	-174.8	0	0	120.4
840	D	31.9	Very low	30.9	Very low	96 Å²	96	136.1 Å²	136.1	51%	0.513	68%	0.675	S	S	.	*			cis	-155.8	-167.8	-13.7	-158.1	-12.6	0	0	0	108.8	R842	D840-R842 IonicContact OD1-CZ 2.73Å; D840-R842 IonicContact OD1-NE 3.19Å; D840-R842 PolarHBondContact OD1-NE 2.95Å; D840-R842 IonicContact OD1-NH2 2.81Å; D840-R842 PolarHBondContact OD1-NH2 3.3Å; D840-R842 IonicContact OD2-CZ 3.78Å; D840-R842 IonicContact OD2-NE 2.83Å; D840-R842 IonicContact OD2-NH2 2.72Å; D840-R842 PolarHBondContact OD2-NH2 3.09Å
841	D	34.6	Very low	30.9	Very low	122 Å²	122	134.7 Å²	134.7	65%	0.652	67%	0.668	S	S	*	*			trans	68.9	105.3	176.9	-80.6	-34.1	0	0	0	115.5
842	R	30.7	Very low	30.8	Very low	180 Å²	180	133.5 Å²	133.5	68%	0.679	67%	0.666	S	S	*	*			cis	59.1	137.4	49.9	-40.8	167.6	-165.5	-152.2	10.7	110.5	D840	D840-R842 IonicContact OD1-CZ 2.73Å; D840-R842 IonicContact OD1-NE 3.19Å; D840-R842 PolarHBondContact OD1-NE 2.95Å; D840-R842 IonicContact OD1-NH2 2.81Å; D840-R842 PolarHBondContact OD1-NH2 3.3Å; D840-R842 IonicContact OD2-CZ 3.78Å; D840-R842 IonicContact OD2-NE 2.83Å; D840-R842 IonicContact OD2-NH2 2.72Å; D840-R842 PolarHBondContact OD2-NH2 3.09Å
843	Q	33.3	Very low	30.7	Very low	138 Å²	138	137.9 Å²	137.9	65%	0.645	67%	0.672	S	S	*	*				-178	156	51.9	-121	149.6	102.6	0	0	106.1
844	Q	32.9	Very low	30.6	Very low	139 Å²	139	136.4 Å²	136.4	65%	0.65	67%	0.668	S	S	*	*			cis	-174.9	170.8	-4.7	-136.5	-179.3	27.9	0	0	112.3
845	N	32.3	Very low	30.6	Very low	93 Å²	93	139.3 Å²	139.3	50%	0.497	68%	0.675	S	S	.	*			trans	78.7	142.7	144.9	-68.3	-19.3	0	0	0	121.7
846	F	29.5	Very low	30.6	Very low	171 Å²	171	136.6 Å²	136.6	75%	0.75	67%	0.667	S	S	*	*			cis	-142.9	136.7	-15.6	-100.5	-82.2	0	0	0	105.2
847	I	29	Very low	30.6	Very low	115 Å²	115	134.4 Å²	134.4	59%	0.59	66%	0.66	S	S	*	*			cis	94	114.6	38.1	-71.5	169	0	0	0	115.3
848	S	30.7	Very low	30.5	Very low	107 Å²	107	133.3 Å²	133.3	75%	0.748	65%	0.654	S	S	*	*			trans	179.5	113.2	134.3	-77.6	0	0	0	0	110
849	K	35.3	Very low	30.4	Very low	153 Å²	153	131.8 Å²	131.8	67%	0.665	65%	0.646	S	S	*	*				75.8	139.4	72.6	-71.8	-178	171.6	-175.1	0	113.7
850	F	28.3	Very low	30.4	Very low	150 Å²	150	130.8 Å²	130.8	66%	0.658	64%	0.643	S	S	*	*			cis	-172.8	174.3	-0.8	-101.5	-24.1	0	0	0	108
851	H	29.7	Very low	30.2	Very low	122 Å²	122	131.7 Å²	131.7	57%	0.565	65%	0.648	S	S	*	*			cis	-166.8	143.3	1.5	-119.6	-51.7	0	0	0	111.1
852	N	27.6	Very low	29.9	Very low	116 Å²	116	131.8 Å²	131.8	62%	0.62	65%	0.649	S	S	*	*			trans	66.5	167.7	152	-47.3	-18.4	0	0	0	119
853	Y	27.1	Very low	29.8	Very low	202 Å²	202	127.5 Å²	127.5	79%	0.792	65%	0.646	S	S	*	*			cis	-153.8	135.4	17.4	-126.1	-72.2	0	0	0	113.7
854	T	28.9	Very low	29.5	Very low	112 Å²	112	128.8 Å²	128.8	69%	0.687	66%	0.656	S	S	*	*			trans	39.4	119.1	153.5	53.5	0	0	0	0	126.3
855	K	29.7	Very low	29.2	Very low	185 Å²	185	126.7 Å²	126.7	80%	0.804	66%	0.657	S	S	*	*				66.8	128.3	99.1	-147.4	-163.8	178.2	177.8	0	122.9
856	S	30	Very low	29	Very low	84 Å²	84	129.8 Å²	129.8	59%	0.587	67%	0.674	S	S	*	*				132.3	112.2	124.9	-94.3	0	0	0	0	120.5
857	N	28.9	Very low	29	Very low	116 Å²	116	128 Å²	128	62%	0.62	67%	0.672	S	S	*	*				80.9	126.8	121.2	-72.3	74	0	0	0	124.5
858	N	29.8	Very low	29.1	Very low	102 Å²	102	129.1 Å²	129.1	55%	0.545	68%	0.679	S	S	.	*				94.9	101.5	128.2	-78.8	52.6	0	0	0	123.7
859	D	27.9	Very low	29.3	Very low	92 Å²	92	131 Å²	131	49%	0.492	68%	0.681	S	S	.	*				71.6	132.3	98	-67.6	-14.3	0	0	0	124.1
860	M	29.6	Very low	29.1	Very low	151 Å²	151	130.2 Å²	130.2	74%	0.744	68%	0.684	S	S	*	*			trans	87.5	105.2	139.7	-67.6	-73.5	-82.1	0	0	122.1
861	D	27.7	Very low	29.4	Very low	116 Å²	116	128.2 Å²	128.2	62%	0.62	68%	0.684	S	S	*	*				96.2	134.3	116.7	-93.9	9.1	0	0	0	125.1
862	N	29.4	Very low	29.4	Very low	124 Å²	124	130.1 Å²	130.1	66%	0.663	69%	0.693	S	S	*	*			trans	64.6	92.5	141.8	-67.1	-39.9	0	0	0	121.7
863	S	28.2	Very low	29.4	Very low	89 Å²	89	132.4 Å²	132.4	62%	0.622	70%	0.7	S	S	*	*				46	127.6	109.2	70.6	0	0	0	0	121.4
864	L	26.4	Very low	29.5	Very low	165 Å²	165	129.9 Å²	129.9	86%	0.864	70%	0.699	S	S	*	*				35.9	132.1	127.5	-60.6	165.3	0	0	0	119.4
865	S	26.9	Very low	29.5	Very low	95 Å²	95	135.6 Å²	135.6	66%	0.664	71%	0.708	S	S	*	*			cis	-174.9	136.6	-2.3	48.3	0	0	0	0	110.6
866	D	29.4	Very low	29.5	Very low	158 Å²	158	134.9 Å²	134.9	85%	0.845	71%	0.707	S	S	*	*			trans	-127	120.3	157.6	-77.5	-31.6	0	0	0	104.9
867	D	29	Very low	29.3	Very low	135 Å²	135	136.7 Å²	136.7	72%	0.722	72%	0.715	S	S	*	*				83.4	142	77	-98.9	7.6	0	0	0	113.9
868	N	31.4	Very low	29.4	Very low	137 Å²	137	138 Å²	138	73%	0.733	72%	0.721	S	S	*	*			trans	71	152.9	171.1	-46.7	-50.1	0	0	0	115.9
869	D	33.9	Very low	29.3	Very low	147 Å²	147	141.1 Å²	141.1	79%	0.786	73%	0.731	S	S	*	*			cis	-153	174.7	-3.3	-100.8	-21.5	0	0	0	106.6
870	D	32.1	Very low	29.3	Very low	136 Å²	136	143.4 Å²	143.4	73%	0.727	74%	0.744	S	S	*	*				-165.9	171.5	-57.1	-172.4	19.5	0	0	0	106.8
871	V	33.1	Very low	29.2	Very low	109 Å²	109	146.1 Å²	146.1	66%	0.661	75%	0.747	S	S	*	*			trans	63.3	106.4	165.3	177.6	0	0	0	0	116.2
872	E	30.1	Very low	29.1	Very low	162 Å²	162	147 Å²	147	76%	0.757	75%	0.752	S	S	*	*				92.3	117.3	58.7	-171.1	175.1	-142.3	0	0	115.6
873	Q	27.5	Very low	29.1	Very low	163 Å²	163	147.8 Å²	147.8	76%	0.762	76%	0.755	S	S	*	*			trans	2.7	136.4	163.5	-44.9	176.5	24.9	0	0	122.3
874	I	29.2	Very low	28.9	Very low	149 Å²	149	149.8 Å²	149.8	76%	0.764	76%	0.762	S	S	*	*				150.8	103	119.7	-75.1	156.8	0	0	0	112
875	R	29.7	Very low	29	Very low	233 Å²	233	146.1 Å²	146.1	88%	0.879	75%	0.751	S	S	*	*				-177.9	106.4	126.4	-106.9	172.9	-177.7	-98.5	-3.7	115.2
876	Q	28.9	Very low	29	Very low	169 Å²	169	151.2 Å²	151.2	79%	0.79	76%	0.764	S	S	*	*			trans	29.4	129.7	134.3	-133	75.5	26.2	0	0	122.4
877	T	27.2	Very low	28.8	Very low	122 Å²	122	149.2 Å²	149.2	75%	0.748	76%	0.758	S	S	*	*			trans	104.1	129.6	134.9	-10.4	0	0	0	0	120.2
878	I	30.3	Very low	28.7	Very low	145 Å²	145	147.8 Å²	147.8	74%	0.744	76%	0.758	S	S	*	*			trans	99.4	123.7	159.5	-55.6	179.6	0	0	0	115.9
879	H	27.1	Very low	28.5	Very low	166 Å²	166	150.7 Å²	150.7	77%	0.769	77%	0.768	S	S	*	*			trans	63.2	145.9	177.8	-89.7	-103	0	0	0	116.2
880	D	28.5	Very low	28.3	Very low	141 Å²	141	148.4 Å²	148.4	75%	0.754	75%	0.754	S	S	*	*			cis	-128.4	178.8	16.7	-85.4	-60.4	0	0	0	115.6
881	Y	27.4	Very low	28.1	Very low	208 Å²	208	148.3 Å²	148.3	82%	0.816	75%	0.753	S	S	*	*			trans	-148.9	137.7	177.3	-140.5	-79.5	0	0	0	109.9
882	D	25	Very low	27.9	Very low	135 Å²	135	148.6 Å²	148.6	72%	0.722	76%	0.76	S	S	*	*			trans	59.8	163.9	-172.9	-56	-40.6	0	0	0	113.4
883	I	29.3	Very low	27.8	Very low	140 Å²	140	148.9 Å²	148.9	72%	0.718	77%	0.767	S	S	*	*			cis	-129.5	141.3	21.9	-58.4	177.3	0	0	0	105.9
884	V	25.5	Very low	27.9	Very low	130 Å²	130	149.4 Å²	149.4	79%	0.788	77%	0.769	S	S	*	*				53.7	164.7	75.4	173.2	0	0	0	0	113.5
885	S	27.5	Very low	27.7	Very low	89 Å²	89	148.7 Å²	148.7	62%	0.622	77%	0.767	S	S	*	*			trans	78.1	90.2	-179.3	-57.8	0	0	0	0	117.5
886	Q	26.8	Very low	27.7	Very low	201 Å²	201	143.3 Å²	143.3	94%	0.939	76%	0.764	S	S	*	*			trans	-107.6	72.6	146.9	-84.7	-167.6	-22.1	0	0	109.6
887	T	24.7	Very low	27.6	Very low	117 Å²	117	142.1 Å²	142.1	72%	0.718	76%	0.763	S	S	*	*			trans	-156.1	143.2	165.5	40.5	0	0	0	0	108.8
888	S	27.3	Very low	27.6	Very low	104 Å²	104	141.1 Å²	141.1	73%	0.727	75%	0.749	S	S	*	*			trans	69.6	90.7	177.8	-54.2	0	0	0	0	115.4
889	E	27.4	Very low	27.4	Very low	199 Å²	199	138.7 Å²	138.7	93%	0.93	75%	0.746	S	S	*	*			trans	-122.7	98	152.2	-168.3	171.1	-127.7	0	0	107.5
890	I	30.3	Very low	27.5	Very low	99 Å²	99	135.4 Å²	135.4	51%	0.508	74%	0.741	S	S	.	*			trans	-156.7	131.9	168.4	-8	174.4	0	0	0	102.2	F240	F240-I890 HydrophobicContact CE1-CD1 4.17Å; F240-I890 HydrophobicContact CZ-CD1 4.04Å
891	L	28.6	Very low	27.5	Very low	134 Å²	134	134.6 Å²	134.6	70%	0.702	74%	0.735	S	S	*	*			cis	-139.2	143.8	27	-67.7	140.5	0	0	0	112.6
892	S	27	Very low	27.4	Very low	115 Å²	115	127.7 Å²	127.7	80%	0.804	71%	0.713	S	S	*	*			trans	-169.9	92	146.7	-82	0	0	0	0	109.6
893	D	29.8	Very low	27.6	Very low	168 Å²	168	126.7 Å²	126.7	90%	0.898	72%	0.717	S	S	*	*				179.9	144.5	127.2	-92.1	-15.4	0	0	0	109.8
894	H	27.8	Very low	27.7	Very low	173 Å²	173	128 Å²	128	80%	0.801	73%	0.725	S	S	*	*			trans	-105.2	-176.9	-169.8	-137.7	-104.5	0	0	0	111.8
895	D	26.4	Very low	27.8	Very low	135 Å²	135	128.9 Å²	128.9	72%	0.722	72%	0.718	S	S	*	*			trans	63.9	64.2	158.9	-59.4	-10.7	0	0	0	118.7
896	S	29.1	Very low	27.8	Very low	119 Å²	119	132.1 Å²	132.1	83%	0.832	73%	0.728	S	S	*	*			trans	-168	58.7	130.9	-86.9	0	0	0	0	114
897	L	27.2	Very low	28	Very low	145 Å²	145	130.2 Å²	130.2	76%	0.759	72%	0.723	S	S	*	*			trans	-102.3	34.1	176.8	-113.4	172.4	0	0	0	114.6	S899	L897-S899 PolarHBondContact O-N 3.28Å
898	Q	27	Very low	28.2	Very low	100 Å²	100	131.9 Å²	131.9	47%	0.467	73%	0.727	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.6	39.2	-176.5	-162.4	53.8	46.1	0	0	114.1	Y1495	Q898-Y1495 VanDerWaalsContact NE2-CB 3.32Å; Q898-Y1495 VanDerWaalsContact NE2-CG 3.32Å
899	S	27	Very low	28.1	Very low	95 Å²	95	134.3 Å²	134.3	66%	0.664	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.6	5.3	176.4	62.7	0	0	0	0	116.2	L897	L897-S899 PolarHBondContact O-N 3.28Å
900	S	27.6	Very low	28.1	Very low	96 Å²	96	134.2 Å²	134.2	67%	0.671	73%	0.727	S	S	*	*	S	Bend	trans	-108.8	18.4	179.8	-162.9	0	0	0	0	114.8
901	I	28.7	Very low	27.9	Very low	124 Å²	124	137.1 Å²	137.1	64%	0.636	74%	0.744	S	S	*	*	S	Bend	trans	-116	36.5	168.8	-42	-176.6	0	0	0	110.5
902	D	25.8	Very low	27.9	Very low	63 Å²	63	141 Å²	141	34%	0.337	75%	0.749	S	S	.	*			trans	-148.4	74.2	163	-119.1	-24.7	0	0	0	113.5	K905 Y1495	D902-K905 WeakPolarHBondContact OD1-CB 3.5Å; D902-K905 WeakPolarHBondContact OD1-CD 3.39Å; D902-K905 IonicContact OD2-NZ 2.69Å; D902-Y1495 HydrophobicContact CB-CE1 4.29Å
903	S	28.6	Very low	27.9	Very low	115 Å²	115	144.6 Å²	144.6	80%	0.804	75%	0.751	S	S	*	*	S	Bend	trans	-142.9	-8	164.1	-78.4	0	0	0	0	114.5
904	N	31.1	Very low	27.7	Very low	168 Å²	168	144.7 Å²	144.7	90%	0.898	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-82.1	1.7	163.5	-80.7	-52.4	0	0	0	113.2
905	K	29.1	Very low	27.6	Very low	148 Å²	148	144.1 Å²	144.1	64%	0.643	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-103.2	10	-174.8	-149.3	175.2	-179.5	-177.9	0	114.7	D902	D902-K905 WeakPolarHBondContact OD1-CB 3.5Å; D902-K905 WeakPolarHBondContact OD1-CD 3.39Å; D902-K905 IonicContact OD2-NZ 2.69Å
906	L	27.7	Very low	27.7	Very low	156 Å²	156	146.8 Å²	146.8	82%	0.817	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-104.8	22.1	166.8	-152.9	68.6	0	0	0	113.5
907	L	30	Very low	27.8	Very low	161 Å²	161	147.2 Å²	147.2	84%	0.843	76%	0.756	S	S	*	*	S	Bend	trans	-104.8	16.8	170.5	-150.1	77.2	0	0	0	113.5
908	L	28.8	Very low	27.9	Very low	152 Å²	152	149.8 Å²	149.8	80%	0.796	76%	0.761	S	S	*	*	S	Bend	trans	-119.5	-1.1	-174.4	-112.9	167.4	0	0	0	115.7
909	L	26.3	Very low	27.9	Very low	155 Å²	155	154.4 Å²	154.4	81%	0.812	78%	0.78	S	S	*	*	S	Bend	trans	-132.9	23.1	-178.4	-115.9	159.7	0	0	0	115
910	K	27.1	Very low	28	Very low	197 Å²	197	154.6 Å²	154.6	86%	0.857	78%	0.781	S	S	*	*	S	Bend	trans	-122.1	30	169.3	-146.4	161.6	-171.5	167.3	0	113.9
911	N	26.2	Very low	28	Very low	160 Å²	160	157.8 Å²	157.8	86%	0.856	79%	0.79	S	S	*	*			trans	-118.3	51.4	169.4	-97.3	-28.8	0	0	0	111.2
912	R	27.4	Very low	28	Very low	217 Å²	217	158 Å²	158	82%	0.819	79%	0.792	S	S	*	*	S	Bend	trans	-123.8	132.6	158.2	-78.3	-173.7	174.8	175	-0.3	108.3
913	F	26.8	Very low	28.2	Very low	190 Å²	190	161.7 Å²	161.7	83%	0.833	81%	0.81	S	S	*	*	S	Bend	trans	68	137.1	-170.8	-63.2	-83.2	0	0	0	116.9
914	M	25.7	Very low	28.2	Very low	169 Å²	169	161.6 Å²	161.6	83%	0.833	80%	0.8	S	S	*	*	S	Bend	trans	62.5	58.3	167.8	-51.2	-48	177.2	0	0	119
915	N	27.1	Very low	28	Very low	162 Å²	162	161.6 Å²	161.6	87%	0.866	80%	0.799	S	S	*	*				-148.9	136.7	120.3	-115.5	-35.9	0	0	0	113.4
916	K	27.5	Very low	27.9	Very low	190 Å²	190	159.8 Å²	159.8	83%	0.826	81%	0.805	S	S	*	*			trans	-102.4	104.6	171.9	-73.2	-178.5	178.2	178.9	0	108.4	K918	K916-K918 PolarHBondContact O-N 3.49Å
917	P	31.2	Very low	27.9	Very low	129 Å²	129	158.7 Å²	158.7	84%	0.838	80%	0.799	S	S	*	*			trans	-69	127.9	173.3	28.6	-32.5	0	0	0	109.6
918	K	29.7	Very low	27.8	Very low	199 Å²	199	161.1 Å²	161.1	87%	0.865	80%	0.803	S	S	*	*			trans	-105.8	125.7	169.7	-85.6	-169.8	174.1	-175.8	0	110	K916	K916-K918 PolarHBondContact O-N 3.49Å
919	K	27.8	Very low	28	Very low	197 Å²	197	158.6 Å²	158.6	86%	0.857	80%	0.803	S	S	*	*	S	Bend	trans	93.2	118.2	167.2	-61.2	-168.7	169.2	-168.3	0	118.4
920	S	27.6	Very low	28.1	Very low	99 Å²	99	158.2 Å²	158.2	69%	0.692	80%	0.801	S	S	*	*			trans	60.1	88.5	134.4	63.9	0	0	0	0	120.3
921	L	28.1	Very low	28	Very low	163 Å²	163	157.9 Å²	157.9	85%	0.853	80%	0.8	S	S	*	*				-86.7	141.7	108.9	-86.2	67.6	0	0	0	106.9
922	N	29.7	Very low	28.2	Very low	128 Å²	128	156.8 Å²	156.8	68%	0.684	79%	0.794	S	S	*	*				55.2	94.5	68.5	-73	10.7	0	0	0	111.3
923	I	28.1	Very low	28.3	Very low	140 Å²	140	152.8 Å²	152.8	72%	0.718	79%	0.785	S	S	*	*				89.8	110.3	80.9	-80.1	168.1	0	0	0	110
924	I	29.3	Very low	28.3	Very low	114 Å²	114	152 Å²	152	59%	0.585	78%	0.781	S	S	*	*			trans	59.5	82.7	166.6	-54	165.3	0	0	0	114.7	I927	I924-I927 HydrophobicContact CG2-CD1 3.61Å; I924-I927 HydrophobicContact CG2-CG1 3.73Å
925	D	27.2	Very low	28.9	Very low	167 Å²	167	149 Å²	149	89%	0.893	77%	0.774	S	S	*	*			trans	-119.4	79.8	132.7	-146.9	-17.5	0	0	0	108.4
926	S	27.1	Very low	28.8	Very low	110 Å²	110	147.2 Å²	147.2	77%	0.769	77%	0.769	S	S	*	*			trans	-157.3	34.1	-179	-71.5	0	0	0	0	111.6
927	I	27.4	Very low	28.8	Very low	133 Å²	133	146.1 Å²	146.1	68%	0.682	77%	0.771	S	S	*	*			trans	-124.1	71.6	174.1	-55.1	178.5	0	0	0	109.7	I924	I924-I927 HydrophobicContact CG2-CD1 3.61Å; I924-I927 HydrophobicContact CG2-CG1 3.73Å
928	K	27.8	Very low	28.7	Very low	213 Å²	213	144 Å²	144	93%	0.926	77%	0.765	S	S	*	*			trans	-147.2	33.1	151.1	-122.3	168.6	-172.8	175.1	0	114.5	L930	K928-L930 PolarHBondContact O-N 3.26Å
929	A	32.2	Very low	28.6	Very low	98 Å²	98	139.2 Å²	139.2	81%	0.81	76%	0.762	S	S	*	*	S	Bend	trans	-84.9	80.9	157.9	0	0	0	0	0	109.9
930	L	28.7	Very low	28.7	Very low	147 Å²	147	135.7 Å²	135.7	77%	0.77	76%	0.757	S	S	*	*			trans	51.6	94.6	162	-67.1	164.6	0	0	0	118.7	K928	K928-L930 PolarHBondContact O-N 3.26Å
931	K	26.2	Very low	28.7	Very low	191 Å²	191	137 Å²	137	83%	0.83	76%	0.761	S	S	*	*			trans	-77.4	118.2	135.4	-99.1	-176.5	177.3	175.8	0	108
932	N	30.2	Very low	28.6	Very low	136 Å²	136	135.2 Å²	135.2	73%	0.727	76%	0.757	S	S	*	*			trans	-169.2	111.5	158.3	-90.4	-21	0	0	0	104
933	Q	28.7	Very low	28.6	Very low	134 Å²	134	136.5 Å²	136.5	63%	0.626	76%	0.762	S	S	*	*			cis	53	130.6	48.5	-58.8	-159.5	37.8	0	0	111.8
934	K	27.3	Very low	28.7	Very low	173 Å²	173	135.7 Å²	135.7	75%	0.752	76%	0.764	S	S	*	*			cis	-153.9	-141.1	8.8	-130.1	167.1	-176	153.4	0	110.2
935	P	37.1	Very low	28.8	Very low	105 Å²	105	136.7 Å²	136.7	68%	0.682	78%	0.775	S	S	*	*				-87.1	160.1	-104.5	29.6	-9.8	0	0	0	114.5
936	T	26.3	Very low	29	Very low	126 Å²	126	133.7 Å²	133.7	77%	0.773	77%	0.765	S	S	*	*				66.7	130.4	57.4	-36.6	0	0	0	0	112
937	I	27.4	Very low	29	Very low	166 Å²	166	135 Å²	135	85%	0.851	76%	0.764	S	S	*	*			cis	-110.4	-120.8	26.6	-27	176	0	0	0	113.4
938	A	28.8	Very low	29	Very low	86 Å²	86	133.7 Å²	133.7	71%	0.711	76%	0.762	S	S	*	*			cis	-159.2	128.9	-1.2	0	0	0	0	0	114.3
939	A	27.5	Very low	29.1	Very low	97 Å²	97	129.9 Å²	129.9	80%	0.802	75%	0.751	S	S	*	*			trans	54.2	152.4	157.2	0	0	0	0	0	120.4
940	T	29.7	Very low	29	Very low	123 Å²	123	132.7 Å²	132.7	76%	0.755	75%	0.753	S	S	*	*			cis	-161	129.9	39	-56.7	0	0	0	0	114.2
941	T	28.8	Very low	29.1	Very low	126 Å²	126	129.2 Å²	129.2	77%	0.773	75%	0.753	S	S	*	*			trans	56.5	120	147.6	-52.2	0	0	0	0	123.8
942	T	25.7	Very low	29.4	Very low	127 Å²	127	127.5 Å²	127.5	78%	0.779	75%	0.751	S	S	*	*			trans	-60	153.5	163	52.1	0	0	0	0	117.1
943	I	29.7	Very low	29.3	Very low	155 Å²	155	128.3 Å²	128.3	80%	0.795	75%	0.754	S	S	*	*			trans	-135.4	119.8	153	-72.3	-171.8	0	0	0	112
944	T	30.2	Very low	29.5	Very low	123 Å²	123	127.7 Å²	127.7	76%	0.755	76%	0.761	S	S	*	*			trans	34.7	124.7	159	62.3	0	0	0	0	122.6
945	T	31.5	Very low	29.4	Very low	134 Å²	134	127.5 Å²	127.5	82%	0.822	77%	0.765	S	S	*	*			trans	-66.2	158.6	143.9	55.6	0	0	0	0	111.1
946	P	31.1	Very low	28.9	Very low	104 Å²	104	129.6 Å²	129.6	68%	0.675	77%	0.769	S	S	*	*				-150.5	161.2	102.4	39.9	-24.7	0	0	0	117.3
947	N	25.5	Very low	28.9	Very low	138 Å²	138	131.9 Å²	131.9	74%	0.738	77%	0.771	S	S	*	*			trans	78.2	119.6	138.8	-78.9	0.5	0	0	0	123.6
948	T	29.4	Very low	28.9	Very low	105 Å²	105	133.4 Å²	133.4	64%	0.644	77%	0.767	S	S	*	*				96.1	102.5	122.8	54	0	0	0	0	122.1
949	N	28.7	Very low	28.8	Very low	133 Å²	133	134.3 Å²	134.3	71%	0.711	76%	0.757	S	S	*	*				98.7	131.3	112.9	-69.8	0.2	0	0	0	121.7
950	N	30.8	Very low	28.6	Very low	158 Å²	158	132 Å²	132	85%	0.845	73%	0.734	S	S	*	*			trans	71.6	110.1	148.3	-56.2	-10.6	0	0	0	118.6
951	G	30.6	Very low	28.5	Very low	74 Å²	74	130.8 Å²	130.8	76%	0.763	72%	0.723	S	S	*	*			trans	-172.9	20.4	179	0	0	0	0	0	121.3
952	I	32.2	Very low	28.4	Very low	155 Å²	155	130.1 Å²	130.1	80%	0.795	71%	0.714	S	S	*	*			trans	66.7	100.5	164.7	-51.8	177.4	0	0	0	117.6
953	I	27.5	Very low	28.4	Very low	153 Å²	153	130.8 Å²	130.8	79%	0.785	71%	0.71	S	S	*	*				39.9	120.2	122.9	-59.7	165.9	0	0	0	117.5
954	P	33.6	Very low	28.2	Very low	121 Å²	121	129.2 Å²	129.2	79%	0.786	71%	0.708	S	S	*	*				-147.3	122.6	95.4	35.9	-18.4	0	0	0	116.6
955	M	25.4	Very low	28.1	Very low	169 Å²	169	130.1 Å²	130.1	83%	0.833	71%	0.708	S	S	*	*			trans	-166.3	127.7	155.8	-101.9	-57.9	-73.1	0	0	108.8
956	I	26.6	Very low	28.1	Very low	148 Å²	148	130.5 Å²	130.5	76%	0.759	71%	0.71	S	S	*	*			trans	-178.1	124.5	145.7	-99.9	160.3	0	0	0	110.2
957	E	26.9	Very low	28	Very low	174 Å²	174	128.1 Å²	128.1	81%	0.813	70%	0.704	S	S	*	*			trans	54.6	147.6	147.1	-60.5	174.1	146	0	0	124.4
958	Y	26.9	Very low	28.3	Very low	199 Å²	199	126.4 Å²	126.4	78%	0.78	70%	0.704	S	S	*	*			trans	-72.5	139.8	171	-82.3	-143.4	0	0	0	111.2
959	E	26.7	Very low	28.4	Very low	104 Å²	104	127.8 Å²	127.8	49%	0.486	71%	0.707	S	S	.	*			trans	-151.9	-174.7	138.4	-76.3	-142.8	159.3	0	0	109.7	S518 L519 K520	S518-E959 WeakPolarHBondContact CB-OE2 3.48Å; S518-E959 PolarHBondContact OG-OE2 2.83Å; L519-E959 WeakPolarHBondContact CD1-OE1 3.46Å; L519-E959 HydrophobicContact CD2-CB 4.18Å; L519-E959 VanDerWaalsContact CD2-CD 3.49Å; L519-E959 HydrophobicContact CD2-CG 3.74Å; L519-E959 WeakPolarHBondContact CD2-OE1 3.43Å; L519-E959 HydrophobicContact CG-CG 4.4Å; K520-E959 PolarHBondContact NZ-O 3.15Å
960	C	23.6	Very low	28.5	Very low	48 Å²	48	128.1 Å²	128.1	32%	0.324	71%	0.707	S	S	.	*			trans	-153.5	153.6	174.5	-73.1	0	0	0	0	106.9	L519 K520	L519-C960 WeakPolarHBondContact CA-O 3.43Å; L519-C960 PolarHBondContact N-O 3.12Å; K520-C960 HydrophobicContact CB-CB 4.25Å; K520-C960 HydrophobicContact CD-CB 3.9Å; K520-C960 WeakPolarHBondContact CE-SG 3.5Å; K520-C960 HydrophobicContact CG-CB 4.02Å; K520-C960 PolarHBondContact NZ-SG 2.93Å
961	N	26.9	Very low	28.4	Very low	99 Å²	99	126.9 Å²	126.9	53%	0.529	70%	0.701	S	S	.	*			trans	63.4	147.5	179.4	-57.5	-13.3	0	0	0	114.1	S518 L519	S518-N961 WeakPolarHBondContact CA-O 3.45Å; S518-N961 PolarHBondContact N-O 3.49Å; L519-N961 PolarHBondContact O-ND2 2.85Å
962	L	26.5	Very low	28.2	Very low	111 Å²	111	127.5 Å²	127.5	58%	0.581	69%	0.693	S	S	*	*			cis	-150.9	144.2	-2.1	-152.3	71	0	0	0	111.6
963	M	25.3	Very low	27.9	Very low	141 Å²	141	125.6 Å²	125.6	70%	0.695	69%	0.689	S	S	*	*			trans	36.8	141.6	152.3	-93.8	72.4	102.3	0	0	125.6
964	T	27.3	Very low	27.8	Very low	123 Å²	123	128 Å²	128	76%	0.755	69%	0.69	S	S	*	*			trans	68.7	147.3	142.3	55.3	0	0	0	0	119.3
965	D	27	Very low	27.4	Very low	141 Å²	141	128.3 Å²	128.3	75%	0.754	68%	0.684	S	S	*	*			cis	-149.5	164.8	-4.1	-133.3	-23.8	0	0	0	106.7
966	V	31.4	Very low	27.4	Very low	142 Å²	142	126.1 Å²	126.1	86%	0.861	68%	0.676	S	S	*	*				-158.9	140.9	50.6	170.9	0	0	0	0	109.7
967	G	29.9	Very low	27.4	Very low	54 Å²	54	126.1 Å²	126.1	56%	0.557	67%	0.668	S	S	*	*			trans	126.8	88.8	144	0	0	0	0	0	119.1
968	S	31.6	Very low	27.3	Very low	103 Å²	103	125.8 Å²	125.8	72%	0.72	67%	0.666	S	S	*	*			trans	45.4	128.6	136.8	56.7	0	0	0	0	120.6
969	D	31.6	Very low	27.2	Very low	133 Å²	133	125.2 Å²	125.2	71%	0.711	66%	0.664	S	S	*	*			cis	-157.7	137.1	8.7	-91.8	-22.6	0	0	0	108.4
970	I	30.3	Very low	27.2	Very low	140 Å²	140	127.2 Å²	127.2	72%	0.718	67%	0.673	S	S	*	*				60.1	120.8	86.2	-61.1	177.2	0	0	0	111.4
971	N	29.8	Very low	27.4	Very low	133 Å²	133	129.7 Å²	129.7	71%	0.711	69%	0.687	S	S	*	*			cis	-147.3	162.3	9.1	-104	-8.3	0	0	0	109.2
972	S	25.7	Very low	27.4	Very low	87 Å²	87	135.9 Å²	135.9	61%	0.608	70%	0.703	S	S	*	*				66.6	145.1	54.5	114.2	0	0	0	0	113.8
973	T	26.5	Very low	27.5	Very low	114 Å²	114	136.1 Å²	136.1	70%	0.699	71%	0.705	S	S	*	*			cis	-156.7	153.5	-0.7	-16.1	0	0	0	0	110.9
974	Y	24.7	Very low	27.7	Very low	205 Å²	205	138.9 Å²	138.9	80%	0.804	71%	0.707	S	S	*	*			trans	52.5	154.1	138.5	-90.5	-143.2	0	0	0	124.8
975	D	24.4	Very low	27.8	Very low	126 Å²	126	138.5 Å²	138.5	67%	0.674	70%	0.7	S	S	*	*			trans	66.3	103.7	146.4	-58	-4.6	0	0	0	124.5
976	D	26	Very low	27.9	Very low	123 Å²	123	137 Å²	137	66%	0.658	70%	0.697	S	S	*	*				62.3	145	101.2	-111.1	1.6	0	0	0	124.6
977	Y	26.7	Very low	27.8	Very low	148 Å²	148	136.4 Å²	136.4	58%	0.58	69%	0.688	S	S	*	*			trans	57.1	121.7	161.6	-76.2	-76.2	0	0	0	123.7	I707	I707-Y977 HydrophobicContact CD1-CD2 3.7Å; I707-Y977 HydrophobicContact CD1-CE2 3.55Å; I707-Y977 HydrophobicContact CG2-CE2 4.04Å
978	E	25.2	Very low	27.7	Very low	168 Å²	168	141.8 Å²	141.8	79%	0.785	70%	0.698	S	S	*	*			trans	97.4	146.2	130.7	-152.8	158.1	-129.7	0	0	122.3
979	Y	24.7	Very low	27.6	Very low	186 Å²	186	143.8 Å²	143.8	73%	0.729	70%	0.696	S	S	*	*			trans	-20.6	154.8	-173.7	-86.1	-74.9	0	0	0	125.7
980	H	26.7	Very low	27.5	Very low	147 Å²	147	143.5 Å²	143.5	68%	0.681	69%	0.694	S	S	*	*			trans	82.2	85.8	139.3	-84.9	-57.5	0	0	0	123.1
981	T	27.3	Very low	27.3	Very low	99 Å²	99	143 Å²	143	61%	0.607	69%	0.692	S	S	*	*				48.4	114.8	121.2	55.1	0	0	0	0	122.2
982	R	28	Very low	27.3	Very low	229 Å²	229	146.3 Å²	146.3	86%	0.864	70%	0.7	S	S	*	*			trans	73.4	150.4	150	-59	171.5	173.5	140.2	-0.9	114.9
983	N	28.1	Very low	27.3	Very low	117 Å²	117	149.8 Å²	149.8	63%	0.626	71%	0.711	S	S	*	*			cis	-155.6	161.7	14.9	-140.1	-16.2	0	0	0	110.5
984	R	29.3	Very low	28.1	Very low	198 Å²	198	149.8 Å²	149.8	75%	0.747	71%	0.713	S	S	*	*			trans	29.4	137.1	142	-80.3	-170.2	163.2	95.3	-2.6	119.5
985	N	29.2	Very low	28.2	Very low	115 Å²	115	146.3 Å²	146.3	62%	0.615	71%	0.713	S	S	*	*			cis	172.4	148.7	40.7	-129.1	16.4	0	0	0	110.1
986	T	29.2	Very low	28.4	Very low	111 Å²	111	146.1 Å²	146.1	68%	0.681	71%	0.711	S	S	*	*			trans	60.4	152.7	140.9	61.7	0	0	0	0	120.1
987	I	28.2	Very low	28.4	Very low	129 Å²	129	150.1 Å²	150.1	66%	0.662	72%	0.717	S	S	*	*			cis	-164.9	158.9	-0.3	-121.7	168	0	0	0	110.5
988	E	28.2	Very low	28.3	Very low	167 Å²	167	147.5 Å²	147.5	78%	0.78	72%	0.72	S	S	*	*			trans	63	162.8	160.6	-78.5	160	-163.2	0	0	118.7
989	E	29.5	Very low	28.4	Very low	144 Å²	144	144.9 Å²	144.9	67%	0.673	72%	0.716	S	S	*	*			cis	-153	166.9	0.9	-138.7	-160.6	152.8	0	0	112.9
990	L	29.1	Very low	28.4	Very low	127 Å²	127	142.2 Å²	142.2	67%	0.665	71%	0.714	S	S	*	*			trans	61.9	145.7	156.4	-59	172.6	0	0	0	119.1
991	L	28	Very low	28.5	Very low	131 Å²	131	141.7 Å²	141.7	69%	0.686	72%	0.717	S	S	*	*			cis	-152.8	147.8	-7.2	-100	156.1	0	0	0	106.3
992	K	28.9	Very low	28.4	Very low	202 Å²	202	140.9 Å²	140.9	88%	0.878	72%	0.715	S	S	*	*				-152.7	162.4	56.6	-75.7	177.5	176.8	170.6	0	112.5
993	L	26.5	Very low	28.6	Very low	160 Å²	160	137.8 Å²	137.8	84%	0.838	71%	0.714	S	S	*	*			trans	-94.8	162.5	-173.6	-77	166.2	0	0	0	114.6
994	P	42.1	Very low	28.7	Very low	114 Å²	114	136.1 Å²	136.1	74%	0.74	71%	0.711	S	S	*	*			trans	-94.1	172.6	-175.3	39.1	-37.8	0	0	0	113.6
995	V	28.3	Very low	28.6	Very low	131 Å²	131	133.8 Å²	133.8	79%	0.794	71%	0.714	S	S	*	*			trans	-158	131.6	167.2	114.2	0	0	0	0	115.7
996	L	27.1	Very low	28.7	Very low	122 Å²	122	133.8 Å²	133.8	64%	0.639	71%	0.714	S	S	*	*			trans	66	129	150.3	-59.7	178.8	0	0	0	125.3
997	R	26.3	Very low	28.8	Very low	207 Å²	207	131.3 Å²	131.3	78%	0.781	70%	0.701	S	S	*	*			trans	71.2	128.5	130.8	-69	177.9	179.7	170.9	1.1	118.6
998	S	24.1	Very low	28.9	Very low	94 Å²	94	128.9 Å²	128.9	66%	0.657	69%	0.689	S	S	*	*				62.9	130.7	59.8	84.9	0	0	0	0	112.8
999	T	28.6	Very low	29	Very low	113 Å²	113	125.1 Å²	125.1	69%	0.693	68%	0.678	S	S	*	*			cis	-149	176.6	40.4	47.5	0	0	0	0	114.4
1000	N	24.7	Very low	29.2	Very low	129 Å²	129	123.7 Å²	123.7	69%	0.69	68%	0.675	S	S	*	*			trans	-3.2	147.2	139.1	-29.7	-9.3	0	0	0	116.2
1001	D	27.8	Very low	29.3	Very low	137 Å²	137	124.1 Å²	124.1	73%	0.733	68%	0.678	S	S	*	*				-171.3	179.9	50.2	-96.3	-58.9	0	0	0	108
1002	S	26.4	Very low	29.5	Very low	81 Å²	81	124.6 Å²	124.6	57%	0.566	68%	0.681	S	S	*	*			cis	173.6	162.3	-32.7	-85.1	0	0	0	0	106.5
1003	I	30.2	Very low	29.6	Very low	164 Å²	164	119.9 Å²	119.9	84%	0.841	67%	0.665	S	S	*	*			trans	70.5	137.9	165.8	-58.1	147.1	0	0	0	115.6
1004	S	30.1	Very low	29.9	Very low	83 Å²	83	119 Å²	119	58%	0.58	66%	0.66	S	S	*	*			cis	-171	151.4	-22.9	61	0	0	0	0	110.8
1005	N	29	Very low	29.1	Very low	148 Å²	148	117.7 Å²	117.7	79%	0.791	65%	0.653	S	S	*	*			trans	45.7	145.8	141.3	-51.6	-8.2	0	0	0	120.8
1006	N	30.4	Very low	29	Very low	116 Å²	116	118.6 Å²	118.6	62%	0.62	65%	0.654	S	S	*	*			cis	-160.5	148.6	21.4	-148.8	18.1	0	0	0	114.9
1007	S	31.2	Very low	29.3	Very low	58 Å²	58	122.5 Å²	122.5	41%	0.406	67%	0.666	S	S	.	*			trans	55.6	115	144.9	60.9	0	0	0	0	124.4
1008	N	29.4	Very low	29.4	Very low	78 Å²	78	123.5 Å²	123.5	42%	0.417	67%	0.669	S	S	.	*				86.9	141	128.9	-63.1	6	0	0	0	119	V1068 I1069	N1008-V1068 WeakPolarHBondContact CA-O 3.35Å; N1008-V1068 PolarHBondContact N-O 3.42Å; N1008-I1069 PolarHBondContact OD1-N 2.91Å
1009	T	32	Very low	29.6	Very low	89 Å²	89	128.3 Å²	128.3	55%	0.546	68%	0.679	S	S	.	*			cis	-156.2	156.1	3.8	-0.7	0	0	0	0	113.3
1010	N	32	Very low	29.6	Very low	114 Å²	114	128.6 Å²	128.6	61%	0.61	68%	0.68	S	S	*	*			trans	65.2	116.1	154.9	-63.9	-7.6	0	0	0	121.9
1011	N	31.9	Very low	29.9	Very low	136 Å²	136	128.5 Å²	128.5	73%	0.727	68%	0.679	S	S	*	*				44.9	122.2	127	-49.5	-9.8	0	0	0	118.6
1012	N	32.8	Very low	29.9	Very low	141 Å²	141	128.9 Å²	128.9	75%	0.754	68%	0.677	S	S	*	*			cis	-159.6	-155.6	8.4	-139.2	-9.2	0	0	0	109.1
1013	N	31.3	Very low	30.1	Very low	103 Å²	103	132.3 Å²	132.3	55%	0.551	69%	0.687	S	S	*	*			cis	-150.3	167	7.5	-155.5	6.3	0	0	0	113.6	K1064	N1013-K1064 PolarHBondContact O-NZ 2.99Å
1014	I	31.1	Very low	29.9	Very low	141 Å²	141	129 Å²	129	72%	0.723	68%	0.678	S	S	*	*			trans	-45.9	143.4	166.6	-71	165.5	0	0	0	111.5
1015	S	26	Very low	29.8	Very low	86 Å²	86	136.8 Å²	136.8	60%	0.601	70%	0.695	S	S	*	*				-157.7	165.5	76.7	56.9	0	0	0	0	117.8
1016	N	27.1	Very low	29.7	Very low	150 Å²	150	138.2 Å²	138.2	80%	0.802	70%	0.696	S	S	*	*			trans	70.7	102.3	159.1	-69.3	-24.2	0	0	0	121.7
1017	K	31.9	Very low	30	Very low	205 Å²	205	137.7 Å²	137.7	89%	0.891	70%	0.699	S	S	*	*				-158.6	99.8	129.3	-116.1	170	-172.8	172.9	0	115.4
1018	R	28.5	Very low	29.8	Very low	227 Å²	227	141.6 Å²	141.6	86%	0.857	72%	0.715	S	S	*	*			trans	44	140.3	134.9	-77.5	-177.9	170.9	170.2	-1.9	123.1
1019	K	28.3	Very low	29.6	Very low	196 Å²	196	147.5 Å²	147.5	85%	0.852	73%	0.732	S	S	*	*			trans	76.7	151.3	161.4	-66.4	-178.8	176.5	-173.4	0	113.9
1020	V	30.5	Very low	29.4	Very low	118 Å²	118	150.7 Å²	150.7	72%	0.715	74%	0.738	S	S	*	*			cis	-147.6	152	41.9	164.2	0	0	0	0	113
1021	N	29.8	Very low	29.1	Very low	127 Å²	127	152.8 Å²	152.8	68%	0.679	74%	0.742	S	S	*	*			trans	67.6	155.7	163.9	-77.2	1	0	0	0	118.7
1022	Q	28.1	Very low	29	Very low	146 Å²	146	153.4 Å²	153.4	68%	0.682	74%	0.744	S	S	*	*			cis	-166.3	167.8	-20.5	-118.6	171.9	6.5	0	0	109.4
1023	I	29.7	Very low	28.6	Very low	152 Å²	152	152.1 Å²	152.1	78%	0.779	75%	0.746	S	S	*	*			trans	66.1	153	160.6	-64.2	154.1	0	0	0	115.5
1024	S	26.5	Very low	28.5	Very low	94 Å²	94	153.3 Å²	153.3	66%	0.657	76%	0.758	S	S	*	*				-170.7	140.4	-62.5	61.6	0	0	0	0	107.2
1025	R	28.7	Very low	28.5	Very low	248 Å²	248	155.2 Å²	155.2	94%	0.936	76%	0.761	S	S	*	*			trans	51	108.4	160.7	-65.1	-177.2	173.5	-175.5	-3.9	118.9
1026	H	26.4	Very low	28.8	Very low	177 Å²	177	155.9 Å²	155.9	82%	0.819	76%	0.758	S	S	*	*			trans	-76.8	164.1	157	-122.2	-70.3	0	0	0	111.5
1027	P	36.8	Very low	28.9	Very low	105 Å²	105	157 Å²	157	68%	0.682	76%	0.755	S	S	*	*				-136.4	146.4	110	11.6	10.6	0	0	0	116
1028	L	27.5	Very low	28.8	Very low	140 Å²	140	149.8 Å²	149.8	73%	0.733	73%	0.731	S	S	*	*			trans	59.7	115.2	137.8	-56.7	-177.6	0	0	0	123.3
1029	W	25.8	Very low	28.9	Very low	203 Å²	203	146.9 Å²	146.9	77%	0.769	72%	0.724	S	S	*	*				134.8	150.1	106.4	-97.9	26.5	0	0	0	119.6
1030	F	27.6	Very low	28.9	Very low	156 Å²	156	142.7 Å²	142.7	68%	0.684	71%	0.711	S	S	*	*			trans	70.1	146.2	166.4	-71.9	-36.8	0	0	0	118.8
1031	K	24.8	Very low	28.7	Very low	157 Å²	157	145.5 Å²	145.5	68%	0.683	72%	0.716	S	S	*	*			cis	-160.4	161.6	-3.4	-137.2	160.7	-179.3	168.6	0	113.1
1032	L	29.1	Very low	28.5	Very low	149 Å²	149	149.1 Å²	149.1	78%	0.78	73%	0.726	S	S	*	*			trans	65.8	117	150.1	-84.1	155.9	0	0	0	122.4
1033	S	25.3	Very low	28.6	Very low	114 Å²	114	146.7 Å²	146.7	80%	0.797	73%	0.725	S	S	*	*				45.1	138	126.6	-154.6	0	0	0	0	122.7
1034	T	29.1	Very low	28.9	Very low	129 Å²	129	148.5 Å²	148.5	79%	0.791	73%	0.73	S	S	*	*			trans	-99.2	145.5	-169.8	52.7	0	0	0	0	116.1
1035	K	30.7	Very low	29.3	Very low	180 Å²	180	148.2 Å²	148.2	78%	0.783	73%	0.733	S	S	*	*			trans	172.5	147.5	137.4	-98.8	-170.1	161.4	-137.1	0	108
1036	D	31.9	Very low	29.6	Very low	100 Å²	100	142.1 Å²	142.1	54%	0.535	73%	0.729	S	S	.	*			cis	-129.6	-164.8	-7.5	-88.7	-60	0	0	0	107.5
1037	K	30	Very low	29.8	Very low	174 Å²	174	140.2 Å²	140.2	76%	0.757	73%	0.73	S	S	*	*				178.9	69.9	-64	-173.6	-154.3	179.1	-173.6	0	109.2	D788	D788-K1037 PolarHBondContact OD1-N 2.97Å; D788-K1037 VanDerWaalsContact OD2-C 3.32Å; D788-K1037 PolarHBondContact OD2-N 2.88Å
1038	S	30.8	Very low	29.7	Very low	53 Å²	53	140.3 Å²	140.3	37%	0.371	73%	0.733	S	S	.	*			trans	-152.9	173.1	165.3	61.3	0	0	0	0	113.6	G787 D788	G787-S1038 WeakPolarHBondContact CA-OG 3.44Å; D788-S1038 WeakPolarHBondContact OD2-CB 3.36Å; D788-S1038 PolarHBondContact OD2-N 2.65Å; D788-S1038 PolarHBondContact OD2-OG 2.87Å
1039	K	28.7	Very low	29.8	Very low	167 Å²	167	144.9 Å²	144.9	73%	0.726	74%	0.741	S	S	*	*			trans	-93.4	-176.2	179.9	-60.5	167.3	-177.9	167.9	0	106.9	D786	D786-K1039 WeakPolarHBondContact OD2-CB 3.34Å; D786-K1039 PolarHBondContact OD2-N 3.38Å; D786-K1039 VanDerWaalsContact OD2-N 3.09Å
1040	L	29.8	Very low	30	Very low	108 Å²	108	145.2 Å²	145.2	57%	0.565	75%	0.748	S	S	*	*			cis	-141.6	163.7	27.1	-78.4	159.9	0	0	0	112.3	F784	F784-L1040 HydrophobicContact CD1-CD1 4.35Å
1041	Q	26.8	Very low	30.1	Very low	177 Å²	177	144.5 Å²	144.5	83%	0.827	75%	0.751	S	S	*	*			trans	-71.7	153.9	162.3	-55.9	168.7	-70.5	0	0	109.3
1042	F	25.5	Very low	30.5	Very low	202 Å²	202	144.7 Å²	144.7	89%	0.886	75%	0.754	S	S	*	*				-167.6	142.7	129.1	-101.3	-61.7	0	0	0	113.6
1043	S	29.9	Very low	30.5	Very low	95 Å²	95	144.1 Å²	144.1	66%	0.664	75%	0.752	S	S	*	*			trans	-118	145.3	157.5	53.3	0	0	0	0	106.5
1044	E	35.3	Very low	30.8	Very low	191 Å²	191	142.6 Å²	142.6	89%	0.893	74%	0.741	S	S	*	*			cis	-159.1	168.8	11.8	-128.6	168.1	-159	0	0	109.3
1045	A	35.3	Very low	31	Very low	87 Å²	87	143 Å²	143	72%	0.719	73%	0.732	S	S	*	*			trans	-77.6	165.9	176.1	0	0	0	0	0	111.9
1046	S	33.8	Very low	30.9	Very low	121 Å²	121	142.5 Å²	142.5	85%	0.846	74%	0.737	S	S	*	*			cis	-166.4	170.3	44.5	-52.1	0	0	0	0	113.8
1047	T	32.3	Very low	30.9	Very low	137 Å²	137	146.3 Å²	146.3	84%	0.84	75%	0.752	S	S	*	*			trans	-78.1	149.5	-175.7	56.1	0	0	0	0	116.7
1048	S	34.4	Very low	30.6	Very low	107 Å²	107	142.6 Å²	142.6	75%	0.748	75%	0.746	S	S	*	*				178.1	124.3	103.2	67	0	0	0	0	116.5
1049	R	30	Very low	30.4	Very low	235 Å²	235	146.4 Å²	146.4	89%	0.887	76%	0.763	S	S	*	*			trans	48.9	100.2	144.7	-63.7	179.5	176.4	162.3	-0.6	120.2
1050	F	29.5	Very low	30.5	Very low	211 Å²	211	148 Å²	148	93%	0.925	77%	0.77	S	S	*	*				-150.9	158.1	97.3	-112	-81.4	0	0	0	108.8	H1052	F1050-H1052 PolarHBondContact O-N 3.04Å
1051	N	29.1	Very low	30.4	Very low	140 Å²	140	152.8 Å²	152.8	75%	0.749	79%	0.786	S	S	*	*			trans	-72.9	117.1	-168.3	-57.3	9.7	0	0	0	112.4
1052	H	32.4	Very low	30.5	Very low	162 Å²	162	151.7 Å²	151.7	75%	0.75	78%	0.781	S	S	*	*				-178.3	117.5	106.9	-96.9	-71.5	0	0	0	110.5	F1050	F1050-H1052 PolarHBondContact O-N 3.04Å
1053	D	30.3	Very low	30.7	Very low	136 Å²	136	150 Å²	150	73%	0.727	78%	0.776	S	S	*	*			trans	41.1	116.3	138.7	-41.3	-35.1	0	0	0	121.1
1054	S	30.5	Very low	30.5	Very low	83 Å²	83	152.7 Å²	152.7	58%	0.58	78%	0.776	S	S	*	*			trans	66.6	130.9	149	-66.5	0	0	0	0	124.8	E781	E781-S1054 VanDerWaalsContact OE2-CB 3.31Å; E781-S1054 WeakPolarHBondContact OE2-CB 3.42Å; E781-S1054 PolarHBondContact OE2-OG 3.47Å
1055	K	33.6	Very low	30.6	Very low	136 Å²	136	148.3 Å²	148.3	59%	0.591	76%	0.764	S	S	*	*			trans	74.1	146.6	153.2	-73.7	165.4	174.2	170.5	0	120.5	E781 E783	E781-K1055 WeakPolarHBondContact OE1-CE 3.45Å; E781-K1055 IonicContact OE1-NZ 3.96Å; E781-K1055 PolarHBondContact OE1-NZ 3.09Å; E783-K1055 WeakPolarHBondContact OE1-CE 3.32Å; E783-K1055 IonicContact OE1-NZ 3.52Å; E783-K1055 PolarHBondContact OE1-NZ 3.17Å
1056	L	29.7	Very low	30.3	Very low	171 Å²	171	153.2 Å²	153.2	90%	0.895	77%	0.769	S	S	*	*			trans	-139.1	138.3	-164.9	-98.8	171.1	0	0	0	110.5
1057	Q	30.3	Very low	30.1	Very low	180 Å²	180	151 Å²	151	84%	0.841	75%	0.754	S	S	*	*			trans	-156.8	134.8	148.7	-153.3	125.5	28.3	0	0	114.3
1058	C	25	Very low	30.2	Very low	95 Å²	95	148.2 Å²	148.2	64%	0.642	74%	0.737	S	S	*	*			trans	67.9	112.7	153	-75.9	0	0	0	0	123.5
1059	N	27.1	Very low	30.1	Very low	134 Å²	134	147.7 Å²	147.7	72%	0.717	72%	0.724	S	S	*	*				109.9	140.5	118.6	-73.2	-18.7	0	0	0	123.6
1060	F	29.3	Very low	30.1	Very low	199 Å²	199	142 Å²	142	87%	0.873	71%	0.708	S	S	*	*			trans	64.1	126	164.6	-67.4	-68.5	0	0	0	121.8
1061	K	28.4	Very low	30.1	Very low	210 Å²	210	138 Å²	138	91%	0.913	70%	0.701	S	S	*	*			trans	-160.9	156.4	154.2	-140.4	169.4	-172.8	172.1	0	114.1
1062	E	28.2	Very low	30.2	Very low	154 Å²	154	139.6 Å²	139.6	72%	0.72	70%	0.704	S	S	*	*			trans	-134.3	149.8	179.6	-94	-154.7	94	0	0	113.4
1063	Q	30.1	Very low	30.1	Very low	166 Å²	166	137.3 Å²	137.3	78%	0.776	70%	0.701	S	S	*	*			trans	63.3	166.9	155.9	-59.4	-179.3	43.4	0	0	118.9
1064	K	26.8	Very low	30.2	Very low	151 Å²	151	137.3 Å²	137.3	66%	0.657	70%	0.7	S	S	*	*			trans	-148.3	-175.1	-160.3	-69	-165.3	178.5	-179.3	0	109	N1013	N1013-K1064 PolarHBondContact O-NZ 2.99Å
1065	P	37.6	Very low	30.1	Very low	99 Å²	99	139.6 Å²	139.6	64%	0.643	71%	0.706	S	S	*	*			cis	-146.7	-169.9	11	45.3	-24.8	0	0	0	118.5
1066	F	28.5	Very low	30	Very low	191 Å²	191	140 Å²	140	84%	0.838	71%	0.713	S	S	*	*			trans	72.9	166.9	157.2	-74.2	-44.7	0	0	0	118
1067	S	29.2	Very low	30	Very low	74 Å²	74	136.6 Å²	136.6	52%	0.517	70%	0.699	S	S	.	*			cis	-141.7	-141.2	23.1	74.8	0	0	0	0	118.4
1068	V	33.4	Very low	30	Very low	79 Å²	79	135.3 Å²	135.3	48%	0.479	69%	0.693	S	S	.	*			trans	-152.6	154.5	-145.6	-163.1	0	0	0	0	107.7	N1008	N1008-V1068 WeakPolarHBondContact CA-O 3.35Å; N1008-V1068 PolarHBondContact N-O 3.42Å
1069	I	33.1	Very low	30.2	Very low	96 Å²	96	136.6 Å²	136.6	49%	0.492	69%	0.693	S	S	.	*			cis	-143.7	-144.8	43	-19.7	174.9	0	0	0	109.9	N1008	N1008-I1069 PolarHBondContact OD1-N 2.91Å
1070	Q	30.9	Very low	30.3	Very low	116 Å²	116	136.6 Å²	136.6	54%	0.542	69%	0.693	S	S	.	*			cis	-158.8	173.9	13.5	-150.2	171	9.6	0	0	112.7
1071	T	28.5	Very low	30.4	Very low	126 Å²	126	131.9 Å²	131.9	77%	0.773	69%	0.685	S	S	*	*			trans	77.6	157.9	172.2	79.8	0	0	0	0	116.1
1072	Q	31.1	Very low	30.5	Very low	173 Å²	173	126.7 Å²	126.7	81%	0.808	68%	0.675	S	S	*	*			cis	-137.2	-143.4	-3.3	-147.1	176.7	-5.4	0	0	113.2
1073	T	30	Very low	30.6	Very low	114 Å²	114	126.3 Å²	126.3	70%	0.699	68%	0.678	S	S	*	*			trans	-157.9	158.5	-157.8	49.8	0	0	0	0	111.3
1074	I	32.4	Very low	30.5	Very low	137 Å²	137	125.5 Å²	125.5	70%	0.703	68%	0.679	S	S	*	*			cis	-155.3	151.5	17.7	-140	157	0	0	0	113.6
1075	D	28.8	Very low	30.6	Very low	131 Å²	131	123.2 Å²	123.2	70%	0.701	68%	0.681	S	S	*	*			trans	61	168.4	161	-65.1	-22.9	0	0	0	118.9
1076	I	31.5	Very low	30.1	Very low	144 Å²	144	125.4 Å²	125.4	74%	0.738	69%	0.687	S	S	*	*			cis	-154.1	174.5	-1.9	-128.9	158.7	0	0	0	108.6
1077	T	30.6	Very low	30.1	Very low	99 Å²	99	122.9 Å²	122.9	61%	0.607	68%	0.682	S	S	*	*				-145.3	174.3	-70.5	39.4	0	0	0	0	110.7
1078	H	30.2	Very low	30	Very low	154 Å²	154	127.1 Å²	127.1	71%	0.713	70%	0.699	S	S	*	*			trans	88.2	101.9	148.7	-75.3	-45.3	0	0	0	124.6
1079	N	28.9	Very low	29.9	Very low	122 Å²	122	130 Å²	130	65%	0.652	71%	0.711	S	S	*	*				81.5	115.8	116.6	-70.9	22.9	0	0	0	123.9
1080	N	29.6	Very low	29.7	Very low	134 Å²	134	133.2 Å²	133.2	72%	0.717	73%	0.729	S	S	*	*				87.2	110.6	123.9	-67.5	5.8	0	0	0	122.6
1081	S	29.8	Very low	29.6	Very low	100 Å²	100	131.5 Å²	131.5	70%	0.699	74%	0.742	S	S	*	*				88.8	112.4	119.9	-64	0	0	0	0	121.9
1082	S	30.4	Very low	29.7	Very low	100 Å²	100	132.9 Å²	132.9	70%	0.699	74%	0.744	S	S	*	*				80.1	103	125.6	-56.6	0	0	0	0	120.9
1083	N	30.3	Very low	29.5	Very low	147 Å²	147	130.4 Å²	130.4	79%	0.786	74%	0.736	S	S	*	*				58.6	121	124.7	-61.5	-1.2	0	0	0	121.8
1084	N	29.3	Very low	29.4	Very low	149 Å²	149	132 Å²	132	80%	0.797	74%	0.739	S	S	*	*				111.1	132.6	123.4	-98.7	7.7	0	0	0	121
1085	C	28.4	Very low	29.2	Very low	103 Å²	103	132.7 Å²	132.7	70%	0.696	74%	0.744	S	S	*	*			trans	70.8	88.2	146.6	-62.5	0	0	0	0	120.3
1086	N	27.2	Very low	29.2	Very low	145 Å²	145	131.2 Å²	131.2	78%	0.775	74%	0.744	S	S	*	*				43.4	133.5	116.7	-73.1	19	0	0	0	122.2
1087	N	28.1	Very low	29.1	Very low	137 Å²	137	129.6 Å²	129.6	73%	0.733	75%	0.746	S	S	*	*			trans	71.4	111.9	146.2	-56.9	0.9	0	0	0	118.5
1088	N	28.6	Very low	29.3	Very low	163 Å²	163	130 Å²	130	87%	0.872	75%	0.75	S	S	*	*				-162.5	176.6	89.2	-117.4	-11.6	0	0	0	113.7
1089	I	31.3	Very low	29.2	Very low	141 Å²	141	133.8 Å²	133.8	72%	0.723	76%	0.758	S	S	*	*			trans	-112.3	136.2	-176.5	-76.5	176	0	0	0	110.9
1090	N	28.7	Very low	29	Very low	163 Å²	163	132.1 Å²	132.1	87%	0.872	76%	0.756	S	S	*	*			trans	62.7	136.2	164	-61.3	-11.5	0	0	0	119.9
1091	G	28.1	Very low	29	Very low	80 Å²	80	132.7 Å²	132.7	83%	0.825	76%	0.757	S	S	*	*			trans	174.8	84.4	173.7	0	0	0	0	0	113.7
1092	L	30.1	Very low	28.8	Very low	154 Å²	154	137.1 Å²	137.1	81%	0.806	76%	0.764	S	S	*	*			trans	-39.2	153.8	-176.4	-72.3	160.2	0	0	0	119.8
1093	D	28	Very low	28.6	Very low	121 Å²	121	136.5 Å²	136.5	65%	0.647	76%	0.76	S	S	*	*			trans	62.1	106.4	143.7	-56.5	-14.3	0	0	0	119.7
1094	I	27.6	Very low	28.3	Very low	148 Å²	148	138.2 Å²	138.2	76%	0.759	76%	0.763	S	S	*	*				72.5	107	91.3	-64.8	159.4	0	0	0	113.4
1095	D	28.5	Very low	28.2	Very low	152 Å²	152	140.9 Å²	140.9	81%	0.813	77%	0.768	S	S	*	*				-155.2	178.4	121.5	-139.4	-31.9	0	0	0	112.5
1096	S	29	Very low	28.1	Very low	100 Å²	100	143.9 Å²	143.9	70%	0.699	78%	0.776	S	S	*	*			trans	-93.7	147.1	-140.1	-56.8	0	0	0	0	117
1097	S	28	Very low	28.2	Very low	110 Å²	110	145.2 Å²	145.2	77%	0.769	78%	0.783	S	S	*	*			trans	-73.3	160.8	162.4	-170.1	0	0	0	0	111.3
1098	P	36	Very low	28.1	Very low	107 Å²	107	141.9 Å²	141.9	70%	0.695	78%	0.781	S	S	*	*				-153.9	151.9	105.4	37	-19.3	0	0	0	118
1099	R	27.4	Very low	28.1	Very low	233 Å²	233	140.2 Å²	140.2	88%	0.879	78%	0.781	S	S	*	*			trans	67.9	155.2	146.1	-74.1	175.9	-179.7	-144.7	-0	119.4
1100	S	25.3	Very low	27.9	Very low	87 Å²	87	143.2 Å²	143.2	61%	0.608	79%	0.791	S	S	*	*			cis	-176.9	170.3	-25.3	53.5	0	0	0	0	110.5
1101	I	29.3	Very low	27.8	Very low	147 Å²	147	140.4 Å²	140.4	75%	0.754	79%	0.785	S	S	*	*			trans	86.6	90.3	163.5	-53.9	162.6	0	0	0	116.6
1102	F	25.8	Very low	27.7	Very low	193 Å²	193	141.9 Å²	141.9	85%	0.846	78%	0.782	S	S	*	*				49.7	140.7	113.7	-101.4	-89.6	0	0	0	123.9
1103	S	25.6	Very low	27.7	Very low	86 Å²	86	139.6 Å²	139.6	60%	0.601	78%	0.779	S	S	*	*			trans	67.6	100.8	150.6	48.9	0	0	0	0	120.5
1104	E	24.4	Very low	27.6	Very low	183 Å²	183	141.4 Å²	141.4	86%	0.855	79%	0.789	S	S	*	*				48.9	111	121.9	-60.2	-179.9	126.9	0	0	120
1105	K	27.8	Very low	27.6	Very low	206 Å²	206	144.3 Å²	144.3	90%	0.896	79%	0.792	S	S	*	*				-155.6	136.3	112.6	-115.5	161.3	-172.7	168	0	113.8
1106	L	25.8	Very low	27.4	Very low	166 Å²	166	144.7 Å²	144.7	87%	0.869	79%	0.789	S	S	*	*			trans	-66.8	144.1	163.6	-71.6	157.9	0	0	0	110
1107	N	28.1	Very low	27.9	Very low	173 Å²	173	145.7 Å²	145.7	93%	0.925	79%	0.793	S	S	*	*			trans	-157.7	143.9	150.3	-104	-23.9	0	0	0	109.2
1108	G	27.7	Very low	27.7	Very low	66 Å²	66	143.8 Å²	143.8	68%	0.68	79%	0.791	S	S	*	*			trans	-124.2	174	174.8	0	0	0	0	0	111.8
1109	C	26.8	Very low	27.2	Very low	129 Å²	129	147 Å²	147	87%	0.872	80%	0.801	S	S	*	*			trans	41.7	100	156.8	-59.2	0	0	0	0	118.7
1110	Q	28.6	Very low	27.2	Very low	203 Å²	203	141.9 Å²	141.9	95%	0.949	80%	0.796	S	S	*	*				-159.3	173.1	122.2	-111.2	171.6	27.6	0	0	111.5
1111	S	26.9	Very low	27.3	Very low	105 Å²	105	142.4 Å²	142.4	73%	0.734	80%	0.799	S	S	*	*			trans	-139.6	159.5	-154.5	53.5	0	0	0	0	115.4
1112	S	25.3	Very low	27.1	Very low	110 Å²	110	144.6 Å²	144.6	77%	0.769	81%	0.806	S	S	*	*			trans	84	157.7	153	80.9	0	0	0	0	120.5
1113	S	29.2	Very low	27.4	Very low	106 Å²	106	139.8 Å²	139.8	74%	0.741	80%	0.802	S	S	*	*			trans	69	138.1	-172.3	76.1	0	0	0	0	115.4
1114	N	26.8	Very low	27.5	Very low	160 Å²	160	141.5 Å²	141.5	86%	0.856	81%	0.805	S	S	*	*			cis	-122.4	172.4	10.2	-102.2	-42.2	0	0	0	115.1
1115	Y	28.6	Very low	27.7	Very low	209 Å²	209	143.4 Å²	143.4	82%	0.82	80%	0.804	S	S	*	*			trans	-94.3	175.7	-168.7	-108.7	-107.5	0	0	0	115.2
1116	Q	23.7	Very low	27.7	Very low	159 Å²	159	139.2 Å²	139.2	74%	0.743	79%	0.788	S	S	*	*			trans	-48.3	179.9	157.4	-58.9	167.5	-80.3	0	0	114.3
1117	P	39.3	Very low	27.9	Very low	122 Å²	122	140.4 Å²	140.4	79%	0.792	78%	0.78	S	S	*	*			cis	-136.6	171	-42.3	35.4	-19.2	0	0	0	114.1
1118	G	24.7	Very low	28	Very low	70 Å²	70	137.7 Å²	137.7	72%	0.722	77%	0.765	S	S	*	*			trans	107.7	124.7	137	0	0	0	0	0	121.3
1119	L	25.1	Very low	28	Very low	174 Å²	174	139.9 Å²	139.9	91%	0.911	77%	0.765	S	S	*	*			trans	73.5	148.4	143.2	-65.4	170.4	0	0	0	123.1
1120	V	25.8	Very low	28.1	Very low	126 Å²	126	142.6 Å²	142.6	76%	0.764	76%	0.762	S	S	*	*			trans	85.8	135.3	158.9	-156.8	0	0	0	0	119.9
1121	S	28.2	Very low	28.1	Very low	97 Å²	97	139.4 Å²	139.4	68%	0.678	76%	0.756	S	S	*	*			trans	61.6	119.3	163.7	47.6	0	0	0	0	118.2
1122	E	25.8	Very low	28.7	Very low	193 Å²	193	139.6 Å²	139.6	90%	0.902	76%	0.755	S	S	*	*			cis	85.7	100.8	48	-72.4	-172.1	129.2	0	0	115.5
1123	A	30.9	Very low	28.8	Very low	92 Å²	92	141.8 Å²	141.8	76%	0.76	76%	0.758	S	S	*	*			trans	-169.4	109	130.7	0	0	0	0	0	108.2
1124	N	28.6	Very low	28.8	Very low	123 Å²	123	142.2 Å²	142.2	66%	0.658	76%	0.756	S	S	*	*				59.6	120.3	92.2	-89.5	-22	0	0	0	113.9
1125	W	27.4	Very low	28.7	Very low	223 Å²	223	140 Å²	140	85%	0.845	75%	0.752	S	S	*	*			cis	-150.8	175.3	10.1	-33.1	73.3	0	0	0	108.3
1126	E	29.2	Very low	28.6	Very low	118 Å²	118	134.3 Å²	134.3	55%	0.551	74%	0.742	S	S	*	*			cis	-160.6	-155.2	-2.6	-141.8	-149	125	0	0	106.9
1127	R	29.1	Very low	28.9	Very low	190 Å²	190	133.7 Å²	133.7	72%	0.717	74%	0.744	S	S	*	*			cis	-149.7	126.2	0.6	170.5	156.4	-78.9	-113.6	-10.6	111.8
1128	I	30.7	Very low	28.5	Very low	117 Å²	117	133.1 Å²	133.1	60%	0.6	74%	0.738	S	S	*	*			trans	35	96.4	146.2	-55	175.8	0	0	0	121.3
1129	T	27.7	Very low	28.8	Very low	111 Å²	111	135.5 Å²	135.5	68%	0.681	74%	0.739	S	S	*	*				44.6	145.8	123.9	85.3	0	0	0	0	125.9
1130	K	29.8	Very low	29	Very low	186 Å²	186	135.9 Å²	135.9	81%	0.809	74%	0.741	S	S	*	*				112.7	125.2	123.9	-96.5	173.9	-179.7	177.9	0	120.6
1131	V	28	Very low	29.2	Very low	136 Å²	136	136.9 Å²	136.9	82%	0.824	74%	0.741	S	S	*	*			trans	79.4	141.9	144.9	172.9	0	0	0	0	116.8
1132	P	39.8	Very low	29.1	Very low	110 Å²	110	141.3 Å²	141.3	71%	0.714	75%	0.751	S	S	*	*			trans	-110.3	157.9	-155	40.2	-31.5	0	0	0	115.1
1133	N	26.6	Very low	29.6	Very low	155 Å²	155	137.1 Å²	137.1	83%	0.829	74%	0.74	S	S	*	*			trans	-172.9	153.3	143.5	-111	-25.6	0	0	0	113.8
1134	V	28.5	Very low	29.6	Very low	116 Å²	116	141.8 Å²	141.8	70%	0.703	74%	0.743	S	S	*	*			trans	63.9	119.3	141	172.2	0	0	0	0	120.8
1135	C	24.8	Very low	29.6	Very low	113 Å²	113	143.1 Å²	143.1	76%	0.764	75%	0.75	S	S	*	*			trans	64.3	153	150.7	-73.5	0	0	0	0	119.7
1136	S	27.5	Very low	29.5	Very low	89 Å²	89	138.3 Å²	138.3	62%	0.622	75%	0.749	S	S	*	*			cis	-160.8	176.2	-6.8	-112.8	0	0	0	0	110.4
1137	D	30	Very low	29.5	Very low	147 Å²	147	137.8 Å²	137.8	79%	0.786	76%	0.764	S	S	*	*			trans	73.5	141.4	152.6	-72	-44.4	0	0	0	119.8
1138	T	31.3	Very low	29.5	Very low	109 Å²	109	134 Å²	134	67%	0.669	77%	0.767	S	S	*	*			cis	-155.2	149.2	-10.9	-131.1	0	0	0	0	113.8
1139	T	30.1	Very low	29.4	Very low	121 Å²	121	133.6 Å²	133.6	74%	0.742	77%	0.774	S	S	*	*			trans	41.4	127.2	166.3	62.5	0	0	0	0	122.7
1140	L	29.2	Very low	29.4	Very low	181 Å²	181	133.3 Å²	133.3	95%	0.948	78%	0.777	S	S	*	*			trans	-135.2	149.9	144.2	-111.5	170.5	0	0	0	109
1141	I	30.6	Very low	29.4	Very low	148 Å²	148	129.3 Å²	129.3	76%	0.759	77%	0.773	S	S	*	*			trans	-105.7	130.7	-168.3	-61.9	170.5	0	0	0	111.3
1142	H	26.4	Very low	29.4	Very low	190 Å²	190	127.5 Å²	127.5	88%	0.88	77%	0.766	S	S	*	*			trans	-161.1	137.7	156.9	-117.9	-80.5	0	0	0	112.2
1143	P	36.1	Very low	28.8	Very low	105 Å²	105	130.1 Å²	130.1	68%	0.682	77%	0.773	S	S	*	*			trans	-114.4	139.1	-178.4	37.3	-29.8	0	0	0	115.4
1144	K	29.7	Very low	28.9	Very low	190 Å²	190	127 Å²	127	83%	0.826	76%	0.764	S	S	*	*			trans	-176	117.7	141.2	-108.4	168.2	-176.5	175.4	0	115.9
1145	L	28.4	Very low	28.9	Very low	151 Å²	151	126.7 Å²	126.7	79%	0.791	77%	0.766	S	S	*	*			trans	48.1	124.8	136.8	-62.1	173.8	0	0	0	123.6
1146	C	26.5	Very low	29.1	Very low	122 Å²	122	125.3 Å²	125.3	82%	0.824	76%	0.758	S	S	*	*			trans	68.4	108.7	137.3	-59.9	0	0	0	0	122.2
1147	A	28.2	Very low	29.3	Very low	106 Å²	106	128.8 Å²	128.8	88%	0.876	76%	0.764	S	S	*	*				-158.9	145.3	125.3	0	0	0	0	0	111.9
1148	S	29.2	Very low	29.2	Very low	111 Å²	111	126.8 Å²	126.8	78%	0.776	76%	0.761	S	S	*	*			trans	-67.3	163.6	-165.5	-42.8	0	0	0	0	119
1149	S	28.7	Very low	29.2	Very low	108 Å²	108	126.9 Å²	126.9	76%	0.755	77%	0.767	S	S	*	*			trans	123.1	120.6	130.2	-63.2	0	0	0	0	120.4
1150	S	28.5	Very low	29.2	Very low	106 Å²	106	126.2 Å²	126.2	74%	0.741	77%	0.767	S	S	*	*			trans	67.5	117.8	140.8	58	0	0	0	0	123.3
1151	S	28.6	Very low	29.1	Very low	102 Å²	102	126.8 Å²	126.8	71%	0.713	76%	0.758	S	S	*	*			trans	74.5	90.3	130.3	66.3	0	0	0	0	122.1
1152	S	28.9	Very low	29	Very low	98 Å²	98	123 Å²	123	69%	0.685	76%	0.755	S	S	*	*				83.2	122.3	105.8	71.9	0	0	0	0	123
1153	L	27.4	Very low	29.2	Very low	164 Å²	164	122.5 Å²	122.5	86%	0.859	75%	0.751	S	S	*	*			trans	75.3	142.9	141.9	-61.8	165.8	0	0	0	119
1154	S	27.7	Very low	28.9	Very low	91 Å²	91	123.1 Å²	123.1	64%	0.636	75%	0.753	S	S	*	*			cis	-170.4	167.3	-11.6	54.6	0	0	0	0	114.3
1155	S	28.9	Very low	28.7	Very low	108 Å²	108	118.7 Å²	118.7	76%	0.755	74%	0.737	S	S	*	*			trans	74.5	153.8	155.3	84.5	0	0	0	0	117.8
1156	S	29.3	Very low	28.7	Very low	84 Å²	84	116.9 Å²	116.9	59%	0.587	74%	0.737	S	S	*	*			cis	-152.3	155.5	-11.4	28.4	0	0	0	0	108.6
1157	H	32.3	Very low	28.6	Very low	163 Å²	163	118.6 Å²	118.6	76%	0.755	73%	0.733	S	S	*	*				-170.2	126.4	71.5	-87	-79.5	0	0	0	109.4
1158	S	28	Very low	28.6	Very low	104 Å²	104	118 Å²	118	73%	0.727	72%	0.723	S	S	*	*				51.8	125.2	92.3	70.8	0	0	0	0	115.9
1159	S	30.4	Very low	28.3	Very low	112 Å²	112	124.6 Å²	124.6	78%	0.783	73%	0.732	S	S	*	*			cis	-150.7	-156.3	3.1	61.3	0	0	0	0	109.9
1160	S	30.7	Very low	28.2	Very low	107 Å²	107	126.2 Å²	126.2	75%	0.748	73%	0.732	S	S	*	*			cis	-165.1	-165.3	23.4	-142.4	0	0	0	0	114.7
1161	Y	26.8	Very low	28	Very low	192 Å²	192	128.5 Å²	128.5	75%	0.753	74%	0.735	S	S	*	*			trans	-80.1	159.3	-172	-80	-99	0	0	0	117.9
1162	G	28.1	Very low	28	Very low	69 Å²	69	134.1 Å²	134.1	71%	0.711	74%	0.74	S	S	*	*			trans	173.2	42.5	152.7	0	0	0	0	0	127.5
1163	K	30.7	Very low	27.9	Very low	179 Å²	179	137.1 Å²	137.1	78%	0.778	75%	0.748	S	S	*	*			trans	70.1	156.9	159.5	-69.5	-174.9	172.8	-175	0	121.1
1164	T	30.6	Very low	27.9	Very low	118 Å²	118	138.5 Å²	138.5	72%	0.724	75%	0.748	S	S	*	*			trans	55.5	115.7	162.8	42.9	0	0	0	0	117.9
1165	I	25.1	Very low	28	Very low	98 Å²	98	139.3 Å²	139.3	50%	0.503	75%	0.753	S	S	.	*				67.6	110.7	51.6	-50.1	159.4	0	0	0	113.2	R1364	I1165-R1364 VanDerWaalsContact CD1-CD 3.42Å
1166	S	27.4	Very low	27.9	Very low	113 Å²	113	139.9 Å²	139.9	79%	0.79	76%	0.757	S	S	*	*			trans	-180	143	130.1	-96.1	0	0	0	0	109.9
1167	E	24.4	Very low	28	Very low	157 Å²	157	145.9 Å²	145.9	73%	0.734	77%	0.773	S	S	*	*			trans	-73.5	159.4	170.5	-58.4	91.4	148.8	0	0	112
1168	S	28	Very low	27.6	Very low	94 Å²	94	143.6 Å²	143.6	66%	0.657	78%	0.775	S	S	*	*				179.3	123.6	112.7	36.2	0	0	0	0	111.2	L1170	S1168-L1170 PolarHBondContact O-N 2.97Å
1169	Y	23.5	Very low	27.7	Very low	249 Å²	249	147.2 Å²	147.2	98%	0.976	79%	0.785	S	S	*	*			trans	-74.5	100.1	158.9	-95	-99.6	0	0	0	107.7
1170	L	27.6	Very low	27.5	Very low	143 Å²	143	146.7 Å²	146.7	75%	0.749	78%	0.782	S	S	*	*			trans	-120.6	128	174.3	-92.3	174.7	0	0	0	114.2	S1168	S1168-L1170 PolarHBondContact O-N 2.97Å
1171	L	24.4	Very low	27.5	Very low	153 Å²	153	148.5 Å²	148.5	80%	0.801	78%	0.783	S	S	*	*			trans	-40.2	163.9	162.4	-73.6	145.2	0	0	0	115.1
1172	R	27.2	Very low	27.6	Very low	221 Å²	221	150 Å²	150	83%	0.834	79%	0.787	S	S	*	*			trans	80.3	90.2	149.2	-163.8	172.8	-66.7	-164.6	-1.4	116.4	K1174	R1172-K1174 PolarHBondContact O-N 3.49Å
1173	N	28	Very low	27.6	Very low	160 Å²	160	158 Å²	158	86%	0.856	80%	0.796	S	S	*	*			trans	-51.3	108.4	161.2	-85	-32.5	0	0	0	112.4
1174	K	26.4	Very low	27.5	Very low	193 Å²	193	156.6 Å²	156.6	84%	0.839	80%	0.796	S	S	*	*			trans	-131.6	94.9	147.6	-85.3	-165.5	173.4	-173.5	0	108.4	R1172 S1176	R1172-K1174 PolarHBondContact O-N 3.49Å; K1174-S1176 PolarHBondContact O-N 3.1Å
1175	S	30	Very low	27.2	Very low	109 Å²	109	156.1 Å²	156.1	76%	0.762	79%	0.794	S	S	*	*			trans	-93.6	93.3	-178.3	40.7	0	0	0	0	111.8
1176	S	26.7	Very low	27.3	Very low	119 Å²	119	157.4 Å²	157.4	83%	0.832	80%	0.801	S	S	*	*			trans	-109.2	95.5	167.4	-62.5	0	0	0	0	109.5	K1174 S1178	K1174-S1176 PolarHBondContact O-N 3.1Å; S1176-S1178 PolarHBondContact O-N 3.11Å
1177	K	30.8	Very low	27.4	Very low	211 Å²	211	161.7 Å²	161.7	92%	0.917	81%	0.806	S	S	*	*			trans	-76.2	121.4	174.2	-76	-175.1	176.9	179.4	0	110.1
1178	S	25.3	Very low	27.4	Very low	114 Å²	114	158.8 Å²	158.8	80%	0.797	80%	0.803	S	S	*	*			trans	-90.2	144.5	158.3	56.1	0	0	0	0	110	S1176	S1176-S1178 PolarHBondContact O-N 3.11Å
1179	L	30.7	Very low	27.4	Very low	180 Å²	180	162 Å²	162	94%	0.942	81%	0.808	S	S	*	*			trans	-131.8	126.3	159.7	-102.2	170.9	0	0	0	106.8
1180	S	25.8	Very low	27.6	Very low	102 Å²	102	157.1 Å²	157.1	71%	0.713	79%	0.793	S	S	*	*			trans	-103.1	142	-167.3	51.6	0	0	0	0	112.1
1181	N	29.2	Very low	27.6	Very low	145 Å²	145	157 Å²	157	78%	0.775	79%	0.788	S	S	*	*			trans	-164.3	132.9	147.5	-118.8	-63.6	0	0	0	113.7
1182	R	28.8	Very low	27.7	Very low	222 Å²	222	157.9 Å²	157.9	84%	0.838	79%	0.789	S	S	*	*			trans	64.3	129.3	168.2	-48.6	-173.8	174.2	-159.4	-3.1	115.2
1183	R	29.2	Very low	27.8	Very low	237 Å²	237	155.5 Å²	155.5	89%	0.894	79%	0.787	S	S	*	*				54.9	133.3	55.7	-67.5	-169.6	-178.6	-175.3	1.4	111.6
1184	L	29	Very low	27.8	Very low	151 Å²	151	153.8 Å²	153.8	79%	0.791	79%	0.787	S	S	*	*			cis	-150.9	-179.1	22.6	-126.7	154.9	0	0	0	110.5
1185	T	23.2	Very low	28.1	Very low	108 Å²	108	152.3 Å²	152.3	66%	0.663	78%	0.783	S	S	*	*			trans	-87.2	-178.5	171.7	54.8	0	0	0	0	112
1186	D	27.6	Very low	28	Very low	125 Å²	125	158.6 Å²	158.6	67%	0.668	79%	0.79	S	S	*	*			trans	104.3	102.2	154.1	-58.9	-0.9	0	0	0	119.3
1187	F	29.2	Very low	28.4	Very low	202 Å²	202	157.9 Å²	157.9	89%	0.886	79%	0.785	S	S	*	*			trans	57.3	132.5	135.1	-69	-80.8	0	0	0	123.2
1188	S	24	Very low	28.7	Very low	97 Å²	97	156.2 Å²	156.2	68%	0.678	78%	0.781	S	S	*	*			trans	-69.4	135.4	167.9	-48.9	0	0	0	0	112.6
1189	H	28.8	Very low	28.9	Very low	162 Å²	162	156.4 Å²	156.4	75%	0.75	78%	0.781	S	S	*	*				178	143.6	98	-100.5	-57.3	0	0	0	115.6
1190	H	27.6	Very low	29	Very low	145 Å²	145	151.8 Å²	151.8	67%	0.671	76%	0.764	S	S	*	*			trans	74.9	134.9	145.6	-83.9	-73.7	0	0	0	124.7
1191	H	28.7	Very low	29.4	Very low	140 Å²	140	155.5 Å²	155.5	65%	0.648	77%	0.767	S	S	*	*			trans	70	86.7	153.5	-70.4	-64.4	0	0	0	123.4
1192	E	26.1	Very low	29.5	Very low	173 Å²	173	155.2 Å²	155.2	81%	0.808	77%	0.765	S	S	*	*				68.5	145.4	109.6	-75	-172.7	118.5	0	0	124
1193	H	29.4	Very low	29.6	Very low	170 Å²	170	151.8 Å²	151.8	79%	0.787	76%	0.756	S	S	*	*			trans	-81.7	158.1	-176.3	-70.6	-89.7	0	0	0	115.3
1194	S	28.3	Very low	29.6	Very low	125 Å²	125	146.2 Å²	146.2	87%	0.874	74%	0.74	S	S	*	*				-145.9	151.9	118.6	-149.9	0	0	0	0	112
1195	Q	32.7	Very low	29.5	Very low	161 Å²	161	144.7 Å²	144.7	75%	0.752	73%	0.732	S	S	*	*			trans	-126.4	154.5	-179.9	-68	-179.3	-12.9	0	0	110.5
1196	R	27.9	Very low	30.1	Very low	242 Å²	242	145.1 Å²	145.1	91%	0.913	74%	0.736	S	S	*	*			trans	-159.8	156.3	147.2	-127.3	174.7	-178.7	-178.6	0.3	116.1
1197	S	35	Very low	30.1	Very low	103 Å²	103	150.4 Å²	150.4	72%	0.72	75%	0.747	S	S	*	*			trans	76.4	134.5	169	72.2	0	0	0	0	117.8
1198	Q	35.3	Very low	30.2	Very low	176 Å²	176	151.8 Å²	151.8	82%	0.822	75%	0.748	S	S	*	*			cis	-149.5	125	-16.9	-109.3	176.2	37.5	0	0	107.2
1199	C	30	Very low	30.5	Very low	118 Å²	118	155 Å²	155	80%	0.797	75%	0.752	S	S	*	*				65.1	140.7	97.5	-72.8	0	0	0	0	115.6
1200	S	33.2	Very low	30.7	Very low	84 Å²	84	155.8 Å²	155.8	59%	0.587	75%	0.753	S	S	*	*			cis	-165.5	176.4	12.7	13.6	0	0	0	0	110.7
1201	K	34.2	Very low	31	Very low	180 Å²	180	153.9 Å²	153.9	78%	0.783	75%	0.748	S	S	*	*			cis	-162.7	156.9	3.8	-104.9	142.3	-155.4	127.8	0	107.1
1202	L	30.6	Very low	31.2	Very low	138 Å²	138	153.2 Å²	153.2	72%	0.723	75%	0.749	S	S	*	*			cis	-140.8	-53.4	-19.2	-137	-178.2	0	0	0	111.8	L1205	L1202-L1205 HydrophobicContact CD2-CD1 4Å
1203	K	32.2	Very low	31.4	Very low	150 Å²	150	152.2 Å²	152.2	65%	0.652	75%	0.748	S	S	*	*				-153.3	137.8	-71.7	-166.4	-138.8	177.6	-163.3	0	108.2
1204	H	29.1	Very low	31.4	Very low	121 Å²	121	153 Å²	153	56%	0.56	75%	0.749	S	S	*	*			cis	-87.1	178.8	-25.9	-79.8	-44	0	0	0	109.6
1205	L	26.5	Very low	31.8	Very low	118 Å²	118	152.7 Å²	152.7	62%	0.618	74%	0.744	S	S	*	*			cis	93.7	149.2	3	-70.8	123.9	0	0	0	118.2	L1202	L1202-L1205 HydrophobicContact CD2-CD1 4Å
1206	P	35.8	Very low	31.4	Very low	117 Å²	117	153 Å²	153	76%	0.76	75%	0.75	S	S	*	*			cis	-128.7	-170.4	9.7	40.8	-23.6	0	0	0	117.2
1207	R	27.5	Very low	31.5	Very low	236 Å²	236	146.6 Å²	146.6	89%	0.891	74%	0.742	S	S	*	*			trans	-124.4	165.4	172.7	-83.8	-176.6	172.7	-179.7	-3.3	110.5
1208	Y	32.2	Very low	31	Very low	231 Å²	231	149.3 Å²	149.3	91%	0.906	75%	0.748	S	S	*	*			trans	-123.7	-175.8	157.3	-101.1	-81.2	0	0	0	113
1209	H	29.7	Very low	30.7	Very low	166 Å²	166	146.9 Å²	146.9	77%	0.769	75%	0.745	S	S	*	*			trans	-149.2	176.7	-138.3	-145.3	-87.8	0	0	0	115.7
1210	K	32.4	Very low	30.7	Very low	177 Å²	177	146.7 Å²	146.7	77%	0.77	74%	0.74	S	S	*	*			trans	98.1	156.3	166.3	-61.3	-162.7	154.8	-166.8	0	117.6
1211	D	33.9	Very low	30.4	Very low	106 Å²	106	148.1 Å²	148.1	57%	0.567	75%	0.746	S	S	*	*			cis	-175	163.6	-23.6	-93.9	-24.6	0	0	0	108.5
1212	N	32.4	Very low	29.9	Very low	126 Å²	126	145.6 Å²	145.6	67%	0.674	74%	0.741	S	S	*	*			cis	-170	166.3	-38.2	-134.1	-54	0	0	0	111.7
1213	I	31	Very low	30.1	Very low	152 Å²	152	146.8 Å²	146.8	78%	0.779	74%	0.743	S	S	*	*			trans	69.9	160.9	156.5	-67.5	159.9	0	0	0	120.7
1214	K	30.4	Very low	29.8	Very low	185 Å²	185	145.7 Å²	145.7	80%	0.804	75%	0.748	S	S	*	*				175.6	151.7	-54.6	-137.1	-175.9	-178.1	-179.1	0	112.4
1215	P	35.4	Very low	30.4	Very low	119 Å²	119	145.6 Å²	145.6	77%	0.773	76%	0.758	S	S	*	*			trans	-95.2	-163.2	153.2	-17.1	35.3	0	0	0	115.8
1216	L	25.8	Very low	30.5	Very low	167 Å²	167	145.2 Å²	145.2	87%	0.874	77%	0.765	S	S	*	*			trans	-138.5	-167.7	-161.5	-142.7	71.2	0	0	0	114.7
1217	S	28.3	Very low	30.2	Very low	109 Å²	109	145.4 Å²	145.4	76%	0.762	77%	0.768	S	S	*	*			trans	56.7	111.1	174.4	55.9	0	0	0	0	118
1218	L	24.4	Very low	30.2	Very low	160 Å²	160	138.5 Å²	138.5	84%	0.838	76%	0.756	S	S	*	*			cis	81.2	145.3	9.5	-145	146.7	0	0	0	116
1219	V	29.5	Very low	30	Very low	125 Å²	125	133.6 Å²	133.6	76%	0.758	75%	0.745	S	S	*	*			trans	84.3	136.4	-172.1	-173.3	0	0	0	0	112.3
1220	T	30.7	Very low	29.9	Very low	114 Å²	114	133.8 Å²	133.8	70%	0.699	75%	0.746	S	S	*	*			cis	-136.6	136.4	-0.7	14.5	0	0	0	0	108
1221	T	26.3	Very low	29.6	Very low	114 Å²	114	131.3 Å²	131.3	70%	0.699	75%	0.746	S	S	*	*				41.4	138.6	98.4	67.4	0	0	0	0	119.3
1222	D	24.5	Very low	29.2	Very low	127 Å²	127	131.3 Å²	131.3	68%	0.679	76%	0.755	S	S	*	*			trans	88.8	137.6	140.4	-91.5	35.3	0	0	0	124
1223	Q	33.2	Very low	28.9	Very low	163 Å²	163	130.1 Å²	130.1	76%	0.762	76%	0.756	S	S	*	*			trans	73.8	139.3	145.8	-71	168.7	54.1	0	0	120.9
1224	V	27.5	Very low	28.6	Very low	127 Å²	127	132.9 Å²	132.9	77%	0.77	76%	0.758	S	S	*	*			cis	-159.4	152.5	-22.9	107.6	0	0	0	0	109.6
1225	P	41.4	Very low	28.4	Very low	118 Å²	118	129 Å²	129	77%	0.766	75%	0.75	S	S	*	*			trans	-106.2	165.4	-176.1	39.8	-33.4	0	0	0	115
1226	S	28.9	Very low	28	Very low	111 Å²	111	128.2 Å²	128.2	78%	0.776	75%	0.747	S	S	*	*			trans	-169.4	161.7	162.7	55.4	0	0	0	0	108.4
1227	C	28.1	Very low	28.1	Very low	120 Å²	120	128.8 Å²	128.8	81%	0.811	74%	0.739	S	S	*	*			cis	-165.8	157.3	-22.5	-98.9	0	0	0	0	106.2
1228	S	28.4	Very low	28.1	Very low	92 Å²	92	131.9 Å²	131.9	64%	0.643	74%	0.738	S	S	*	*			cis	-168.5	178.9	-8.7	47.4	0	0	0	0	109.8
1229	N	27.5	Very low	28.3	Very low	127 Å²	127	129 Å²	129	68%	0.679	73%	0.731	S	S	*	*			trans	1.7	136.3	152.9	-43.7	-9	0	0	0	118.6
1230	H	28.7	Very low	28.3	Very low	171 Å²	171	131.3 Å²	131.3	79%	0.792	73%	0.731	S	S	*	*				-174.1	153.3	86.8	-108.2	-74.9	0	0	0	114.4
1231	T	25.9	Very low	28.2	Very low	125 Å²	125	133.1 Å²	133.1	77%	0.767	73%	0.731	S	S	*	*			trans	-92.9	152.1	165	40.9	0	0	0	0	111.8
1232	S	25.3	Very low	28	Very low	106 Å²	106	132.2 Å²	132.2	74%	0.741	73%	0.729	S	S	*	*			trans	82.4	122.6	149.9	-143.4	0	0	0	0	120.7
1233	S	26.5	Very low	28	Very low	100 Å²	100	132.1 Å²	132.1	70%	0.699	73%	0.729	S	S	*	*			trans	80.9	154.7	135.9	89	0	0	0	0	118.8
1234	Y	23.7	Very low	27.6	Very low	211 Å²	211	131.6 Å²	131.6	83%	0.827	73%	0.726	S	S	*	*			cis	-163.4	176.1	-9.2	-136.8	-136.5	0	0	0	111
1235	V	27.6	Very low	27.4	Very low	104 Å²	104	132.4 Å²	132.4	63%	0.63	73%	0.725	S	S	*	*			trans	50.2	120.1	169.7	-104	0	0	0	0	117.5	Y1237	V1235-Y1237 HydrophobicContact CG1-CE2 4.31Å
1236	S	26.2	Very low	26.5	Very low	101 Å²	101	131.1 Å²	131.1	71%	0.706	72%	0.719	S	S	*	*			cis	64.4	130	39.9	-170.2	0	0	0	0	115.5
1237	Y	28.5	Very low	26.5	Very low	180 Å²	180	129.1 Å²	129.1	71%	0.706	72%	0.716	S	S	*	*			trans	-171.1	123.3	134.4	-102.1	-50.2	0	0	0	114	V1235	V1235-Y1237 HydrophobicContact CG1-CE2 4.31Å
1238	K	27.9	Very low	26.4	Very low	173 Å²	173	129.4 Å²	129.4	75%	0.752	71%	0.71	S	S	*	*			trans	59.4	155.4	149.4	-71.5	156.7	-177.6	169.8	0	117.2
1239	C	27.2	Very low	26.4	Very low	101 Å²	101	130.5 Å²	130.5	68%	0.682	71%	0.708	S	S	*	*			cis	-148.7	159.8	2.4	-133.3	0	0	0	0	106.8
1240	K	29.9	Very low	26.4	Very low	173 Å²	173	130.1 Å²	130.1	75%	0.752	71%	0.706	S	S	*	*			cis	-134.9	150.6	18.7	-94.4	-178.2	179.7	179.6	0	109.5
1241	Q	28.1	Very low	26.2	Very low	152 Å²	152	128.6 Å²	128.6	71%	0.71	70%	0.699	S	S	*	*				40.9	110.1	94.5	-62.9	176.6	-57.7	0	0	113.2
1242	S	23.9	Very low	26.4	Very low	94 Å²	94	129.5 Å²	129.5	66%	0.657	69%	0.692	S	S	*	*			cis	82.2	150	49.4	77.9	0	0	0	0	114.2
1243	N	23.3	Very low	26.5	Very low	125 Å²	125	131.1 Å²	131.1	67%	0.668	69%	0.688	S	S	*	*			trans	75.6	141.5	167	-85.5	37	0	0	0	118.6
1244	E	24.4	Very low	26.4	Very low	153 Å²	153	133.5 Å²	133.5	72%	0.715	69%	0.692	S	S	*	*			trans	71	142.4	145.7	-64.9	160.3	-133.1	0	0	117.8
1245	L	24.7	Very low	26.6	Very low	143 Å²	143	128.7 Å²	128.7	75%	0.749	68%	0.684	S	S	*	*			cis	-154.2	-178.4	-10.3	-123.1	165.1	0	0	0	111.1	G1247	L1245-G1247 PolarHBondContact O-N 3.33Å
1246	S	22.6	Very low	26.6	Very low	92 Å²	92	128.9 Å²	128.9	64%	0.643	69%	0.686	S	S	*	*			trans	-37.1	122.2	171.4	53.2	0	0	0	0	115.7
1247	G	27.8	Very low	26.7	Very low	68 Å²	68	130.1 Å²	130.1	70%	0.701	68%	0.684	S	S	*	*			trans	-122.3	127.9	134.2	0	0	0	0	0	106.5	L1245	L1245-G1247 PolarHBondContact O-N 3.33Å
1248	N	25.5	Very low	26.7	Very low	127 Å²	127	132.3 Å²	132.3	68%	0.679	69%	0.691	S	S	*	*			cis	52.7	117	46.3	-66.6	54.9	0	0	0	110.1
1249	D	29.2	Very low	27.2	Very low	115 Å²	115	129.1 Å²	129.1	62%	0.615	69%	0.688	S	S	*	*			cis	-156.8	153.6	19.5	-106.3	-25.2	0	0	0	113.7
1250	L	28	Very low	27.2	Very low	119 Å²	119	131.6 Å²	131.6	62%	0.623	69%	0.693	S	S	*	*			trans	61.4	125.3	134	-62.6	172.8	0	0	0	117.5
1251	Q	24.5	Very low	27.6	Very low	139 Å²	139	128.3 Å²	128.3	65%	0.65	69%	0.69	S	S	*	*				61.8	144.2	91.9	-68.7	-179.8	18.7	0	0	113.6
1252	K	30.1	Very low	27.7	Very low	143 Å²	143	128.2 Å²	128.2	62%	0.622	69%	0.693	S	S	*	*			cis	-160.1	175.4	23	-137	162.5	-177.4	150.3	0	113.3
1253	E	26	Very low	27.9	Very low	141 Å²	141	130.7 Å²	130.7	66%	0.659	70%	0.699	S	S	*	*			trans	14.3	128.2	139.8	-75	160.8	168.5	0	0	119.5
1254	L	25.1	Very low	28.1	Very low	149 Å²	149	129.4 Å²	129.4	78%	0.78	70%	0.698	S	S	*	*				86.3	168.3	71.4	-140.7	73.9	0	0	0	112
1255	V	28.8	Very low	28.1	Very low	111 Å²	111	129 Å²	129	67%	0.673	70%	0.701	S	S	*	*			trans	63.6	64.7	160	-172.1	0	0	0	0	116.3
1256	T	27.5	Very low	28.5	Very low	108 Å²	108	131.8 Å²	131.8	66%	0.663	71%	0.707	S	S	*	*				57	158.7	108.9	67	0	0	0	0	123
1257	N	28.2	Very low	28.6	Very low	126 Å²	126	133.9 Å²	133.9	67%	0.674	71%	0.711	S	S	*	*			trans	92	102.4	135.3	-81.4	-34.5	0	0	0	120.7
1258	R	28.2	Very low	28.7	Very low	226 Å²	226	136.8 Å²	136.8	85%	0.853	71%	0.71	S	S	*	*				96.3	151.8	115.9	-82.1	-174	171.9	-135.3	-4.6	119.3
1259	P	37.2	Very low	28.8	Very low	106 Å²	106	137.4 Å²	137.4	69%	0.688	71%	0.714	S	S	*	*			trans	-143	-136.4	-130.7	38.3	-12.5	0	0	0	113.4
1260	I	29.2	Very low	28.8	Very low	153 Å²	153	136.1 Å²	136.1	79%	0.785	71%	0.714	S	S	*	*			trans	73.6	162.4	170.1	7.6	-176.3	0	0	0	116.1
1261	P	38.2	Very low	28.7	Very low	104 Å²	104	136.7 Å²	136.7	68%	0.675	72%	0.718	S	S	*	*				-130.9	-161.9	-107.8	44.5	-26.7	0	0	0	113.8
1262	I	30.3	Very low	29	Very low	151 Å²	151	137.6 Å²	137.6	77%	0.774	72%	0.722	S	S	*	*				170.2	115.9	124.6	-85.4	158.2	0	0	0	111.4
1263	N	27.1	Very low	28.8	Very low	146 Å²	146	138.4 Å²	138.4	78%	0.781	73%	0.732	S	S	*	*			trans	31.2	162.6	132.4	-142.7	1.3	0	0	0	124.8
1264	C	27.2	Very low	28.9	Very low	97 Å²	97	134.8 Å²	134.8	66%	0.655	73%	0.733	S	S	*	*			trans	92	100.5	154	-63.7	0	0	0	0	121.3
1265	N	25.4	Very low	29.1	Very low	146 Å²	146	136.6 Å²	136.6	78%	0.781	73%	0.734	S	S	*	*			trans	25.5	128.1	130.5	-60.6	-4.7	0	0	0	121
1266	K	31.6	Very low	29.2	Very low	201 Å²	201	137.7 Å²	137.7	87%	0.874	74%	0.737	S	S	*	*				-174.6	126.9	106.1	-101.1	166.1	-176.7	178.2	0	115
1267	N	26.1	Very low	29.2	Very low	135 Å²	135	138.9 Å²	138.9	72%	0.722	74%	0.739	S	S	*	*				27.2	140.5	126.1	-96.5	53.6	0	0	0	123.6
1268	D	29.7	Very low	29.3	Very low	129 Å²	129	140 Å²	140	69%	0.69	74%	0.744	S	S	*	*			trans	89.5	145.4	137.7	-63.2	-31.9	0	0	0	123.3
1269	N	28.4	Very low	29.5	Very low	140 Å²	140	134 Å²	134	75%	0.749	74%	0.738	S	S	*	*			trans	77.4	81.9	158.3	-71.7	-50.2	0	0	0	121.5
1270	S	28.1	Very low	29.1	Very low	89 Å²	89	133 Å²	133	62%	0.622	74%	0.738	S	S	*	*				56.4	147.4	96.6	82.3	0	0	0	0	122
1271	N	26.9	Very low	29.2	Very low	131 Å²	131	133.9 Å²	133.9	70%	0.701	75%	0.745	S	S	*	*			trans	85.5	122.3	148.9	-77.7	-53.8	0	0	0	122.8
1272	Q	29.1	Very low	28.8	Very low	157 Å²	157	134.1 Å²	134.1	73%	0.734	75%	0.749	S	S	*	*			trans	90.9	104.4	130.6	-73.5	-179.2	39.3	0	0	123.2
1273	L	26.2	Very low	29.5	Very low	160 Å²	160	132 Å²	132	84%	0.838	75%	0.745	S	S	*	*				81.2	134.5	104	-150.9	77.6	0	0	0	120.5
1274	G	28.7	Very low	29.7	Very low	66 Å²	66	132.8 Å²	132.8	68%	0.68	75%	0.748	S	S	*	*			trans	113.4	96.4	169	0	0	0	0	0	112.6
1275	K	29.9	Very low	29.9	Very low	187 Å²	187	132.5 Å²	132.5	81%	0.813	75%	0.747	S	S	*	*				66.4	128.1	60	-67.5	-167.5	173.5	-178.2	0	115.7
1276	N	29.2	Very low	30.3	Very low	134 Å²	134	130.8 Å²	130.8	72%	0.717	75%	0.747	S	S	*	*			trans	104.7	90	154.2	-57.3	-19.2	0	0	0	120
1277	N	28.7	Very low	30.4	Very low	132 Å²	132	125.8 Å²	125.8	71%	0.706	74%	0.737	S	S	*	*				55.1	134.9	108.4	-58.3	-0.9	0	0	0	122.7
1278	N	31.1	Very low	30.8	Very low	149 Å²	149	126.3 Å²	126.3	80%	0.797	74%	0.738	S	S	*	*			trans	74.4	150.7	145.1	-62.2	-5.2	0	0	0	119.2
1279	S	30.4	Very low	30.9	Very low	102 Å²	102	126.2 Å²	126.2	71%	0.713	74%	0.743	S	S	*	*			cis	-171.3	144.6	-22.6	52.6	0	0	0	0	111.8
1280	A	29.5	Very low	31.2	Very low	85 Å²	85	123.6 Å²	123.6	70%	0.702	74%	0.74	S	S	*	*			trans	45.7	131.8	147.5	0	0	0	0	0	122.2
1281	N	32.5	Very low	31.5	Very low	171 Å²	171	125.7 Å²	125.7	91%	0.914	75%	0.749	S	S	*	*				-165.2	153.5	113.2	-96.8	-29.2	0	0	0	112.3
1282	S	29.5	Very low	31.8	Very low	109 Å²	109	127.9 Å²	127.9	76%	0.762	75%	0.752	S	S	*	*			trans	-135.7	169.5	176.8	62.6	0	0	0	0	110.2
1283	P	44.4	Very low	31.9	Very low	107 Å²	107	125 Å²	125	70%	0.695	75%	0.745	S	S	*	*			trans	-153.3	141.4	130.5	32.3	-12.8	0	0	0	118
1284	L	32	Very low	32	Very low	162 Å²	162	123 Å²	123	85%	0.848	74%	0.74	S	S	*	*			trans	61.6	151.7	132.5	-58.2	171.2	0	0	0	122.1
1285	S	30.6	Very low	32.1	Very low	91 Å²	91	125.5 Å²	125.5	64%	0.636	74%	0.743	S	S	*	*			cis	-175.5	170.4	-24.9	55.2	0	0	0	0	112.3
1286	S	33.3	Very low	32	Very low	110 Å²	110	125.5 Å²	125.5	77%	0.769	74%	0.742	S	S	*	*			trans	78.9	155	162.6	-74.1	0	0	0	0	117.5
1287	S	33.8	Very low	31.8	Very low	95 Å²	95	124.9 Å²	124.9	66%	0.664	75%	0.747	S	S	*	*			cis	-175.3	163.4	-11.7	-97.9	0	0	0	0	109.2
1288	I	34.5	Very low	31.5	Very low	146 Å²	146	123.4 Å²	123.4	75%	0.749	75%	0.747	S	S	*	*			cis	-168.9	-173.5	-19.7	-110.8	173.5	0	0	0	107.4
1289	T	33.1	Very low	31.4	Very low	128 Å²	128	123.1 Å²	123.1	79%	0.785	75%	0.746	S	S	*	*			trans	112.4	150.2	151.1	-15.6	0	0	0	0	119.7
1290	A	34	Very low	31.2	Very low	85 Å²	85	126.4 Å²	126.4	70%	0.702	75%	0.75	S	S	*	*			trans	-4.4	148.5	156.4	0	0	0	0	0	120.7
1291	V	33.3	Very low	31	Very low	133 Å²	133	132.4 Å²	132.4	81%	0.806	76%	0.76	S	S	*	*			cis	-173.8	157.4	8.3	115.7	0	0	0	0	107.2
1292	K	33.1	Very low	30.6	Very low	177 Å²	177	132.6 Å²	132.6	77%	0.77	76%	0.755	S	S	*	*			cis	-153.9	-173.6	0	-112.8	-166.7	169.5	-175.4	0	106.7
1293	T	31.5	Very low	30.8	Very low	95 Å²	95	132.1 Å²	132.1	58%	0.583	75%	0.75	S	S	*	*				-165.4	144.4	-61.3	34.7	0	0	0	0	109.6
1294	T	29.9	Very low	30	Very low	119 Å²	119	132.5 Å²	132.5	73%	0.73	75%	0.746	S	S	*	*			trans	63.4	141.4	146	57.4	0	0	0	0	120.9
1295	T	30.4	Very low	30	Very low	119 Å²	119	132.2 Å²	132.2	73%	0.73	74%	0.738	S	S	*	*			cis	-165.9	141.5	-4.9	12.4	0	0	0	0	114.5
1296	K	27.7	Very low	29.9	Very low	186 Å²	186	133.9 Å²	133.9	81%	0.809	74%	0.739	S	S	*	*			trans	36.3	131.3	130.8	-75.4	-167.8	173.4	-170.4	0	124.7
1297	C	23.7	Very low	29.6	Very low	122 Å²	122	139.2 Å²	139.2	82%	0.824	74%	0.744	S	S	*	*				76.6	168.2	125	-62.7	0	0	0	0	122.3
1298	S	24.1	Very low	29.2	Very low	100 Å²	100	142 Å²	142	70%	0.699	75%	0.746	S	S	*	*			trans	-88	170.1	-164.9	-42.6	0	0	0	0	116.1
1299	D	27.8	Very low	28.9	Very low	143 Å²	143	145.3 Å²	145.3	77%	0.765	76%	0.755	S	S	*	*			trans	77.5	128.4	152.6	-56.6	-38.6	0	0	0	121.1
1300	H	26.5	Very low	28.5	Very low	172 Å²	172	143.7 Å²	143.7	80%	0.796	75%	0.749	S	S	*	*			trans	45.4	106.1	159.6	-79.6	-93.6	0	0	0	119.7
1301	F	25.4	Very low	28.2	Very low	210 Å²	210	144 Å²	144	92%	0.921	75%	0.746	S	S	*	*				-163.4	143.5	101.8	-110.8	-79.2	0	0	0	111.9
1302	Q	23.7	Very low	28	Very low	175 Å²	175	143.7 Å²	143.7	82%	0.818	74%	0.739	S	S	*	*			trans	-109.5	170.2	167.2	-108.4	-164.3	20.9	0	0	108.4
1303	P	33.4	Very low	27.7	Very low	99 Å²	99	141.1 Å²	141.1	64%	0.643	74%	0.742	S	S	*	*			cis	-148.8	-171.1	38.2	43.6	-22.8	0	0	0	117.5
1304	D	28.5	Very low	27.6	Very low	115 Å²	115	142.5 Å²	142.5	62%	0.615	75%	0.746	S	S	*	*			trans	66.4	142.2	153.8	-73.1	-12.6	0	0	0	119.7
1305	K	32	Very low	27.5	Very low	156 Å²	156	144.9 Å²	144.9	68%	0.678	75%	0.754	S	S	*	*			cis	-159.9	148	-7.4	-122.4	158.6	-168.2	140.6	0	111.6
1306	L	27.1	Very low	27.5	Very low	126 Å²	126	144.5 Å²	144.5	66%	0.66	75%	0.754	S	S	*	*			trans	29.1	128.6	149.4	-62.7	166	0	0	0	119.3
1307	Y	28.2	Very low	27.6	Very low	223 Å²	223	144.1 Å²	144.1	88%	0.875	76%	0.759	S	S	*	*				-154	159.9	70.8	-103.9	-84.8	0	0	0	114.4
1308	H	26.3	Very low	27.6	Very low	152 Å²	152	145.8 Å²	145.8	70%	0.704	76%	0.759	S	S	*	*			trans	-76.3	148.2	175.4	-92.6	-108.2	0	0	0	113.5
1309	F	26.3	Very low	27.7	Very low	216 Å²	216	148.6 Å²	148.6	95%	0.947	77%	0.765	S	S	*	*				-151.7	148.1	119.6	-113.6	-74.8	0	0	0	110.7
1310	S	24.7	Very low	27.6	Very low	94 Å²	94	150.8 Å²	150.8	66%	0.657	77%	0.773	S	S	*	*			trans	-128.4	156	-177.6	53.1	0	0	0	0	111.5
1311	S	28	Very low	27.5	Very low	92 Å²	92	151.1 Å²	151.1	64%	0.643	78%	0.778	S	S	*	*				144.2	151.7	120.5	-159.2	0	0	0	0	114.4
1312	I	28.8	Very low	27.4	Very low	127 Å²	127	150.5 Å²	150.5	65%	0.651	77%	0.774	S	S	*	*			trans	67.3	131.9	167.6	-58.9	135.6	0	0	0	115
1313	C	27.7	Very low	27.5	Very low	123 Å²	123	148 Å²	148	83%	0.831	77%	0.772	S	S	*	*			cis	-96.5	141.2	8.9	-51.9	0	0	0	0	112.3
1314	N	29.5	Very low	27.1	Very low	124 Å²	124	148.9 Å²	148.9	66%	0.663	78%	0.775	S	S	*	*			cis	67.4	84	35.5	-70	10.5	0	0	0	115.6
1315	D	26.8	Very low	27	Very low	168 Å²	168	149 Å²	149	90%	0.898	78%	0.78	S	S	*	*			trans	-122.7	115.4	149.4	-118	-29.4	0	0	0	107.3
1316	P	31.6	Very low	26.6	Very low	112 Å²	112	150.2 Å²	150.2	73%	0.727	79%	0.785	S	S	*	*			trans	-118.8	90.7	-175.8	37.5	-25.4	0	0	0	113.3
1317	I	28.7	Very low	26.5	Very low	178 Å²	178	151.6 Å²	151.6	91%	0.913	79%	0.792	S	S	*	*			trans	-128.4	94.3	150.1	-58.4	-175.9	0	0	0	109.1
1318	N	25.5	Very low	26.4	Very low	157 Å²	157	145.7 Å²	145.7	84%	0.84	78%	0.779	S	S	*	*			trans	-139.3	162.3	157.4	-162.8	-13.1	0	0	0	106.3
1319	L	25.7	Very low	26.4	Very low	158 Å²	158	142.9 Å²	142.9	83%	0.827	77%	0.774	S	S	*	*			trans	71.3	64.2	174.2	-150.9	80.7	0	0	0	117.9
1320	M	24.3	Very low	26.3	Very low	189 Å²	189	138 Å²	138	93%	0.931	77%	0.767	S	S	*	*	S	Bend	trans	-148	159	136.3	-127.4	-175.3	-178.3	0	0	110.9
1321	M	25.6	Very low	26.5	Very low	180 Å²	180	137.2 Å²	137.2	89%	0.887	77%	0.774	S	S	*	*			trans	59.4	50.4	-169.6	-62.6	-160.7	173.9	0	0	115.8
1322	K	24.1	Very low	26.5	Very low	196 Å²	196	141.6 Å²	141.6	85%	0.852	78%	0.784	S	S	*	*			trans	-107.3	73.1	142.7	-90.2	-168	173.8	-176.5	0	110.2
1323	T	25.8	Very low	26.5	Very low	124 Å²	124	142.4 Å²	142.4	76%	0.761	79%	0.788	S	S	*	*			trans	-100.1	63.9	165.5	22	0	0	0	0	109.6	T1325	T1323-T1325 VanDerWaalsContact C-N 3.32Å; T1323-T1325 PolarHBondContact O-N 2.85Å
1324	T	24.6	Very low	26.6	Very low	117 Å²	117	143.5 Å²	143.5	72%	0.718	78%	0.784	S	S	*	*			trans	-70.1	94.4	162.9	-52.1	0	0	0	0	107.5	K1326	T1324-K1326 VanDerWaalsContact C-N 3.32Å; T1324-K1326 PolarHBondContact O-N 3.49Å
1325	T	25.6	Very low	26.4	Very low	116 Å²	116	146 Å²	146	71%	0.712	79%	0.789	S	S	*	*			trans	-63.4	96.6	165.1	43	0	0	0	0	108.1	T1323 I1327	T1323-T1325 VanDerWaalsContact C-N 3.32Å; T1323-T1325 PolarHBondContact O-N 2.85Å; T1325-I1327 PolarHBondContact O-N 2.73Å
1326	K	23.8	Very low	26.5	Very low	183 Å²	183	145.8 Å²	145.8	80%	0.796	79%	0.788	S	S	*	*			trans	-60.3	103.7	160	-72.8	-176.2	177.2	-176.7	0	107	T1324 T1328	T1324-K1326 VanDerWaalsContact C-N 3.32Å; T1324-K1326 PolarHBondContact O-N 3.49Å; K1326-T1328 PolarHBondContact O-N 2.71Å
1327	I	25.6	Very low	26.2	Very low	154 Å²	154	149.7 Å²	149.7	79%	0.79	80%	0.796	S	S	*	*			trans	-76.5	113.5	155.6	-62.7	176.9	0	0	0	104.5	T1325 P1329	T1325-I1327 PolarHBondContact O-N 2.73Å; I1327-P1329 WeakPolarHBondContact O-CD 3.24Å
1328	T	26.3	Very low	26.2	Very low	99 Å²	99	147 Å²	147	61%	0.607	78%	0.783	S	S	*	*			trans	-86.6	117.4	173.7	-53.3	0	0	0	0	107.7	K1326 S1330	K1326-T1328 PolarHBondContact O-N 2.71Å; T1328-S1330 WeakPolarHBondContact CG2-OG 3.25Å; T1328-S1330 PolarHBondContact O-N 2.9Å
1329	P	26.5	Very low	26.3	Very low	94 Å²	94	148 Å²	148	61%	0.61	78%	0.782	S	S	*	*			trans	-76.9	69.7	172.3	32.4	-34.2	0	0	0	110.5	I1327 G1331	I1327-P1329 WeakPolarHBondContact O-CD 3.24Å; P1329-G1331 VanDerWaalsContact C-N 3.33Å; P1329-G1331 PolarHBondContact O-N 3.28Å; P1329-G1331 VanDerWaalsContact O-N 3.08Å
1330	S	24.1	Very low	26.4	Very low	114 Å²	114	149.6 Å²	149.6	80%	0.797	79%	0.785	S	S	*	*			trans	-78.1	83.6	168.9	-67.9	0	0	0	0	109.4	T1328	T1328-S1330 WeakPolarHBondContact CG2-OG 3.25Å; T1328-S1330 PolarHBondContact O-N 2.9Å
1331	G	28.9	Very low	26.9	Very low	77 Å²	77	143.4 Å²	143.4	79%	0.794	76%	0.756	S	S	*	*			trans	-166.3	64.2	-175.5	0	0	0	0	0	112.3	P1329	P1329-G1331 VanDerWaalsContact C-N 3.33Å; P1329-G1331 PolarHBondContact O-N 3.28Å; P1329-G1331 VanDerWaalsContact O-N 3.08Å
1332	Q	27.8	Very low	27	Very low	183 Å²	183	143 Å²	143	86%	0.855	75%	0.751	S	S	*	*			trans	-103.3	151	-179.6	-153.2	172.5	22.6	0	0	110.3
1333	I	28.6	Very low	27.5	Very low	144 Å²	144	136.3 Å²	136.3	74%	0.738	73%	0.725	S	S	*	*			trans	77.6	95.8	176.4	-45.9	164	0	0	0	115.1
1334	I	28.6	Very low	27.7	Very low	147 Å²	147	138.3 Å²	138.3	75%	0.754	73%	0.731	S	S	*	*				-121.5	147.8	95	-66	-172	0	0	0	107
1335	K	26.1	Very low	28.6	Very low	176 Å²	176	139.7 Å²	139.7	77%	0.765	73%	0.733	S	S	*	*			trans	-79.2	141.1	-176.3	-59.3	173.7	-177.4	175.2	0	111.1
1336	N	29	Very low	29.1	Very low	164 Å²	164	141.2 Å²	141.2	88%	0.877	74%	0.736	S	S	*	*			trans	-130.5	138.6	142.5	-100.8	-25.4	0	0	0	108	I1338	N1336-I1338 PolarHBondContact O-N 2.93Å
1337	E	25.5	Very low	29.8	Very low	193 Å²	193	139.8 Å²	139.8	90%	0.902	73%	0.733	S	S	*	*			trans	-97.2	82	-158.2	-167.3	160.2	-130.5	0	0	112.1
1338	I	28.4	Very low	30.5	Very low	122 Å²	122	141.8 Å²	141.8	63%	0.626	74%	0.736	S	S	*	*			trans	-121.6	140.6	167.6	-60.1	-177.8	0	0	0	108.4	N1336	N1336-I1338 PolarHBondContact O-N 2.93Å
1339	Q	28	Very low	31.5	Very low	177 Å²	177	141.4 Å²	141.4	83%	0.827	73%	0.733	S	S	*	*			trans	-71.3	141.6	-160	-65.9	179.1	-2.7	0	0	113.6	L1341	Q1339-L1341 PolarHBondContact O-N 3.44Å
1340	H	28.2	Very low	33.1	Very low	192 Å²	192	143.8 Å²	143.8	89%	0.889	74%	0.738	S	S	*	*			trans	-66.4	114.3	179.2	-119.2	-84.7	0	0	0	111
1341	L	32.9	Very low	34.9	Very low	60 Å²	60	141.2 Å²	141.2	31%	0.314	72%	0.718	S	S	.	*			trans	-114.9	110	169.5	-79	160.5	0	0	0	109.5	L411 E415 Q1339 N1343	L411-L1341 HydrophobicContact CD1-CD1 3.81Å; L411-L1341 HydrophobicContact CD1-CD2 4.15Å; L411-L1341 HydrophobicContact CD1-CG 4.4Å; L411-L1341 HydrophobicContact CD2-CD1 3.84Å; L411-L1341 HydrophobicContact CD2-CD2 3.94Å; L411-L1341 HydrophobicContact CG-CD1 4.47Å; E415-L1341 HydrophobicContact CG-CD1 4.44Å; Q1339-L1341 PolarHBondContact O-N 3.44Å; L1341-N1343 PolarHBondContact O-N 2.8Å; L1341-N1343 VanDerWaalsContact O-N 3.13Å; L1341-N1343 PolarHBondContact O-ND2 3.03Å
1342	E	29.1	Very low	36.4	Very low	170 Å²	170	137.9 Å²	137.9	79%	0.794	68%	0.683	S	S	*	*			trans	-53.2	115.5	-176.6	-65	176.4	131	0	0	111.9
1343	N	34.4	Very low	38.9	Very low	56 Å²	56	132.4 Å²	132.4	30%	0.299	66%	0.66	S	S	.	*			trans	-140.4	111.1	165.7	-69.9	-85.7	0	0	0	107.1	L1341 I1345	L1341-N1343 PolarHBondContact O-N 2.8Å; L1341-N1343 VanDerWaalsContact O-N 3.13Å; L1341-N1343 PolarHBondContact O-ND2 3.03Å; N1343-I1345 PolarHBondContact O-N 3.21Å
1344	D	30.8	Very low	41.4	Very low	167 Å²	167	131.1 Å²	131.1	89%	0.893	65%	0.646	S	S	*	*			trans	-61.2	122	173.7	-63.3	-62.2	0	0	0	109.9
1345	I	41.6	Very low	43.9	Very low	145 Å²	145	125 Å²	125	74%	0.744	62%	0.615	S	S	*	*			trans	-99.7	110.2	173.7	-61.4	178.1	0	0	0	107.9	N1343 E1347	N1343-I1345 PolarHBondContact O-N 3.21Å; I1345-E1347 HydrophobicContact CG2-CB 4.39Å; I1345-E1347 PolarHBondContact O-N 3.38Å
1346	D	36.3	Very low	45.6	Very low	148 Å²	148	122.8 Å²	122.8	79%	0.791	62%	0.615	S	S	*	*			trans	-72	70.7	171.6	-92	-52.3	0	0	0	111	K1348	D1346-K1348 PolarHBondContact O-N 2.65Å
1347	E	40.1	Very low	46.7	Very low	154 Å²	154	116.6 Å²	116.6	72%	0.72	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	5	-171	-152.8	-170.5	-162.3	0	0	115.3	I1345	I1345-E1347 HydrophobicContact CG2-CB 4.39Å; I1345-E1347 PolarHBondContact O-N 3.38Å
1348	K	40	Very low	47.4	Very low	196 Å²	196	116 Å²	116	85%	0.852	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-4.4	-171.1	-80.9	174.9	-176.1	129.8	0	115.7	D1346	D1346-K1348 PolarHBondContact O-N 2.65Å
1349	T	47.5	Very low	47.9	Very low	90 Å²	90	117.5 Å²	117.5	55%	0.552	59%	0.586	S	S	*	*			trans	-149.6	116.2	-179.4	9.7	0	0	0	0	111.2	T1351	T1349-T1351 PolarHBondContact O-N 3.28Å
1350	M	58.9	Low	48.2	Very low	145 Å²	145	115 Å²	115	71%	0.714	58%	0.583	S	S	*	*	S	Bend	trans	-77.5	35.6	173.2	-60.8	-166.8	79.6	0	0	113.1	F391 A392	F391-M1350 VanDerWaalsContact CD1-C 3.48Å; A392-M1350 PolarHBondContact N-O 2.99Å
1351	T	61.4	Low	48.4	Very low	60 Å²	60	113.3 Å²	113.3	37%	0.368	58%	0.579	S	S	.	*	S	Bend	trans	-120.6	130.1	176.2	53.4	0	0	0	0	107.6	T1349	T1349-T1351 PolarHBondContact O-N 3.28Å
1352	G	61.5	Low	48.2	Very low	7 Å²	7	116 Å²	116	7%	0.072	59%	0.594	C	S	.	*			trans	-66	174.1	177.2	0	0	0	0	0	113	W401 G402 R1354	W401-G1352 VanDerWaalsContact CE3-O 3.22Å; W401-G1352 WeakPolarHBondContact CZ3-O 3.41Å; G402-G1352 CarbonylContact O-C 3.58Å; G402-G1352 WeakPolarHBondContact O-CA 3.34Å; G1352-R1354 PolarHBondContact O-N 3.07Å
1353	D	79.3	Confident	48.2	Very low	67 Å²	67	115.5 Å²	115.5	36%	0.358	60%	0.597	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-61.5	130.4	165.1	-69.8	-29.5	0	0	0	109.6	F356 W401 G402 N404	F356-D1353 HydrophobicContact CE1-CB 4.19Å; W401-D1353 CarbonylContact C-O 3.52Å; W401-D1353 WeakPolarHBondContact CA-O 3.13Å; G402-D1353 PolarHBondContact N-O 2.95Å; G402-D1353 PolarHBondContact O-N 3.13Å; N404-D1353 WeakPolarHBondContact CB-OD2 3.4Å; N404-D1353 PolarHBondContact N-OD2 2.82Å; N404-D1353 WeakPolarHBondContact ND2-CB 3.3Å; N404-D1353 VanDerWaalsContact ND2-CG 3.31Å; N404-D1353 PolarHBondContact ND2-OD2 2.9Å
1354	R	81.9	Confident	47.9	Very low	118 Å²	118	121.9 Å²	121.9	45%	0.445	62%	0.617	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.1	136.6	163.3	-169	-177.6	-179.4	106	-0.8	108.8	E399 W401 G1352 V1356	E399-R1354 IonicContact OE1-CZ 3.84Å; E399-R1354 IonicContact OE1-NH1 2.7Å; E399-R1354 PolarHBondContact OE1-NH1 3.05Å; E399-R1354 IonicContact OE1-NH2 3.75Å; E399-R1354 PolarHBondContact OE1-NH2 3.04Å; E399-R1354 IonicContact OE2-NH1 2.73Å; W401-R1354 HydrophobicContact CD2-CB 4.32Å; W401-R1354 HydrophobicContact CE3-CB 3.87Å; W401-R1354 HydrophobicContact CH2-CB 4.04Å; W401-R1354 HydrophobicContact CH2-CG 4.39Å; W401-R1354 HydrophobicContact CZ2-CB 4.45Å; W401-R1354 HydrophobicContact CZ2-CG 4.35Å; W401-R1354 HydrophobicContact CZ3-CB 3.72Å; W401-R1354 HydrophobicContact CZ3-CG 4.47Å; G1352-R1354 PolarHBondContact O-N 3.07Å; R1354-V1356 VanDerWaalsContact O-CG2 3.32Å; R1354-V1356 WeakPolarHBondContact O-CG2 3.49Å; R1354-V1356 PolarHBondContact O-N 2.96Å
1355	D	81	Confident	47.7	Very low	19 Å²	19	121.2 Å²	121.2	10%	0.102	60%	0.602	C	S	.	*	P	Polyproline II helix	trans	-71.1	120.7	170.3	-169.5	-8.5	0	0	0	109.7	K339 Y341 N345 F356 C400 S1357	K339-D1355 IonicContact NZ-OD2 2.73Å; K339-D1355 PolarHBondContact NZ-OD2 3.34Å; Y341-D1355 PolarHBondContact OH-OD2 2.92Å; N345-D1355 PolarHBondContact ND2-OD1 2.89Å; F356-D1355 HydrophobicContact CD1-CB 4.07Å; F356-D1355 HydrophobicContact CE1-CB 4.09Å; C400-D1355 HydrophobicContact CB-CB 3.66Å; C400-D1355 PolarHBondContact O-N 3.39Å; D1355-S1357 VanDerWaalsContact OD1-CB 3.29Å; D1355-S1357 WeakPolarHBondContact OD1-CB 3.21Å; D1355-S1357 PolarHBondContact OD1-N 3.35Å; D1355-S1357 PolarHBondContact OD1-OG 2.8Å
1356	V	62.1	Low	47	Very low	128 Å²	128	123 Å²	123	78%	0.776	61%	0.605	S	S	*	*			trans	-112.8	22.1	-178.1	-153	0	0	0	0	111.7	R1354	R1354-V1356 VanDerWaalsContact O-CG2 3.32Å; R1354-V1356 WeakPolarHBondContact O-CG2 3.49Å; R1354-V1356 PolarHBondContact O-N 2.96Å
1357	S	52.4	Low	46.5	Very low	34 Å²	34	128.2 Å²	128.2	24%	0.238	61%	0.613	C	S	.	*			trans	-62.4	141.4	-178.6	-57.4	0	0	0	0	112.8	Y341 N345 D1355 H1359	Y341-S1357 PolarHBondContact OH-OG 3.43Å; N345-S1357 PolarHBondContact ND2-OG 2.92Å; N345-S1357 VanDerWaalsContact ND2-OG 3.07Å; N345-S1357 PolarHBondContact OD1-OG 3.48Å; D1355-S1357 VanDerWaalsContact OD1-CB 3.29Å; D1355-S1357 WeakPolarHBondContact OD1-CB 3.21Å; D1355-S1357 PolarHBondContact OD1-N 3.35Å; D1355-S1357 PolarHBondContact OD1-OG 2.8Å; S1357-H1359 PolarHBondContact O-N 2.73Å
1358	E	39.7	Very low	46	Very low	182 Å²	182	129.6 Å²	129.6	85%	0.85	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-60.4	-10.4	-165.5	-65.4	-171.3	114.8	0	0	116.8	V1360	E1358-V1360 VanDerWaalsContact C-N 3.28Å; E1358-V1360 PolarHBondContact O-N 3.33Å
1359	H	38.2	Very low	45.5	Very low	152 Å²	152	127.5 Å²	127.5	70%	0.704	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-70.9	-11.5	-174	-95.7	-95.8	0	0	0	116	S1357 L1361 N1362	S1357-H1359 PolarHBondContact O-N 2.73Å; H1359-L1361 PolarHBondContact O-N 2.79Å; H1359-L1361 VanDerWaalsContact O-N 3.12Å; H1359-N1362 PolarHBondContact O-N 2.8Å
1360	V	35.7	Very low	44.7	Very low	125 Å²	125	127.8 Å²	127.8	76%	0.758	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-62.3	-20.8	-179.3	-178.3	0	0	0	0	112.8	E1358 N1362	E1358-V1360 VanDerWaalsContact C-N 3.28Å; E1358-V1360 PolarHBondContact O-N 3.33Å; V1360-N1362 PolarHBondContact O-N 3.45Å
1361	L	32.7	Very low	43.2	Very low	157 Å²	157	128 Å²	128	82%	0.822	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-75.1	-18.5	-178.7	-72.3	174.8	0	0	0	115.4	H1359	H1359-L1361 PolarHBondContact O-N 2.79Å; H1359-L1361 VanDerWaalsContact O-N 3.12Å
1362	N	28.6	Very low	41.7	Very low	115 Å²	115	133.8 Å²	133.8	62%	0.615	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	-27.5	-171.5	-78.8	-16.9	0	0	0	115.1	H1359 V1360 R1364	H1359-N1362 PolarHBondContact O-N 2.8Å; V1360-N1362 PolarHBondContact O-N 3.45Å; N1362-R1364 PolarHBondContact O-N 3.29Å
1363	N	27.5	Very low	40.2	Very low	161 Å²	161	142.3 Å²	142.3	86%	0.861	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	32.5	-174.9	-79.3	8.4	0	0	0	115
1364	R	28.6	Very low	37.8	Very low	190 Å²	190	143.8 Å²	143.8	72%	0.717	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.3	16.2	172.8	-141.3	-175.3	-93.8	-113.5	10.5	115.3	I1165 N1362	I1165-R1364 VanDerWaalsContact CD1-CD 3.42Å; N1362-R1364 PolarHBondContact O-N 3.29Å
1365	R	26	Very low	35.2	Very low	152 Å²	152	144.4 Å²	144.4	57%	0.574	72%	0.724	S	S	*	*			trans	-152.1	115.9	159	-71.2	-169.8	178	-161.9	-2.3	110
1366	F	26.7	Very low	32.8	Very low	184 Å²	184	151.6 Å²	151.6	81%	0.807	76%	0.762	S	S	*	*				-179.6	104.1	128.3	-106.4	-70.4	0	0	0	110.3
1367	W	27.1	Very low	31.2	Very low	256 Å²	256	151.8 Å²	151.8	97%	0.97	76%	0.759	S	S	*	*			trans	-140.9	155.1	150.5	-84.6	93.2	0	0	0	105.9
1368	E	29.4	Very low	30.2	Very low	184 Å²	184	155.4 Å²	155.4	86%	0.86	78%	0.784	S	S	*	*			trans	70.7	138	-169.4	-55.3	-166.9	151.9	0	0	116.1
1369	D	29.3	Very low	29.5	Very low	151 Å²	151	153.3 Å²	153.3	81%	0.807	78%	0.779	S	S	*	*			trans	-134	174.9	-157.6	-121.6	-44.1	0	0	0	111.8
1370	S	31.1	Very low	29.1	Very low	96 Å²	96	154.2 Å²	154.2	67%	0.671	79%	0.789	S	S	*	*			trans	72.5	84.1	158.2	-65.9	0	0	0	0	120.7
1371	N	27.3	Very low	28.7	Very low	150 Å²	150	154.3 Å²	154.3	80%	0.802	79%	0.785	S	S	*	*				48.6	120.6	116.1	-69.8	-64.8	0	0	0	121.4
1372	L	29.9	Very low	28.6	Very low	181 Å²	181	150.8 Å²	150.8	95%	0.948	77%	0.774	S	S	*	*				-147.8	163.6	126	-116.6	170.2	0	0	0	111.1
1373	K	29.4	Very low	28.6	Very low	186 Å²	186	150.8 Å²	150.8	81%	0.809	77%	0.774	S	S	*	*			trans	-143.3	115.6	-149.1	176.2	-179.2	179.4	177	0	112.4
1374	A	29.1	Very low	28.8	Very low	99 Å²	99	151.3 Å²	151.3	82%	0.818	77%	0.769	S	S	*	*			trans	-154.3	123.4	164.8	0	0	0	0	0	112.9
1375	N	27.3	Very low	28.7	Very low	131 Å²	131	146.5 Å²	146.5	70%	0.701	76%	0.764	S	S	*	*			trans	-21.4	139.8	169.1	-45.2	-9.5	0	0	0	118.2
1376	N	30.8	Very low	28.8	Very low	169 Å²	169	145.2 Å²	145.2	90%	0.904	77%	0.769	S	S	*	*				-147.9	135.3	110.5	-113.4	-21.9	0	0	0	111
1377	D	28.6	Very low	29	Very low	133 Å²	133	144 Å²	144	71%	0.711	77%	0.77	S	S	*	*			trans	-89.8	-178.8	-176.6	-67	-79.9	0	0	0	112.6
1378	S	30.3	Very low	29.1	Very low	109 Å²	109	137.1 Å²	137.1	76%	0.762	75%	0.753	S	S	*	*			trans	75.8	102.1	176.5	-39.8	0	0	0	0	113.8
1379	N	26.6	Very low	29.3	Very low	138 Å²	138	135.6 Å²	135.6	74%	0.738	75%	0.75	S	S	*	*			cis	56.3	101.7	19.8	-162.6	14	0	0	0	114.3
1380	N	29.4	Very low	29.3	Very low	172 Å²	172	132.1 Å²	132.1	92%	0.92	75%	0.75	S	S	*	*			trans	-152.8	100.2	139.6	-113.8	-29.5	0	0	0	110.5
1381	N	27	Very low	29.3	Very low	127 Å²	127	135.2 Å²	135.2	68%	0.679	75%	0.754	S	S	*	*			trans	-94.5	165.4	173.7	-168.9	3.2	0	0	0	109.8
1382	S	30.7	Very low	29.5	Very low	83 Å²	83	135.4 Å²	135.4	58%	0.58	75%	0.748	S	S	*	*			trans	73.3	163.1	144.9	73.6	0	0	0	0	121.6
1383	N	29.3	Very low	29.3	Very low	115 Å²	115	133.2 Å²	133.2	62%	0.615	74%	0.736	S	S	*	*			trans	106.8	138.5	154.4	-55.7	-67.6	0	0	0	117.2
1384	K	30.4	Very low	29.3	Very low	172 Å²	172	132.3 Å²	132.3	75%	0.748	73%	0.732	S	S	*	*			cis	-156.1	145.6	-13.6	-101.6	161.5	173.5	142.3	0	105.9
1385	S	28.1	Very low	29.2	Very low	88 Å²	88	134 Å²	134	62%	0.615	73%	0.727	S	S	*	*			cis	93.3	155.1	35.6	99.5	0	0	0	0	115.6
1386	N	27.2	Very low	29.1	Very low	126 Å²	126	133 Å²	133	67%	0.674	73%	0.731	S	S	*	*			trans	74.8	132.1	173.6	-56.2	22.2	0	0	0	114.3
1387	N	30.9	Very low	28.9	Very low	157 Å²	157	131.1 Å²	131.1	84%	0.84	73%	0.731	S	S	*	*			cis	-126.4	-178.3	43.7	-68.3	-29.5	0	0	0	113.3
1388	N	28.6	Very low	28.7	Very low	113 Å²	113	130.6 Å²	130.6	60%	0.604	74%	0.737	S	S	*	*			cis	166.3	166.2	-37.7	-138.1	63.1	0	0	0	106.3
1389	D	33.3	Very low	28.5	Very low	152 Å²	152	133 Å²	133	81%	0.813	74%	0.74	S	S	*	*			trans	72.7	137.6	169.7	-40.8	-28.1	0	0	0	116.3
1390	G	30.5	Very low	28.4	Very low	77 Å²	77	133.5 Å²	133.5	79%	0.794	74%	0.742	S	S	*	*			cis	-166.5	-169	1.9	0	0	0	0	0	116.4
1391	E	30.2	Very low	28.3	Very low	161 Å²	161	130.9 Å²	130.9	75%	0.752	73%	0.727	S	S	*	*			trans	-63.7	176.9	-172.7	-60.1	-166.6	136.9	0	0	117.1
1392	K	31.8	Very low	28.5	Very low	155 Å²	155	133 Å²	133	67%	0.674	74%	0.738	S	S	*	*			cis	-172.5	148.3	-20.8	-102.5	170.2	180	160.3	0	110.1
1393	L	26.9	Very low	28.4	Very low	134 Å²	134	134.8 Å²	134.8	70%	0.702	74%	0.741	S	S	*	*			trans	52	145.5	138.3	-63.6	168.7	0	0	0	125.8
1394	F	28	Very low	28.7	Very low	167 Å²	167	137 Å²	137	73%	0.732	75%	0.748	S	S	*	*			trans	84.2	98.4	146.2	-74.8	-54.8	0	0	0	124.3
1395	N	26.8	Very low	28.7	Very low	134 Å²	134	134.3 Å²	134.3	72%	0.717	74%	0.742	S	S	*	*				46.5	117	123.8	-64.5	15.3	0	0	0	123.8
1396	S	26	Very low	28.7	Very low	112 Å²	112	137 Å²	137	78%	0.783	75%	0.749	S	S	*	*				54.5	110.7	122.6	-50.5	0	0	0	0	122
1397	S	26.7	Very low	28.7	Very low	128 Å²	128	134.1 Å²	134.1	90%	0.895	75%	0.749	S	S	*	*			trans	-157.3	159	132.5	-82.4	0	0	0	0	110.2
1398	C	24.8	Very low	28.5	Very low	123 Å²	123	133.6 Å²	133.6	83%	0.831	75%	0.745	S	S	*	*			trans	-105.7	168.5	-166.5	-59.3	0	0	0	0	114.2
1399	L	24.5	Very low	28.5	Very low	160 Å²	160	137 Å²	137	84%	0.838	75%	0.754	S	S	*	*			trans	86.2	129.2	156.9	-65.5	174.6	0	0	0	120.6
1400	L	25	Very low	28.1	Very low	148 Å²	148	135.5 Å²	135.5	78%	0.775	75%	0.751	S	S	*	*			trans	87.4	138.1	143.2	-74.4	166.1	0	0	0	122
1401	L	28.4	Very low	27.8	Very low	117 Å²	117	138.8 Å²	138.8	61%	0.613	75%	0.75	S	S	*	*			trans	71.9	100	151	-67.2	160.8	0	0	0	119.7	N1403	L1401-N1403 WeakPolarHBondContact CD2-ND2 3.32Å; L1401-N1403 WeakPolarHBondContact CD2-OD1 3.47Å
1402	N	29.9	Very low	27.6	Very low	170 Å²	170	139.2 Å²	139.2	91%	0.909	75%	0.752	S	S	*	*				-126.7	151.4	97.9	-108.2	-35	0	0	0	109.7
1403	N	29.9	Very low	27.6	Very low	121 Å²	121	137.5 Å²	137.5	65%	0.647	76%	0.757	S	S	*	*			trans	-92.3	168.7	-168.5	-83.1	-30.6	0	0	0	114.3	L1401	L1401-N1403 WeakPolarHBondContact CD2-ND2 3.32Å; L1401-N1403 WeakPolarHBondContact CD2-OD1 3.47Å
1404	H	33.9	Very low	27.6	Very low	161 Å²	161	139.2 Å²	139.2	75%	0.745	76%	0.758	S	S	*	*			trans	75.7	115.7	174.5	-60.6	-61	0	0	0	116.3
1405	D	30.3	Very low	27.6	Very low	116 Å²	116	139 Å²	139	62%	0.62	76%	0.759	S	S	*	*			cis	-150.7	127.7	-3.5	-98.5	-40.7	0	0	0	114.9
1406	N	29.3	Very low	27.7	Very low	146 Å²	146	138.2 Å²	138.2	78%	0.781	76%	0.759	S	S	*	*			trans	63.4	131.2	140	-53.5	-38.2	0	0	0	124.2
1407	G	27.2	Very low	27.8	Very low	65 Å²	65	137.4 Å²	137.4	67%	0.67	75%	0.752	S	S	*	*			trans	78.1	118.3	161.5	0	0	0	0	0	115.7
1408	I	26.7	Very low	27.8	Very low	146 Å²	146	137.9 Å²	137.9	75%	0.749	75%	0.745	S	S	*	*			cis	69.1	136.1	11.2	-24	178.4	0	0	0	116.6
1409	F	27.9	Very low	28.1	Very low	183 Å²	183	137.7 Å²	137.7	80%	0.803	75%	0.745	S	S	*	*			trans	73	119.4	178.5	-62.3	-76.8	0	0	0	114.6
1410	V	26.4	Very low	28.9	Very low	121 Å²	121	135.2 Å²	135.2	73%	0.733	74%	0.739	S	S	*	*			cis	100.7	123.6	48.7	161	0	0	0	0	111
1411	N	22.9	Very low	29.3	Very low	146 Å²	146	136.4 Å²	136.4	78%	0.781	74%	0.74	S	S	*	*			trans	18.8	129	164.6	-74.5	-19.9	0	0	0	121.5
1412	Q	25.5	Very low	29.5	Very low	171 Å²	171	136.9 Å²	136.9	80%	0.799	75%	0.748	S	S	*	*			trans	74.1	159	157.4	-68.3	-162.1	48.1	0	0	116.6
1413	P	31.7	Very low	29.6	Very low	118 Å²	118	132.7 Å²	132.7	77%	0.766	74%	0.737	S	S	*	*			cis	-120.9	-177.3	8.4	39.6	-24.8	0	0	0	116.5
1414	K	27.3	Very low	29.8	Very low	170 Å²	170	132.5 Å²	132.5	74%	0.739	74%	0.74	S	S	*	*			trans	-59.6	143.1	178	-52.3	161.4	-175.2	173.2	0	112.2
1415	H	29.3	Very low	29.9	Very low	163 Å²	163	130.4 Å²	130.4	76%	0.755	74%	0.738	S	S	*	*				174.8	145.1	106.3	-102.7	-89	0	0	0	112.9
1416	V	27.1	Very low	30	Very low	118 Å²	118	134.2 Å²	134.2	72%	0.715	75%	0.749	S	S	*	*			trans	39.9	129.5	136.1	172.8	0	0	0	0	119.5
1417	C	29.1	Very low	30.3	Very low	94 Å²	94	130.9 Å²	130.9	64%	0.635	74%	0.738	S	S	*	*			cis	-165	147.5	-7.5	-110.9	0	0	0	0	112.8
1418	N	26.9	Very low	30.6	Very low	139 Å²	139	137 Å²	137	74%	0.743	75%	0.746	S	S	*	*			trans	37.3	107.4	135	-53.2	-6.8	0	0	0	122
1419	S	30.3	Very low	30.8	Very low	119 Å²	119	135.4 Å²	135.4	83%	0.832	75%	0.748	S	S	*	*				62	164.4	126.7	-74.9	0	0	0	0	122.6
1420	P	42.4	Very low	30.9	Very low	108 Å²	108	131.1 Å²	131.1	70%	0.701	75%	0.746	S	S	*	*			cis	-131.4	-169.5	-24.7	33.5	-13.1	0	0	0	113.8
1421	H	32.4	Very low	30.8	Very low	172 Å²	172	134.7 Å²	134.7	80%	0.796	76%	0.757	S	S	*	*			trans	8.3	144.8	153.2	-68.3	-42.1	0	0	0	121.2
1422	T	33.1	Very low	31.1	Very low	127 Å²	127	139 Å²	139	78%	0.779	76%	0.763	S	S	*	*			cis	-166.2	-177.3	21.4	-6.1	0	0	0	0	112.9
1423	A	32.6	Very low	31.2	Very low	82 Å²	82	139.4 Å²	139.4	68%	0.678	77%	0.767	S	S	*	*			trans	83.9	147.6	145.1	0	0	0	0	0	120.8
1424	T	32.6	Very low	30.9	Very low	118 Å²	118	142 Å²	142	72%	0.724	77%	0.771	S	S	*	*			cis	-164.5	131.7	-19.8	25.9	0	0	0	0	113.8
1425	V	36.1	Very low	30.9	Very low	116 Å²	116	138.5 Å²	138.5	70%	0.703	77%	0.767	S	S	*	*				52.5	138.5	118.1	-179.5	0	0	0	0	121.9
1426	K	33.8	Very low	30.7	Very low	196 Å²	196	136.3 Å²	136.3	85%	0.852	77%	0.765	S	S	*	*				-176.7	150.4	122.4	-94.2	144.9	-166.5	167.2	0	114.2
1427	S	34.9	Very low	30.8	Very low	77 Å²	77	138 Å²	138	54%	0.538	77%	0.769	S	S	.	*			cis	180	165.7	-28.5	58.5	0	0	0	0	112.6
1428	K	34.3	Very low	30.7	Very low	192 Å²	192	141.6 Å²	141.6	84%	0.835	77%	0.774	S	S	*	*			trans	111	150.6	139.9	-82.3	165.9	-174.5	-179.7	0	117.6
1429	S	29.6	Very low	30.8	Very low	113 Å²	113	142.9 Å²	142.9	79%	0.79	78%	0.775	S	S	*	*			cis	-141.6	-179.2	9.7	-148.7	0	0	0	0	113.8
1430	A	30.2	Very low	30.6	Very low	93 Å²	93	143.9 Å²	143.9	77%	0.769	77%	0.772	S	S	*	*			trans	-119.6	176.2	-171.5	0	0	0	0	0	113.8
1431	M	24.7	Very low	30	Very low	196 Å²	196	144.2 Å²	144.2	97%	0.966	77%	0.768	S	S	*	*			trans	-149.4	124.2	146.3	-144.5	176	-149.5	0	0	112.3
1432	R	28.8	Very low	29.8	Very low	238 Å²	238	142.9 Å²	142.9	90%	0.898	76%	0.759	S	S	*	*			trans	-159.2	131.1	165	-153.7	-176	-163.2	-168	6.5	109.8
1433	M	27.2	Very low	29.5	Very low	179 Å²	179	141 Å²	141	88%	0.882	75%	0.748	S	S	*	*			trans	-153.5	148.7	162.5	-68.6	-171.4	-179.2	0	0	104.9
1434	M	26.3	Very low	29.3	Very low	173 Å²	173	141.5 Å²	141.5	85%	0.852	75%	0.746	S	S	*	*			cis	-114.4	169.6	-1	-69.8	168	169.9	0	0	108.9
1435	S	26.8	Very low	29.1	Very low	95 Å²	95	141.5 Å²	141.5	66%	0.664	74%	0.737	S	S	*	*			cis	-148.2	165.1	4.7	-132.5	0	0	0	0	111.4
1436	T	26.1	Very low	29.1	Very low	117 Å²	117	141.1 Å²	141.1	72%	0.718	74%	0.737	S	S	*	*			trans	14.7	144	148.3	61	0	0	0	0	120.4
1437	I	28.6	Very low	28.8	Very low	153 Å²	153	139.8 Å²	139.8	79%	0.785	74%	0.738	S	S	*	*			cis	-143	137.7	23.4	-44.3	164.8	0	0	0	105.3
1438	F	27.2	Very low	28.5	Very low	171 Å²	171	142.6 Å²	142.6	75%	0.75	75%	0.752	S	S	*	*				48.4	148.1	74.4	-76.9	-68.7	0	0	0	113.9
1439	Q	29.4	Very low	28.3	Very low	165 Å²	165	138.1 Å²	138.1	77%	0.771	75%	0.745	S	S	*	*			cis	-151.6	-178.8	3.1	-153.2	131.9	-2.4	0	0	111.5
1440	N	25.4	Very low	28.3	Very low	141 Å²	141	139.3 Å²	139.3	75%	0.754	74%	0.742	S	S	*	*			trans	-82.2	176	174.6	-66.4	-13.2	0	0	0	113.5
1441	N	30.6	Very low	28	Very low	115 Å²	115	142.9 Å²	142.9	62%	0.615	74%	0.743	S	S	*	*			trans	98.1	89.4	152.3	-63	-19.1	0	0	0	119.9	H1641	N1441-H1641 PolarHBondContact ND2-NE2 3.1Å; N1441-H1641 PolarHBondContact OD1-NE2 3.03Å
1442	K	28.2	Very low	28.2	Very low	143 Å²	143	140.9 Å²	140.9	62%	0.622	74%	0.737	S	S	*	*				2.4	134.6	129.9	-61.7	-178.9	-83.4	167	0	118.2	H1641	K1442-H1641 HydrophobicContact CB-CB 3.62Å; K1442-H1641 HydrophobicContact CD-CB 4.04Å; K1442-H1641 VanDerWaalsContact CE-ND1 3.25Å; K1442-H1641 WeakPolarHBondContact CE-ND1 3.43Å; K1442-H1641 HydrophobicContact CG-CB 4.48Å; K1442-H1641 PolarHBondContact NZ-ND1 2.67Å; K1442-H1641 PolarHBondContact O-CD2 2.58Å
1443	T	26	Very low	28	Very low	88 Å²	88	133.7 Å²	133.7	54%	0.54	72%	0.723	S	S	.	*			trans	-161.9	155.5	130.8	-30.4	0	0	0	0	113.2	H1641	T1443-H1641 WeakPolarHBondContact CG2-O 3.31Å; T1443-H1641 PolarHBondContact OG1-O 3.3Å
1444	C	29.4	Very low	27.9	Very low	93 Å²	93	131.3 Å²	131.3	63%	0.628	72%	0.718	S	S	*	*			trans	74.2	129.2	159.9	-70.1	0	0	0	0	122.3
1445	H	26.8	Very low	28.4	Very low	118 Å²	118	128 Å²	128	55%	0.546	71%	0.71	S	S	.	*			trans	-83.9	-163.9	147.9	-34.8	176.9	0	0	0	109.8	N1639	H1445-N1639 PolarHBondContact CD2-OD1 2.73Å; H1445-N1639 VanDerWaalsContact CG-CG 3.49Å; H1445-N1639 VanDerWaalsContact CG-OD1 3.25Å; H1445-N1639 PolarHBondContact N-OD1 3.05Å
1446	P	36.2	Very low	28.4	Very low	108 Å²	108	127.4 Å²	127.4	70%	0.701	71%	0.706	S	S	*	*			cis	-122.7	-168	-41.2	28.2	-7.9	0	0	0	110.5
1447	L	27.5	Very low	28.6	Very low	168 Å²	168	129.8 Å²	129.8	88%	0.88	71%	0.706	S	S	*	*			trans	-81.4	133.2	154.6	-71.6	170.4	0	0	0	110.8
1448	T	29.8	Very low	28.4	Very low	136 Å²	136	127 Å²	127	83%	0.834	70%	0.701	S	S	*	*				-138.5	139.8	128.1	51.2	0	0	0	0	106.6
1449	S	30.5	Very low	28.6	Very low	98 Å²	98	125.6 Å²	125.6	69%	0.685	70%	0.699	S	S	*	*			trans	-68.3	166.7	168.8	49.2	0	0	0	0	109.6
1450	D	27.7	Very low	28.8	Very low	137 Å²	137	125.2 Å²	125.2	73%	0.733	70%	0.702	S	S	*	*				-159.6	154.3	68.2	-70	-33.3	0	0	0	113.1
1451	E	25	Very low	28.9	Very low	168 Å²	168	122.5 Å²	122.5	79%	0.785	69%	0.694	S	S	*	*			trans	21.2	120.1	148.1	-52.8	-170.7	152.1	0	0	120.3
1452	N	27.7	Very low	28.8	Very low	155 Å²	155	123.9 Å²	123.9	83%	0.829	70%	0.701	S	S	*	*				-157.6	157.4	89.3	-114.2	-92.6	0	0	0	113.4
1453	S	24.9	Very low	28.8	Very low	86 Å²	86	125.3 Å²	125.3	60%	0.601	71%	0.71	S	S	*	*			trans	-103.7	145.7	-156.5	56.8	0	0	0	0	114.1
1454	T	25	Very low	29.1	Very low	129 Å²	129	127.4 Å²	127.4	79%	0.791	72%	0.717	S	S	*	*			trans	66.7	-173.9	143.7	70	0	0	0	0	117
1455	P	38.6	Very low	29	Very low	105 Å²	105	129.8 Å²	129.8	68%	0.682	72%	0.723	S	S	*	*				-139.5	-143.7	-92.1	45.4	-25.8	0	0	0	113.1
1456	S	25.1	Very low	29.3	Very low	82 Å²	82	128.8 Å²	128.8	57%	0.573	73%	0.729	S	S	*	*			trans	84.7	159	166.1	-31.4	0	0	0	0	116.2
1457	K	30	Very low	29.2	Very low	166 Å²	166	133.9 Å²	133.9	72%	0.722	73%	0.734	S	S	*	*			cis	-123.1	143.6	-4.8	-92.2	93.9	-163.9	162.9	0	107.8	I1459	K1457-I1459 HydrophobicContact CG-CD1 4.37Å
1458	S	25.7	Very low	29.3	Very low	96 Å²	96	131.2 Å²	131.2	67%	0.671	72%	0.721	S	S	*	*			cis	78.1	162.2	35.8	88.4	0	0	0	0	115.7
1459	I	31.4	Very low	29.5	Very low	141 Å²	141	133.1 Å²	133.1	72%	0.723	72%	0.723	S	S	*	*			trans	84.6	101.8	174.3	-55.1	153	0	0	0	116.1	K1457	K1457-I1459 HydrophobicContact CG-CD1 4.37Å
1460	L	32.8	Very low	29.5	Very low	157 Å²	157	131.3 Å²	131.3	82%	0.822	71%	0.71	S	S	*	*				-161.5	-176.2	92.9	-125.6	160.3	0	0	0	110.1
1461	S	27.1	Very low	29.8	Very low	84 Å²	84	129 Å²	129	59%	0.587	70%	0.696	S	S	*	*			trans	-121.9	177.6	-153.3	-45.2	0	0	0	0	114.4
1462	D	29.8	Very low	30.2	Very low	144 Å²	144	125.8 Å²	125.8	77%	0.77	68%	0.68	S	S	*	*			trans	80.6	116.6	148.9	-52.8	-29.2	0	0	0	120.7
1463	E	27.1	Very low	30.3	Very low	173 Å²	173	124.9 Å²	124.9	81%	0.808	67%	0.665	S	S	*	*			trans	79.5	138.8	136.2	-73.4	-164.2	153.3	0	0	123.7
1464	I	32.4	Very low	30.5	Very low	132 Å²	132	124.5 Å²	124.5	68%	0.677	66%	0.662	S	S	*	*			trans	82.2	102.8	153.9	-64.9	151.9	0	0	0	118.9
1465	N	28.7	Very low	30.8	Very low	143 Å²	143	122.8 Å²	122.8	77%	0.765	66%	0.655	S	S	*	*			trans	60	133.7	144.9	-62.8	-7.4	0	0	0	119.4
1466	S	32.8	Very low	30.4	Very low	96 Å²	96	126 Å²	126	67%	0.671	66%	0.661	S	S	*	*			cis	-151.8	143.5	0.6	-87.4	0	0	0	0	107.7
1467	R	33.7	Very low	30.5	Very low	215 Å²	215	126.9 Å²	126.9	81%	0.811	66%	0.663	S	S	*	*				70.7	116.3	53.2	-167	-175.1	-150.7	136.7	11.2	112.7
1468	D	30.3	Very low	30.4	Very low	112 Å²	112	127.2 Å²	127.2	60%	0.599	67%	0.667	S	S	*	*			cis	-169.3	154	-14.9	-113.9	-48.1	0	0	0	109.7	C1470	D1468-C1470 PolarHBondContact OD1-SG 3.17Å
1469	M	33.5	Very low	30.5	Very low	176 Å²	176	130 Å²	130	87%	0.867	67%	0.669	S	S	*	*			trans	-140.7	47.1	148.1	-109.2	-109.3	52.7	0	0	111.8
1470	C	31	Very low	30.3	Very low	61 Å²	61	129.8 Å²	129.8	41%	0.412	67%	0.668	S	S	.	*			trans	-58.9	149.9	154.6	-73.5	0	0	0	0	110.9	D1468	D1468-C1470 PolarHBondContact OD1-SG 3.17Å
1471	I	33.7	Very low	30.1	Very low	89 Å²	89	130.1 Å²	130.1	46%	0.456	67%	0.665	S	S	.	*			cis	-170.5	150.4	3.2	-106.1	161.8	0	0	0	105.6	G817	G817-I1471 WeakPolarHBondContact O-CD1 3.39Å
1472	K	32.4	Very low	30.1	Very low	100 Å²	100	131.5 Å²	131.5	44%	0.435	67%	0.666	S	S	.	*			cis	-139.6	-179.7	-13.2	-97.4	169.9	167.4	176.1	0	104.9	V816 E818	V816-K1472 HydrophobicContact CG2-CG 4.49Å; E818-K1472 WeakPolarHBondContact O-CE 3.46Å; E818-K1472 PolarHBondContact O-NZ 3.07Å
1473	R	29.6	Very low	30.1	Very low	136 Å²	136	130.5 Å²	130.5	51%	0.513	66%	0.66	S	S	.	*			cis	66.8	152.4	32.4	-83.8	-147.8	173.9	-152.7	-12.7	115.5	D814	D814-R1473 IonicContact OD1-CZ 3.24Å; D814-R1473 IonicContact OD1-NE 3.15Å; D814-R1473 PolarHBondContact OD1-NE 2.79Å; D814-R1473 IonicContact OD1-NH1 3.66Å; D814-R1473 IonicContact OD1-NH2 2.86Å; D814-R1473 PolarHBondContact OD1-NH2 3.45Å; D814-R1473 IonicContact OD2-CZ 3.98Å; D814-R1473 IonicContact OD2-NE 2.8Å; D814-R1473 IonicContact OD2-NH1 2.68Å; D814-R1473 IonicContact OD2-NH2 2.75Å; D814-R1473 PolarHBondContact OD2-NH2 3.18Å
1474	S	29.5	Very low	30.2	Very low	77 Å²	77	129.4 Å²	129.4	54%	0.538	66%	0.659	S	S	.	*			cis	-165.9	163.3	-16.5	43.9	0	0	0	0	111.6
1475	S	32.3	Very low	30	Very low	93 Å²	93	131.8 Å²	131.8	65%	0.65	67%	0.668	S	S	*	*			trans	24.1	144	142	64	0	0	0	0	121.6
1476	H	29.1	Very low	30.1	Very low	173 Å²	173	129.9 Å²	129.9	80%	0.801	66%	0.664	S	S	*	*			cis	-165.4	156	5	-130.8	-71.5	0	0	0	110.8
1477	T	28	Very low	30	Very low	100 Å²	100	131.2 Å²	131.2	61%	0.613	66%	0.664	S	S	*	*			trans	59.1	112.6	150.5	-47.4	0	0	0	0	121.9
1478	E	27	Very low	29.9	Very low	173 Å²	173	130.8 Å²	130.8	81%	0.808	66%	0.662	S	S	*	*			trans	68.3	136.4	145.7	-69.6	171.9	-177.1	0	0	123.5
1479	H	29.1	Very low	29.9	Very low	156 Å²	156	132 Å²	132	72%	0.722	67%	0.668	S	S	*	*			trans	38.5	113.5	164	-70.6	-91.3	0	0	0	120.6
1480	I	27.6	Very low	29.7	Very low	136 Å²	136	129.7 Å²	129.7	70%	0.697	66%	0.659	S	S	*	*				68.3	128.9	65.1	-63.8	169.5	0	0	0	111
1481	H	27.9	Very low	29.6	Very low	164 Å²	164	137.7 Å²	137.7	76%	0.759	68%	0.682	S	S	*	*			cis	-131	170.6	23.3	-123.5	-89.3	0	0	0	109.2
1482	D	27.6	Very low	29.3	Very low	113 Å²	113	142 Å²	142	60%	0.604	70%	0.701	S	S	*	*				178.7	165.9	52.7	-148.1	1.3	0	0	0	114.4
1483	N	29.1	Very low	29.6	Very low	122 Å²	122	142.4 Å²	142.4	65%	0.652	71%	0.713	S	S	*	*			trans	63.3	140.2	156.1	-68.5	-46.7	0	0	0	120.9
1484	L	28.9	Very low	29.2	Very low	150 Å²	150	143.2 Å²	143.2	79%	0.785	72%	0.724	S	S	*	*			cis	-164.7	122.1	-9.6	-136.6	168.2	0	0	0	110.7
1485	E	28.2	Very low	29.1	Very low	183 Å²	183	143.8 Å²	143.8	86%	0.855	72%	0.715	S	S	*	*			trans	-152.7	111.6	152	-164.9	157	-143.9	0	0	113.3
1486	C	31	Very low	29	Very low	102 Å²	102	146.1 Å²	146.1	69%	0.689	72%	0.721	S	S	*	*			trans	48.1	136.4	150.3	-61.7	0	0	0	0	124.6
1487	D	30.6	Very low	28.9	Very low	125 Å²	125	141.6 Å²	141.6	67%	0.668	71%	0.708	S	S	*	*			trans	72.9	90.4	152.9	-78.4	-52.1	0	0	0	121.9
1488	R	31.1	Very low	28.8	Very low	205 Å²	205	146.5 Å²	146.5	77%	0.774	72%	0.72	S	S	*	*				94.1	101.4	122.1	-70.4	170.3	-167.6	-128.5	-3.6	121.7
1489	L	30.3	Very low	29.4	Very low	139 Å²	139	143 Å²	143	73%	0.728	71%	0.713	S	S	*	*				69.9	107.7	119.1	-63.6	173.6	0	0	0	119.9
1490	N	30.6	Very low	29.2	Very low	127 Å²	127	142.4 Å²	142.4	68%	0.679	72%	0.715	S	S	*	*				96.4	103.2	124.2	-69.2	5.4	0	0	0	121.2
1491	Y	28.5	Very low	29.3	Very low	229 Å²	229	143.5 Å²	143.5	90%	0.898	72%	0.721	S	S	*	*				90.6	148.4	126.8	-92.5	-94.9	0	0	0	121
1492	E	26.3	Very low	29.3	Very low	180 Å²	180	140.8 Å²	140.8	84%	0.841	72%	0.719	S	S	*	*			trans	-101.4	170.3	-162.9	-94.3	-160.1	126.8	0	0	114.5
1493	P	38.9	Very low	29.4	Very low	107 Å²	107	143.3 Å²	143.3	70%	0.695	73%	0.728	S	S	*	*			trans	-100.5	158	-171.1	38.5	-34.3	0	0	0	114.5
1494	M	22.9	Very low	29.3	Very low	153 Å²	153	141.8 Å²	141.8	75%	0.754	72%	0.722	S	S	*	*				-173.4	153.4	124.4	-103.9	173.5	62.3	0	0	113.4
1495	Y	26	Very low	29.4	Very low	89 Å²	89	139.6 Å²	139.6	35%	0.349	72%	0.719	S	S	.	*			trans	4.4	130.3	169.2	-62.5	-98.5	0	0	0	121.4	Q898 D902	Q898-Y1495 VanDerWaalsContact NE2-CB 3.32Å; Q898-Y1495 VanDerWaalsContact NE2-CG 3.32Å; D902-Y1495 HydrophobicContact CB-CE1 4.29Å
1496	N	29.9	Very low	29.5	Very low	142 Å²	142	137.2 Å²	137.2	76%	0.759	71%	0.712	S	S	*	*				-158.6	-173.5	112.3	-131	-41.7	0	0	0	114.7
1497	C	26.9	Very low	29.4	Very low	78 Å²	78	138.4 Å²	138.4	53%	0.527	71%	0.707	S	S	.	*			trans	-105.9	151.1	-156	-57.5	0	0	0	0	117.4
1498	K	27.2	Very low	29.7	Very low	203 Å²	203	139.4 Å²	139.4	88%	0.883	71%	0.708	S	S	*	*			trans	71.5	170.5	142.8	-100.6	-174.5	178.2	-178.3	0	118.1
1499	P	38.6	Very low	29.8	Very low	99 Å²	99	135.1 Å²	135.1	64%	0.643	70%	0.697	S	S	*	*				-132.6	177.1	-120.4	45.9	-30.1	0	0	0	117.6
1500	N	26.3	Very low	29.9	Very low	145 Å²	145	135.8 Å²	135.8	78%	0.775	69%	0.694	S	S	*	*			trans	50.2	107.8	151.2	-63	2.3	0	0	0	120.3
1501	L	29	Very low	29.9	Very low	158 Å²	158	136.7 Å²	136.7	83%	0.827	69%	0.694	S	S	*	*				-160.5	138.5	110.1	-116.2	67.5	0	0	0	106.5
1502	C	27.5	Very low	30.1	Very low	107 Å²	107	129.5 Å²	129.5	72%	0.723	68%	0.682	S	S	*	*				53.3	133.7	90	-54.4	0	0	0	0	114.3
1503	H	29	Very low	30.5	Very low	167 Å²	167	129.2 Å²	129.2	77%	0.773	68%	0.684	S	S	*	*			cis	-154.3	143.2	5.9	-150	-141.8	0	0	0	113.1
1504	V	28	Very low	30	Very low	90 Å²	90	130.8 Å²	130.8	55%	0.545	69%	0.687	S	S	.	*			trans	41.8	121.6	136.3	171.8	0	0	0	0	122.4	L1506	V1504-L1506 HydrophobicContact CG1-CD1 3.62Å
1505	S	31.4	Very low	30.3	Very low	103 Å²	103	128.1 Å²	128.1	72%	0.72	68%	0.683	S	S	*	*				-161.3	138.9	110.6	-80.5	0	0	0	0	109.1
1506	L	30.3	Very low	30.5	Very low	134 Å²	134	134.8 Å²	134.8	70%	0.702	71%	0.708	S	S	*	*				59.4	134.2	66.4	-82.4	85.3	0	0	0	112	V1504	V1504-L1506 HydrophobicContact CG1-CD1 3.62Å
1507	E	28.5	Very low	30.8	Very low	126 Å²	126	136.2 Å²	136.2	59%	0.589	72%	0.715	S	S	*	*			cis	-160.7	173.5	2.7	-141.9	-172.7	177.5	0	0	111.2
1508	H	36.4	Very low	30.8	Very low	147 Å²	147	141.7 Å²	141.7	68%	0.681	73%	0.729	S	S	*	*			trans	143.8	101.4	143.6	-78.6	78.7	0	0	0	111.1
1509	Q	33.2	Very low	31.4	Very low	115 Å²	115	136.6 Å²	136.6	54%	0.537	72%	0.717	S	S	.	*				86	115.3	73.5	-79	-173.6	35.4	0	0	111.8
1510	K	32.7	Very low	31	Very low	153 Å²	153	139 Å²	139	67%	0.665	73%	0.725	S	S	*	*				81.2	151.2	95.9	-72.7	-178.3	166.7	-132.4	0	113.2
1511	E	31.5	Very low	30.9	Very low	145 Å²	145	138.8 Å²	138.8	68%	0.678	72%	0.723	S	S	*	*			cis	-153.4	164.6	-3.3	-128.9	156.5	-163	0	0	112.3
1512	A	31.5	Very low	31	Very low	79 Å²	79	138.2 Å²	138.2	65%	0.653	72%	0.72	S	S	*	*			trans	29.6	147.3	145.9	0	0	0	0	0	123.2
1513	I	35.7	Very low	31.2	Very low	173 Å²	173	137.8 Å²	137.8	89%	0.887	72%	0.715	S	S	*	*				-157.9	151.7	108.3	-103.1	159.7	0	0	0	111.2
1514	N	28.4	Very low	31.2	Very low	141 Å²	141	137.2 Å²	137.2	75%	0.754	71%	0.714	S	S	*	*			trans	-92.6	161.6	-173.2	-69.5	-73.8	0	0	0	113.9
1515	S	29.4	Very low	31.1	Very low	97 Å²	97	138.1 Å²	138.1	68%	0.678	72%	0.724	S	S	*	*				125.8	148.2	115	79	0	0	0	0	117.7
1516	R	30.2	Very low	30.9	Very low	229 Å²	229	138.9 Å²	138.9	86%	0.864	73%	0.73	S	S	*	*			trans	56.2	118.6	155.9	-64	168	175.6	-158.9	-1.2	116.2
1517	L	34.5	Very low	30.8	Very low	172 Å²	172	135.6 Å²	135.6	90%	0.901	73%	0.729	S	S	*	*				-151.5	151.9	60	-89.5	162.5	0	0	0	114.7
1518	K	26.8	Very low	30.7	Very low	192 Å²	192	138.6 Å²	138.6	84%	0.835	74%	0.743	S	S	*	*			trans	-91.9	171.3	156.1	-90.7	-173.2	176.6	-172.9	0	108.9
1519	P	39.8	Very low	30.4	Very low	96 Å²	96	137 Å²	137	62%	0.623	74%	0.743	S	S	*	*			cis	-130	-166.8	-27.8	34.2	-13.9	0	0	0	110.4
1520	D	30.3	Very low	30.1	Very low	151 Å²	151	137.3 Å²	137.3	81%	0.807	75%	0.752	S	S	*	*				-160.9	142.3	106.3	-98	-14.7	0	0	0	111.2
1521	L	25.4	Very low	30.4	Very low	140 Å²	140	135.2 Å²	135.2	73%	0.733	76%	0.755	S	S	*	*			trans	-82.5	151.7	154.4	-82.5	57.6	0	0	0	105.6
1522	D	31.4	Very low	30.2	Very low	145 Å²	145	133.3 Å²	133.3	78%	0.775	76%	0.757	S	S	*	*				172.2	168.2	92.8	-96.9	-37.9	0	0	0	106.3
1523	T	31.4	Very low	30.1	Very low	99 Å²	99	138 Å²	138	61%	0.607	77%	0.765	S	S	*	*			cis	174.1	125.4	-22.1	-93.4	0	0	0	0	103.9
1524	M	28.6	Very low	29.9	Very low	154 Å²	154	134.3 Å²	134.3	76%	0.759	76%	0.755	S	S	*	*			trans	67	154.2	163.1	-65.2	175.3	83.1	0	0	121.3
1525	S	26.6	Very low	29.8	Very low	109 Å²	109	134.5 Å²	134.5	76%	0.762	76%	0.756	S	S	*	*			trans	-118.6	148.4	169.9	170.9	0	0	0	0	108.5
1526	S	26.6	Very low	29.9	Very low	119 Å²	119	136.1 Å²	136.1	83%	0.832	76%	0.761	S	S	*	*			trans	153	166.1	140.7	57.4	0	0	0	0	113.4
1527	G	29.1	Very low	29.7	Very low	66 Å²	66	130.1 Å²	130.1	68%	0.68	75%	0.754	S	S	*	*			trans	95	109.3	-178.4	0	0	0	0	0	112.6
1528	E	26.2	Very low	29.6	Very low	189 Å²	189	127.6 Å²	127.6	88%	0.883	75%	0.751	S	S	*	*				66.9	135.2	62.6	-62.4	-153	127.9	0	0	113.5
1529	V	29.2	Very low	29.6	Very low	114 Å²	114	126.4 Å²	126.4	69%	0.691	75%	0.753	S	S	*	*			cis	-155.5	150	7.2	109.9	0	0	0	0	113.4
1530	V	27.3	Very low	29.3	Very low	120 Å²	120	127 Å²	127	73%	0.727	76%	0.757	S	S	*	*			trans	-14.7	158.4	149.7	-158	0	0	0	0	117.6
1531	P	38.4	Very low	29.3	Very low	110 Å²	110	124.8 Å²	124.8	71%	0.714	75%	0.753	S	S	*	*			cis	-129.4	-174.8	-44.9	41.5	-26.7	0	0	0	113
1532	S	28.6	Very low	29.9	Very low	105 Å²	105	126.7 Å²	126.7	73%	0.734	76%	0.758	S	S	*	*				-179.3	149.8	130	35.3	0	0	0	0	116
1533	H	29.4	Very low	29.9	Very low	177 Å²	177	124.6 Å²	124.6	82%	0.819	76%	0.755	S	S	*	*			trans	1.2	149.9	144.6	-53	-71.9	0	0	0	119.9
1534	S	30.4	Very low	30.1	Very low	96 Å²	96	127.4 Å²	127.4	67%	0.671	77%	0.765	S	S	*	*			cis	-175.1	172.9	-2.7	44.7	0	0	0	0	110
1535	D	26.4	Very low	29.9	Very low	144 Å²	144	123 Å²	123	77%	0.77	76%	0.759	S	S	*	*			trans	6.3	140.8	151.7	-41.1	-41.7	0	0	0	118.8
1536	V	31.1	Very low	30	Very low	132 Å²	132	126.4 Å²	126.4	80%	0.8	77%	0.768	S	S	*	*				-163.2	153.6	63.9	162.8	0	0	0	0	111.7
1537	S	26.3	Very low	29.9	Very low	102 Å²	102	125.7 Å²	125.7	71%	0.713	76%	0.763	S	S	*	*			trans	-48.2	147.3	177.3	58	0	0	0	0	119.2
1538	S	33.6	Very low	29.7	Very low	120 Å²	120	127.5 Å²	127.5	84%	0.839	76%	0.761	S	S	*	*				-168.5	129.3	116.4	38.3	0	0	0	0	114.7
1539	L	26	Very low	29.6	Very low	166 Å²	166	125.5 Å²	125.5	87%	0.869	75%	0.751	S	S	*	*			trans	-90.4	174.6	157.8	-83.8	146.1	0	0	0	108.5
1540	P	33.6	Very low	29.5	Very low	109 Å²	109	126.4 Å²	126.4	71%	0.708	75%	0.752	S	S	*	*			cis	-134.8	177.6	8	43.1	-27.8	0	0	0	115.3
1541	S	31.1	Very low	29.5	Very low	104 Å²	104	127.2 Å²	127.2	73%	0.727	75%	0.746	S	S	*	*				171.1	145.5	122.8	-77.7	0	0	0	0	112.4
1542	Q	36.2	Very low	28.8	Very low	180 Å²	180	130.3 Å²	130.3	84%	0.841	75%	0.751	S	S	*	*			trans	65.2	119.2	176.9	-58.8	175.6	6	0	0	113.8
1543	S	31.5	Very low	28.7	Very low	101 Å²	101	130.8 Å²	130.8	71%	0.706	75%	0.754	S	S	*	*			cis	71	123.7	45.4	85.5	0	0	0	0	112.1
1544	I	35.5	Very low	28.4	Very low	158 Å²	158	129.5 Å²	129.5	81%	0.81	75%	0.753	S	S	*	*			cis	-137.2	148.9	10.9	-62.5	173.3	0	0	0	107.3
1545	G	25.9	Very low	28.1	Very low	63 Å²	63	132.6 Å²	132.6	65%	0.649	76%	0.761	S	S	*	*			cis	121.7	20.8	5	0	0	0	0	0	115.5	S1547	G1545-S1547 PolarHBondContact O-N 2.9Å
1546	L	27.8	Very low	27.9	Very low	179 Å²	179	133.7 Å²	133.7	94%	0.937	77%	0.765	S	S	*	*			trans	-94.6	68.5	165.9	-74.3	178.3	0	0	0	111.4
1547	S	24.9	Very low	27.5	Very low	105 Å²	105	130.7 Å²	130.7	73%	0.734	76%	0.761	S	S	*	*			trans	-96.8	-163.6	143.4	-171.5	0	0	0	0	107.5	G1545	G1545-S1547 PolarHBondContact O-N 2.9Å
1548	V	25	Very low	27.4	Very low	104 Å²	104	133.3 Å²	133.3	63%	0.63	77%	0.766	S	S	*	*			trans	87.8	108.4	160.4	-171.7	0	0	0	0	118
1549	H	23.4	Very low	26.9	Very low	146 Å²	146	133.6 Å²	133.6	68%	0.676	76%	0.758	S	S	*	*			trans	71.3	145.2	156.3	-60.4	-21.5	0	0	0	117.1
1550	N	28.5	Very low	26.8	Very low	133 Å²	133	134.7 Å²	134.7	71%	0.711	75%	0.751	S	S	*	*			cis	-119.7	147.1	24.6	-83.2	-62.6	0	0	0	112.9
1551	K	26.6	Very low	26.4	Very low	138 Å²	138	136.3 Å²	136.3	60%	0.6	75%	0.753	S	S	*	*				55.6	110.8	76.7	-67	-178.7	-176.1	169.3	0	112.6
1552	E	22.3	Very low	26.2	Very low	175 Å²	175	136.6 Å²	136.6	82%	0.818	75%	0.751	S	S	*	*				66.2	91.3	80.5	-70.2	-172.1	125.7	0	0	113.8
1553	S	26.8	Very low	25.6	Very low	115 Å²	115	135.4 Å²	135.4	80%	0.804	75%	0.745	S	S	*	*			trans	-164.1	128.6	158.2	-72.4	0	0	0	0	105.7
1554	N	23.7	Very low	25.6	Very low	150 Å²	150	137.6 Å²	137.6	80%	0.802	76%	0.755	S	S	*	*			cis	65	81.5	9.3	-155.7	12	0	0	0	114.1
1555	I	23.9	Very low	25.1	Very low	161 Å²	161	138 Å²	138	83%	0.826	75%	0.753	S	S	*	*			trans	179.1	156.8	141.2	-93.7	154.8	0	0	0	111.9
1556	L	22.7	Very low	25.2	Very low	166 Å²	166	144 Å²	144	87%	0.869	76%	0.764	S	S	*	*			trans	-45.8	132.7	-179.6	-54.3	157.2	0	0	0	118.3
1557	G	22.2	Very low	25	Very low	69 Å²	69	144 Å²	144	71%	0.711	76%	0.764	S	S	*	*				94.2	155.1	118.5	0	0	0	0	0	121.4
1558	I	23.6	Very low	25	Very low	158 Å²	158	147 Å²	147	81%	0.81	77%	0.771	S	S	*	*			trans	63.6	122.5	144.4	-59.2	172	0	0	0	116.8
1559	D	23.6	Very low	25	Very low	125 Å²	125	146.2 Å²	146.2	67%	0.668	78%	0.775	S	S	*	*			cis	-165.8	159.4	-7.5	-117.2	-30.7	0	0	0	110.9
1560	Y	25	Very low	25.3	Very low	189 Å²	189	146.8 Å²	146.8	74%	0.741	78%	0.778	S	S	*	*			trans	68.5	116.6	152.8	-83	-128.4	0	0	0	123.1
1561	L	24.2	Very low	25.5	Very low	143 Å²	143	147 Å²	147	75%	0.749	79%	0.787	S	S	*	*			trans	61	148.4	135.6	-51.3	-179.4	0	0	0	119.7
1562	T	26.7	Very low	25.9	Very low	110 Å²	110	144.9 Å²	144.9	68%	0.675	79%	0.785	S	S	*	*			cis	-145.1	162.6	12.7	-30.1	0	0	0	0	111.6
1563	E	24.6	Very low	26.6	Very low	155 Å²	155	141.2 Å²	141.2	72%	0.724	77%	0.771	S	S	*	*			trans	22.6	124.5	156.7	-75.1	160.3	179.8	0	0	120.2
1564	T	31.3	Very low	27.2	Very low	147 Å²	147	142.5 Å²	142.5	90%	0.902	77%	0.768	S	S	*	*				-148.8	160.7	82.9	18.1	0	0	0	0	114.6
1565	Q	25.3	Very low	28.3	Very low	167 Å²	167	139.9 Å²	139.9	78%	0.78	76%	0.762	S	S	*	*			trans	-108.7	137.4	179.8	-57.3	170.2	5.5	0	0	110.6
1566	Q	27.4	Very low	29.2	Very low	189 Å²	189	137 Å²	137	88%	0.883	75%	0.748	S	S	*	*			trans	172.7	113	133.4	-97.8	165.5	18.7	0	0	112.6
1567	L	22.7	Very low	30.3	Very low	179 Å²	179	132 Å²	132	94%	0.937	73%	0.73	S	S	*	*			trans	-157.9	78.9	148.8	-94.4	-164.6	0	0	0	111.3
1568	I	25.1	Very low	31.6	Very low	169 Å²	169	134.9 Å²	134.9	87%	0.867	73%	0.727	S	S	*	*			trans	-145.3	131	160.4	-46.8	178.2	0	0	0	102.6
1569	A	26.1	Very low	32.8	Very low	87 Å²	87	132.1 Å²	132.1	72%	0.719	71%	0.713	S	S	*	*			cis	-154.4	-164.6	48.1	0	0	0	0	0	114.7
1570	E	28.7	Very low	34	Very low	157 Å²	157	129.1 Å²	129.1	73%	0.734	70%	0.701	S	S	*	*			trans	-69.1	161.8	177	-68.7	-164.5	140.3	0	0	114.4	T1572	E1570-T1572 VanDerWaalsContact C-N 3.35Å; E1570-T1572 PolarHBondContact O-N 3.39Å
1571	P	32.5	Very low	35.4	Very low	139 Å²	139	126.7 Å²	126.7	90%	0.903	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	74.4	-179.2	32.6	-37.8	0	0	0	113.7
1572	T	35.8	Very low	37	Very low	93 Å²	93	128.7 Å²	128.7	57%	0.571	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-26.3	165.9	40.3	0	0	0	0	113.6	E1570 L1574 S1575	E1570-T1572 VanDerWaalsContact C-N 3.35Å; E1570-T1572 PolarHBondContact O-N 3.39Å; T1572-L1574 PolarHBondContact O-N 2.88Å; T1572-S1575 PolarHBondContact O-N 3.08Å
1573	D	36.8	Very low	38.6	Very low	97 Å²	97	127.1 Å²	127.1	52%	0.519	68%	0.68	S	S	.	*	H	α-helix	trans	-85.7	-18.8	-150.8	-60.7	-9.4	0	0	0	114.5	S1575 L1576 A1577	D1573-S1575 PolarHBondContact O-N 3.46Å; D1573-L1576 PolarHBondContact O-N 2.98Å; D1573-A1577 WeakPolarHBondContact O-CB 3.46Å; D1573-A1577 PolarHBondContact O-N 2.92Å
1574	L	39.4	Very low	40.2	Very low	142 Å²	142	122.6 Å²	122.6	74%	0.743	67%	0.666	S	S	*	*	H	α-helix	trans	-60.4	-32.1	175.3	-168.5	66.2	0	0	0	111.9	T1572 M1578	T1572-L1574 PolarHBondContact O-N 2.88Å; L1574-M1578 WeakPolarHBondContact O-CB 3.44Å; L1574-M1578 VanDerWaalsContact O-CG 3.3Å; L1574-M1578 WeakPolarHBondContact O-CG 3.46Å; L1574-M1578 PolarHBondContact O-N 3.42Å
1575	S	46.2	Very low	41.6	Very low	96 Å²	96	123 Å²	123	67%	0.671	65%	0.651	S	S	*	*	H	α-helix	trans	-72.4	-33.3	174.3	-172.5	0	0	0	0	112.7	T1572 D1573 L1579	T1572-S1575 PolarHBondContact O-N 3.08Å; D1573-S1575 PolarHBondContact O-N 3.46Å; S1575-L1579 WeakPolarHBondContact O-CB 3.49Å; S1575-L1579 PolarHBondContact O-N 3.43Å
1576	L	42.8	Very low	43.2	Very low	100 Å²	100	119.9 Å²	119.9	52%	0.524	64%	0.639	S	S	.	*	H	α-helix	trans	-82.9	-41.5	-177.4	-174.1	59.9	0	0	0	111.1	D1573 M1578 L1579 C1580	D1573-L1576 PolarHBondContact O-N 2.98Å; L1576-M1578 PolarHBondContact O-N 3.48Å; L1576-L1579 WeakPolarHBondContact O-CB 3.36Å; L1576-L1579 PolarHBondContact O-N 2.62Å; L1576-L1579 VanDerWaalsContact O-N 3.11Å; L1576-C1580 WeakPolarHBondContact O-CB 3.34Å; L1576-C1580 PolarHBondContact O-N 2.86Å; L1576-C1580 PolarHBondContact O-SG 3.32Å
1577	A	45.9	Very low	44.4	Very low	60 Å²	60	116.3 Å²	116.3	50%	0.496	62%	0.623	S	S	.	*	H	α-helix	trans	-59.2	-44	173.9	0	0	0	0	0	111.8	D1573 L1579 C1580 H1581	D1573-A1577 WeakPolarHBondContact O-CB 3.46Å; D1573-A1577 PolarHBondContact O-N 2.92Å; A1577-L1579 VanDerWaalsContact C-N 3.34Å; A1577-L1579 PolarHBondContact O-N 3.4Å; A1577-C1580 PolarHBondContact O-N 3.24Å; A1577-H1581 VanDerWaalsContact O-CB 3.31Å; A1577-H1581 WeakPolarHBondContact O-CB 3.15Å; A1577-H1581 PolarHBondContact O-N 3.11Å
1578	M	49.3	Very low	46.2	Very low	131 Å²	131	112.1 Å²	112.1	65%	0.645	61%	0.605	S	S	*	*	H	α-helix	trans	-63.9	-37	173.2	-74.7	-175.9	71.1	0	0	112.8	L1574 L1576 R1582	L1574-M1578 WeakPolarHBondContact O-CB 3.44Å; L1574-M1578 VanDerWaalsContact O-CG 3.3Å; L1574-M1578 WeakPolarHBondContact O-CG 3.46Å; L1574-M1578 PolarHBondContact O-N 3.42Å; L1576-M1578 PolarHBondContact O-N 3.48Å; M1578-R1582 VanDerWaalsContact O-CB 3.27Å; M1578-R1582 WeakPolarHBondContact O-CB 3.44Å; M1578-R1582 PolarHBondContact O-N 3.41Å
1579	L	50	Low	47.7	Very low	99 Å²	99	107.8 Å²	107.8	52%	0.518	58%	0.581	S	S	.	*	H	α-helix	trans	-68.2	-48.4	176.9	-167.1	77.7	0	0	0	111	S1575 L1576 A1577 R1582 I1583	S1575-L1579 WeakPolarHBondContact O-CB 3.49Å; S1575-L1579 PolarHBondContact O-N 3.43Å; L1576-L1579 WeakPolarHBondContact O-CB 3.36Å; L1576-L1579 PolarHBondContact O-N 2.62Å; L1576-L1579 VanDerWaalsContact O-N 3.11Å; A1577-L1579 VanDerWaalsContact C-N 3.34Å; A1577-L1579 PolarHBondContact O-N 3.4Å; L1579-R1582 PolarHBondContact O-N 3.22Å; L1579-I1583 HydrophobicContact CD2-CD1 4.22Å; L1579-I1583 HydrophobicContact CG-CD1 3.89Å; L1579-I1583 WeakPolarHBondContact O-CB 3.45Å; L1579-I1583 VanDerWaalsContact O-CG1 3.3Å; L1579-I1583 WeakPolarHBondContact O-CG1 3.32Å; L1579-I1583 PolarHBondContact O-N 3.29Å
1580	C	49.1	Very low	48.9	Very low	63 Å²	63	106.4 Å²	106.4	43%	0.426	57%	0.57	S	S	.	*	H	α-helix	trans	-60.5	-46.3	177.1	-67.8	0	0	0	0	111.4	L1576 A1577 R1582 I1583 S1584	L1576-C1580 WeakPolarHBondContact O-CB 3.34Å; L1576-C1580 PolarHBondContact O-N 2.86Å; L1576-C1580 PolarHBondContact O-SG 3.32Å; A1577-C1580 PolarHBondContact O-N 3.24Å; C1580-R1582 VanDerWaalsContact C-N 3.3Å; C1580-R1582 PolarHBondContact O-N 3.38Å; C1580-I1583 PolarHBondContact O-N 3.27Å; C1580-S1584 WeakPolarHBondContact O-CB 3.37Å; C1580-S1584 PolarHBondContact O-N 2.8Å; C1580-S1584 PolarHBondContact O-OG 2.86Å
1581	H	54.3	Low	50.1	Low	138 Å²	138	104.7 Å²	104.7	64%	0.639	56%	0.561	S	S	*	*	H	α-helix	trans	-62.4	-37.3	176.9	-169.2	-14.4	0	0	0	112	A1577 R1585	A1577-H1581 VanDerWaalsContact O-CB 3.31Å; A1577-H1581 WeakPolarHBondContact O-CB 3.15Å; A1577-H1581 PolarHBondContact O-N 3.11Å; H1581-R1585 VanDerWaalsContact O-CB 3.26Å; H1581-R1585 WeakPolarHBondContact O-CB 3.18Å; H1581-R1585 PolarHBondContact O-N 2.98Å
1582	R	57.4	Low	51	Low	185 Å²	185	100.8 Å²	100.8	70%	0.698	54%	0.541	S	S	*	.	H	α-helix	trans	-72.6	-34.6	176.4	-164.7	169.1	-174.6	158.8	0.7	112.3	M1578 L1579 C1580 L1586	M1578-R1582 VanDerWaalsContact O-CB 3.27Å; M1578-R1582 WeakPolarHBondContact O-CB 3.44Å; M1578-R1582 PolarHBondContact O-N 3.41Å; L1579-R1582 PolarHBondContact O-N 3.22Å; C1580-R1582 VanDerWaalsContact C-N 3.3Å; C1580-R1582 PolarHBondContact O-N 3.38Å; R1582-L1586 HydrophobicContact CG-CD1 4.45Å; R1582-L1586 WeakPolarHBondContact O-CB 3.35Å; R1582-L1586 VanDerWaalsContact O-CG 3.27Å; R1582-L1586 WeakPolarHBondContact O-CG 3.43Å; R1582-L1586 PolarHBondContact O-N 2.94Å
1583	I	60.7	Low	51.8	Low	76 Å²	76	100.5 Å²	100.5	39%	0.39	54%	0.539	S	S	.	.	H	α-helix	trans	-67.4	-50.7	172.7	-71.9	167.9	0	0	0	110.3	L1579 C1580 R1585 L1586 Q1587	L1579-I1583 HydrophobicContact CD2-CD1 4.22Å; L1579-I1583 HydrophobicContact CG-CD1 3.89Å; L1579-I1583 WeakPolarHBondContact O-CB 3.45Å; L1579-I1583 VanDerWaalsContact O-CG1 3.3Å; L1579-I1583 WeakPolarHBondContact O-CG1 3.32Å; L1579-I1583 PolarHBondContact O-N 3.29Å; C1580-I1583 PolarHBondContact O-N 3.27Å; I1583-R1585 VanDerWaalsContact C-N 3.31Å; I1583-R1585 PolarHBondContact O-N 3.19Å; I1583-L1586 CarbonylContact O-C 3.28Å; I1583-L1586 PolarHBondContact O-N 3.21Å; I1583-L1586 VanDerWaalsContact O-N 3.16Å; I1583-Q1587 HydrophobicContact CG2-CG 4.4Å; I1583-Q1587 WeakPolarHBondContact O-CG 3.4Å; I1583-Q1587 PolarHBondContact O-N 3.36Å
1584	S	57.5	Low	52.2	Low	61 Å²	61	98.3 Å²	98.3	43%	0.427	53%	0.534	S	S	.	.	H	α-helix	trans	-59.5	-41.6	176.6	-62.2	0	0	0	0	111.7	C1580 Q1587 T1588	C1580-S1584 WeakPolarHBondContact O-CB 3.37Å; C1580-S1584 PolarHBondContact O-N 2.8Å; C1580-S1584 PolarHBondContact O-OG 2.86Å; S1584-Q1587 WeakPolarHBondContact O-CB 3.47Å; S1584-Q1587 PolarHBondContact O-N 3.02Å; S1584-T1588 PolarHBondContact O-N 2.87Å; S1584-T1588 PolarHBondContact O-OG1 3.33Å
1585	R	61.6	Low	52.7	Low	154 Å²	154	98.3 Å²	98.3	58%	0.581	53%	0.528	S	S	*	.	H	α-helix	trans	-60.1	-47.7	174.1	178.4	175.5	168.2	163.5	3.3	111.9	H1581 I1583 Q1587 T1588 E1589	H1581-R1585 VanDerWaalsContact O-CB 3.26Å; H1581-R1585 WeakPolarHBondContact O-CB 3.18Å; H1581-R1585 PolarHBondContact O-N 2.98Å; I1583-R1585 VanDerWaalsContact C-N 3.31Å; I1583-R1585 PolarHBondContact O-N 3.19Å; R1585-Q1587 VanDerWaalsContact C-N 3.28Å; R1585-Q1587 PolarHBondContact O-N 3.48Å; R1585-T1588 PolarHBondContact O-N 3.23Å; R1585-E1589 HydrophobicContact CG-CG 4.39Å; R1585-E1589 IonicContact CZ-OE1 2.77Å; R1585-E1589 IonicContact NE-OE1 3.58Å; R1585-E1589 PolarHBondContact NE-OE1 2.84Å; R1585-E1589 IonicContact NE-OE2 3.58Å; R1585-E1589 IonicContact NH2-OE1 3.43Å; R1585-E1589 PolarHBondContact NH2-OE1 3.17Å; R1585-E1589 WeakPolarHBondContact O-CB 3.16Å; R1585-E1589 WeakPolarHBondContact O-CG 3.38Å; R1585-E1589 PolarHBondContact O-N 3.25Å
1586	L	58	Low	52.6	Low	102 Å²	102	96.3 Å²	96.3	53%	0.534	52%	0.518	S	S	.	.	H	α-helix	trans	-65	-30.8	176.6	-73.8	168.6	0	0	0	112.5	R1582 I1583 A1590	R1582-L1586 HydrophobicContact CG-CD1 4.45Å; R1582-L1586 WeakPolarHBondContact O-CB 3.35Å; R1582-L1586 VanDerWaalsContact O-CG 3.27Å; R1582-L1586 WeakPolarHBondContact O-CG 3.43Å; R1582-L1586 PolarHBondContact O-N 2.94Å; I1583-L1586 CarbonylContact O-C 3.28Å; I1583-L1586 PolarHBondContact O-N 3.21Å; I1583-L1586 VanDerWaalsContact O-N 3.16Å; L1586-A1590 WeakPolarHBondContact O-CB 3.27Å; L1586-A1590 PolarHBondContact O-N 3.14Å
1587	Q	52.8	Low	52.5	Low	115 Å²	115	96.3 Å²	96.3	54%	0.537	52%	0.517	S	S	.	.	H	α-helix	trans	-69.2	-43.5	172.2	-72.7	174.8	-56	0	0	111.5	I1583 S1584 R1585 A1590 E1591	I1583-Q1587 HydrophobicContact CG2-CG 4.4Å; I1583-Q1587 WeakPolarHBondContact O-CG 3.4Å; I1583-Q1587 PolarHBondContact O-N 3.36Å; S1584-Q1587 WeakPolarHBondContact O-CB 3.47Å; S1584-Q1587 PolarHBondContact O-N 3.02Å; R1585-Q1587 VanDerWaalsContact C-N 3.28Å; R1585-Q1587 PolarHBondContact O-N 3.48Å; Q1587-A1590 PolarHBondContact O-N 3.02Å; Q1587-E1591 WeakPolarHBondContact O-CB 3.48Å; Q1587-E1591 WeakPolarHBondContact O-CG 3.48Å; Q1587-E1591 PolarHBondContact O-N 3.29Å
1588	T	59.4	Low	52.3	Low	91 Å²	91	96.7 Å²	96.7	56%	0.558	52%	0.516	S	S	*	.	H	α-helix	trans	-66.6	-38.4	175	-49.6	0	0	0	0	112	S1584 R1585 E1591 A1592	S1584-T1588 PolarHBondContact O-N 2.87Å; S1584-T1588 PolarHBondContact O-OG1 3.33Å; R1585-T1588 PolarHBondContact O-N 3.23Å; T1588-E1591 PolarHBondContact O-N 2.66Å; T1588-A1592 VanDerWaalsContact O-CB 3.26Å; T1588-A1592 WeakPolarHBondContact O-CB 3.07Å; T1588-A1592 PolarHBondContact O-N 3.01Å
1589	E	57.4	Low	51.7	Low	77 Å²	77	92.8 Å²	92.8	36%	0.36	51%	0.505	S	S	.	.	H	α-helix	trans	-66.2	-40.4	174	-73.2	169.6	162.4	0	0	111	R1585 A1592 V1593	R1585-E1589 HydrophobicContact CG-CG 4.39Å; R1585-E1589 IonicContact CZ-OE1 2.77Å; R1585-E1589 IonicContact NE-OE1 3.58Å; R1585-E1589 PolarHBondContact NE-OE1 2.84Å; R1585-E1589 IonicContact NE-OE2 3.58Å; R1585-E1589 IonicContact NH2-OE1 3.43Å; R1585-E1589 PolarHBondContact NH2-OE1 3.17Å; R1585-E1589 WeakPolarHBondContact O-CB 3.16Å; R1585-E1589 WeakPolarHBondContact O-CG 3.38Å; R1585-E1589 PolarHBondContact O-N 3.25Å; E1589-A1592 PolarHBondContact O-N 3.39Å; E1589-V1593 WeakPolarHBondContact O-CG2 3.44Å; E1589-V1593 PolarHBondContact O-N 2.81Å
1590	A	51.5	Low	51.1	Low	59 Å²	59	94.1 Å²	94.1	49%	0.488	51%	0.512	S	S	.	.	H	α-helix	trans	-68.4	-39.1	173.9	0	0	0	0	0	113.1	L1586 Q1587 V1593 A1594	L1586-A1590 WeakPolarHBondContact O-CB 3.27Å; L1586-A1590 PolarHBondContact O-N 3.14Å; Q1587-A1590 PolarHBondContact O-N 3.02Å; A1590-V1593 PolarHBondContact O-N 2.8Å; A1590-A1594 VanDerWaalsContact O-CB 3.23Å; A1590-A1594 WeakPolarHBondContact O-CB 3.36Å; A1590-A1594 PolarHBondContact O-N 3.18Å
1591	E	53.5	Low	50.3	Low	120 Å²	120	95.6 Å²	95.6	56%	0.561	52%	0.516	S	S	*	.	H	α-helix	trans	-66.8	-36.4	172.8	-78.8	-168	156.1	0	0	112.1	Q1587 T1588 A1594 K1595	Q1587-E1591 WeakPolarHBondContact O-CB 3.48Å; Q1587-E1591 WeakPolarHBondContact O-CG 3.48Å; Q1587-E1591 PolarHBondContact O-N 3.29Å; T1588-E1591 PolarHBondContact O-N 2.66Å; E1591-A1594 PolarHBondContact O-N 2.87Å; E1591-K1595 VanDerWaalsContact O-CB 3.26Å; E1591-K1595 WeakPolarHBondContact O-CB 3.29Å; E1591-K1595 VanDerWaalsContact O-CG 3.28Å; E1591-K1595 WeakPolarHBondContact O-CG 3.17Å; E1591-K1595 PolarHBondContact O-N 2.93Å
1592	A	52.6	Low	49.2	Very low	58 Å²	58	95.4 Å²	95.4	48%	0.479	52%	0.515	S	S	.	.	H	α-helix	trans	-65.9	-43.8	174.3	0	0	0	0	0	111.3	T1588 E1589 K1595 A1596	T1588-A1592 VanDerWaalsContact O-CB 3.26Å; T1588-A1592 WeakPolarHBondContact O-CB 3.07Å; T1588-A1592 PolarHBondContact O-N 3.01Å; E1589-A1592 PolarHBondContact O-N 3.39Å; A1592-K1595 PolarHBondContact O-N 3.39Å; A1592-A1596 WeakPolarHBondContact O-CB 3.21Å; A1592-A1596 PolarHBondContact O-N 2.87Å
1593	V	51.7	Low	47.9	Very low	87 Å²	87	93.1 Å²	93.1	53%	0.527	52%	0.517	S	S	.	.	H	α-helix	trans	-65.5	-42.5	174	170.1	0	0	0	0	111.4	E1589 A1590 K1595 A1596 I1597	E1589-V1593 WeakPolarHBondContact O-CG2 3.44Å; E1589-V1593 PolarHBondContact O-N 2.81Å; A1590-V1593 PolarHBondContact O-N 2.8Å; V1593-K1595 VanDerWaalsContact C-N 3.34Å; V1593-K1595 PolarHBondContact O-N 3.33Å; V1593-A1596 PolarHBondContact O-N 3.16Å; V1593-I1597 HydrophobicContact CG1-CD1 3.72Å; V1593-I1597 HydrophobicContact CG1-CG1 4.43Å; V1593-I1597 WeakPolarHBondContact O-CB 3.37Å; V1593-I1597 VanDerWaalsContact O-CG1 3.29Å; V1593-I1597 WeakPolarHBondContact O-CG1 3.39Å; V1593-I1597 PolarHBondContact O-N 3.12Å
1594	A	44.8	Very low	46.3	Very low	50 Å²	50	97 Å²	97	41%	0.413	54%	0.538	S	S	.	.	H	α-helix	trans	-64.4	-37.5	175.9	0	0	0	0	0	112.2	A1590 E1591 S1598	A1590-A1594 VanDerWaalsContact O-CB 3.23Å; A1590-A1594 WeakPolarHBondContact O-CB 3.36Å; A1590-A1594 PolarHBondContact O-N 3.18Å; E1591-A1594 PolarHBondContact O-N 2.87Å; A1594-S1598 VanDerWaalsContact O-CB 3.27Å; A1594-S1598 WeakPolarHBondContact O-CB 3.43Å; A1594-S1598 PolarHBondContact O-N 2.88Å; A1594-S1598 PolarHBondContact O-OG 2.71Å
1595	K	49.4	Very low	44.8	Very low	143 Å²	143	98.4 Å²	98.4	62%	0.622	55%	0.548	S	S	*	.	H	α-helix	trans	-68.8	-39.6	172.8	-78.7	172.3	177.6	169.2	0	112.3	E1591 A1592 V1593 S1598 A1599	E1591-K1595 VanDerWaalsContact O-CB 3.26Å; E1591-K1595 WeakPolarHBondContact O-CB 3.29Å; E1591-K1595 VanDerWaalsContact O-CG 3.28Å; E1591-K1595 WeakPolarHBondContact O-CG 3.17Å; E1591-K1595 PolarHBondContact O-N 2.93Å; A1592-K1595 PolarHBondContact O-N 3.39Å; V1593-K1595 VanDerWaalsContact C-N 3.34Å; V1593-K1595 PolarHBondContact O-N 3.33Å; K1595-S1598 PolarHBondContact O-N 2.92Å; K1595-A1599 VanDerWaalsContact O-CB 3.3Å; K1595-A1599 WeakPolarHBondContact O-CB 3.46Å; K1595-A1599 PolarHBondContact O-N 3.13Å
1596	A	44.8	Very low	43	Very low	54 Å²	54	95.3 Å²	95.3	45%	0.446	56%	0.556	S	S	.	*	H	α-helix	trans	-63.8	-43.1	174.2	0	0	0	0	0	111.9	A1592 V1593 S1598 A1599 N1600	A1592-A1596 WeakPolarHBondContact O-CB 3.21Å; A1592-A1596 PolarHBondContact O-N 2.87Å; V1593-A1596 PolarHBondContact O-N 3.16Å; A1596-S1598 VanDerWaalsContact C-N 3.35Å; A1596-A1599 PolarHBondContact O-N 3.41Å; A1596-N1600 WeakPolarHBondContact O-CB 3.24Å; A1596-N1600 PolarHBondContact O-N 3.32Å
1597	I	41.6	Very low	41.5	Very low	99 Å²	99	96.5 Å²	96.5	51%	0.508	57%	0.571	S	S	.	*	H	α-helix	trans	-67.1	-35.7	175	-67.1	169	0	0	0	111	V1593 N1601	V1593-I1597 HydrophobicContact CG1-CD1 3.72Å; V1593-I1597 HydrophobicContact CG1-CG1 4.43Å; V1593-I1597 WeakPolarHBondContact O-CB 3.37Å; V1593-I1597 VanDerWaalsContact O-CG1 3.29Å; V1593-I1597 WeakPolarHBondContact O-CG1 3.39Å; V1593-I1597 PolarHBondContact O-N 3.12Å; I1597-N1601 WeakPolarHBondContact O-CB 3.49Å; I1597-N1601 PolarHBondContact O-N 2.74Å; I1597-N1601 VanDerWaalsContact O-N 3.12Å; I1597-N1601 PolarHBondContact O-ND2 3.21Å
1598	S	40.1	Very low	40.5	Very low	68 Å²	68	97 Å²	97	48%	0.476	58%	0.582	S	S	.	*	H	α-helix	trans	-73.2	-34.3	175.9	-58.4	0	0	0	0	113	A1594 K1595 A1596 N1601 H1602	A1594-S1598 VanDerWaalsContact O-CB 3.27Å; A1594-S1598 WeakPolarHBondContact O-CB 3.43Å; A1594-S1598 PolarHBondContact O-N 2.88Å; A1594-S1598 PolarHBondContact O-OG 2.71Å; K1595-S1598 PolarHBondContact O-N 2.92Å; A1596-S1598 VanDerWaalsContact C-N 3.35Å; S1598-N1601 PolarHBondContact O-N 3.35Å; S1598-H1602 PolarHBondContact O-N 2.67Å
1599	A	38.2	Very low	38.8	Very low	50 Å²	50	103 Å²	103	41%	0.413	60%	0.595	S	S	.	*	H	α-helix	trans	-68	-46.7	174.2	0	0	0	0	0	111.2	K1595 A1596 N1601 H1602 N1603	K1595-A1599 VanDerWaalsContact O-CB 3.3Å; K1595-A1599 WeakPolarHBondContact O-CB 3.46Å; K1595-A1599 PolarHBondContact O-N 3.13Å; A1596-A1599 PolarHBondContact O-N 3.41Å; A1599-N1601 PolarHBondContact O-N 3.06Å; A1599-H1602 PolarHBondContact O-N 2.99Å; A1599-N1603 PolarHBondContact O-N 3.27Å
1600	N	37.1	Very low	37.3	Very low	126 Å²	126	106.4 Å²	106.4	67%	0.674	62%	0.615	S	S	*	*	H	α-helix	trans	-68.7	-15.2	176.1	-76	9.3	0	0	0	113.5	A1596	A1596-N1600 WeakPolarHBondContact O-CB 3.24Å; A1596-N1600 PolarHBondContact O-N 3.32Å
1601	N	31.8	Very low	36.2	Very low	94 Å²	94	111.8 Å²	111.8	50%	0.503	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.9	2.8	169.7	-79	-68.3	0	0	0	114.2	I1597 S1598 A1599	I1597-N1601 WeakPolarHBondContact O-CB 3.49Å; I1597-N1601 PolarHBondContact O-N 2.74Å; I1597-N1601 VanDerWaalsContact O-N 3.12Å; I1597-N1601 PolarHBondContact O-ND2 3.21Å; S1598-N1601 PolarHBondContact O-N 3.35Å; A1599-N1601 PolarHBondContact O-N 3.06Å
1602	H	31.4	Very low	35	Very low	135 Å²	135	114.5 Å²	114.5	63%	0.625	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.3	-17.8	170.5	-92	-55.4	0	0	0	114.1	S1598 A1599 N1604	S1598-H1602 PolarHBondContact O-N 2.67Å; A1599-H1602 PolarHBondContact O-N 2.99Å; H1602-N1604 PolarHBondContact O-N 3.35Å
1603	N	29.7	Very low	33.9	Very low	137 Å²	137	116.8 Å²	116.8	73%	0.733	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	36.4	173.2	-70.8	-2.5	0	0	0	113.3	A1599	A1599-N1603 PolarHBondContact O-N 3.27Å
1604	N	27.1	Very low	32.9	Very low	157 Å²	157	118.6 Å²	118.6	84%	0.84	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.9	34.5	170.7	-118.2	-22.9	0	0	0	112.7	H1602	H1602-N1604 PolarHBondContact O-N 3.35Å
1605	S	25.4	Very low	32	Very low	91 Å²	91	120.6 Å²	120.6	64%	0.636	68%	0.675	S	S	*	*	S	Bend	trans	-152.9	45.2	177	71.8	0	0	0	0	112.9
1606	A	25.9	Very low	31	Very low	89 Å²	89	121 Å²	121	74%	0.736	68%	0.684	S	S	*	*			trans	-142.3	36.4	-169.7	0	0	0	0	0	115
1607	C	26.4	Very low	30.2	Very low	127 Å²	127	126.1 Å²	126.1	86%	0.858	70%	0.703	S	S	*	*			trans	-69	134.2	161.1	-166	0	0	0	0	109.3
1608	T	29.9	Very low	30.1	Very low	125 Å²	125	126.2 Å²	126.2	77%	0.767	71%	0.71	S	S	*	*			trans	-63.2	134	177.6	38.1	0	0	0	0	110
1609	R	25.4	Very low	29.5	Very low	218 Å²	218	129.9 Å²	129.9	82%	0.823	72%	0.723	S	S	*	*			cis	76.5	90.6	38.8	-159.6	-174.2	-158.8	-178.4	7.6	113.6
1610	N	25.2	Very low	29.2	Very low	148 Å²	148	135 Å²	135	79%	0.791	74%	0.742	S	S	*	*			trans	71.2	149.9	168.4	-61.2	-24.2	0	0	0	115.6
1611	K	28.3	Very low	28.8	Very low	172 Å²	172	136.7 Å²	136.7	75%	0.748	75%	0.75	S	S	*	*			cis	-129.7	151.2	10.7	-71.4	177	179.9	172.9	0	112.8
1612	Q	27.7	Very low	28.9	Very low	177 Å²	177	140.8 Å²	140.8	83%	0.827	77%	0.767	S	S	*	*			trans	55.6	128.1	147.4	-67.2	155.8	-45.6	0	0	117.9
1613	S	29.3	Very low	29	Very low	105 Å²	105	141.6 Å²	141.6	73%	0.734	77%	0.771	S	S	*	*			cis	-146	150.8	42.3	50.8	0	0	0	0	116.1
1614	T	30.7	Very low	29	Very low	126 Å²	126	143.9 Å²	143.9	77%	0.773	77%	0.774	S	S	*	*			trans	42.6	100.9	151.3	52.5	0	0	0	0	121.3
1615	S	27.1	Very low	29.2	Very low	92 Å²	92	141 Å²	141	64%	0.643	77%	0.773	S	S	*	*			trans	-35.9	152.4	134.2	62.6	0	0	0	0	114.2
1616	N	28.9	Very low	29.6	Very low	151 Å²	151	142 Å²	142	81%	0.807	78%	0.78	S	S	*	*			cis	-148.2	159.4	25.8	-73.9	-82.1	0	0	0	113.1
1617	L	26.9	Very low	30.6	Very low	161 Å²	161	142.7 Å²	142.7	84%	0.843	78%	0.777	S	S	*	*			trans	-105.2	161.8	153.4	-86.1	165.9	0	0	0	108.8
1618	P	40	Very low	30.9	Very low	102 Å²	102	142.5 Å²	142.5	66%	0.662	77%	0.771	S	S	*	*			cis	-142.3	-173.2	-11	29.1	-4.5	0	0	0	115.5
1619	I	28.2	Very low	31.1	Very low	145 Å²	145	142.5 Å²	142.5	74%	0.744	77%	0.767	S	S	*	*			trans	87.7	99	154.9	-47.1	-163.9	0	0	0	119.1
1620	I	30.7	Very low	31.4	Very low	158 Å²	158	140.5 Å²	140.5	81%	0.81	77%	0.767	S	S	*	*			trans	63.6	101.7	144.6	-56	170.4	0	0	0	117.8
1621	N	29.3	Very low	31.8	Very low	160 Å²	160	136.9 Å²	136.9	86%	0.856	76%	0.757	S	S	*	*			trans	-78.4	114.6	164.7	-83.1	-32.7	0	0	0	112
1622	Q	33.2	Very low	31.9	Very low	181 Å²	181	137.4 Å²	137.4	85%	0.846	76%	0.762	S	S	*	*				-163.7	106.1	129.8	-109.6	168.7	39.2	0	0	113.1
1623	Q	32.9	Very low	32	Very low	152 Å²	152	133.3 Å²	133.3	71%	0.71	75%	0.753	S	S	*	*			trans	6.8	123.4	149.2	-52.9	165.4	-41.6	0	0	118.6
1624	F	31.3	Very low	32.1	Very low	184 Å²	184	137.3 Å²	137.3	81%	0.807	76%	0.757	S	S	*	*				174.6	148.5	89.3	-98.8	-69.1	0	0	0	114.4
1625	A	31.7	Very low	32.1	Very low	98 Å²	98	141.8 Å²	141.8	81%	0.81	76%	0.76	S	S	*	*			trans	59.3	120	149.9	0	0	0	0	0	122.4
1626	S	33.4	Very low	32.3	Very low	112 Å²	112	142.8 Å²	142.8	78%	0.783	76%	0.763	S	S	*	*			trans	-124.9	157.1	140.3	174.7	0	0	0	0	106.8
1627	P	46.1	Very low	32.5	Very low	103 Å²	103	142.6 Å²	142.6	67%	0.669	76%	0.762	S	S	*	*				-157.3	171.1	116.7	36.3	-15.7	0	0	0	118.2
1628	V	33.1	Very low	32.9	Very low	123 Å²	123	140 Å²	140	75%	0.745	76%	0.757	S	S	*	*			trans	65.4	154.6	153	-77.3	0	0	0	0	121.4
1629	D	33	Very low	32.6	Very low	125 Å²	125	138.6 Å²	138.6	67%	0.668	74%	0.744	S	S	*	*			cis	-140.9	150.8	16	-102	-41.2	0	0	0	115.8
1630	E	32.3	Very low	32.7	Very low	176 Å²	176	134.9 Å²	134.9	82%	0.822	73%	0.731	S	S	*	*			trans	53.2	149.4	141.2	-63.1	-170.8	135.2	0	0	125.4
1631	A	33.1	Very low	32.8	Very low	71 Å²	71	130 Å²	130	59%	0.587	71%	0.705	S	S	*	*			cis	-172.4	159.2	-19.5	0	0	0	0	0	114.4
1632	Q	30.5	Very low	32.5	Very low	183 Å²	183	126.6 Å²	126.6	86%	0.855	69%	0.69	S	S	*	*			trans	66.9	152.5	156	-67.6	162.2	30	0	0	121.3
1633	S	30.1	Very low	33.5	Very low	91 Å²	91	125.1 Å²	125.1	64%	0.636	69%	0.686	S	S	*	*			cis	-173	155.5	-25.5	63.6	0	0	0	0	114
1634	F	31.4	Very low	33.6	Very low	189 Å²	189	125 Å²	125	83%	0.829	69%	0.69	S	S	*	*			trans	67.9	125.7	157.5	-76.1	-74.2	0	0	0	124.1
1635	R	30.8	Very low	33.5	Very low	220 Å²	220	124 Å²	124	83%	0.83	69%	0.688	S	S	*	*			trans	2.9	152	134.8	-66.8	-163.7	175	-168.5	-1.1	120.3
1636	T	32.5	Very low	33.4	Very low	114 Å²	114	127.2 Å²	127.2	70%	0.699	69%	0.688	S	S	*	*			cis	-166	166.6	-2.7	18.6	0	0	0	0	112.3
1637	D	31.7	Very low	33.4	Very low	146 Å²	146	129.1 Å²	129.1	78%	0.781	69%	0.685	S	S	*	*			trans	-62.5	-177.3	163.8	-46.7	-98.1	0	0	0	113.3
1638	S	36.3	Very low	32.8	Very low	107 Å²	107	130.4 Å²	130.4	75%	0.748	69%	0.685	S	S	*	*			cis	-161.6	174.8	36.4	-79	0	0	0	0	114.5
1639	N	32.3	Very low	32.6	Very low	72 Å²	72	134.3 Å²	134.3	39%	0.385	69%	0.686	S	S	.	*			trans	74.4	147.9	168.9	-162.2	9.9	0	0	0	118.2	H1445	H1445-N1639 PolarHBondContact CD2-OD1 2.73Å; H1445-N1639 VanDerWaalsContact CG-CG 3.49Å; H1445-N1639 VanDerWaalsContact CG-OD1 3.25Å; H1445-N1639 PolarHBondContact N-OD1 3.05Å
1640	S	31.5	Very low	32.5	Very low	67 Å²	67	136 Å²	136	47%	0.469	69%	0.689	S	S	.	*			trans	57.1	98.7	156.8	46.9	0	0	0	0	119.7
1641	H	32	Very low	32.3	Very low	56 Å²	56	133 Å²	133	26%	0.259	69%	0.688	S	S	.	*			trans	-65.2	120.6	168.6	180	79.9	0	0	0	115	N1441 K1442 T1443	N1441-H1641 PolarHBondContact ND2-NE2 3.1Å; N1441-H1641 PolarHBondContact OD1-NE2 3.03Å; K1442-H1641 HydrophobicContact CB-CB 3.62Å; K1442-H1641 HydrophobicContact CD-CB 4.04Å; K1442-H1641 VanDerWaalsContact CE-ND1 3.25Å; K1442-H1641 WeakPolarHBondContact CE-ND1 3.43Å; K1442-H1641 HydrophobicContact CG-CB 4.48Å; K1442-H1641 PolarHBondContact NZ-ND1 2.67Å; K1442-H1641 PolarHBondContact O-CD2 2.58Å; T1443-H1641 WeakPolarHBondContact CG2-O 3.31Å; T1443-H1641 PolarHBondContact OG1-O 3.3Å
1642	T	23.9	Very low	32.7	Very low	88 Å²	88	135.9 Å²	135.9	54%	0.54	70%	0.701	S	S	.	*			trans	-141.8	-134.5	134	-38.6	0	0	0	0	106	N1644	T1642-N1644 PolarHBondContact O-N 3.34Å
1643	I	52.9	Low	32.7	Very low	151 Å²	151	130.6 Å²	130.6	77%	0.774	70%	0.696	S	S	*	*	S	Bend	trans	41.7	83	132.7	-62.6	155.6	0	0	0	115.2
1644	N	36.7	Very low	32.8	Very low	148 Å²	148	135.7 Å²	135.7	79%	0.791	71%	0.706	S	S	*	*			trans	-10	155.2	162.3	-42	-12.4	0	0	0	119.8	T1642	T1642-N1644 PolarHBondContact O-N 3.34Å
1645	E	27.9	Very low	32.7	Very low	164 Å²	164	135.2 Å²	135.2	77%	0.766	70%	0.704	S	S	*	*			cis	175.3	109.9	-37.1	-113.8	-174.8	168.9	0	0	108.4
1646	M	30.6	Very low	32.6	Very low	166 Å²	166	131.4 Å²	131.4	82%	0.818	70%	0.7	S	S	*	*			trans	-166.7	145.2	172	-157.2	172.7	-67.6	0	0	114
1647	Q	31.9	Very low	32.5	Very low	151 Å²	151	135.2 Å²	135.2	71%	0.706	71%	0.71	S	S	*	*			trans	57.9	-178.6	158.7	-94.8	40.9	-5.5	0	0	118.8
1648	I	33.6	Very low	32.4	Very low	130 Å²	130	131.9 Å²	131.9	67%	0.667	71%	0.711	S	S	*	*				-160.5	134.9	-80.2	-104.5	168.8	0	0	0	111.4
1649	R	28.9	Very low	32.2	Very low	206 Å²	206	135 Å²	135	78%	0.777	72%	0.718	S	S	*	*			trans	58.5	139.5	153.2	-74.5	178.5	177.4	-138.9	0.5	124.8
1650	H	30.9	Very low	32	Very low	159 Å²	159	136.9 Å²	136.9	74%	0.736	74%	0.736	S	S	*	*			trans	88.4	168.5	140.2	-66.9	-22.6	0	0	0	121.7
1651	S	29.1	Very low	31.8	Very low	114 Å²	114	144.8 Å²	144.8	80%	0.797	76%	0.756	S	S	*	*			trans	-139.3	-159.5	-152.9	-51.2	0	0	0	0	112.7
1652	P	41	Very low	31.7	Very low	132 Å²	132	147 Å²	147	86%	0.857	78%	0.778	S	S	*	*				-120.8	174.2	-89.2	39.8	-24.9	0	0	0	115
1653	G	30.4	Very low	32.1	Very low	72 Å²	72	148.4 Å²	148.4	74%	0.742	79%	0.786	S	S	*	*			trans	166.3	125.7	159.4	0	0	0	0	0	120.6
1654	K	33.3	Very low	31.3	Very low	197 Å²	197	147.5 Å²	147.5	86%	0.857	78%	0.783	S	S	*	*			trans	66	131.5	150.6	-64.4	-163.4	173	-168.7	0	123.1
1655	F	27.9	Very low	31.3	Very low	179 Å²	179	148.2 Å²	148.2	79%	0.785	78%	0.779	S	S	*	*				23.3	147.6	123.4	-62	-82	0	0	0	120.3
1656	D	29.5	Very low	31.6	Very low	141 Å²	141	146.3 Å²	146.3	75%	0.754	77%	0.774	S	S	*	*			cis	-140.1	-176.1	22.2	-110.6	-44.4	0	0	0	114.4
1657	E	30.4	Very low	31.7	Very low	193 Å²	193	144.7 Å²	144.7	90%	0.902	76%	0.764	S	S	*	*			trans	-62.6	160.9	-175.3	-58.7	-179.5	122	0	0	115.9
1658	G	28.8	Very low	31.8	Very low	77 Å²	77	145.2 Å²	145.2	79%	0.794	77%	0.767	S	S	*	*			trans	176.5	50.8	179.3	0	0	0	0	0	116.6	S1660	G1658-S1660 PolarHBondContact O-N 3.43Å
1659	L	33	Very low	31.8	Very low	173 Å²	173	143.5 Å²	143.5	91%	0.906	77%	0.766	S	S	*	*			trans	-74.6	119.3	173.2	-109.2	170.5	0	0	0	111.4
1660	S	28.1	Very low	32	Very low	110 Å²	110	138.8 Å²	138.8	77%	0.769	77%	0.765	S	S	*	*			trans	-161.5	103.4	164	-78.3	0	0	0	0	108.9	G1658	G1658-S1660 PolarHBondContact O-N 3.43Å
1661	R	27.7	Very low	32.1	Very low	234 Å²	234	139.5 Å²	139.5	88%	0.883	77%	0.768	S	S	*	*				72.8	118.7	66.2	-165.8	-176.4	-157.6	-160.3	7.1	112
1662	S	29	Very low	32.3	Very low	102 Å²	102	140 Å²	140	71%	0.713	76%	0.762	S	S	*	*				163.4	124.8	124	64.2	0	0	0	0	116.6
1663	V	31.7	Very low	31.7	Very low	118 Å²	118	140.3 Å²	140.3	72%	0.715	76%	0.756	S	S	*	*				71.9	129.6	123.1	174.5	0	0	0	0	122
1664	N	37.7	Very low	31.9	Very low	131 Å²	131	143.6 Å²	143.6	70%	0.701	76%	0.762	S	S	*	*				-162.8	138.8	122.5	-85.8	-70.5	0	0	0	106.2
1665	K	37	Very low	31.9	Very low	163 Å²	163	137 Å²	137	71%	0.709	75%	0.75	S	S	*	*			cis	-165	144.7	4.9	-102.5	159.9	179.6	142.2	0	105.4
1666	N	32.8	Very low	32.3	Very low	124 Å²	124	136 Å²	136	66%	0.663	75%	0.753	S	S	*	*			cis	-174.7	174.3	48.4	-105.6	11.1	0	0	0	105.1
1667	E	33.1	Very low	32.6	Very low	133 Å²	133	135.4 Å²	135.4	62%	0.621	75%	0.75	S	S	*	*			cis	-162.2	140	-1.6	-122.1	174.4	114.7	0	0	110.1
1668	Q	33.3	Very low	32.9	Very low	162 Å²	162	131.7 Å²	131.7	76%	0.757	74%	0.736	S	S	*	*			trans	62.4	161.9	155.4	-52.9	-179.6	47.3	0	0	118.5
1669	S	33.3	Very low	33.3	Very low	93 Å²	93	133.5 Å²	133.5	65%	0.65	73%	0.727	S	S	*	*			cis	-170.8	150.4	-36.4	-87.8	0	0	0	0	109.9
1670	S	33.5	Very low	33.4	Very low	107 Å²	107	129.5 Å²	129.5	75%	0.748	71%	0.706	S	S	*	*			trans	67.3	130.5	169.1	18.3	0	0	0	0	116.9
1671	Q	34	Very low	33.9	Very low	174 Å²	174	133.9 Å²	133.9	81%	0.813	71%	0.707	S	S	*	*				67.6	133.6	71.9	-75.4	-172.5	-23	0	0	113.6
1672	L	32	Very low	34.4	Very low	126 Å²	126	128 Å²	128	66%	0.66	69%	0.693	S	S	*	*			cis	-157.7	179.3	18.9	-114.7	156.2	0	0	0	112.2
1673	D	30.1	Very low	34.7	Very low	137 Å²	137	131.5 Å²	131.5	73%	0.733	70%	0.698	S	S	*	*			trans	-33.5	153.6	172	-38.4	-32.4	0	0	0	116.2
1674	T	34.6	Very low	34.9	Very low	141 Å²	141	129 Å²	129	87%	0.865	70%	0.696	S	S	*	*			cis	-153.1	167.2	45.9	53.9	0	0	0	0	111.6
1675	G	32.8	Very low	35	Very low	59 Å²	59	130 Å²	130	61%	0.608	70%	0.701	S	S	*	*			cis	139.4	121.3	3.7	0	0	0	0	0	111.9
1676	D	36.3	Very low	35	Very low	157 Å²	157	132.8 Å²	132.8	84%	0.84	73%	0.733	S	S	*	*			trans	58.4	145	154.1	-39.1	-21.6	0	0	0	119.7
1677	D	36.5	Very low	35.1	Very low	129 Å²	129	133.3 Å²	133.3	69%	0.69	74%	0.736	S	S	*	*			cis	-166.6	151.3	-2.2	-127.3	-4.4	0	0	0	114.8
1678	N	36.2	Very low	35.2	Very low	116 Å²	116	133.3 Å²	133.3	62%	0.62	74%	0.742	S	S	*	*			trans	55	131.4	144.2	-66	-41.6	0	0	0	128
1679	N	35.7	Very low	35.3	Very low	114 Å²	114	131.7 Å²	131.7	61%	0.61	74%	0.741	S	S	*	*			trans	60.6	154.2	141	-56.8	-14.7	0	0	0	120.9
1680	I	35.4	Very low	35.4	Very low	89 Å²	89	133.9 Å²	133.9	46%	0.456	75%	0.747	S	S	.	*			cis	-147.2	134.7	34.7	-73.3	174.3	0	0	0	107.7
1681	Y	39	Very low	35.5	Very low	202 Å²	202	135.6 Å²	135.6	79%	0.792	75%	0.747	S	S	*	*				53.3	147.8	94.3	-92.7	-64.7	0	0	0	115.6
1682	D	37.9	Very low	35.6	Very low	112 Å²	112	133.1 Å²	133.1	60%	0.599	74%	0.742	S	S	*	*			cis	-162.9	168.3	3	-161.5	8.5	0	0	0	112.3
1683	Q	36.8	Very low	35.9	Very low	175 Å²	175	133.6 Å²	133.6	82%	0.818	75%	0.748	S	S	*	*			trans	54.9	152.4	161.6	-72.3	160	49.7	0	0	119.9
1684	G	35.4	Very low	36.3	Very low	64 Å²	64	133.3 Å²	133.3	66%	0.66	75%	0.749	S	S	*	*			cis	-163.6	176.3	-4.2	0	0	0	0	0	107.9
1685	D	38.9	Very low	36.5	Very low	152 Å²	152	132.7 Å²	132.7	81%	0.813	74%	0.739	S	S	*	*			cis	-143.4	173.8	12	-71.5	-42.1	0	0	0	111.3
1686	T	37.1	Very low	36.8	Very low	223 Å²	223	139.4 Å²	139.4	100%	1.368	75%	0.751	S	S	*	*			trans	75.6	0	-178.3	60.9	0	0	0	0	117.9

Retrieved 1,686 of 1,686 residues in 2378.3 ms (Link to these results)

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