A0A5K4FB45_SCHMA Loading...

Protein-tyrosine-phosphatase

AlphaFold DB , UniProt , Accession A0A5K4FB45, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,383 aa.

						>A0A5K4FB45_SCHMA|A0A5K4FB45
MKQSSKRNSQISSQCFQSIMFFSLSVIGIQCASPQSPAKIIHPPLDTKAIAGESVLFFCQAEGNPLPRVVFRWNNNEITQNRPGLQFKELSADSVALRAKLEPNHNGDTVTCFAQNHVGSDSATAQISVYNANETPPRGFPKVHQDPSATISQVGDSTHLQCDVSAEPQATVYWIKDQFELIDTSLPRFRIVGSGSLVIETLLETDSGAYECMARNEIGTVLSNSGHLHVRRIQFPPTINEMPDKVEVSSGKGTNLTCRAGGFPIPMVWWSTLGTPAGPRPSGPIMLSERALTEPQPHEATLRLTDITESSGYNCIAKNGLGLVRRNVSVIVKQLPAPPSSLDARPIGSTYAVLRWPPSISSGVDSYTVSLQIDDGGLGELSRRQITNIDPSEMKSENSFSLLDTKYSNENPMILYNLTGLSPFTLYSAQVHAVSRVAGLSLPSDLVKFRTAELAPGTPPQVLQAIVDSPDSVVVTWKSPVESNGRITGYKLYYTTRPEDSLNSWLIARTTQEKYHLTKLIPNATYYIKVNAFNAAGDGPVSEQLPIVVTPGVPTAPTNLRGISLKPTNIHLTWTPPEDMSSDRKLLGYKLKFRPATTSSSAVDQISDVKSPLSSASDEEEIKKQKQKSFITETRDIDATATQYLLTDLEPSTRYYLSLAGKSIHGYGVAAQIEVQTNDYPFDLPSPKNVQLRTLTNVSAKICWDQPNLPELMYSTISYEILFGLSNESISPLNATGIIPLPQSICCCFTMMHLRPGTDYRIWLRLVSHKTLPTTIINNHDDNNNGFMNKNVASWPSIDSKNKITGPVSELQAFRTLISVPMKPRKLHLVDIHKRTRLTSVLSGTEQAGVHGQVDLPYLCVELAWDPPEGLHTTKQISYQVFVRLIGPQELIEELTDTTLSSSELYGSSLEREGGHPLLQRRLLANVTGNTFRSSESDRIGYGLTYLFEVALMNTSSVGLTAQLEVTTPDAPPSSSPLHVRLSGLSSSSVEVSWAPPPVQYRNGKLTGYEVRIFEVGAETQTETIIKVTVPGQRQYTARGLKEKTFYTFMVRAFTSAGPGPWSGASNIRTSIELPPPPLDIQASRINQHQIKVTWRIPTREDQSGVGSKQISIQGFRLLYSANNNPYESGQWTSFDVGPVNMAIISHLESKTSYVICIKSRGPDGRYGDCSQPVISRLASGNGESDFSVRGLFCSGDDTSVKVTWQQPKRTEKLEGFKLRIGGSKKFADDAGVIKRLEFPARSVSVTYAALHSGYTYTVSDLEPNSVYDVQLSAYYDLTLNMQSNWETTSCFTQMQRPPFVPTPIPVAVSPSRLQVLLQLSRVSEQYGKIRQYFLVVAPVHLADSSTEKISIDTTITASRGLPSSETRYVAARYLQDYFDPPPRHSRNFTLGSYNVKSNRPQRHVNSSRIPRQTMTTDDEFLYEQDSEIMFDNKALVLGQEYKSFVRACVFQEDQSTSDGPEACTSSAWSHGFGPDRHLPPWSEMMNKHLRDSEFRNKNNLDTSDNRNSNSLGFSLTRGLTGSNRDLFIIGLVAVIISLALIAVICIAFGCFIRRKRRPKLINHLTPNDSTMKQPLMRMNDCGPANGNSFPLMTSGIEVINTNFTSSVDKRGSSVVGNDSLKSGTLIAASSPGPPQSSLISSISATGRPNLITSATPSPLTGIAQLDPRHHVTQAPSPIIDMSVHHGYSLGLTNLNSPPAIQQPMNPFISHRGGTSSSHTGSHPSSLTGSGTGAAYNVMGINNNCVSENNAATMYDGLIIARNGLPGSESGPESAFDMPHLPFEIKGHSMHHPIPVNLLPDHVARLSAADNLLFSQEYESIETEQQFTWENSNLDMNKPKNRYANVIAYDHSRVVLQSIDCVPGSDYINANYIDGYRRMNAYIATQGPTPETFSDFWRMIWEQRVSIIVMMTRLEERSRVKCDQYWPSRGPESFASGLLLVKPVDTIELAYYTIRTFHLTARGIEDECREVKHFQFTGWPDHGVPEYPIPLLLFIRRVRATLTPNTNNMFQSNHNVEQAPIVVHCSAGVGRTGAFIVIDIMLERLKYEKTVDIYGCVKALRKQRNFMVQTEDQYIFIHSALLEVIDAGNTEVPARNLSAHIKKLRMLDATGGSGMELEFKKLAQFRLPHAKYTSAQQGCNKNKNRLLNILPYESTRVPLQPIRGVEGSDYINANFVDSYRDRKAYIATQAPMAKTVEDFWRMIWELNSNIVVMLTNLNERGRECCYPYWPTERSSRYQYYVVDPMVEYNMPNYTLREFKLTDARDGQARTLRQFQFTDWPEHGVPESCEAFIDFLGQVHKTKEQFGQDGPITIHCSAGVGRTGVFLALSIVLERMRHEGIVDMFQTIRMLRTQRPGMVQTEDQYQFCYNAVLEYLSSFDHYSV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.2	Very low	27	Very low	251 Å²	251	140.7 Å²	140.7	100%	1.236	71%	0.707	S	S	*	*				0	164.2	0	-76	178.5	168.3	0	0	110
2	K	23.5	Very low	26.7	Very low	171 Å²	171	136.8 Å²	136.8	74%	0.743	70%	0.703	S	S	*	*			trans	-116.8	152.7	178.1	-74.4	-179.2	176.8	174.6	0	111.1
3	Q	24.9	Very low	26.4	Very low	175 Å²	175	132.8 Å²	132.8	82%	0.818	69%	0.694	S	S	*	*			trans	56.7	110.1	162.4	-64.3	173.7	-61.1	0	0	117.7
4	S	29	Very low	26.4	Very low	115 Å²	115	134.1 Å²	134.1	80%	0.804	70%	0.695	S	S	*	*				162.2	135.5	89.1	54.7	0	0	0	0	115.9
5	S	28	Very low	26.6	Very low	93 Å²	93	131.9 Å²	131.9	65%	0.65	69%	0.694	S	S	*	*			trans	58.5	102.6	132.6	-178.7	0	0	0	0	122.3
6	K	28.5	Very low	26.6	Very low	158 Å²	158	136.1 Å²	136.1	69%	0.687	71%	0.705	S	S	*	*				79.1	141.3	127.3	-66.9	179.2	173.5	-179.3	0	121.4	L910	K6-L910 HydrophobicContact CB-CD2 4.05Å; K6-L910 HydrophobicContact CD-CD1 4Å; K6-L910 HydrophobicContact CG-CD1 4.11Å; K6-L910 HydrophobicContact CG-CD2 4.09Å
7	R	28.8	Very low	26.6	Very low	151 Å²	151	138.3 Å²	138.3	57%	0.57	71%	0.711	S	S	*	*			trans	90.8	101.9	146.4	-81.9	-174.7	164.2	148.2	1.4	121.2	S908 S909 L910	R7-S908 PolarHBondContact NH2-O 3.42Å; R7-S909 PolarHBondContact NE-O 3.14Å; R7-S909 PolarHBondContact NH2-O 2.87Å; R7-L910 HydrophobicContact CB-CD2 4.36Å; R7-L910 HydrophobicContact CG-CD1 4.32Å; R7-L910 HydrophobicContact CG-CD2 3.65Å; R7-L910 HydrophobicContact CG-CG 3.57Å
8	N	26.4	Very low	26.6	Very low	39 Å²	39	136.5 Å²	136.5	21%	0.209	71%	0.713	C	S	.	*				77.4	142.5	124.8	-70.5	-36.4	0	0	0	121	S909 L910 E911	N8-S909 PolarHBondContact ND2-O 2.86Å; N8-S909 VanDerWaalsContact ND2-O 3.09Å; N8-L910 VanDerWaalsContact OD1-CA 3.27Å; N8-L910 WeakPolarHBondContact OD1-CA 3.46Å; N8-L910 PolarHBondContact OD1-N 2.95Å; N8-E911 PolarHBondContact N-O 3.11Å; N8-E911 VanDerWaalsContact N-O 3.16Å; N8-E911 PolarHBondContact OD1-N 3.2Å
9	S	27.3	Very low	26.5	Very low	57 Å²	57	137.5 Å²	137.5	40%	0.399	72%	0.717	S	S	.	*			trans	85.6	140.1	140.6	73.2	0	0	0	0	120.9	E911 R912	S9-E911 VanDerWaalsContact CA-OE2 3.23Å; S9-E911 WeakPolarHBondContact CA-OE2 3.37Å; S9-E911 PolarHBondContact N-OE2 2.79Å; S9-R912 PolarHBondContact O-NH2 2.87Å
10	Q	28.6	Very low	26.5	Very low	166 Å²	166	134 Å²	134	78%	0.776	70%	0.698	S	S	*	*			trans	58.4	73.7	138.4	-67.6	176.7	-0.7	0	0	120.1	S12	Q10-S12 PolarHBondContact O-N 3.3Å
11	I	24.4	Very low	26.5	Very low	172 Å²	172	131.9 Å²	131.9	88%	0.882	68%	0.684	S	S	*	*				40.9	66.2	119.5	-42.8	170.3	0	0	0	117.3
12	S	23.3	Very low	26.5	Very low	94 Å²	94	125.3 Å²	125.3	66%	0.657	65%	0.648	S	S	*	*			trans	-169.8	145.9	143.5	55.4	0	0	0	0	112.5	Q10	Q10-S12 PolarHBondContact O-N 3.3Å
13	S	23.3	Very low	26.8	Very low	84 Å²	84	121.4 Å²	121.4	59%	0.587	64%	0.642	S	S	*	*			trans	41.3	82	153.4	61.1	0	0	0	0	119.3
14	Q	26.9	Very low	27.1	Very low	151 Å²	151	120.8 Å²	120.8	71%	0.706	64%	0.644	S	S	*	*			trans	-153.6	137.3	158.2	-68.7	-177	-49.8	0	0	108.2
15	C	28.5	Very low	27.1	Very low	101 Å²	101	119.9 Å²	119.9	68%	0.682	64%	0.638	S	S	*	*			cis	-134.7	151.9	-34.4	-65.2	0	0	0	0	104.7
16	F	27.1	Very low	27.2	Very low	199 Å²	199	121.4 Å²	121.4	87%	0.873	64%	0.643	S	S	*	*			cis	67.5	46	27.7	-99.4	-81.8	0	0	0	115.9
17	Q	26.8	Very low	27.4	Very low	174 Å²	174	119.7 Å²	119.7	81%	0.813	64%	0.64	S	S	*	*			trans	-159.7	123.4	156.3	-100.2	164	-5.6	0	0	105.8
18	S	25.9	Very low	27.4	Very low	106 Å²	106	115.2 Å²	115.2	74%	0.741	64%	0.64	S	S	*	*			cis	-134.4	126.7	-0.8	-64	0	0	0	0	111
19	I	25.9	Very low	27.6	Very low	155 Å²	155	117.5 Å²	117.5	80%	0.795	65%	0.652	S	S	*	*			trans	-115.3	106	166.3	-65	175.6	0	0	0	107.8
20	M	25	Very low	27.7	Very low	68 Å²	68	123.7 Å²	123.7	34%	0.335	68%	0.675	S	S	.	*			trans	-155.4	148.9	157.8	-68.5	-152.7	-147.1	0	0	109.4	D183 L186	M20-D183 HydrophobicContact CE-CB 3.89Å; M20-D183 WeakPolarHBondContact CE-OD2 3.44Å; M20-L186 HydrophobicContact CB-CD1 4.33Å; M20-L186 HydrophobicContact CB-CD2 3.89Å; M20-L186 HydrophobicContact CE-CD1 3.99Å; M20-L186 HydrophobicContact CE-CD2 3.85Å; M20-L186 HydrophobicContact CE-CG 3.65Å; M20-L186 HydrophobicContact CG-CD1 4.29Å; M20-L186 HydrophobicContact CG-CD2 3.88Å; M20-L186 HydrophobicContact CG-CG 4.41Å; M20-L186 HydrophobicContact SD-CD1 3.22Å; M20-L186 WeakPolarHBondContact SD-CD1 3Å; M20-L186 HydrophobicContact SD-CD2 3.69Å; M20-L186 HydrophobicContact SD-CG 3.55Å; M20-L186 VanDerWaalsContact SD-CG 3.55Å
21	F	26.4	Very low	27.7	Very low	90 Å²	90	121.4 Å²	121.4	40%	0.395	68%	0.676	S	S	.	*			cis	-152.5	148.5	-4	-124.2	-159.5	0	0	0	108.7
22	F	28.1	Very low	28.4	Very low	112 Å²	112	118.3 Å²	118.3	49%	0.491	68%	0.675	S	S	.	*			trans	51.3	135.9	164.2	-61.7	-59.2	0	0	0	121.3
23	S	29.1	Very low	29.2	Very low	89 Å²	89	117.4 Å²	117.4	62%	0.622	67%	0.669	S	S	*	*			cis	-161.2	142.4	-3.3	48.1	0	0	0	0	112.5
24	L	31.2	Very low	30.6	Very low	163 Å²	163	119 Å²	119	85%	0.853	68%	0.677	S	S	*	*			trans	22.8	140.8	142.1	-61.1	166	0	0	0	120.1
25	S	30.8	Very low	33	Very low	96 Å²	96	118.1 Å²	118.1	67%	0.671	67%	0.673	S	S	*	*			cis	-178.9	179.5	-3.2	53.6	0	0	0	0	108
26	V	29.1	Very low	35.4	Very low	124 Å²	124	115.6 Å²	115.6	75%	0.752	66%	0.657	S	S	*	*			cis	-146.8	159.8	6.7	-153.3	0	0	0	0	108.9
27	I	32	Very low	38.1	Very low	123 Å²	123	109.5 Å²	109.5	63%	0.631	64%	0.637	S	S	*	*			trans	145.5	110	141.8	-75	161.2	0	0	0	109.3	R981	I27-R981 PolarHBondContact O-NH2 2.69Å
28	G	29.3	Very low	41	Very low	56 Å²	56	101.6 Å²	101.6	58%	0.577	60%	0.601	S	S	*	*			trans	-87.5	179	-168.2	0	0	0	0	0	116.3	R981	G28-R981 PolarHBondContact O-NE 2.86Å; G28-R981 PolarHBondContact O-NH2 2.78Å
29	I	30.7	Very low	43.9	Very low	88 Å²	88	101.5 Å²	101.5	45%	0.451	59%	0.588	S	S	.	*			trans	-135.3	128.8	160.9	-67.7	150.5	0	0	0	103.9	H979	I29-H979 HydrophobicContact CD1-CB 4.06Å; I29-H979 WeakPolarHBondContact CD1-CD2 3.42Å; I29-H979 HydrophobicContact CG1-CB 4.06Å
30	Q	29.5	Very low	46.9	Very low	187 Å²	187	95 Å²	95	87%	0.874	55%	0.554	S	S	*	*			trans	-110.5	97.1	-160.4	-168.4	170.4	4.3	0	0	112.1
31	C	29.5	Very low	49.6	Very low	118 Å²	118	95.2 Å²	95.2	80%	0.797	56%	0.556	S	S	*	*			trans	-77.2	133.2	163.4	-65.9	0	0	0	0	109.3	S33	C31-S33 PolarHBondContact O-N 3.31Å
32	A	38.5	Very low	52.2	Low	106 Å²	106	95.4 Å²	95.4	88%	0.876	56%	0.558	S	S	*	*			trans	-74.2	106.4	179.9	0	0	0	0	0	110.9
33	S	38.7	Very low	54.9	Low	76 Å²	76	92.6 Å²	92.6	53%	0.531	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-76.3	142.9	173.5	46.6	0	0	0	0	111.3	C31 N64	C31-S33 PolarHBondContact O-N 3.31Å; S33-N64 WeakPolarHBondContact CB-ND2 3.5Å; S33-N64 PolarHBondContact O-ND2 2.81Å; S33-N64 PolarHBondContact OG-ND2 2.73Å
34	P	54.5	Low	57.6	Low	117 Å²	117	88.8 Å²	88.8	76%	0.76	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-67.1	134.7	180	27.7	-34.5	0	0	0	111.1	N64	P34-N64 PolarHBondContact O-ND2 2.78Å
35	Q	75.7	Confident	60.1	Low	133 Å²	133	85.2 Å²	85.2	62%	0.621	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-69.9	145.2	-179.1	-66.2	-176.3	22.2	0	0	111.8	N64 H117 V118	Q35-N64 CarbonylContact C-O 3.52Å; Q35-N64 WeakPolarHBondContact CA-O 3.38Å; Q35-N64 WeakPolarHBondContact CB-O 3.4Å; Q35-H117 PolarHBondContact OE1-NE2 2.99Å; Q35-V118 HydrophobicContact CB-CG2 4.06Å
36	S	79.4	Confident	62.8	Low	47 Å²	47	85.6 Å²	85.6	33%	0.329	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	145.9	179.1	58	0	0	0	0	111.3	N64 N116	S36-N64 PolarHBondContact N-O 3.35Å; S36-N64 PolarHBondContact O-N 2.88Å; S36-N64 VanDerWaalsContact O-N 3.08Å; S36-N64 PolarHBondContact OG-N 2.75Å; S36-N116 PolarHBondContact O-ND2 2.78Å
37	P	84.7	Confident	65.3	Low	72 Å²	72	79.8 Å²	79.8	47%	0.468	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	158.2	178.3	29.2	-36.2	0	0	0	112.1	V118	P37-V118 HydrophobicContact CB-CG1 4.27Å
38	A	86.5	Confident	68	Low	7 Å²	7	77.6 Å²	77.6	6%	0.058	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	135.5	166.8	0	0	0	0	0	110.5	E62 P67 A114 N116 G119	A38-E62 CarbonylContact C-O 3.6Å; A38-E62 WeakPolarHBondContact CA-O 3.34Å; A38-P67 HydrophobicContact CB-CB 3.54Å; A38-P67 HydrophobicContact CB-CG 4.23Å; A38-A114 HydrophobicContact CB-CB 4.22Å; A38-N116 PolarHBondContact N-ND2 3.2Å; A38-N116 PolarHBondContact N-OD1 2.73Å; A38-G119 WeakPolarHBondContact CB-O 3.4Å
39	K	88.3	Confident	70.6	Confident	104 Å²	104	75 Å²	75	45%	0.452	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	124	177.8	171	-175.3	161.6	-135.7	0	109.5	I41 A61 E62 D121	K39-I41 PolarHBondContact O-N 3.4Å; K39-A61 CarbonylContact O-C 3.46Å; K39-A61 WeakPolarHBondContact O-CA 3.46Å; K39-A61 WeakPolarHBondContact O-CB 3.4Å; K39-E62 HydrophobicContact CB-CG 4.13Å; K39-E62 HydrophobicContact CD-CG 4.44Å; K39-E62 WeakPolarHBondContact CD-OE1 3.42Å; K39-E62 WeakPolarHBondContact CE-OE1 3.24Å; K39-E62 HydrophobicContact CG-CG 4.49Å; K39-E62 PolarHBondContact N-O 3.01Å; K39-E62 IonicContact NZ-OE1 3.43Å; K39-E62 PolarHBondContact NZ-OE1 3.3Å; K39-E62 PolarHBondContact O-N 2.9Å; K39-D121 WeakPolarHBondContact CA-OD2 3.45Å
40	I	87.7	Confident	73.2	Confident	19 Å²	19	72.3 Å²	72.3	10%	0.097	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	121	178.2	-65.3	170.5	0	0	0	108.8	H42 P43 Q60 A61 C112 A114 D121 A123	I40-H42 WeakPolarHBondContact CG2-O 3.43Å; I40-P43 HydrophobicContact CG2-CB 3.91Å; I40-Q60 CarbonylContact C-O 3.48Å; I40-Q60 WeakPolarHBondContact CA-O 3.41Å; I40-A61 HydrophobicContact CG1-CB 4.06Å; I40-C112 HydrophobicContact CD1-CB 4.23Å; I40-A114 HydrophobicContact CD1-CB 4.48Å; I40-A114 HydrophobicContact CG1-CB 3.96Å; I40-D121 HydrophobicContact CD1-CB 4.5Å; I40-D121 HydrophobicContact CG1-CB 4.28Å; I40-D121 PolarHBondContact N-OD2 2.95Å; I40-A123 HydrophobicContact CD1-CB 4.13Å
41	I	82.8	Confident	75.7	Confident	73 Å²	73	64.2 Å²	64.2	37%	0.374	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-47.3	173.6	-59.9	171.1	0	0	0	109.3	K39 Q60 E62	K39-I41 PolarHBondContact O-N 3.4Å; I41-Q60 PolarHBondContact N-O 3.06Å; I41-E62 HydrophobicContact CD1-CB 3.79Å; I41-E62 HydrophobicContact CD1-CG 3.9Å; I41-E62 HydrophobicContact CG1-CB 4.27Å; I41-E62 HydrophobicContact CG1-CG 3.89Å
42	H	80.9	Confident	78.1	Confident	93 Å²	93	60 Å²	60	43%	0.431	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	102.2	-178.1	-64.6	120.4	0	0	0	108.5	I40 F58 C59 Q60	I40-H42 WeakPolarHBondContact CG2-O 3.43Å; H42-F58 HydrophobicContact CB-CD1 3.86Å; H42-F58 HydrophobicContact CB-CE1 3.77Å; H42-C59 VanDerWaalsContact O-CA 3.26Å; H42-C59 WeakPolarHBondContact O-CA 3.3Å; H42-Q60 HydrophobicContact CB-CB 4.16Å; H42-Q60 PolarHBondContact CE1-OE1 3.12Å; H42-Q60 PolarHBondContact N-O 3.11Å; H42-Q60 PolarHBondContact ND1-OE1 3.4Å; H42-Q60 PolarHBondContact O-N 2.96Å; H42-Q60 VanDerWaalsContact O-N 3.11Å
43	P	84.8	Confident	80.2	Confident	54 Å²	54	58.2 Å²	58.2	35%	0.351	33%	0.325	S	S	.	.			trans	-83.5	158.3	177.9	33.3	-35	0	0	0	112.2	I40 L45 A123	I40-P43 HydrophobicContact CG2-CB 3.91Å; P43-L45 HydrophobicContact CG-CD2 4.47Å; P43-A123 HydrophobicContact CB-CB 3.48Å; P43-A123 VanDerWaalsContact CB-CB 3.48Å
44	P	85.7	Confident	82.4	Confident	8 Å²	8	56 Å²	56	5%	0.052	31%	0.309	C	S	.	.			trans	-63.1	144.8	163.7	29.5	-34.9	0	0	0	110.2	F57 F71 C112 A123 A125	P44-F57 HydrophobicContact CB-CB 4.4Å; P44-F57 HydrophobicContact CB-CD1 4.04Å; P44-F71 HydrophobicContact CB-CE1 4.08Å; P44-F71 HydrophobicContact CG-CE1 4.17Å; P44-C112 HydrophobicContact CG-CB 3.87Å; P44-A123 WeakPolarHBondContact CG-O 3.02Å; P44-A125 HydrophobicContact CB-CB 3.97Å; P44-A125 HydrophobicContact CG-CB 4.45Å
45	L	83.6	Confident	83.9	Confident	88 Å²	88	50.5 Å²	50.5	46%	0.461	27%	0.274	S	S	.	.			trans	-116.8	145.8	-175.1	-62	174.1	0	0	0	111.7	P43 T47 A125 R215	P43-L45 HydrophobicContact CG-CD2 4.47Å; L45-T47 PolarHBondContact O-N 2.87Å; L45-T47 PolarHBondContact O-OG1 2.86Å; L45-A125 WeakPolarHBondContact O-CB 3.48Å; L45-R215 VanDerWaalsContact CB-NH2 3.32Å; L45-R215 PolarHBondContact O-NH2 3.16Å
46	D	86.2	Confident	84.5	Confident	105 Å²	105	44.4 Å²	44.4	56%	0.561	25%	0.245	S	C	*	.			trans	-52.6	116.3	179	-73.3	-12.9	0	0	0	112.3	A125 Q126 R215	D46-A125 WeakPolarHBondContact OD1-CA 3.39Å; D46-Q126 WeakPolarHBondContact CA-O 3.41Å; D46-Q126 PolarHBondContact OD1-N 2.82Å; D46-R215 PolarHBondContact O-NH2 2.98Å
47	T	83.2	Confident	84.9	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.012	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	122.3	-166.2	-60.9	0	0	0	0	111.2	L45 V55 F57 Q126 I127 S128 R215	L45-T47 PolarHBondContact O-N 2.87Å; L45-T47 PolarHBondContact O-OG1 2.86Å; T47-V55 HydrophobicContact CG2-CB 3.97Å; T47-V55 HydrophobicContact CG2-CG1 3.66Å; T47-V55 HydrophobicContact CG2-CG2 4.24Å; T47-F57 WeakPolarHBondContact OG1-CE1 3.4Å; T47-Q126 PolarHBondContact N-O 2.77Å; T47-I127 WeakPolarHBondContact O-CA 3.41Å; T47-S128 PolarHBondContact O-N 2.85Å; T47-R215 PolarHBondContact OG1-NH1 3.01Å; T47-R215 PolarHBondContact OG1-NH2 3.21Å
48	K	87.1	Confident	84.9	Confident	77 Å²	77	41 Å²	41	34%	0.335	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	126.6	173.2	-52	176.7	-177.1	168.2	0	108.2	S128 Y130 E217 I218 G219 T220	K48-S128 WeakPolarHBondContact CA-O 3.43Å; K48-Y130 HydrophobicContact CB-CE2 3.92Å; K48-E217 WeakPolarHBondContact CE-O 3.35Å; K48-E217 PolarHBondContact NZ-O 3.34Å; K48-I218 WeakPolarHBondContact CB-O 3.35Å; K48-I218 WeakPolarHBondContact CD-O 3.34Å; K48-G219 CarbonylContact O-C 2.94Å; K48-G219 WeakPolarHBondContact O-CA 3.24Å; K48-T220 PolarHBondContact O-N 2.81Å
49	A	84.9	Confident	84.9	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	173.1	-179	0	0	0	0	0	111.6	V55 L101 S128 V129 Y130	A49-V55 HydrophobicContact CB-CG1 3.77Å; A49-L101 HydrophobicContact CB-CD1 3.74Å; A49-S128 PolarHBondContact N-O 2.81Å; A49-V129 CarbonylContact O-C 3.31Å; A49-V129 WeakPolarHBondContact O-CA 3.36Å; A49-Y130 PolarHBondContact O-N 2.83Å
50	I	84.5	Confident	84.8	Confident	33 Å²	33	37.9 Å²	37.9	17%	0.169	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	144.1	173.1	-60.7	162.3	0	0	0	109	G52 E53 A132 P136 F140	I50-G52 PolarHBondContact O-N 3.38Å; I50-E53 HydrophobicContact CB-CG 4.01Å; I50-E53 VanDerWaalsContact O-CB 3.28Å; I50-E53 WeakPolarHBondContact O-CB 3.48Å; I50-E53 PolarHBondContact O-N 2.88Å; I50-A132 HydrophobicContact CG2-CB 3.97Å; I50-P136 HydrophobicContact CD1-CB 4.24Å; I50-P136 HydrophobicContact CD1-CG 3.65Å; I50-F140 HydrophobicContact CD1-CD1 4.22Å; I50-F140 HydrophobicContact CD1-CE1 3.71Å; I50-F140 HydrophobicContact CD1-CZ 3.9Å; I50-F140 HydrophobicContact CG1-CE1 4.1Å; I50-F140 HydrophobicContact CG1-CE2 4.13Å; I50-F140 HydrophobicContact CG1-CZ 3.74Å
51	A	83.5	Confident	84.6	Confident	17 Å²	17	37 Å²	37	14%	0.14	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	126.5	176.7	0	0	0	0	0	111.7	P103 V129 Y130 A132	A51-P103 HydrophobicContact CB-CG 3.78Å; A51-V129 HydrophobicContact CB-CG1 3.75Å; A51-Y130 WeakPolarHBondContact CB-O 3.5Å; A51-Y130 PolarHBondContact N-O 2.89Å; A51-A132 HydrophobicContact CB-CB 4.36Å
52	G	79.7	Confident	84.8	Confident	29 Å²	29	36.5 Å²	36.5	30%	0.299	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.2	-15.7	-173.9	0	0	0	0	0	114.1	I50 K100 L101	I50-G52 PolarHBondContact O-N 3.38Å; G52-K100 WeakPolarHBondContact O-CE 3.42Å; G52-L101 PolarHBondContact N-O 2.91Å
53	E	82.3	Confident	84.9	Confident	68 Å²	68	32.7 Å²	32.7	32%	0.318	18%	0.181	S	C	.	.			trans	-73.2	155	176.1	-70.4	-56.8	147.5	0	0	112.7	I50 K100 L101	I50-E53 HydrophobicContact CB-CG 4.01Å; I50-E53 VanDerWaalsContact O-CB 3.28Å; I50-E53 WeakPolarHBondContact O-CB 3.48Å; I50-E53 PolarHBondContact O-N 2.88Å; E53-K100 WeakPolarHBondContact O-CA 3.32Å; E53-L101 PolarHBondContact O-N 2.86Å
54	S	85.1	Confident	84.6	Confident	30 Å²	30	32.1 Å²	32.1	21%	0.21	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	150	167	-64.8	0	0	0	0	110.6	A99 L222	S54-A99 CarbonylContact C-O 3.5Å; S54-A99 WeakPolarHBondContact CA-O 3.5Å; S54-L222 WeakPolarHBondContact O-CD1 3.27Å
55	V	85.7	Confident	84.4	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.006	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	150.7	170.1	-58.6	0	0	0	0	110.1	T47 A49 F57 R98 A99 L101	T47-V55 HydrophobicContact CG2-CB 3.97Å; T47-V55 HydrophobicContact CG2-CG1 3.66Å; T47-V55 HydrophobicContact CG2-CG2 4.24Å; A49-V55 HydrophobicContact CB-CG1 3.77Å; V55-F57 HydrophobicContact CG2-CD2 4.17Å; V55-F57 HydrophobicContact CG2-CE2 3.46Å; V55-F57 VanDerWaalsContact CG2-CE2 3.46Å; V55-F57 HydrophobicContact CG2-CZ 3.91Å; V55-R98 WeakPolarHBondContact O-CA 3.44Å; V55-A99 HydrophobicContact CG2-CB 4.16Å; V55-A99 PolarHBondContact N-O 2.85Å; V55-A99 PolarHBondContact O-N 3.1Å; V55-L101 HydrophobicContact CB-CD1 4.42Å; V55-L101 HydrophobicContact CG1-CD1 3.78Å; V55-L101 HydrophobicContact CG1-CG 4.43Å; V55-L101 HydrophobicContact CG2-CD1 3.69Å; V55-L101 HydrophobicContact CG2-CD2 4.29Å; V55-L101 HydrophobicContact CG2-CG 3.91Å
56	L	87.7	Confident	84.1	Confident	5 Å²	5	35.1 Å²	35.1	3%	0.026	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	118.8	174.8	-167	72.7	0	0	0	110.3	A96 R98 I175 F179 L181 M213	L56-A96 HydrophobicContact CD1-CB 4.13Å; L56-R98 HydrophobicContact CD1-CB 3.83Å; L56-R98 HydrophobicContact CD1-CG 4.31Å; L56-I175 HydrophobicContact CB-CD1 4.18Å; L56-I175 HydrophobicContact CD2-CD1 3.59Å; L56-I175 HydrophobicContact CD2-CG1 3.74Å; L56-I175 HydrophobicContact CD2-CG2 4.17Å; L56-I175 HydrophobicContact CG-CD1 4.49Å; L56-F179 HydrophobicContact CD1-CD1 4.2Å; L56-L181 HydrophobicContact CD2-CD1 4.37Å; L56-M213 HydrophobicContact CB-SD 3.98Å
57	F	88.4	Confident	84	Confident	3 Å²	3	30.1 Å²	30.1	1%	0.013	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	118.7	165.4	-60	-85.1	0	0	0	108.4	P44 T47 V55 F71 W73 A96 L97 A99 V110 A125 I127	P44-F57 HydrophobicContact CB-CB 4.4Å; P44-F57 HydrophobicContact CB-CD1 4.04Å; T47-F57 WeakPolarHBondContact OG1-CE1 3.4Å; V55-F57 HydrophobicContact CG2-CD2 4.17Å; V55-F57 HydrophobicContact CG2-CE2 3.46Å; V55-F57 VanDerWaalsContact CG2-CE2 3.46Å; V55-F57 HydrophobicContact CG2-CZ 3.91Å; F57-F71 HydrophobicContact CB-CE1 3.96Å; F57-F71 HydrophobicContact CB-CZ 3.87Å; F57-F71 WeakPolarHBondContact O-CZ 3.43Å; F57-W73 HydrophobicContact CE2-CZ3 4.37Å; F57-A96 CarbonylContact O-C 3.46Å; F57-A96 WeakPolarHBondContact O-CA 3.34Å; F57-L97 HydrophobicContact CB-CB 4.32Å; F57-L97 HydrophobicContact CD2-CD2 4.23Å; F57-L97 PolarHBondContact N-O 2.88Å; F57-L97 PolarHBondContact O-N 2.88Å; F57-A99 HydrophobicContact CD2-CB 4.41Å; F57-A99 HydrophobicContact CE2-CB 4.09Å; F57-V110 HydrophobicContact CB-CG1 4.17Å; F57-V110 HydrophobicContact CD1-CB 4.21Å; F57-V110 HydrophobicContact CD1-CG1 4.04Å; F57-V110 HydrophobicContact CD1-CG2 4.49Å; F57-V110 HydrophobicContact CD2-CG1 4.13Å; F57-V110 HydrophobicContact CD2-CG2 4.18Å; F57-V110 HydrophobicContact CE1-CB 4.17Å; F57-V110 HydrophobicContact CE1-CG1 4.48Å; F57-V110 HydrophobicContact CE1-CG2 4.15Å; F57-V110 HydrophobicContact CE2-CG2 3.81Å; F57-V110 HydrophobicContact CG-CB 4.4Å; F57-V110 HydrophobicContact CG-CG1 3.86Å; F57-V110 HydrophobicContact CZ-CB 4.34Å; F57-V110 HydrophobicContact CZ-CG2 3.81Å; F57-A125 HydrophobicContact CD1-CB 4.4Å; F57-A125 HydrophobicContact CE1-CB 4.11Å; F57-I127 HydrophobicContact CE2-CD1 4.44Å; F57-I127 HydrophobicContact CZ-CD1 4.11Å; F57-I127 HydrophobicContact CZ-CG1 3.85Å
58	F	85.3	Confident	84.2	Confident	45 Å²	45	36.5 Å²	36.5	20%	0.197	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	147.5	172.9	-179.6	-100.6	0	0	0	109.6	H42 Q60 L90 L181	H42-F58 HydrophobicContact CB-CD1 3.86Å; H42-F58 HydrophobicContact CB-CE1 3.77Å; F58-Q60 HydrophobicContact CE1-CB 3.71Å; F58-Q60 HydrophobicContact CZ-CB 3.96Å; F58-L90 HydrophobicContact CD2-CD1 4Å; F58-L90 HydrophobicContact CE2-CD1 3.7Å; F58-L181 HydrophobicContact CB-CD1 3.73Å; F58-L181 HydrophobicContact CD1-CD1 4.45Å; F58-L181 HydrophobicContact CD2-CB 4.19Å; F58-L181 HydrophobicContact CD2-CD1 3.87Å; F58-L181 HydrophobicContact CE2-CB 4.3Å; F58-L181 HydrophobicContact CG-CD1 3.78Å
59	C	85.5	Confident	84.2	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	135	166.1	-168.3	0	0	0	0	111.6	H42 V69 F71 S94 V95 C112	H42-C59 VanDerWaalsContact O-CA 3.26Å; H42-C59 WeakPolarHBondContact O-CA 3.3Å; C59-V69 HydrophobicContact CB-CG1 4.26Å; C59-F71 HydrophobicContact CB-CE1 4.17Å; C59-F71 HydrophobicContact CB-CE2 4.19Å; C59-F71 HydrophobicContact CB-CZ 3.63Å; C59-S94 CarbonylContact O-C 3.41Å; C59-S94 VanDerWaalsContact O-CA 3.31Å; C59-S94 WeakPolarHBondContact O-CA 3.18Å; C59-V95 HydrophobicContact CB-CG2 4.14Å; C59-V95 PolarHBondContact N-O 3.01Å; C59-V95 PolarHBondContact O-N 2.84Å; C59-C112 HydrophobicContact CB-CB 3.65Å; C59-C112 WeakPolarHBondContact CB-SG 3.45Å; C59-C112 WeakPolarHBondContact SG-CB 3.45Å; C59-C112 CovalentContact SG-SG 2.02Å; C59-C112 PolarHBondContact SG-SG 3.4Å
60	Q	85.4	Confident	84.4	Confident	46 Å²	46	33.7 Å²	33.7	22%	0.215	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	138.8	173.7	-178.1	179.7	26.5	0	0	110.4	I40 I41 H42 F58 D93	I40-Q60 CarbonylContact C-O 3.48Å; I40-Q60 WeakPolarHBondContact CA-O 3.41Å; I41-Q60 PolarHBondContact N-O 3.06Å; H42-Q60 HydrophobicContact CB-CB 4.16Å; H42-Q60 PolarHBondContact CE1-OE1 3.12Å; H42-Q60 PolarHBondContact N-O 3.11Å; H42-Q60 PolarHBondContact ND1-OE1 3.4Å; H42-Q60 PolarHBondContact O-N 2.96Å; H42-Q60 VanDerWaalsContact O-N 3.11Å; F58-Q60 HydrophobicContact CE1-CB 3.71Å; F58-Q60 HydrophobicContact CZ-CB 3.96Å; Q60-D93 CarbonylContact C-O 3.51Å; Q60-D93 VanDerWaalsContact CA-O 3.27Å; Q60-D93 WeakPolarHBondContact CA-O 3.44Å; Q60-D93 PolarHBondContact NE2-OD2 2.88Å
61	A	84.9	Confident	84.6	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	130.3	179.7	0	0	0	0	0	113.1	K39 I40 P67 V69 D93 A114	K39-A61 CarbonylContact O-C 3.46Å; K39-A61 WeakPolarHBondContact O-CA 3.46Å; K39-A61 WeakPolarHBondContact O-CB 3.4Å; I40-A61 HydrophobicContact CG1-CB 4.06Å; A61-P67 HydrophobicContact CB-CG 3.77Å; A61-P67 WeakPolarHBondContact O-CD 3.31Å; A61-P67 WeakPolarHBondContact O-CG 3.47Å; A61-V69 HydrophobicContact CB-CG2 3.9Å; A61-D93 PolarHBondContact N-O 3.15Å; A61-D93 WeakPolarHBondContact O-CB 3.46Å; A61-A114 HydrophobicContact CB-CB 3.4Å; A61-A114 VanDerWaalsContact CB-CB 3.4Å
62	E	86.3	Confident	84.9	Confident	62 Å²	62	34 Å²	34	29%	0.29	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	161.5	170.7	59.2	-178.2	159.8	0	0	112.2	A38 K39 I41	A38-E62 CarbonylContact C-O 3.6Å; A38-E62 WeakPolarHBondContact CA-O 3.34Å; K39-E62 HydrophobicContact CB-CG 4.13Å; K39-E62 HydrophobicContact CD-CG 4.44Å; K39-E62 WeakPolarHBondContact CD-OE1 3.42Å; K39-E62 WeakPolarHBondContact CE-OE1 3.24Å; K39-E62 HydrophobicContact CG-CG 4.49Å; K39-E62 PolarHBondContact N-O 3.01Å; K39-E62 IonicContact NZ-OE1 3.43Å; K39-E62 PolarHBondContact NZ-OE1 3.3Å; K39-E62 PolarHBondContact O-N 2.9Å; I41-E62 HydrophobicContact CD1-CB 3.79Å; I41-E62 HydrophobicContact CD1-CG 3.9Å; I41-E62 HydrophobicContact CG1-CB 4.27Å; I41-E62 HydrophobicContact CG1-CG 3.89Å
63	G	82.3	Confident	85.3	Confident	14 Å²	14	33.8 Å²	33.8	14%	0.144	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.9	158.9	175.8	0	0	0	0	0	110.2	P65 L66	G63-P65 VanDerWaalsContact C-C 3.5Å; G63-P65 CarbonylContact C-O 3.54Å; G63-P65 CarbonylContact O-C 3.59Å; G63-P65 VanDerWaalsContact O-C 3.29Å; G63-L66 PolarHBondContact O-N 2.89Å
64	N	79.5	Confident	85.6	Confident	41 Å²	41	33.4 Å²	33.4	22%	0.219	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	106.5	172.4	-175.8	22.9	0	0	0	110.3	S33 P34 Q35 S36	S33-N64 WeakPolarHBondContact CB-ND2 3.5Å; S33-N64 PolarHBondContact O-ND2 2.81Å; S33-N64 PolarHBondContact OG-ND2 2.73Å; P34-N64 PolarHBondContact O-ND2 2.78Å; Q35-N64 CarbonylContact C-O 3.52Å; Q35-N64 WeakPolarHBondContact CA-O 3.38Å; Q35-N64 WeakPolarHBondContact CB-O 3.4Å; S36-N64 PolarHBondContact N-O 3.35Å; S36-N64 PolarHBondContact O-N 2.88Å; S36-N64 VanDerWaalsContact O-N 3.08Å; S36-N64 PolarHBondContact OG-N 2.75Å
65	P	80.8	Confident	85.4	Confident	52 Å²	52	38 Å²	38	34%	0.338	19%	0.188	S	C	.	.	S	Bend	cis	-64.3	161.3	1.9	-22.3	35.2	0	0	0	114.3	G63 N116 H117	G63-P65 VanDerWaalsContact C-C 3.5Å; G63-P65 CarbonylContact C-O 3.54Å; G63-P65 CarbonylContact O-C 3.59Å; G63-P65 VanDerWaalsContact O-C 3.29Å; P65-N116 WeakPolarHBondContact O-CB 3.29Å; P65-N116 PolarHBondContact O-ND2 2.76Å; P65-H117 WeakPolarHBondContact CD-CE1 3.42Å; P65-H117 WeakPolarHBondContact CG-CE1 3.14Å
66	L	78.9	Confident	85.3	Confident	107 Å²	107	43 Å²	43	56%	0.56	21%	0.214	S	C	*	.	P	Polyproline II helix	trans	-50.8	131.8	174.6	-70.2	152.5	0	0	0	110.4	G63 A92 D93	G63-L66 PolarHBondContact O-N 2.89Å; L66-A92 HydrophobicContact CB-CB 4.45Å; L66-A92 HydrophobicContact CD1-CB 4.25Å; L66-D93 HydrophobicContact CD2-CB 3.92Å
67	P	83.4	Confident	85.1	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.006	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-83.2	139.5	-172.9	33.8	-35.9	0	0	0	112.7	A38 A61 V69 A92 A114 Q115 N116	A38-P67 HydrophobicContact CB-CB 3.54Å; A38-P67 HydrophobicContact CB-CG 4.23Å; A61-P67 HydrophobicContact CB-CG 3.77Å; A61-P67 WeakPolarHBondContact O-CD 3.31Å; A61-P67 WeakPolarHBondContact O-CG 3.47Å; P67-V69 HydrophobicContact CG-CG2 4.38Å; P67-V69 WeakPolarHBondContact O-CG2 3.46Å; P67-V69 PolarHBondContact O-N 2.82Å; P67-V69 VanDerWaalsContact O-N 3.08Å; P67-A92 VanDerWaalsContact O-O 3.1Å; P67-A114 HydrophobicContact CB-CB 4.35Å; P67-Q115 CarbonylContact C-O 3.53Å; P67-Q115 WeakPolarHBondContact CA-O 3.39Å; P67-N116 HydrophobicContact CB-CB 4.17Å
68	R	87.2	Confident	84.8	Confident	136 Å²	136	45.1 Å²	45.1	51%	0.513	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	109.8	166.4	179.6	-175.6	-179.2	-115.2	-6.6	108.4	V70 E77 A114 Q115	R68-V70 HydrophobicContact CG-CG1 4.36Å; R68-E77 IonicContact CZ-OE1 2.71Å; R68-E77 IonicContact NH1-OE1 3.34Å; R68-E77 PolarHBondContact NH1-OE1 3.48Å; R68-E77 IonicContact NH2-OE1 3.31Å; R68-E77 PolarHBondContact NH2-OE1 3.47Å; R68-A114 WeakPolarHBondContact O-CA 3.36Å; R68-Q115 PolarHBondContact N-O 2.89Å; R68-Q115 PolarHBondContact O-N 2.61Å
69	V	87.4	Confident	84	Confident	10 Å²	10	47 Å²	47	6%	0.061	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	135.6	175.2	-161.4	0	0	0	0	109.9	C59 A61 P67 V95 C112 F113 A114	C59-V69 HydrophobicContact CB-CG1 4.26Å; A61-V69 HydrophobicContact CB-CG2 3.9Å; P67-V69 HydrophobicContact CG-CG2 4.38Å; P67-V69 WeakPolarHBondContact O-CG2 3.46Å; P67-V69 PolarHBondContact O-N 2.82Å; P67-V69 VanDerWaalsContact O-N 3.08Å; V69-V95 HydrophobicContact CB-CG1 4.19Å; V69-V95 HydrophobicContact CB-CG2 3.91Å; V69-V95 HydrophobicContact CG1-CG2 3.54Å; V69-V95 WeakPolarHBondContact O-CG1 3.35Å; V69-C112 WeakPolarHBondContact CG1-SG 3.46Å; V69-F113 WeakPolarHBondContact CA-O 3.47Å; V69-A114 HydrophobicContact CG1-CB 4.34Å; V69-A114 HydrophobicContact CG2-CB 4.17Å
70	V	88.1	Confident	83.3	Confident	8 Å²	8	51.4 Å²	51.4	5%	0.048	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	153.6	176.5	-66.7	0	0	0	0	111.2	R68 E77 F113	R68-V70 HydrophobicContact CG-CG1 4.36Å; V70-E77 HydrophobicContact CB-CG 4.1Å; V70-E77 HydrophobicContact CG1-CG 4.46Å; V70-E77 HydrophobicContact CG2-CG 4Å; V70-F113 HydrophobicContact CG2-CB 4.09Å; V70-F113 HydrophobicContact CG2-CD1 4.06Å; V70-F113 PolarHBondContact N-O 3.01Å; V70-F113 PolarHBondContact O-N 3.18Å
71	F	89.1	Confident	82.9	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	148.8	168.6	-81.1	-71.7	0	0	0	111.9	P44 F57 C59 I78 F87 V95 L97 V110 T111 C112	P44-F71 HydrophobicContact CB-CE1 4.08Å; P44-F71 HydrophobicContact CG-CE1 4.17Å; F57-F71 HydrophobicContact CB-CE1 3.96Å; F57-F71 HydrophobicContact CB-CZ 3.87Å; F57-F71 WeakPolarHBondContact O-CZ 3.43Å; C59-F71 HydrophobicContact CB-CE1 4.17Å; C59-F71 HydrophobicContact CB-CE2 4.19Å; C59-F71 HydrophobicContact CB-CZ 3.63Å; F71-I78 HydrophobicContact CB-CD1 3.91Å; F71-I78 HydrophobicContact CB-CG1 4.42Å; F71-I78 PolarHBondContact O-N 3.01Å; F71-F87 HydrophobicContact CD2-CD2 4.28Å; F71-F87 HydrophobicContact CD2-CE2 4.27Å; F71-V95 HydrophobicContact CD2-CG2 3.88Å; F71-V95 HydrophobicContact CE2-CB 4.39Å; F71-V95 HydrophobicContact CE2-CG2 3.71Å; F71-L97 HydrophobicContact CB-CB 4.43Å; F71-L97 HydrophobicContact CB-CD2 4.18Å; F71-L97 HydrophobicContact CD1-CB 4.49Å; F71-L97 HydrophobicContact CD1-CD2 4.4Å; F71-L97 HydrophobicContact CD2-CB 3.5Å; F71-L97 VanDerWaalsContact CD2-CB 3.5Å; F71-L97 HydrophobicContact CE2-CB 3.73Å; F71-L97 HydrophobicContact CG-CB 3.9Å; F71-L97 HydrophobicContact CG-CD2 4.17Å; F71-L97 HydrophobicContact CZ-CB 4.33Å; F71-V110 HydrophobicContact CD1-CG1 3.55Å; F71-V110 HydrophobicContact CE1-CG1 3.83Å; F71-T111 CarbonylContact C-O 3.59Å; F71-T111 WeakPolarHBondContact CA-O 3.21Å; F71-C112 HydrophobicContact CD1-CB 4.25Å; F71-C112 HydrophobicContact CE1-CB 3.97Å
72	R	89.8	Confident	82.7	Confident	56 Å²	56	58.9 Å²	58.9	21%	0.211	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	123.9	172.2	-62.5	-175.1	174.1	136	9.7	110.2	N76 E77 T111 F113	R72-N76 CarbonylContact C-O 3.46Å; R72-N76 WeakPolarHBondContact CA-O 3.45Å; R72-E77 HydrophobicContact CG-CB 4.22Å; R72-E77 HydrophobicContact CG-CG 4.45Å; R72-E77 IonicContact CZ-OE2 3.35Å; R72-E77 IonicContact NE-OE2 2.76Å; R72-E77 PolarHBondContact NE-OE2 3.5Å; R72-E77 IonicContact NH2-OE2 3.74Å; R72-E77 PolarHBondContact NH2-OE2 3.17Å; R72-T111 PolarHBondContact N-O 2.65Å; R72-T111 PolarHBondContact O-N 3.25Å; R72-F113 VanDerWaalsContact NH1-CG 3.25Å; R72-F113 VanDerWaalsContact NH2-CD1 3.29Å
73	W	89.3	Confident	82.2	Confident	24 Å²	24	62.4 Å²	62.4	9%	0.091	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	115.5	174.2	-163.8	-79.1	0	0	0	109.6	F57 N75 N76 I78 L85 L97 A99 L101 H105 D108 T109 V110 I127	F57-W73 HydrophobicContact CE2-CZ3 4.37Å; W73-N75 VanDerWaalsContact C-N 3.26Å; W73-N75 PolarHBondContact O-N 3.47Å; W73-N76 PolarHBondContact N-O 3.29Å; W73-N76 WeakPolarHBondContact O-CB 3.28Å; W73-N76 PolarHBondContact O-N 3.31Å; W73-N76 PolarHBondContact O-ND2 2.95Å; W73-I78 HydrophobicContact CB-CD1 3.96Å; W73-I78 HydrophobicContact CB-CG1 4.22Å; W73-I78 HydrophobicContact CE3-CD1 4.41Å; W73-L85 HydrophobicContact CD2-CD1 4.15Å; W73-L85 HydrophobicContact CD2-CD2 4.15Å; W73-L85 HydrophobicContact CE3-CD1 4.24Å; W73-L85 HydrophobicContact CE3-CD2 3.54Å; W73-L85 HydrophobicContact CG-CD1 4.4Å; W73-L85 HydrophobicContact CH2-CD2 3.76Å; W73-L85 HydrophobicContact CZ2-CD2 4.34Å; W73-L85 HydrophobicContact CZ3-CD2 3.34Å; W73-L97 HydrophobicContact CE3-CD2 3.97Å; W73-L97 HydrophobicContact CZ3-CD2 4.11Å; W73-A99 HydrophobicContact CH2-CB 3.76Å; W73-A99 HydrophobicContact CZ3-CB 3.63Å; W73-L101 HydrophobicContact CH2-CD2 3.84Å; W73-L101 HydrophobicContact CZ2-CD2 4.46Å; W73-H105 HydrophobicContact CZ2-CB 4.12Å; W73-H105 AromaticContact CZ2-CG 3.87Å; W73-D108 HydrophobicContact CZ2-CB 4.12Å; W73-D108 PolarHBondContact NE1-OD2 2.83Å; W73-T109 WeakPolarHBondContact CA-O 3.22Å; W73-V110 HydrophobicContact CD2-CG2 4.33Å; W73-V110 HydrophobicContact CE3-CG2 3.56Å; W73-V110 HydrophobicContact CH2-CG2 4.26Å; W73-V110 HydrophobicContact CZ3-CG2 3.5Å; W73-I127 HydrophobicContact CH2-CD1 3.21Å; W73-I127 HydrophobicContact CZ2-CD1 3.49Å; W73-I127 VanDerWaalsContact CZ2-CD1 3.49Å; W73-I127 HydrophobicContact CZ3-CD1 3.83Å
74	N	87.5	Confident	82	Confident	61 Å²	61	63.6 Å²	63.6	33%	0.326	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.1	52.9	-171.2	-67	-17.6	0	0	0	111.6	N76 D108 T109	N74-N76 PolarHBondContact O-N 2.76Å; N74-N76 VanDerWaalsContact O-N 3.15Å; N74-N76 PolarHBondContact O-ND2 3.14Å; N74-D108 VanDerWaalsContact ND2-CG 3.27Å; N74-D108 PolarHBondContact ND2-OD1 2.82Å; N74-D108 WeakPolarHBondContact OD1-CA 3.34Å; N74-T109 PolarHBondContact N-O 3.4Å; N74-T109 PolarHBondContact OD1-N 3.36Å; N74-T109 PolarHBondContact OD1-OG1 3.2Å
75	N	81.1	Confident	82.3	Confident	127 Å²	127	62.6 Å²	62.6	68%	0.679	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	-5	-173.7	-57	-49.4	0	0	0	117.4	W73	W73-N75 VanDerWaalsContact C-N 3.26Å; W73-N75 PolarHBondContact O-N 3.47Å
76	N	83.3	Confident	82.3	Confident	104 Å²	104	63.7 Å²	63.7	56%	0.556	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	119.2	179.2	-60	-83	0	0	0	112	R72 W73 N74 I78	R72-N76 CarbonylContact C-O 3.46Å; R72-N76 WeakPolarHBondContact CA-O 3.45Å; W73-N76 PolarHBondContact N-O 3.29Å; W73-N76 WeakPolarHBondContact O-CB 3.28Å; W73-N76 PolarHBondContact O-N 3.31Å; W73-N76 PolarHBondContact O-ND2 2.95Å; N74-N76 PolarHBondContact O-N 2.76Å; N74-N76 VanDerWaalsContact O-N 3.15Å; N74-N76 PolarHBondContact O-ND2 3.14Å; N76-I78 PolarHBondContact O-N 2.79Å
77	E	83.6	Confident	82.6	Confident	51 Å²	51	60.4 Å²	60.4	24%	0.238	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	126.4	-178.9	-161.3	161.7	122.5	0	0	112.7	R68 V70 R72 T79	R68-E77 IonicContact CZ-OE1 2.71Å; R68-E77 IonicContact NH1-OE1 3.34Å; R68-E77 PolarHBondContact NH1-OE1 3.48Å; R68-E77 IonicContact NH2-OE1 3.31Å; R68-E77 PolarHBondContact NH2-OE1 3.47Å; V70-E77 HydrophobicContact CB-CG 4.1Å; V70-E77 HydrophobicContact CG1-CG 4.46Å; V70-E77 HydrophobicContact CG2-CG 4Å; R72-E77 HydrophobicContact CG-CB 4.22Å; R72-E77 HydrophobicContact CG-CG 4.45Å; R72-E77 IonicContact CZ-OE2 3.35Å; R72-E77 IonicContact NE-OE2 2.76Å; R72-E77 PolarHBondContact NE-OE2 3.5Å; R72-E77 IonicContact NH2-OE2 3.74Å; R72-E77 PolarHBondContact NH2-OE2 3.17Å; E77-T79 HydrophobicContact CB-CG2 4.42Å; E77-T79 HydrophobicContact CG-CG2 4Å; E77-T79 PolarHBondContact O-N 3.38Å
78	I	82.1	Confident	82.4	Confident	3 Å²	3	63.5 Å²	63.5	2%	0.015	32%	0.322	C	S	.	.			trans	-91.2	86.7	-178.5	-48.2	175.6	0	0	0	107.8	F71 W73 N76 F87 L97	F71-I78 HydrophobicContact CB-CD1 3.91Å; F71-I78 HydrophobicContact CB-CG1 4.42Å; F71-I78 PolarHBondContact O-N 3.01Å; W73-I78 HydrophobicContact CB-CD1 3.96Å; W73-I78 HydrophobicContact CB-CG1 4.22Å; W73-I78 HydrophobicContact CE3-CD1 4.41Å; N76-I78 PolarHBondContact O-N 2.79Å; I78-F87 HydrophobicContact CG2-CB 4.11Å; I78-L97 HydrophobicContact CD1-CD1 3.54Å; I78-L97 HydrophobicContact CD1-CD2 3.45Å; I78-L97 VanDerWaalsContact CD1-CD2 3.45Å; I78-L97 HydrophobicContact CD1-CG 4.13Å; I78-L97 HydrophobicContact CG2-CD1 4.17Å
79	T	67.9	Low	82.1	Confident	84 Å²	84	63.5 Å²	63.5	52%	0.515	33%	0.328	S	S	.	.			trans	-91.8	-10.2	-177.8	54.2	0	0	0	0	114.1	E77	E77-T79 HydrophobicContact CB-CG2 4.42Å; E77-T79 HydrophobicContact CG-CG2 4Å; E77-T79 PolarHBondContact O-N 3.38Å
80	Q	71	Confident	81.3	Confident	93 Å²	93	65.5 Å²	65.5	44%	0.435	34%	0.338	S	S	.	.	S	Bend	trans	-152.3	155.3	-174.8	-68.4	-177.4	-23.1	0	0	110.3
81	N	78.3	Confident	80.4	Confident	75 Å²	75	67 Å²	67	40%	0.401	35%	0.349	S	S	.	.			trans	-58.5	140.5	169.7	-70.9	-25.1	0	0	0	111.4	Q86 F87	N81-Q86 WeakPolarHBondContact OD1-CA 3.38Å; N81-F87 PolarHBondContact OD1-N 2.92Å; N81-F87 PolarHBondContact OD1-O 2.98Å
82	R	79.8	Confident	79.6	Confident	128 Å²	128	69.8 Å²	69.8	48%	0.483	37%	0.371	S	S	.	.	B	Isolated β-bridge	trans	-133.7	160.4	173	-57.7	-176.9	-174.7	176.3	4.8	109.2	G84 L85	R82-G84 PolarHBondContact O-N 2.96Å; R82-G84 VanDerWaalsContact O-N 3.14Å; R82-L85 HydrophobicContact CB-CB 4.38Å; R82-L85 PolarHBondContact N-O 2.84Å; R82-L85 CarbonylContact O-C 3.58Å; R82-L85 PolarHBondContact O-N 2.78Å
83	P	76.3	Confident	78.9	Confident	136 Å²	136	68.9 Å²	68.9	88%	0.883	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	122.8	172.3	-25.4	35.4	0	0	0	110.7	L85	P83-L85 VanDerWaalsContact C-N 3.29Å; P83-L85 PolarHBondContact O-N 2.87Å
84	G	77.7	Confident	78.4	Confident	38 Å²	38	68.2 Å²	68.2	39%	0.392	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	-7	-176.5	0	0	0	0	0	116.4	R82 A99 K100	R82-G84 PolarHBondContact O-N 2.96Å; R82-G84 VanDerWaalsContact O-N 3.14Å; G84-A99 CarbonylContact O-C 3.52Å; G84-A99 WeakPolarHBondContact O-CA 3.28Å; G84-K100 PolarHBondContact O-N 3.09Å
85	L	84.9	Confident	78.3	Confident	21 Å²	21	65.5 Å²	65.5	11%	0.11	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	101.2	178.7	-67.3	174.9	0	0	0	110.5	W73 R82 P83 L97 A99	W73-L85 HydrophobicContact CD2-CD1 4.15Å; W73-L85 HydrophobicContact CD2-CD2 4.15Å; W73-L85 HydrophobicContact CE3-CD1 4.24Å; W73-L85 HydrophobicContact CE3-CD2 3.54Å; W73-L85 HydrophobicContact CG-CD1 4.4Å; W73-L85 HydrophobicContact CH2-CD2 3.76Å; W73-L85 HydrophobicContact CZ2-CD2 4.34Å; W73-L85 HydrophobicContact CZ3-CD2 3.34Å; R82-L85 HydrophobicContact CB-CB 4.38Å; R82-L85 PolarHBondContact N-O 2.84Å; R82-L85 CarbonylContact O-C 3.58Å; R82-L85 PolarHBondContact O-N 2.78Å; P83-L85 VanDerWaalsContact C-N 3.29Å; P83-L85 PolarHBondContact O-N 2.87Å; L85-L97 HydrophobicContact CB-CD1 4.43Å; L85-L97 HydrophobicContact CD2-CD1 4.35Å; L85-A99 HydrophobicContact CD2-CB 3.61Å
86	Q	82.6	Confident	78.5	Confident	75 Å²	75	59.4 Å²	59.4	35%	0.35	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	131.7	177.7	-53.3	175.2	-33.4	0	0	110.2	N81 L97 R98 F179	N81-Q86 WeakPolarHBondContact OD1-CA 3.38Å; Q86-L97 CarbonylContact O-C 3.38Å; Q86-L97 WeakPolarHBondContact O-CA 3.26Å; Q86-R98 HydrophobicContact CB-CB 4.4Å; Q86-R98 PolarHBondContact N-O 2.94Å; Q86-R98 PolarHBondContact O-N 2.83Å; Q86-F179 HydrophobicContact CB-CE1 3.99Å; Q86-F179 HydrophobicContact CB-CZ 3.58Å
87	F	84	Confident	78.7	Confident	38 Å²	38	54.5 Å²	54.5	17%	0.167	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	132.9	-179.2	171.2	-91.4	0	0	0	109.7	F71 I78 N81 V95 A96	F71-F87 HydrophobicContact CD2-CD2 4.28Å; F71-F87 HydrophobicContact CD2-CE2 4.27Å; I78-F87 HydrophobicContact CG2-CB 4.11Å; N81-F87 PolarHBondContact OD1-N 2.92Å; N81-F87 PolarHBondContact OD1-O 2.98Å; F87-V95 HydrophobicContact CE2-CB 3.82Å; F87-V95 HydrophobicContact CE2-CG1 3.94Å; F87-V95 HydrophobicContact CE2-CG2 4.36Å; F87-V95 HydrophobicContact CZ-CB 4.12Å; F87-V95 HydrophobicContact CZ-CG1 3.73Å; F87-A96 WeakPolarHBondContact CA-O 3.37Å
88	K	80.3	Confident	79	Confident	66 Å²	66	53.4 Å²	53.4	29%	0.287	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	126.5	174.4	-167.3	-171.6	-177.5	-175.6	0	109.7	L90 A96 D177 F179	K88-L90 HydrophobicContact CD-CD2 3.86Å; K88-L90 HydrophobicContact CG-CD2 4.38Å; K88-A96 PolarHBondContact N-O 2.8Å; K88-A96 PolarHBondContact O-N 2.83Å; K88-D177 PolarHBondContact NZ-O 2.86Å; K88-F179 HydrophobicContact CB-CB 4.13Å; K88-F179 HydrophobicContact CB-CD1 3.62Å; K88-F179 HydrophobicContact CB-CD2 4.09Å; K88-F179 HydrophobicContact CB-CE1 3.98Å; K88-F179 HydrophobicContact CB-CE2 4.43Å; K88-F179 HydrophobicContact CB-CG 3.69Å; K88-F179 HydrophobicContact CB-CZ 4.38Å; K88-F179 HydrophobicContact CD-CB 3.43Å; K88-F179 VanDerWaalsContact CD-CB 3.43Å; K88-F179 HydrophobicContact CD-CD1 4.33Å; K88-F179 HydrophobicContact CD-CD2 3.51Å; K88-F179 HydrophobicContact CD-CE2 4.34Å; K88-F179 HydrophobicContact CD-CG 3.52Å; K88-F179 HydrophobicContact CG-CB 4.43Å; K88-F179 HydrophobicContact CG-CD2 4.41Å; K88-F179 HydrophobicContact CG-CG 4.28Å
89	E	80.1	Confident	79.2	Confident	135 Å²	135	53.3 Å²	53.3	63%	0.631	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.2	119.6	164.1	-167.2	172	-178.7	0	0	107.7	V95	E89-V95 HydrophobicContact CG-CG1 4.4Å
90	L	71.5	Confident	80.1	Confident	52 Å²	52	53.2 Å²	53.2	27%	0.272	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	-40.7	-175.7	-69.9	173.6	0	0	0	110.8	F58 K88 S94 A96 F179 E180	F58-L90 HydrophobicContact CD2-CD1 4Å; F58-L90 HydrophobicContact CE2-CD1 3.7Å; K88-L90 HydrophobicContact CD-CD2 3.86Å; K88-L90 HydrophobicContact CG-CD2 4.38Å; L90-S94 WeakPolarHBondContact CB-OG 3.34Å; L90-S94 PolarHBondContact N-O 3.3Å; L90-A96 HydrophobicContact CD1-CB 3.8Å; L90-A96 HydrophobicContact CG-CB 4.34Å; L90-F179 WeakPolarHBondContact CD1-O 3.41Å; L90-F179 HydrophobicContact CD2-CB 4Å; L90-E180 HydrophobicContact CD2-CB 4.46Å
91	S	69.1	Low	80.9	Confident	41 Å²	41	48.8 Å²	48.8	29%	0.287	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	173	171.2	63.7	0	0	0	0	109.4	D93 S94	S91-D93 VanDerWaalsContact CB-OD1 3.25Å; S91-D93 WeakPolarHBondContact CB-OD1 3.48Å; S91-D93 PolarHBondContact O-N 3.28Å; S91-D93 VanDerWaalsContact OG-CG 3.26Å; S91-D93 PolarHBondContact OG-OD1 2.76Å; S91-S94 PolarHBondContact N-O 2.98Å; S91-S94 VanDerWaalsContact N-O 3.12Å; S91-S94 PolarHBondContact N-OG 2.76Å; S91-S94 PolarHBondContact O-N 2.88Å; S91-S94 VanDerWaalsContact O-N 3.1Å; S91-S94 WeakPolarHBondContact OG-CB 2.99Å; S91-S94 PolarHBondContact OG-N 3Å; S91-S94 PolarHBondContact OG-OG 2.84Å
92	A	70.6	Confident	81.3	Confident	57 Å²	57	48.7 Å²	48.7	47%	0.471	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-11	177.6	0	0	0	0	0	114	L66 P67	L66-A92 HydrophobicContact CB-CB 4.45Å; L66-A92 HydrophobicContact CD1-CB 4.25Å; P67-A92 VanDerWaalsContact O-O 3.1Å
93	D	75.8	Confident	81.4	Confident	37 Å²	37	46.5 Å²	46.5	20%	0.198	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-6.1	175.3	60.4	-59	0	0	0	114	Q60 A61 L66 S91	Q60-D93 CarbonylContact C-O 3.51Å; Q60-D93 VanDerWaalsContact CA-O 3.27Å; Q60-D93 WeakPolarHBondContact CA-O 3.44Å; Q60-D93 PolarHBondContact NE2-OD2 2.88Å; A61-D93 PolarHBondContact N-O 3.15Å; A61-D93 WeakPolarHBondContact O-CB 3.46Å; L66-D93 HydrophobicContact CD2-CB 3.92Å; S91-D93 VanDerWaalsContact CB-OD1 3.25Å; S91-D93 WeakPolarHBondContact CB-OD1 3.48Å; S91-D93 PolarHBondContact O-N 3.28Å; S91-D93 VanDerWaalsContact OG-CG 3.26Å; S91-D93 PolarHBondContact OG-OD1 2.76Å
94	S	78.6	Confident	81.8	Confident	11 Å²	11	45.4 Å²	45.4	8%	0.077	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	141.1	-174.9	73.2	0	0	0	0	115.3	C59 L90 S91	C59-S94 CarbonylContact O-C 3.41Å; C59-S94 VanDerWaalsContact O-CA 3.31Å; C59-S94 WeakPolarHBondContact O-CA 3.18Å; L90-S94 WeakPolarHBondContact CB-OG 3.34Å; L90-S94 PolarHBondContact N-O 3.3Å; S91-S94 PolarHBondContact N-O 2.98Å; S91-S94 VanDerWaalsContact N-O 3.12Å; S91-S94 PolarHBondContact N-OG 2.76Å; S91-S94 PolarHBondContact O-N 2.88Å; S91-S94 VanDerWaalsContact O-N 3.1Å; S91-S94 WeakPolarHBondContact OG-CB 2.99Å; S91-S94 PolarHBondContact OG-N 3Å; S91-S94 PolarHBondContact OG-OG 2.84Å
95	V	85.3	Confident	82.3	Confident	3 Å²	3	45.2 Å²	45.2	2%	0.018	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	150.6	-178.3	-66.6	0	0	0	0	110.6	C59 V69 F71 F87 E89	C59-V95 HydrophobicContact CB-CG2 4.14Å; C59-V95 PolarHBondContact N-O 3.01Å; C59-V95 PolarHBondContact O-N 2.84Å; V69-V95 HydrophobicContact CB-CG1 4.19Å; V69-V95 HydrophobicContact CB-CG2 3.91Å; V69-V95 HydrophobicContact CG1-CG2 3.54Å; V69-V95 WeakPolarHBondContact O-CG1 3.35Å; F71-V95 HydrophobicContact CD2-CG2 3.88Å; F71-V95 HydrophobicContact CE2-CB 4.39Å; F71-V95 HydrophobicContact CE2-CG2 3.71Å; F87-V95 HydrophobicContact CE2-CB 3.82Å; F87-V95 HydrophobicContact CE2-CG1 3.94Å; F87-V95 HydrophobicContact CE2-CG2 4.36Å; F87-V95 HydrophobicContact CZ-CB 4.12Å; F87-V95 HydrophobicContact CZ-CG1 3.73Å; E89-V95 HydrophobicContact CG-CG1 4.4Å
96	A	85.8	Confident	82.4	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	139.2	173.7	0	0	0	0	0	111.5	L56 F57 F87 K88 L90 F179	L56-A96 HydrophobicContact CD1-CB 4.13Å; F57-A96 CarbonylContact O-C 3.46Å; F57-A96 WeakPolarHBondContact O-CA 3.34Å; F87-A96 WeakPolarHBondContact CA-O 3.37Å; K88-A96 PolarHBondContact N-O 2.8Å; K88-A96 PolarHBondContact O-N 2.83Å; L90-A96 HydrophobicContact CD1-CB 3.8Å; L90-A96 HydrophobicContact CG-CB 4.34Å; A96-F179 HydrophobicContact CB-CB 4.24Å; A96-F179 HydrophobicContact CB-CD1 4.02Å
97	L	88.2	Confident	82.6	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	112.6	174	173.1	72.9	0	0	0	108.8	F57 F71 W73 I78 L85 Q86 V110	F57-L97 HydrophobicContact CB-CB 4.32Å; F57-L97 HydrophobicContact CD2-CD2 4.23Å; F57-L97 PolarHBondContact N-O 2.88Å; F57-L97 PolarHBondContact O-N 2.88Å; F71-L97 HydrophobicContact CB-CB 4.43Å; F71-L97 HydrophobicContact CB-CD2 4.18Å; F71-L97 HydrophobicContact CD1-CB 4.49Å; F71-L97 HydrophobicContact CD1-CD2 4.4Å; F71-L97 HydrophobicContact CD2-CB 3.5Å; F71-L97 VanDerWaalsContact CD2-CB 3.5Å; F71-L97 HydrophobicContact CE2-CB 3.73Å; F71-L97 HydrophobicContact CG-CB 3.9Å; F71-L97 HydrophobicContact CG-CD2 4.17Å; F71-L97 HydrophobicContact CZ-CB 4.33Å; W73-L97 HydrophobicContact CE3-CD2 3.97Å; W73-L97 HydrophobicContact CZ3-CD2 4.11Å; I78-L97 HydrophobicContact CD1-CD1 3.54Å; I78-L97 HydrophobicContact CD1-CD2 3.45Å; I78-L97 VanDerWaalsContact CD1-CD2 3.45Å; I78-L97 HydrophobicContact CD1-CG 4.13Å; I78-L97 HydrophobicContact CG2-CD1 4.17Å; L85-L97 HydrophobicContact CB-CD1 4.43Å; L85-L97 HydrophobicContact CD2-CD1 4.35Å; Q86-L97 CarbonylContact O-C 3.38Å; Q86-L97 WeakPolarHBondContact O-CA 3.26Å; L97-V110 HydrophobicContact CD2-CG1 3.82Å
98	R	88.4	Confident	82.9	Confident	29 Å²	29	46.8 Å²	46.8	11%	0.109	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	118.6	171.1	-167.7	-176.8	-174.9	118.3	1.1	109	V55 L56 Q86 Q178 F179 E211	V55-R98 WeakPolarHBondContact O-CA 3.44Å; L56-R98 HydrophobicContact CD1-CB 3.83Å; L56-R98 HydrophobicContact CD1-CG 4.31Å; Q86-R98 HydrophobicContact CB-CB 4.4Å; Q86-R98 PolarHBondContact N-O 2.94Å; Q86-R98 PolarHBondContact O-N 2.83Å; R98-Q178 PolarHBondContact NH1-O 3.24Å; R98-F179 HydrophobicContact CB-CD1 4.38Å; R98-F179 HydrophobicContact CB-CE1 3.74Å; R98-F179 HydrophobicContact CB-CZ 4.26Å; R98-E211 IonicContact CZ-OE1 2.98Å; R98-E211 IonicContact CZ-OE2 3.28Å; R98-E211 VanDerWaalsContact NH1-CD 3.27Å; R98-E211 IonicContact NH1-OE1 2.65Å; R98-E211 PolarHBondContact NH1-OE1 3.15Å; R98-E211 IonicContact NH1-OE2 3.25Å; R98-E211 PolarHBondContact NH1-OE2 2.94Å; R98-E211 IonicContact NH2-OE1 2.76Å; R98-E211 PolarHBondContact NH2-OE1 3.37Å; R98-E211 IonicContact NH2-OE2 3.33Å; R98-E211 PolarHBondContact NH2-OE2 2.84Å
99	A	87.8	Confident	83.4	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129.8	-177.9	0	0	0	0	0	110.7	S54 V55 F57 W73 G84 L85 L101	S54-A99 CarbonylContact C-O 3.5Å; S54-A99 WeakPolarHBondContact CA-O 3.5Å; V55-A99 HydrophobicContact CG2-CB 4.16Å; V55-A99 PolarHBondContact N-O 2.85Å; V55-A99 PolarHBondContact O-N 3.1Å; F57-A99 HydrophobicContact CD2-CB 4.41Å; F57-A99 HydrophobicContact CE2-CB 4.09Å; W73-A99 HydrophobicContact CH2-CB 3.76Å; W73-A99 HydrophobicContact CZ3-CB 3.63Å; G84-A99 CarbonylContact O-C 3.52Å; G84-A99 WeakPolarHBondContact O-CA 3.28Å; L85-A99 HydrophobicContact CD2-CB 3.61Å; A99-L101 HydrophobicContact CB-CD2 4.19Å
100	K	87	Confident	83.9	Confident	83 Å²	83	38.9 Å²	38.9	36%	0.361	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	121.6	165.6	-166.3	-174.4	178.4	-123.3	0	108.4	G52 E53 G84 E102 H105	G52-K100 WeakPolarHBondContact O-CE 3.42Å; E53-K100 WeakPolarHBondContact O-CA 3.32Å; G84-K100 PolarHBondContact O-N 3.09Å; K100-E102 IonicContact NZ-OE1 2.79Å; K100-E102 PolarHBondContact NZ-OE1 3.24Å; K100-H105 PolarHBondContact O-ND1 3.25Å
101	L	87.7	Confident	84.9	Confident	0 Å²	0	37 Å²	37	0%	0	22%	0.219	C	C	.	.			trans	-93.1	114.1	-172.2	-63	-176.3	0	0	0	110.8	A49 G52 E53 V55 W73 A99 H105 I127 V129	A49-L101 HydrophobicContact CB-CD1 3.74Å; G52-L101 PolarHBondContact N-O 2.91Å; E53-L101 PolarHBondContact O-N 2.86Å; V55-L101 HydrophobicContact CB-CD1 4.42Å; V55-L101 HydrophobicContact CG1-CD1 3.78Å; V55-L101 HydrophobicContact CG1-CG 4.43Å; V55-L101 HydrophobicContact CG2-CD1 3.69Å; V55-L101 HydrophobicContact CG2-CD2 4.29Å; V55-L101 HydrophobicContact CG2-CG 3.91Å; W73-L101 HydrophobicContact CH2-CD2 3.84Å; W73-L101 HydrophobicContact CZ2-CD2 4.46Å; A99-L101 HydrophobicContact CB-CD2 4.19Å; L101-H105 HydrophobicContact CD2-CB 4.26Å; L101-I127 HydrophobicContact CD1-CG2 3.84Å; L101-I127 HydrophobicContact CD2-CD1 3.94Å; L101-I127 HydrophobicContact CD2-CG1 4.46Å; L101-I127 HydrophobicContact CD2-CG2 3.95Å; L101-I127 HydrophobicContact CG-CG2 4.46Å; L101-V129 HydrophobicContact CB-CG2 4.11Å
102	E	85	Confident	85.9	Confident	72 Å²	72	35 Å²	35	34%	0.336	21%	0.205	S	C	.	.			trans	-98.1	159.1	172.7	-61.4	-65.9	158.1	0	0	108.9	K100 N104 H105	K100-E102 IonicContact NZ-OE1 2.79Å; K100-E102 PolarHBondContact NZ-OE1 3.24Å; E102-N104 WeakPolarHBondContact CB-OD1 3.32Å; E102-N104 PolarHBondContact O-N 3.18Å; E102-H105 PolarHBondContact N-ND1 3.02Å; E102-H105 WeakPolarHBondContact O-CB 3.36Å; E102-H105 PolarHBondContact O-N 3.25Å
103	P	82.8	Confident	86.9	Confident	82 Å²	82	33.8 Å²	33.8	53%	0.532	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-56.5	-26.9	-173.7	-26.2	34.1	0	0	0	114.9	A51 H105 N106	A51-P103 HydrophobicContact CB-CG 3.78Å; P103-H105 VanDerWaalsContact C-N 3.26Å; P103-H105 PolarHBondContact O-N 3Å; P103-N106 WeakPolarHBondContact O-CB 3.36Å; P103-N106 PolarHBondContact O-N 2.83Å
104	N	85.2	Confident	87.5	Confident	113 Å²	113	32 Å²	32	60%	0.604	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-76.6	-4.8	177.1	66.6	-83.7	0	0	0	114.2	E102 N106	E102-N104 WeakPolarHBondContact CB-OD1 3.32Å; E102-N104 PolarHBondContact O-N 3.18Å; N104-N106 VanDerWaalsContact C-N 3.33Å
105	H	88.2	Confident	88.1	Confident	34 Å²	34	36 Å²	36	16%	0.157	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-89.2	1.2	171.7	-57.1	155.4	0	0	0	112.2	W73 K100 L101 E102 P103 G107 D108 I127 V129	W73-H105 HydrophobicContact CZ2-CB 4.12Å; W73-H105 AromaticContact CZ2-CG 3.87Å; K100-H105 PolarHBondContact O-ND1 3.25Å; L101-H105 HydrophobicContact CD2-CB 4.26Å; E102-H105 PolarHBondContact N-ND1 3.02Å; E102-H105 WeakPolarHBondContact O-CB 3.36Å; E102-H105 PolarHBondContact O-N 3.25Å; P103-H105 VanDerWaalsContact C-N 3.26Å; P103-H105 PolarHBondContact O-N 3Å; H105-G107 PolarHBondContact O-N 3.09Å; H105-D108 WeakPolarHBondContact CA-OD2 3.5Å; H105-D108 HydrophobicContact CB-CB 4.43Å; H105-D108 IonicContact CD2-OD2 3.4Å; H105-D108 PolarHBondContact CD2-OD2 2.88Å; H105-D108 IonicContact CG-OD2 3.1Å; H105-D108 VanDerWaalsContact O-CB 3.3Å; H105-D108 WeakPolarHBondContact O-CB 3.27Å; H105-D108 PolarHBondContact O-N 2.7Å; H105-I127 HydrophobicContact CB-CG2 4.39Å; H105-I127 WeakPolarHBondContact O-CB 3.46Å; H105-I127 WeakPolarHBondContact O-CG2 3.38Å; H105-V129 HydrophobicContact CB-CG2 4.39Å
106	N	87.2	Confident	88	Confident	94 Å²	94	36.6 Å²	36.6	50%	0.503	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	113.5	176.1	-175.3	71.8	0	0	0	111	P103 N104 S128 V129	P103-N106 WeakPolarHBondContact O-CB 3.36Å; P103-N106 PolarHBondContact O-N 2.83Å; N104-N106 VanDerWaalsContact C-N 3.33Å; N106-S128 WeakPolarHBondContact OD1-CA 3.43Å; N106-V129 HydrophobicContact CB-CB 4.09Å; N106-V129 HydrophobicContact CB-CG2 4.19Å; N106-V129 PolarHBondContact OD1-N 2.84Å
107	G	85.7	Confident	88	Confident	51 Å²	51	42.9 Å²	42.9	53%	0.526	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	97	-1.9	-171.1	0	0	0	0	0	114.5	H105 I127	H105-G107 PolarHBondContact O-N 3.09Å; G107-I127 PolarHBondContact N-O 2.88Å
108	D	91.1	Very high	87.7	Confident	23 Å²	23	45.7 Å²	45.7	12%	0.123	25%	0.246	C	C	.	.			trans	-69.1	157.4	174	-78.4	-7.3	0	0	0	111.8	W73 N74 H105 I127	W73-D108 HydrophobicContact CZ2-CB 4.12Å; W73-D108 PolarHBondContact NE1-OD2 2.83Å; N74-D108 VanDerWaalsContact ND2-CG 3.27Å; N74-D108 PolarHBondContact ND2-OD1 2.82Å; N74-D108 WeakPolarHBondContact OD1-CA 3.34Å; H105-D108 WeakPolarHBondContact CA-OD2 3.5Å; H105-D108 HydrophobicContact CB-CB 4.43Å; H105-D108 IonicContact CD2-OD2 3.4Å; H105-D108 PolarHBondContact CD2-OD2 2.88Å; H105-D108 IonicContact CG-OD2 3.1Å; H105-D108 VanDerWaalsContact O-CB 3.3Å; H105-D108 WeakPolarHBondContact O-CB 3.27Å; H105-D108 PolarHBondContact O-N 2.7Å; D108-I127 HydrophobicContact CB-CB 4.47Å; D108-I127 HydrophobicContact CB-CD1 3.97Å; D108-I127 PolarHBondContact O-N 2.8Å
109	T	91.2	Very high	87.6	Confident	35 Å²	35	45.5 Å²	45.5	22%	0.215	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	130.1	-175.3	51.6	0	0	0	0	111.8	W73 N74 T124 A125 Q126	W73-T109 WeakPolarHBondContact CA-O 3.22Å; N74-T109 PolarHBondContact N-O 3.4Å; N74-T109 PolarHBondContact OD1-N 3.36Å; N74-T109 PolarHBondContact OD1-OG1 3.2Å; T109-T124 HydrophobicContact CG2-CG2 4.22Å; T109-A125 CarbonylContact C-O 3.41Å; T109-A125 WeakPolarHBondContact CA-O 3.39Å; T109-Q126 HydrophobicContact CG2-CG 4.47Å
110	V	90	Very high	87.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	103.9	177.3	-179.8	0	0	0	0	108.6	F57 F71 W73 L97 T124 A125 I127	F57-V110 HydrophobicContact CB-CG1 4.17Å; F57-V110 HydrophobicContact CD1-CB 4.21Å; F57-V110 HydrophobicContact CD1-CG1 4.04Å; F57-V110 HydrophobicContact CD1-CG2 4.49Å; F57-V110 HydrophobicContact CD2-CG1 4.13Å; F57-V110 HydrophobicContact CD2-CG2 4.18Å; F57-V110 HydrophobicContact CE1-CB 4.17Å; F57-V110 HydrophobicContact CE1-CG1 4.48Å; F57-V110 HydrophobicContact CE1-CG2 4.15Å; F57-V110 HydrophobicContact CE2-CG2 3.81Å; F57-V110 HydrophobicContact CG-CB 4.4Å; F57-V110 HydrophobicContact CG-CG1 3.86Å; F57-V110 HydrophobicContact CZ-CB 4.34Å; F57-V110 HydrophobicContact CZ-CG2 3.81Å; F71-V110 HydrophobicContact CD1-CG1 3.55Å; F71-V110 HydrophobicContact CE1-CG1 3.83Å; W73-V110 HydrophobicContact CD2-CG2 4.33Å; W73-V110 HydrophobicContact CE3-CG2 3.56Å; W73-V110 HydrophobicContact CH2-CG2 4.26Å; W73-V110 HydrophobicContact CZ3-CG2 3.5Å; L97-V110 HydrophobicContact CD2-CG1 3.82Å; V110-T124 WeakPolarHBondContact O-CA 3.35Å; V110-A125 PolarHBondContact N-O 2.87Å; V110-A125 PolarHBondContact O-N 3.36Å; V110-I127 HydrophobicContact CG2-CD1 3.69Å; V110-I127 HydrophobicContact CG2-CG1 4.34Å
111	T	91.4	Very high	87.9	Confident	12 Å²	12	47.8 Å²	47.8	7%	0.074	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	118.8	179.2	-57	0	0	0	0	110.2	F71 R72 A123 T124	F71-T111 CarbonylContact C-O 3.59Å; F71-T111 WeakPolarHBondContact CA-O 3.21Å; R72-T111 PolarHBondContact N-O 2.65Å; R72-T111 PolarHBondContact O-N 3.25Å; T111-A123 CarbonylContact C-O 3.54Å; T111-A123 WeakPolarHBondContact CA-O 3.38Å; T111-T124 WeakPolarHBondContact CG2-OG1 3.33Å; T111-T124 VanDerWaalsContact OG1-CG2 3.31Å; T111-T124 WeakPolarHBondContact OG1-CG2 3.27Å; T111-T124 PolarHBondContact OG1-OG1 2.69Å
112	C	90.5	Very high	88.1	Confident	0 Å²	0	51 Å²	51	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	138.4	160.9	179.8	0	0	0	0	109.4	I40 P44 C59 V69 F71 S122 A123	I40-C112 HydrophobicContact CD1-CB 4.23Å; P44-C112 HydrophobicContact CG-CB 3.87Å; C59-C112 HydrophobicContact CB-CB 3.65Å; C59-C112 WeakPolarHBondContact CB-SG 3.45Å; C59-C112 WeakPolarHBondContact SG-CB 3.45Å; C59-C112 CovalentContact SG-SG 2.02Å; C59-C112 PolarHBondContact SG-SG 3.4Å; V69-C112 WeakPolarHBondContact CG1-SG 3.46Å; F71-C112 HydrophobicContact CD1-CB 4.25Å; F71-C112 HydrophobicContact CE1-CB 3.97Å; C112-S122 CarbonylContact O-C 3.2Å; C112-S122 WeakPolarHBondContact O-CA 3.35Å; C112-S122 WeakPolarHBondContact O-CB 3.47Å; C112-A123 PolarHBondContact N-O 3.19Å; C112-A123 PolarHBondContact O-N 3.31Å
113	F	91.5	Very high	88.3	Confident	31 Å²	31	48.8 Å²	48.8	14%	0.136	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	119.3	176.2	179.1	-94	0	0	0	108.7	V69 V70 R72 Q115	V69-F113 WeakPolarHBondContact CA-O 3.47Å; V70-F113 HydrophobicContact CG2-CB 4.09Å; V70-F113 HydrophobicContact CG2-CD1 4.06Å; V70-F113 PolarHBondContact N-O 3.01Å; V70-F113 PolarHBondContact O-N 3.18Å; R72-F113 VanDerWaalsContact NH1-CG 3.25Å; R72-F113 VanDerWaalsContact NH2-CD1 3.29Å; F113-Q115 HydrophobicContact CD1-CB 4.48Å; F113-Q115 HydrophobicContact CE1-CB 3.81Å; F113-Q115 HydrophobicContact CZ-CB 4.35Å
114	A	89.9	Confident	88.7	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	133.7	178.9	0	0	0	0	0	109.9	A38 I40 A61 P67 R68 V69 S120 D121	A38-A114 HydrophobicContact CB-CB 4.22Å; I40-A114 HydrophobicContact CD1-CB 4.48Å; I40-A114 HydrophobicContact CG1-CB 3.96Å; A61-A114 HydrophobicContact CB-CB 3.4Å; A61-A114 VanDerWaalsContact CB-CB 3.4Å; P67-A114 HydrophobicContact CB-CB 4.35Å; R68-A114 WeakPolarHBondContact O-CA 3.36Å; V69-A114 HydrophobicContact CG1-CB 4.34Å; V69-A114 HydrophobicContact CG2-CB 4.17Å; A114-S120 CarbonylContact O-C 3.57Å; A114-S120 WeakPolarHBondContact O-CA 3.37Å; A114-S120 WeakPolarHBondContact O-CB 3.4Å; A114-D121 PolarHBondContact N-O 2.75Å; A114-D121 PolarHBondContact O-N 2.82Å
115	Q	89.7	Confident	88.8	Confident	94 Å²	94	43.1 Å²	43.1	44%	0.439	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	128	-178.5	-178.1	177.5	20.8	0	0	112.5	P67 R68 F113	P67-Q115 CarbonylContact C-O 3.53Å; P67-Q115 WeakPolarHBondContact CA-O 3.39Å; R68-Q115 PolarHBondContact N-O 2.89Å; R68-Q115 PolarHBondContact O-N 2.61Å; F113-Q115 HydrophobicContact CD1-CB 4.48Å; F113-Q115 HydrophobicContact CE1-CB 3.81Å; F113-Q115 HydrophobicContact CZ-CB 4.35Å
116	N	84.4	Confident	88.8	Confident	16 Å²	16	47 Å²	47	9%	0.086	28%	0.278	C	S	.	.			trans	-116.5	-173.8	159.9	68.3	12.5	0	0	0	109.8	S36 A38 P65 P67 V118 G119	S36-N116 PolarHBondContact O-ND2 2.78Å; A38-N116 PolarHBondContact N-ND2 3.2Å; A38-N116 PolarHBondContact N-OD1 2.73Å; P65-N116 WeakPolarHBondContact O-CB 3.29Å; P65-N116 PolarHBondContact O-ND2 2.76Å; P67-N116 HydrophobicContact CB-CB 4.17Å; N116-V118 PolarHBondContact O-N 2.86Å; N116-V118 WeakPolarHBondContact OD1-CA 3.19Å; N116-V118 WeakPolarHBondContact OD1-CB 3.42Å; N116-V118 PolarHBondContact OD1-N 3.35Å; N116-G119 PolarHBondContact N-O 2.85Å; N116-G119 PolarHBondContact OD1-N 2.96Å; N116-G119 PolarHBondContact OD1-O 3.03Å
117	H	85.2	Confident	89	Confident	131 Å²	131	42.6 Å²	42.6	61%	0.606	25%	0.254	S	S	*	.	S	Bend	trans	-74.7	-5.9	178.9	72.6	-115.8	0	0	0	113.9	Q35 P65	Q35-H117 PolarHBondContact OE1-NE2 2.99Å; P65-H117 WeakPolarHBondContact CD-CE1 3.42Å; P65-H117 WeakPolarHBondContact CG-CE1 3.14Å
118	V	82.9	Confident	89	Confident	60 Å²	60	42.2 Å²	42.2	36%	0.364	24%	0.243	S	C	.	.	S	Bend	trans	-100.8	-30.8	-176	-172	0	0	0	0	111.2	Q35 P37 N116	Q35-V118 HydrophobicContact CB-CG2 4.06Å; P37-V118 HydrophobicContact CB-CG1 4.27Å; N116-V118 PolarHBondContact O-N 2.86Å; N116-V118 WeakPolarHBondContact OD1-CA 3.19Å; N116-V118 WeakPolarHBondContact OD1-CB 3.42Å; N116-V118 PolarHBondContact OD1-N 3.35Å
119	G	84.8	Confident	88.8	Confident	24 Å²	24	41.9 Å²	41.9	25%	0.247	24%	0.242	C	C	.	.			trans	-175.6	177.1	176.6	0	0	0	0	0	113.4	A38 N116	A38-G119 WeakPolarHBondContact CB-O 3.4Å; N116-G119 PolarHBondContact N-O 2.85Å; N116-G119 PolarHBondContact OD1-N 2.96Å; N116-G119 PolarHBondContact OD1-O 3.03Å
120	S	90.4	Very high	88.4	Confident	72 Å²	72	43.3 Å²	43.3	50%	0.503	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	146.6	176.2	59	0	0	0	0	111.3	A114	A114-S120 CarbonylContact O-C 3.57Å; A114-S120 WeakPolarHBondContact O-CA 3.37Å; A114-S120 WeakPolarHBondContact O-CB 3.4Å
121	D	91.4	Very high	87.8	Confident	59 Å²	59	46.4 Å²	46.4	32%	0.316	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	155.7	177.9	-171.3	15.4	0	0	0	110.2	K39 I40 A114	K39-D121 WeakPolarHBondContact CA-OD2 3.45Å; I40-D121 HydrophobicContact CD1-CB 4.5Å; I40-D121 HydrophobicContact CG1-CB 4.28Å; I40-D121 PolarHBondContact N-OD2 2.95Å; A114-D121 PolarHBondContact N-O 2.75Å; A114-D121 PolarHBondContact O-N 2.82Å
122	S	91.5	Very high	86.8	Confident	68 Å²	68	48.7 Å²	48.7	48%	0.476	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	135.8	-176.8	62.9	0	0	0	0	113.7	C112	C112-S122 CarbonylContact O-C 3.2Å; C112-S122 WeakPolarHBondContact O-CA 3.35Å; C112-S122 WeakPolarHBondContact O-CB 3.47Å
123	A	89	Confident	86	Confident	25 Å²	25	55.8 Å²	55.8	21%	0.207	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	137.1	178.1	0	0	0	0	0	110.8	I40 P43 P44 T111 C112	I40-A123 HydrophobicContact CD1-CB 4.13Å; P43-A123 HydrophobicContact CB-CB 3.48Å; P43-A123 VanDerWaalsContact CB-CB 3.48Å; P44-A123 WeakPolarHBondContact CG-O 3.02Å; T111-A123 CarbonylContact C-O 3.54Å; T111-A123 WeakPolarHBondContact CA-O 3.38Å; C112-A123 PolarHBondContact N-O 3.19Å; C112-A123 PolarHBondContact O-N 3.31Å
124	T	91.3	Very high	84.9	Confident	77 Å²	77	59.8 Å²	59.8	47%	0.472	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	131.4	-173.4	-55.7	0	0	0	0	111.1	T109 V110 T111	T109-T124 HydrophobicContact CG2-CG2 4.22Å; V110-T124 WeakPolarHBondContact O-CA 3.35Å; T111-T124 WeakPolarHBondContact CG2-OG1 3.33Å; T111-T124 VanDerWaalsContact OG1-CG2 3.31Å; T111-T124 WeakPolarHBondContact OG1-CG2 3.27Å; T111-T124 PolarHBondContact OG1-OG1 2.69Å
125	A	88.3	Confident	83.9	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	143.4	167.8	0	0	0	0	0	111.1	P44 L45 D46 F57 T109 V110	P44-A125 HydrophobicContact CB-CB 3.97Å; P44-A125 HydrophobicContact CG-CB 4.45Å; L45-A125 WeakPolarHBondContact O-CB 3.48Å; D46-A125 WeakPolarHBondContact OD1-CA 3.39Å; F57-A125 HydrophobicContact CD1-CB 4.4Å; F57-A125 HydrophobicContact CE1-CB 4.11Å; T109-A125 CarbonylContact C-O 3.41Å; T109-A125 WeakPolarHBondContact CA-O 3.39Å; V110-A125 PolarHBondContact N-O 2.87Å; V110-A125 PolarHBondContact O-N 3.36Å
126	Q	88.6	Confident	83	Confident	115 Å²	115	64.8 Å²	64.8	54%	0.537	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	152.8	166.6	-62.2	-164.7	-4.2	0	0	111.8	D46 T47 T109	D46-Q126 WeakPolarHBondContact CA-O 3.41Å; D46-Q126 PolarHBondContact OD1-N 2.82Å; T47-Q126 PolarHBondContact N-O 2.77Å; T109-Q126 HydrophobicContact CG2-CG 4.47Å
127	I	89.6	Confident	82.7	Confident	2 Å²	2	66.2 Å²	66.2	1%	0.01	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	129.7	172.9	-68.2	164.4	0	0	0	109.7	T47 F57 W73 L101 H105 G107 D108 V110 V129	T47-I127 WeakPolarHBondContact O-CA 3.41Å; F57-I127 HydrophobicContact CE2-CD1 4.44Å; F57-I127 HydrophobicContact CZ-CD1 4.11Å; F57-I127 HydrophobicContact CZ-CG1 3.85Å; W73-I127 HydrophobicContact CH2-CD1 3.21Å; W73-I127 HydrophobicContact CZ2-CD1 3.49Å; W73-I127 VanDerWaalsContact CZ2-CD1 3.49Å; W73-I127 HydrophobicContact CZ3-CD1 3.83Å; L101-I127 HydrophobicContact CD1-CG2 3.84Å; L101-I127 HydrophobicContact CD2-CD1 3.94Å; L101-I127 HydrophobicContact CD2-CG1 4.46Å; L101-I127 HydrophobicContact CD2-CG2 3.95Å; L101-I127 HydrophobicContact CG-CG2 4.46Å; H105-I127 HydrophobicContact CB-CG2 4.39Å; H105-I127 WeakPolarHBondContact O-CB 3.46Å; H105-I127 WeakPolarHBondContact O-CG2 3.38Å; G107-I127 PolarHBondContact N-O 2.88Å; D108-I127 HydrophobicContact CB-CB 4.47Å; D108-I127 HydrophobicContact CB-CD1 3.97Å; D108-I127 PolarHBondContact O-N 2.8Å; V110-I127 HydrophobicContact CG2-CD1 3.69Å; V110-I127 HydrophobicContact CG2-CG1 4.34Å; I127-V129 HydrophobicContact CG2-CG2 3.65Å
128	S	86.8	Confident	82.4	Confident	42 Å²	42	71.2 Å²	71.2	29%	0.294	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	135.5	163.2	-53.7	0	0	0	0	109.7	T47 K48 A49 N106	T47-S128 PolarHBondContact O-N 2.85Å; K48-S128 WeakPolarHBondContact CA-O 3.43Å; A49-S128 PolarHBondContact N-O 2.81Å; N106-S128 WeakPolarHBondContact OD1-CA 3.43Å
129	V	85.5	Confident	82.3	Confident	17 Å²	17	69 Å²	69	10%	0.103	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	111.5	-178.4	-167.8	0	0	0	0	109.8	A49 A51 L101 H105 N106 I127	A49-V129 CarbonylContact O-C 3.31Å; A49-V129 WeakPolarHBondContact O-CA 3.36Å; A51-V129 HydrophobicContact CB-CG1 3.75Å; L101-V129 HydrophobicContact CB-CG2 4.11Å; H105-V129 HydrophobicContact CB-CG2 4.39Å; N106-V129 HydrophobicContact CB-CB 4.09Å; N106-V129 HydrophobicContact CB-CG2 4.19Å; N106-V129 PolarHBondContact OD1-N 2.84Å; I127-V129 HydrophobicContact CG2-CG2 3.65Å
130	Y	84	Confident	82.3	Confident	65 Å²	65	68.8 Å²	68.8	26%	0.255	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	146.1	170.2	-63.9	-68.1	0	0	0	110.7	K48 A49 A51 A132 P137 F140 I218	K48-Y130 HydrophobicContact CB-CE2 3.92Å; A49-Y130 PolarHBondContact O-N 2.83Å; A51-Y130 WeakPolarHBondContact CB-O 3.5Å; A51-Y130 PolarHBondContact N-O 2.89Å; Y130-A132 PolarHBondContact O-N 2.92Å; Y130-P137 HydrophobicContact CD1-CG 4.12Å; Y130-P137 HydrophobicContact CE1-CG 3.66Å; Y130-P137 HydrophobicContact CE2-CG 4.15Å; Y130-F140 HydrophobicContact CD2-CD2 4.18Å; Y130-F140 AromaticContact CD2-CE2 3.83Å; Y130-F140 HydrophobicContact CD2-CE2 3.83Å; Y130-F140 HydrophobicContact CE2-CD2 4.1Å; Y130-F140 AromaticContact CE2-CE2 4Å; Y130-F140 HydrophobicContact CE2-CE2 4Å; Y130-I218 WeakPolarHBondContact CE2-O 3.31Å
131	N	77.5	Confident	82.1	Confident	65 Å²	65	65.6 Å²	65.6	35%	0.348	36%	0.359	S	S	.	.			trans	-68.5	129.3	176.4	-178.5	2.3	0	0	0	110.6	N133 E134	N131-N133 PolarHBondContact O-N 3.23Å; N131-N133 VanDerWaalsContact O-N 3.12Å; N131-N133 PolarHBondContact OD1-N 2.68Å; N131-N133 VanDerWaalsContact OD1-N 3.17Å; N131-E134 HydrophobicContact CB-CB 4.23Å; N131-E134 VanDerWaalsContact CB-CD 3.5Å; N131-E134 HydrophobicContact CB-CG 4.05Å; N131-E134 VanDerWaalsContact CB-OE1 3.24Å; N131-E134 WeakPolarHBondContact CB-OE1 3.25Å; N131-E134 PolarHBondContact ND2-OE1 2.8Å; N131-E134 PolarHBondContact O-N 3.5Å
132	A	71.1	Confident	81.9	Confident	59 Å²	59	68.2 Å²	68.2	49%	0.488	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-17.5	179	0	0	0	0	0	114.3	I50 A51 Y130	I50-A132 HydrophobicContact CG2-CB 3.97Å; A51-A132 HydrophobicContact CB-CB 4.36Å; Y130-A132 PolarHBondContact O-N 2.92Å
133	N	72.6	Confident	81.7	Confident	149 Å²	149	66.3 Å²	66.3	80%	0.797	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-9.2	175.7	-64.1	-21.1	0	0	0	113.5	N131	N131-N133 PolarHBondContact O-N 3.23Å; N131-N133 VanDerWaalsContact O-N 3.12Å; N131-N133 PolarHBondContact OD1-N 2.68Å; N131-N133 VanDerWaalsContact OD1-N 3.17Å
134	E	69.4	Low	81.4	Confident	116 Å²	116	71.3 Å²	71.3	54%	0.542	37%	0.372	S	S	.	.	S	Bend	trans	-93.3	137.7	176.2	-76.3	157.9	-138.8	0	0	109.5	N131 P136	N131-E134 HydrophobicContact CB-CB 4.23Å; N131-E134 VanDerWaalsContact CB-CD 3.5Å; N131-E134 HydrophobicContact CB-CG 4.05Å; N131-E134 VanDerWaalsContact CB-OE1 3.24Å; N131-E134 WeakPolarHBondContact CB-OE1 3.25Å; N131-E134 PolarHBondContact ND2-OE1 2.8Å; N131-E134 PolarHBondContact O-N 3.5Å; E134-P136 WeakPolarHBondContact O-CD 3.44Å
135	T	67.1	Low	81	Confident	133 Å²	133	70.7 Å²	70.7	82%	0.816	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-58.1	124.4	172.5	48.1	0	0	0	0	108.8
136	P	70.7	Confident	80.8	Confident	66 Å²	66	73.2 Å²	73.2	43%	0.429	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-53	142.7	-178	-28.9	35.9	0	0	0	111.2	I50 E134 R138 F140	I50-P136 HydrophobicContact CD1-CB 4.24Å; I50-P136 HydrophobicContact CD1-CG 3.65Å; E134-P136 WeakPolarHBondContact O-CD 3.44Å; P136-R138 PolarHBondContact O-N 2.62Å; P136-F140 HydrophobicContact CB-CB 3.79Å; P136-F140 HydrophobicContact CB-CD1 4.21Å; P136-F140 HydrophobicContact CB-CD2 4.48Å; P136-F140 HydrophobicContact CB-CG 3.92Å
137	P	79.1	Confident	80.6	Confident	46 Å²	46	67.9 Å²	67.9	30%	0.299	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-53.4	136.7	-177.5	-23.8	31.6	0	0	0	110.7	Y130 G139 F140 I218	Y130-P137 HydrophobicContact CD1-CG 4.12Å; Y130-P137 HydrophobicContact CE1-CG 3.66Å; Y130-P137 HydrophobicContact CE2-CG 4.15Å; P137-G139 PolarHBondContact O-N 3.1Å; P137-F140 VanDerWaalsContact O-CB 3.29Å; P137-F140 WeakPolarHBondContact O-CB 3.17Å; P137-F140 PolarHBondContact O-N 2.82Å; P137-I218 HydrophobicContact CB-CG2 3.8Å; P137-I218 HydrophobicContact CG-CG2 4.31Å
138	R	79.4	Confident	80	Confident	235 Å²	235	70.5 Å²	70.5	89%	0.887	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	112.6	-175.3	-176.2	-179.7	-179.7	-179.7	0.4	109.7	P136	P136-R138 PolarHBondContact O-N 2.62Å
139	G	79.9	Confident	79.6	Confident	15 Å²	15	70.9 Å²	70.9	16%	0.155	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	113	-10.4	-174.9	0	0	0	0	0	116	P137 E167 N216	P137-G139 PolarHBondContact O-N 3.1Å; G139-E167 WeakPolarHBondContact CA-O 3.5Å; G139-E167 PolarHBondContact O-N 3.33Å; G139-N216 PolarHBondContact O-ND2 3.12Å
140	F	85.5	Confident	79.2	Confident	19 Å²	19	70.1 Å²	70.1	8%	0.083	37%	0.372	C	S	.	.			trans	-55	136.4	173.7	-170.1	-77.2	0	0	0	110.6	I50 Y130 P136 P137 I218 V221	I50-F140 HydrophobicContact CD1-CD1 4.22Å; I50-F140 HydrophobicContact CD1-CE1 3.71Å; I50-F140 HydrophobicContact CD1-CZ 3.9Å; I50-F140 HydrophobicContact CG1-CE1 4.1Å; I50-F140 HydrophobicContact CG1-CE2 4.13Å; I50-F140 HydrophobicContact CG1-CZ 3.74Å; Y130-F140 HydrophobicContact CD2-CD2 4.18Å; Y130-F140 AromaticContact CD2-CE2 3.83Å; Y130-F140 HydrophobicContact CD2-CE2 3.83Å; Y130-F140 HydrophobicContact CE2-CD2 4.1Å; Y130-F140 AromaticContact CE2-CE2 4Å; Y130-F140 HydrophobicContact CE2-CE2 4Å; P136-F140 HydrophobicContact CB-CB 3.79Å; P136-F140 HydrophobicContact CB-CD1 4.21Å; P136-F140 HydrophobicContact CB-CD2 4.48Å; P136-F140 HydrophobicContact CB-CG 3.92Å; P137-F140 VanDerWaalsContact O-CB 3.29Å; P137-F140 WeakPolarHBondContact O-CB 3.17Å; P137-F140 PolarHBondContact O-N 2.82Å; F140-I218 HydrophobicContact CB-CG2 3.93Å; F140-I218 HydrophobicContact CD2-CG2 4.23Å; F140-V221 HydrophobicContact CE1-CB 4.45Å
141	P	86.7	Confident	78.9	Confident	4 Å²	4	68.4 Å²	68.4	3%	0.026	37%	0.367	C	S	.	.			trans	-65.4	137.2	-173.3	-20.9	33.8	0	0	0	112.8	V164 A166 A170 A214 N216 G219 V221	P141-V164 HydrophobicContact CB-CG1 4.48Å; P141-A166 HydrophobicContact CB-CB 3.9Å; P141-A166 HydrophobicContact CG-CB 4.02Å; P141-A170 HydrophobicContact CB-CB 4.09Å; P141-A170 HydrophobicContact CG-CB 4.09Å; P141-A214 HydrophobicContact CB-CB 4.07Å; P141-N216 WeakPolarHBondContact CD-OD1 3.28Å; P141-N216 HydrophobicContact CG-CB 4.22Å; P141-N216 WeakPolarHBondContact CG-OD1 3.42Å; P141-G219 WeakPolarHBondContact CG-O 3.33Å; P141-V221 HydrophobicContact CB-CG1 4.07Å
142	K	85.6	Confident	78.8	Confident	115 Å²	115	65.3 Å²	65.3	50%	0.5	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	118	-179.6	-179.4	179.4	177.1	-174.8	0	110.2	V164 S165	K142-V164 WeakPolarHBondContact O-CA 3.33Å; K142-S165 PolarHBondContact N-O 2.75Å; K142-S165 PolarHBondContact O-N 3.37Å
143	V	87	Confident	78.7	Confident	27 Å²	27	62.5 Å²	62.5	16%	0.164	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	127.7	164.8	-177.3	0	0	0	0	108.1	Q145 D163 V164 V221	V143-Q145 WeakPolarHBondContact CG1-O 3.34Å; V143-D163 CarbonylContact C-O 3.53Å; V143-D163 WeakPolarHBondContact CA-O 3.39Å; V143-V164 HydrophobicContact CG2-CG2 4.48Å; V143-V221 HydrophobicContact CG2-CG1 3.94Å
144	H	84	Confident	78.6	Confident	130 Å²	130	55.9 Å²	55.9	60%	0.602	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	-26.1	172.7	-65.7	-81.1	0	0	0	112.3	D163 S165	H144-D163 PolarHBondContact N-O 3Å; H144-S165 WeakPolarHBondContact NE2-CA 3.31Å; H144-S165 WeakPolarHBondContact NE2-CB 3.3Å; H144-S165 PolarHBondContact NE2-N 3.19Å; H144-S165 PolarHBondContact NE2-OG 2.68Å
145	Q	82.2	Confident	78.4	Confident	64 Å²	64	50.4 Å²	50.4	30%	0.299	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	126.4	176.4	-172.8	173.9	6.4	0	0	110.3	V143 Q161 C162 D163	V143-Q145 WeakPolarHBondContact CG1-O 3.34Å; Q145-Q161 HydrophobicContact CG-CB 4.27Å; Q145-C162 WeakPolarHBondContact O-CA 3.4Å; Q145-D163 PolarHBondContact O-N 3.08Å
146	D	84.7	Confident	78.9	Confident	54 Å²	54	44 Å²	44	29%	0.289	23%	0.227	S	C	.	.			trans	-82.5	155.3	170.6	-65.9	-57.5	0	0	0	111.4	Q161 S223 N224	D146-Q161 CarbonylContact C-O 3.45Å; D146-S223 VanDerWaalsContact OD1-CA 3.27Å; D146-S223 WeakPolarHBondContact OD1-CA 3.34Å; D146-S223 WeakPolarHBondContact OD1-CB 3.34Å; D146-N224 HydrophobicContact CB-CB 4.03Å; D146-N224 PolarHBondContact OD1-N 2.81Å; D146-N224 PolarHBondContact OD2-ND2 3.25Å
147	P	83.6	Confident	79.4	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.019	21%	0.207	C	C	.	.			trans	-71.6	133.5	164	28.1	-32	0	0	0	111.5	Q161 W174 Y210 S223 N224 S225 G226	P147-Q161 WeakPolarHBondContact CA-O 3.26Å; P147-Q161 WeakPolarHBondContact CB-O 3.1Å; P147-Q161 VanDerWaalsContact N-O 3.17Å; P147-W174 HydrophobicContact CB-CH2 3.81Å; P147-W174 HydrophobicContact CB-CZ3 3.9Å; P147-W174 HydrophobicContact CG-CH2 3.85Å; P147-W174 HydrophobicContact CG-CZ3 3.77Å; P147-Y210 WeakPolarHBondContact CG-O 3.45Å; P147-S223 WeakPolarHBondContact CD-OG 3.47Å; P147-N224 WeakPolarHBondContact CD-O 3.3Å; P147-N224 WeakPolarHBondContact CG-O 3.44Å; P147-S225 CarbonylContact O-C 3.51Å; P147-G226 WeakPolarHBondContact O-CA 3.43Å; P147-G226 PolarHBondContact O-N 3.33Å
148	S	78.5	Confident	79.6	Confident	57 Å²	57	38.7 Å²	38.7	40%	0.399	19%	0.193	S	C	.	.			trans	-112.1	178.1	172.3	-14.5	0	0	0	0	113.5	G226 D1835 K1838	S148-G226 VanDerWaalsContact C-CA 3.42Å; S148-G226 VanDerWaalsContact O-CA 3.31Å; S148-G226 WeakPolarHBondContact O-CA 3.34Å; S148-D1835 VanDerWaalsContact CA-CG 3.43Å; S148-D1835 WeakPolarHBondContact CA-OD1 3.33Å; S148-D1835 WeakPolarHBondContact CB-OD2 3.48Å; S148-D1835 PolarHBondContact N-OD1 3.08Å; S148-D1835 PolarHBondContact N-OD2 2.95Å; S148-D1835 VanDerWaalsContact N-OD2 3.12Å; S148-D1835 PolarHBondContact OG-OD2 3.05Å; S148-K1838 PolarHBondContact O-NZ 3.07Å
149	A	78.2	Confident	79.9	Confident	50 Å²	50	28 Å²	28	41%	0.413	15%	0.153	S	C	.	.			trans	-91.5	138.6	-158.9	0	0	0	0	0	115.1	H227 D1835	A149-H227 CarbonylContact C-O 3.52Å; A149-H227 HydrophobicContact CB-CB 4.07Å; A149-D1835 VanDerWaalsContact O-O 3.06Å
150	T	76.2	Confident	80.4	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-152.9	121.7	-156.3	35.5	0	0	0	0	116.5	S152 H227 L228 H229 D1835 K1838 P1839	T150-S152 PolarHBondContact O-N 3.05Å; T150-H227 PolarHBondContact N-O 2.57Å; T150-L228 CarbonylContact O-C 2.87Å; T150-L228 WeakPolarHBondContact O-CA 3.32Å; T150-H229 PolarHBondContact O-N 3.33Å; T150-D1835 HydrophobicContact CG2-CB 4.21Å; T150-D1835 WeakPolarHBondContact CG2-O 3.38Å; T150-K1838 VanDerWaalsContact CB-C 3.42Å; T150-K1838 HydrophobicContact CG2-CB 3.5Å; T150-K1838 HydrophobicContact CG2-CD 3.37Å; T150-K1838 HydrophobicContact CG2-CG 3.49Å; T150-K1838 VanDerWaalsContact CG2-CG 3.49Å; T150-K1838 WeakPolarHBondContact OG1-CD 2.89Å; T150-P1839 VanDerWaalsContact CG2-CD 3.49Å; T150-P1839 HydrophobicContact CG2-CG 3.99Å
151	I	77.6	Confident	80.3	Confident	30 Å²	30	27.1 Å²	27.1	15%	0.154	15%	0.145	C	C	.	.			trans	-88.9	56	-166.5	-34.7	178	0	0	0	114.9	H229 R231 P1839 E1891	I151-H229 CarbonylContact C-O 3.1Å; I151-H229 HydrophobicContact CB-CB 4.4Å; I151-H229 HydrophobicContact CG2-CB 3.83Å; I151-R231 HydrophobicContact CG2-CG 4Å; I151-P1839 CarbonylContact C-O 3.39Å; I151-P1839 VanDerWaalsContact C-O 3.3Å; I151-P1839 HydrophobicContact CB-CB 3.88Å; I151-P1839 HydrophobicContact CG1-CB 4.34Å; I151-P1839 VanDerWaalsContact N-CB 3.31Å; I151-P1839 CarbonylContact O-C 3.4Å; I151-P1839 WeakPolarHBondContact O-CA 3.43Å; I151-E1891 HydrophobicContact CB-CG 4.16Å; I151-E1891 HydrophobicContact CG2-CG 3.97Å
152	S	74.9	Confident	80.4	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.144	C	C	.	.			trans	-49.4	-172.4	175.6	-104.4	0	0	0	0	115.6	T150 T158 L228 H229 V230 R231 K1838 P1839 N1841	T150-S152 PolarHBondContact O-N 3.05Å; S152-T158 PolarHBondContact OG-OG1 3.35Å; S152-L228 VanDerWaalsContact OG-CD1 3.28Å; S152-L228 WeakPolarHBondContact OG-CD1 3.44Å; S152-H229 CarbonylContact C-O 3.57Å; S152-H229 WeakPolarHBondContact CA-O 3.48Å; S152-H229 WeakPolarHBondContact CB-O 3.46Å; S152-H229 PolarHBondContact N-O 3.49Å; S152-H229 VanDerWaalsContact O-O 3.1Å; S152-V230 CarbonylContact O-C 3.53Å; S152-V230 WeakPolarHBondContact O-CA 3.45Å; S152-R231 PolarHBondContact O-N 2.62Å; S152-R231 VanDerWaalsContact O-N 3.15Å; S152-K1838 PolarHBondContact OG-O 2.86Å; S152-P1839 WeakPolarHBondContact CA-O 3.29Å; S152-P1839 PolarHBondContact N-O 3.44Å; S152-N1841 CarbonylContact C-O 3.34Å; S152-N1841 WeakPolarHBondContact CA-O 3.17Å; S152-N1841 WeakPolarHBondContact CB-O 3.42Å; S152-N1841 PolarHBondContact OG-O 3.39Å
153	Q	70.5	Confident	80.4	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.135	C	C	.	.			trans	-151	-133.8	-167.2	-12	169.2	-55.5	0	0	114.7	V230 N1841 R1842 T1889 E1891 T1892	Q153-V230 WeakPolarHBondContact O-CG1 3.43Å; Q153-V230 WeakPolarHBondContact O-CG2 3.23Å; Q153-N1841 PolarHBondContact N-O 3.22Å; Q153-N1841 VanDerWaalsContact N-O 3.1Å; Q153-R1842 VanDerWaalsContact C-C 3.43Å; Q153-R1842 CarbonylContact C-O 3.5Å; Q153-R1842 HydrophobicContact CB-CB 3.7Å; Q153-R1842 HydrophobicContact CB-CG 3.58Å; Q153-R1842 HydrophobicContact CG-CB 4.07Å; Q153-R1842 HydrophobicContact CG-CG 4.26Å; Q153-T1889 HydrophobicContact CB-CG2 3.34Å; Q153-T1889 WeakPolarHBondContact CB-OG1 3.25Å; Q153-T1889 HydrophobicContact CG-CG2 4.03Å; Q153-T1889 WeakPolarHBondContact CG-OG1 3.36Å; Q153-T1889 PolarHBondContact NE2-OG1 3.1Å; Q153-E1891 PolarHBondContact NE2-OE2 3.44Å; Q153-T1892 PolarHBondContact NE2-OG1 3.02Å; Q153-T1892 PolarHBondContact OE1-OG1 3.35Å
154	V	69.5	Low	80.5	Confident	10 Å²	10	23.6 Å²	23.6	6%	0.061	13%	0.131	C	C	.	.	S	Bend	trans	-136.5	74.6	170.9	-168.5	0	0	0	0	116.9	E204 V230 R1842 Y1843 S2026	V154-E204 HydrophobicContact CG2-CG 4.34Å; V154-V230 HydrophobicContact CG2-CG1 3.65Å; V154-R1842 CarbonylContact C-O 3.56Å; V154-R1842 WeakPolarHBondContact CA-O 3.18Å; V154-R1842 VanDerWaalsContact N-C 3.35Å; V154-R1842 VanDerWaalsContact N-CG 3.26Å; V154-R1842 PolarHBondContact N-O 2.93Å; V154-R1842 WeakPolarHBondContact O-CD 3.07Å; V154-R1842 WeakPolarHBondContact O-CG 3.44Å; V154-R1842 PolarHBondContact O-NE 2.97Å; V154-R1842 PolarHBondContact O-NH1 2.88Å; V154-Y1843 HydrophobicContact CB-CE1 4.21Å; V154-Y1843 HydrophobicContact CG1-CD1 4.33Å; V154-Y1843 HydrophobicContact CG1-CE1 3.52Å; V154-S2026 PolarHBondContact O-OG 3.41Å
155	G	65.3	Low	80.6	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.119	C	C	.	.	S	Bend	trans	173.8	-60.2	-178.4	0	0	0	0	0	124.8	R1842 Y1843 V1846 A2027	G155-R1842 VanDerWaalsContact CA-CB 3.47Å; G155-R1842 VanDerWaalsContact CA-CD 3.43Å; G155-R1842 VanDerWaalsContact N-CG 3.34Å; G155-R1842 PolarHBondContact N-O 3.29Å; G155-Y1843 VanDerWaalsContact CA-CD1 3.5Å; G155-Y1843 VanDerWaalsContact CA-N 3.33Å; G155-Y1843 WeakPolarHBondContact O-CB 3.2Å; G155-Y1843 WeakPolarHBondContact O-CD2 3.5Å; G155-Y1843 VanDerWaalsContact O-CG 3.22Å; G155-V1846 WeakPolarHBondContact O-CB 2.9Å; G155-A2027 WeakPolarHBondContact O-CA 3.49Å; G155-A2027 WeakPolarHBondContact O-CB 3.42Å
156	D	77.7	Confident	80.6	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.114	C	C	.	.	S	Bend	trans	-85.8	-143.9	-174.1	14.7	-47.3	0	0	0	118.1	N1841 R1842 Y1843 A1844 N1845 V1846 N1869 Q1886	D156-N1841 WeakPolarHBondContact OD2-CA 2.99Å; D156-N1841 PolarHBondContact OD2-N 3.49Å; D156-R1842 VanDerWaalsContact CG-CB 3.43Å; D156-R1842 WeakPolarHBondContact OD1-CB 3.26Å; D156-R1842 PolarHBondContact OD1-N 3.5Å; D156-R1842 PolarHBondContact OD2-N 3.29Å; D156-Y1843 VanDerWaalsContact C-C 3.42Å; D156-Y1843 CarbonylContact C-O 3.41Å; D156-Y1843 CarbonylContact O-C 3.53Å; D156-Y1843 WeakPolarHBondContact O-CA 3.31Å; D156-Y1843 WeakPolarHBondContact O-CB 3.36Å; D156-Y1843 PolarHBondContact O-N 2.9Å; D156-A1844 PolarHBondContact O-N 3.31Å; D156-N1845 CarbonylContact O-C 3.58Å; D156-N1845 WeakPolarHBondContact O-CA 3.43Å; D156-N1845 PolarHBondContact O-N 3.03Å; D156-V1846 VanDerWaalsContact C-N 3.3Å; D156-V1846 CarbonylContact C-O 3.54Å; D156-V1846 VanDerWaalsContact CA-O 3.26Å; D156-V1846 WeakPolarHBondContact CA-O 3.34Å; D156-V1846 PolarHBondContact O-N 3.47Å; D156-N1869 HydrophobicContact CB-CB 3.51Å; D156-N1869 VanDerWaalsContact CB-ND2 3.35Å; D156-N1869 WeakPolarHBondContact CB-ND2 3.42Å; D156-N1869 WeakPolarHBondContact CB-OD1 3.34Å; D156-N1869 WeakPolarHBondContact OD2-CB 3.29Å; D156-Q1886 HydrophobicContact CB-CB 4.23Å; D156-Q1886 WeakPolarHBondContact OD1-CB 3.3Å; D156-Q1886 WeakPolarHBondContact OD1-CG 3.35Å; D156-Q1886 PolarHBondContact OD2-NE2 2.9Å; D156-Q1886 PolarHBondContact OD2-OE1 2.91Å
157	S	80.7	Confident	80.4	Confident	0 Å²	0	22 Å²	22	0%	0	13%	0.132	C	C	.	.	B	Isolated β-bridge	trans	-142.3	116	174.5	-87.2	0	0	0	0	117.8	S1832 N1841 Y1843 A1844 N1845 V1846 I1847 N1869	S157-S1832 WeakPolarHBondContact O-CB 3.4Å; S157-N1841 VanDerWaalsContact C-ND2 3.34Å; S157-N1841 PolarHBondContact N-OD1 3.43Å; S157-N1841 PolarHBondContact O-ND2 3.13Å; S157-N1841 PolarHBondContact O-OD1 2.71Å; S157-Y1843 WeakPolarHBondContact CA-O 3.19Å; S157-Y1843 PolarHBondContact N-O 3Å; S157-A1844 WeakPolarHBondContact CB-O 3.03Å; S157-A1844 PolarHBondContact OG-O 3.33Å; S157-N1845 VanDerWaalsContact CB-N 3.28Å; S157-N1845 WeakPolarHBondContact OG-CA 3.45Å; S157-N1845 PolarHBondContact OG-N 3.01Å; S157-V1846 VanDerWaalsContact CB-C 3.42Å; S157-V1846 PolarHBondContact N-O 3.4Å; S157-V1846 VanDerWaalsContact OG-C 3.3Å; S157-V1846 WeakPolarHBondContact OG-CA 3.29Å; S157-V1846 PolarHBondContact OG-N 2.78Å; S157-I1847 VanDerWaalsContact CB-CA 3.43Å; S157-I1847 VanDerWaalsContact CB-N 3.34Å; S157-I1847 WeakPolarHBondContact O-CG2 3.5Å; S157-I1847 PolarHBondContact OG-N 2.78Å; S157-I1847 VanDerWaalsContact OG-N 3.16Å; S157-N1869 PolarHBondContact N-ND2 2.81Å; S157-N1869 VanDerWaalsContact N-ND2 3.11Å
158	T	83.4	Confident	80.3	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.149	C	C	.	.			trans	-61.3	131.2	138.2	-68	0	0	0	0	114	S152 L160 L228 K1838 N1841 Y1843 A1844	S152-T158 PolarHBondContact OG-OG1 3.35Å; T158-L160 HydrophobicContact CG2-CD2 4.18Å; T158-L160 HydrophobicContact CG2-CG 3.96Å; T158-L228 HydrophobicContact CG2-CD1 3.68Å; T158-L228 HydrophobicContact CG2-CD2 4.36Å; T158-K1838 HydrophobicContact CG2-CB 3.38Å; T158-K1838 HydrophobicContact CG2-CD 3.81Å; T158-K1838 HydrophobicContact CG2-CG 3.88Å; T158-K1838 WeakPolarHBondContact OG1-CA 3.42Å; T158-K1838 WeakPolarHBondContact OG1-CB 3.37Å; T158-K1838 PolarHBondContact OG1-O 3.32Å; T158-N1841 VanDerWaalsContact N-CB 3.27Å; T158-N1841 WeakPolarHBondContact OG1-CB 3.16Å; T158-Y1843 PolarHBondContact N-O 3.17Å; T158-A1844 HydrophobicContact CG2-CB 4.03Å; T158-A1844 VanDerWaalsContact N-CA 3.28Å; T158-A1844 CarbonylContact O-C 3.57Å; T158-A1844 VanDerWaalsContact O-C 3.24Å; T158-A1844 VanDerWaalsContact O-CA 3.3Å; T158-A1844 WeakPolarHBondContact O-CA 3.42Å; T158-A1844 WeakPolarHBondContact O-CB 3.42Å
159	H	86.7	Confident	80.4	Confident	9 Å²	9	29.9 Å²	29.9	4%	0.042	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	130.7	163.6	172	-169.4	0	0	0	107.6	Q161 V192 S196 L197 V198 W1829 N1833 K1838	H159-Q161 PolarHBondContact O-N 3.13Å; H159-V192 WeakPolarHBondContact CE1-CG2 3.31Å; H159-V192 VanDerWaalsContact NE2-CG2 3.28Å; H159-V192 WeakPolarHBondContact NE2-CG2 3.39Å; H159-S196 VanDerWaalsContact NE2-C 3.28Å; H159-S196 WeakPolarHBondContact NE2-CB 3.17Å; H159-S196 PolarHBondContact NE2-O 3.49Å; H159-L197 CarbonylContact C-O 3.45Å; H159-L197 WeakPolarHBondContact CA-O 3.45Å; H159-L197 PolarHBondContact CD2-O 2.84Å; H159-V198 HydrophobicContact CB-CG1 4.22Å; H159-V198 PolarHBondContact CD2-N 2.9Å; H159-V198 VanDerWaalsContact CD2-N 3.33Å; H159-W1829 AromaticContact CE1-CD1 3.9Å; H159-W1829 AromaticContact CE1-NE1 3.44Å; H159-W1829 PolarHBondContact CE1-NE1 3.39Å; H159-W1829 AromaticContact CG-CD1 3.75Å; H159-W1829 AromaticContact CG-NE1 3.61Å; H159-W1829 AromaticContact ND1-CD1 2.97Å; H159-W1829 AromaticContact ND1-CE2 3.96Å; H159-W1829 AromaticContact ND1-NE1 2.84Å; H159-W1829 PolarHBondContact ND1-NE1 2.97Å; H159-N1833 HydrophobicContact CB-CB 4.17Å; H159-N1833 VanDerWaalsContact CB-OD1 3.23Å; H159-N1833 WeakPolarHBondContact CB-OD1 3.49Å; H159-N1833 PolarHBondContact CE1-ND2 2.6Å; H159-N1833 VanDerWaalsContact CG-ND2 3.29Å; H159-N1833 PolarHBondContact ND1-ND2 3.16Å; H159-N1833 PolarHBondContact ND1-OD1 2.87Å; H159-N1833 PolarHBondContact NE2-ND2 3.38Å; H159-N1833 WeakPolarHBondContact O-CA 3.45Å; H159-N1833 VanDerWaalsContact O-CB 3.22Å; H159-N1833 WeakPolarHBondContact O-CB 3.45Å; H159-K1838 WeakPolarHBondContact O-CE 3.3Å
160	L	89.4	Confident	80.7	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	110.3	-173.6	-55	131	0	0	0	111.4	T158 C162 W174 S196 L197 I199 Y210 K1838	T158-L160 HydrophobicContact CG2-CD2 4.18Å; T158-L160 HydrophobicContact CG2-CG 3.96Å; L160-C162 PolarHBondContact O-N 2.85Å; L160-W174 HydrophobicContact CB-CE3 4.22Å; L160-W174 HydrophobicContact CB-CH2 3.24Å; L160-W174 HydrophobicContact CB-CZ2 3.9Å; L160-W174 HydrophobicContact CB-CZ3 3.42Å; L160-W174 VanDerWaalsContact CB-CZ3 3.42Å; L160-W174 HydrophobicContact CD1-CE3 4.32Å; L160-W174 HydrophobicContact CD1-CZ3 4.2Å; L160-W174 HydrophobicContact CD2-CZ3 4.48Å; L160-W174 HydrophobicContact CG-CH2 4.47Å; L160-W174 HydrophobicContact CG-CZ3 4.23Å; L160-W174 WeakPolarHBondContact O-CH2 3.04Å; L160-W174 WeakPolarHBondContact O-CZ2 3.48Å; L160-S196 CarbonylContact O-C 3.6Å; L160-S196 WeakPolarHBondContact O-CA 3.27Å; L160-S196 WeakPolarHBondContact O-CB 3.49Å; L160-L197 HydrophobicContact CB-CB 4.38Å; L160-L197 HydrophobicContact CD1-CB 4.15Å; L160-L197 HydrophobicContact CD1-CD2 3.75Å; L160-L197 HydrophobicContact CD1-CG 4.17Å; L160-L197 PolarHBondContact N-O 2.02Å; L160-L197 PolarHBondContact O-N 2.91Å; L160-I199 HydrophobicContact CD1-CD1 3.91Å; L160-Y210 HydrophobicContact CD1-CD1 3.35Å; L160-Y210 HydrophobicContact CD1-CE1 3.76Å; L160-Y210 HydrophobicContact CD1-CG 3.88Å; L160-Y210 HydrophobicContact CD2-CD1 4.25Å; L160-Y210 HydrophobicContact CD2-CD2 4.36Å; L160-Y210 HydrophobicContact CD2-CG 3.89Å; L160-Y210 HydrophobicContact CG-CD1 4.45Å; L160-K1838 VanDerWaalsContact CA-CE 3.47Å; L160-K1838 HydrophobicContact CD2-CD 4.2Å; L160-K1838 VanDerWaalsContact CD2-NZ 3.3Å
161	Q	84.8	Confident	81.2	Confident	17 Å²	17	32 Å²	32	8%	0.079	18%	0.176	C	C	.	.			trans	-59.4	127.9	174.3	-58.9	-161	-92.6	0	0	110.6	Q145 D146 P147 H159 S196 N1833	Q145-Q161 HydrophobicContact CG-CB 4.27Å; D146-Q161 CarbonylContact C-O 3.45Å; P147-Q161 WeakPolarHBondContact CA-O 3.26Å; P147-Q161 WeakPolarHBondContact CB-O 3.1Å; P147-Q161 VanDerWaalsContact N-O 3.17Å; H159-Q161 PolarHBondContact O-N 3.13Å; Q161-S196 WeakPolarHBondContact CA-OG 3.41Å; Q161-N1833 HydrophobicContact CG-CB 3.3Å
162	C	88.6	Confident	81.7	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.174	C	C	.	.			trans	-152.5	105.1	162.5	174.4	0	0	0	0	105.5	Q145 L160 V164 W174 G195 S196 C212	Q145-C162 WeakPolarHBondContact O-CA 3.4Å; L160-C162 PolarHBondContact O-N 2.85Å; C162-V164 VanDerWaalsContact SG-CG2 3.51Å; C162-W174 HydrophobicContact CB-CH2 3.81Å; C162-W174 HydrophobicContact CB-CZ2 3.29Å; C162-G195 CarbonylContact O-C 3.46Å; C162-G195 WeakPolarHBondContact O-CA 3.19Å; C162-G195 PolarHBondContact O-N 3.01Å; C162-S196 PolarHBondContact N-OG 3.5Å; C162-S196 PolarHBondContact O-N 3.3Å; C162-S196 PolarHBondContact O-OG 3.4Å; C162-C212 HydrophobicContact CB-CB 3.57Å; C162-C212 WeakPolarHBondContact CB-SG 3.46Å; C162-C212 WeakPolarHBondContact SG-CB 3.49Å; C162-C212 CovalentContact SG-SG 2.02Å; C162-C212 PolarHBondContact SG-SG 3.08Å
163	D	85.9	Confident	82.3	Confident	58 Å²	58	35.3 Å²	35.3	31%	0.31	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	132.5	173.7	-88.6	-39.7	0	0	0	110.1	V143 H144 Q145 S194	V143-D163 CarbonylContact C-O 3.53Å; V143-D163 WeakPolarHBondContact CA-O 3.39Å; H144-D163 PolarHBondContact N-O 3Å; Q145-D163 PolarHBondContact O-N 3.08Å; D163-S194 WeakPolarHBondContact CA-OG 3.47Å; D163-S194 WeakPolarHBondContact CB-OG 3.45Å; D163-S194 PolarHBondContact OD1-OG 3.19Å
164	V	88.2	Confident	83.2	Confident	14 Å²	14	35.3 Å²	35.3	9%	0.085	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	121	-167.5	-176.8	0	0	0	0	109.7	P141 K142 V143 C162 A170 V172 S194 A214	P141-V164 HydrophobicContact CB-CG1 4.48Å; K142-V164 WeakPolarHBondContact O-CA 3.33Å; V143-V164 HydrophobicContact CG2-CG2 4.48Å; C162-V164 VanDerWaalsContact SG-CG2 3.51Å; V164-A170 HydrophobicContact CG1-CB 4.19Å; V164-V172 HydrophobicContact CB-CG2 4.25Å; V164-V172 HydrophobicContact CG1-CG2 4.44Å; V164-V172 HydrophobicContact CG2-CG2 3.89Å; V164-S194 PolarHBondContact N-OG 3Å; V164-S194 WeakPolarHBondContact O-CB 3.46Å; V164-A214 HydrophobicContact CB-CB 4.39Å; V164-A214 HydrophobicContact CG1-CB 3.47Å; V164-A214 VanDerWaalsContact CG1-CB 3.47Å; V164-A214 HydrophobicContact CG2-CB 4Å
165	S	85.5	Confident	84.1	Confident	49 Å²	49	34.8 Å²	34.8	34%	0.343	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	134.1	163.3	69.5	0	0	0	0	110.5	K142 H144	K142-S165 PolarHBondContact N-O 2.75Å; K142-S165 PolarHBondContact O-N 3.37Å; H144-S165 WeakPolarHBondContact NE2-CA 3.31Å; H144-S165 WeakPolarHBondContact NE2-CB 3.3Å; H144-S165 PolarHBondContact NE2-N 3.19Å; H144-S165 PolarHBondContact NE2-OG 2.68Å
166	A	81.9	Confident	85.2	Confident	25 Å²	25	35.4 Å²	35.4	21%	0.207	19%	0.189	C	C	.	.			trans	-150.9	151	169.4	0	0	0	0	0	109	P141 P168 Q169 A170	P141-A166 HydrophobicContact CB-CB 3.9Å; P141-A166 HydrophobicContact CG-CB 4.02Å; A166-P168 CarbonylContact C-O 3.53Å; A166-P168 WeakPolarHBondContact CB-O 3.47Å; A166-P168 CarbonylContact O-C 3.55Å; A166-Q169 PolarHBondContact O-N 3.33Å; A166-A170 HydrophobicContact CB-CB 3.62Å
167	E	80.4	Confident	85.5	Confident	141 Å²	141	38 Å²	38	66%	0.659	20%	0.203	S	C	*	.	S	Bend	trans	-139.6	99.1	178.7	-172.4	165.6	-144.3	0	0	109.3	G139 I218	G139-E167 WeakPolarHBondContact CA-O 3.5Å; G139-E167 PolarHBondContact O-N 3.33Å; E167-I218 WeakPolarHBondContact O-CD1 3.38Å
168	P	83.2	Confident	85.6	Confident	58 Å²	58	42.1 Å²	42.1	38%	0.377	22%	0.222	S	C	.	.	S	Bend	cis	-68.8	159.6	7.4	30.2	-36.9	0	0	0	113.8	A166 N216 E217	A166-P168 CarbonylContact C-O 3.53Å; A166-P168 WeakPolarHBondContact CB-O 3.47Å; A166-P168 CarbonylContact O-C 3.55Å; P168-N216 PolarHBondContact O-ND2 3.1Å; P168-E217 HydrophobicContact CG-CG 3.92Å; P168-E217 WeakPolarHBondContact CG-OE1 3.26Å
169	Q	79.9	Confident	85.4	Confident	166 Å²	166	42.9 Å²	42.9	78%	0.776	23%	0.225	S	C	*	.	P	Polyproline II helix	trans	-53.3	137.4	-177.6	-171.8	176.6	7.3	0	0	112.1	A166	A166-Q169 PolarHBondContact O-N 3.33Å
170	A	84	Confident	85	Confident	14 Å²	14	45 Å²	45	12%	0.116	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-87	141.3	-179.5	0	0	0	0	0	111.7	P141 V164 A166 A214 R215 N216	P141-A170 HydrophobicContact CB-CB 4.09Å; P141-A170 HydrophobicContact CG-CB 4.09Å; V164-A170 HydrophobicContact CG1-CB 4.19Å; A166-A170 HydrophobicContact CB-CB 3.62Å; A170-A214 HydrophobicContact CB-CB 4.27Å; A170-R215 CarbonylContact C-O 3.56Å; A170-R215 VanDerWaalsContact CA-O 3.23Å; A170-R215 WeakPolarHBondContact CA-O 3.33Å; A170-R215 WeakPolarHBondContact CB-O 3.39Å; A170-N216 HydrophobicContact CB-CB 4.31Å
171	T	86.2	Confident	84.6	Confident	80 Å²	80	47.4 Å²	47.4	49%	0.491	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	129.3	160.8	-44.6	0	0	0	0	108.3	Y173 R215	T171-Y173 HydrophobicContact CG2-CD2 4.44Å; T171-Y173 HydrophobicContact CG2-CE1 4.35Å; T171-Y173 HydrophobicContact CG2-CE2 3.67Å; T171-R215 PolarHBondContact N-O 2.92Å; T171-R215 PolarHBondContact O-N 3.04Å
172	V	88.4	Confident	84.4	Confident	17 Å²	17	47 Å²	47	10%	0.103	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	137	176.7	-173.2	0	0	0	0	109.3	V164 I191 G195 C212 M213 A214	V164-V172 HydrophobicContact CB-CG2 4.25Å; V164-V172 HydrophobicContact CG1-CG2 4.44Å; V164-V172 HydrophobicContact CG2-CG2 3.89Å; V172-I191 WeakPolarHBondContact O-CD1 3.38Å; V172-G195 WeakPolarHBondContact CG1-O 3.33Å; V172-C212 HydrophobicContact CG1-CB 3.99Å; V172-M213 CarbonylContact C-O 3.49Å; V172-M213 WeakPolarHBondContact CA-O 3.12Å; V172-A214 HydrophobicContact CG2-CB 4.28Å
173	Y	88.4	Confident	83.9	Confident	83 Å²	83	50.4 Å²	50.4	33%	0.325	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	158.6	174.8	-57.4	-93.7	0	0	0	109	T171 L181 C212 M213	T171-Y173 HydrophobicContact CG2-CD2 4.44Å; T171-Y173 HydrophobicContact CG2-CE1 4.35Å; T171-Y173 HydrophobicContact CG2-CE2 3.67Å; Y173-L181 HydrophobicContact CD1-CD2 4.26Å; Y173-C212 CarbonylContact O-C 3.59Å; Y173-C212 VanDerWaalsContact O-CA 3.3Å; Y173-C212 WeakPolarHBondContact O-CA 3.42Å; Y173-M213 HydrophobicContact CD2-CE 4.01Å; Y173-M213 HydrophobicContact CG-CE 4.24Å; Y173-M213 PolarHBondContact N-O 2.93Å; Y173-M213 PolarHBondContact O-N 2.93Å
174	W	90	Very high	83.3	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	146.4	176.6	-80	77.7	0	0	0	112.4	P147 L160 C162 I182 G195 L197 Y210 E211 C212	P147-W174 HydrophobicContact CB-CH2 3.81Å; P147-W174 HydrophobicContact CB-CZ3 3.9Å; P147-W174 HydrophobicContact CG-CH2 3.85Å; P147-W174 HydrophobicContact CG-CZ3 3.77Å; L160-W174 HydrophobicContact CB-CE3 4.22Å; L160-W174 HydrophobicContact CB-CH2 3.24Å; L160-W174 HydrophobicContact CB-CZ2 3.9Å; L160-W174 HydrophobicContact CB-CZ3 3.42Å; L160-W174 VanDerWaalsContact CB-CZ3 3.42Å; L160-W174 HydrophobicContact CD1-CE3 4.32Å; L160-W174 HydrophobicContact CD1-CZ3 4.2Å; L160-W174 HydrophobicContact CD2-CZ3 4.48Å; L160-W174 HydrophobicContact CG-CH2 4.47Å; L160-W174 HydrophobicContact CG-CZ3 4.23Å; L160-W174 WeakPolarHBondContact O-CH2 3.04Å; L160-W174 WeakPolarHBondContact O-CZ2 3.48Å; C162-W174 HydrophobicContact CB-CH2 3.81Å; C162-W174 HydrophobicContact CB-CZ2 3.29Å; W174-I182 HydrophobicContact CB-CB 4.11Å; W174-I182 HydrophobicContact CB-CD1 4.04Å; W174-I182 HydrophobicContact CB-CG1 4.4Å; W174-I182 PolarHBondContact O-N 2.85Å; W174-G195 PolarHBondContact NE1-O 3.19Å; W174-L197 HydrophobicContact CB-CD2 3.76Å; W174-L197 HydrophobicContact CD2-CB 3.54Å; W174-L197 HydrophobicContact CD2-CD2 3.99Å; W174-L197 HydrophobicContact CD2-CG 4.37Å; W174-L197 VanDerWaalsContact CE2-CB 3.41Å; W174-L197 HydrophobicContact CE3-CB 4.24Å; W174-L197 HydrophobicContact CE3-CD2 4.28Å; W174-L197 HydrophobicContact CG-CB 3.67Å; W174-L197 HydrophobicContact CG-CD2 3.78Å; W174-L197 HydrophobicContact CG-CG 4.19Å; W174-L197 HydrophobicContact CZ2-CB 3.98Å; W174-Y210 HydrophobicContact CE3-CD1 4.46Å; W174-E211 WeakPolarHBondContact CA-O 3.4Å; W174-E211 VanDerWaalsContact CE3-O 3.26Å; W174-C212 HydrophobicContact CD2-CB 3.9Å; W174-C212 HydrophobicContact CE3-CB 4.25Å; W174-C212 HydrophobicContact CG-CB 4.44Å; W174-C212 HydrophobicContact CH2-CB 4.07Å; W174-C212 HydrophobicContact CZ2-CB 3.75Å; W174-C212 HydrophobicContact CZ3-CB 4.32Å
175	I	88.3	Confident	82.4	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	116.9	-168.7	-61	157.7	0	0	0	108	L56 Y210 E211 M213 L222	L56-I175 HydrophobicContact CB-CD1 4.18Å; L56-I175 HydrophobicContact CD2-CD1 3.59Å; L56-I175 HydrophobicContact CD2-CG1 3.74Å; L56-I175 HydrophobicContact CD2-CG2 4.17Å; L56-I175 HydrophobicContact CG-CD1 4.49Å; I175-Y210 CarbonylContact O-C 3.52Å; I175-Y210 WeakPolarHBondContact O-CA 3.49Å; I175-E211 HydrophobicContact CB-CB 4.48Å; I175-E211 PolarHBondContact N-O 2.95Å; I175-E211 PolarHBondContact O-N 3.05Å; I175-M213 HydrophobicContact CD1-CB 3.97Å; I175-L222 HydrophobicContact CD1-CD2 3.57Å
176	K	86.8	Confident	81.8	Confident	13 Å²	13	53.3 Å²	53.3	6%	0.057	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	145.6	172.1	178.2	177.9	-178.7	-65.2	0	110.5	Q178 F179 E180 I182 D206 S207 A209 Y210	K176-Q178 PolarHBondContact O-N 3.27Å; K176-Q178 VanDerWaalsContact O-N 3.09Å; K176-F179 PolarHBondContact O-N 2.99Å; K176-F179 VanDerWaalsContact O-N 3.1Å; K176-E180 HydrophobicContact CB-CB 4.08Å; K176-E180 HydrophobicContact CB-CG 4.46Å; K176-E180 PolarHBondContact N-O 3.14Å; K176-E180 IonicContact NZ-OE2 3.7Å; K176-E180 PolarHBondContact NZ-OE2 3.02Å; K176-E180 WeakPolarHBondContact O-CA 3.36Å; K176-E180 VanDerWaalsContact O-CB 3.25Å; K176-E180 WeakPolarHBondContact O-CB 3.36Å; K176-E180 PolarHBondContact O-N 3.19Å; K176-I182 HydrophobicContact CB-CD1 4.14Å; K176-I182 HydrophobicContact CB-CG1 4.28Å; K176-D206 WeakPolarHBondContact CE-O 3.31Å; K176-S207 VanDerWaalsContact CE-O 3.28Å; K176-S207 WeakPolarHBondContact CE-O 3.41Å; K176-S207 PolarHBondContact NZ-O 3.45Å; K176-S207 VanDerWaalsContact NZ-O 3.11Å; K176-A209 CarbonylContact C-O 3.33Å; K176-A209 WeakPolarHBondContact CA-O 3.43Å; K176-Y210 HydrophobicContact CB-CE1 4.38Å; K176-Y210 HydrophobicContact CD-CE1 4.48Å; K176-Y210 HydrophobicContact CD-CE2 4.14Å; K176-Y210 HydrophobicContact CG-CE2 4.1Å
177	D	85.1	Confident	81.4	Confident	55 Å²	55	56.2 Å²	56.2	29%	0.294	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	40	53.6	178.8	-62.2	-46.9	0	0	0	112.7	K88 F179 G208 A209	K88-D177 PolarHBondContact NZ-O 2.86Å; D177-F179 WeakPolarHBondContact O-CD2 3.34Å; D177-F179 PolarHBondContact O-N 3.34Å; D177-G208 WeakPolarHBondContact OD1-CA 3.46Å; D177-A209 PolarHBondContact N-O 2.78Å; D177-A209 PolarHBondContact OD1-N 2.91Å
178	Q	82.3	Confident	81.6	Confident	85 Å²	85	50.8 Å²	50.8	40%	0.397	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	-6.7	177.4	-65	175.6	-16.7	0	0	117.8	R98 K176	R98-Q178 PolarHBondContact NH1-O 3.24Å; K176-Q178 PolarHBondContact O-N 3.27Å; K176-Q178 VanDerWaalsContact O-N 3.09Å
179	F	80.3	Confident	81.8	Confident	16 Å²	16	48.6 Å²	48.6	7%	0.07	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-153.4	-25.6	-171.4	-59	-94.6	0	0	0	116.2	L56 Q86 K88 L90 A96 R98 K176 D177 L181	L56-F179 HydrophobicContact CD1-CD1 4.2Å; Q86-F179 HydrophobicContact CB-CE1 3.99Å; Q86-F179 HydrophobicContact CB-CZ 3.58Å; K88-F179 HydrophobicContact CB-CB 4.13Å; K88-F179 HydrophobicContact CB-CD1 3.62Å; K88-F179 HydrophobicContact CB-CD2 4.09Å; K88-F179 HydrophobicContact CB-CE1 3.98Å; K88-F179 HydrophobicContact CB-CE2 4.43Å; K88-F179 HydrophobicContact CB-CG 3.69Å; K88-F179 HydrophobicContact CB-CZ 4.38Å; K88-F179 HydrophobicContact CD-CB 3.43Å; K88-F179 VanDerWaalsContact CD-CB 3.43Å; K88-F179 HydrophobicContact CD-CD1 4.33Å; K88-F179 HydrophobicContact CD-CD2 3.51Å; K88-F179 HydrophobicContact CD-CE2 4.34Å; K88-F179 HydrophobicContact CD-CG 3.52Å; K88-F179 HydrophobicContact CG-CB 4.43Å; K88-F179 HydrophobicContact CG-CD2 4.41Å; K88-F179 HydrophobicContact CG-CG 4.28Å; L90-F179 WeakPolarHBondContact CD1-O 3.41Å; L90-F179 HydrophobicContact CD2-CB 4Å; A96-F179 HydrophobicContact CB-CB 4.24Å; A96-F179 HydrophobicContact CB-CD1 4.02Å; R98-F179 HydrophobicContact CB-CD1 4.38Å; R98-F179 HydrophobicContact CB-CE1 3.74Å; R98-F179 HydrophobicContact CB-CZ 4.26Å; K176-F179 PolarHBondContact O-N 2.99Å; K176-F179 VanDerWaalsContact O-N 3.1Å; D177-F179 WeakPolarHBondContact O-CD2 3.34Å; D177-F179 PolarHBondContact O-N 3.34Å; F179-L181 PolarHBondContact O-N 2.85Å
180	E	77.3	Confident	82	Confident	55 Å²	55	46.9 Å²	46.9	26%	0.257	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	91	-175.8	-176.4	-178.3	179.4	0	0	108.7	L90 K176 I182	L90-E180 HydrophobicContact CD2-CB 4.46Å; K176-E180 HydrophobicContact CB-CB 4.08Å; K176-E180 HydrophobicContact CB-CG 4.46Å; K176-E180 PolarHBondContact N-O 3.14Å; K176-E180 IonicContact NZ-OE2 3.7Å; K176-E180 PolarHBondContact NZ-OE2 3.02Å; K176-E180 WeakPolarHBondContact O-CA 3.36Å; K176-E180 VanDerWaalsContact O-CB 3.25Å; K176-E180 WeakPolarHBondContact O-CB 3.36Å; K176-E180 PolarHBondContact O-N 3.19Å; E180-I182 PolarHBondContact O-N 2.81Å
181	L	80.2	Confident	82.1	Confident	49 Å²	49	49 Å²	49	26%	0.257	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	122.6	-176.6	-144.2	163.2	0	0	0	109	L56 F58 Y173 F179 D183	L56-L181 HydrophobicContact CD2-CD1 4.37Å; F58-L181 HydrophobicContact CB-CD1 3.73Å; F58-L181 HydrophobicContact CD1-CD1 4.45Å; F58-L181 HydrophobicContact CD2-CB 4.19Å; F58-L181 HydrophobicContact CD2-CD1 3.87Å; F58-L181 HydrophobicContact CE2-CB 4.3Å; F58-L181 HydrophobicContact CG-CD1 3.78Å; Y173-L181 HydrophobicContact CD1-CD2 4.26Å; F179-L181 PolarHBondContact O-N 2.85Å; L181-D183 PolarHBondContact O-N 2.85Å
182	I	82.6	Confident	81.9	Confident	9 Å²	9	47.2 Å²	47.2	5%	0.046	24%	0.244	C	C	.	.			trans	-79.7	117.8	-169.9	-69.2	-175.7	0	0	0	110.1	W174 K176 E180 T184 F189 L197 Y210	W174-I182 HydrophobicContact CB-CB 4.11Å; W174-I182 HydrophobicContact CB-CD1 4.04Å; W174-I182 HydrophobicContact CB-CG1 4.4Å; W174-I182 PolarHBondContact O-N 2.85Å; K176-I182 HydrophobicContact CB-CD1 4.14Å; K176-I182 HydrophobicContact CB-CG1 4.28Å; E180-I182 PolarHBondContact O-N 2.81Å; I182-T184 PolarHBondContact O-N 3.38Å; I182-T184 VanDerWaalsContact O-N 3.12Å; I182-F189 HydrophobicContact CB-CD1 4.48Å; I182-F189 HydrophobicContact CD1-CE1 4.21Å; I182-F189 HydrophobicContact CG1-CE1 4.42Å; I182-F189 HydrophobicContact CG2-CB 3.75Å; I182-F189 HydrophobicContact CG2-CD1 3.09Å; I182-F189 HydrophobicContact CG2-CD2 3.84Å; I182-F189 HydrophobicContact CG2-CE1 3.44Å; I182-F189 VanDerWaalsContact CG2-CE1 3.44Å; I182-F189 HydrophobicContact CG2-CE2 4.14Å; I182-F189 HydrophobicContact CG2-CG 3.32Å; I182-F189 HydrophobicContact CG2-CZ 3.97Å; I182-L197 HydrophobicContact CD1-CD2 3.49Å; I182-L197 VanDerWaalsContact CD1-CD2 3.49Å; I182-L197 HydrophobicContact CG2-CD1 4.29Å; I182-L197 HydrophobicContact CG2-CD2 4.04Å; I182-Y210 HydrophobicContact CD1-CD1 3.6Å; I182-Y210 HydrophobicContact CD1-CE1 3.35Å
183	D	76.7	Confident	81.4	Confident	72 Å²	72	50.1 Å²	50.1	39%	0.385	28%	0.277	S	S	.	.			trans	-77.7	97.3	-179.2	-173.6	-7.2	0	0	0	111.7	M20 L181 S185 L186 F189	M20-D183 HydrophobicContact CE-CB 3.89Å; M20-D183 WeakPolarHBondContact CE-OD2 3.44Å; L181-D183 PolarHBondContact O-N 2.85Å; D183-S185 PolarHBondContact O-N 3.3Å; D183-S185 WeakPolarHBondContact OD1-CA 3.35Å; D183-S185 WeakPolarHBondContact OD1-CB 3.35Å; D183-S185 PolarHBondContact OD1-N 2.88Å; D183-S185 PolarHBondContact OD1-OG 2.9Å; D183-S185 PolarHBondContact OD2-OG 2.82Å; D183-L186 PolarHBondContact O-N 2.89Å; D183-F189 VanDerWaalsContact O-CD2 3.28Å; D183-F189 WeakPolarHBondContact O-CD2 3.45Å
184	T	73.8	Confident	80.8	Confident	71 Å²	71	48.3 Å²	48.3	44%	0.436	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	6	176.4	52.1	0	0	0	0	114.5	I182 L186 F189 I191 L197	I182-T184 PolarHBondContact O-N 3.38Å; I182-T184 VanDerWaalsContact O-N 3.12Å; T184-L186 VanDerWaalsContact C-N 3.29Å; T184-F189 VanDerWaalsContact CA-O 3.32Å; T184-F189 WeakPolarHBondContact CA-O 3.41Å; T184-F189 HydrophobicContact CG2-CB 4.25Å; T184-I191 HydrophobicContact CG2-CD1 3.88Å; T184-I191 HydrophobicContact CG2-CG1 3.89Å; T184-L197 HydrophobicContact CG2-CD1 4.36Å
185	S	68.4	Low	80.5	Confident	89 Å²	89	48.3 Å²	48.3	62%	0.622	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-14.8	167.2	77	0	0	0	0	113	D183	D183-S185 PolarHBondContact O-N 3.3Å; D183-S185 WeakPolarHBondContact OD1-CA 3.35Å; D183-S185 WeakPolarHBondContact OD1-CB 3.35Å; D183-S185 PolarHBondContact OD1-N 2.88Å; D183-S185 PolarHBondContact OD1-OG 2.9Å; D183-S185 PolarHBondContact OD2-OG 2.82Å
186	L	74.1	Confident	80.5	Confident	22 Å²	22	48.5 Å²	48.5	12%	0.115	28%	0.279	C	S	.	.	S	Bend	trans	-71.9	144.8	168.3	-73.3	-179.8	0	0	0	111.6	M20 D183 T184 R188 F189	M20-L186 HydrophobicContact CB-CD1 4.33Å; M20-L186 HydrophobicContact CB-CD2 3.89Å; M20-L186 HydrophobicContact CE-CD1 3.99Å; M20-L186 HydrophobicContact CE-CD2 3.85Å; M20-L186 HydrophobicContact CE-CG 3.65Å; M20-L186 HydrophobicContact CG-CD1 4.29Å; M20-L186 HydrophobicContact CG-CD2 3.88Å; M20-L186 HydrophobicContact CG-CG 4.41Å; M20-L186 HydrophobicContact SD-CD1 3.22Å; M20-L186 WeakPolarHBondContact SD-CD1 3Å; M20-L186 HydrophobicContact SD-CD2 3.69Å; M20-L186 HydrophobicContact SD-CG 3.55Å; M20-L186 VanDerWaalsContact SD-CG 3.55Å; D183-L186 PolarHBondContact O-N 2.89Å; T184-L186 VanDerWaalsContact C-N 3.29Å; L186-R188 HydrophobicContact CB-CB 3.77Å; L186-R188 HydrophobicContact CD1-CB 3.76Å; L186-R188 HydrophobicContact CD1-CG 3.75Å; L186-R188 HydrophobicContact CG-CB 4.33Å; L186-R188 PolarHBondContact O-N 3.24Å; L186-F189 HydrophobicContact CB-CD2 4.09Å; L186-F189 HydrophobicContact CD1-CD2 3.51Å; L186-F189 HydrophobicContact CD1-CE2 3.62Å; L186-F189 HydrophobicContact CG-CD2 4.26Å; L186-F189 PolarHBondContact O-N 2.88Å
187	P	72.8	Confident	80.7	Confident	86 Å²	86	47.9 Å²	47.9	56%	0.558	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	-41	158.4	-20.5	31.5	0	0	0	109.7	F189 E200	P187-F189 PolarHBondContact O-N 2.85Å; P187-E200 VanDerWaalsContact C-CD 3.45Å; P187-E200 VanDerWaalsContact CB-OE2 3.24Å; P187-E200 WeakPolarHBondContact CB-OE2 3.36Å; P187-E200 WeakPolarHBondContact O-CG 3.35Å
188	R	84.8	Confident	80.9	Confident	27 Å²	27	45.6 Å²	45.6	10%	0.102	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-7.7	172.1	166.1	178.1	145.7	90.5	5.7	117.4	L186 I199 E200 T201 D206	L186-R188 HydrophobicContact CB-CB 3.77Å; L186-R188 HydrophobicContact CD1-CB 3.76Å; L186-R188 HydrophobicContact CD1-CG 3.75Å; L186-R188 HydrophobicContact CG-CB 4.33Å; L186-R188 PolarHBondContact O-N 3.24Å; R188-I199 HydrophobicContact CG-CG2 4.44Å; R188-I199 CarbonylContact O-C 3.19Å; R188-I199 VanDerWaalsContact O-C 3.24Å; R188-I199 WeakPolarHBondContact O-CA 3.26Å; R188-I199 WeakPolarHBondContact O-CG2 3.26Å; R188-E200 VanDerWaalsContact CA-N 3.29Å; R188-E200 VanDerWaalsContact CA-O 3.29Å; R188-E200 WeakPolarHBondContact CA-O 3.41Å; R188-E200 HydrophobicContact CB-CB 4.44Å; R188-E200 WeakPolarHBondContact CB-O 3.31Å; R188-E200 WeakPolarHBondContact CG-O 3.39Å; R188-E200 PolarHBondContact O-N 2.88Å; R188-T201 PolarHBondContact NH1-O 2.77Å; R188-D206 IonicContact CZ-OD1 2.82Å; R188-D206 IonicContact CZ-OD2 3.79Å; R188-D206 VanDerWaalsContact NH1-CG 3.35Å; R188-D206 IonicContact NH1-OD1 3.58Å; R188-D206 PolarHBondContact NH1-OD1 2.9Å; R188-D206 IonicContact NH1-OD2 3.98Å; R188-D206 PolarHBondContact NH1-OD2 3.12Å; R188-D206 IonicContact NH2-OD1 3.18Å; R188-D206 PolarHBondContact NH2-OD1 2.9Å; R188-D206 IonicContact NH2-OD2 2.7Å
189	F	87.7	Confident	81.3	Confident	11 Å²	11	41.6 Å²	41.6	5%	0.048	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	117.8	175.5	-68.2	-73.4	0	0	0	111.1	I182 D183 T184 L186 P187 L197 I199	I182-F189 HydrophobicContact CB-CD1 4.48Å; I182-F189 HydrophobicContact CD1-CE1 4.21Å; I182-F189 HydrophobicContact CG1-CE1 4.42Å; I182-F189 HydrophobicContact CG2-CB 3.75Å; I182-F189 HydrophobicContact CG2-CD1 3.09Å; I182-F189 HydrophobicContact CG2-CD2 3.84Å; I182-F189 HydrophobicContact CG2-CE1 3.44Å; I182-F189 VanDerWaalsContact CG2-CE1 3.44Å; I182-F189 HydrophobicContact CG2-CE2 4.14Å; I182-F189 HydrophobicContact CG2-CG 3.32Å; I182-F189 HydrophobicContact CG2-CZ 3.97Å; D183-F189 VanDerWaalsContact O-CD2 3.28Å; D183-F189 WeakPolarHBondContact O-CD2 3.45Å; T184-F189 VanDerWaalsContact CA-O 3.32Å; T184-F189 WeakPolarHBondContact CA-O 3.41Å; T184-F189 HydrophobicContact CG2-CB 4.25Å; L186-F189 HydrophobicContact CB-CD2 4.09Å; L186-F189 HydrophobicContact CD1-CD2 3.51Å; L186-F189 HydrophobicContact CD1-CE2 3.62Å; L186-F189 HydrophobicContact CG-CD2 4.26Å; L186-F189 PolarHBondContact O-N 2.88Å; P187-F189 PolarHBondContact O-N 2.85Å; F189-L197 HydrophobicContact CB-CD1 4.25Å; F189-L197 HydrophobicContact CD1-CD1 4.37Å; F189-L197 HydrophobicContact CD1-CD2 4.41Å; F189-I199 HydrophobicContact CD1-CB 4.27Å; F189-I199 HydrophobicContact CD1-CD1 4.46Å; F189-I199 HydrophobicContact CD1-CG1 4.31Å; F189-I199 HydrophobicContact CD1-CG2 3.42Å; F189-I199 VanDerWaalsContact CD1-CG2 3.42Å; F189-I199 HydrophobicContact CE1-CD1 4.29Å; F189-I199 HydrophobicContact CE1-CG2 3.41Å; F189-I199 VanDerWaalsContact CE1-CG2 3.41Å; F189-I199 HydrophobicContact CG-CG2 4.33Å; F189-I199 HydrophobicContact CZ-CG2 4.28Å
190	R	83.3	Confident	81.3	Confident	131 Å²	131	42 Å²	42	49%	0.494	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	123.4	-173.8	-65.5	171.6	88.5	159	8.2	111.3	V198 E200	R190-V198 HydrophobicContact CB-CB 4.49Å; R190-V198 PolarHBondContact N-O 2.92Å; R190-V198 WeakPolarHBondContact O-CG2 3.37Å; R190-V198 PolarHBondContact O-N 3.11Å; R190-E200 WeakPolarHBondContact CD-OE1 3.35Å; R190-E200 IonicContact CZ-OE1 2.69Å; R190-E200 IonicContact NE-OE1 2.81Å; R190-E200 IonicContact NH1-OE1 2.95Å; R190-E200 PolarHBondContact NH1-OE1 2.95Å
191	I	85.6	Confident	81.5	Confident	57 Å²	57	41.7 Å²	41.7	29%	0.292	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	132	172.4	-62.7	172.7	0	0	0	108.9	V172 T184 S196 L197	V172-I191 WeakPolarHBondContact O-CD1 3.38Å; T184-I191 HydrophobicContact CG2-CD1 3.88Å; T184-I191 HydrophobicContact CG2-CG1 3.89Å; I191-S196 CarbonylContact C-O 3.56Å; I191-S196 VanDerWaalsContact CA-O 3.28Å; I191-S196 WeakPolarHBondContact CA-O 3.46Å; I191-L197 HydrophobicContact CG1-CD1 4.13Å
192	V	82.4	Confident	81.6	Confident	43 Å²	43	39.4 Å²	39.4	26%	0.261	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	172.3	-178	-58.9	0	0	0	0	111.8	H159 G195 S196 V198 W1829	H159-V192 WeakPolarHBondContact CE1-CG2 3.31Å; H159-V192 VanDerWaalsContact NE2-CG2 3.28Å; H159-V192 WeakPolarHBondContact NE2-CG2 3.39Å; V192-G195 PolarHBondContact O-N 2.91Å; V192-S196 PolarHBondContact N-O 2.92Å; V192-S196 PolarHBondContact O-N 3.3Å; V192-V198 HydrophobicContact CG1-CG2 4.15Å; V192-V198 HydrophobicContact CG2-CG2 3.68Å; V192-W1829 HydrophobicContact CB-CZ2 4.42Å; V192-W1829 HydrophobicContact CG1-CZ2 4.04Å; V192-W1829 HydrophobicContact CG2-CZ2 3.9Å
193	G	79.1	Confident	81.7	Confident	78 Å²	78	40.9 Å²	40.9	80%	0.804	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	-136.2	-172.7	0	0	0	0	0	110.4
194	S	76.1	Confident	81.5	Confident	45 Å²	45	42.5 Å²	42.5	32%	0.315	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	0	176.6	77.1	0	0	0	0	114.7	D163 V164	D163-S194 WeakPolarHBondContact CA-OG 3.47Å; D163-S194 WeakPolarHBondContact CB-OG 3.45Å; D163-S194 PolarHBondContact OD1-OG 3.19Å; V164-S194 PolarHBondContact N-OG 3Å; V164-S194 WeakPolarHBondContact O-CB 3.46Å
195	G	83.6	Confident	81.9	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.01	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	166.2	6.1	178.2	0	0	0	0	0	117.4	C162 V172 W174 V192	C162-G195 CarbonylContact O-C 3.46Å; C162-G195 WeakPolarHBondContact O-CA 3.19Å; C162-G195 PolarHBondContact O-N 3.01Å; V172-G195 WeakPolarHBondContact CG1-O 3.33Å; W174-G195 PolarHBondContact NE1-O 3.19Å; V192-G195 PolarHBondContact O-N 2.91Å
196	S	88.3	Confident	82.8	Confident	4 Å²	4	38.5 Å²	38.5	3%	0.028	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	139.1	-165.9	-62.1	0	0	0	0	112.9	H159 L160 Q161 C162 I191 V192	H159-S196 VanDerWaalsContact NE2-C 3.28Å; H159-S196 WeakPolarHBondContact NE2-CB 3.17Å; H159-S196 PolarHBondContact NE2-O 3.49Å; L160-S196 CarbonylContact O-C 3.6Å; L160-S196 WeakPolarHBondContact O-CA 3.27Å; L160-S196 WeakPolarHBondContact O-CB 3.49Å; Q161-S196 WeakPolarHBondContact CA-OG 3.41Å; C162-S196 PolarHBondContact N-OG 3.5Å; C162-S196 PolarHBondContact O-N 3.3Å; C162-S196 PolarHBondContact O-OG 3.4Å; I191-S196 CarbonylContact C-O 3.56Å; I191-S196 VanDerWaalsContact CA-O 3.28Å; I191-S196 WeakPolarHBondContact CA-O 3.46Å; V192-S196 PolarHBondContact N-O 2.92Å; V192-S196 PolarHBondContact O-N 3.3Å
197	L	91	Very high	83.3	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	107.9	-172.9	175.5	71.7	0	0	0	114	H159 L160 W174 I182 T184 F189 I191 I199 Y210	H159-L197 CarbonylContact C-O 3.45Å; H159-L197 WeakPolarHBondContact CA-O 3.45Å; H159-L197 PolarHBondContact CD2-O 2.84Å; L160-L197 HydrophobicContact CB-CB 4.38Å; L160-L197 HydrophobicContact CD1-CB 4.15Å; L160-L197 HydrophobicContact CD1-CD2 3.75Å; L160-L197 HydrophobicContact CD1-CG 4.17Å; L160-L197 PolarHBondContact N-O 2.02Å; L160-L197 PolarHBondContact O-N 2.91Å; W174-L197 HydrophobicContact CB-CD2 3.76Å; W174-L197 HydrophobicContact CD2-CB 3.54Å; W174-L197 HydrophobicContact CD2-CD2 3.99Å; W174-L197 HydrophobicContact CD2-CG 4.37Å; W174-L197 VanDerWaalsContact CE2-CB 3.41Å; W174-L197 HydrophobicContact CE3-CB 4.24Å; W174-L197 HydrophobicContact CE3-CD2 4.28Å; W174-L197 HydrophobicContact CG-CB 3.67Å; W174-L197 HydrophobicContact CG-CD2 3.78Å; W174-L197 HydrophobicContact CG-CG 4.19Å; W174-L197 HydrophobicContact CZ2-CB 3.98Å; I182-L197 HydrophobicContact CD1-CD2 3.49Å; I182-L197 VanDerWaalsContact CD1-CD2 3.49Å; I182-L197 HydrophobicContact CG2-CD1 4.29Å; I182-L197 HydrophobicContact CG2-CD2 4.04Å; T184-L197 HydrophobicContact CG2-CD1 4.36Å; F189-L197 HydrophobicContact CB-CD1 4.25Å; F189-L197 HydrophobicContact CD1-CD1 4.37Å; F189-L197 HydrophobicContact CD1-CD2 4.41Å; I191-L197 HydrophobicContact CG1-CD1 4.13Å; L197-I199 HydrophobicContact CD2-CD1 4.18Å; L197-I199 HydrophobicContact CD2-CG1 4.35Å; L197-I199 HydrophobicContact CG-CG1 4.19Å; L197-Y210 HydrophobicContact CD2-CD1 4.29Å; L197-Y210 HydrophobicContact CD2-CE1 4.32Å
198	V	88.1	Confident	84	Confident	7 Å²	7	35.3 Å²	35.3	4%	0.042	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	158.6	157.2	-141.9	0	0	0	0	109.7	H159 R190 V192 W1829 I1847	H159-V198 HydrophobicContact CB-CG1 4.22Å; H159-V198 PolarHBondContact CD2-N 2.9Å; H159-V198 VanDerWaalsContact CD2-N 3.33Å; R190-V198 HydrophobicContact CB-CB 4.49Å; R190-V198 PolarHBondContact N-O 2.92Å; R190-V198 WeakPolarHBondContact O-CG2 3.37Å; R190-V198 PolarHBondContact O-N 3.11Å; V192-V198 HydrophobicContact CG1-CG2 4.15Å; V192-V198 HydrophobicContact CG2-CG2 3.68Å; V198-W1829 HydrophobicContact CG2-CZ2 3.64Å; V198-W1829 VanDerWaalsContact CG2-NE1 3.27Å; V198-I1847 HydrophobicContact CG1-CG1 4.22Å
199	I	90.9	Very high	84.1	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	173.9	176.5	-37.8	-162.8	0	0	0	106.3	L160 R188 F189 L197 L202 Y210 A1844 N1845	L160-I199 HydrophobicContact CD1-CD1 3.91Å; R188-I199 HydrophobicContact CG-CG2 4.44Å; R188-I199 CarbonylContact O-C 3.19Å; R188-I199 VanDerWaalsContact O-C 3.24Å; R188-I199 WeakPolarHBondContact O-CA 3.26Å; R188-I199 WeakPolarHBondContact O-CG2 3.26Å; F189-I199 HydrophobicContact CD1-CB 4.27Å; F189-I199 HydrophobicContact CD1-CD1 4.46Å; F189-I199 HydrophobicContact CD1-CG1 4.31Å; F189-I199 HydrophobicContact CD1-CG2 3.42Å; F189-I199 VanDerWaalsContact CD1-CG2 3.42Å; F189-I199 HydrophobicContact CE1-CD1 4.29Å; F189-I199 HydrophobicContact CE1-CG2 3.41Å; F189-I199 VanDerWaalsContact CE1-CG2 3.41Å; F189-I199 HydrophobicContact CG-CG2 4.33Å; F189-I199 HydrophobicContact CZ-CG2 4.28Å; L197-I199 HydrophobicContact CD2-CD1 4.18Å; L197-I199 HydrophobicContact CD2-CG1 4.35Å; L197-I199 HydrophobicContact CG-CG1 4.19Å; I199-L202 HydrophobicContact CD1-CD2 4.44Å; I199-L202 HydrophobicContact CG2-CD2 4.38Å; I199-Y210 HydrophobicContact CD1-CE1 3.88Å; I199-A1844 CarbonylContact C-O 3.52Å; I199-A1844 WeakPolarHBondContact CA-O 3.39Å; I199-A1844 HydrophobicContact CB-CB 3.61Å; I199-A1844 VanDerWaalsContact CB-O 3.23Å; I199-A1844 WeakPolarHBondContact CB-O 3.42Å; I199-A1844 HydrophobicContact CD1-CB 3.45Å; I199-A1844 VanDerWaalsContact CD1-CB 3.45Å; I199-A1844 HydrophobicContact CG1-CB 3.51Å; I199-A1844 HydrophobicContact CG2-CB 4.27Å; I199-A1844 PolarHBondContact N-O 2.94Å; I199-N1845 VanDerWaalsContact C-CA 3.48Å; I199-N1845 HydrophobicContact CB-CB 4.08Å; I199-N1845 WeakPolarHBondContact CB-ND2 3.39Å; I199-N1845 HydrophobicContact CG2-CB 4.48Å; I199-N1845 WeakPolarHBondContact CG2-ND2 3.44Å; I199-N1845 WeakPolarHBondContact CG2-OD1 3.48Å; I199-N1845 WeakPolarHBondContact O-CA 3.26Å; I199-N1845 WeakPolarHBondContact O-CB 2.81Å
200	E	80	Confident	84.2	Confident	26 Å²	26	34.2 Å²	34.2	12%	0.121	20%	0.202	C	C	.	.	S	Bend	trans	-137.6	120.5	164.2	-51.8	175.3	-178.1	0	0	113.8	P187 R188 R190 N1845 F2066	P187-E200 VanDerWaalsContact C-CD 3.45Å; P187-E200 VanDerWaalsContact CB-OE2 3.24Å; P187-E200 WeakPolarHBondContact CB-OE2 3.36Å; P187-E200 WeakPolarHBondContact O-CG 3.35Å; R188-E200 VanDerWaalsContact CA-N 3.29Å; R188-E200 VanDerWaalsContact CA-O 3.29Å; R188-E200 WeakPolarHBondContact CA-O 3.41Å; R188-E200 HydrophobicContact CB-CB 4.44Å; R188-E200 WeakPolarHBondContact CB-O 3.31Å; R188-E200 WeakPolarHBondContact CG-O 3.39Å; R188-E200 PolarHBondContact O-N 2.88Å; R190-E200 WeakPolarHBondContact CD-OE1 3.35Å; R190-E200 IonicContact CZ-OE1 2.69Å; R190-E200 IonicContact NE-OE1 2.81Å; R190-E200 IonicContact NH1-OE1 2.95Å; R190-E200 PolarHBondContact NH1-OE1 2.95Å; E200-N1845 WeakPolarHBondContact CA-ND2 3.25Å; E200-N1845 WeakPolarHBondContact CA-O 3.48Å; E200-N1845 HydrophobicContact CB-CB 4.3Å; E200-N1845 PolarHBondContact N-ND2 2.85Å; E200-N1845 PolarHBondContact O-ND2 2.88Å; E200-F2066 HydrophobicContact CB-CE2 4.35Å; E200-F2066 HydrophobicContact CG-CE2 3.68Å; E200-F2066 HydrophobicContact CG-CZ 3.93Å; E200-F2066 WeakPolarHBondContact OE1-CZ 3.29Å; E200-F2066 WeakPolarHBondContact OE2-CZ 3.33Å
201	T	82.2	Confident	84.6	Confident	48 Å²	48	28.1 Å²	28.1	29%	0.294	18%	0.18	S	C	.	.	S	Bend	trans	44.5	101.2	-155.4	-50.2	0	0	0	0	120.8	R188 Y1843 N1845 Q2069	R188-T201 PolarHBondContact NH1-O 2.77Å; T201-Y1843 HydrophobicContact CG2-CD2 4.09Å; T201-Y1843 HydrophobicContact CG2-CE1 4.5Å; T201-Y1843 HydrophobicContact CG2-CE2 3.85Å; T201-N1845 VanDerWaalsContact CA-CB 3.48Å; T201-N1845 WeakPolarHBondContact CA-ND2 2.89Å; T201-N1845 VanDerWaalsContact N-CG 3.26Å; T201-N1845 PolarHBondContact N-ND2 3.4Å; T201-N1845 VanDerWaalsContact N-ND2 3.19Å; T201-N1845 PolarHBondContact N-O 2.79Å; T201-N1845 PolarHBondContact O-ND2 3.41Å; T201-Q2069 PolarHBondContact OG1-NE2 3.31Å
202	L	82.2	Confident	84.8	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	17%	0.166	C	C	.	.			trans	-76.8	173.1	168.9	-76.9	178.4	0	0	0	106	I199 D206 L228 V230 Y1843 A1844 N1845	I199-L202 HydrophobicContact CD1-CD2 4.44Å; I199-L202 HydrophobicContact CG2-CD2 4.38Å; L202-D206 WeakPolarHBondContact CA-OD2 3.33Å; L202-D206 HydrophobicContact CB-CB 4.12Å; L202-D206 HydrophobicContact CD1-CB 4.39Å; L202-D206 HydrophobicContact CD2-CB 3.04Å; L202-D206 HydrophobicContact CG-CB 3.91Å; L202-L228 HydrophobicContact CD1-CD2 4.45Å; L202-L228 HydrophobicContact CD2-CD2 4.25Å; L202-V230 HydrophobicContact CD1-CG2 3.98Å; L202-Y1843 HydrophobicContact CB-CD1 3.76Å; L202-Y1843 HydrophobicContact CB-CG 4.24Å; L202-Y1843 VanDerWaalsContact N-CB 3.33Å; L202-Y1843 VanDerWaalsContact N-CG 3.3Å; L202-Y1843 WeakPolarHBondContact O-CD1 3.25Å; L202-Y1843 WeakPolarHBondContact O-CE1 3.41Å; L202-A1844 HydrophobicContact CD1-CB 4.21Å; L202-A1844 HydrophobicContact CD2-CB 3.57Å; L202-A1844 HydrophobicContact CG-CB 3.81Å; L202-N1845 WeakPolarHBondContact CA-OD1 3.35Å; L202-N1845 WeakPolarHBondContact CB-OD1 3.46Å; L202-N1845 VanDerWaalsContact CD2-OD1 3.26Å; L202-N1845 WeakPolarHBondContact CD2-OD1 3.08Å; L202-N1845 WeakPolarHBondContact CG-OD1 3.28Å; L202-N1845 PolarHBondContact N-ND2 3.3Å; L202-N1845 PolarHBondContact N-OD1 3.08Å
203	L	83.9	Confident	85.1	Confident	40 Å²	40	23.8 Å²	23.8	21%	0.209	16%	0.155	C	C	.	.			trans	-130.8	175.5	157.2	-54.7	166.1	0	0	0	108.9	T205 D206	L203-T205 PolarHBondContact O-N 2.91Å; L203-D206 PolarHBondContact N-OD2 3.1Å; L203-D206 PolarHBondContact O-N 2.91Å
204	E	74.3	Confident	85.6	Confident	107 Å²	107	20 Å²	20	50%	0.5	12%	0.117	S	C	.	.	G	3₁₀ helix	trans	-52.5	-19.8	171.7	-135.3	170.3	132.2	0	0	112.7	V154 V230 R232	V154-E204 HydrophobicContact CG2-CG 4.34Å; E204-V230 HydrophobicContact CB-CG1 4.39Å; E204-V230 HydrophobicContact CG-CG1 3.85Å; E204-R232 IonicContact OE1-NE 3.09Å; E204-R232 IonicContact OE2-CZ 2.65Å; E204-R232 IonicContact OE2-NE 3.6Å; E204-R232 PolarHBondContact OE2-NE 2.91Å; E204-R232 IonicContact OE2-NH2 2.85Å; E204-R232 PolarHBondContact OE2-NH2 2.89Å
205	T	81.5	Confident	86.1	Confident	72 Å²	72	19.4 Å²	19.4	44%	0.442	11%	0.108	S	C	.	.	G	3₁₀ helix	trans	-78.2	-18.5	179.5	55.4	0	0	0	0	115.6	L203 S207	L203-T205 PolarHBondContact O-N 2.91Å; T205-S207 VanDerWaalsContact C-N 3.31Å
206	D	86.6	Confident	86.2	Confident	3 Å²	3	20.4 Å²	20.4	2%	0.016	11%	0.113	C	C	.	.	G	3₁₀ helix	trans	-92.2	6.1	-171.9	-61.6	-56.3	0	0	0	113	K176 R188 L202 L203 Y210	K176-D206 WeakPolarHBondContact CE-O 3.31Å; R188-D206 IonicContact CZ-OD1 2.82Å; R188-D206 IonicContact CZ-OD2 3.79Å; R188-D206 VanDerWaalsContact NH1-CG 3.35Å; R188-D206 IonicContact NH1-OD1 3.58Å; R188-D206 PolarHBondContact NH1-OD1 2.9Å; R188-D206 IonicContact NH1-OD2 3.98Å; R188-D206 PolarHBondContact NH1-OD2 3.12Å; R188-D206 IonicContact NH2-OD1 3.18Å; R188-D206 PolarHBondContact NH2-OD1 2.9Å; R188-D206 IonicContact NH2-OD2 2.7Å; L202-D206 WeakPolarHBondContact CA-OD2 3.33Å; L202-D206 HydrophobicContact CB-CB 4.12Å; L202-D206 HydrophobicContact CD1-CB 4.39Å; L202-D206 HydrophobicContact CD2-CB 3.04Å; L202-D206 HydrophobicContact CG-CB 3.91Å; L203-D206 PolarHBondContact N-OD2 3.1Å; L203-D206 PolarHBondContact O-N 2.91Å; D206-Y210 PolarHBondContact O-OH 2.79Å
207	S	85.5	Confident	86	Confident	38 Å²	38	26.9 Å²	26.9	27%	0.266	14%	0.142	S	C	.	.			trans	-60.5	140.9	159.8	178.7	0	0	0	0	110.2	K176 T205 L228 H229	K176-S207 VanDerWaalsContact CE-O 3.28Å; K176-S207 WeakPolarHBondContact CE-O 3.41Å; K176-S207 PolarHBondContact NZ-O 3.45Å; K176-S207 VanDerWaalsContact NZ-O 3.11Å; T205-S207 VanDerWaalsContact C-N 3.31Å; S207-L228 CarbonylContact C-O 3.32Å; S207-L228 VanDerWaalsContact CA-O 3.27Å; S207-L228 WeakPolarHBondContact CA-O 3.18Å; S207-L228 WeakPolarHBondContact CB-O 3.41Å; S207-L228 PolarHBondContact OG-O 3.05Å; S207-H229 WeakPolarHBondContact OG-CA 3.29Å
208	G	85.9	Confident	85.6	Confident	3 Å²	3	28.3 Å²	28.3	3%	0.031	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.8	177.1	-176.8	0	0	0	0	0	112.9	D177 Y210 H227 L228	D177-G208 WeakPolarHBondContact OD1-CA 3.46Å; G208-Y210 WeakPolarHBondContact O-CD2 3.38Å; G208-H227 CarbonylContact O-C 3.59Å; G208-H227 WeakPolarHBondContact O-CA 3.46Å; G208-H227 PolarHBondContact O-ND1 2.7Å; G208-L228 PolarHBondContact N-O 3.21Å; G208-L228 WeakPolarHBondContact O-CB 3.31Å; G208-L228 PolarHBondContact O-N 3.05Å
209	A	87.9	Confident	85.4	Confident	15 Å²	15	28 Å²	28	12%	0.124	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	125.4	175.5	0	0	0	0	0	111.9	K176 D177	K176-A209 CarbonylContact C-O 3.33Å; K176-A209 WeakPolarHBondContact CA-O 3.43Å; D177-A209 PolarHBondContact N-O 2.78Å; D177-A209 PolarHBondContact OD1-N 2.91Å
210	Y	90.5	Very high	85.2	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	134	-173.7	-74.3	-110.8	0	0	0	111.9	P147 L160 W174 I175 K176 I182 L197 I199 D206 G208 S225 G226 L228	P147-Y210 WeakPolarHBondContact CG-O 3.45Å; L160-Y210 HydrophobicContact CD1-CD1 3.35Å; L160-Y210 HydrophobicContact CD1-CE1 3.76Å; L160-Y210 HydrophobicContact CD1-CG 3.88Å; L160-Y210 HydrophobicContact CD2-CD1 4.25Å; L160-Y210 HydrophobicContact CD2-CD2 4.36Å; L160-Y210 HydrophobicContact CD2-CG 3.89Å; L160-Y210 HydrophobicContact CG-CD1 4.45Å; W174-Y210 HydrophobicContact CE3-CD1 4.46Å; I175-Y210 CarbonylContact O-C 3.52Å; I175-Y210 WeakPolarHBondContact O-CA 3.49Å; K176-Y210 HydrophobicContact CB-CE1 4.38Å; K176-Y210 HydrophobicContact CD-CE1 4.48Å; K176-Y210 HydrophobicContact CD-CE2 4.14Å; K176-Y210 HydrophobicContact CG-CE2 4.1Å; I182-Y210 HydrophobicContact CD1-CD1 3.6Å; I182-Y210 HydrophobicContact CD1-CE1 3.35Å; L197-Y210 HydrophobicContact CD2-CD1 4.29Å; L197-Y210 HydrophobicContact CD2-CE1 4.32Å; I199-Y210 HydrophobicContact CD1-CE1 3.88Å; D206-Y210 PolarHBondContact O-OH 2.79Å; G208-Y210 WeakPolarHBondContact O-CD2 3.38Å; Y210-S225 CarbonylContact O-C 3.49Å; Y210-S225 WeakPolarHBondContact O-CA 3.32Å; Y210-G226 PolarHBondContact N-O 3.18Å; Y210-G226 PolarHBondContact O-N 2.82Å; Y210-L228 HydrophobicContact CD2-CB 3.92Å; Y210-L228 HydrophobicContact CD2-CD2 4.35Å; Y210-L228 HydrophobicContact CE2-CB 3.67Å; Y210-L228 HydrophobicContact CE2-CD2 3.6Å; Y210-L228 HydrophobicContact CE2-CG 4.29Å
211	E	90.4	Very high	85.6	Confident	4 Å²	4	27.7 Å²	27.7	2%	0.019	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	151.6	176.7	-61.3	166.9	-146.9	0	0	110	R98 W174 I175	R98-E211 IonicContact CZ-OE1 2.98Å; R98-E211 IonicContact CZ-OE2 3.28Å; R98-E211 VanDerWaalsContact NH1-CD 3.27Å; R98-E211 IonicContact NH1-OE1 2.65Å; R98-E211 PolarHBondContact NH1-OE1 3.15Å; R98-E211 IonicContact NH1-OE2 3.25Å; R98-E211 PolarHBondContact NH1-OE2 2.94Å; R98-E211 IonicContact NH2-OE1 2.76Å; R98-E211 PolarHBondContact NH2-OE1 3.37Å; R98-E211 IonicContact NH2-OE2 3.33Å; R98-E211 PolarHBondContact NH2-OE2 2.84Å; W174-E211 WeakPolarHBondContact CA-O 3.4Å; W174-E211 VanDerWaalsContact CE3-O 3.26Å; I175-E211 HydrophobicContact CB-CB 4.48Å; I175-E211 PolarHBondContact N-O 2.95Å; I175-E211 PolarHBondContact O-N 3.05Å
212	C	89.9	Confident	85.8	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	145.8	169.1	68.5	0	0	0	0	111.6	C162 V172 Y173 W174 L222 S223	C162-C212 HydrophobicContact CB-CB 3.57Å; C162-C212 WeakPolarHBondContact CB-SG 3.46Å; C162-C212 WeakPolarHBondContact SG-CB 3.49Å; C162-C212 CovalentContact SG-SG 2.02Å; C162-C212 PolarHBondContact SG-SG 3.08Å; V172-C212 HydrophobicContact CG1-CB 3.99Å; Y173-C212 CarbonylContact O-C 3.59Å; Y173-C212 VanDerWaalsContact O-CA 3.3Å; Y173-C212 WeakPolarHBondContact O-CA 3.42Å; W174-C212 HydrophobicContact CD2-CB 3.9Å; W174-C212 HydrophobicContact CE3-CB 4.25Å; W174-C212 HydrophobicContact CG-CB 4.44Å; W174-C212 HydrophobicContact CH2-CB 4.07Å; W174-C212 HydrophobicContact CZ2-CB 3.75Å; W174-C212 HydrophobicContact CZ3-CB 4.32Å; C212-L222 WeakPolarHBondContact O-CA 3.18Å; C212-S223 PolarHBondContact N-OG 3.32Å; C212-S223 PolarHBondContact O-N 2.62Å; C212-S223 WeakPolarHBondContact SG-CB 3.04Å
213	M	89.1	Confident	86.1	Confident	8 Å²	8	26.4 Å²	26.4	4%	0.039	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	113.9	176.1	-172.7	173.7	57.9	0	0	109.4	L56 V172 Y173 I175 T220 V221 L222	L56-M213 HydrophobicContact CB-SD 3.98Å; V172-M213 CarbonylContact C-O 3.49Å; V172-M213 WeakPolarHBondContact CA-O 3.12Å; Y173-M213 HydrophobicContact CD2-CE 4.01Å; Y173-M213 HydrophobicContact CG-CE 4.24Å; Y173-M213 PolarHBondContact N-O 2.93Å; Y173-M213 PolarHBondContact O-N 2.93Å; I175-M213 HydrophobicContact CD1-CB 3.97Å; M213-T220 HydrophobicContact CG-CG2 3.81Å; M213-T220 HydrophobicContact SD-CG2 4.04Å; M213-V221 CarbonylContact C-O 3.58Å; M213-V221 WeakPolarHBondContact CA-O 3.39Å; M213-L222 HydrophobicContact CB-CD2 3.53Å; M213-L222 HydrophobicContact CB-CG 4.4Å; M213-L222 HydrophobicContact CG-CD2 3.85Å; M213-L222 HydrophobicContact CG-CG 4.22Å; M213-L222 HydrophobicContact SD-CD2 4.39Å
214	A	89	Confident	86.2	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	131.2	177.6	0	0	0	0	0	110.9	P141 V164 A170 V172 T220 V221	P141-A214 HydrophobicContact CB-CB 4.07Å; V164-A214 HydrophobicContact CB-CB 4.39Å; V164-A214 HydrophobicContact CG1-CB 3.47Å; V164-A214 VanDerWaalsContact CG1-CB 3.47Å; V164-A214 HydrophobicContact CG2-CB 4Å; A170-A214 HydrophobicContact CB-CB 4.27Å; V172-A214 HydrophobicContact CG2-CB 4.28Å; A214-T220 CarbonylContact O-C 3.56Å; A214-T220 VanDerWaalsContact O-CA 3.27Å; A214-T220 WeakPolarHBondContact O-CA 3.43Å; A214-V221 HydrophobicContact CB-CG1 3.86Å; A214-V221 PolarHBondContact N-O 2.79Å; A214-V221 PolarHBondContact O-N 2.76Å
215	R	87.4	Confident	86.7	Confident	32 Å²	32	27.8 Å²	27.8	12%	0.121	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	130.6	-174.7	-179.4	177.4	-160.5	124	7.9	112.7	L45 D46 T47 A170 T171 G219 T220	L45-R215 VanDerWaalsContact CB-NH2 3.32Å; L45-R215 PolarHBondContact O-NH2 3.16Å; D46-R215 PolarHBondContact O-NH2 2.98Å; T47-R215 PolarHBondContact OG1-NH1 3.01Å; T47-R215 PolarHBondContact OG1-NH2 3.21Å; A170-R215 CarbonylContact C-O 3.56Å; A170-R215 VanDerWaalsContact CA-O 3.23Å; A170-R215 WeakPolarHBondContact CA-O 3.33Å; A170-R215 WeakPolarHBondContact CB-O 3.39Å; T171-R215 PolarHBondContact N-O 2.92Å; T171-R215 PolarHBondContact O-N 3.04Å; R215-G219 WeakPolarHBondContact CA-O 3.32Å; R215-T220 HydrophobicContact CB-CG2 4.39Å
216	N	85.9	Confident	86.7	Confident	21 Å²	21	24.3 Å²	24.3	11%	0.112	14%	0.135	C	C	.	.			trans	-132.4	-170.2	162.6	73.7	-0.2	0	0	0	110.4	G139 P141 P168 A170 I218 G219	G139-N216 PolarHBondContact O-ND2 3.12Å; P141-N216 WeakPolarHBondContact CD-OD1 3.28Å; P141-N216 HydrophobicContact CG-CB 4.22Å; P141-N216 WeakPolarHBondContact CG-OD1 3.42Å; P168-N216 PolarHBondContact O-ND2 3.1Å; A170-N216 HydrophobicContact CB-CB 4.31Å; N216-I218 PolarHBondContact O-N 3.35Å; N216-I218 WeakPolarHBondContact OD1-CA 3.03Å; N216-I218 WeakPolarHBondContact OD1-CB 3.31Å; N216-I218 PolarHBondContact OD1-N 2.75Å; N216-G219 PolarHBondContact N-O 3.15Å; N216-G219 PolarHBondContact OD1-N 3.08Å
217	E	82.9	Confident	86.8	Confident	140 Å²	140	27.5 Å²	27.5	65%	0.654	15%	0.149	S	C	*	.	S	Bend	trans	-68.5	-15	178.3	67.4	-178.5	-178.9	0	0	114.3	K48 P168	K48-E217 WeakPolarHBondContact CE-O 3.35Å; K48-E217 PolarHBondContact NZ-O 3.34Å; P168-E217 HydrophobicContact CG-CG 3.92Å; P168-E217 WeakPolarHBondContact CG-OE1 3.26Å
218	I	84.5	Confident	86.9	Confident	30 Å²	30	25.7 Å²	25.7	15%	0.154	14%	0.137	C	C	.	.	S	Bend	trans	-94.9	-36.5	-178.3	-55.8	176	0	0	0	110.6	K48 Y130 P137 F140 E167 N216	K48-I218 WeakPolarHBondContact CB-O 3.35Å; K48-I218 WeakPolarHBondContact CD-O 3.34Å; Y130-I218 WeakPolarHBondContact CE2-O 3.31Å; P137-I218 HydrophobicContact CB-CG2 3.8Å; P137-I218 HydrophobicContact CG-CG2 4.31Å; F140-I218 HydrophobicContact CB-CG2 3.93Å; F140-I218 HydrophobicContact CD2-CG2 4.23Å; E167-I218 WeakPolarHBondContact O-CD1 3.38Å; N216-I218 PolarHBondContact O-N 3.35Å; N216-I218 WeakPolarHBondContact OD1-CA 3.03Å; N216-I218 WeakPolarHBondContact OD1-CB 3.31Å; N216-I218 PolarHBondContact OD1-N 2.75Å
219	G	83.2	Confident	86.5	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.01	15%	0.152	C	C	.	.			trans	-162.5	166.6	-171.4	0	0	0	0	0	116.1	K48 P141 R215 N216	K48-G219 CarbonylContact O-C 2.94Å; K48-G219 WeakPolarHBondContact O-CA 3.24Å; P141-G219 WeakPolarHBondContact CG-O 3.33Å; R215-G219 WeakPolarHBondContact CA-O 3.32Å; N216-G219 PolarHBondContact N-O 3.15Å; N216-G219 PolarHBondContact OD1-N 3.08Å
220	T	87.1	Confident	86.1	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.006	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.2	166.3	-55.2	0	0	0	0	109.1	K48 M213 A214 R215	K48-T220 PolarHBondContact O-N 2.81Å; M213-T220 HydrophobicContact CG-CG2 3.81Å; M213-T220 HydrophobicContact SD-CG2 4.04Å; A214-T220 CarbonylContact O-C 3.56Å; A214-T220 VanDerWaalsContact O-CA 3.27Å; A214-T220 WeakPolarHBondContact O-CA 3.43Å; R215-T220 HydrophobicContact CB-CG2 4.39Å
221	V	87	Confident	84.8	Confident	18 Å²	18	34.5 Å²	34.5	11%	0.109	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	147.5	175.6	64.2	0	0	0	0	109.8	F140 P141 V143 M213 A214	F140-V221 HydrophobicContact CE1-CB 4.45Å; P141-V221 HydrophobicContact CB-CG1 4.07Å; V143-V221 HydrophobicContact CG2-CG1 3.94Å; M213-V221 CarbonylContact C-O 3.58Å; M213-V221 WeakPolarHBondContact CA-O 3.39Å; A214-V221 HydrophobicContact CB-CG1 3.86Å; A214-V221 PolarHBondContact N-O 2.79Å; A214-V221 PolarHBondContact O-N 2.76Å
222	L	87.9	Confident	83.3	Confident	13 Å²	13	38.1 Å²	38.1	7%	0.068	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	145.9	171.1	-85	170.9	0	0	0	109.9	S54 I175 C212 M213	S54-L222 WeakPolarHBondContact O-CD1 3.27Å; I175-L222 HydrophobicContact CD1-CD2 3.57Å; C212-L222 WeakPolarHBondContact O-CA 3.18Å; M213-L222 HydrophobicContact CB-CD2 3.53Å; M213-L222 HydrophobicContact CB-CG 4.4Å; M213-L222 HydrophobicContact CG-CD2 3.85Å; M213-L222 HydrophobicContact CG-CG 4.22Å; M213-L222 HydrophobicContact SD-CD2 4.39Å
223	S	88.3	Confident	81.7	Confident	8 Å²	8	38.4 Å²	38.4	6%	0.056	19%	0.187	C	C	.	.			trans	-78.6	169.8	169.6	72.9	0	0	0	0	112.4	D146 P147 C212	D146-S223 VanDerWaalsContact OD1-CA 3.27Å; D146-S223 WeakPolarHBondContact OD1-CA 3.34Å; D146-S223 WeakPolarHBondContact OD1-CB 3.34Å; P147-S223 WeakPolarHBondContact CD-OG 3.47Å; C212-S223 PolarHBondContact N-OG 3.32Å; C212-S223 PolarHBondContact O-N 2.62Å; C212-S223 WeakPolarHBondContact SG-CB 3.04Å
224	N	85.4	Confident	80.3	Confident	112 Å²	112	44 Å²	44	60%	0.599	21%	0.213	S	C	*	.			trans	-66.1	168.1	157.1	-65.8	-71.4	0	0	0	111.2	D146 P147	D146-N224 HydrophobicContact CB-CB 4.03Å; D146-N224 PolarHBondContact OD1-N 2.81Å; D146-N224 PolarHBondContact OD2-ND2 3.25Å; P147-N224 WeakPolarHBondContact CD-O 3.3Å; P147-N224 WeakPolarHBondContact CG-O 3.44Å
225	S	83.9	Confident	79.4	Confident	64 Å²	64	44.1 Å²	44.1	45%	0.448	21%	0.213	S	C	.	.			trans	-104.7	127.5	-171.1	66.9	0	0	0	0	114.2	P147 Y210	P147-S225 CarbonylContact O-C 3.51Å; Y210-S225 CarbonylContact O-C 3.49Å; Y210-S225 WeakPolarHBondContact O-CA 3.32Å
226	G	83.3	Confident	78.5	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	121.1	174.9	0	0	0	0	0	113	P147 S148 Y210	P147-G226 WeakPolarHBondContact O-CA 3.43Å; P147-G226 PolarHBondContact O-N 3.33Å; S148-G226 VanDerWaalsContact C-CA 3.42Å; S148-G226 VanDerWaalsContact O-CA 3.31Å; S148-G226 WeakPolarHBondContact O-CA 3.34Å; Y210-G226 PolarHBondContact N-O 3.18Å; Y210-G226 PolarHBondContact O-N 2.82Å
227	H	87	Confident	78.3	Confident	69 Å²	69	42 Å²	42	32%	0.319	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	108.4	-173.5	-163.6	-41.6	0	0	0	115.1	A149 T150 G208 H229	A149-H227 CarbonylContact C-O 3.52Å; A149-H227 HydrophobicContact CB-CB 4.07Å; T150-H227 PolarHBondContact N-O 2.57Å; G208-H227 CarbonylContact O-C 3.59Å; G208-H227 WeakPolarHBondContact O-CA 3.46Å; G208-H227 PolarHBondContact O-ND1 2.7Å; H227-H229 AromaticContact CE1-CE1 3.87Å; H227-H229 AromaticContact CG-CE1 3.74Å; H227-H229 AromaticContact ND1-CE1 3.44Å; H227-H229 PolarHBondContact ND1-CE1 2.87Å; H227-H229 AromaticContact ND1-ND1 3.45Å; H227-H229 PolarHBondContact ND1-ND1 3.37Å; H227-H229 PolarHBondContact O-ND1 2.77Å
228	L	87.4	Confident	78	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	119.7	173	-157.5	56.4	0	0	0	110.7	T150 S152 T158 L202 S207 G208 Y210 A1844	T150-L228 CarbonylContact O-C 2.87Å; T150-L228 WeakPolarHBondContact O-CA 3.32Å; S152-L228 VanDerWaalsContact OG-CD1 3.28Å; S152-L228 WeakPolarHBondContact OG-CD1 3.44Å; T158-L228 HydrophobicContact CG2-CD1 3.68Å; T158-L228 HydrophobicContact CG2-CD2 4.36Å; L202-L228 HydrophobicContact CD1-CD2 4.45Å; L202-L228 HydrophobicContact CD2-CD2 4.25Å; S207-L228 CarbonylContact C-O 3.32Å; S207-L228 VanDerWaalsContact CA-O 3.27Å; S207-L228 WeakPolarHBondContact CA-O 3.18Å; S207-L228 WeakPolarHBondContact CB-O 3.41Å; S207-L228 PolarHBondContact OG-O 3.05Å; G208-L228 PolarHBondContact N-O 3.21Å; G208-L228 WeakPolarHBondContact O-CB 3.31Å; G208-L228 PolarHBondContact O-N 3.05Å; Y210-L228 HydrophobicContact CD2-CB 3.92Å; Y210-L228 HydrophobicContact CD2-CD2 4.35Å; Y210-L228 HydrophobicContact CE2-CB 3.67Å; Y210-L228 HydrophobicContact CE2-CD2 3.6Å; Y210-L228 HydrophobicContact CE2-CG 4.29Å; L228-A1844 HydrophobicContact CD2-CB 4.39Å
229	H	78.7	Confident	77.8	Confident	75 Å²	75	34.5 Å²	34.5	35%	0.347	17%	0.17	S	C	.	.			trans	-104.6	165.3	169.4	-60.7	64.5	0	0	0	110.6	T150 I151 S152 S207 H227	T150-H229 PolarHBondContact O-N 3.33Å; I151-H229 CarbonylContact C-O 3.1Å; I151-H229 HydrophobicContact CB-CB 4.4Å; I151-H229 HydrophobicContact CG2-CB 3.83Å; S152-H229 CarbonylContact C-O 3.57Å; S152-H229 WeakPolarHBondContact CA-O 3.48Å; S152-H229 WeakPolarHBondContact CB-O 3.46Å; S152-H229 PolarHBondContact N-O 3.49Å; S152-H229 VanDerWaalsContact O-O 3.1Å; S207-H229 WeakPolarHBondContact OG-CA 3.29Å; H227-H229 AromaticContact CE1-CE1 3.87Å; H227-H229 AromaticContact CG-CE1 3.74Å; H227-H229 AromaticContact ND1-CE1 3.44Å; H227-H229 PolarHBondContact ND1-CE1 2.87Å; H227-H229 AromaticContact ND1-ND1 3.45Å; H227-H229 PolarHBondContact ND1-ND1 3.37Å; H227-H229 PolarHBondContact O-ND1 2.77Å
230	V	78.4	Confident	77.4	Confident	29 Å²	29	34.4 Å²	34.4	18%	0.176	17%	0.169	C	C	.	.			trans	-139.6	123.5	-178.3	163.3	0	0	0	0	110.5	S152 Q153 V154 L202 E204	S152-V230 CarbonylContact O-C 3.53Å; S152-V230 WeakPolarHBondContact O-CA 3.45Å; Q153-V230 WeakPolarHBondContact O-CG1 3.43Å; Q153-V230 WeakPolarHBondContact O-CG2 3.23Å; V154-V230 HydrophobicContact CG2-CG1 3.65Å; L202-V230 HydrophobicContact CD1-CG2 3.98Å; E204-V230 HydrophobicContact CB-CG1 4.39Å; E204-V230 HydrophobicContact CG-CG1 3.85Å
231	R	64.1	Low	77	Confident	100 Å²	100	34.5 Å²	34.5	38%	0.377	17%	0.17	S	C	.	.			trans	-123.3	169.6	-171.8	-59	-125.4	-158.8	116.9	-5.9	116.7	I151 S152 T1889 P1890 E1891	I151-R231 HydrophobicContact CG2-CG 4Å; S152-R231 PolarHBondContact O-N 2.62Å; S152-R231 VanDerWaalsContact O-N 3.15Å; R231-T1889 WeakPolarHBondContact O-CG2 3.45Å; R231-P1890 HydrophobicContact CB-CG 4.37Å; R231-E1891 WeakPolarHBondContact CB-OE1 2.33Å; R231-E1891 WeakPolarHBondContact CD-OE1 3.41Å; R231-E1891 WeakPolarHBondContact CG-OE1 3.36Å; R231-E1891 IonicContact CZ-OE1 2.7Å; R231-E1891 VanDerWaalsContact CZ-OE1 3.32Å; R231-E1891 IonicContact NE-OE1 3.05Å; R231-E1891 PolarHBondContact NE-OE1 2.82Å; R231-E1891 IonicContact NH1-OE1 2.7Å; R231-E1891 PolarHBondContact NH1-OE1 2.73Å
232	R	58.6	Low	76.7	Confident	80 Å²	80	34.3 Å²	34.3	30%	0.302	17%	0.168	S	C	.	.			trans	-138.6	158.4	176.8	-75.6	-165.2	-164.3	-160.1	2.1	111.9	E204 P1890 E1915 V1920 D1923	E204-R232 IonicContact OE1-NE 3.09Å; E204-R232 IonicContact OE2-CZ 2.65Å; E204-R232 IonicContact OE2-NE 3.6Å; E204-R232 PolarHBondContact OE2-NE 2.91Å; E204-R232 IonicContact OE2-NH2 2.85Å; E204-R232 PolarHBondContact OE2-NH2 2.89Å; R232-P1890 WeakPolarHBondContact O-CD 3.21Å; R232-P1890 WeakPolarHBondContact O-CG 3.44Å; R232-E1915 IonicContact CZ-OE1 3.49Å; R232-E1915 IonicContact NH1-OE1 3.64Å; R232-E1915 PolarHBondContact NH1-OE1 2.82Å; R232-V1920 HydrophobicContact CG-CB 4.46Å; R232-V1920 HydrophobicContact CG-CG1 4.47Å; R232-D1923 WeakPolarHBondContact CA-OD1 3.43Å; R232-D1923 WeakPolarHBondContact CB-OD1 3.31Å; R232-D1923 WeakPolarHBondContact CG-OD1 3.15Å
233	I	55.7	Low	75.9	Confident	5 Å²	5	34.3 Å²	34.3	3%	0.026	17%	0.168	C	C	.	.			trans	-108.3	156.5	-172.6	-63	162	0	0	0	115.1	F263 P1888 P1890 F1893 D1923 Q1924	I233-F263 VanDerWaalsContact O-CD1 3.23Å; I233-F263 WeakPolarHBondContact O-CD1 3.5Å; I233-F263 VanDerWaalsContact O-CE1 3.23Å; I233-F263 WeakPolarHBondContact O-CE1 3.27Å; I233-P1888 HydrophobicContact CD1-CB 4.4Å; I233-P1888 WeakPolarHBondContact CD1-O 3.32Å; I233-P1890 HydrophobicContact CG1-CG 3.87Å; I233-F1893 HydrophobicContact CB-CE1 4.09Å; I233-F1893 HydrophobicContact CB-CZ 4.31Å; I233-F1893 HydrophobicContact CD1-CD1 3.55Å; I233-F1893 HydrophobicContact CD1-CE1 3.17Å; I233-F1893 HydrophobicContact CD1-CZ 4.2Å; I233-F1893 HydrophobicContact CG1-CD1 4Å; I233-F1893 HydrophobicContact CG1-CE1 3.51Å; I233-F1893 HydrophobicContact CG1-CZ 4.12Å; I233-F1893 HydrophobicContact CG2-CD1 4.49Å; I233-F1893 HydrophobicContact CG2-CE1 3.33Å; I233-F1893 HydrophobicContact CG2-CE2 4.25Å; I233-F1893 HydrophobicContact CG2-CZ 3.19Å; I233-D1923 HydrophobicContact CB-CB 3.62Å; I233-D1923 HydrophobicContact CD1-CB 3.39Å; I233-D1923 HydrophobicContact CG1-CB 3.51Å; I233-D1923 PolarHBondContact N-OD1 3.45Å; I233-Q1924 HydrophobicContact CG2-CB 4.16Å; I233-Q1924 VanDerWaalsContact CG2-O 3.23Å; I233-Q1924 WeakPolarHBondContact CG2-O 3.39Å
234	Q	60.9	Low	75	Confident	126 Å²	126	38.9 Å²	38.9	59%	0.589	19%	0.192	S	C	*	.			trans	-124.7	158.1	159	-52.8	174.8	32.4	0	0	112.4	F263 L321	Q234-F263 HydrophobicContact CB-CD1 4.4Å; Q234-F263 HydrophobicContact CG-CD1 4.1Å; Q234-F263 HydrophobicContact CG-CE1 4.15Å; Q234-L321 HydrophobicContact CB-CD1 4.15Å
235	F	70.4	Confident	74.5	Confident	2 Å²	2	38 Å²	38	1%	0.009	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-158.5	167.8	-179.3	65.8	-55.3	0	0	0	112.8	F263 N319 L321 L1914 Q1924 W1926 S1928	F235-F263 HydrophobicContact CD1-CB 3.46Å; F235-F263 VanDerWaalsContact CD1-CB 3.46Å; F235-F263 HydrophobicContact CE1-CB 3.2Å; F235-F263 HydrophobicContact CE1-CG 4.38Å; F235-F263 PolarHBondContact N-O 3.19Å; F235-F263 VanDerWaalsContact O-O 3.07Å; F235-N319 PolarHBondContact O-ND2 2.82Å; F235-L321 VanDerWaalsContact C-CD1 3.45Å; F235-L321 WeakPolarHBondContact O-CD1 3.47Å; F235-L1914 HydrophobicContact CE1-CD1 3.8Å; F235-L1914 HydrophobicContact CE1-CD2 4.3Å; F235-L1914 HydrophobicContact CZ-CD1 4.01Å; F235-L1914 HydrophobicContact CZ-CD2 4.41Å; F235-Q1924 HydrophobicContact CB-CB 4.25Å; F235-Q1924 HydrophobicContact CB-CG 3.54Å; F235-Q1924 HydrophobicContact CD1-CB 2.68Å; F235-Q1924 HydrophobicContact CD1-CG 2.3Å; F235-Q1924 HydrophobicContact CD2-CB 3.85Å; F235-Q1924 HydrophobicContact CD2-CG 2.32Å; F235-Q1924 HydrophobicContact CE1-CB 2.68Å; F235-Q1924 HydrophobicContact CE1-CG 2.31Å; F235-Q1924 HydrophobicContact CE2-CB 3.84Å; F235-Q1924 HydrophobicContact CE2-CG 2.31Å; F235-Q1924 HydrophobicContact CG-CB 3.31Å; F235-Q1924 HydrophobicContact CG-CG 2.31Å; F235-Q1924 HydrophobicContact CZ-CB 3.3Å; F235-Q1924 HydrophobicContact CZ-CG 2.3Å; F235-Q1924 PolarHBondContact O-NE2 2.88Å; F235-W1926 WeakPolarHBondContact CB-O 3.26Å; F235-W1926 HydrophobicContact CD2-CD2 4.47Å; F235-W1926 HydrophobicContact CD2-CG 4.23Å; F235-W1926 WeakPolarHBondContact CD2-O 3.37Å; F235-W1926 AromaticContact CE2-CD1 3.42Å; F235-W1926 VanDerWaalsContact CE2-CD1 3.42Å; F235-W1926 AromaticContact CE2-CD2 3.72Å; F235-W1926 HydrophobicContact CE2-CD2 3.72Å; F235-W1926 AromaticContact CE2-CE2 3.18Å; F235-W1926 AromaticContact CE2-CG 3.86Å; F235-W1926 HydrophobicContact CE2-CG 3.86Å; F235-W1926 HydrophobicContact CE2-CH2 4.45Å; F235-W1926 AromaticContact CE2-CZ2 3.59Å; F235-W1926 HydrophobicContact CE2-CZ2 3.59Å; F235-W1926 AromaticContact CE2-NE1 3.07Å; F235-W1926 WeakPolarHBondContact CG-O 3.29Å; F235-W1926 AromaticContact CZ-CE2 3.77Å; F235-W1926 HydrophobicContact CZ-CH2 4.1Å; F235-W1926 AromaticContact CZ-CZ2 3.5Å; F235-W1926 HydrophobicContact CZ-CZ2 3.5Å; F235-W1926 VanDerWaalsContact CZ-CZ2 3.5Å; F235-S1928 VanDerWaalsContact CD2-OG 3.26Å; F235-S1928 WeakPolarHBondContact CD2-OG 3.38Å; F235-S1928 WeakPolarHBondContact CE2-OG 3.11Å
236	P	68.1	Low	74.2	Confident	8 Å²	8	35.1 Å²	35.1	5%	0.052	16%	0.162	C	C	.	.			trans	-81.1	171.4	170	30.3	-31.5	0	0	0	113.4	L321 Q1924 P1927 S1928 R1929 E1932	P236-L321 HydrophobicContact CB-CB 3.88Å; P236-Q1924 PolarHBondContact O-NE2 2.82Å; P236-Q1924 PolarHBondContact O-OE1 2.7Å; P236-P1927 HydrophobicContact CG-CB 4.27Å; P236-S1928 VanDerWaalsContact C-C 3.43Å; P236-S1928 CarbonylContact O-C 3.59Å; P236-S1928 WeakPolarHBondContact O-CA 3.34Å; P236-S1928 WeakPolarHBondContact O-CB 3.46Å; P236-S1928 PolarHBondContact O-N 3.38Å; P236-S1928 PolarHBondContact O-OG 2.88Å; P236-R1929 VanDerWaalsContact C-N 3.26Å; P236-R1929 HydrophobicContact CB-CB 3.94Å; P236-R1929 VanDerWaalsContact CB-N 3.33Å; P236-R1929 WeakPolarHBondContact CB-O 3.27Å; P236-R1929 WeakPolarHBondContact CG-O 3.46Å; P236-E1932 WeakPolarHBondContact CD-OE2 3.2Å
237	P	81	Confident	73.7	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.165	C	C	.	.			trans	-120.1	110.3	-161.5	1.6	23.5	0	0	0	124.5	G261 P266 N319 S1928 R1929	P237-G261 CarbonylContact C-O 3.57Å; P237-G261 WeakPolarHBondContact CA-O 3.25Å; P237-G261 WeakPolarHBondContact CB-O 3.23Å; P237-P266 HydrophobicContact CB-CB 3.45Å; P237-P266 VanDerWaalsContact CB-CB 3.45Å; P237-P266 HydrophobicContact CB-CG 3.8Å; P237-P266 HydrophobicContact CG-CB 3.9Å; P237-N319 WeakPolarHBondContact CD-OD1 3.14Å; P237-N319 HydrophobicContact CG-CB 3.5Å; P237-N319 WeakPolarHBondContact CG-ND2 2.99Å; P237-N319 WeakPolarHBondContact CG-OD1 3.2Å; P237-S1928 CarbonylContact C-O 3.55Å; P237-S1928 WeakPolarHBondContact CA-OG 3.39Å; P237-S1928 VanDerWaalsContact N-C 3.28Å; P237-R1929 VanDerWaalsContact C-CG 3.45Å; P237-R1929 VanDerWaalsContact CD-CG 3.48Å; P237-R1929 WeakPolarHBondContact O-CD 3.4Å; P237-R1929 WeakPolarHBondContact O-CG 3.25Å; P237-R1929 PolarHBondContact O-NE 3.43Å; P237-R1929 PolarHBondContact O-NH2 3.32Å
238	T	77.6	Confident	72.5	Confident	4 Å²	4	32.9 Å²	32.9	3%	0.025	15%	0.153	C	C	.	.			trans	-71.1	156.6	-165.2	-72.6	0	0	0	0	112.8	N240 A260 G261 S1928 P1943 T1946	T238-N240 WeakPolarHBondContact CA-OD1 3.04Å; T238-N240 WeakPolarHBondContact CB-OD1 3.37Å; T238-N240 VanDerWaalsContact CG2-OD1 3.32Å; T238-N240 WeakPolarHBondContact CG2-OD1 3.25Å; T238-N240 PolarHBondContact O-N 2.95Å; T238-N240 VanDerWaalsContact O-N 3.1Å; T238-N240 PolarHBondContact O-OD1 2.87Å; T238-A260 WeakPolarHBondContact O-CA 3.44Å; T238-A260 WeakPolarHBondContact O-CB 3.46Å; T238-G261 PolarHBondContact N-O 3.09Å; T238-G261 PolarHBondContact O-N 3.09Å; T238-S1928 WeakPolarHBondContact CA-O 3.31Å; T238-S1928 WeakPolarHBondContact CB-O 3.36Å; T238-S1928 PolarHBondContact N-O 3.3Å; T238-S1928 PolarHBondContact N-OG 2.74Å; T238-S1928 WeakPolarHBondContact OG1-CA 3.39Å; T238-S1928 WeakPolarHBondContact OG1-CB 3.33Å; T238-S1928 PolarHBondContact OG1-O 2.84Å; T238-P1943 HydrophobicContact CG2-CB 3.96Å; T238-P1943 WeakPolarHBondContact OG1-CB 3.3Å; T238-T1946 WeakPolarHBondContact CG2-OG1 3.44Å
239	I	79.6	Confident	71	Confident	9 Å²	9	34 Å²	34	5%	0.046	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	102.5	161.3	-89.4	168.9	0	0	0	108.9	E241 M242 R259 C315 V324 R326 T1946	I239-E241 WeakPolarHBondContact CG2-O 3.44Å; I239-E241 PolarHBondContact O-N 2.97Å; I239-M242 HydrophobicContact CG2-CB 4.26Å; I239-R259 CarbonylContact C-O 3.48Å; I239-R259 WeakPolarHBondContact CA-O 3.34Å; I239-C315 HydrophobicContact CD1-CB 4.08Å; I239-V324 HydrophobicContact CB-CG1 4.36Å; I239-V324 HydrophobicContact CD1-CG1 3.83Å; I239-V324 HydrophobicContact CG1-CG1 3.68Å; I239-R326 HydrophobicContact CD1-CB 3.9Å; I239-R326 HydrophobicContact CG2-CB 4.37Å; I239-T1946 VanDerWaalsContact O-CB 3.32Å; I239-T1946 WeakPolarHBondContact O-CB 3.25Å; I239-T1946 PolarHBondContact O-N 3.46Å; I239-T1946 VanDerWaalsContact O-N 3.14Å
240	N	75.8	Confident	70.1	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-43.9	-38.9	175.4	-26	0.3	0	0	0	119.9	T238 R259 G261 T1946 I1947 E1948 T1953 R1955	T238-N240 WeakPolarHBondContact CA-OD1 3.04Å; T238-N240 WeakPolarHBondContact CB-OD1 3.37Å; T238-N240 VanDerWaalsContact CG2-OD1 3.32Å; T238-N240 WeakPolarHBondContact CG2-OD1 3.25Å; T238-N240 PolarHBondContact O-N 2.95Å; T238-N240 VanDerWaalsContact O-N 3.1Å; T238-N240 PolarHBondContact O-OD1 2.87Å; N240-R259 VanDerWaalsContact CA-O 3.26Å; N240-R259 WeakPolarHBondContact CA-O 3.41Å; N240-R259 HydrophobicContact CB-CB 4.09Å; N240-R259 PolarHBondContact N-O 2.74Å; N240-G261 VanDerWaalsContact ND2-CA 3.3Å; N240-G261 WeakPolarHBondContact ND2-CA 3.36Å; N240-G261 PolarHBondContact ND2-N 2.57Å; N240-G261 PolarHBondContact OD1-N 2.78Å; N240-T1946 VanDerWaalsContact C-C 3.45Å; N240-T1946 CarbonylContact C-O 3.52Å; N240-T1946 VanDerWaalsContact C-O 3.24Å; N240-T1946 HydrophobicContact CB-CG2 3.37Å; N240-T1946 CarbonylContact O-C 3.59Å; N240-T1946 VanDerWaalsContact O-CB 3.29Å; N240-T1946 WeakPolarHBondContact O-CB 3Å; N240-T1946 WeakPolarHBondContact O-CG2 3.26Å; N240-T1946 PolarHBondContact OD1-OG1 3.14Å; N240-I1947 CarbonylContact O-C 3.54Å; N240-I1947 VanDerWaalsContact O-CA 3.25Å; N240-I1947 WeakPolarHBondContact O-CA 3.21Å; N240-I1947 PolarHBondContact O-N 2.71Å; N240-E1948 HydrophobicContact CB-CG 3.24Å; N240-E1948 WeakPolarHBondContact CB-OE1 3.35Å; N240-E1948 PolarHBondContact ND2-OE1 3.24Å; N240-E1948 VanDerWaalsContact O-CG 3.32Å; N240-E1948 WeakPolarHBondContact O-CG 3.43Å; N240-E1948 PolarHBondContact O-N 2.91Å; N240-T1953 HydrophobicContact CB-CG2 4.49Å; N240-R1955 PolarHBondContact ND2-NE 2.75Å; N240-R1955 PolarHBondContact ND2-NH2 2.77Å
241	E	77.9	Confident	69.3	Low	3 Å²	3	33.6 Å²	33.6	1%	0.014	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	144	-174.7	-78.7	-118.2	144.7	0	0	106.4	I239 C258 R259 T1946 I1947 E1948 L1949 R2180	I239-E241 WeakPolarHBondContact CG2-O 3.44Å; I239-E241 PolarHBondContact O-N 2.97Å; E241-C258 VanDerWaalsContact O-CA 3.23Å; E241-C258 WeakPolarHBondContact O-CA 3.46Å; E241-C258 PolarHBondContact O-SG 2.73Å; E241-C258 VanDerWaalsContact O-SG 3.39Å; E241-R259 HydrophobicContact CB-CB 4.04Å; E241-R259 HydrophobicContact CB-CG 4.4Å; E241-R259 HydrophobicContact CG-CB 4.12Å; E241-R259 HydrophobicContact CG-CG 4.33Å; E241-R259 PolarHBondContact O-N 2.77Å; E241-T1946 WeakPolarHBondContact CA-O 3.45Å; E241-T1946 PolarHBondContact N-O 3.36Å; E241-I1947 VanDerWaalsContact OE1-CA 3.24Å; E241-I1947 WeakPolarHBondContact OE1-CA 3.43Å; E241-I1947 WeakPolarHBondContact OE1-CG2 3.39Å; E241-E1948 HydrophobicContact CG-CG 4.47Å; E241-E1948 WeakPolarHBondContact CG-O 3.2Å; E241-E1948 VanDerWaalsContact OE1-C 3.28Å; E241-E1948 PolarHBondContact OE1-N 2.89Å; E241-E1948 VanDerWaalsContact OE1-N 3.08Å; E241-L1949 WeakPolarHBondContact OE1-CD2 3.39Å; E241-R2180 IonicContact OE2-CZ 2.65Å; E241-R2180 IonicContact OE2-NE 3.37Å; E241-R2180 PolarHBondContact OE2-NE 3.09Å; E241-R2180 IonicContact OE2-NH2 2.74Å; E241-R2180 PolarHBondContact OE2-NH2 3.16Å
242	M	80.3	Confident	68.9	Low	14 Å²	14	30.1 Å²	30.1	7%	0.069	16%	0.158	C	C	.	.			trans	-163.9	134.8	151.3	-154.5	164.3	143	0	0	111.6	I239 W270 C315 R326 N327 V328	I239-M242 HydrophobicContact CG2-CB 4.26Å; M242-W270 HydrophobicContact CE-CH2 3.5Å; M242-W270 HydrophobicContact CE-CZ3 3.53Å; M242-W270 HydrophobicContact CG-CH2 3.83Å; M242-W270 HydrophobicContact CG-CZ2 4.39Å; M242-W270 HydrophobicContact SD-CH2 3.77Å; M242-W270 HydrophobicContact SD-CZ2 4.49Å; M242-W270 HydrophobicContact SD-CZ3 4.19Å; M242-C315 HydrophobicContact CE-CB 4.46Å; M242-C315 HydrophobicContact SD-CB 3.43Å; M242-C315 WeakPolarHBondContact SD-CB 3.36Å; M242-R326 HydrophobicContact CB-CG 4.26Å; M242-R326 VanDerWaalsContact CE-C 3.47Å; M242-R326 HydrophobicContact CE-CG 4.38Å; M242-R326 VanDerWaalsContact CE-O 3.31Å; M242-R326 WeakPolarHBondContact CE-O 3.49Å; M242-R326 HydrophobicContact CG-CG 4.49Å; M242-R326 VanDerWaalsContact SD-C 3.58Å; M242-R326 HydrophobicContact SD-CB 3.61Å; M242-R326 HydrophobicContact SD-CG 3.72Å; M242-N327 VanDerWaalsContact CE-CA 3.49Å; M242-N327 WeakPolarHBondContact CE-O 3.35Å; M242-V328 HydrophobicContact CE-CB 3.6Å; M242-V328 HydrophobicContact CE-CG1 3.55Å
243	P	72.2	Confident	69.4	Low	12 Å²	12	26.8 Å²	26.8	8%	0.078	15%	0.149	C	C	.	.			trans	-72.7	141.5	167.8	29.1	-32.6	0	0	0	111.1	L256 T257 V328	P243-L256 HydrophobicContact CG-CD2 4.2Å; P243-T257 WeakPolarHBondContact CD-O 3.38Å; P243-V328 HydrophobicContact CG-CG2 4.36Å; P243-V328 VanDerWaalsContact O-CB 3.29Å; P243-V328 WeakPolarHBondContact O-CB 3.36Å; P243-V328 WeakPolarHBondContact O-CG2 3.34Å
244	D	68.7	Low	70.3	Confident	104 Å²	104	26.7 Å²	26.7	56%	0.556	15%	0.148	S	C	*	.	S	Bend	trans	-85.6	-30.4	-179.8	-60.4	-49	0	0	0	113.5	R326	D244-R326 IonicContact OD1-CZ 2.69Å; D244-R326 IonicContact OD1-NE 3.84Å; D244-R326 PolarHBondContact OD1-NE 3.31Å; D244-R326 IonicContact OD1-NH2 3.52Å; D244-R326 PolarHBondContact OD1-NH2 3.13Å; D244-R326 IonicContact OD2-NH2 3.64Å; D244-R326 PolarHBondContact OD2-NH2 2.91Å
245	K	74.6	Confident	71.5	Confident	95 Å²	95	21.7 Å²	21.7	41%	0.413	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	165	173.9	66.2	159.5	-175.1	154.4	0	113.3	E247 S329 H2380	K245-E247 IonicContact NZ-OE1 3.37Å; K245-E247 PolarHBondContact NZ-OE1 2.93Å; K245-S329 CarbonylContact C-O 3.57Å; K245-S329 WeakPolarHBondContact CA-O 3.46Å; K245-H2380 PolarHBondContact NZ-CD2 3.45Å; K245-H2380 PolarHBondContact NZ-NE2 2.86Å
246	V	78.1	Confident	72	Confident	2 Å²	2	21.6 Å²	21.6	1%	0.012	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	144.5	-179.1	-170.4	0	0	0	0	111.7	V248 T254 L256 V328 S329 V330 I331	V246-V248 HydrophobicContact CG1-CG2 3.65Å; V246-T254 HydrophobicContact CG1-CG2 4.1Å; V246-T254 WeakPolarHBondContact CG1-OG1 3.38Å; V246-L256 HydrophobicContact CG2-CD2 3.98Å; V246-V328 HydrophobicContact CG2-CG2 4.38Å; V246-S329 PolarHBondContact N-O 3.42Å; V246-V330 HydrophobicContact CB-CG1 4.46Å; V246-V330 CarbonylContact O-C 3.54Å; V246-V330 WeakPolarHBondContact O-CA 3.39Å; V246-I331 PolarHBondContact O-N 2.9Å; V246-I331 VanDerWaalsContact O-N 3.07Å
247	E	73.2	Confident	72.9	Confident	12 Å²	12	21.3 Å²	21.3	6%	0.056	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	138.7	171.6	-73.8	149.3	-131.3	0	0	109.4	K245 I331 F2378 D2379 H2380	K245-E247 IonicContact NZ-OE1 3.37Å; K245-E247 PolarHBondContact NZ-OE1 2.93Å; E247-I331 HydrophobicContact CG-CB 4.09Å; E247-I331 HydrophobicContact CG-CD1 3.84Å; E247-I331 HydrophobicContact CG-CG1 3.86Å; E247-F2378 HydrophobicContact CB-CD1 3.8Å; E247-F2378 HydrophobicContact CB-CE1 3.95Å; E247-F2378 HydrophobicContact CG-CD1 4.43Å; E247-F2378 VanDerWaalsContact OE2-CA 3.32Å; E247-F2378 WeakPolarHBondContact OE2-CA 3.22Å; E247-D2379 PolarHBondContact OE2-N 2.76Å; E247-H2380 IonicContact OE1-CD2 3.64Å
248	V	60.8	Low	73	Confident	11 Å²	11	21.3 Å²	21.3	7%	0.067	12%	0.124	C	C	.	.			trans	-154.8	111.4	-162.3	-174.5	0	0	0	0	111.8	V246 K252 I307 V330 I331 V332	V246-V248 HydrophobicContact CG1-CG2 3.65Å; V248-K252 HydrophobicContact CG1-CB 3.59Å; V248-I307 HydrophobicContact CG1-CB 4.25Å; V248-I307 HydrophobicContact CG1-CD1 4.21Å; V248-I307 HydrophobicContact CG1-CG2 4.46Å; V248-I307 HydrophobicContact CG2-CD1 4.27Å; V248-V330 HydrophobicContact CB-CG1 4.38Å; V248-V330 HydrophobicContact CG2-CG1 3.76Å; V248-I331 CarbonylContact C-O 3.53Å; V248-I331 WeakPolarHBondContact CA-O 3.34Å; V248-I331 PolarHBondContact N-O 2.81Å; V248-V332 VanDerWaalsContact O-CA 3.28Å; V248-V332 WeakPolarHBondContact O-CA 3.31Å; V248-V332 WeakPolarHBondContact O-CG2 3.49Å
249	S	56.2	Low	73.5	Confident	22 Å²	22	22 Å²	22	15%	0.154	13%	0.126	C	C	.	.			trans	-54.8	152.3	175.2	-51.7	0	0	0	0	113	G251 K252	S249-G251 PolarHBondContact O-N 2.78Å; S249-K252 WeakPolarHBondContact O-CB 3.48Å; S249-K252 WeakPolarHBondContact O-CG 3.35Å; S249-K252 PolarHBondContact O-N 3.06Å
250	S	60.9	Low	73.6	Confident	79 Å²	79	21.5 Å²	21.5	55%	0.552	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	126.8	-167.7	-168.2	0	0	0	0	112.4	K252	S250-K252 PolarHBondContact O-N 2.81Å
251	G	60.8	Low	73.4	Confident	18 Å²	18	21.7 Å²	21.7	19%	0.186	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	-8.7	-177	0	0	0	0	0	114.7	S249 I307 Q2297 K2300	S249-G251 PolarHBondContact O-N 2.78Å; G251-I307 PolarHBondContact N-O 3.46Å; G251-Q2297 PolarHBondContact O-NE2 3Å; G251-K2300 PolarHBondContact O-NZ 2.82Å
252	K	56	Low	73.1	Confident	26 Å²	26	21.8 Å²	21.8	11%	0.113	13%	0.127	C	C	.	.			trans	-72.9	-174.1	169.6	-54.7	-151.8	175.1	-159.1	0	111.2	V248 S249 S250 I307 E2289 D2293 K2300	V248-K252 HydrophobicContact CG1-CB 3.59Å; S249-K252 WeakPolarHBondContact O-CB 3.48Å; S249-K252 WeakPolarHBondContact O-CG 3.35Å; S249-K252 PolarHBondContact O-N 3.06Å; S250-K252 PolarHBondContact O-N 2.81Å; K252-I307 WeakPolarHBondContact O-CB 3.22Å; K252-I307 PolarHBondContact O-N 3.05Å; K252-E2289 PolarHBondContact NZ-O 2.75Å; K252-E2289 IonicContact NZ-OE1 3.83Å; K252-D2293 HydrophobicContact CD-CB 4.06Å; K252-D2293 HydrophobicContact CG-CB 4.47Å; K252-D2293 VanDerWaalsContact CG-OD1 3.26Å; K252-D2293 WeakPolarHBondContact CG-OD1 3.43Å; K252-K2300 VanDerWaalsContact C-CE 3.48Å; K252-K2300 WeakPolarHBondContact O-CE 3.3Å; K252-K2300 PolarHBondContact O-NZ 3.4Å
253	G	69.3	Low	72.5	Confident	11 Å²	11	23.9 Å²	23.9	11%	0.113	14%	0.136	C	C	.	.			trans	-140.1	164.4	-167.7	0	0	0	0	0	116.4
254	T	74.3	Confident	72.5	Confident	2 Å²	2	26.4 Å²	26.4	1%	0.012	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	157.9	172.2	-165.5	0	0	0	0	113.2	V246 L256 R303 L304 I307 R2336	V246-T254 HydrophobicContact CG1-CG2 4.1Å; V246-T254 WeakPolarHBondContact CG1-OG1 3.38Å; T254-L256 HydrophobicContact CG2-CD2 4.34Å; T254-R303 WeakPolarHBondContact O-CA 3.41Å; T254-L304 HydrophobicContact CG2-CB 4.4Å; T254-L304 HydrophobicContact CG2-CD1 4.03Å; T254-L304 HydrophobicContact CG2-CG 4.48Å; T254-L304 PolarHBondContact O-N 2.79Å; T254-I307 HydrophobicContact CG2-CD1 3.75Å; T254-R2336 PolarHBondContact OG1-NH1 3.02Å; T254-R2336 PolarHBondContact OG1-NH2 2.8Å
255	N	84.8	Confident	72.7	Confident	21 Å²	21	26.3 Å²	26.3	11%	0.112	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	149.8	165.8	-49.7	6.2	0	0	0	108.1	R303 H2299	N255-R303 HydrophobicContact CB-CG 4.08Å; N255-R303 WeakPolarHBondContact ND2-CD 3.38Å; N255-R303 WeakPolarHBondContact OD1-CD 3.22Å; N255-R303 WeakPolarHBondContact OD1-CG 3.46Å; N255-H2299 PolarHBondContact ND2-ND1 2.74Å; N255-H2299 WeakPolarHBondContact OD1-CB 3.14Å
256	L	82.2	Confident	73	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	94.9	168.7	-58.3	176.9	0	0	0	108.1	P243 V246 T254 W270 T301 L302 L304 Y313 V328	P243-L256 HydrophobicContact CG-CD2 4.2Å; V246-L256 HydrophobicContact CG2-CD2 3.98Å; T254-L256 HydrophobicContact CG2-CD2 4.34Å; L256-W270 HydrophobicContact CB-CH2 3.59Å; L256-W270 HydrophobicContact CB-CZ2 3.68Å; L256-W270 HydrophobicContact CB-CZ3 4.1Å; L256-W270 HydrophobicContact CD1-CH2 4.37Å; L256-W270 HydrophobicContact CD1-CZ3 4.12Å; L256-W270 WeakPolarHBondContact O-CZ2 3.49Å; L256-W270 PolarHBondContact O-NE1 2.82Å; L256-T301 CarbonylContact O-C 3.57Å; L256-T301 WeakPolarHBondContact O-CA 3.34Å; L256-L302 WeakPolarHBondContact CA-O 3.38Å; L256-L302 HydrophobicContact CB-CB 4.28Å; L256-L302 WeakPolarHBondContact CB-O 3.32Å; L256-L302 HydrophobicContact CD1-CD2 4.25Å; L256-L302 HydrophobicContact CD1-CG 4.46Å; L256-L302 PolarHBondContact N-O 3.35Å; L256-L302 PolarHBondContact O-N 2.79Å; L256-L304 HydrophobicContact CD1-CD1 3.72Å; L256-L304 HydrophobicContact CD1-CG 4.3Å; L256-L304 HydrophobicContact CG-CD1 4.21Å; L256-Y313 HydrophobicContact CD1-CD2 3.55Å; L256-Y313 HydrophobicContact CD1-CE2 4.3Å; L256-Y313 HydrophobicContact CD1-CG 3.83Å; L256-V328 HydrophobicContact CD1-CG1 3.76Å; L256-V328 HydrophobicContact CD2-CG1 4.01Å; L256-V328 HydrophobicContact CD2-CG2 3.92Å; L256-V328 HydrophobicContact CG-CG1 4.46Å
257	T	86.4	Confident	73.4	Confident	3 Å²	3	25.2 Å²	25.2	2%	0.018	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	136.5	175.4	-51.5	0	0	0	0	111.2	P243 R259 E299 T301 R2180	P243-T257 WeakPolarHBondContact CD-O 3.38Å; T257-R259 HydrophobicContact CG2-CG 4.19Å; T257-E299 WeakPolarHBondContact CG2-OE1 3.26Å; T257-T301 VanDerWaalsContact CA-CG2 3.43Å; T257-T301 HydrophobicContact CG2-CG2 3.64Å; T257-T301 WeakPolarHBondContact OG1-CG2 3.26Å; T257-R2180 WeakPolarHBondContact OG1-CD 3.22Å; T257-R2180 PolarHBondContact OG1-NH1 2.75Å
258	C	84.2	Confident	74.1	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	132.4	166.3	179.3	0	0	0	0	110.5	E241 V268 W270 A300 C315	E241-C258 VanDerWaalsContact O-CA 3.23Å; E241-C258 WeakPolarHBondContact O-CA 3.46Å; E241-C258 PolarHBondContact O-SG 2.73Å; E241-C258 VanDerWaalsContact O-SG 3.39Å; C258-V268 HydrophobicContact CB-CG1 4.44Å; C258-W270 HydrophobicContact CB-CH2 4.33Å; C258-W270 HydrophobicContact CB-CZ2 3.42Å; C258-W270 VanDerWaalsContact CB-CZ2 3.42Å; C258-A300 CarbonylContact C-O 3.51Å; C258-A300 PolarHBondContact N-O 3.33Å; C258-A300 CarbonylContact O-C 3.59Å; C258-A300 PolarHBondContact O-N 2.87Å; C258-C315 HydrophobicContact CB-CB 3.47Å; C258-C315 VanDerWaalsContact CB-CB 3.47Å; C258-C315 WeakPolarHBondContact CB-SG 3.2Å; C258-C315 WeakPolarHBondContact SG-CB 3.31Å; C258-C315 CovalentContact SG-SG 2.01Å; C258-C315 PolarHBondContact SG-SG 2.78Å
259	R	87.8	Confident	75.5	Confident	17 Å²	17	26 Å²	26	6%	0.064	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	177.7	-179.2	-78.8	164.2	163.1	-146	-15.9	110.9	I239 N240 E241 T257 H298 E299 E1948 R2180 D2181	I239-R259 CarbonylContact C-O 3.48Å; I239-R259 WeakPolarHBondContact CA-O 3.34Å; N240-R259 VanDerWaalsContact CA-O 3.26Å; N240-R259 WeakPolarHBondContact CA-O 3.41Å; N240-R259 HydrophobicContact CB-CB 4.09Å; N240-R259 PolarHBondContact N-O 2.74Å; E241-R259 HydrophobicContact CB-CB 4.04Å; E241-R259 HydrophobicContact CB-CG 4.4Å; E241-R259 HydrophobicContact CG-CB 4.12Å; E241-R259 HydrophobicContact CG-CG 4.33Å; E241-R259 PolarHBondContact O-N 2.77Å; T257-R259 HydrophobicContact CG2-CG 4.19Å; R259-H298 CarbonylContact C-O 3.55Å; R259-H298 WeakPolarHBondContact CA-O 3.39Å; R259-E299 HydrophobicContact CG-CB 3.83Å; R259-E299 HydrophobicContact CG-CG 3.71Å; R259-E299 IonicContact CZ-OE1 3.81Å; R259-E299 IonicContact CZ-OE2 3.24Å; R259-E299 VanDerWaalsContact CZ-OE2 3.31Å; R259-E299 IonicContact NE-OE1 3.15Å; R259-E299 PolarHBondContact NE-OE1 2.84Å; R259-E299 IonicContact NE-OE2 3.71Å; R259-E299 PolarHBondContact NE-OE2 2.86Å; R259-E299 VanDerWaalsContact NE-OE2 3.14Å; R259-E299 IonicContact NH2-OE1 3.76Å; R259-E299 PolarHBondContact NH2-OE1 2.92Å; R259-E299 IonicContact NH2-OE2 2.88Å; R259-E299 PolarHBondContact NH2-OE2 2.89Å; R259-E1948 HydrophobicContact CB-CG 3.72Å; R259-E1948 WeakPolarHBondContact CB-OE2 3.44Å; R259-E1948 WeakPolarHBondContact CD-O 3.32Å; R259-E1948 HydrophobicContact CG-CG 4.36Å; R259-E1948 VanDerWaalsContact NH1-C 3.29Å; R259-E1948 PolarHBondContact NH1-O 3.3Å; R259-R2180 VanDerWaalsContact CZ-O 3.23Å; R259-R2180 PolarHBondContact NH1-O 2.96Å; R259-R2180 PolarHBondContact NH2-O 2.83Å; R259-D2181 IonicContact CZ-OD1 3.59Å; R259-D2181 IonicContact NH2-OD1 2.71Å; R259-D2181 PolarHBondContact NH2-OD1 2.88Å
260	A	80.4	Confident	77	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	136.1	166.7	0	0	0	0	0	114.1	T238 P266 V268 H298 A317	T238-A260 WeakPolarHBondContact O-CA 3.44Å; T238-A260 WeakPolarHBondContact O-CB 3.46Å; A260-P266 HydrophobicContact CB-CB 4.24Å; A260-P266 HydrophobicContact CB-CG 3.57Å; A260-P266 WeakPolarHBondContact O-CG 3.34Å; A260-V268 HydrophobicContact CB-CG2 3.45Å; A260-V268 VanDerWaalsContact CB-CG2 3.45Å; A260-H298 PolarHBondContact N-O 2.8Å; A260-H298 VanDerWaalsContact O-CA 3.32Å; A260-H298 WeakPolarHBondContact O-CA 3.21Å; A260-H298 PolarHBondContact O-ND1 2.98Å; A260-A317 HydrophobicContact CB-CB 4.09Å
261	G	73.2	Confident	78	Confident	4 Å²	4	21.3 Å²	21.3	4%	0.041	12%	0.116	C	C	.	.			trans	-91.2	141.7	172.2	0	0	0	0	0	109.6	P237 T238 N240 Q1924 S1928	P237-G261 CarbonylContact C-O 3.57Å; P237-G261 WeakPolarHBondContact CA-O 3.25Å; P237-G261 WeakPolarHBondContact CB-O 3.23Å; T238-G261 PolarHBondContact N-O 3.09Å; T238-G261 PolarHBondContact O-N 3.09Å; N240-G261 VanDerWaalsContact ND2-CA 3.3Å; N240-G261 WeakPolarHBondContact ND2-CA 3.36Å; N240-G261 PolarHBondContact ND2-N 2.57Å; N240-G261 PolarHBondContact OD1-N 2.78Å; G261-Q1924 PolarHBondContact O-OE1 3.41Å; G261-S1928 PolarHBondContact O-OG 2.89Å
262	G	70.2	Confident	78.2	Confident	4 Å²	4	23.5 Å²	23.5	4%	0.041	13%	0.126	C	C	.	.			trans	-154.5	146.9	-175.7	0	0	0	0	0	113	P264 I265 P266	G262-P264 VanDerWaalsContact C-C 3.48Å; G262-P264 CarbonylContact C-O 3.53Å; G262-P264 VanDerWaalsContact C-O 3.31Å; G262-I265 VanDerWaalsContact O-CA 3.28Å; G262-I265 WeakPolarHBondContact O-CA 3.36Å; G262-I265 VanDerWaalsContact O-CG1 3.26Å; G262-I265 WeakPolarHBondContact O-CG1 3.14Å; G262-I265 PolarHBondContact O-N 2.79Å; G262-P266 VanDerWaalsContact CA-CD 3.47Å
263	F	68.4	Low	78.6	Confident	59 Å²	59	25.3 Å²	25.3	26%	0.259	14%	0.136	S	C	.	.	B	Isolated β-bridge	trans	-152.4	99.4	159.8	-168	-81.8	0	0	0	109.2	I233 Q234 F235 Q1924	I233-F263 VanDerWaalsContact O-CD1 3.23Å; I233-F263 WeakPolarHBondContact O-CD1 3.5Å; I233-F263 VanDerWaalsContact O-CE1 3.23Å; I233-F263 WeakPolarHBondContact O-CE1 3.27Å; Q234-F263 HydrophobicContact CB-CD1 4.4Å; Q234-F263 HydrophobicContact CG-CD1 4.1Å; Q234-F263 HydrophobicContact CG-CE1 4.15Å; F235-F263 HydrophobicContact CD1-CB 3.46Å; F235-F263 VanDerWaalsContact CD1-CB 3.46Å; F235-F263 HydrophobicContact CE1-CB 3.2Å; F235-F263 HydrophobicContact CE1-CG 4.38Å; F235-F263 PolarHBondContact N-O 3.19Å; F235-F263 VanDerWaalsContact O-O 3.07Å; F263-Q1924 VanDerWaalsContact N-CD 3.27Å
264	P	72.1	Confident	77.6	Confident	65 Å²	65	27.6 Å²	27.6	42%	0.422	16%	0.16	S	C	.	.	S	Bend	cis	-57.7	139.2	1.9	-26.6	36.2	0	0	0	114	G262 N319	G262-P264 VanDerWaalsContact C-C 3.48Å; G262-P264 CarbonylContact C-O 3.53Å; G262-P264 VanDerWaalsContact C-O 3.31Å; P264-N319 VanDerWaalsContact O-CB 3.28Å; P264-N319 WeakPolarHBondContact O-CB 3.04Å; P264-N319 PolarHBondContact O-ND2 2.8Å
265	I	72.1	Confident	75.7	Confident	102 Å²	102	31.3 Å²	31.3	52%	0.523	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-53.9	143.1	-176	-65.3	172.4	0	0	0	110.5	G262 P297 H298	G262-I265 VanDerWaalsContact O-CA 3.28Å; G262-I265 WeakPolarHBondContact O-CA 3.36Å; G262-I265 VanDerWaalsContact O-CG1 3.26Å; G262-I265 WeakPolarHBondContact O-CG1 3.14Å; G262-I265 PolarHBondContact O-N 2.79Å; I265-P297 HydrophobicContact CG2-CB 3.94Å; I265-H298 HydrophobicContact CG2-CB 4.47Å
266	P	80.7	Confident	73	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-98.9	142.2	-166.6	36	-23.6	0	0	0	111.9	P237 A260 G262 P297 H298 K318 N319	P237-P266 HydrophobicContact CB-CB 3.45Å; P237-P266 VanDerWaalsContact CB-CB 3.45Å; P237-P266 HydrophobicContact CB-CG 3.8Å; P237-P266 HydrophobicContact CG-CB 3.9Å; A260-P266 HydrophobicContact CB-CB 4.24Å; A260-P266 HydrophobicContact CB-CG 3.57Å; A260-P266 WeakPolarHBondContact O-CG 3.34Å; G262-P266 VanDerWaalsContact CA-CD 3.47Å; P266-P297 CarbonylContact O-C 3.57Å; P266-P297 VanDerWaalsContact O-CA 3.29Å; P266-P297 WeakPolarHBondContact O-CA 3.41Å; P266-H298 PolarHBondContact O-N 2.79Å; P266-K318 CarbonylContact C-O 3.52Å; P266-K318 WeakPolarHBondContact CA-O 3.36Å; P266-N319 HydrophobicContact CB-CB 4.41Å
267	M	87.1	Confident	70.4	Confident	74 Å²	74	41.3 Å²	41.3	37%	0.365	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	132.1	165.8	-44	-49.9	-58.4	0	0	108.7	W269 P295 Q296 A317 K318	M267-W269 HydrophobicContact CB-CE3 4.42Å; M267-W269 HydrophobicContact CB-CZ3 4.21Å; M267-P295 HydrophobicContact CB-CB 3.87Å; M267-P295 HydrophobicContact CE-CB 4.38Å; M267-P295 WeakPolarHBondContact CE-O 3.37Å; M267-Q296 CarbonylContact C-O 3Å; M267-Q296 VanDerWaalsContact CA-O 3.31Å; M267-Q296 WeakPolarHBondContact CA-O 3.33Å; M267-A317 CarbonylContact O-C 3.52Å; M267-A317 WeakPolarHBondContact O-CA 3.2Å; M267-A317 WeakPolarHBondContact O-CB 3.41Å; M267-K318 PolarHBondContact N-O 2.77Å; M267-K318 PolarHBondContact O-N 2.81Å
268	V	88.5	Confident	67.6	Low	0 Å²	0	44.8 Å²	44.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	143.4	177.3	-167	0	0	0	0	108.4	C258 A260 P295 Q296 A300 I316 A317	C258-V268 HydrophobicContact CB-CG1 4.44Å; A260-V268 HydrophobicContact CB-CG2 3.45Å; A260-V268 VanDerWaalsContact CB-CG2 3.45Å; V268-P295 CarbonylContact O-C 3.45Å; V268-P295 VanDerWaalsContact O-CA 3.31Å; V268-P295 WeakPolarHBondContact O-CA 3.4Å; V268-Q296 PolarHBondContact N-O 3.2Å; V268-Q296 PolarHBondContact O-N 2.81Å; V268-A300 VanDerWaalsContact C-CB 3.48Å; V268-A300 HydrophobicContact CB-CB 3.86Å; V268-A300 HydrophobicContact CG1-CB 3.9Å; V268-A300 WeakPolarHBondContact O-CB 3.28Å; V268-I316 CarbonylContact C-O 3.58Å; V268-I316 WeakPolarHBondContact CA-O 3.35Å; V268-A317 HydrophobicContact CB-CB 4.27Å; V268-A317 HydrophobicContact CG1-CB 4.18Å; V268-A317 HydrophobicContact CG2-CB 4.04Å
269	W	89.4	Confident	65.1	Low	38 Å²	38	51.2 Å²	51.2	14%	0.144	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	163.6	172.2	65.4	95.1	0	0	0	112.2	M267 A291 T293 P295 I316 K318 L323	M267-W269 HydrophobicContact CB-CE3 4.42Å; M267-W269 HydrophobicContact CB-CZ3 4.21Å; W269-A291 HydrophobicContact CB-CB 4.49Å; W269-A291 HydrophobicContact CG-CB 4.29Å; W269-T293 VanDerWaalsContact CA-OG1 3.23Å; W269-T293 WeakPolarHBondContact CA-OG1 3.41Å; W269-T293 WeakPolarHBondContact CB-OG1 3.24Å; W269-P295 HydrophobicContact CD2-CG 4.43Å; W269-P295 HydrophobicContact CE3-CB 3.92Å; W269-P295 HydrophobicContact CE3-CG 4.27Å; W269-I316 HydrophobicContact CD2-CB 4.25Å; W269-I316 HydrophobicContact CD2-CG2 4.43Å; W269-I316 HydrophobicContact CH2-CG2 4.01Å; W269-I316 HydrophobicContact CZ2-CB 4.11Å; W269-I316 HydrophobicContact CZ2-CG2 3.46Å; W269-I316 VanDerWaalsContact CZ2-CG2 3.46Å; W269-I316 PolarHBondContact N-O 2.81Å; W269-I316 PolarHBondContact O-N 2.82Å; W269-K318 HydrophobicContact CH2-CB 3.64Å; W269-K318 HydrophobicContact CH2-CD 4.38Å; W269-K318 HydrophobicContact CZ3-CB 3.68Å; W269-L323 HydrophobicContact CH2-CD1 4.4Å
270	W	88.2	Confident	62.6	Low	0 Å²	0	58.4 Å²	58.4	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	158.3	175.8	-72.8	82.4	0	0	0	113.6	M242 L256 C258 A291 L292 T293 A300 L302 N314 C315 V328	M242-W270 HydrophobicContact CE-CH2 3.5Å; M242-W270 HydrophobicContact CE-CZ3 3.53Å; M242-W270 HydrophobicContact CG-CH2 3.83Å; M242-W270 HydrophobicContact CG-CZ2 4.39Å; M242-W270 HydrophobicContact SD-CH2 3.77Å; M242-W270 HydrophobicContact SD-CZ2 4.49Å; M242-W270 HydrophobicContact SD-CZ3 4.19Å; L256-W270 HydrophobicContact CB-CH2 3.59Å; L256-W270 HydrophobicContact CB-CZ2 3.68Å; L256-W270 HydrophobicContact CB-CZ3 4.1Å; L256-W270 HydrophobicContact CD1-CH2 4.37Å; L256-W270 HydrophobicContact CD1-CZ3 4.12Å; L256-W270 WeakPolarHBondContact O-CZ2 3.49Å; L256-W270 PolarHBondContact O-NE1 2.82Å; C258-W270 HydrophobicContact CB-CH2 4.33Å; C258-W270 HydrophobicContact CB-CZ2 3.42Å; C258-W270 VanDerWaalsContact CB-CZ2 3.42Å; W270-A291 CarbonylContact O-C 3.58Å; W270-A291 VanDerWaalsContact O-CA 3.25Å; W270-A291 WeakPolarHBondContact O-CA 3.37Å; W270-L292 HydrophobicContact CB-CB 4.15Å; W270-L292 PolarHBondContact O-N 2.78Å; W270-T293 HydrophobicContact CB-CG2 4.14Å; W270-T293 HydrophobicContact CG-CG2 4.33Å; W270-T293 PolarHBondContact N-OG1 2.88Å; W270-T293 VanDerWaalsContact N-OG1 3.09Å; W270-A300 PolarHBondContact NE1-O 2.83Å; W270-L302 HydrophobicContact CB-CB 3.95Å; W270-L302 HydrophobicContact CB-CD2 3.77Å; W270-L302 HydrophobicContact CB-CG 4.41Å; W270-L302 HydrophobicContact CD2-CB 3.72Å; W270-L302 HydrophobicContact CD2-CD2 3.97Å; W270-L302 HydrophobicContact CE3-CB 4.35Å; W270-L302 HydrophobicContact CE3-CD2 3.86Å; W270-L302 HydrophobicContact CG-CB 3.5Å; W270-L302 HydrophobicContact CG-CD2 3.97Å; W270-L302 HydrophobicContact CG-CG 4.37Å; W270-N314 CarbonylContact C-O 3.53Å; W270-N314 VanDerWaalsContact CA-O 3.31Å; W270-N314 WeakPolarHBondContact CA-O 3.35Å; W270-N314 VanDerWaalsContact CE3-C 3.4Å; W270-C315 HydrophobicContact CD2-CB 4.32Å; W270-C315 HydrophobicContact CE3-CB 4.34Å; W270-C315 HydrophobicContact CH2-CB 4.28Å; W270-C315 HydrophobicContact CZ2-CB 4.25Å; W270-C315 HydrophobicContact CZ3-CB 4.32Å; W270-V328 HydrophobicContact CH2-CG1 4.09Å; W270-V328 HydrophobicContact CZ3-CG1 3.76Å
271	S	80.9	Confident	60.3	Low	3 Å²	3	62.5 Å²	62.5	2%	0.021	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	167.3	164	78.1	0	0	0	0	110.9	L292 N314	S271-L292 VanDerWaalsContact C-CD1 3.45Å; S271-N314 PolarHBondContact N-O 3.45Å; S271-N314 PolarHBondContact O-N 3.24Å
272	T	65.5	Low	58.1	Low	65 Å²	65	65.9 Å²	65.9	40%	0.399	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	151.6	169.3	46.5	0	0	0	0	111.1	L292 Y313	T272-L292 HydrophobicContact CG2-CD1 3.93Å; T272-L292 HydrophobicContact CG2-CD2 4.38Å; T272-Y313 HydrophobicContact CG2-CD1 4.49Å; T272-Y313 HydrophobicContact CG2-CE1 4.39Å
273	L	64.7	Low	56.1	Low	63 Å²	63	66.8 Å²	66.8	33%	0.33	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-72.8	124.3	154.6	-87.5	164.8	0	0	0	108.4	G312 N314 N327	L273-G312 WeakPolarHBondContact CB-O 3.28Å; L273-G312 PolarHBondContact N-O 2.9Å; L273-G312 VanDerWaalsContact N-O 3.1Å; L273-N314 WeakPolarHBondContact CD2-OD1 3.06Å; L273-N314 WeakPolarHBondContact CG-OD1 3.46Å; L273-N327 HydrophobicContact CD1-CB 4.26Å
274	G	48.2	Very low	54.2	Low	59 Å²	59	68.6 Å²	68.6	61%	0.608	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-68.4	138.9	172.7	0	0	0	0	0	111
275	T	35.6	Very low	52.1	Low	80 Å²	80	70.3 Å²	70.3	49%	0.491	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-72.4	140.9	-179.8	44.9	0	0	0	0	111.8	A277 Q1440 E1441	T275-A277 PolarHBondContact O-N 3.19Å; T275-Q1440 PolarHBondContact OG1-O 3.24Å; T275-E1441 VanDerWaalsContact CG2-O 3.26Å; T275-E1441 WeakPolarHBondContact CG2-O 3.28Å
276	P	27.1	Very low	49.9	Very low	135 Å²	135	74.1 Å²	74.1	88%	0.877	46%	0.461	S	S	*	.			trans	-84.9	95.7	-177.5	32.2	-34.1	0	0	0	112.5
277	A	27.7	Very low	47.3	Very low	96 Å²	96	78.3 Å²	78.3	79%	0.793	48%	0.483	S	S	*	.			trans	-152.6	128.7	170.1	0	0	0	0	0	113.8	T275	T275-A277 PolarHBondContact O-N 3.19Å
278	G	27.4	Very low	44.6	Very low	76 Å²	76	79.2 Å²	79.2	78%	0.784	50%	0.497	S	S	*	.			trans	98.6	146.4	164.3	0	0	0	0	0	117.3
279	P	31.9	Very low	42.6	Very low	135 Å²	135	83.2 Å²	83.2	88%	0.877	52%	0.516	S	S	*	.			trans	-93.8	170.3	-173.2	36	-36.4	0	0	0	117.4
280	R	34.6	Very low	40.7	Very low	168 Å²	168	91.4 Å²	91.4	63%	0.634	55%	0.547	S	S	*	.			trans	-51.1	166.2	176.1	-83.8	179.5	161.2	161.9	-1.3	116.1	D1432	R280-D1432 WeakPolarHBondContact CD-OD2 3.43Å; R280-D1432 WeakPolarHBondContact CG-OD2 3.1Å; R280-D1432 IonicContact CZ-OD2 3.51Å; R280-D1432 IonicContact NE-OD2 2.68Å; R280-D1432 PolarHBondContact NE-OD2 3.34Å; R280-D1432 IonicContact NH2-OD2 3.35Å
281	P	32.9	Very low	39	Very low	86 Å²	86	93.5 Å²	93.5	56%	0.558	56%	0.564	S	S	*	*			cis	-148.9	158.1	35.5	41.3	-21.3	0	0	0	120.5	K1434	P281-K1434 WeakPolarHBondContact O-CE 3.31Å; P281-K1434 PolarHBondContact O-NZ 3.24Å
282	S	27	Very low	38.5	Very low	75 Å²	75	96.6 Å²	96.6	52%	0.524	58%	0.58	S	S	.	*			trans	66.3	151.4	152.3	58.5	0	0	0	0	122.7	D1432 N1433 K1434	S282-D1432 WeakPolarHBondContact CA-OD1 3.19Å; S282-D1432 PolarHBondContact N-OD1 2.83Å; S282-N1433 WeakPolarHBondContact CA-ND2 3.31Å; S282-K1434 WeakPolarHBondContact O-CE 3.38Å
283	G	28.1	Very low	38.9	Very low	23 Å²	23	94.4 Å²	94.4	24%	0.237	57%	0.566	C	S	.	*			trans	106.6	113.6	175.5	0	0	0	0	0	116	I285 N1433	G283-I285 PolarHBondContact O-N 3.04Å; G283-N1433 VanDerWaalsContact C-CB 3.46Å; G283-N1433 PolarHBondContact N-ND2 3.41Å; G283-N1433 VanDerWaalsContact O-CB 3.23Å; G283-N1433 WeakPolarHBondContact O-CB 3.49Å
284	P	28.2	Very low	39.4	Very low	97 Å²	97	98.4 Å²	98.4	63%	0.63	58%	0.583	S	S	*	*			trans	-80.3	55.7	-169.2	32.4	-36.8	0	0	0	113.4	M286 F1431 N1433	P284-M286 PolarHBondContact O-N 2.99Å; P284-F1431 HydrophobicContact CG-CE1 4.19Å; P284-N1433 WeakPolarHBondContact CA-OD1 3.04Å; P284-N1433 VanDerWaalsContact CB-OD1 3.25Å; P284-N1433 WeakPolarHBondContact CB-OD1 3.14Å; P284-N1433 VanDerWaalsContact CD-OD1 3.24Å; P284-N1433 WeakPolarHBondContact CD-OD1 3.49Å
285	I	27.4	Very low	40.9	Very low	102 Å²	102	98.9 Å²	98.9	52%	0.523	58%	0.575	S	S	.	*			trans	-86.4	110.2	-172.6	-45.7	176.7	0	0	0	110.1	G283 L287 L1436	G283-I285 PolarHBondContact O-N 3.04Å; I285-L287 HydrophobicContact CG2-CD1 3.6Å; I285-L287 PolarHBondContact O-N 3.24Å; I285-L1436 HydrophobicContact CB-CD1 4.14Å; I285-L1436 HydrophobicContact CG2-CD1 4.2Å
286	M	26.8	Very low	42.8	Very low	181 Å²	181	97.7 Å²	97.7	89%	0.892	57%	0.565	S	S	*	*			trans	-67.2	114	165	-63.9	-170.3	-60.3	0	0	110.2	P284	P284-M286 PolarHBondContact O-N 2.99Å
287	L	26.3	Very low	45.1	Very low	89 Å²	89	94.7 Å²	94.7	47%	0.466	55%	0.545	S	S	.	.			trans	-129.5	136.8	144.5	-76.2	85.2	0	0	0	110.2	I285 E289 L1436	I285-L287 HydrophobicContact CG2-CD1 3.6Å; I285-L287 PolarHBondContact O-N 3.24Å; L287-E289 PolarHBondContact O-N 2.81Å; L287-L1436 HydrophobicContact CB-CB 4.43Å; L287-L1436 HydrophobicContact CB-CD2 3.86Å; L287-L1436 HydrophobicContact CB-CG 3.79Å; L287-L1436 HydrophobicContact CD1-CD1 4.05Å; L287-L1436 HydrophobicContact CD1-CD2 3.83Å; L287-L1436 HydrophobicContact CD1-CG 3.59Å; L287-L1436 HydrophobicContact CD2-CD2 4.09Å; L287-L1436 HydrophobicContact CG-CD2 4.13Å; L287-L1436 HydrophobicContact CG-CG 4.18Å; L287-L1436 WeakPolarHBondContact O-CA 3.22Å; L287-L1436 PolarHBondContact O-N 2.9Å; L287-L1436 VanDerWaalsContact O-N 3.09Å
288	S	30.6	Very low	47.2	Very low	93 Å²	93	94.1 Å²	94.1	65%	0.65	53%	0.526	S	S	*	.			trans	-7.1	104.7	162.4	55.5	0	0	0	0	116.8	R290	S288-R290 PolarHBondContact O-N 2.89Å; S288-R290 VanDerWaalsContact O-N 3.16Å
289	E	46	Very low	50	Low	84 Å²	84	92.4 Å²	92.4	39%	0.393	50%	0.497	S	S	.	.			trans	-55.6	112.6	134.4	-68.4	177.4	133.4	0	0	106.4	L287 A291 I316 R325	L287-E289 PolarHBondContact O-N 2.81Å; E289-A291 PolarHBondContact O-N 2.64Å; E289-I316 WeakPolarHBondContact OE2-CD1 3.45Å; E289-R325 IonicContact OE1-CZ 2.81Å; E289-R325 IonicContact OE1-NH1 2.68Å; E289-R325 PolarHBondContact OE1-NH1 2.76Å; E289-R325 IonicContact OE1-NH2 3.66Å; E289-R325 PolarHBondContact OE1-NH2 2.86Å; E289-R325 IonicContact OE2-CZ 3.36Å; E289-R325 IonicContact OE2-NH1 2.65Å; E289-R325 IonicContact OE2-NH2 2.74Å; E289-R325 PolarHBondContact OE2-NH2 3.45Å
290	R	48.8	Very low	52.4	Low	210 Å²	210	86.1 Å²	86.1	79%	0.792	46%	0.456	S	S	*	.			trans	-73.4	103.6	-175.3	-167	176.9	-169.8	171.9	2.3	108.2	S288 L292	S288-R290 PolarHBondContact O-N 2.89Å; S288-R290 VanDerWaalsContact O-N 3.16Å; R290-L292 PolarHBondContact O-N 3.48Å
291	A	54.1	Low	54.9	Low	44 Å²	44	79.3 Å²	79.3	36%	0.364	43%	0.433	S	S	.	.			trans	-58.3	124.1	178.1	0	0	0	0	0	109.4	W269 W270 E289 T293	W269-A291 HydrophobicContact CB-CB 4.49Å; W269-A291 HydrophobicContact CG-CB 4.29Å; W270-A291 CarbonylContact O-C 3.58Å; W270-A291 VanDerWaalsContact O-CA 3.25Å; W270-A291 WeakPolarHBondContact O-CA 3.37Å; E289-A291 PolarHBondContact O-N 2.64Å; A291-T293 VanDerWaalsContact CB-O 3.32Å; A291-T293 WeakPolarHBondContact CB-O 3.4Å
292	L	69.1	Low	57.3	Low	67 Å²	67	75.7 Å²	75.7	35%	0.351	41%	0.409	S	S	.	.	S	Bend	trans	-80.9	-11.6	179.2	-63.9	172.9	0	0	0	111.9	W270 S271 T272 R290 L302 Y313	W270-L292 HydrophobicContact CB-CB 4.15Å; W270-L292 PolarHBondContact O-N 2.78Å; S271-L292 VanDerWaalsContact C-CD1 3.45Å; T272-L292 HydrophobicContact CG2-CD1 3.93Å; T272-L292 HydrophobicContact CG2-CD2 4.38Å; R290-L292 PolarHBondContact O-N 3.48Å; L292-L302 HydrophobicContact CB-CD1 3.82Å; L292-L302 HydrophobicContact CB-CD2 4.23Å; L292-L302 HydrophobicContact CD1-CD1 4.15Å; L292-L302 HydrophobicContact CD1-CD2 3.46Å; L292-L302 VanDerWaalsContact CD1-CD2 3.46Å; L292-L302 HydrophobicContact CD1-CG 4.46Å; L292-L302 HydrophobicContact CG-CD2 4.5Å; L292-Y313 HydrophobicContact CD1-CD1 3.81Å; L292-Y313 HydrophobicContact CD1-CE1 4.18Å
293	T	74.1	Confident	60	Low	19 Å²	19	72.7 Å²	72.7	12%	0.117	39%	0.387	C	S	.	.	S	Bend	trans	-134.6	157.4	173.9	66	0	0	0	0	108.3	W269 W270 A291 T301 L302	W269-T293 VanDerWaalsContact CA-OG1 3.23Å; W269-T293 WeakPolarHBondContact CA-OG1 3.41Å; W269-T293 WeakPolarHBondContact CB-OG1 3.24Å; W270-T293 HydrophobicContact CB-CG2 4.14Å; W270-T293 HydrophobicContact CG-CG2 4.33Å; W270-T293 PolarHBondContact N-OG1 2.88Å; W270-T293 VanDerWaalsContact N-OG1 3.09Å; A291-T293 VanDerWaalsContact CB-O 3.32Å; A291-T293 WeakPolarHBondContact CB-O 3.4Å; T293-T301 WeakPolarHBondContact CG2-O 3.49Å; T293-L302 HydrophobicContact CG2-CB 4.32Å
294	E	75.4	Confident	62.2	Low	148 Å²	148	72.3 Å²	72.3	69%	0.692	38%	0.379	S	S	*	.			trans	-67.4	153.2	166.7	-63.7	-154.8	150.3	0	0	110.4	Q296	E294-Q296 PolarHBondContact O-N 3.41Å
295	P	78.8	Confident	64.5	Low	68 Å²	68	70.1 Å²	70.1	44%	0.442	36%	0.364	S	S	.	.			trans	-67.8	111.2	172.2	-19.6	33.5	0	0	0	110.8	M267 V268 W269	M267-P295 HydrophobicContact CB-CB 3.87Å; M267-P295 HydrophobicContact CE-CB 4.38Å; M267-P295 WeakPolarHBondContact CE-O 3.37Å; V268-P295 CarbonylContact O-C 3.45Å; V268-P295 VanDerWaalsContact O-CA 3.31Å; V268-P295 WeakPolarHBondContact O-CA 3.4Å; W269-P295 HydrophobicContact CD2-CG 4.43Å; W269-P295 HydrophobicContact CE3-CB 3.92Å; W269-P295 HydrophobicContact CE3-CG 4.27Å
296	Q	76.3	Confident	66.4	Low	56 Å²	56	70.5 Å²	70.5	26%	0.262	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	141.9	-173.5	-76	-75.4	25.3	0	0	111	M267 V268 E294 E299 A300 D2308	M267-Q296 CarbonylContact C-O 3Å; M267-Q296 VanDerWaalsContact CA-O 3.31Å; M267-Q296 WeakPolarHBondContact CA-O 3.33Å; V268-Q296 PolarHBondContact N-O 3.2Å; V268-Q296 PolarHBondContact O-N 2.81Å; E294-Q296 PolarHBondContact O-N 3.41Å; Q296-E299 WeakPolarHBondContact CB-O 3.4Å; Q296-A300 HydrophobicContact CB-CB 4.46Å; Q296-D2308 PolarHBondContact NE2-OD1 2.81Å; Q296-D2308 PolarHBondContact NE2-OD2 1.86Å
297	P	75.7	Confident	68.3	Low	71 Å²	71	62.3 Å²	62.3	46%	0.461	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	135.2	177.7	29.4	-32.7	0	0	0	110.6	I265 P266 E299	I265-P297 HydrophobicContact CG2-CB 3.94Å; P266-P297 CarbonylContact O-C 3.57Å; P266-P297 VanDerWaalsContact O-CA 3.29Å; P266-P297 WeakPolarHBondContact O-CA 3.41Å; P297-E299 PolarHBondContact O-N 2.83Å
298	H	71.5	Confident	69.9	Low	85 Å²	85	61.1 Å²	61.1	39%	0.394	32%	0.323	S	S	.	.	S	Bend	trans	71.1	-28.8	175.8	-150.2	6.3	0	0	0	116.1	R259 A260 I265 P266 E1948	R259-H298 CarbonylContact C-O 3.55Å; R259-H298 WeakPolarHBondContact CA-O 3.39Å; A260-H298 PolarHBondContact N-O 2.8Å; A260-H298 VanDerWaalsContact O-CA 3.32Å; A260-H298 WeakPolarHBondContact O-CA 3.21Å; A260-H298 PolarHBondContact O-ND1 2.98Å; I265-H298 HydrophobicContact CG2-CB 4.47Å; P266-H298 PolarHBondContact O-N 2.79Å; H298-E1948 VanDerWaalsContact CE1-CD 3.49Å; H298-E1948 IonicContact CE1-OE1 3.98Å; H298-E1948 PolarHBondContact CE1-OE1 3.08Å; H298-E1948 VanDerWaalsContact CE1-OE1 3.26Å; H298-E1948 IonicContact CE1-OE2 3.82Å; H298-E1948 PolarHBondContact CE1-OE2 2.98Å; H298-E1948 IonicContact ND1-OE1 2.7Å; H298-E1948 IonicContact ND1-OE2 3.76Å; H298-E1948 PolarHBondContact ND1-OE2 3.4Å; H298-E1948 VanDerWaalsContact ND1-OE2 3.17Å; H298-E1948 IonicContact NE2-OE2 2.7Å
299	E	86.7	Confident	71	Confident	40 Å²	40	58.5 Å²	58.5	19%	0.187	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	143.4	-173.6	174.1	161.9	-146.4	0	0	113.9	T257 R259 Q296 P297	T257-E299 WeakPolarHBondContact CG2-OE1 3.26Å; R259-E299 HydrophobicContact CG-CB 3.83Å; R259-E299 HydrophobicContact CG-CG 3.71Å; R259-E299 IonicContact CZ-OE1 3.81Å; R259-E299 IonicContact CZ-OE2 3.24Å; R259-E299 VanDerWaalsContact CZ-OE2 3.31Å; R259-E299 IonicContact NE-OE1 3.15Å; R259-E299 PolarHBondContact NE-OE1 2.84Å; R259-E299 IonicContact NE-OE2 3.71Å; R259-E299 PolarHBondContact NE-OE2 2.86Å; R259-E299 VanDerWaalsContact NE-OE2 3.14Å; R259-E299 IonicContact NH2-OE1 3.76Å; R259-E299 PolarHBondContact NH2-OE1 2.92Å; R259-E299 IonicContact NH2-OE2 2.88Å; R259-E299 PolarHBondContact NH2-OE2 2.89Å; Q296-E299 WeakPolarHBondContact CB-O 3.4Å; P297-E299 PolarHBondContact O-N 2.83Å
300	A	82.5	Confident	72.1	Confident	2 Å²	2	57.2 Å²	57.2	2%	0.017	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	153.1	159.7	0	0	0	0	0	113.4	C258 V268 W270 Q296	C258-A300 CarbonylContact C-O 3.51Å; C258-A300 PolarHBondContact N-O 3.33Å; C258-A300 CarbonylContact O-C 3.59Å; C258-A300 PolarHBondContact O-N 2.87Å; V268-A300 VanDerWaalsContact C-CB 3.48Å; V268-A300 HydrophobicContact CB-CB 3.86Å; V268-A300 HydrophobicContact CG1-CB 3.9Å; V268-A300 WeakPolarHBondContact O-CB 3.28Å; W270-A300 PolarHBondContact NE1-O 2.83Å; Q296-A300 HydrophobicContact CB-CB 4.46Å
301	T	86.6	Confident	72.9	Confident	25 Å²	25	49.4 Å²	49.4	15%	0.153	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	131.2	-155.3	-13	0	0	0	0	108.3	L256 T257 T293 E2303	L256-T301 CarbonylContact O-C 3.57Å; L256-T301 WeakPolarHBondContact O-CA 3.34Å; T257-T301 VanDerWaalsContact CA-CG2 3.43Å; T257-T301 HydrophobicContact CG2-CG2 3.64Å; T257-T301 WeakPolarHBondContact OG1-CG2 3.26Å; T293-T301 WeakPolarHBondContact CG2-O 3.49Å; T301-E2303 VanDerWaalsContact CB-OE1 3.23Å; T301-E2303 WeakPolarHBondContact CB-OE1 3.25Å; T301-E2303 VanDerWaalsContact CG2-CD 3.48Å; T301-E2303 HydrophobicContact CG2-CG 4.22Å; T301-E2303 WeakPolarHBondContact CG2-OE1 3.37Å; T301-E2303 WeakPolarHBondContact O-CB 3.5Å; T301-E2303 WeakPolarHBondContact O-CG 3.23Å
302	L	83.8	Confident	74	Confident	10 Å²	10	48.1 Å²	48.1	5%	0.052	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	113.1	-172.3	170.3	62.9	0	0	0	113.7	L256 W270 L292 T293 L304 Y313 E2303	L256-L302 WeakPolarHBondContact CA-O 3.38Å; L256-L302 HydrophobicContact CB-CB 4.28Å; L256-L302 WeakPolarHBondContact CB-O 3.32Å; L256-L302 HydrophobicContact CD1-CD2 4.25Å; L256-L302 HydrophobicContact CD1-CG 4.46Å; L256-L302 PolarHBondContact N-O 3.35Å; L256-L302 PolarHBondContact O-N 2.79Å; W270-L302 HydrophobicContact CB-CB 3.95Å; W270-L302 HydrophobicContact CB-CD2 3.77Å; W270-L302 HydrophobicContact CB-CG 4.41Å; W270-L302 HydrophobicContact CD2-CB 3.72Å; W270-L302 HydrophobicContact CD2-CD2 3.97Å; W270-L302 HydrophobicContact CE3-CB 4.35Å; W270-L302 HydrophobicContact CE3-CD2 3.86Å; W270-L302 HydrophobicContact CG-CB 3.5Å; W270-L302 HydrophobicContact CG-CD2 3.97Å; W270-L302 HydrophobicContact CG-CG 4.37Å; L292-L302 HydrophobicContact CB-CD1 3.82Å; L292-L302 HydrophobicContact CB-CD2 4.23Å; L292-L302 HydrophobicContact CD1-CD1 4.15Å; L292-L302 HydrophobicContact CD1-CD2 3.46Å; L292-L302 VanDerWaalsContact CD1-CD2 3.46Å; L292-L302 HydrophobicContact CD1-CG 4.46Å; L292-L302 HydrophobicContact CG-CD2 4.5Å; T293-L302 HydrophobicContact CG2-CB 4.32Å; L302-L304 HydrophobicContact CD1-CD2 4.06Å; L302-L304 HydrophobicContact CD2-CD2 4.3Å; L302-L304 HydrophobicContact CG-CD2 3.91Å; L302-Y313 HydrophobicContact CD2-CD1 3.54Å; L302-Y313 HydrophobicContact CD2-CE1 4.18Å; L302-Y313 HydrophobicContact CD2-CG 3.93Å; L302-E2303 VanDerWaalsContact CA-OE2 3.26Å; L302-E2303 WeakPolarHBondContact CA-OE2 3.15Å; L302-E2303 VanDerWaalsContact N-CD 3.33Å; L302-E2303 PolarHBondContact N-OE2 2.87Å; L302-E2303 VanDerWaalsContact O-OE2 3.14Å
303	R	82.2	Confident	74.7	Confident	12 Å²	12	46.6 Å²	46.6	5%	0.045	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	132.2	-164.9	-131.7	121.4	48.3	-162.5	169.9	106.1	T254 N255 H2299 K2300 K2302 E2303 Q2304	T254-R303 WeakPolarHBondContact O-CA 3.41Å; N255-R303 HydrophobicContact CB-CG 4.08Å; N255-R303 WeakPolarHBondContact ND2-CD 3.38Å; N255-R303 WeakPolarHBondContact OD1-CD 3.22Å; N255-R303 WeakPolarHBondContact OD1-CG 3.46Å; R303-H2299 WeakPolarHBondContact CD-O 3.35Å; R303-H2299 WeakPolarHBondContact CG-O 3Å; R303-H2299 PolarHBondContact NE-O 3.17Å; R303-K2300 CarbonylContact C-O 3.57Å; R303-K2300 VanDerWaalsContact CB-O 3.27Å; R303-K2300 WeakPolarHBondContact CB-O 3.4Å; R303-K2300 VanDerWaalsContact CG-CA 3.42Å; R303-K2300 WeakPolarHBondContact CG-O 3.31Å; R303-K2302 PolarHBondContact NH1-O 3.1Å; R303-E2303 WeakPolarHBondContact CA-OE2 3.38Å; R303-E2303 VanDerWaalsContact CB-CA 3.41Å; R303-E2303 HydrophobicContact CB-CB 3.42Å; R303-E2303 VanDerWaalsContact CB-CB 3.42Å; R303-E2303 HydrophobicContact CB-CG 3.82Å; R303-E2303 WeakPolarHBondContact CB-OE2 3.48Å; R303-E2303 WeakPolarHBondContact CD-OE1 3.31Å; R303-E2303 WeakPolarHBondContact CD-OE2 3.36Å; R303-E2303 HydrophobicContact CG-CB 4.36Å; R303-E2303 HydrophobicContact CG-CG 4.29Å; R303-E2303 VanDerWaalsContact CG-OE2 3.29Å; R303-E2303 WeakPolarHBondContact CG-OE2 3.47Å; R303-E2303 IonicContact CZ-OE1 3.9Å; R303-E2303 PolarHBondContact N-OE2 2.85Å; R303-E2303 IonicContact NE-OE1 3.78Å; R303-E2303 PolarHBondContact NE-OE1 2.76Å; R303-E2303 VanDerWaalsContact NE-OE1 3.1Å; R303-E2303 IonicContact NE-OE2 3.31Å; R303-E2303 VanDerWaalsContact NH1-CG 3.32Å; R303-E2303 IonicContact NH1-OE1 2.66Å; R303-E2303 IonicContact NH2-OE1 2.73Å; R303-E2303 PolarHBondContact NH2-OE1 2.86Å; R303-Q2304 WeakPolarHBondContact O-CA 3.33Å; R303-Q2304 VanDerWaalsContact O-CB 3.26Å; R303-Q2304 WeakPolarHBondContact O-CB 3.04Å; R303-Q2304 PolarHBondContact O-N 2.86Å; R303-Q2304 VanDerWaalsContact O-N 3.09Å
304	L	75.5	Confident	75.2	Confident	16 Å²	16	46.5 Å²	46.5	8%	0.084	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	97.4	-160.1	-62.3	-179.6	0	0	0	111.2	T254 L256 L302 I307 Y313 V330 K2300	T254-L304 HydrophobicContact CG2-CB 4.4Å; T254-L304 HydrophobicContact CG2-CD1 4.03Å; T254-L304 HydrophobicContact CG2-CG 4.48Å; T254-L304 PolarHBondContact O-N 2.79Å; L256-L304 HydrophobicContact CD1-CD1 3.72Å; L256-L304 HydrophobicContact CD1-CG 4.3Å; L256-L304 HydrophobicContact CG-CD1 4.21Å; L302-L304 HydrophobicContact CD1-CD2 4.06Å; L302-L304 HydrophobicContact CD2-CD2 4.3Å; L302-L304 HydrophobicContact CG-CD2 3.91Å; L304-I307 HydrophobicContact CB-CD1 3.81Å; L304-I307 HydrophobicContact CB-CG1 4.15Å; L304-I307 WeakPolarHBondContact O-CD1 3.36Å; L304-I307 WeakPolarHBondContact O-CG1 3.23Å; L304-Y313 HydrophobicContact CD1-CD2 3.93Å; L304-Y313 HydrophobicContact CD1-CE2 3.3Å; L304-Y313 HydrophobicContact CD2-CE1 3.83Å; L304-Y313 HydrophobicContact CD2-CE2 4.07Å; L304-Y313 HydrophobicContact CG-CE2 4.33Å; L304-V330 HydrophobicContact CD1-CG2 4.45Å; L304-K2300 WeakPolarHBondContact O-CE 3.5Å; L304-K2300 WeakPolarHBondContact O-CG 3.38Å
305	T	75.5	Confident	75.9	Confident	50 Å²	50	39.4 Å²	39.4	31%	0.307	23%	0.225	S	C	.	.			trans	-70.7	160.1	174.7	57.6	0	0	0	0	113.7	I307 K2300 Q2304	T305-I307 PolarHBondContact O-N 2.81Å; T305-K2300 HydrophobicContact CG2-CD 4.08Å; T305-K2300 HydrophobicContact CG2-CG 3.89Å; T305-Q2304 HydrophobicContact CG2-CB 3.8Å; T305-Q2304 HydrophobicContact CG2-CG 3.84Å; T305-Q2304 VanDerWaalsContact OG1-CG 3.25Å; T305-Q2304 WeakPolarHBondContact OG1-CG 3.37Å; T305-Q2304 PolarHBondContact OG1-NE2 2.56Å; T305-Q2304 VanDerWaalsContact OG1-NE2 3.08Å; T305-Q2304 PolarHBondContact OG1-OE1 3.35Å
306	D	67.5	Low	76.2	Confident	111 Å²	111	36.2 Å²	36.2	59%	0.594	20%	0.204	S	C	*	.			trans	30	72	-172.6	-105.4	3	0	0	0	116.4	T308 K2300	D306-T308 VanDerWaalsContact C-N 3.28Å; D306-T308 PolarHBondContact O-N 2.7Å; D306-K2300 VanDerWaalsContact N-NZ 3.16Å; D306-K2300 IonicContact OD1-NZ 3.82Å
307	I	67.9	Low	76.7	Confident	9 Å²	9	33.5 Å²	33.5	5%	0.046	19%	0.192	C	C	.	.			trans	-78.8	83.9	176.1	-48.3	-173.7	0	0	0	108.8	V248 G251 K252 T254 L304 T305 V330	V248-I307 HydrophobicContact CG1-CB 4.25Å; V248-I307 HydrophobicContact CG1-CD1 4.21Å; V248-I307 HydrophobicContact CG1-CG2 4.46Å; V248-I307 HydrophobicContact CG2-CD1 4.27Å; G251-I307 PolarHBondContact N-O 3.46Å; K252-I307 WeakPolarHBondContact O-CB 3.22Å; K252-I307 PolarHBondContact O-N 3.05Å; T254-I307 HydrophobicContact CG2-CD1 3.75Å; L304-I307 HydrophobicContact CB-CD1 3.81Å; L304-I307 HydrophobicContact CB-CG1 4.15Å; L304-I307 WeakPolarHBondContact O-CD1 3.36Å; L304-I307 WeakPolarHBondContact O-CG1 3.23Å; T305-I307 PolarHBondContact O-N 2.81Å; I307-V330 HydrophobicContact CD1-CG1 4.29Å; I307-V330 HydrophobicContact CG2-CG1 3.78Å
308	T	58.2	Low	76.9	Confident	63 Å²	63	35.8 Å²	35.8	39%	0.387	19%	0.194	S	C	.	.			trans	-88.1	-14.2	167.8	57.1	0	0	0	0	112.2	D306 Y1442	D306-T308 VanDerWaalsContact C-N 3.28Å; D306-T308 PolarHBondContact O-N 2.7Å; T308-Y1442 PolarHBondContact OG1-OH 2.85Å
309	E	55.6	Low	77.3	Confident	38 Å²	38	32.7 Å²	32.7	18%	0.178	18%	0.181	C	C	.	.	S	Bend	trans	-146.5	153	-170.2	-59.9	-167	-179.9	0	0	114.7	Y1442 K1443	E309-Y1442 VanDerWaalsContact CD-CD1 3.46Å; E309-Y1442 HydrophobicContact CG-CE1 4.4Å; E309-Y1442 VanDerWaalsContact OE1-CD1 3.3Å; E309-Y1442 WeakPolarHBondContact OE1-CD1 3.17Å; E309-Y1442 WeakPolarHBondContact OE1-CE1 3.48Å; E309-Y1442 WeakPolarHBondContact OE2-CA 3.31Å; E309-Y1442 WeakPolarHBondContact OE2-CD1 3.38Å; E309-K1443 WeakPolarHBondContact OE1-CE 3.45Å; E309-K1443 WeakPolarHBondContact OE1-CG 3.48Å; E309-K1443 IonicContact OE1-NZ 2.7Å; E309-K1443 WeakPolarHBondContact OE2-CA 3.27Å; E309-K1443 WeakPolarHBondContact OE2-CG 3.23Å; E309-K1443 PolarHBondContact OE2-N 3.39Å
310	S	68.3	Low	76.6	Confident	57 Å²	57	34.2 Å²	34.2	40%	0.399	21%	0.208	S	C	.	.			trans	-69.9	132.3	172.7	-64.5	0	0	0	0	112.2	V330	S310-V330 WeakPolarHBondContact CA-O 3.34Å; S310-V330 WeakPolarHBondContact CB-O 3.36Å; S310-V330 PolarHBondContact OG-O 2.82Å
311	S	64.9	Low	75.9	Confident	46 Å²	46	38.3 Å²	38.3	32%	0.322	23%	0.229	S	C	.	.			trans	-152.1	175.4	-178	52.2	0	0	0	0	110.3	Y313 S329 V330	S311-Y313 WeakPolarHBondContact OG-CE2 3.32Å; S311-Y313 PolarHBondContact OG-OH 3.48Å; S311-S329 WeakPolarHBondContact O-CA 3.48Å; S311-V330 PolarHBondContact O-N 2.8Å
312	G	77.4	Confident	75.2	Confident	17 Å²	17	38.4 Å²	38.4	18%	0.175	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	157.9	179.7	0	0	0	0	0	115.2	L273 V328	L273-G312 WeakPolarHBondContact CB-O 3.28Å; L273-G312 PolarHBondContact N-O 2.9Å; L273-G312 VanDerWaalsContact N-O 3.1Å; G312-V328 CarbonylContact C-O 3.33Å; G312-V328 WeakPolarHBondContact CA-O 3.28Å
313	Y	85.2	Confident	75.1	Confident	35 Å²	35	41.9 Å²	41.9	14%	0.137	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	155.7	-166.3	-56.3	-87.4	0	0	0	112.5	L256 T272 L292 L302 L304 S311 N327 V328	L256-Y313 HydrophobicContact CD1-CD2 3.55Å; L256-Y313 HydrophobicContact CD1-CE2 4.3Å; L256-Y313 HydrophobicContact CD1-CG 3.83Å; T272-Y313 HydrophobicContact CG2-CD1 4.49Å; T272-Y313 HydrophobicContact CG2-CE1 4.39Å; L292-Y313 HydrophobicContact CD1-CD1 3.81Å; L292-Y313 HydrophobicContact CD1-CE1 4.18Å; L302-Y313 HydrophobicContact CD2-CD1 3.54Å; L302-Y313 HydrophobicContact CD2-CE1 4.18Å; L302-Y313 HydrophobicContact CD2-CG 3.93Å; L304-Y313 HydrophobicContact CD1-CD2 3.93Å; L304-Y313 HydrophobicContact CD1-CE2 3.3Å; L304-Y313 HydrophobicContact CD2-CE1 3.83Å; L304-Y313 HydrophobicContact CD2-CE2 4.07Å; L304-Y313 HydrophobicContact CG-CE2 4.33Å; S311-Y313 WeakPolarHBondContact OG-CE2 3.32Å; S311-Y313 PolarHBondContact OG-OH 3.48Å; Y313-N327 CarbonylContact O-C 3.53Å; Y313-N327 VanDerWaalsContact O-CA 3.31Å; Y313-N327 WeakPolarHBondContact O-CA 3.33Å; Y313-V328 PolarHBondContact N-O 2.02Å; Y313-V328 PolarHBondContact O-N 2.85Å
314	N	84.2	Confident	75.1	Confident	17 Å²	17	43.2 Å²	43.2	9%	0.091	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.7	175.8	-73	-27.5	0	0	0	110.9	W270 S271 L273 R326 N327	W270-N314 CarbonylContact C-O 3.53Å; W270-N314 VanDerWaalsContact CA-O 3.31Å; W270-N314 WeakPolarHBondContact CA-O 3.35Å; W270-N314 VanDerWaalsContact CE3-C 3.4Å; S271-N314 PolarHBondContact N-O 3.45Å; S271-N314 PolarHBondContact O-N 3.24Å; L273-N314 WeakPolarHBondContact CD2-OD1 3.06Å; L273-N314 WeakPolarHBondContact CG-OD1 3.46Å; N314-R326 CarbonylContact C-O 3.53Å; N314-R326 WeakPolarHBondContact CA-O 3.4Å; N314-N327 VanDerWaalsContact OD1-CG 3.29Å; N314-N327 PolarHBondContact OD1-OD1 2.82Å
315	C	89	Confident	75.4	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	146.3	154.8	178.7	0	0	0	0	110.1	I239 M242 C258 W270 R325 R326	I239-C315 HydrophobicContact CD1-CB 4.08Å; M242-C315 HydrophobicContact CE-CB 4.46Å; M242-C315 HydrophobicContact SD-CB 3.43Å; M242-C315 WeakPolarHBondContact SD-CB 3.36Å; C258-C315 HydrophobicContact CB-CB 3.47Å; C258-C315 VanDerWaalsContact CB-CB 3.47Å; C258-C315 WeakPolarHBondContact CB-SG 3.2Å; C258-C315 WeakPolarHBondContact SG-CB 3.31Å; C258-C315 CovalentContact SG-SG 2.01Å; C258-C315 PolarHBondContact SG-SG 2.78Å; W270-C315 HydrophobicContact CD2-CB 4.32Å; W270-C315 HydrophobicContact CE3-CB 4.34Å; W270-C315 HydrophobicContact CH2-CB 4.28Å; W270-C315 HydrophobicContact CZ2-CB 4.25Å; W270-C315 HydrophobicContact CZ3-CB 4.32Å; C315-R325 CarbonylContact O-C 3.52Å; C315-R325 WeakPolarHBondContact O-CA 3.11Å; C315-R326 PolarHBondContact N-O 3.37Å; C315-R326 PolarHBondContact O-N 3.41Å; C315-R326 VanDerWaalsContact O-N 3.1Å
316	I	85.2	Confident	75.8	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	145.4	175.4	-51.2	-179.4	0	0	0	108.5	V268 W269 E289 L323 V324 R325	V268-I316 CarbonylContact C-O 3.58Å; V268-I316 WeakPolarHBondContact CA-O 3.35Å; W269-I316 HydrophobicContact CD2-CB 4.25Å; W269-I316 HydrophobicContact CD2-CG2 4.43Å; W269-I316 HydrophobicContact CH2-CG2 4.01Å; W269-I316 HydrophobicContact CZ2-CB 4.11Å; W269-I316 HydrophobicContact CZ2-CG2 3.46Å; W269-I316 VanDerWaalsContact CZ2-CG2 3.46Å; W269-I316 PolarHBondContact N-O 2.81Å; W269-I316 PolarHBondContact O-N 2.82Å; E289-I316 WeakPolarHBondContact OE2-CD1 3.45Å; I316-L323 HydrophobicContact CG2-CD1 4.17Å; I316-L323 HydrophobicContact CG2-CD2 4.26Å; I316-L323 HydrophobicContact CG2-CG 4.23Å; I316-V324 WeakPolarHBondContact CA-O 3.2Å; I316-R325 HydrophobicContact CG1-CG 4.16Å; I316-R325 HydrophobicContact CG2-CG 4.28Å
317	A	86.7	Confident	76.5	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	152.4	171.7	0	0	0	0	0	113.3	A260 M267 V268 L323 V324 R1929	A260-A317 HydrophobicContact CB-CB 4.09Å; M267-A317 CarbonylContact O-C 3.52Å; M267-A317 WeakPolarHBondContact O-CA 3.2Å; M267-A317 WeakPolarHBondContact O-CB 3.41Å; V268-A317 HydrophobicContact CB-CB 4.27Å; V268-A317 HydrophobicContact CG1-CB 4.18Å; V268-A317 HydrophobicContact CG2-CB 4.04Å; A317-L323 VanDerWaalsContact O-CA 3.31Å; A317-L323 WeakPolarHBondContact O-CA 3.19Å; A317-L323 WeakPolarHBondContact O-CG 3.41Å; A317-V324 PolarHBondContact N-O 3.26Å; A317-V324 VanDerWaalsContact N-O 3.07Å; A317-V324 PolarHBondContact O-N 2.94Å; A317-R1929 PolarHBondContact O-NE 2.99Å; A317-R1929 PolarHBondContact O-NH1 3.13Å; A317-R1929 PolarHBondContact O-NH2 3.01Å
318	K	81.2	Confident	77.3	Confident	118 Å²	118	46.4 Å²	46.4	51%	0.513	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	139.9	-173.6	-169.9	174.4	-178.3	178.6	0	114.5	P266 M267 W269 L323	P266-K318 CarbonylContact C-O 3.52Å; P266-K318 WeakPolarHBondContact CA-O 3.36Å; M267-K318 PolarHBondContact N-O 2.77Å; M267-K318 PolarHBondContact O-N 2.81Å; W269-K318 HydrophobicContact CH2-CB 3.64Å; W269-K318 HydrophobicContact CH2-CD 4.38Å; W269-K318 HydrophobicContact CZ3-CB 3.68Å; K318-L323 HydrophobicContact CB-CD1 4.3Å; K318-L323 HydrophobicContact CD-CD1 4.35Å; K318-L323 HydrophobicContact CG-CD1 4.42Å
319	N	80.2	Confident	78.1	Confident	20 Å²	20	46.5 Å²	46.5	11%	0.107	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	-168.4	158.7	87	-27.3	0	0	0	109.8	F235 P237 P264 P266 L321 G322	F235-N319 PolarHBondContact O-ND2 2.82Å; P237-N319 WeakPolarHBondContact CD-OD1 3.14Å; P237-N319 HydrophobicContact CG-CB 3.5Å; P237-N319 WeakPolarHBondContact CG-ND2 2.99Å; P237-N319 WeakPolarHBondContact CG-OD1 3.2Å; P264-N319 VanDerWaalsContact O-CB 3.28Å; P264-N319 WeakPolarHBondContact O-CB 3.04Å; P264-N319 PolarHBondContact O-ND2 2.8Å; P266-N319 HydrophobicContact CB-CB 4.41Å; N319-L321 PolarHBondContact O-N 2.85Å; N319-L321 WeakPolarHBondContact OD1-CA 3.09Å; N319-L321 PolarHBondContact OD1-N 2.89Å; N319-G322 PolarHBondContact N-O 2.83Å; N319-G322 PolarHBondContact OD1-N 3.09Å
320	G	71.6	Confident	79.3	Confident	73 Å²	73	44.9 Å²	44.9	75%	0.753	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-5	176.6	0	0	0	0	0	117
321	L	67.4	Low	79.4	Confident	88 Å²	88	46.1 Å²	46.1	46%	0.461	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.7	-4.1	-175.8	-69.2	167.5	0	0	0	113.8	Q234 F235 P236 N319	Q234-L321 HydrophobicContact CB-CD1 4.15Å; F235-L321 VanDerWaalsContact C-CD1 3.45Å; F235-L321 WeakPolarHBondContact O-CD1 3.47Å; P236-L321 HydrophobicContact CB-CB 3.88Å; N319-L321 PolarHBondContact O-N 2.85Å; N319-L321 WeakPolarHBondContact OD1-CA 3.09Å; N319-L321 PolarHBondContact OD1-N 2.89Å
322	G	71.4	Confident	79.4	Confident	27 Å²	27	47 Å²	47	28%	0.278	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	173.1	179.9	170.5	0	0	0	0	0	117	N319 R1929	N319-G322 PolarHBondContact N-O 2.83Å; N319-G322 PolarHBondContact OD1-N 3.09Å; G322-R1929 PolarHBondContact O-NH1 2.97Å
323	L	82.9	Confident	77.6	Confident	82 Å²	82	49.3 Å²	49.3	43%	0.429	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	141.2	173.4	-178.8	146	0	0	0	112.1	W269 I316 A317 K318 R325 R1929	W269-L323 HydrophobicContact CH2-CD1 4.4Å; I316-L323 HydrophobicContact CG2-CD1 4.17Å; I316-L323 HydrophobicContact CG2-CD2 4.26Å; I316-L323 HydrophobicContact CG2-CG 4.23Å; A317-L323 VanDerWaalsContact O-CA 3.31Å; A317-L323 WeakPolarHBondContact O-CA 3.19Å; A317-L323 WeakPolarHBondContact O-CG 3.41Å; K318-L323 HydrophobicContact CB-CD1 4.3Å; K318-L323 HydrophobicContact CD-CD1 4.35Å; K318-L323 HydrophobicContact CG-CD1 4.42Å; L323-R325 HydrophobicContact CD2-CG 4.17Å; L323-R1929 VanDerWaalsContact N-CD 3.32Å
324	V	80.9	Confident	75	Confident	41 Å²	41	56.8 Å²	56.8	25%	0.248	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	160.7	-175.2	76.4	0	0	0	0	111	I239 I316 A317 R1929	I239-V324 HydrophobicContact CB-CG1 4.36Å; I239-V324 HydrophobicContact CD1-CG1 3.83Å; I239-V324 HydrophobicContact CG1-CG1 3.68Å; I316-V324 WeakPolarHBondContact CA-O 3.2Å; A317-V324 PolarHBondContact N-O 3.26Å; A317-V324 VanDerWaalsContact N-O 3.07Å; A317-V324 PolarHBondContact O-N 2.94Å; V324-R1929 HydrophobicContact CB-CG 3.75Å; V324-R1929 HydrophobicContact CG1-CG 3.87Å
325	R	82.6	Confident	72.9	Confident	115 Å²	115	61.9 Å²	61.9	43%	0.434	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	152.3	-173.2	-53.5	-177.8	169.9	-147.9	-10	111.8	E289 C315 I316 L323	E289-R325 IonicContact OE1-CZ 2.81Å; E289-R325 IonicContact OE1-NH1 2.68Å; E289-R325 PolarHBondContact OE1-NH1 2.76Å; E289-R325 IonicContact OE1-NH2 3.66Å; E289-R325 PolarHBondContact OE1-NH2 2.86Å; E289-R325 IonicContact OE2-CZ 3.36Å; E289-R325 IonicContact OE2-NH1 2.65Å; E289-R325 IonicContact OE2-NH2 2.74Å; E289-R325 PolarHBondContact OE2-NH2 3.45Å; C315-R325 CarbonylContact O-C 3.52Å; C315-R325 WeakPolarHBondContact O-CA 3.11Å; I316-R325 HydrophobicContact CG1-CG 4.16Å; I316-R325 HydrophobicContact CG2-CG 4.28Å; L323-R325 HydrophobicContact CD2-CG 4.17Å
326	R	82.8	Confident	71.4	Confident	50 Å²	50	64.5 Å²	64.5	19%	0.189	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	161.4	172.7	-176.1	166.7	179.5	169.2	-10.3	111.4	I239 M242 D244 N314 C315 D1945	I239-R326 HydrophobicContact CD1-CB 3.9Å; I239-R326 HydrophobicContact CG2-CB 4.37Å; M242-R326 HydrophobicContact CB-CG 4.26Å; M242-R326 VanDerWaalsContact CE-C 3.47Å; M242-R326 HydrophobicContact CE-CG 4.38Å; M242-R326 VanDerWaalsContact CE-O 3.31Å; M242-R326 WeakPolarHBondContact CE-O 3.49Å; M242-R326 HydrophobicContact CG-CG 4.49Å; M242-R326 VanDerWaalsContact SD-C 3.58Å; M242-R326 HydrophobicContact SD-CB 3.61Å; M242-R326 HydrophobicContact SD-CG 3.72Å; D244-R326 IonicContact OD1-CZ 2.69Å; D244-R326 IonicContact OD1-NE 3.84Å; D244-R326 PolarHBondContact OD1-NE 3.31Å; D244-R326 IonicContact OD1-NH2 3.52Å; D244-R326 PolarHBondContact OD1-NH2 3.13Å; D244-R326 IonicContact OD2-NH2 3.64Å; D244-R326 PolarHBondContact OD2-NH2 2.91Å; N314-R326 CarbonylContact C-O 3.53Å; N314-R326 WeakPolarHBondContact CA-O 3.4Å; C315-R326 PolarHBondContact N-O 3.37Å; C315-R326 PolarHBondContact O-N 3.41Å; C315-R326 VanDerWaalsContact O-N 3.1Å; R326-D1945 IonicContact CZ-OD1 2.77Å; R326-D1945 IonicContact NH1-OD1 3Å; R326-D1945 PolarHBondContact NH1-OD1 2.93Å; R326-D1945 IonicContact NH2-OD1 3.83Å
327	N	84.1	Confident	69.9	Low	86 Å²	86	67.3 Å²	67.3	46%	0.46	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	149.3	-160	-57.1	28	0	0	0	113.6	M242 L273 Y313 N314	M242-N327 VanDerWaalsContact CE-CA 3.49Å; M242-N327 WeakPolarHBondContact CE-O 3.35Å; L273-N327 HydrophobicContact CD1-CB 4.26Å; Y313-N327 CarbonylContact O-C 3.53Å; Y313-N327 VanDerWaalsContact O-CA 3.31Å; Y313-N327 WeakPolarHBondContact O-CA 3.33Å; N314-N327 VanDerWaalsContact OD1-CG 3.29Å; N314-N327 PolarHBondContact OD1-OD1 2.82Å
328	V	83.4	Confident	69.3	Low	1 Å²	1	70.4 Å²	70.4	1%	0.006	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	158.1	-177.8	62.9	0	0	0	0	114.9	M242 P243 V246 L256 W270 G312 Y313	M242-V328 HydrophobicContact CE-CB 3.6Å; M242-V328 HydrophobicContact CE-CG1 3.55Å; P243-V328 HydrophobicContact CG-CG2 4.36Å; P243-V328 VanDerWaalsContact O-CB 3.29Å; P243-V328 WeakPolarHBondContact O-CB 3.36Å; P243-V328 WeakPolarHBondContact O-CG2 3.34Å; V246-V328 HydrophobicContact CG2-CG2 4.38Å; L256-V328 HydrophobicContact CD1-CG1 3.76Å; L256-V328 HydrophobicContact CD2-CG1 4.01Å; L256-V328 HydrophobicContact CD2-CG2 3.92Å; L256-V328 HydrophobicContact CG-CG1 4.46Å; W270-V328 HydrophobicContact CH2-CG1 4.09Å; W270-V328 HydrophobicContact CZ3-CG1 3.76Å; G312-V328 CarbonylContact C-O 3.33Å; G312-V328 WeakPolarHBondContact CA-O 3.28Å; Y313-V328 PolarHBondContact N-O 2.02Å; Y313-V328 PolarHBondContact O-N 2.85Å
329	S	75.8	Confident	68.9	Low	65 Å²	65	65.3 Å²	65.3	46%	0.455	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	166.2	-174.1	-54.4	0	0	0	0	116.8	K245 V246 S311	K245-S329 CarbonylContact C-O 3.57Å; K245-S329 WeakPolarHBondContact CA-O 3.46Å; V246-S329 PolarHBondContact N-O 3.42Å; S311-S329 WeakPolarHBondContact O-CA 3.48Å
330	V	79.3	Confident	68.7	Low	4 Å²	4	67.7 Å²	67.7	2%	0.024	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	146.5	-168.4	-162.7	0	0	0	0	117.9	V246 V248 L304 I307 S310 S311	V246-V330 HydrophobicContact CB-CG1 4.46Å; V246-V330 CarbonylContact O-C 3.54Å; V246-V330 WeakPolarHBondContact O-CA 3.39Å; V248-V330 HydrophobicContact CB-CG1 4.38Å; V248-V330 HydrophobicContact CG2-CG1 3.76Å; L304-V330 HydrophobicContact CD1-CG2 4.45Å; I307-V330 HydrophobicContact CD1-CG1 4.29Å; I307-V330 HydrophobicContact CG2-CG1 3.78Å; S310-V330 WeakPolarHBondContact CA-O 3.34Å; S310-V330 WeakPolarHBondContact CB-O 3.36Å; S310-V330 PolarHBondContact OG-O 2.82Å; S311-V330 PolarHBondContact O-N 2.8Å
331	I	71.4	Confident	68.9	Low	83 Å²	83	68 Å²	68	43%	0.426	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	-177.8	-176.4	-13.3	177	0	0	0	118.6	V246 E247 V248	V246-I331 PolarHBondContact O-N 2.9Å; V246-I331 VanDerWaalsContact O-N 3.07Å; E247-I331 HydrophobicContact CG-CB 4.09Å; E247-I331 HydrophobicContact CG-CD1 3.84Å; E247-I331 HydrophobicContact CG-CG1 3.86Å; V248-I331 CarbonylContact C-O 3.53Å; V248-I331 WeakPolarHBondContact CA-O 3.34Å; V248-I331 PolarHBondContact N-O 2.81Å
332	V	65.2	Low	69.6	Low	64 Å²	64	64.9 Å²	64.9	39%	0.388	37%	0.365	S	S	.	.			trans	-148.4	0	-158	176.3	0	0	0	0	122	V248	V248-V332 VanDerWaalsContact O-CA 3.28Å; V248-V332 WeakPolarHBondContact O-CA 3.31Å; V248-V332 WeakPolarHBondContact O-CG2 3.49Å
333	K	38.5	Very low	70.1	Confident	67 Å²	67	65.8 Å²	65.8	29%	0.291	36%	0.364	S	S	.	.				0	-179.1	0	-71.4	-170.2	176.4	169.1	0	121.5	S2377 D2379	K333-S2377 VanDerWaalsContact CD-O 3.32Å; K333-S2377 WeakPolarHBondContact CD-O 3.24Å; K333-S2377 VanDerWaalsContact CE-O 3.25Å; K333-S2377 WeakPolarHBondContact CE-O 3.35Å; K333-S2377 PolarHBondContact NZ-O 3.23Å; K333-D2379 VanDerWaalsContact CE-CG 3.47Å; K333-D2379 VanDerWaalsContact CE-OD1 3.24Å; K333-D2379 WeakPolarHBondContact CE-OD1 3.43Å; K333-D2379 WeakPolarHBondContact CE-OD2 3.14Å; K333-D2379 IonicContact NZ-OD1 3.14Å; K333-D2379 PolarHBondContact NZ-OD1 3.17Å; K333-D2379 IonicContact NZ-OD2 3.8Å; K333-D2379 PolarHBondContact NZ-OD2 3.47Å
334	Q	30.2	Very low	70	Confident	192 Å²	192	62.5 Å²	62.5	90%	0.897	35%	0.348	S	S	*	.			trans	-151.2	0	-169.5	-58.9	-167.9	-86.3	0	0	121.8
335	L	40.7	Very low	69.8	Low	123 Å²	123	67.5 Å²	67.5	64%	0.644	36%	0.363	S	S	*	.				0	0	0	-64.7	177.1	0	0	0	123.1	E2289	L335-E2289 WeakPolarHBondContact CD1-OE2 3.28Å
336	P	58.7	Low	69	Low	55 Å²	55	65 Å²	65	36%	0.357	36%	0.362	S	S	.	.				0	-155	0	47.5	-34.5	0	0	0	123.8	A438 L440	P336-A438 HydrophobicContact CB-CB 3.78Å; P336-A438 VanDerWaalsContact CD-O 3.31Å; P336-A438 WeakPolarHBondContact CD-O 3.47Å; P336-A438 HydrophobicContact CG-CB 3.92Å; P336-A438 WeakPolarHBondContact CG-O 3.32Å; P336-L440 VanDerWaalsContact CG-O 3.31Å; P336-L440 WeakPolarHBondContact CG-O 3.48Å
337	A	54	Low	68.5	Low	60 Å²	60	67.3 Å²	67.3	50%	0.496	38%	0.377	S	S	.	.			trans	-142.9	158	-161.1	0	0	0	0	0	122.6	S441	A337-S441 WeakPolarHBondContact O-CB 3.22Å
338	P	72.7	Confident	67.9	Low	64 Å²	64	63.9 Å²	63.9	42%	0.416	36%	0.361	S	S	.	.			trans	-112.5	174.8	-150.6	44	-40.4	0	0	0	123.5	L442	P338-L442 HydrophobicContact CB-CB 3.93Å; P338-L442 WeakPolarHBondContact CB-O 3.09Å; P338-L442 HydrophobicContact CG-CB 4.25Å
339	P	73.9	Confident	67.6	Low	11 Å²	11	65 Å²	65	7%	0.071	37%	0.37	C	S	.	.			trans	-94.6	168.3	175.3	6	15.6	0	0	0	116.1	Y367 V431 A433	P339-Y367 HydrophobicContact CB-CE1 4.48Å; P339-Y367 HydrophobicContact CG-CD1 4.46Å; P339-Y367 HydrophobicContact CG-CE1 4.49Å; P339-V431 HydrophobicContact CG-CG1 4.28Å; P339-A433 HydrophobicContact CG-CB 4.13Å
340	S	74.1	Confident	67.7	Low	70 Å²	70	64.7 Å²	64.7	49%	0.49	37%	0.365	S	S	.	.			trans	-139.7	167.1	-175.4	61.4	0	0	0	0	115.5	P357	S340-P357 WeakPolarHBondContact O-CD 3.38Å
341	S	76.9	Confident	67.6	Low	81 Å²	81	68.8 Å²	68.8	57%	0.566	38%	0.381	S	S	*	.			trans	59.8	58.3	169.9	-59.8	0	0	0	0	116.6	P357	S341-P357 WeakPolarHBondContact O-CD 3.28Å
342	L	83	Confident	68.1	Low	21 Å²	21	64.9 Å²	64.9	11%	0.11	36%	0.36	C	S	.	.			trans	-84.3	144.4	175.5	-174.8	62.7	0	0	0	112.7	L354 W356 V431 V447	L342-L354 HydrophobicContact CD1-CB 4.43Å; L342-W356 HydrophobicContact CD1-CB 4.17Å; L342-W356 HydrophobicContact CD1-CD2 4.33Å; L342-W356 HydrophobicContact CD1-CE3 3.72Å; L342-V431 HydrophobicContact CD1-CG2 3.77Å; L342-V431 HydrophobicContact CD2-CG2 4.04Å; L342-V447 HydrophobicContact CB-CG2 3.96Å; L342-V447 HydrophobicContact CD2-CG2 3.98Å; L342-V447 HydrophobicContact CG-CG2 3.77Å; L342-V447 WeakPolarHBondContact O-CG2 2.93Å
343	D	81.1	Confident	68.8	Low	47 Å²	47	63.5 Å²	63.5	25%	0.251	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	154.7	168.1	177.8	35.9	0	0	0	110.9	R345 L354 R355	D343-R345 IonicContact OD2-NE 2.77Å; D343-L354 CarbonylContact O-C 3.56Å; D343-L354 WeakPolarHBondContact O-CA 3.46Å; D343-R355 HydrophobicContact CB-CG 3.88Å; D343-R355 PolarHBondContact N-O 2.84Å; D343-R355 PolarHBondContact O-N 3.12Å; D343-R355 IonicContact OD2-CZ 2.69Å; D343-R355 IonicContact OD2-NE 3.67Å; D343-R355 PolarHBondContact OD2-NE 2.72Å; D343-R355 IonicContact OD2-NH2 2.76Å; D343-R355 PolarHBondContact OD2-NH2 2.83Å
344	A	80.8	Confident	70.9	Confident	12 Å²	12	60.3 Å²	60.3	10%	0.099	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	137.5	-175.4	0	0	0	0	0	112.4	V353 L354 V447 F449	A344-V353 CarbonylContact C-O 3.54Å; A344-V353 WeakPolarHBondContact CA-O 3.28Å; A344-L354 HydrophobicContact CB-CD2 3.47Å; A344-L354 VanDerWaalsContact CB-CD2 3.47Å; A344-V447 HydrophobicContact CB-CB 4.19Å; A344-V447 HydrophobicContact CB-CG1 3.54Å; A344-F449 HydrophobicContact CB-CD1 3.73Å; A344-F449 HydrophobicContact CB-CE1 4.3Å; A344-F449 HydrophobicContact CB-CG 4.42Å
345	R	75.7	Confident	73.5	Confident	147 Å²	147	55.7 Å²	55.7	56%	0.555	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.2	122.6	179.6	-62.9	-175.8	179.8	-160.7	-4.6	112	D343 A352 V353	D343-R345 IonicContact OD2-NE 2.77Å; R345-A352 CarbonylContact O-C 3.47Å; R345-A352 VanDerWaalsContact O-CA 3.24Å; R345-A352 WeakPolarHBondContact O-CA 2.93Å; R345-A352 WeakPolarHBondContact O-CB 3.11Å; R345-V353 PolarHBondContact N-O 2.75Å; R345-V353 PolarHBondContact O-N 2.69Å
346	P	67.5	Low	75.5	Confident	63 Å²	63	50 Å²	50	41%	0.409	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	136.4	170.8	31.2	-30.9	0	0	0	109.7	F449 R450	P346-F449 HydrophobicContact CB-CD2 4.28Å; P346-F449 HydrophobicContact CG-CB 4.49Å; P346-R450 WeakPolarHBondContact CB-O 3.44Å; P346-R450 WeakPolarHBondContact CG-O 3.38Å
347	I	72.4	Confident	76.3	Confident	98 Å²	98	48.9 Å²	48.9	50%	0.503	28%	0.276	S	S	.	.			trans	-122.2	-20.7	-178.6	-53.3	-175.4	0	0	0	111.5	Y351 V353	I347-Y351 HydrophobicContact CB-CD2 3.96Å; I347-Y351 HydrophobicContact CB-CE2 3.51Å; I347-Y351 HydrophobicContact CG2-CD2 4.43Å; I347-Y351 HydrophobicContact CG2-CE2 3.5Å; I347-Y351 VanDerWaalsContact CG2-CE2 3.5Å; I347-Y351 PolarHBondContact N-O 3.06Å; I347-Y351 VanDerWaalsContact N-O 3.1Å; I347-V353 HydrophobicContact CD1-CB 4.06Å; I347-V353 HydrophobicContact CD1-CG2 3.55Å
348	G	71.1	Confident	77	Confident	13 Å²	13	49 Å²	49	13%	0.134	27%	0.271	C	S	.	.	S	Bend	trans	-148.6	-168.2	171.5	0	0	0	0	0	114.1	T350 Y351 A452	G348-T350 VanDerWaalsContact C-N 3.29Å; G348-Y351 PolarHBondContact N-O 3.39Å; G348-Y351 VanDerWaalsContact N-O 3.1Å; G348-A452 PolarHBondContact O-N 3.45Å; G348-A452 VanDerWaalsContact O-N 3.16Å
349	S	76.9	Confident	76.4	Confident	26 Å²	26	47.4 Å²	47.4	18%	0.182	26%	0.262	C	S	.	.	S	Bend	trans	-74.2	-19.1	174.7	50.1	0	0	0	0	113.2	S422 P423 T451 A452	S349-S422 CarbonylContact O-C 3.56Å; S349-P423 VanDerWaalsContact O-CA 3.31Å; S349-P423 WeakPolarHBondContact O-CA 3.24Å; S349-T451 WeakPolarHBondContact O-CB 3.36Å; S349-A452 WeakPolarHBondContact CA-O 3.1Å; S349-A452 VanDerWaalsContact CB-O 3.28Å; S349-A452 WeakPolarHBondContact CB-O 3.1Å
350	T	76.8	Confident	75.5	Confident	58 Å²	58	55.2 Å²	55.2	36%	0.356	30%	0.301	S	S	.	.	S	Bend	trans	-128.7	8.1	-176.8	59.7	0	0	0	0	114.3	G348 G420 L421	G348-T350 VanDerWaalsContact C-N 3.29Å; T350-G420 PolarHBondContact O-N 2.82Å; T350-G420 VanDerWaalsContact O-N 3.08Å; T350-L421 WeakPolarHBondContact CA-O 3.45Å; T350-L421 WeakPolarHBondContact O-CB 3.42Å; T350-L421 PolarHBondContact O-N 2.91Å
351	Y	78.7	Confident	74.5	Confident	90 Å²	90	54.8 Å²	54.8	35%	0.353	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	155.5	-178.7	68.9	-77.8	0	0	0	116.1	I347 G348 L418	I347-Y351 HydrophobicContact CB-CD2 3.96Å; I347-Y351 HydrophobicContact CB-CE2 3.51Å; I347-Y351 HydrophobicContact CG2-CD2 4.43Å; I347-Y351 HydrophobicContact CG2-CE2 3.5Å; I347-Y351 VanDerWaalsContact CG2-CE2 3.5Å; I347-Y351 PolarHBondContact N-O 3.06Å; I347-Y351 VanDerWaalsContact N-O 3.1Å; G348-Y351 PolarHBondContact N-O 3.39Å; G348-Y351 VanDerWaalsContact N-O 3.1Å; Y351-L418 CarbonylContact C-O 3.52Å; Y351-L418 WeakPolarHBondContact CA-O 3.3Å; Y351-L418 VanDerWaalsContact CB-O 3.24Å; Y351-L418 WeakPolarHBondContact CB-O 3.44Å
352	A	80.3	Confident	73.2	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	164.1	-179.1	0	0	0	0	0	111.2	R345 N417 L418 L421 F449	R345-A352 CarbonylContact O-C 3.47Å; R345-A352 VanDerWaalsContact O-CA 3.24Å; R345-A352 WeakPolarHBondContact O-CA 2.93Å; R345-A352 WeakPolarHBondContact O-CB 3.11Å; A352-N417 CarbonylContact O-C 3.57Å; A352-N417 PolarHBondContact O-OD1 2.87Å; A352-L418 HydrophobicContact CB-CB 4.44Å; A352-L418 HydrophobicContact CB-CD1 4.43Å; A352-L418 PolarHBondContact N-O 2.93Å; A352-L418 WeakPolarHBondContact O-CA 3.34Å; A352-L418 WeakPolarHBondContact O-CB 3.34Å; A352-L418 PolarHBondContact O-N 2.62Å; A352-L421 HydrophobicContact CB-CD1 3.94Å; A352-F449 HydrophobicContact CB-CD2 3.86Å; A352-F449 HydrophobicContact CB-CE2 3.41Å; A352-F449 VanDerWaalsContact CB-CE2 3.41Å; A352-F449 HydrophobicContact CB-CZ 3.91Å
353	V	81.3	Confident	72.1	Confident	36 Å²	36	58 Å²	58	22%	0.218	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	132.4	178.4	171.4	0	0	0	0	111.2	A344 R345 I347 L415 Y416 N417	A344-V353 CarbonylContact C-O 3.54Å; A344-V353 WeakPolarHBondContact CA-O 3.28Å; R345-V353 PolarHBondContact N-O 2.75Å; R345-V353 PolarHBondContact O-N 2.69Å; I347-V353 HydrophobicContact CD1-CB 4.06Å; I347-V353 HydrophobicContact CD1-CG2 3.55Å; V353-L415 HydrophobicContact CG1-CD2 4.14Å; V353-Y416 CarbonylContact C-O 3.46Å; V353-Y416 WeakPolarHBondContact CA-O 3.47Å; V353-N417 HydrophobicContact CG2-CB 4.46Å
354	L	82.9	Confident	71.3	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	151.9	172	-61.5	-179.1	0	0	0	111.3	L342 D343 A344 W356 V369 Y416 L418 A429	L342-L354 HydrophobicContact CD1-CB 4.43Å; D343-L354 CarbonylContact O-C 3.56Å; D343-L354 WeakPolarHBondContact O-CA 3.46Å; A344-L354 HydrophobicContact CB-CD2 3.47Å; A344-L354 VanDerWaalsContact CB-CD2 3.47Å; L354-W356 HydrophobicContact CB-CE3 4.3Å; L354-W356 HydrophobicContact CB-CZ3 3.87Å; L354-W356 HydrophobicContact CD1-CZ3 4.46Å; L354-V369 HydrophobicContact CD1-CB 4.38Å; L354-V369 HydrophobicContact CD1-CG1 3.65Å; L354-V369 HydrophobicContact CD1-CG2 3.72Å; L354-Y416 PolarHBondContact N-O 2.78Å; L354-Y416 PolarHBondContact O-N 2.69Å; L354-L418 HydrophobicContact CD1-CD1 3.91Å; L354-L418 HydrophobicContact CD1-CD2 4.24Å; L354-L418 HydrophobicContact CD1-CG 4.13Å; L354-L418 HydrophobicContact CD2-CD1 3.93Å; L354-L418 HydrophobicContact CG-CD1 3.68Å; L354-L418 HydrophobicContact CG-CG 4.05Å; L354-A429 HydrophobicContact CD2-CB 4.17Å
355	R	83.7	Confident	70.7	Confident	95 Å²	95	59.5 Å²	59.5	36%	0.358	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	139.4	172.9	64.3	-173.7	-178.8	128.6	9.3	114.2	D343 M413 I414 L415	D343-R355 HydrophobicContact CB-CG 3.88Å; D343-R355 PolarHBondContact N-O 2.84Å; D343-R355 PolarHBondContact O-N 3.12Å; D343-R355 IonicContact OD2-CZ 2.69Å; D343-R355 IonicContact OD2-NE 3.67Å; D343-R355 PolarHBondContact OD2-NE 2.72Å; D343-R355 IonicContact OD2-NH2 2.76Å; D343-R355 PolarHBondContact OD2-NH2 2.83Å; R355-M413 HydrophobicContact CB-CE 3.92Å; R355-M413 HydrophobicContact CG-CE 4.02Å; R355-I414 WeakPolarHBondContact CA-O 3.33Å; R355-L415 HydrophobicContact CB-CD2 3.89Å
356	W	82.3	Confident	70.9	Confident	2 Å²	2	53 Å²	53	1%	0.008	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	157.6	177.3	65.8	98.4	0	0	0	112.8	L342 L354 Y367 V369 I389 I414 V431	L342-W356 HydrophobicContact CD1-CB 4.17Å; L342-W356 HydrophobicContact CD1-CD2 4.33Å; L342-W356 HydrophobicContact CD1-CE3 3.72Å; L354-W356 HydrophobicContact CB-CE3 4.3Å; L354-W356 HydrophobicContact CB-CZ3 3.87Å; L354-W356 HydrophobicContact CD1-CZ3 4.46Å; W356-Y367 HydrophobicContact CZ2-CD2 4.46Å; W356-Y367 HydrophobicContact CZ2-CG 4.16Å; W356-Y367 AromaticContact NE1-CD1 3.69Å; W356-Y367 AromaticContact NE1-CE1 3.86Å; W356-Y367 AromaticContact NE1-CG 3.84Å; W356-V369 HydrophobicContact CH2-CG2 3.98Å; W356-V369 HydrophobicContact CZ3-CG2 4.29Å; W356-I389 HydrophobicContact CH2-CD1 3.97Å; W356-I389 HydrophobicContact CZ2-CD1 4.48Å; W356-I389 HydrophobicContact CZ2-CG2 4.47Å; W356-I414 HydrophobicContact CD2-CB 4.25Å; W356-I414 HydrophobicContact CD2-CG2 4.29Å; W356-I414 HydrophobicContact CH2-CG2 3.87Å; W356-I414 HydrophobicContact CZ2-CB 4.3Å; W356-I414 HydrophobicContact CZ2-CG2 3.55Å; W356-I414 HydrophobicContact CZ3-CG2 4.36Å; W356-I414 PolarHBondContact N-O 3.11Å; W356-I414 WeakPolarHBondContact O-CB 3.33Å; W356-I414 PolarHBondContact O-N 3Å; W356-V431 HydrophobicContact CD2-CG1 4.5Å; W356-V431 HydrophobicContact CD2-CG2 4.03Å; W356-V431 HydrophobicContact CE3-CG2 3.98Å; W356-V431 HydrophobicContact CH2-CG2 4.31Å; W356-V431 HydrophobicContact CZ2-CG1 4.13Å; W356-V431 HydrophobicContact CZ2-CG2 4.34Å; W356-V431 HydrophobicContact CZ3-CG2 4.13Å
357	P	75.9	Confident	71.5	Confident	33 Å²	33	50.3 Å²	50.3	21%	0.214	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-82.3	154.8	172.9	33.2	-36.1	0	0	0	113.2	S340 S341 M413	S340-P357 WeakPolarHBondContact O-CD 3.38Å; S341-P357 WeakPolarHBondContact O-CD 3.28Å; P357-M413 HydrophobicContact CB-SD 4.07Å
358	P	68.7	Low	71.9	Confident	61 Å²	61	45.8 Å²	45.8	40%	0.396	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-75.2	144.4	-179.4	29.6	-35.1	0	0	0	114.4	Y367 P412 I414	P358-Y367 WeakPolarHBondContact CA-OH 3.27Å; P358-P412 WeakPolarHBondContact CD-O 3.31Å; P358-P412 HydrophobicContact CG-CG 4.34Å; P358-I414 HydrophobicContact CB-CD1 4.25Å
359	S	60.9	Low	72.4	Confident	32 Å²	32	45.2 Å²	45.2	22%	0.224	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-70.9	145.8	179.3	-64.1	0	0	0	0	114	Y367	S359-Y367 PolarHBondContact N-OH 3.1Å
360	I	54.3	Low	72.5	Confident	175 Å²	175	44.2 Å²	44.2	90%	0.897	26%	0.259	S	S	*	.			trans	-89.4	-14	-171.1	-58.8	168.8	0	0	0	113.3
361	S	53.6	Low	72.6	Confident	61 Å²	61	41.7 Å²	41.7	43%	0.427	24%	0.244	S	C	.	.	S	Bend	trans	-76.7	129.4	-174.7	44.4	0	0	0	0	113.4	G363	S361-G363 PolarHBondContact O-N 3.01Å
362	S	50	Low	72.5	Confident	128 Å²	128	39.9 Å²	39.9	90%	0.895	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.4	117.6	171.5	52.4	0	0	0	0	110.7
363	G	59.5	Low	72.2	Confident	42 Å²	42	40.9 Å²	40.9	43%	0.433	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	121.7	9.1	178.7	0	0	0	0	0	115.7	S361 S435	S361-G363 PolarHBondContact O-N 3.01Å; G363-S435 WeakPolarHBondContact O-CA 3.32Å; G363-S435 WeakPolarHBondContact O-CB 3.48Å; G363-S435 PolarHBondContact O-OG 3.5Å
364	V	63.5	Low	71.5	Confident	40 Å²	40	41.1 Å²	41.1	24%	0.242	24%	0.243	C	C	.	.			trans	-82.4	120.4	167.1	-178.8	0	0	0	0	109.8	A433 V434	V364-A433 HydrophobicContact CG1-CB 3.89Å; V364-A433 HydrophobicContact CG2-CB 3.95Å; V364-V434 WeakPolarHBondContact CA-O 3.06Å
365	D	69.7	Low	70.2	Confident	49 Å²	49	44.4 Å²	44.4	26%	0.262	26%	0.261	S	S	.	.			trans	-97.4	-30.6	-179.8	-71.5	-70	0	0	0	113.5	V434 R436	D365-V434 PolarHBondContact N-O 2.77Å; D365-R436 VanDerWaalsContact CG-NE 3.29Å; D365-R436 IonicContact OD1-CZ 3.48Å; D365-R436 IonicContact OD1-NE 2.72Å; D365-R436 PolarHBondContact OD1-NE 3.35Å; D365-R436 IonicContact OD1-NH2 2.74Å; D365-R436 PolarHBondContact OD1-NH2 2.95Å; D365-R436 VanDerWaalsContact OD2-CB 3.26Å; D365-R436 WeakPolarHBondContact OD2-CB 3.28Å; D365-R436 WeakPolarHBondContact OD2-CG 3.12Å; D365-R436 PolarHBondContact OD2-N 3.32Å; D365-R436 IonicContact OD2-NE 3.53Å; D365-R436 PolarHBondContact OD2-NE 2.59Å
366	S	78	Confident	68.3	Low	10 Å²	10	44.1 Å²	44.1	7%	0.07	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164	171	175.5	62.3	0	0	0	0	111.7	V434	S366-V434 PolarHBondContact O-N 2.97Å
367	Y	81	Confident	66	Low	7 Å²	7	46.3 Å²	46.3	3%	0.027	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	150.8	169	-58.8	-84.9	0	0	0	111.8	P339 W356 P358 S359 N388 I389 P391 I414 V431 H432	P339-Y367 HydrophobicContact CB-CE1 4.48Å; P339-Y367 HydrophobicContact CG-CD1 4.46Å; P339-Y367 HydrophobicContact CG-CE1 4.49Å; W356-Y367 HydrophobicContact CZ2-CD2 4.46Å; W356-Y367 HydrophobicContact CZ2-CG 4.16Å; W356-Y367 AromaticContact NE1-CD1 3.69Å; W356-Y367 AromaticContact NE1-CE1 3.86Å; W356-Y367 AromaticContact NE1-CG 3.84Å; P358-Y367 WeakPolarHBondContact CA-OH 3.27Å; S359-Y367 PolarHBondContact N-OH 3.1Å; Y367-N388 PolarHBondContact O-N 2.78Å; Y367-I389 PolarHBondContact N-O 3.02Å; Y367-I389 VanDerWaalsContact N-O 3.17Å; Y367-I389 PolarHBondContact O-N 3.12Å; Y367-P391 HydrophobicContact CD2-CG 4.45Å; Y367-P391 HydrophobicContact CE2-CG 4.05Å; Y367-I414 HydrophobicContact CD2-CD1 3.98Å; Y367-I414 HydrophobicContact CE2-CD1 3.46Å; Y367-I414 VanDerWaalsContact CE2-CD1 3.46Å; Y367-V431 HydrophobicContact CD1-CG1 3.84Å; Y367-V431 HydrophobicContact CG-CG1 4.28Å; Y367-H432 CarbonylContact C-O 3.59Å; Y367-H432 VanDerWaalsContact CA-O 3.3Å; Y367-H432 WeakPolarHBondContact CA-O 3.43Å
368	T	80.2	Confident	63.8	Low	4 Å²	4	49 Å²	49	3%	0.025	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	118.3	171.1	-65.6	0	0	0	0	110	Q385 I386 T387 V431 H432 V434	T368-Q385 HydrophobicContact CG2-CB 4.39Å; T368-Q385 HydrophobicContact CG2-CG 4.39Å; T368-I386 CarbonylContact C-O 3.54Å; T368-I386 WeakPolarHBondContact CA-O 3.38Å; T368-T387 HydrophobicContact CG2-CG2 3.8Å; T368-V431 CarbonylContact O-C 3.38Å; T368-V431 WeakPolarHBondContact O-CA 3.2Å; T368-H432 PolarHBondContact N-O 3.38Å; T368-H432 PolarHBondContact O-N 3.45Å; T368-V434 WeakPolarHBondContact OG1-CG2 3.28Å
369	V	82	Confident	62	Low	0 Å²	0	46.4 Å²	46.4	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	133.5	171.7	164.7	0	0	0	0	109	L354 W356 Q385 I386 I389 L418 Q430 V431	L354-V369 HydrophobicContact CD1-CB 4.38Å; L354-V369 HydrophobicContact CD1-CG1 3.65Å; L354-V369 HydrophobicContact CD1-CG2 3.72Å; W356-V369 HydrophobicContact CH2-CG2 3.98Å; W356-V369 HydrophobicContact CZ3-CG2 4.29Å; V369-Q385 CarbonylContact O-C 3.59Å; V369-Q385 WeakPolarHBondContact O-CA 3.47Å; V369-I386 HydrophobicContact CB-CB 4.23Å; V369-I386 PolarHBondContact N-O 2.85Å; V369-I386 PolarHBondContact O-N 3.06Å; V369-I389 HydrophobicContact CB-CD1 4.2Å; V369-I389 HydrophobicContact CG2-CD1 3.53Å; V369-L418 HydrophobicContact CG1-CD2 4.35Å; V369-Q430 CarbonylContact C-O 3.59Å; V369-Q430 VanDerWaalsContact CA-O 3.3Å; V369-Q430 WeakPolarHBondContact CA-O 3.5Å; V369-V431 HydrophobicContact CG2-CG2 3.91Å
370	S	78.6	Confident	60.6	Low	6 Å²	6	47.5 Å²	47.5	4%	0.042	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	140	165.2	60.1	0	0	0	0	110.3	A429 Q430 E2286	S370-A429 VanDerWaalsContact O-CA 3.23Å; S370-A429 WeakPolarHBondContact O-CA 3.14Å; S370-Q430 PolarHBondContact N-O 3.44Å; S370-Q430 PolarHBondContact O-N 2.93Å; S370-E2286 WeakPolarHBondContact CB-OE2 3.36Å
371	L	80.2	Confident	59.6	Low	5 Å²	5	45 Å²	45	3%	0.026	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	128	-176.8	-176.1	76.8	0	0	0	110.4	R383 R384 L418 L421 Y427 S428 A429 F449	L371-R383 CarbonylContact O-C 3.59Å; L371-R383 WeakPolarHBondContact O-CA 3.43Å; L371-R383 WeakPolarHBondContact O-CG 3.43Å; L371-R384 HydrophobicContact CB-CB 4.39Å; L371-R384 WeakPolarHBondContact CB-O 3.41Å; L371-R384 PolarHBondContact N-O 3.43Å; L371-R384 PolarHBondContact O-N 2.79Å; L371-L418 HydrophobicContact CD1-CD1 4.19Å; L371-L421 HydrophobicContact CD2-CD2 3.64Å; L371-Y427 HydrophobicContact CD1-CD1 3.82Å; L371-Y427 HydrophobicContact CD1-CG 4.21Å; L371-Y427 HydrophobicContact CD2-CD1 3.94Å; L371-Y427 HydrophobicContact CD2-CE1 4.02Å; L371-Y427 HydrophobicContact CG-CD1 3.77Å; L371-Y427 HydrophobicContact CG-CE1 4.29Å; L371-S428 CarbonylContact C-O 3.6Å; L371-S428 WeakPolarHBondContact CA-O 3.09Å; L371-A429 HydrophobicContact CD1-CB 4.08Å; L371-F449 HydrophobicContact CD1-CE1 4.08Å; L371-F449 HydrophobicContact CD1-CZ 3.91Å
372	Q	75.1	Confident	59.1	Low	52 Å²	52	45.1 Å²	45.1	24%	0.243	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	153.1	-179.9	173	168.3	-41.2	0	0	110.8	Y427 S428	Q372-Y427 CarbonylContact O-C 3.58Å; Q372-Y427 VanDerWaalsContact O-CA 3.24Å; Q372-Y427 WeakPolarHBondContact O-CA 3.11Å; Q372-Y427 WeakPolarHBondContact O-CD1 2.87Å; Q372-S428 PolarHBondContact N-O 2.88Å; Q372-S428 PolarHBondContact O-N 2.96Å
373	I	75.5	Confident	59.3	Low	20 Å²	20	42.5 Å²	42.5	10%	0.103	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	141.2	170.8	-67.3	172.1	0	0	0	110.1	D375 S382 T425 L426 Y427 H2282	I373-D375 HydrophobicContact CG2-CB 4.02Å; I373-D375 WeakPolarHBondContact CG2-OD2 3.48Å; I373-S382 WeakPolarHBondContact CD1-OG 3.47Å; I373-T425 HydrophobicContact CB-CG2 4.22Å; I373-T425 HydrophobicContact CD1-CG2 3.86Å; I373-T425 HydrophobicContact CG1-CG2 3.72Å; I373-T425 HydrophobicContact CG2-CG2 3.58Å; I373-L426 CarbonylContact C-O 3.53Å; I373-L426 WeakPolarHBondContact CA-O 3.11Å; I373-Y427 HydrophobicContact CD1-CE1 4.02Å; I373-Y427 HydrophobicContact CG1-CD1 3.82Å; I373-Y427 HydrophobicContact CG1-CE1 3.35Å; I373-H2282 PolarHBondContact O-NE2 2.85Å
374	D	66.4	Low	59.3	Low	41 Å²	41	45.3 Å²	45.3	22%	0.219	27%	0.265	C	S	.	.			trans	-111.6	54.6	-177.5	-86.6	49.6	0	0	0	111.7	L426 S428 K448	D374-L426 HydrophobicContact CB-CB 4.07Å; D374-L426 HydrophobicContact CB-CD2 3.64Å; D374-L426 HydrophobicContact CB-CG 3.73Å; D374-L426 PolarHBondContact N-O 2.83Å; D374-S428 WeakPolarHBondContact OD1-CB 3.41Å; D374-S428 PolarHBondContact OD1-OG 3.32Å; D374-S428 PolarHBondContact OD2-OG 2.73Å; D374-K448 IonicContact OD2-NZ 3.2Å; D374-K448 PolarHBondContact OD2-NZ 3.21Å
375	D	55.4	Low	59.4	Low	70 Å²	70	46.8 Å²	46.8	37%	0.374	27%	0.27	S	S	.	.			trans	-107.1	106.4	176.3	-79.2	-43.6	0	0	0	111.4	I373 G377 R2220	I373-D375 HydrophobicContact CG2-CB 4.02Å; I373-D375 WeakPolarHBondContact CG2-OD2 3.48Å; D375-G377 PolarHBondContact O-N 3.12Å; D375-R2220 VanDerWaalsContact O-CD 3.22Å; D375-R2220 WeakPolarHBondContact O-CD 3.26Å
376	G	44.5	Very low	59.3	Low	88 Å²	88	45.4 Å²	45.4	91%	0.907	26%	0.262	S	S	*	.			trans	-75.1	51.8	-172.4	0	0	0	0	0	115.7
377	G	33.1	Very low	58.5	Low	48 Å²	48	48.5 Å²	48.5	50%	0.495	28%	0.281	S	S	.	.	S	Bend	trans	-168.8	92.6	-179.9	0	0	0	0	0	116	D375 R2220	D375-G377 PolarHBondContact O-N 3.12Å; G377-R2220 CarbonylContact C-O 3.57Å; G377-R2220 VanDerWaalsContact CA-O 3.26Å; G377-R2220 WeakPolarHBondContact CA-O 3.4Å; G377-R2220 PolarHBondContact N-O 2.98Å
378	L	30.2	Very low	57.5	Low	91 Å²	91	53.7 Å²	53.7	48%	0.476	31%	0.309	S	S	.	.	S	Bend	trans	90.3	79.8	154.4	-53.7	163.5	0	0	0	119.3	R2220 R2222	L378-R2220 PolarHBondContact N-O 3.28Å; L378-R2222 HydrophobicContact CB-CG 3.72Å; L378-R2222 HydrophobicContact CD2-CB 4.28Å; L378-R2222 HydrophobicContact CD2-CG 3.49Å; L378-R2222 VanDerWaalsContact CD2-CG 3.49Å; L378-R2222 HydrophobicContact CG-CG 4.21Å; L378-R2222 PolarHBondContact O-NH1 3.19Å; L378-R2222 PolarHBondContact O-NH2 3.21Å; L378-R2222 VanDerWaalsContact O-NH2 3.11Å
379	G	29.5	Very low	56.8	Low	6 Å²	6	54 Å²	54	6%	0.062	31%	0.31	C	S	.	.			trans	98.7	112.3	142	0	0	0	0	0	123.5	L381 E2219 R2220	G379-L381 PolarHBondContact O-N 3.49Å; G379-E2219 WeakPolarHBondContact CA-O 3.49Å; G379-E2219 PolarHBondContact N-O 2.96Å; G379-R2220 PolarHBondContact O-NH2 2.98Å
380	E	31.5	Very low	55.9	Low	54 Å²	54	56.9 Å²	56.9	25%	0.252	33%	0.326	S	S	.	.			trans	50.5	-12.8	145.5	-81.1	-175.5	102.4	0	0	124.5	E2219 E2281 S2316 R2321	E380-E2219 HydrophobicContact CG-CB 4.37Å; E380-E2219 WeakPolarHBondContact CG-OE2 3.49Å; E380-E2281 CarbonylContact C-O 3.52Å; E380-E2281 WeakPolarHBondContact CA-O 3.38Å; E380-E2281 PolarHBondContact N-O 2.7Å; E380-S2316 WeakPolarHBondContact OE2-CB 3.43Å; E380-R2321 IonicContact OE1-CZ 3.34Å; E380-R2321 IonicContact OE1-NE 2.76Å; E380-R2321 IonicContact OE1-NH1 2.67Å; E380-R2321 IonicContact OE1-NH2 3.63Å
381	L	33.9	Very low	54.9	Low	123 Å²	123	60 Å²	60	64%	0.644	35%	0.346	S	S	*	.			trans	-105.7	131.7	-173.1	-66.4	167.5	0	0	0	116.1	G379 R2220 E2281 H2282	G379-L381 PolarHBondContact O-N 3.49Å; L381-R2220 PolarHBondContact O-NH2 2.91Å; L381-E2281 PolarHBondContact N-O 3.18Å; L381-H2282 PolarHBondContact O-CE1 3.27Å; L381-H2282 VanDerWaalsContact O-CE1 3.23Å; L381-H2282 PolarHBondContact O-ND1 2.82Å
382	S	44	Very low	53.3	Low	63 Å²	63	63.6 Å²	63.6	44%	0.441	37%	0.371	S	S	.	.			trans	85.3	85.3	161.8	83.3	0	0	0	0	122.9	I373 H2282	I373-S382 WeakPolarHBondContact CD1-OG 3.47Å; S382-H2282 VanDerWaalsContact C-CB 3.48Å; S382-H2282 VanDerWaalsContact C-ND1 3.28Å; S382-H2282 PolarHBondContact O-ND1 3.17Å
383	R	52.7	Low	51.9	Low	73 Å²	73	68 Å²	68	28%	0.275	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129.7	156.1	-178.1	-176.9	-79.5	-175.2	3	106.6	L371 H2282 E2286	L371-R383 CarbonylContact O-C 3.59Å; L371-R383 WeakPolarHBondContact O-CA 3.43Å; L371-R383 WeakPolarHBondContact O-CG 3.43Å; R383-H2282 HydrophobicContact CB-CB 3.8Å; R383-H2282 WeakPolarHBondContact CB-O 3.49Å; R383-H2282 PolarHBondContact N-O 3.32Å; R383-E2286 VanDerWaalsContact CD-OE1 3.31Å; R383-E2286 WeakPolarHBondContact CD-OE1 3.47Å; R383-E2286 IonicContact CZ-OE1 2.8Å; R383-E2286 IonicContact NE-OE1 2.61Å; R383-E2286 IonicContact NH1-OE1 2.8Å; R383-E2286 PolarHBondContact NH1-OE1 3.42Å
384	R	61.1	Low	50.2	Low	101 Å²	101	71.5 Å²	71.5	38%	0.381	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	105.7	-173.6	-178.8	174.9	175	-162.7	-6.9	109.2	L371 I386 T419 G420	L371-R384 HydrophobicContact CB-CB 4.39Å; L371-R384 WeakPolarHBondContact CB-O 3.41Å; L371-R384 PolarHBondContact N-O 3.43Å; L371-R384 PolarHBondContact O-N 2.79Å; R384-I386 HydrophobicContact CG-CG1 4.3Å; R384-T419 PolarHBondContact NH1-O 2.89Å; R384-T419 PolarHBondContact NH2-O 2.95Å; R384-G420 PolarHBondContact NH1-O 2.83Å; R384-G420 VanDerWaalsContact NH1-O 3.16Å
385	Q	64.4	Low	48.7	Very low	72 Å²	72	78.4 Å²	78.4	34%	0.336	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	144.1	163.9	-81.2	-172.5	-29	0	0	110	T368 V369 E2286	T368-Q385 HydrophobicContact CG2-CB 4.39Å; T368-Q385 HydrophobicContact CG2-CG 4.39Å; V369-Q385 CarbonylContact O-C 3.59Å; V369-Q385 WeakPolarHBondContact O-CA 3.47Å; Q385-E2286 HydrophobicContact CG-CG 4.35Å; Q385-E2286 VanDerWaalsContact NE2-CG 3.32Å; Q385-E2286 PolarHBondContact NE2-OE2 2.79Å
386	I	67.3	Low	47.4	Very low	19 Å²	19	80.1 Å²	80.1	10%	0.097	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	94.5	175.5	-60.7	175.7	0	0	0	105.8	T368 V369 R384 I389 Y416 L418	T368-I386 CarbonylContact C-O 3.54Å; T368-I386 WeakPolarHBondContact CA-O 3.38Å; V369-I386 HydrophobicContact CB-CB 4.23Å; V369-I386 PolarHBondContact N-O 2.85Å; V369-I386 PolarHBondContact O-N 3.06Å; R384-I386 HydrophobicContact CG-CG1 4.3Å; I386-I389 HydrophobicContact CG2-CD1 4.31Å; I386-I389 HydrophobicContact CG2-CG1 4.36Å; I386-Y416 HydrophobicContact CD1-CE1 4Å; I386-Y416 HydrophobicContact CG2-CE1 4.16Å; I386-Y416 HydrophobicContact CG2-CE2 4.38Å; I386-Y416 WeakPolarHBondContact CG2-OH 3.36Å; I386-L418 HydrophobicContact CD1-CD2 3.55Å
387	T	61.3	Low	46.6	Very low	76 Å²	76	84.7 Å²	84.7	47%	0.466	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	163.4	-176	54	0	0	0	0	112.4	T368	T368-T387 HydrophobicContact CG2-CG2 3.8Å
388	N	61.4	Low	46.3	Very low	115 Å²	115	89.8 Å²	89.8	62%	0.615	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	61.9	40.7	170	-53.3	-14.3	0	0	0	114.4	Y367 D390	Y367-N388 PolarHBondContact O-N 2.78Å; N388-D390 PolarHBondContact O-N 2.71Å
389	I	65.5	Low	46.2	Very low	12 Å²	12	90.7 Å²	90.7	6%	0.062	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	102.7	167.8	-57.9	174.7	0	0	0	107.2	W356 Y367 V369 I386 M394 Y416	W356-I389 HydrophobicContact CH2-CD1 3.97Å; W356-I389 HydrophobicContact CZ2-CD1 4.48Å; W356-I389 HydrophobicContact CZ2-CG2 4.47Å; Y367-I389 PolarHBondContact N-O 3.02Å; Y367-I389 VanDerWaalsContact N-O 3.17Å; Y367-I389 PolarHBondContact O-N 3.12Å; V369-I389 HydrophobicContact CB-CD1 4.2Å; V369-I389 HydrophobicContact CG2-CD1 3.53Å; I386-I389 HydrophobicContact CG2-CD1 4.31Å; I386-I389 HydrophobicContact CG2-CG1 4.36Å; I389-M394 HydrophobicContact CG2-CE 4.28Å; I389-Y416 HydrophobicContact CD1-CD2 3.73Å; I389-Y416 HydrophobicContact CD1-CE2 3.99Å; I389-Y416 HydrophobicContact CD1-CG 4.03Å; I389-Y416 HydrophobicContact CG1-CD2 4.1Å; I389-Y416 HydrophobicContact CG1-CE2 4.06Å; I389-Y416 HydrophobicContact CG2-CD2 4.2Å
390	D	62.4	Low	46.1	Very low	60 Å²	60	99.8 Å²	99.8	32%	0.321	52%	0.52	S	S	.	.			trans	-79.6	127.8	-174	-166.5	-57.4	0	0	0	111.3	N388 S392 E393	N388-D390 PolarHBondContact O-N 2.71Å; D390-S392 PolarHBondContact O-N 2.65Å; D390-S392 VanDerWaalsContact O-N 3.13Å; D390-S392 WeakPolarHBondContact OD1-CA 3.34Å; D390-S392 VanDerWaalsContact OD1-CB 3.26Å; D390-S392 WeakPolarHBondContact OD1-CB 3.47Å; D390-S392 PolarHBondContact OD1-N 3.02Å; D390-S392 PolarHBondContact OD1-OG 3.33Å; D390-E393 HydrophobicContact CB-CG 4.07Å
391	P	57.4	Low	45.8	Very low	72 Å²	72	101 Å²	101	47%	0.468	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-12.1	178.1	-21.1	32.9	0	0	0	115.4	Y367	Y367-P391 HydrophobicContact CD2-CG 4.45Å; Y367-P391 HydrophobicContact CE2-CG 4.05Å
392	S	47.7	Very low	45.5	Very low	80 Å²	80	102.4 Å²	102.4	56%	0.559	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-23.7	-174.5	71.8	0	0	0	0	114.7	D390 M394	D390-S392 PolarHBondContact O-N 2.65Å; D390-S392 VanDerWaalsContact O-N 3.13Å; D390-S392 WeakPolarHBondContact OD1-CA 3.34Å; D390-S392 VanDerWaalsContact OD1-CB 3.26Å; D390-S392 WeakPolarHBondContact OD1-CB 3.47Å; D390-S392 PolarHBondContact OD1-N 3.02Å; D390-S392 PolarHBondContact OD1-OG 3.33Å; S392-M394 VanDerWaalsContact C-N 3.31Å; S392-M394 PolarHBondContact O-N 2.87Å
393	E	44.9	Very low	44.7	Very low	145 Å²	145	107.8 Å²	107.8	68%	0.678	57%	0.565	S	S	*	*	S	Bend	trans	-70.7	-22	-175.6	-71.8	-172.9	145.5	0	0	113.8	D390 K395	D390-E393 HydrophobicContact CB-CG 4.07Å; E393-K395 PolarHBondContact O-N 2.83Å
394	M	40.3	Very low	43.5	Very low	93 Å²	93	110.5 Å²	110.5	46%	0.458	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.7	29.6	-178.4	-61.8	-172.1	179.1	0	0	114.7	I389 S392 I414 L415	I389-M394 HydrophobicContact CG2-CE 4.28Å; S392-M394 VanDerWaalsContact C-N 3.31Å; S392-M394 PolarHBondContact O-N 2.87Å; M394-I414 HydrophobicContact CE-CG2 3.75Å; M394-I414 HydrophobicContact SD-CG2 3.89Å; M394-L415 WeakPolarHBondContact CE-O 3.31Å
395	K	33.2	Very low	41.9	Very low	185 Å²	185	111.2 Å²	111.2	80%	0.804	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.9	0.2	-174.2	-75.7	-172.1	177	178	0	116.2	E393	E393-K395 PolarHBondContact O-N 2.83Å
396	S	28.4	Very low	40.4	Very low	107 Å²	107	115.6 Å²	115.6	75%	0.748	62%	0.618	S	S	*	*			trans	-106.5	141.9	177.7	45.7	0	0	0	0	112.3
397	E	28.1	Very low	38.6	Very low	184 Å²	184	125.2 Å²	125.2	86%	0.86	66%	0.655	S	S	*	*			trans	-87.5	130.4	-172.5	-58.6	164	121	0	0	111.4
398	N	26.9	Very low	37	Very low	155 Å²	155	125.7 Å²	125.7	83%	0.829	66%	0.662	S	S	*	*			trans	178.7	115.4	136.8	-97.5	-53.3	0	0	0	113.1
399	S	28	Very low	35.5	Very low	110 Å²	110	128.7 Å²	128.7	77%	0.769	68%	0.678	S	S	*	*			trans	66.4	147.3	161.1	80.2	0	0	0	0	118.7
400	F	27.2	Very low	34.1	Very low	197 Å²	197	136.3 Å²	136.3	86%	0.864	71%	0.713	S	S	*	*			cis	-169.7	143.9	-23.1	-132.6	-92.1	0	0	0	107
401	S	26.7	Very low	33.2	Very low	79 Å²	79	139.9 Å²	139.9	55%	0.552	73%	0.732	S	S	*	*			cis	-164.4	159.8	-30.5	67.2	0	0	0	0	109.5
402	L	27.1	Very low	33	Very low	152 Å²	152	141 Å²	141	80%	0.796	74%	0.74	S	S	*	*			trans	50.7	108	154.4	-75.7	160	0	0	0	120.4
403	L	26.2	Very low	33.7	Very low	177 Å²	177	141.2 Å²	141.2	93%	0.927	73%	0.733	S	S	*	*				-177.5	81.4	123.3	-102.2	165.1	0	0	0	114.4
404	D	28.8	Very low	34.8	Very low	130 Å²	130	135.1 Å²	135.1	70%	0.695	71%	0.705	S	S	*	*				159.7	143.1	118.3	-168.4	21.4	0	0	0	110.3
405	T	27.6	Very low	36.4	Very low	115 Å²	115	135.5 Å²	135.5	71%	0.706	71%	0.708	S	S	*	*			trans	-125.2	101.8	-165.5	47	0	0	0	0	112.7
406	K	31.5	Very low	38.6	Very low	164 Å²	164	129.6 Å²	129.6	71%	0.713	68%	0.681	S	S	*	*			trans	-155.3	154.4	159.6	-88.2	113.8	-170	170.1	0	110.4
407	Y	29.7	Very low	41	Very low	221 Å²	221	128.4 Å²	128.4	87%	0.867	67%	0.666	S	S	*	*			trans	65.9	117.1	-173.5	-55.3	-85.1	0	0	0	113.8
408	S	27.6	Very low	43.3	Very low	87 Å²	87	119.6 Å²	119.6	61%	0.608	63%	0.625	S	S	*	*			cis	117.1	83.3	11.7	74.8	0	0	0	0	113.5	E410	S408-E410 VanDerWaalsContact C-N 3.34Å; S408-E410 PolarHBondContact O-N 2.96Å
409	N	30.8	Very low	45.6	Very low	178 Å²	178	115.7 Å²	115.7	95%	0.952	61%	0.607	S	S	*	*	S	Bend	trans	57	-3.6	142.3	-66.5	13.8	0	0	0	122.9
410	E	36.6	Very low	47.7	Very low	171 Å²	171	113.2 Å²	113.2	80%	0.799	60%	0.599	S	S	*	*	S	Bend	trans	-124.1	126.3	-179.9	-67.7	-174.9	-170.4	0	0	113.7	S408	S408-E410 VanDerWaalsContact C-N 3.34Å; S408-E410 PolarHBondContact O-N 2.96Å
411	N	41.7	Very low	50.2	Low	135 Å²	135	104.2 Å²	104.2	72%	0.722	56%	0.56	S	S	*	*	S	Bend	trans	63.1	135.2	179	-60.6	-45	0	0	0	117.7	M413	N411-M413 PolarHBondContact O-N 2.96Å
412	P	53.5	Low	52.8	Low	97 Å²	97	103.2 Å²	103.2	63%	0.63	55%	0.553	S	S	*	*			trans	-71.5	127.7	171.8	30.3	-33.1	0	0	0	110.5	P358	P358-P412 WeakPolarHBondContact CD-O 3.31Å; P358-P412 HydrophobicContact CG-CG 4.34Å
413	M	62.6	Low	55.3	Low	83 Å²	83	97.2 Å²	97.2	41%	0.409	52%	0.523	S	S	.	.			trans	-108.5	136.1	176.8	-71.7	-71.5	-68.3	0	0	110.5	R355 P357 N411	R355-M413 HydrophobicContact CB-CE 3.92Å; R355-M413 HydrophobicContact CG-CE 4.02Å; P357-M413 HydrophobicContact CB-SD 4.07Å; N411-M413 PolarHBondContact O-N 2.96Å
414	I	68.5	Low	58.1	Low	18 Å²	18	92.1 Å²	92.1	9%	0.092	49%	0.493	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	139.6	169.5	-62.1	166.7	0	0	0	107.9	R355 W356 P358 Y367 M394	R355-I414 WeakPolarHBondContact CA-O 3.33Å; W356-I414 HydrophobicContact CD2-CB 4.25Å; W356-I414 HydrophobicContact CD2-CG2 4.29Å; W356-I414 HydrophobicContact CH2-CG2 3.87Å; W356-I414 HydrophobicContact CZ2-CB 4.3Å; W356-I414 HydrophobicContact CZ2-CG2 3.55Å; W356-I414 HydrophobicContact CZ3-CG2 4.36Å; W356-I414 PolarHBondContact N-O 3.11Å; W356-I414 WeakPolarHBondContact O-CB 3.33Å; W356-I414 PolarHBondContact O-N 3Å; P358-I414 HydrophobicContact CB-CD1 4.25Å; Y367-I414 HydrophobicContact CD2-CD1 3.98Å; Y367-I414 HydrophobicContact CE2-CD1 3.46Å; Y367-I414 VanDerWaalsContact CE2-CD1 3.46Å; M394-I414 HydrophobicContact CE-CG2 3.75Å; M394-I414 HydrophobicContact SD-CG2 3.89Å
415	L	74.2	Confident	60.5	Low	101 Å²	101	86.6 Å²	86.6	53%	0.529	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	112.9	-175.1	-81.1	160.4	0	0	0	110	V353 R355 M394	V353-L415 HydrophobicContact CG1-CD2 4.14Å; R355-L415 HydrophobicContact CB-CD2 3.89Å; M394-L415 WeakPolarHBondContact CE-O 3.31Å
416	Y	78.9	Confident	63.2	Low	60 Å²	60	83.3 Å²	83.3	24%	0.235	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	129.7	-176.1	-170.7	-90.2	0	0	0	112.6	V353 L354 I386 I389 L418	V353-Y416 CarbonylContact C-O 3.46Å; V353-Y416 WeakPolarHBondContact CA-O 3.47Å; L354-Y416 PolarHBondContact N-O 2.78Å; L354-Y416 PolarHBondContact O-N 2.69Å; I386-Y416 HydrophobicContact CD1-CE1 4Å; I386-Y416 HydrophobicContact CG2-CE1 4.16Å; I386-Y416 HydrophobicContact CG2-CE2 4.38Å; I386-Y416 WeakPolarHBondContact CG2-OH 3.36Å; I389-Y416 HydrophobicContact CD1-CD2 3.73Å; I389-Y416 HydrophobicContact CD1-CE2 3.99Å; I389-Y416 HydrophobicContact CD1-CG 4.03Å; I389-Y416 HydrophobicContact CG1-CD2 4.1Å; I389-Y416 HydrophobicContact CG1-CE2 4.06Å; I389-Y416 HydrophobicContact CG2-CD2 4.2Å; Y416-L418 HydrophobicContact CD1-CD2 4.1Å; Y416-L418 HydrophobicContact CD1-CG 4.3Å; Y416-L418 HydrophobicContact CE1-CD2 3.98Å; Y416-L418 HydrophobicContact CE1-CG 4.49Å
417	N	78	Confident	65.6	Low	82 Å²	82	76 Å²	76	44%	0.439	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	103.3	-178.1	-168.7	13	0	0	0	111	A352 V353 T419	A352-N417 CarbonylContact O-C 3.57Å; A352-N417 PolarHBondContact O-OD1 2.87Å; V353-N417 HydrophobicContact CG2-CB 4.46Å; N417-T419 PolarHBondContact O-N 2.77Å
418	L	76.4	Confident	68.2	Low	0 Å²	0	65.8 Å²	65.8	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	106.5	175.2	-68.2	170.5	0	0	0	110	Y351 A352 L354 V369 L371 I386 Y416 L421 F449	Y351-L418 CarbonylContact C-O 3.52Å; Y351-L418 WeakPolarHBondContact CA-O 3.3Å; Y351-L418 VanDerWaalsContact CB-O 3.24Å; Y351-L418 WeakPolarHBondContact CB-O 3.44Å; A352-L418 HydrophobicContact CB-CB 4.44Å; A352-L418 HydrophobicContact CB-CD1 4.43Å; A352-L418 PolarHBondContact N-O 2.93Å; A352-L418 WeakPolarHBondContact O-CA 3.34Å; A352-L418 WeakPolarHBondContact O-CB 3.34Å; A352-L418 PolarHBondContact O-N 2.62Å; L354-L418 HydrophobicContact CD1-CD1 3.91Å; L354-L418 HydrophobicContact CD1-CD2 4.24Å; L354-L418 HydrophobicContact CD1-CG 4.13Å; L354-L418 HydrophobicContact CD2-CD1 3.93Å; L354-L418 HydrophobicContact CG-CD1 3.68Å; L354-L418 HydrophobicContact CG-CG 4.05Å; V369-L418 HydrophobicContact CG1-CD2 4.35Å; L371-L418 HydrophobicContact CD1-CD1 4.19Å; I386-L418 HydrophobicContact CD1-CD2 3.55Å; Y416-L418 HydrophobicContact CD1-CD2 4.1Å; Y416-L418 HydrophobicContact CD1-CG 4.3Å; Y416-L418 HydrophobicContact CE1-CD2 3.98Å; Y416-L418 HydrophobicContact CE1-CG 4.49Å; L418-L421 HydrophobicContact CB-CD1 4.32Å; L418-F449 HydrophobicContact CD1-CE1 4.07Å; L418-F449 HydrophobicContact CD1-CZ 3.69Å
419	T	76.4	Confident	70.9	Confident	72 Å²	72	61.7 Å²	61.7	44%	0.442	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	158.1	177	59.9	0	0	0	0	112.4	R384 N417	R384-T419 PolarHBondContact NH1-O 2.89Å; R384-T419 PolarHBondContact NH2-O 2.95Å; N417-T419 PolarHBondContact O-N 2.77Å
420	G	72.5	Confident	73.6	Confident	59 Å²	59	55.4 Å²	55.4	61%	0.608	31%	0.308	S	S	*	.	S	Bend	trans	74.7	42.9	-179.6	0	0	0	0	0	112.6	T350 R384	T350-G420 PolarHBondContact O-N 2.82Å; T350-G420 VanDerWaalsContact O-N 3.08Å; R384-G420 PolarHBondContact NH1-O 2.83Å; R384-G420 VanDerWaalsContact NH1-O 3.16Å
421	L	79.8	Confident	75.9	Confident	8 Å²	8	47.3 Å²	47.3	4%	0.042	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-90.4	157.1	171.8	-53.1	-177.3	0	0	0	110.7	T350 A352 L371 L418 Y427 F449 T451	T350-L421 WeakPolarHBondContact CA-O 3.45Å; T350-L421 WeakPolarHBondContact O-CB 3.42Å; T350-L421 PolarHBondContact O-N 2.91Å; A352-L421 HydrophobicContact CB-CD1 3.94Å; L371-L421 HydrophobicContact CD2-CD2 3.64Å; L418-L421 HydrophobicContact CB-CD1 4.32Å; L421-Y427 HydrophobicContact CB-CE2 3.87Å; L421-Y427 HydrophobicContact CD1-CD2 4.48Å; L421-Y427 HydrophobicContact CD1-CE2 4.34Å; L421-Y427 HydrophobicContact CD2-CE1 4.23Å; L421-Y427 HydrophobicContact CD2-CE2 4.31Å; L421-Y427 HydrophobicContact CG-CE2 4.42Å; L421-F449 HydrophobicContact CD1-CE2 3.77Å; L421-F449 HydrophobicContact CD1-CZ 4.18Å; L421-T451 HydrophobicContact CB-CG2 3.81Å; L421-T451 HydrophobicContact CD1-CG2 3.78Å; L421-T451 HydrophobicContact CG-CG2 4.47Å
422	S	79.7	Confident	78	Confident	57 Å²	57	41.8 Å²	41.8	40%	0.399	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-80.7	142.9	175.4	-57	0	0	0	0	111.3	S349 T425 Y427 T451	S349-S422 CarbonylContact O-C 3.56Å; S422-T425 VanDerWaalsContact CB-OG1 3.22Å; S422-T425 WeakPolarHBondContact CB-OG1 2.98Å; S422-T425 PolarHBondContact O-OG1 2.72Å; S422-Y427 WeakPolarHBondContact CB-OH 3.13Å; S422-Y427 PolarHBondContact N-OH 3.02Å; S422-T451 PolarHBondContact O-OG1 2.81Å
423	P	80.5	Confident	79.2	Confident	26 Å²	26	37.3 Å²	37.3	17%	0.169	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	145.7	176.8	-24.1	34.9	0	0	0	114.4	S349 T425 L454 N484	S349-P423 VanDerWaalsContact O-CA 3.31Å; S349-P423 WeakPolarHBondContact O-CA 3.24Å; P423-T425 PolarHBondContact O-N 2.8Å; P423-T425 PolarHBondContact O-OG1 2.88Å; P423-T425 VanDerWaalsContact O-OG1 3.11Å; P423-L454 HydrophobicContact CB-CB 3.61Å; P423-L454 HydrophobicContact CG-CB 3.63Å; P423-L454 HydrophobicContact CG-CD2 3.75Å; P423-L454 HydrophobicContact CG-CG 4.35Å; P423-N484 HydrophobicContact CB-CB 4.25Å; P423-N484 WeakPolarHBondContact CB-O 3.22Å
424	F	84.7	Confident	79.8	Confident	70 Å²	70	34.9 Å²	34.9	31%	0.307	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	6.4	179.4	-163.3	-122.7	0	0	0	116.5	R450 T451 A452 E453 R486	F424-R450 PolarHBondContact O-NH1 3Å; F424-T451 WeakPolarHBondContact CA-O 3.39Å; F424-T451 PolarHBondContact N-OG1 3.47Å; F424-T451 VanDerWaalsContact N-OG1 3.13Å; F424-A452 PolarHBondContact N-O 2.7Å; F424-E453 HydrophobicContact CB-CG 4.07Å; F424-E453 HydrophobicContact CD2-CG 3.36Å; F424-E453 HydrophobicContact CE2-CG 3.91Å; F424-E453 HydrophobicContact CG-CG 3.82Å; F424-R486 HydrophobicContact CE1-CB 4.35Å; F424-R486 HydrophobicContact CZ-CB 4.47Å
425	T	80.4	Confident	79.7	Confident	15 Å²	15	35.3 Å²	35.3	9%	0.092	21%	0.205	C	C	.	.			trans	-81.6	139.7	-173.4	-58.2	0	0	0	0	111.8	I373 S422 P423 Y427 R450 T451	I373-T425 HydrophobicContact CB-CG2 4.22Å; I373-T425 HydrophobicContact CD1-CG2 3.86Å; I373-T425 HydrophobicContact CG1-CG2 3.72Å; I373-T425 HydrophobicContact CG2-CG2 3.58Å; S422-T425 VanDerWaalsContact CB-OG1 3.22Å; S422-T425 WeakPolarHBondContact CB-OG1 2.98Å; S422-T425 PolarHBondContact O-OG1 2.72Å; P423-T425 PolarHBondContact O-N 2.8Å; P423-T425 PolarHBondContact O-OG1 2.88Å; P423-T425 VanDerWaalsContact O-OG1 3.11Å; T425-Y427 HydrophobicContact CG2-CD2 4.17Å; T425-Y427 HydrophobicContact CG2-CE1 4.36Å; T425-Y427 HydrophobicContact CG2-CE2 3.65Å; T425-R450 WeakPolarHBondContact O-CA 3Å; T425-R450 WeakPolarHBondContact O-CG 3.17Å; T425-T451 PolarHBondContact N-OG1 3.33Å; T425-T451 PolarHBondContact O-N 2.72Å; T425-T451 PolarHBondContact O-OG1 2.88Å
426	L	82.9	Confident	79	Confident	45 Å²	45	40.8 Å²	40.8	24%	0.236	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	132	172.7	-173.4	66	0	0	0	109.6	I373 D374 R450	I373-L426 CarbonylContact C-O 3.53Å; I373-L426 WeakPolarHBondContact CA-O 3.11Å; D374-L426 HydrophobicContact CB-CB 4.07Å; D374-L426 HydrophobicContact CB-CD2 3.64Å; D374-L426 HydrophobicContact CB-CG 3.73Å; D374-L426 PolarHBondContact N-O 2.83Å; L426-R450 HydrophobicContact CD1-CB 3.95Å
427	Y	82.6	Confident	77.6	Confident	11 Å²	11	44.7 Å²	44.7	4%	0.043	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	149.7	-177.4	-75	-80.7	0	0	0	112	L371 Q372 I373 L421 S422 T425 K448 F449 T451	L371-Y427 HydrophobicContact CD1-CD1 3.82Å; L371-Y427 HydrophobicContact CD1-CG 4.21Å; L371-Y427 HydrophobicContact CD2-CD1 3.94Å; L371-Y427 HydrophobicContact CD2-CE1 4.02Å; L371-Y427 HydrophobicContact CG-CD1 3.77Å; L371-Y427 HydrophobicContact CG-CE1 4.29Å; Q372-Y427 CarbonylContact O-C 3.58Å; Q372-Y427 VanDerWaalsContact O-CA 3.24Å; Q372-Y427 WeakPolarHBondContact O-CA 3.11Å; Q372-Y427 WeakPolarHBondContact O-CD1 2.87Å; I373-Y427 HydrophobicContact CD1-CE1 4.02Å; I373-Y427 HydrophobicContact CG1-CD1 3.82Å; I373-Y427 HydrophobicContact CG1-CE1 3.35Å; L421-Y427 HydrophobicContact CB-CE2 3.87Å; L421-Y427 HydrophobicContact CD1-CD2 4.48Å; L421-Y427 HydrophobicContact CD1-CE2 4.34Å; L421-Y427 HydrophobicContact CD2-CE1 4.23Å; L421-Y427 HydrophobicContact CD2-CE2 4.31Å; L421-Y427 HydrophobicContact CG-CE2 4.42Å; S422-Y427 WeakPolarHBondContact CB-OH 3.13Å; S422-Y427 PolarHBondContact N-OH 3.02Å; T425-Y427 HydrophobicContact CG2-CD2 4.17Å; T425-Y427 HydrophobicContact CG2-CE1 4.36Å; T425-Y427 HydrophobicContact CG2-CE2 3.65Å; Y427-K448 CarbonylContact O-C 3.58Å; Y427-K448 VanDerWaalsContact O-CA 3.22Å; Y427-K448 WeakPolarHBondContact O-CA 3.2Å; Y427-F449 AromaticContact CD2-CE2 3.99Å; Y427-F449 HydrophobicContact CD2-CE2 3.99Å; Y427-F449 HydrophobicContact CD2-CZ 4.37Å; Y427-F449 HydrophobicContact CG-CE2 4.15Å; Y427-F449 HydrophobicContact CG-CZ 4.08Å; Y427-F449 PolarHBondContact N-O 2.81Å; Y427-F449 PolarHBondContact O-N 3.19Å; Y427-T451 HydrophobicContact CD2-CG2 4.16Å; Y427-T451 HydrophobicContact CE2-CG2 3.94Å
428	S	84.5	Confident	76.5	Confident	6 Å²	6	42.3 Å²	42.3	4%	0.042	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	138.6	169.9	-66.4	0	0	0	0	110.1	L371 Q372 D374 V447 K448	L371-S428 CarbonylContact C-O 3.6Å; L371-S428 WeakPolarHBondContact CA-O 3.09Å; Q372-S428 PolarHBondContact N-O 2.88Å; Q372-S428 PolarHBondContact O-N 2.96Å; D374-S428 WeakPolarHBondContact OD1-CB 3.41Å; D374-S428 PolarHBondContact OD1-OG 3.32Å; D374-S428 PolarHBondContact OD2-OG 2.73Å; S428-V447 CarbonylContact C-O 3.56Å; S428-V447 WeakPolarHBondContact CA-O 3.39Å; S428-K448 WeakPolarHBondContact OG-CD 3.11Å; S428-K448 WeakPolarHBondContact OG-CE 3.23Å; S428-K448 WeakPolarHBondContact OG-CG 3.49Å
429	A	83.2	Confident	75.8	Confident	1 Å²	1	44 Å²	44	1%	0.008	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	146.6	-176.9	0	0	0	0	0	114.4	L354 S370 L371 V447 F449	L354-A429 HydrophobicContact CD2-CB 4.17Å; S370-A429 VanDerWaalsContact O-CA 3.23Å; S370-A429 WeakPolarHBondContact O-CA 3.14Å; L371-A429 HydrophobicContact CD1-CB 4.08Å; A429-V447 PolarHBondContact N-O 3.08Å; A429-V447 PolarHBondContact O-N 2.89Å; A429-F449 HydrophobicContact CB-CE1 4.32Å
430	Q	88.2	Confident	75.4	Confident	47 Å²	47	43.8 Å²	43.8	22%	0.22	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	166.3	174.6	-72.8	174.1	-70.7	0	0	111.2	V369 S370 P443 S444 L446	V369-Q430 CarbonylContact C-O 3.59Å; V369-Q430 VanDerWaalsContact CA-O 3.3Å; V369-Q430 WeakPolarHBondContact CA-O 3.5Å; S370-Q430 PolarHBondContact N-O 3.44Å; S370-Q430 PolarHBondContact O-N 2.93Å; Q430-P443 HydrophobicContact CB-CB 4.25Å; Q430-S444 PolarHBondContact NE2-O 2.99Å; Q430-L446 HydrophobicContact CG-CB 4.05Å; Q430-L446 HydrophobicContact CG-CD1 3.64Å; Q430-L446 HydrophobicContact CG-CG 4.46Å
431	V	84.4	Confident	75.5	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	135.3	176	-178.1	0	0	0	0	111	P339 L342 W356 Y367 T368 V369 P443 S444	P339-V431 HydrophobicContact CG-CG1 4.28Å; L342-V431 HydrophobicContact CD1-CG2 3.77Å; L342-V431 HydrophobicContact CD2-CG2 4.04Å; W356-V431 HydrophobicContact CD2-CG1 4.5Å; W356-V431 HydrophobicContact CD2-CG2 4.03Å; W356-V431 HydrophobicContact CE3-CG2 3.98Å; W356-V431 HydrophobicContact CH2-CG2 4.31Å; W356-V431 HydrophobicContact CZ2-CG1 4.13Å; W356-V431 HydrophobicContact CZ2-CG2 4.34Å; W356-V431 HydrophobicContact CZ3-CG2 4.13Å; Y367-V431 HydrophobicContact CD1-CG1 3.84Å; Y367-V431 HydrophobicContact CG-CG1 4.28Å; T368-V431 CarbonylContact O-C 3.38Å; T368-V431 WeakPolarHBondContact O-CA 3.2Å; V369-V431 HydrophobicContact CG2-CG2 3.91Å; V431-P443 CarbonylContact O-C 3.31Å; V431-S444 PolarHBondContact N-OG 2.8Å; V431-S444 WeakPolarHBondContact O-CB 3.28Å; V431-S444 PolarHBondContact O-N 2.93Å
432	H	86.9	Confident	75.4	Confident	18 Å²	18	46.7 Å²	46.7	8%	0.083	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	153.5	170.7	-56.4	84.9	0	0	0	110.7	Y367 T368 L440 S441 E2286	Y367-H432 CarbonylContact C-O 3.59Å; Y367-H432 VanDerWaalsContact CA-O 3.3Å; Y367-H432 WeakPolarHBondContact CA-O 3.43Å; T368-H432 PolarHBondContact N-O 3.38Å; T368-H432 PolarHBondContact O-N 3.45Å; H432-L440 HydrophobicContact CB-CD2 4.07Å; H432-S441 PolarHBondContact CD2-O 3.5Å; H432-E2286 IonicContact CE1-OE2 2.67Å; H432-E2286 PolarHBondContact CE1-OE2 3.44Å
433	A	77.6	Confident	75.3	Confident	3 Å²	3	46.5 Å²	46.5	3%	0.025	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	145.3	164.6	0	0	0	0	0	110.3	P339 V364 S441	P339-A433 HydrophobicContact CG-CB 4.13Å; V364-A433 HydrophobicContact CG1-CB 3.89Å; V364-A433 HydrophobicContact CG2-CB 3.95Å; A433-S441 PolarHBondContact N-OG 3.03Å; A433-S441 PolarHBondContact O-N 2.91Å; A433-S441 PolarHBondContact O-OG 2.65Å
434	V	75.9	Confident	75.4	Confident	33 Å²	33	45.7 Å²	45.7	20%	0.2	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	136.7	-177.7	-175.1	0	0	0	0	110.1	V364 D365 S366 T368 L440	V364-V434 WeakPolarHBondContact CA-O 3.06Å; D365-V434 PolarHBondContact N-O 2.77Å; S366-V434 PolarHBondContact O-N 2.97Å; T368-V434 WeakPolarHBondContact OG1-CG2 3.28Å; V434-L440 HydrophobicContact CG2-CD2 4.29Å; V434-L440 HydrophobicContact CG2-CG 4.38Å
435	S	66	Low	75.1	Confident	27 Å²	27	47.9 Å²	47.9	19%	0.189	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130.9	173.5	-170.8	0	0	0	0	112.1	G363 V437 A438 G439	G363-S435 WeakPolarHBondContact O-CA 3.32Å; G363-S435 WeakPolarHBondContact O-CB 3.48Å; G363-S435 PolarHBondContact O-OG 3.5Å; S435-V437 PolarHBondContact O-N 3.23Å; S435-V437 VanDerWaalsContact O-N 3.07Å; S435-A438 PolarHBondContact O-N 3.41Å; S435-G439 PolarHBondContact N-O 3.34Å; S435-G439 PolarHBondContact O-N 3.12Å
436	R	60.3	Low	75.1	Confident	215 Å²	215	51.3 Å²	51.3	81%	0.811	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-19.2	178.2	-88.6	-176.8	-88.6	-155.1	-12.4	115	D365	D365-R436 VanDerWaalsContact CG-NE 3.29Å; D365-R436 IonicContact OD1-CZ 3.48Å; D365-R436 IonicContact OD1-NE 2.72Å; D365-R436 PolarHBondContact OD1-NE 3.35Å; D365-R436 IonicContact OD1-NH2 2.74Å; D365-R436 PolarHBondContact OD1-NH2 2.95Å; D365-R436 VanDerWaalsContact OD2-CB 3.26Å; D365-R436 WeakPolarHBondContact OD2-CB 3.28Å; D365-R436 WeakPolarHBondContact OD2-CG 3.12Å; D365-R436 PolarHBondContact OD2-N 3.32Å; D365-R436 IonicContact OD2-NE 3.53Å; D365-R436 PolarHBondContact OD2-NE 2.59Å
437	V	50.1	Low	75.2	Confident	142 Å²	142	50.4 Å²	50.4	86%	0.861	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-26	-174.2	-170.1	0	0	0	0	112.6	S435	S435-V437 PolarHBondContact O-N 3.23Å; S435-V437 VanDerWaalsContact O-N 3.07Å
438	A	54	Low	75.3	Confident	33 Å²	33	55.4 Å²	55.4	27%	0.273	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.6	1.4	-169.3	0	0	0	0	0	115.1	P336 S435	P336-A438 HydrophobicContact CB-CB 3.78Å; P336-A438 VanDerWaalsContact CD-O 3.31Å; P336-A438 WeakPolarHBondContact CD-O 3.47Å; P336-A438 HydrophobicContact CG-CB 3.92Å; P336-A438 WeakPolarHBondContact CG-O 3.32Å; S435-A438 PolarHBondContact O-N 3.41Å
439	G	61.3	Low	75.3	Confident	34 Å²	34	55.6 Å²	55.6	35%	0.351	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	85.7	-152.1	178	0	0	0	0	0	113.9	S435	S435-G439 PolarHBondContact N-O 3.34Å; S435-G439 PolarHBondContact O-N 3.12Å
440	L	68.5	Low	75.4	Confident	68 Å²	68	60.3 Å²	60.3	36%	0.356	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	150.2	179.1	-66.9	102.4	0	0	0	112	P336 H432 V434	P336-L440 VanDerWaalsContact CG-O 3.31Å; P336-L440 WeakPolarHBondContact CG-O 3.48Å; H432-L440 HydrophobicContact CB-CD2 4.07Å; V434-L440 HydrophobicContact CG2-CD2 4.29Å; V434-L440 HydrophobicContact CG2-CG 4.38Å
441	S	74.7	Confident	75.1	Confident	12 Å²	12	58.3 Å²	58.3	8%	0.084	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	176.5	165.9	70.8	0	0	0	0	113.1	A337 H432 A433	A337-S441 WeakPolarHBondContact O-CB 3.22Å; H432-S441 PolarHBondContact CD2-O 3.5Å; A433-S441 PolarHBondContact N-OG 3.03Å; A433-S441 PolarHBondContact O-N 2.91Å; A433-S441 PolarHBondContact O-OG 2.65Å
442	L	77.1	Confident	74.9	Confident	117 Å²	117	60.6 Å²	60.6	61%	0.613	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.6	157.1	156.6	-61.1	170.7	0	0	0	111.2	P338	P338-L442 HydrophobicContact CB-CB 3.93Å; P338-L442 WeakPolarHBondContact CB-O 3.09Å; P338-L442 HydrophobicContact CG-CB 4.25Å
443	P	77.8	Confident	74.7	Confident	53 Å²	53	61.8 Å²	61.8	34%	0.344	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	163.1	175	28.9	-35.1	0	0	0	113.7	Q430 V431	Q430-P443 HydrophobicContact CB-CB 4.25Å; V431-P443 CarbonylContact O-C 3.31Å
444	S	83.5	Confident	75.1	Confident	8 Å²	8	65.1 Å²	65.1	6%	0.056	35%	0.349	C	S	.	.			trans	-71	176.8	164	73.8	0	0	0	0	112.9	Q430 V431	Q430-S444 PolarHBondContact NE2-O 2.99Å; V431-S444 PolarHBondContact N-OG 2.8Å; V431-S444 WeakPolarHBondContact O-CB 3.28Å; V431-S444 PolarHBondContact O-N 2.93Å
445	D	77.4	Confident	75.5	Confident	117 Å²	117	64.9 Å²	64.9	63%	0.626	35%	0.35	S	S	*	.			trans	-55.6	150.1	164.5	-59.1	-63.5	0	0	0	112.7
446	L	81.2	Confident	76.4	Confident	86 Å²	86	63.8 Å²	63.8	45%	0.45	34%	0.342	S	S	.	.			trans	-89.4	121.9	-177	-174.9	78.3	0	0	0	111.4	Q430	Q430-L446 HydrophobicContact CG-CB 4.05Å; Q430-L446 HydrophobicContact CG-CD1 3.64Å; Q430-L446 HydrophobicContact CG-CG 4.46Å
447	V	83.5	Confident	77.5	Confident	26 Å²	26	55.3 Å²	55.3	16%	0.158	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	137.3	176.4	-171.8	0	0	0	0	110.7	L342 A344 S428 A429	L342-V447 HydrophobicContact CB-CG2 3.96Å; L342-V447 HydrophobicContact CD2-CG2 3.98Å; L342-V447 HydrophobicContact CG-CG2 3.77Å; L342-V447 WeakPolarHBondContact O-CG2 2.93Å; A344-V447 HydrophobicContact CB-CB 4.19Å; A344-V447 HydrophobicContact CB-CG1 3.54Å; S428-V447 CarbonylContact C-O 3.56Å; S428-V447 WeakPolarHBondContact CA-O 3.39Å; A429-V447 PolarHBondContact N-O 3.08Å; A429-V447 PolarHBondContact O-N 2.89Å
448	K	84.5	Confident	79.2	Confident	116 Å²	116	50 Å²	50	50%	0.504	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	140.5	-178.9	-54	-159.4	177.9	-163.4	0	112.9	D374 Y427 S428	D374-K448 IonicContact OD2-NZ 3.2Å; D374-K448 PolarHBondContact OD2-NZ 3.21Å; Y427-K448 CarbonylContact O-C 3.58Å; Y427-K448 VanDerWaalsContact O-CA 3.22Å; Y427-K448 WeakPolarHBondContact O-CA 3.2Å; S428-K448 WeakPolarHBondContact OG-CD 3.11Å; S428-K448 WeakPolarHBondContact OG-CE 3.23Å; S428-K448 WeakPolarHBondContact OG-CG 3.49Å
449	F	84.5	Confident	80.9	Confident	11 Å²	11	50.2 Å²	50.2	5%	0.048	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	154.6	179	65.7	-87.4	0	0	0	111.8	A344 P346 A352 L371 L418 L421 Y427 A429	A344-F449 HydrophobicContact CB-CD1 3.73Å; A344-F449 HydrophobicContact CB-CE1 4.3Å; A344-F449 HydrophobicContact CB-CG 4.42Å; P346-F449 HydrophobicContact CB-CD2 4.28Å; P346-F449 HydrophobicContact CG-CB 4.49Å; A352-F449 HydrophobicContact CB-CD2 3.86Å; A352-F449 HydrophobicContact CB-CE2 3.41Å; A352-F449 VanDerWaalsContact CB-CE2 3.41Å; A352-F449 HydrophobicContact CB-CZ 3.91Å; L371-F449 HydrophobicContact CD1-CE1 4.08Å; L371-F449 HydrophobicContact CD1-CZ 3.91Å; L418-F449 HydrophobicContact CD1-CE1 4.07Å; L418-F449 HydrophobicContact CD1-CZ 3.69Å; L421-F449 HydrophobicContact CD1-CE2 3.77Å; L421-F449 HydrophobicContact CD1-CZ 4.18Å; Y427-F449 AromaticContact CD2-CE2 3.99Å; Y427-F449 HydrophobicContact CD2-CE2 3.99Å; Y427-F449 HydrophobicContact CD2-CZ 4.37Å; Y427-F449 HydrophobicContact CG-CE2 4.15Å; Y427-F449 HydrophobicContact CG-CZ 4.08Å; Y427-F449 PolarHBondContact N-O 2.81Å; Y427-F449 PolarHBondContact O-N 3.19Å; A429-F449 HydrophobicContact CB-CE1 4.32Å
450	R	85.4	Confident	82.2	Confident	100 Å²	100	48.9 Å²	48.9	38%	0.377	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	136.8	176.9	-175.4	-178.1	-76.9	-100.3	-2.6	110.5	P346 F424 T425 L426	P346-R450 WeakPolarHBondContact CB-O 3.44Å; P346-R450 WeakPolarHBondContact CG-O 3.38Å; F424-R450 PolarHBondContact O-NH1 3Å; T425-R450 WeakPolarHBondContact O-CA 3Å; T425-R450 WeakPolarHBondContact O-CG 3.17Å; L426-R450 HydrophobicContact CD1-CB 3.95Å
451	T	83	Confident	83.1	Confident	4 Å²	4	49.1 Å²	49.1	3%	0.025	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-74.6	159.3	173.2	50.4	0	0	0	0	112.2	S349 L421 S422 F424 T425 Y427	S349-T451 WeakPolarHBondContact O-CB 3.36Å; L421-T451 HydrophobicContact CB-CG2 3.81Å; L421-T451 HydrophobicContact CD1-CG2 3.78Å; L421-T451 HydrophobicContact CG-CG2 4.47Å; S422-T451 PolarHBondContact O-OG1 2.81Å; F424-T451 WeakPolarHBondContact CA-O 3.39Å; F424-T451 PolarHBondContact N-OG1 3.47Å; F424-T451 VanDerWaalsContact N-OG1 3.13Å; T425-T451 PolarHBondContact N-OG1 3.33Å; T425-T451 PolarHBondContact O-N 2.72Å; T425-T451 PolarHBondContact O-OG1 2.88Å; Y427-T451 HydrophobicContact CD2-CG2 4.16Å; Y427-T451 HydrophobicContact CE2-CG2 3.94Å
452	A	79.5	Confident	83.5	Confident	50 Å²	50	52.3 Å²	52.3	41%	0.413	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-70.3	160	175.7	0	0	0	0	0	112.6	G348 S349 F424	G348-A452 PolarHBondContact O-N 3.45Å; G348-A452 VanDerWaalsContact O-N 3.16Å; S349-A452 WeakPolarHBondContact CA-O 3.1Å; S349-A452 VanDerWaalsContact CB-O 3.28Å; S349-A452 WeakPolarHBondContact CB-O 3.1Å; F424-A452 PolarHBondContact N-O 2.7Å
453	E	83.5	Confident	84.1	Confident	42 Å²	42	48.2 Å²	48.2	20%	0.196	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-64.6	152.6	170.3	-67.1	-168.4	-161.2	0	0	111.6	F424 R486 N534 A535 A536	F424-E453 HydrophobicContact CB-CG 4.07Å; F424-E453 HydrophobicContact CD2-CG 3.36Å; F424-E453 HydrophobicContact CE2-CG 3.91Å; F424-E453 HydrophobicContact CG-CG 3.82Å; E453-R486 PolarHBondContact OE1-N 2.88Å; E453-N534 WeakPolarHBondContact OE2-CB 3.47Å; E453-A535 WeakPolarHBondContact OE2-CB 3.22Å; E453-A535 PolarHBondContact OE2-N 2.81Å; E453-A536 HydrophobicContact CB-CB 3.83Å; E453-A536 WeakPolarHBondContact O-CB 3.41Å
454	L	84.7	Confident	84.5	Confident	74 Å²	74	50.9 Å²	50.9	39%	0.387	28%	0.278	S	S	.	.			trans	-126.8	153.8	166.8	-179.5	68.8	0	0	0	107.8	P423 N484 N534	P423-L454 HydrophobicContact CB-CB 3.61Å; P423-L454 HydrophobicContact CG-CB 3.63Å; P423-L454 HydrophobicContact CG-CD2 3.75Å; P423-L454 HydrophobicContact CG-CG 4.35Å; L454-N484 HydrophobicContact CB-CB 4.14Å; L454-N484 PolarHBondContact N-O 2.77Å; L454-N484 CarbonylContact O-C 3.59Å; L454-N484 WeakPolarHBondContact O-CB 3.45Å; L454-N484 VanDerWaalsContact O-O 3.06Å; L454-N534 PolarHBondContact O-ND2 2.78Å
455	A	84.3	Confident	84.6	Confident	28 Å²	28	51.6 Å²	51.6	23%	0.231	28%	0.284	C	S	.	.			trans	-57.9	149.3	178	0	0	0	0	0	111.7	G457 N484	A455-G457 PolarHBondContact O-N 2.66Å; A455-N484 WeakPolarHBondContact O-CB 3.06Å; A455-N484 PolarHBondContact O-ND2 3.4Å
456	P	86.4	Confident	84.6	Confident	4 Å²	4	50.1 Å²	50.1	3%	0.026	28%	0.276	C	S	.	.			trans	-56.1	131.3	-178.3	-23.6	33.7	0	0	0	111.7	P480 E482 I487 A532 G539 P540	P456-P480 HydrophobicContact CB-CG 4.26Å; P456-E482 CarbonylContact C-O 3.59Å; P456-E482 WeakPolarHBondContact CA-O 2.98Å; P456-I487 HydrophobicContact CB-CD1 4.28Å; P456-I487 HydrophobicContact CG-CD1 3.67Å; P456-A532 HydrophobicContact CG-CB 4.26Å; P456-G539 VanDerWaalsContact O-CA 3.28Å; P456-G539 WeakPolarHBondContact O-CA 3.37Å; P456-P540 WeakPolarHBondContact O-CD 3.33Å
457	G	83.5	Confident	84.3	Confident	36 Å²	36	46.2 Å²	46.2	37%	0.371	26%	0.255	S	S	.	.	S	Bend	trans	-82.1	-24.8	-170	0	0	0	0	0	114.4	A455 E482 N484	A455-G457 PolarHBondContact O-N 2.66Å; G457-E482 WeakPolarHBondContact CA-OE2 3.37Å; G457-E482 PolarHBondContact N-O 2.82Å; G457-N484 PolarHBondContact N-ND2 3.46Å; G457-N484 VanDerWaalsContact N-ND2 3.14Å
458	T	85.7	Confident	83.8	Confident	30 Å²	30	49.5 Å²	49.5	18%	0.184	27%	0.272	C	S	.	.	S	Bend	trans	-123.7	155.2	-178.4	43.7	0	0	0	0	111.9	P480 V481 E482	T458-P480 WeakPolarHBondContact O-CB 3.35Å; T458-P480 WeakPolarHBondContact O-CG 3.46Å; T458-V481 PolarHBondContact OG1-N 2.74Å; T458-V481 VanDerWaalsContact OG1-N 3.1Å; T458-E482 HydrophobicContact CG2-CB 4.28Å; T458-E482 HydrophobicContact CG2-CG 4.08Å; T458-E482 PolarHBondContact OG1-N 3.35Å
459	P	89.5	Confident	82.9	Confident	39 Å²	39	45.1 Å²	45.1	25%	0.253	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-72.3	157.4	175.9	29.2	-34.4	0	0	0	111.3	Q461	P459-Q461 PolarHBondContact O-N 2.8Å; P459-Q461 PolarHBondContact O-NE2 3.11Å
460	P	88	Confident	82.1	Confident	6 Å²	6	46.8 Å²	46.8	4%	0.039	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-54.1	134.5	170.2	-25.3	36.1	0	0	0	111.5	W477 K478 P480 Y490 V530 A532	P460-W477 HydrophobicContact CB-CB 4.25Å; P460-W477 HydrophobicContact CB-CG 4.19Å; P460-K478 CarbonylContact C-O 3.53Å; P460-K478 VanDerWaalsContact CA-O 3.28Å; P460-K478 WeakPolarHBondContact CA-O 3.03Å; P460-K478 WeakPolarHBondContact CB-O 3Å; P460-P480 HydrophobicContact CG-CG 4.46Å; P460-Y490 HydrophobicContact CB-CE1 4.48Å; P460-Y490 HydrophobicContact CG-CD1 4.14Å; P460-Y490 HydrophobicContact CG-CE1 4.14Å; P460-V530 HydrophobicContact CB-CG1 3.88Å; P460-V530 HydrophobicContact CG-CG1 3.95Å; P460-V530 HydrophobicContact CG-CG2 4.44Å; P460-A532 HydrophobicContact CG-CB 4.31Å
461	Q	86.6	Confident	81.8	Confident	73 Å²	73	45.4 Å²	45.4	34%	0.341	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	154	-170.8	-62.6	-64.5	-58.2	0	0	111.5	P459 L463 W477 K478 V481	P459-Q461 PolarHBondContact O-N 2.8Å; P459-Q461 PolarHBondContact O-NE2 3.11Å; Q461-L463 PolarHBondContact O-N 2.8Å; Q461-W477 CarbonylContact O-C 3.52Å; Q461-K478 HydrophobicContact CB-CB 4.23Å; Q461-K478 PolarHBondContact N-O 3.16Å; Q461-K478 PolarHBondContact O-N 2.86Å; Q461-V481 HydrophobicContact CG-CG2 3.78Å
462	V	83.9	Confident	81.8	Confident	78 Å²	78	45.4 Å²	45.4	47%	0.473	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53.4	48.9	172.5	-159.4	0	0	0	0	112.9	Q464 K478	V462-Q464 HydrophobicContact CG1-CG 4.31Å; V462-Q464 PolarHBondContact O-N 2.94Å; V462-K478 HydrophobicContact CG2-CD 4.19Å
463	L	89.8	Confident	82.1	Confident	32 Å²	32	43 Å²	43	17%	0.168	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	122.6	172	178.5	62.8	0	0	0	110.1	Q461 V475 W477 I528 V530 S542 L545	Q461-L463 PolarHBondContact O-N 2.8Å; L463-V475 HydrophobicContact CD1-CG1 3.57Å; L463-W477 HydrophobicContact CD1-CB 4.39Å; L463-W477 HydrophobicContact CD1-CE3 4.12Å; L463-I528 HydrophobicContact CD2-CG2 4.47Å; L463-V530 HydrophobicContact CD1-CG1 3.93Å; L463-V530 HydrophobicContact CD2-CG1 4.27Å; L463-S542 WeakPolarHBondContact CD2-OG 3.23Å; L463-L545 HydrophobicContact CD2-CB 3.84Å; L463-L545 HydrophobicContact CD2-CD2 4.37Å; L463-L545 HydrophobicContact CG-CB 4.31Å; L463-L545 HydrophobicContact CG-CD2 3.95Å
464	Q	85	Confident	82.4	Confident	108 Å²	108	42 Å²	42	51%	0.505	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	150.2	178.4	-67.6	-179.3	-7.4	0	0	109.7	V462 V475 T476	V462-Q464 HydrophobicContact CG1-CG 4.31Å; V462-Q464 PolarHBondContact O-N 2.94Å; Q464-V475 WeakPolarHBondContact O-CA 3.26Å; Q464-V475 WeakPolarHBondContact O-CG1 3.3Å; Q464-T476 PolarHBondContact N-O 3.01Å; Q464-T476 PolarHBondContact O-N 2.83Å; Q464-T476 VanDerWaalsContact O-O 3.11Å
465	A	85.8	Confident	82.7	Confident	23 Å²	23	38.4 Å²	38.4	19%	0.19	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	140	176.2	0	0	0	0	0	110.2	V473 V474 V475 I528 L545 I547	A465-V473 HydrophobicContact CB-CG1 3.83Å; A465-V474 CarbonylContact C-O 3.54Å; A465-V474 WeakPolarHBondContact CA-O 3.34Å; A465-V475 HydrophobicContact CB-CG1 4.44Å; A465-V475 HydrophobicContact CB-CG2 4.27Å; A465-I528 HydrophobicContact CB-CD1 4.31Å; A465-L545 HydrophobicContact CB-CD2 3.66Å; A465-I547 HydrophobicContact CB-CD1 3.54Å; A465-I547 HydrophobicContact CB-CG2 4.42Å
466	I	78.8	Confident	83	Confident	87 Å²	87	38.8 Å²	38.8	45%	0.446	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	126	-173.9	-56.2	178.3	0	0	0	107.3	D468 V473 V474 V553	I466-D468 PolarHBondContact O-N 3.41Å; I466-V473 CarbonylContact O-C 3.48Å; I466-V473 WeakPolarHBondContact O-CA 3.3Å; I466-V474 PolarHBondContact N-O 2.93Å; I466-V474 PolarHBondContact O-N 3.11Å; I466-V553 HydrophobicContact CG2-CG2 3.95Å
467	V	74	Confident	83.4	Confident	4 Å²	4	39.1 Å²	39.1	2%	0.024	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	115.9	178.9	-166.2	0	0	0	0	109.7	S469 V473 I547 V548 V549 T550 V553	V467-S469 VanDerWaalsContact CG1-O 3.24Å; V467-S469 WeakPolarHBondContact CG1-O 3.17Å; V467-V473 HydrophobicContact CG1-CG2 4.36Å; V467-V473 HydrophobicContact CG2-CG2 4.27Å; V467-I547 HydrophobicContact CG2-CD1 3.71Å; V467-I547 HydrophobicContact CG2-CG1 3.97Å; V467-V548 WeakPolarHBondContact CG2-O 3.36Å; V467-V549 HydrophobicContact CG1-CG1 4.42Å; V467-T550 VanDerWaalsContact CG1-O 3.31Å; V467-T550 WeakPolarHBondContact CG1-O 3.49Å; V467-V553 HydrophobicContact CB-CG2 4.09Å; V467-V553 WeakPolarHBondContact O-CB 3.22Å; V467-V553 WeakPolarHBondContact O-CG2 3.5Å; V467-V553 PolarHBondContact O-N 2.8Å; V467-V553 VanDerWaalsContact O-N 3.17Å
468	D	72.4	Confident	83.6	Confident	94 Å²	94	43.5 Å²	43.5	50%	0.503	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-37.8	-169.1	165.3	86.4	0	0	0	111.2	I466 S472 V474 H516	I466-D468 PolarHBondContact O-N 3.41Å; D468-S472 VanDerWaalsContact CB-OG 3.25Å; D468-S472 WeakPolarHBondContact CB-OG 3.39Å; D468-S472 PolarHBondContact N-O 2.58Å; D468-S472 PolarHBondContact OD2-OG 3.12Å; D468-V474 HydrophobicContact CB-CG2 3.94Å; D468-H516 IonicContact OD2-CD2 3.29Å; D468-H516 IonicContact OD2-CE1 2.65Å; D468-H516 IonicContact OD2-NE2 3.47Å; D468-H516 PolarHBondContact OD2-NE2 2.79Å
469	S	66.9	Low	83.7	Confident	25 Å²	25	44.5 Å²	44.5	18%	0.175	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	173.8	169.6	85.8	0	0	0	0	109.8	V467 D471 S472	V467-S469 VanDerWaalsContact CG1-O 3.24Å; V467-S469 WeakPolarHBondContact CG1-O 3.17Å; S469-D471 PolarHBondContact O-N 2.79Å; S469-D471 PolarHBondContact OG-N 2.77Å; S469-D471 PolarHBondContact OG-OD1 3.33Å; S469-S472 WeakPolarHBondContact CB-OG 3.18Å; S469-S472 PolarHBondContact N-O 3.33Å; S469-S472 PolarHBondContact N-OG 3.34Å; S469-S472 PolarHBondContact O-N 2.89Å; S469-S472 WeakPolarHBondContact OG-CB 3.45Å; S469-S472 PolarHBondContact OG-N 2.71Å; S469-S472 PolarHBondContact OG-OG 2.81Å
470	P	66.4	Low	83.5	Confident	46 Å²	46	43.2 Å²	43.2	30%	0.299	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-13.3	170.4	-22.3	34.4	0	0	0	115.2	P522 V549 P551	P470-P522 WeakPolarHBondContact O-CA 3.08Å; P470-P522 WeakPolarHBondContact O-CB 3.2Å; P470-P522 VanDerWaalsContact O-CG 3.31Å; P470-P522 WeakPolarHBondContact O-CG 3.16Å; P470-V549 VanDerWaalsContact O-CG1 3.3Å; P470-V549 WeakPolarHBondContact O-CG1 3.5Å; P470-P551 HydrophobicContact CB-CB 4.5Å; P470-P551 HydrophobicContact CG-CB 4.35Å
471	D	80.7	Confident	83.3	Confident	71 Å²	71	48.2 Å²	48.2	38%	0.38	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.4	7.2	178.7	79.9	-61.8	0	0	0	113.8	S469 T518 K519 L520	S469-D471 PolarHBondContact O-N 2.79Å; S469-D471 PolarHBondContact OG-N 2.77Å; S469-D471 PolarHBondContact OG-OD1 3.33Å; D471-T518 CarbonylContact O-C 3.46Å; D471-T518 WeakPolarHBondContact O-CA 3.43Å; D471-K519 PolarHBondContact O-N 2.63Å; D471-K519 PolarHBondContact OD2-N 3.06Å; D471-L520 WeakPolarHBondContact O-CB 3.31Å; D471-L520 PolarHBondContact O-N 2.86Å
472	S	83.2	Confident	83.2	Confident	3 Å²	3	49.5 Å²	49.5	2%	0.021	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	147.3	-176.8	80.8	0	0	0	0	114.3	D468 S469 L517	D468-S472 VanDerWaalsContact CB-OG 3.25Å; D468-S472 WeakPolarHBondContact CB-OG 3.39Å; D468-S472 PolarHBondContact N-O 2.58Å; D468-S472 PolarHBondContact OD2-OG 3.12Å; S469-S472 WeakPolarHBondContact CB-OG 3.18Å; S469-S472 PolarHBondContact N-O 3.33Å; S469-S472 PolarHBondContact N-OG 3.34Å; S469-S472 PolarHBondContact O-N 2.89Å; S469-S472 WeakPolarHBondContact OG-CB 3.45Å; S469-S472 PolarHBondContact OG-N 2.71Å; S469-S472 PolarHBondContact OG-OG 2.81Å; S472-L517 CarbonylContact C-O 3.52Å; S472-L517 WeakPolarHBondContact CA-O 3.37Å; S472-L517 VanDerWaalsContact CB-O 3.31Å; S472-L517 WeakPolarHBondContact CB-O 3.45Å
473	V	84.3	Confident	83.1	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	124.6	175	169.6	0	0	0	0	109.3	A465 I466 V467 V475 L517 L520 I547 V549	A465-V473 HydrophobicContact CB-CG1 3.83Å; I466-V473 CarbonylContact O-C 3.48Å; I466-V473 WeakPolarHBondContact O-CA 3.3Å; V467-V473 HydrophobicContact CG1-CG2 4.36Å; V467-V473 HydrophobicContact CG2-CG2 4.27Å; V473-V475 HydrophobicContact CG1-CG2 3.82Å; V473-L517 HydrophobicContact CB-CB 4.37Å; V473-L517 PolarHBondContact N-O 2.99Å; V473-L517 PolarHBondContact O-N 3.19Å; V473-L520 HydrophobicContact CB-CD1 3.79Å; V473-L520 HydrophobicContact CG2-CD1 3.6Å; V473-I547 HydrophobicContact CG1-CD1 3.96Å; V473-I547 HydrophobicContact CG2-CD1 4.25Å; V473-V549 HydrophobicContact CG2-CG2 3.93Å
474	V	89.6	Confident	82.8	Confident	20 Å²	20	48.3 Å²	48.3	12%	0.121	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	118.6	165.6	169.5	0	0	0	0	108.4	A465 I466 D468 T476 K514	A465-V474 CarbonylContact C-O 3.54Å; A465-V474 WeakPolarHBondContact CA-O 3.34Å; I466-V474 PolarHBondContact N-O 2.93Å; I466-V474 PolarHBondContact O-N 3.11Å; D468-V474 HydrophobicContact CB-CG2 3.94Å; V474-T476 HydrophobicContact CG1-CG2 4.23Å; V474-K514 HydrophobicContact CG1-CD 4.45Å; V474-K514 VanDerWaalsContact CG1-CE 3.43Å; V474-K514 HydrophobicContact CG1-CG 4.39Å
475	V	91	Very high	82.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	137.9	173.1	-166.6	0	0	0	0	109	L463 Q464 A465 V473 W477 L492 K514 Y515 L517 I528	L463-V475 HydrophobicContact CD1-CG1 3.57Å; Q464-V475 WeakPolarHBondContact O-CA 3.26Å; Q464-V475 WeakPolarHBondContact O-CG1 3.3Å; A465-V475 HydrophobicContact CB-CG1 4.44Å; A465-V475 HydrophobicContact CB-CG2 4.27Å; V473-V475 HydrophobicContact CG1-CG2 3.82Å; V475-W477 HydrophobicContact CB-CZ3 4.06Å; V475-W477 HydrophobicContact CG1-CE3 3.92Å; V475-W477 HydrophobicContact CG1-CZ3 3.8Å; V475-L492 HydrophobicContact CB-CD2 4.3Å; V475-L492 HydrophobicContact CG1-CD1 4.06Å; V475-L492 HydrophobicContact CG2-CD2 4.19Å; V475-K514 CarbonylContact O-C 3.54Å; V475-K514 VanDerWaalsContact O-CA 3.3Å; V475-K514 WeakPolarHBondContact O-CA 3.07Å; V475-Y515 PolarHBondContact N-O 2.96Å; V475-Y515 PolarHBondContact O-N 3.26Å; V475-L517 HydrophobicContact CG2-CD1 3.75Å; V475-L517 HydrophobicContact CG2-CG 4.2Å; V475-I528 HydrophobicContact CG1-CG2 4.3Å; V475-I528 HydrophobicContact CG2-CD1 3.88Å
476	T	92.2	Very high	82.6	Confident	36 Å²	36	51.5 Å²	51.5	22%	0.221	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	147.6	179.8	47.9	0	0	0	0	111	Q464 V474 E513 K514	Q464-T476 PolarHBondContact N-O 3.01Å; Q464-T476 PolarHBondContact O-N 2.83Å; Q464-T476 VanDerWaalsContact O-O 3.11Å; V474-T476 HydrophobicContact CG1-CG2 4.23Å; T476-E513 WeakPolarHBondContact CA-O 3.47Å; T476-K514 HydrophobicContact CG2-CB 4.1Å; T476-K514 HydrophobicContact CG2-CD 4.18Å; T476-K514 HydrophobicContact CG2-CG 3.81Å
477	W	93.5	Very high	83	Confident	10 Å²	10	49.4 Å²	49.4	4%	0.038	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	-173.1	175.1	52.6	90.3	0	0	0	109.8	P460 Q461 L463 V475 Y490 L492 T510 Q512 E513 V530	P460-W477 HydrophobicContact CB-CB 4.25Å; P460-W477 HydrophobicContact CB-CG 4.19Å; Q461-W477 CarbonylContact O-C 3.52Å; L463-W477 HydrophobicContact CD1-CB 4.39Å; L463-W477 HydrophobicContact CD1-CE3 4.12Å; V475-W477 HydrophobicContact CB-CZ3 4.06Å; V475-W477 HydrophobicContact CG1-CE3 3.92Å; V475-W477 HydrophobicContact CG1-CZ3 3.8Å; W477-Y490 AromaticContact CD1-CE1 3.8Å; W477-Y490 AromaticContact CE2-CG 3.84Å; W477-Y490 HydrophobicContact CZ2-CD1 4.43Å; W477-Y490 HydrophobicContact CZ2-CD2 4.02Å; W477-Y490 AromaticContact CZ2-CG 3.8Å; W477-Y490 HydrophobicContact CZ2-CG 3.8Å; W477-Y490 AromaticContact NE1-CD1 3.23Å; W477-Y490 AromaticContact NE1-CD2 3.52Å; W477-Y490 AromaticContact NE1-CE1 3.33Å; W477-Y490 VanDerWaalsContact NE1-CE1 3.33Å; W477-Y490 AromaticContact NE1-CE2 3.63Å; W477-Y490 AromaticContact NE1-CG 3.34Å; W477-Y490 VanDerWaalsContact NE1-CG 3.34Å; W477-Y490 AromaticContact NE1-CZ 3.55Å; W477-L492 HydrophobicContact CZ3-CD1 4.04Å; W477-L492 HydrophobicContact CZ3-CD2 4.36Å; W477-T510 HydrophobicContact CH2-CG2 3.75Å; W477-T510 HydrophobicContact CZ2-CG2 3.61Å; W477-Q512 WeakPolarHBondContact CZ2-O 3.46Å; W477-E513 PolarHBondContact N-O 2.95Å; W477-V530 HydrophobicContact CD2-CG1 4.38Å; W477-V530 HydrophobicContact CD2-CG2 4.07Å; W477-V530 HydrophobicContact CE3-CG2 4.28Å; W477-V530 HydrophobicContact CG-CG1 4.37Å; W477-V530 HydrophobicContact CH2-CG2 4.28Å; W477-V530 HydrophobicContact CZ2-CG2 4.07Å; W477-V530 HydrophobicContact CZ3-CG2 4.38Å
478	K	88	Confident	83.6	Confident	128 Å²	128	52.6 Å²	52.6	56%	0.557	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.8	156.6	166.4	-63.8	-176.9	178.5	-175.4	0	109.4	P460 Q461 V462	P460-K478 CarbonylContact C-O 3.53Å; P460-K478 VanDerWaalsContact CA-O 3.28Å; P460-K478 WeakPolarHBondContact CA-O 3.03Å; P460-K478 WeakPolarHBondContact CB-O 3Å; Q461-K478 HydrophobicContact CB-CB 4.23Å; Q461-K478 PolarHBondContact N-O 3.16Å; Q461-K478 PolarHBondContact O-N 2.86Å; V462-K478 HydrophobicContact CG2-CD 4.19Å
479	S	87.6	Confident	84.5	Confident	52 Å²	52	48.2 Å²	48.2	36%	0.364	26%	0.257	S	S	.	.			trans	-49.8	151.3	173.7	-66.2	0	0	0	0	112.9	Y490 E513	S479-Y490 WeakPolarHBondContact CA-OH 3.38Å; S479-Y490 PolarHBondContact OG-OH 3.41Å; S479-E513 WeakPolarHBondContact CB-OE1 3.41Å; S479-E513 PolarHBondContact N-OE1 3.4Å; S479-E513 PolarHBondContact OG-OE1 2.81Å
480	P	85.9	Confident	85.8	Confident	11 Å²	11	47.3 Å²	47.3	7%	0.071	25%	0.25	C	S	.	.			trans	-48.9	152	165.9	-30.7	37.9	0	0	0	113.5	P456 T458 P460 E482 A532	P456-P480 HydrophobicContact CB-CG 4.26Å; T458-P480 WeakPolarHBondContact O-CB 3.35Å; T458-P480 WeakPolarHBondContact O-CG 3.46Å; P460-P480 HydrophobicContact CG-CG 4.46Å; P480-E482 VanDerWaalsContact C-N 3.31Å; P480-A532 HydrophobicContact CG-CB 3.62Å
481	V	83.6	Confident	87	Confident	112 Å²	112	46.2 Å²	46.2	68%	0.679	24%	0.241	S	C	*	.	S	Bend	trans	-71.7	-33.6	170.4	-176.3	0	0	0	0	110.5	T458 Q461	T458-V481 PolarHBondContact OG1-N 2.74Å; T458-V481 VanDerWaalsContact OG1-N 3.1Å; Q461-V481 HydrophobicContact CG-CG2 3.78Å
482	E	84.3	Confident	87.6	Confident	100 Å²	100	42.9 Å²	42.9	47%	0.467	22%	0.223	S	C	.	.			trans	-116.3	89.6	179.8	-64	176	-176	0	0	108.8	P456 G457 T458 P480	P456-E482 CarbonylContact C-O 3.59Å; P456-E482 WeakPolarHBondContact CA-O 2.98Å; G457-E482 WeakPolarHBondContact CA-OE2 3.37Å; G457-E482 PolarHBondContact N-O 2.82Å; T458-E482 HydrophobicContact CG2-CB 4.28Å; T458-E482 HydrophobicContact CG2-CG 4.08Å; T458-E482 PolarHBondContact OG1-N 3.35Å; P480-E482 VanDerWaalsContact C-N 3.31Å
483	S	82	Confident	88.1	Confident	53 Å²	53	43.6 Å²	43.6	37%	0.371	23%	0.225	S	C	.	.			trans	-77.3	-26	-178	56.4	0	0	0	0	113.9	G485 N534	S483-G485 PolarHBondContact O-N 2.89Å; S483-N534 PolarHBondContact O-ND2 2.91Å; S483-N534 VanDerWaalsContact O-ND2 3.13Å
484	N	83.6	Confident	88.5	Confident	32 Å²	32	45.7 Å²	45.7	17%	0.171	23%	0.233	C	C	.	.			trans	52.7	9.8	176.9	-65.4	-13.4	0	0	0	116.8	P423 L454 A455 G457	P423-N484 HydrophobicContact CB-CB 4.25Å; P423-N484 WeakPolarHBondContact CB-O 3.22Å; L454-N484 HydrophobicContact CB-CB 4.14Å; L454-N484 PolarHBondContact N-O 2.77Å; L454-N484 CarbonylContact O-C 3.59Å; L454-N484 WeakPolarHBondContact O-CB 3.45Å; L454-N484 VanDerWaalsContact O-O 3.06Å; A455-N484 WeakPolarHBondContact O-CB 3.06Å; A455-N484 PolarHBondContact O-ND2 3.4Å; G457-N484 PolarHBondContact N-ND2 3.46Å; G457-N484 VanDerWaalsContact N-ND2 3.14Å
485	G	82.9	Confident	88.6	Confident	8 Å²	8	45.4 Å²	45.4	8%	0.082	23%	0.232	C	C	.	.	S	Bend	trans	167.1	-176.5	-171.6	0	0	0	0	0	110.5	S483 I487	S483-G485 PolarHBondContact O-N 2.89Å; G485-I487 PolarHBondContact O-N 3Å
486	R	84	Confident	88.5	Confident	189 Å²	189	48.2 Å²	48.2	71%	0.713	25%	0.249	S	C	*	.			trans	-82	109.1	176.5	-175.3	-179.9	-175.9	177.3	3.1	109.5	F424 E453 T488 N534	F424-R486 HydrophobicContact CE1-CB 4.35Å; F424-R486 HydrophobicContact CZ-CB 4.47Å; E453-R486 PolarHBondContact OE1-N 2.88Å; R486-T488 WeakPolarHBondContact O-CG2 3.41Å; R486-T488 PolarHBondContact O-N 3.47Å; R486-N534 VanDerWaalsContact O-CB 3.24Å; R486-N534 WeakPolarHBondContact O-CB 3.17Å
487	I	86.3	Confident	88.2	Confident	44 Å²	44	53.9 Å²	53.9	23%	0.226	27%	0.266	C	S	.	.			trans	-54.5	118	174.3	-54	-52.1	0	0	0	109.5	P456 G485 G489 Y490 A532 F533	P456-I487 HydrophobicContact CB-CD1 4.28Å; P456-I487 HydrophobicContact CG-CD1 3.67Å; G485-I487 PolarHBondContact O-N 3Å; I487-G489 WeakPolarHBondContact CG2-O 3.26Å; I487-Y490 HydrophobicContact CG2-CE1 4.41Å; I487-Y490 HydrophobicContact CG2-CE2 4.39Å; I487-A532 HydrophobicContact CD1-CB 4.09Å; I487-A532 HydrophobicContact CG2-CB 4.15Å; I487-F533 CarbonylContact C-O 3.56Å; I487-F533 WeakPolarHBondContact CA-O 3.05Å
488	T	87.9	Confident	87.8	Confident	70 Å²	70	54.7 Å²	54.7	43%	0.429	27%	0.273	S	S	.	.			trans	-96.6	-16.6	179.7	54	0	0	0	0	111.9	R486 F533 N534	R486-T488 WeakPolarHBondContact O-CG2 3.41Å; R486-T488 PolarHBondContact O-N 3.47Å; T488-F533 PolarHBondContact N-O 3.36Å; T488-F533 WeakPolarHBondContact OG1-CD2 3.38Å; T488-F533 VanDerWaalsContact OG1-CE2 3.27Å; T488-F533 WeakPolarHBondContact OG1-CE2 3.2Å; T488-F533 PolarHBondContact OG1-O 2.72Å; T488-N534 WeakPolarHBondContact OG1-CA 2.97Å; T488-N534 PolarHBondContact OG1-O 3.12Å
489	G	90.2	Very high	87.5	Confident	2 Å²	2	56.3 Å²	56.3	2%	0.021	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.8	-167.2	166.9	0	0	0	0	0	113.9	I487 T510 A532 F533	I487-G489 WeakPolarHBondContact CG2-O 3.26Å; G489-T510 CarbonylContact C-O 3.56Å; G489-T510 WeakPolarHBondContact CA-O 2.98Å; G489-A532 WeakPolarHBondContact O-CA 3.43Å; G489-F533 VanDerWaalsContact C-CD1 3.49Å; G489-F533 PolarHBondContact N-O 3.11Å; G489-F533 WeakPolarHBondContact O-CD1 3.39Å; G489-F533 PolarHBondContact O-N 2.94Å
490	Y	93.9	Very high	87.3	Confident	7 Å²	7	56.4 Å²	56.4	3%	0.027	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	145.4	178.2	-60	-82.5	0	0	0	110.7	P460 W477 S479 I487 R509 T510 E513 V530 N531 A532	P460-Y490 HydrophobicContact CB-CE1 4.48Å; P460-Y490 HydrophobicContact CG-CD1 4.14Å; P460-Y490 HydrophobicContact CG-CE1 4.14Å; W477-Y490 AromaticContact CD1-CE1 3.8Å; W477-Y490 AromaticContact CE2-CG 3.84Å; W477-Y490 HydrophobicContact CZ2-CD1 4.43Å; W477-Y490 HydrophobicContact CZ2-CD2 4.02Å; W477-Y490 AromaticContact CZ2-CG 3.8Å; W477-Y490 HydrophobicContact CZ2-CG 3.8Å; W477-Y490 AromaticContact NE1-CD1 3.23Å; W477-Y490 AromaticContact NE1-CD2 3.52Å; W477-Y490 AromaticContact NE1-CE1 3.33Å; W477-Y490 VanDerWaalsContact NE1-CE1 3.33Å; W477-Y490 AromaticContact NE1-CE2 3.63Å; W477-Y490 AromaticContact NE1-CG 3.34Å; W477-Y490 VanDerWaalsContact NE1-CG 3.34Å; W477-Y490 AromaticContact NE1-CZ 3.55Å; S479-Y490 WeakPolarHBondContact CA-OH 3.38Å; S479-Y490 PolarHBondContact OG-OH 3.41Å; I487-Y490 HydrophobicContact CG2-CE1 4.41Å; I487-Y490 HydrophobicContact CG2-CE2 4.39Å; Y490-R509 WeakPolarHBondContact O-CA 3.32Å; Y490-T510 PolarHBondContact N-O 2.93Å; Y490-T510 PolarHBondContact O-N 3.21Å; Y490-T510 VanDerWaalsContact O-N 3.13Å; Y490-E513 HydrophobicContact CE2-CG 4.2Å; Y490-V530 HydrophobicContact CD1-CG2 4.46Å; Y490-N531 CarbonylContact C-O 3.44Å; Y490-N531 VanDerWaalsContact CA-O 3.22Å; Y490-N531 WeakPolarHBondContact CA-O 3.39Å; Y490-A532 HydrophobicContact CD1-CB 3.78Å; Y490-A532 HydrophobicContact CE1-CB 3.65Å
491	K	92.5	Very high	87.1	Confident	23 Å²	23	59.8 Å²	59.8	10%	0.1	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	122.8	166.6	-58.4	164.5	177	174.5	0	108.5	Y493 I507 A508 R509 V530 N531 F533 D538	K491-Y493 HydrophobicContact CB-CD2 4.36Å; K491-Y493 HydrophobicContact CB-CE2 3.68Å; K491-I507 HydrophobicContact CB-CG2 4.05Å; K491-I507 HydrophobicContact CG-CG2 4.44Å; K491-A508 WeakPolarHBondContact CA-O 2.9Å; K491-R509 HydrophobicContact CG-CG 4.33Å; K491-V530 WeakPolarHBondContact O-CA 3.1Å; K491-V530 WeakPolarHBondContact O-CG2 3.43Å; K491-N531 WeakPolarHBondContact CB-OD1 3.26Å; K491-N531 PolarHBondContact N-O 2.84Å; K491-N531 PolarHBondContact O-N 3.1Å; K491-F533 HydrophobicContact CD-CD1 4.32Å; K491-F533 HydrophobicContact CG-CD1 3.88Å; K491-F533 HydrophobicContact CG-CE1 3.92Å; K491-D538 VanDerWaalsContact CE-OD1 3.27Å; K491-D538 WeakPolarHBondContact CE-OD1 3.01Å; K491-D538 IonicContact NZ-OD1 3.14Å; K491-D538 PolarHBondContact NZ-OD1 3.46Å; K491-D538 IonicContact NZ-OD2 2.68Å; K491-D538 PolarHBondContact NZ-OD2 3.43Å
492	L	93.1	Very high	87	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	108.6	179.1	179.2	69.4	0	0	0	108.2	V475 W477 I507 A508 Y515 L517 I528 V530	V475-L492 HydrophobicContact CB-CD2 4.3Å; V475-L492 HydrophobicContact CG1-CD1 4.06Å; V475-L492 HydrophobicContact CG2-CD2 4.19Å; W477-L492 HydrophobicContact CZ3-CD1 4.04Å; W477-L492 HydrophobicContact CZ3-CD2 4.36Å; L492-I507 WeakPolarHBondContact O-CA 3.12Å; L492-A508 HydrophobicContact CB-CB 4.2Å; L492-A508 HydrophobicContact CD2-CB 4.47Å; L492-A508 PolarHBondContact N-O 2.85Å; L492-A508 PolarHBondContact O-N 3.4Å; L492-Y515 HydrophobicContact CD2-CD1 3.77Å; L492-Y515 HydrophobicContact CD2-CG 4.08Å; L492-L517 HydrophobicContact CD2-CD1 4.28Å; L492-L517 HydrophobicContact CD2-CD2 3.98Å; L492-L517 HydrophobicContact CD2-CG 4.09Å; L492-I528 HydrophobicContact CD1-CG2 3.46Å; L492-I528 VanDerWaalsContact CD1-CG2 3.46Å; L492-I528 HydrophobicContact CG-CG2 4.43Å; L492-V530 HydrophobicContact CD1-CB 4.09Å; L492-V530 HydrophobicContact CD1-CG2 4.37Å
493	Y	93.4	Very high	86.9	Confident	18 Å²	18	59.3 Å²	59.3	7%	0.071	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	131	178.8	-62.3	-101.6	0	0	0	109.2	K491 L502 W505 L506 I507 I528 K529 V541	K491-Y493 HydrophobicContact CB-CD2 4.36Å; K491-Y493 HydrophobicContact CB-CE2 3.68Å; Y493-L502 HydrophobicContact CD1-CD1 3.69Å; Y493-L502 HydrophobicContact CD1-CD2 4.43Å; Y493-L502 HydrophobicContact CD1-CG 3.77Å; Y493-L502 HydrophobicContact CE1-CD1 4.31Å; Y493-L502 HydrophobicContact CE1-CD2 4.25Å; Y493-L502 HydrophobicContact CE1-CG 3.91Å; Y493-L502 HydrophobicContact CG-CD1 3.8Å; Y493-L502 HydrophobicContact CG-CG 4.31Å; Y493-W505 HydrophobicContact CD1-CB 4.41Å; Y493-L506 CarbonylContact C-O 3.55Å; Y493-L506 VanDerWaalsContact CA-O 3.32Å; Y493-L506 WeakPolarHBondContact CA-O 3.39Å; Y493-I507 HydrophobicContact CD1-CD1 4.09Å; Y493-I507 HydrophobicContact CD1-CG1 3.81Å; Y493-I507 HydrophobicContact CE1-CD1 3.58Å; Y493-I507 HydrophobicContact CE1-CG1 3.84Å; Y493-I528 WeakPolarHBondContact O-CA 3.36Å; Y493-K529 PolarHBondContact N-O 3.44Å; Y493-K529 PolarHBondContact O-N 3.44Å; Y493-V541 HydrophobicContact CD2-CG1 4.24Å; Y493-V541 HydrophobicContact CE2-CG1 4.15Å
494	Y	92.9	Very high	87.1	Confident	44 Å²	44	60 Å²	60	17%	0.173	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	139.8	177.3	62.6	-74.6	0	0	0	112.4	L506 A508 L517 L520 Y526 Y527	Y494-L506 HydrophobicContact CD1-CB 3.99Å; Y494-L506 WeakPolarHBondContact CD1-O 3.22Å; Y494-L506 HydrophobicContact CD2-CB 4.06Å; Y494-L506 HydrophobicContact CD2-CD1 4.1Å; Y494-L506 HydrophobicContact CE1-CB 3.63Å; Y494-L506 HydrophobicContact CE2-CB 3.72Å; Y494-L506 HydrophobicContact CE2-CD1 3.52Å; Y494-L506 HydrophobicContact CE2-CG 4.27Å; Y494-L506 HydrophobicContact CG-CB 4.18Å; Y494-L506 VanDerWaalsContact CZ-CB 3.47Å; Y494-L506 PolarHBondContact N-O 3.43Å; Y494-L506 WeakPolarHBondContact O-CB 3.46Å; Y494-L506 PolarHBondContact O-N 3.28Å; Y494-A508 HydrophobicContact CE1-CB 4.12Å; Y494-L517 HydrophobicContact CD1-CD2 3.76Å; Y494-L517 HydrophobicContact CD2-CD2 4.26Å; Y494-L517 HydrophobicContact CE1-CD2 3.64Å; Y494-L517 HydrophobicContact CE2-CD2 4.13Å; Y494-L517 HydrophobicContact CG-CD1 4.35Å; Y494-L517 HydrophobicContact CG-CD2 4.1Å; Y494-L520 HydrophobicContact CD2-CD2 4.23Å; Y494-L520 HydrophobicContact CE2-CD2 4.11Å; Y494-Y526 AromaticContact CD2-CD1 3.99Å; Y494-Y526 HydrophobicContact CD2-CD1 3.99Å; Y494-Y526 HydrophobicContact CD2-CE1 4.06Å; Y494-Y527 VanDerWaalsContact CA-O 3.3Å; Y494-Y527 WeakPolarHBondContact CA-O 3.45Å
495	T	92.4	Very high	87.4	Confident	14 Å²	14	58.9 Å²	58.9	9%	0.086	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	157.3	-179.9	-172.5	0	0	0	0	111.4	R497 W505 Y526 Y527	T495-R497 WeakPolarHBondContact CG2-O 3.16Å; T495-R497 PolarHBondContact OG1-N 2.92Å; T495-R497 PolarHBondContact OG1-O 3.3Å; T495-R497 VanDerWaalsContact OG1-O 3.09Å; T495-W505 HydrophobicContact CG2-CD2 3.39Å; T495-W505 HydrophobicContact CG2-CE3 3.74Å; T495-W505 HydrophobicContact CG2-CG 3.84Å; T495-W505 HydrophobicContact CG2-CH2 3.96Å; T495-W505 HydrophobicContact CG2-CZ2 3.66Å; T495-W505 HydrophobicContact CG2-CZ3 4Å; T495-Y526 CarbonylContact O-C 3.36Å; T495-Y526 VanDerWaalsContact O-CA 3.28Å; T495-Y526 WeakPolarHBondContact O-CA 3.11Å; T495-Y527 PolarHBondContact N-O 3.28Å; T495-Y527 VanDerWaalsContact N-O 3.13Å; T495-Y527 PolarHBondContact O-N 3.33Å
496	T	88.5	Confident	87.8	Confident	60 Å²	60	63.2 Å²	63.2	37%	0.368	32%	0.319	S	S	.	.	S	Bend	trans	-93.7	-5.4	163.7	54.9	0	0	0	0	113.3	A524 T525 Y526	T496-A524 HydrophobicContact CG2-CB 4.06Å; T496-T525 WeakPolarHBondContact CA-O 3.06Å; T496-Y526 HydrophobicContact CG2-CD1 3.88Å; T496-Y526 HydrophobicContact CG2-CD2 4Å; T496-Y526 HydrophobicContact CG2-CE1 3.63Å; T496-Y526 HydrophobicContact CG2-CE2 3.78Å; T496-Y526 HydrophobicContact CG2-CG 4.08Å
497	R	86.1	Confident	88.1	Confident	154 Å²	154	58 Å²	58	58%	0.581	30%	0.304	S	S	*	.			trans	-122.7	94.6	178.6	-76.5	-177.9	-87.3	144.7	-13.1	110	T495 E499 D500	T495-R497 WeakPolarHBondContact CG2-O 3.16Å; T495-R497 PolarHBondContact OG1-N 2.92Å; T495-R497 PolarHBondContact OG1-O 3.3Å; T495-R497 VanDerWaalsContact OG1-O 3.09Å; R497-E499 VanDerWaalsContact C-N 3.28Å; R497-E499 PolarHBondContact O-N 2.92Å; R497-D500 HydrophobicContact CB-CB 4.48Å; R497-D500 WeakPolarHBondContact CB-OD2 3.14Å; R497-D500 VanDerWaalsContact CD-OD2 3.29Å; R497-D500 WeakPolarHBondContact CD-OD2 3.38Å; R497-D500 IonicContact CZ-OD2 3.45Å; R497-D500 VanDerWaalsContact CZ-OD2 3.29Å; R497-D500 IonicContact NE-OD2 2.66Å; R497-D500 PolarHBondContact NE-OD2 3.4Å; R497-D500 IonicContact NH1-OD1 2.65Å; R497-D500 IonicContact NH1-OD2 3.78Å; R497-D500 PolarHBondContact NH1-OD2 2.83Å; R497-D500 PolarHBondContact O-N 3Å
498	P	84.7	Confident	88.2	Confident	27 Å²	27	56.2 Å²	56.2	18%	0.175	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-21.8	-176.3	28.8	-36.5	0	0	0	113.7	D500 Y527	P498-D500 VanDerWaalsContact C-N 3.34Å; P498-Y527 HydrophobicContact CB-CD1 4.01Å; P498-Y527 HydrophobicContact CB-CD2 3.81Å; P498-Y527 HydrophobicContact CB-CE1 4.22Å; P498-Y527 HydrophobicContact CB-CE2 4.05Å; P498-Y527 HydrophobicContact CB-CG 3.78Å; P498-Y527 VanDerWaalsContact CD-CE2 3.45Å; P498-Y527 HydrophobicContact CG-CD1 4.37Å; P498-Y527 HydrophobicContact CG-CD2 3.8Å; P498-Y527 HydrophobicContact CG-CE1 4.11Å; P498-Y527 HydrophobicContact CG-CE2 3.52Å; P498-Y527 HydrophobicContact CG-CG 4.2Å
499	E	81.8	Confident	88.3	Confident	162 Å²	162	60.5 Å²	60.5	76%	0.757	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-20.9	176.9	25.3	-74.9	147.5	0	0	113.7	R497	R497-E499 VanDerWaalsContact C-N 3.28Å; R497-E499 PolarHBondContact O-N 2.92Å
500	D	83.6	Confident	88.3	Confident	54 Å²	54	61.5 Å²	61.5	29%	0.289	31%	0.31	S	S	.	.	S	Bend	trans	-71.5	143.6	174.6	-67.2	-41.7	0	0	0	110.5	R497 P498 S504 W505	R497-D500 HydrophobicContact CB-CB 4.48Å; R497-D500 WeakPolarHBondContact CB-OD2 3.14Å; R497-D500 VanDerWaalsContact CD-OD2 3.29Å; R497-D500 WeakPolarHBondContact CD-OD2 3.38Å; R497-D500 IonicContact CZ-OD2 3.45Å; R497-D500 VanDerWaalsContact CZ-OD2 3.29Å; R497-D500 IonicContact NE-OD2 2.66Å; R497-D500 PolarHBondContact NE-OD2 3.4Å; R497-D500 IonicContact NH1-OD1 2.65Å; R497-D500 IonicContact NH1-OD2 3.78Å; R497-D500 PolarHBondContact NH1-OD2 2.83Å; R497-D500 PolarHBondContact O-N 3Å; P498-D500 VanDerWaalsContact C-N 3.34Å; D500-S504 WeakPolarHBondContact CB-OG 3.39Å; D500-W505 PolarHBondContact O-NE1 2.79Å
501	S	81.2	Confident	87.9	Confident	82 Å²	82	66.6 Å²	66.6	57%	0.573	34%	0.342	S	S	*	.			trans	-59.1	148.6	-177	73.1	0	0	0	0	113	N503 S504 W505	S501-N503 PolarHBondContact O-N 2.84Å; S501-S504 WeakPolarHBondContact O-CB 3.33Å; S501-S504 PolarHBondContact O-N 2.92Å; S501-S504 PolarHBondContact O-OG 3.15Å; S501-W505 VanDerWaalsContact O-CD1 3.28Å
502	L	82.4	Confident	87.6	Confident	52 Å²	52	71.6 Å²	71.6	27%	0.272	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-53	-30.8	-176.5	-171.2	70.4	0	0	0	113.7	Y493 S504 W505 K529 V541	Y493-L502 HydrophobicContact CD1-CD1 3.69Å; Y493-L502 HydrophobicContact CD1-CD2 4.43Å; Y493-L502 HydrophobicContact CD1-CG 3.77Å; Y493-L502 HydrophobicContact CE1-CD1 4.31Å; Y493-L502 HydrophobicContact CE1-CD2 4.25Å; Y493-L502 HydrophobicContact CE1-CG 3.91Å; Y493-L502 HydrophobicContact CG-CD1 3.8Å; Y493-L502 HydrophobicContact CG-CG 4.31Å; L502-S504 PolarHBondContact O-N 2.93Å; L502-W505 HydrophobicContact CD1-CD2 3.97Å; L502-W505 HydrophobicContact CD1-CE3 4.08Å; L502-W505 HydrophobicContact CD1-CG 4.29Å; L502-W505 PolarHBondContact O-N 2.68Å; L502-K529 HydrophobicContact CD1-CD 4.12Å; L502-V541 HydrophobicContact CD2-CG1 4.04Å; L502-V541 HydrophobicContact CD2-CG2 4.34Å
503	N	81.2	Confident	87.3	Confident	151 Å²	151	75.7 Å²	75.7	81%	0.807	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-65.9	-12.1	177.1	-66.8	-12.6	0	0	0	114.4	S501	S501-N503 PolarHBondContact O-N 2.84Å
504	S	86	Confident	87.2	Confident	67 Å²	67	80 Å²	80	47%	0.469	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-106.4	-7.6	177.9	68.9	0	0	0	0	113.9	D500 S501 L502	D500-S504 WeakPolarHBondContact CB-OG 3.39Å; S501-S504 WeakPolarHBondContact O-CB 3.33Å; S501-S504 PolarHBondContact O-N 2.92Å; S501-S504 PolarHBondContact O-OG 3.15Å; L502-S504 PolarHBondContact O-N 2.93Å
505	W	90.9	Very high	87.1	Confident	9 Å²	9	81.7 Å²	81.7	3%	0.034	41%	0.41	C	S	.	.	S	Bend	trans	-69.2	148.8	174.5	-65.2	27.1	0	0	0	109.1	Y493 T495 D500 S501 L502 I507 Y527 K529 Q544	Y493-W505 HydrophobicContact CD1-CB 4.41Å; T495-W505 HydrophobicContact CG2-CD2 3.39Å; T495-W505 HydrophobicContact CG2-CE3 3.74Å; T495-W505 HydrophobicContact CG2-CG 3.84Å; T495-W505 HydrophobicContact CG2-CH2 3.96Å; T495-W505 HydrophobicContact CG2-CZ2 3.66Å; T495-W505 HydrophobicContact CG2-CZ3 4Å; D500-W505 PolarHBondContact O-NE1 2.79Å; S501-W505 VanDerWaalsContact O-CD1 3.28Å; L502-W505 HydrophobicContact CD1-CD2 3.97Å; L502-W505 HydrophobicContact CD1-CE3 4.08Å; L502-W505 HydrophobicContact CD1-CG 4.29Å; L502-W505 PolarHBondContact O-N 2.68Å; W505-I507 WeakPolarHBondContact O-CG1 3.46Å; W505-Y527 VanDerWaalsContact CZ3-O 3.3Å; W505-Y527 WeakPolarHBondContact CZ3-O 3.35Å; W505-K529 HydrophobicContact CH2-CD 3.82Å; W505-K529 HydrophobicContact CH2-CG 4.26Å; W505-K529 HydrophobicContact CZ3-CB 4.29Å; W505-K529 HydrophobicContact CZ3-CD 3.79Å; W505-K529 HydrophobicContact CZ3-CG 3.88Å; W505-Q544 HydrophobicContact CH2-CG 4.41Å
506	L	90	Very high	87	Confident	99 Å²	99	85.2 Å²	85.2	52%	0.518	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	136.3	175.8	-61.7	171.9	0	0	0	109.5	Y493 Y494	Y493-L506 CarbonylContact C-O 3.55Å; Y493-L506 VanDerWaalsContact CA-O 3.32Å; Y493-L506 WeakPolarHBondContact CA-O 3.39Å; Y494-L506 HydrophobicContact CD1-CB 3.99Å; Y494-L506 WeakPolarHBondContact CD1-O 3.22Å; Y494-L506 HydrophobicContact CD2-CB 4.06Å; Y494-L506 HydrophobicContact CD2-CD1 4.1Å; Y494-L506 HydrophobicContact CE1-CB 3.63Å; Y494-L506 HydrophobicContact CE2-CB 3.72Å; Y494-L506 HydrophobicContact CE2-CD1 3.52Å; Y494-L506 HydrophobicContact CE2-CG 4.27Å; Y494-L506 HydrophobicContact CG-CB 4.18Å; Y494-L506 VanDerWaalsContact CZ-CB 3.47Å; Y494-L506 PolarHBondContact N-O 3.43Å; Y494-L506 WeakPolarHBondContact O-CB 3.46Å; Y494-L506 PolarHBondContact O-N 3.28Å
507	I	90.3	Very high	87	Confident	79 Å²	79	82.5 Å²	82.5	41%	0.405	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	114.4	-175.2	-49.5	-179.5	0	0	0	110.1	K491 L492 Y493 W505 R509	K491-I507 HydrophobicContact CB-CG2 4.05Å; K491-I507 HydrophobicContact CG-CG2 4.44Å; L492-I507 WeakPolarHBondContact O-CA 3.12Å; Y493-I507 HydrophobicContact CD1-CD1 4.09Å; Y493-I507 HydrophobicContact CD1-CG1 3.81Å; Y493-I507 HydrophobicContact CE1-CD1 3.58Å; Y493-I507 HydrophobicContact CE1-CG1 3.84Å; W505-I507 WeakPolarHBondContact O-CG1 3.46Å; I507-R509 HydrophobicContact CG2-CG 4.46Å
508	A	89.2	Confident	87	Confident	7 Å²	7	78.4 Å²	78.4	6%	0.058	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	149	162.4	0	0	0	0	0	110.2	K491 L492 Y494 Y515	K491-A508 WeakPolarHBondContact CA-O 2.9Å; L492-A508 HydrophobicContact CB-CB 4.2Å; L492-A508 HydrophobicContact CD2-CB 4.47Å; L492-A508 PolarHBondContact N-O 2.85Å; L492-A508 PolarHBondContact O-N 3.4Å; Y494-A508 HydrophobicContact CE1-CB 4.12Å; A508-Y515 HydrophobicContact CB-CD1 4.01Å; A508-Y515 HydrophobicContact CB-CE1 3.46Å; A508-Y515 VanDerWaalsContact CB-CE1 3.46Å; A508-Y515 HydrophobicContact CB-CE2 4.37Å
509	R	89.2	Confident	87	Confident	160 Å²	160	85.9 Å²	85.9	60%	0.604	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.8	140.6	174.8	-62.3	-169.2	-175.6	-154.5	5.3	110.3	Y490 K491 I507	Y490-R509 WeakPolarHBondContact O-CA 3.32Å; K491-R509 HydrophobicContact CG-CG 4.33Å; I507-R509 HydrophobicContact CG2-CG 4.46Å
510	T	90.1	Very high	87.1	Confident	22 Å²	22	78.5 Å²	78.5	14%	0.135	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	155.7	179.2	-177.5	0	0	0	0	111.4	W477 G489 Y490 Q512 Y515	W477-T510 HydrophobicContact CH2-CG2 3.75Å; W477-T510 HydrophobicContact CZ2-CG2 3.61Å; G489-T510 CarbonylContact C-O 3.56Å; G489-T510 WeakPolarHBondContact CA-O 2.98Å; Y490-T510 PolarHBondContact N-O 2.93Å; Y490-T510 PolarHBondContact O-N 3.21Å; Y490-T510 VanDerWaalsContact O-N 3.13Å; T510-Q512 WeakPolarHBondContact CG2-O 3.19Å; T510-Q512 PolarHBondContact OG1-N 2.98Å; T510-Q512 VanDerWaalsContact OG1-N 3.07Å; T510-Y515 HydrophobicContact CG2-CD2 4.11Å
511	T	86.8	Confident	86.9	Confident	115 Å²	115	80.7 Å²	80.7	71%	0.706	41%	0.407	S	S	*	.	S	Bend	trans	-97.6	-6.4	169.2	52.9	0	0	0	0	112.7
512	Q	85	Confident	86.4	Confident	127 Å²	127	80.2 Å²	80.2	59%	0.593	40%	0.402	S	S	*	.	S	Bend	trans	-99.1	153.3	-178.3	-58.6	-178.8	4.1	0	0	111	W477 T510 K514	W477-Q512 WeakPolarHBondContact CZ2-O 3.46Å; T510-Q512 WeakPolarHBondContact CG2-O 3.19Å; T510-Q512 PolarHBondContact OG1-N 2.98Å; T510-Q512 VanDerWaalsContact OG1-N 3.07Å; Q512-K514 PolarHBondContact O-N 3.22Å
513	E	88.8	Confident	85.7	Confident	87 Å²	87	83.3 Å²	83.3	41%	0.407	42%	0.419	S	S	.	.	S	Bend	trans	-74.8	17.7	173.1	-56.3	-172.1	130.7	0	0	113.5	T476 W477 S479 Y490	T476-E513 WeakPolarHBondContact CA-O 3.47Å; W477-E513 PolarHBondContact N-O 2.95Å; S479-E513 WeakPolarHBondContact CB-OE1 3.41Å; S479-E513 PolarHBondContact N-OE1 3.4Å; S479-E513 PolarHBondContact OG-OE1 2.81Å; Y490-E513 HydrophobicContact CE2-CG 4.2Å
514	K	90	Very high	85.6	Confident	108 Å²	108	77 Å²	77	47%	0.47	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	146.1	-178.1	-178.5	175.3	-178	-177.4	0	109.2	V474 V475 T476 Q512	V474-K514 HydrophobicContact CG1-CD 4.45Å; V474-K514 VanDerWaalsContact CG1-CE 3.43Å; V474-K514 HydrophobicContact CG1-CG 4.39Å; V475-K514 CarbonylContact O-C 3.54Å; V475-K514 VanDerWaalsContact O-CA 3.3Å; V475-K514 WeakPolarHBondContact O-CA 3.07Å; T476-K514 HydrophobicContact CG2-CB 4.1Å; T476-K514 HydrophobicContact CG2-CD 4.18Å; T476-K514 HydrophobicContact CG2-CG 3.81Å; Q512-K514 PolarHBondContact O-N 3.22Å
515	Y	91.6	Very high	85.6	Confident	79 Å²	79	76.3 Å²	76.3	31%	0.31	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	153.1	168.8	-160.8	-105.4	0	0	0	111.5	V475 L492 A508 T510 L517	V475-Y515 PolarHBondContact N-O 2.96Å; V475-Y515 PolarHBondContact O-N 3.26Å; L492-Y515 HydrophobicContact CD2-CD1 3.77Å; L492-Y515 HydrophobicContact CD2-CG 4.08Å; A508-Y515 HydrophobicContact CB-CD1 4.01Å; A508-Y515 HydrophobicContact CB-CE1 3.46Å; A508-Y515 VanDerWaalsContact CB-CE1 3.46Å; A508-Y515 HydrophobicContact CB-CE2 4.37Å; T510-Y515 HydrophobicContact CG2-CD2 4.11Å; Y515-L517 HydrophobicContact CD1-CD2 3.9Å; Y515-L517 HydrophobicContact CD1-CG 4.16Å; Y515-L517 HydrophobicContact CE1-CD2 3.96Å
516	H	90.1	Very high	85.5	Confident	88 Å²	88	76.6 Å²	76.6	41%	0.407	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	96.4	175.9	-170	-141	0	0	0	108	D468	D468-H516 IonicContact OD2-CD2 3.29Å; D468-H516 IonicContact OD2-CE1 2.65Å; D468-H516 IonicContact OD2-NE2 3.47Å; D468-H516 PolarHBondContact OD2-NE2 2.79Å
517	L	88.4	Confident	85.6	Confident	3 Å²	3	74.6 Å²	74.6	2%	0.016	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	133.8	168.9	-66.5	172.1	0	0	0	107.6	S472 V473 V475 L492 Y494 Y515 L520 I528	S472-L517 CarbonylContact C-O 3.52Å; S472-L517 WeakPolarHBondContact CA-O 3.37Å; S472-L517 VanDerWaalsContact CB-O 3.31Å; S472-L517 WeakPolarHBondContact CB-O 3.45Å; V473-L517 HydrophobicContact CB-CB 4.37Å; V473-L517 PolarHBondContact N-O 2.99Å; V473-L517 PolarHBondContact O-N 3.19Å; V475-L517 HydrophobicContact CG2-CD1 3.75Å; V475-L517 HydrophobicContact CG2-CG 4.2Å; L492-L517 HydrophobicContact CD2-CD1 4.28Å; L492-L517 HydrophobicContact CD2-CD2 3.98Å; L492-L517 HydrophobicContact CD2-CG 4.09Å; Y494-L517 HydrophobicContact CD1-CD2 3.76Å; Y494-L517 HydrophobicContact CD2-CD2 4.26Å; Y494-L517 HydrophobicContact CE1-CD2 3.64Å; Y494-L517 HydrophobicContact CE2-CD2 4.13Å; Y494-L517 HydrophobicContact CG-CD1 4.35Å; Y494-L517 HydrophobicContact CG-CD2 4.1Å; Y515-L517 HydrophobicContact CD1-CD2 3.9Å; Y515-L517 HydrophobicContact CD1-CG 4.16Å; Y515-L517 HydrophobicContact CE1-CD2 3.96Å; L517-L520 HydrophobicContact CB-CD1 3.83Å; L517-L520 HydrophobicContact CB-CD2 4.22Å; L517-L520 HydrophobicContact CB-CG 4.24Å; L517-I528 HydrophobicContact CD1-CD1 3.91Å
518	T	87	Confident	85.7	Confident	68 Å²	68	70.9 Å²	70.9	42%	0.417	35%	0.349	S	S	.	.			trans	-138.4	164.9	-179.6	50.6	0	0	0	0	109.4	D471 L520	D471-T518 CarbonylContact O-C 3.46Å; D471-T518 WeakPolarHBondContact O-CA 3.43Å; T518-L520 PolarHBondContact O-N 3.22Å
519	K	83.1	Confident	85.9	Confident	185 Å²	185	72.5 Å²	72.5	80%	0.804	36%	0.355	S	S	*	.	S	Bend	trans	60.4	30.5	-174.9	-47.4	176.7	-177	178	0	113.1	D471	D471-K519 PolarHBondContact O-N 2.63Å; D471-K519 PolarHBondContact OD2-N 3.06Å
520	L	84.3	Confident	86.1	Confident	7 Å²	7	64.9 Å²	64.9	4%	0.037	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-75.6	152.9	172.3	-57.8	177.6	0	0	0	110.1	D471 V473 Y494 L517 T518 P522 Y526 V549	D471-L520 WeakPolarHBondContact O-CB 3.31Å; D471-L520 PolarHBondContact O-N 2.86Å; V473-L520 HydrophobicContact CB-CD1 3.79Å; V473-L520 HydrophobicContact CG2-CD1 3.6Å; Y494-L520 HydrophobicContact CD2-CD2 4.23Å; Y494-L520 HydrophobicContact CE2-CD2 4.11Å; L517-L520 HydrophobicContact CB-CD1 3.83Å; L517-L520 HydrophobicContact CB-CD2 4.22Å; L517-L520 HydrophobicContact CB-CG 4.24Å; T518-L520 PolarHBondContact O-N 3.22Å; L520-P522 WeakPolarHBondContact O-CD 3.01Å; L520-Y526 HydrophobicContact CB-CE2 3.9Å; L520-Y526 HydrophobicContact CD2-CD1 4.17Å; L520-Y526 HydrophobicContact CD2-CE1 3.72Å; L520-Y526 HydrophobicContact CD2-CE2 4.19Å; L520-V549 HydrophobicContact CB-CG1 4.11Å; L520-V549 HydrophobicContact CB-CG2 4.02Å; L520-V549 HydrophobicContact CD1-CG2 3.73Å
521	I	79.5	Confident	86.3	Confident	100 Å²	100	64.1 Å²	64.1	51%	0.513	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-76.1	121.4	178.2	-61.4	170.6	0	0	0	109.1	A524 Y526	I521-A524 HydrophobicContact CB-CB 3.88Å; I521-A524 HydrophobicContact CG2-CB 3.97Å; I521-A524 WeakPolarHBondContact O-CB 3.13Å; I521-A524 PolarHBondContact O-N 2.82Å; I521-Y526 HydrophobicContact CB-CE2 4.41Å; I521-Y526 PolarHBondContact N-OH 2.79Å
522	P	71.4	Confident	86.6	Confident	71 Å²	71	58.7 Å²	58.7	46%	0.461	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	143.3	175.8	-19.1	29.4	0	0	0	111.7	P470 L520 A524	P470-P522 WeakPolarHBondContact O-CA 3.08Å; P470-P522 WeakPolarHBondContact O-CB 3.2Å; P470-P522 VanDerWaalsContact O-CG 3.31Å; P470-P522 WeakPolarHBondContact O-CG 3.16Å; L520-P522 WeakPolarHBondContact O-CD 3.01Å; P522-A524 PolarHBondContact O-N 3.18Å
523	N	67.5	Low	86.9	Confident	117 Å²	117	54.4 Å²	54.4	63%	0.626	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	8.4	-174	-64	-35.3	0	0	0	116.1	V549	N523-V549 WeakPolarHBondContact CA-O 3.01Å; N523-V549 PolarHBondContact N-O 2.89Å
524	A	79.6	Confident	87	Confident	19 Å²	19	50.7 Å²	50.7	16%	0.157	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-85.7	141.5	172.2	0	0	0	0	0	112	T496 I521 P522 Y526 V549	T496-A524 HydrophobicContact CG2-CB 4.06Å; I521-A524 HydrophobicContact CB-CB 3.88Å; I521-A524 HydrophobicContact CG2-CB 3.97Å; I521-A524 WeakPolarHBondContact O-CB 3.13Å; I521-A524 PolarHBondContact O-N 2.82Å; P522-A524 PolarHBondContact O-N 3.18Å; A524-Y526 HydrophobicContact CB-CD2 4.23Å; A524-Y526 HydrophobicContact CB-CE2 3.86Å; A524-Y526 PolarHBondContact O-N 3.35Å; A524-V549 PolarHBondContact O-N 2.83Å
525	T	84.2	Confident	86.7	Confident	52 Å²	52	49.3 Å²	49.3	32%	0.319	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	118.5	167	-49.7	0	0	0	0	109.4	T496 Y527 V548	T496-T525 WeakPolarHBondContact CA-O 3.06Å; T525-Y527 HydrophobicContact CG2-CD2 4.3Å; T525-Y527 HydrophobicContact CG2-CE1 4.37Å; T525-Y527 HydrophobicContact CG2-CE2 3.65Å; T525-V548 HydrophobicContact CG2-CG2 4.33Å
526	Y	90.4	Very high	86.2	Confident	15 Å²	15	48.1 Å²	48.1	6%	0.059	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	135	169.1	-78	-97.9	0	0	0	110.2	Y494 T495 T496 L520 I521 A524 I547 V549	Y494-Y526 AromaticContact CD2-CD1 3.99Å; Y494-Y526 HydrophobicContact CD2-CD1 3.99Å; Y494-Y526 HydrophobicContact CD2-CE1 4.06Å; T495-Y526 CarbonylContact O-C 3.36Å; T495-Y526 VanDerWaalsContact O-CA 3.28Å; T495-Y526 WeakPolarHBondContact O-CA 3.11Å; T496-Y526 HydrophobicContact CG2-CD1 3.88Å; T496-Y526 HydrophobicContact CG2-CD2 4Å; T496-Y526 HydrophobicContact CG2-CE1 3.63Å; T496-Y526 HydrophobicContact CG2-CE2 3.78Å; T496-Y526 HydrophobicContact CG2-CG 4.08Å; L520-Y526 HydrophobicContact CB-CE2 3.9Å; L520-Y526 HydrophobicContact CD2-CD1 4.17Å; L520-Y526 HydrophobicContact CD2-CE1 3.72Å; L520-Y526 HydrophobicContact CD2-CE2 4.19Å; I521-Y526 HydrophobicContact CB-CE2 4.41Å; I521-Y526 PolarHBondContact N-OH 2.79Å; A524-Y526 HydrophobicContact CB-CD2 4.23Å; A524-Y526 HydrophobicContact CB-CE2 3.86Å; A524-Y526 PolarHBondContact O-N 3.35Å; Y526-I547 PolarHBondContact N-O 2.72Å; Y526-I547 PolarHBondContact O-N 2.72Å; Y526-I547 VanDerWaalsContact O-O 3.12Å; Y526-V549 HydrophobicContact CD2-CB 4.46Å; Y526-V549 HydrophobicContact CD2-CG2 3.46Å; Y526-V549 VanDerWaalsContact CD2-CG2 3.46Å; Y526-V549 HydrophobicContact CE2-CG2 3.9Å; Y526-V549 HydrophobicContact CG-CG2 4.36Å
527	Y	91.6	Very high	86	Confident	57 Å²	57	45.2 Å²	45.2	22%	0.224	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	124.8	174.7	-62.6	-94.1	0	0	0	108.3	Y494 T495 P498 W505 T525 Q544 P546	Y494-Y527 VanDerWaalsContact CA-O 3.3Å; Y494-Y527 WeakPolarHBondContact CA-O 3.45Å; T495-Y527 PolarHBondContact N-O 3.28Å; T495-Y527 VanDerWaalsContact N-O 3.13Å; T495-Y527 PolarHBondContact O-N 3.33Å; P498-Y527 HydrophobicContact CB-CD1 4.01Å; P498-Y527 HydrophobicContact CB-CD2 3.81Å; P498-Y527 HydrophobicContact CB-CE1 4.22Å; P498-Y527 HydrophobicContact CB-CE2 4.05Å; P498-Y527 HydrophobicContact CB-CG 3.78Å; P498-Y527 VanDerWaalsContact CD-CE2 3.45Å; P498-Y527 HydrophobicContact CG-CD1 4.37Å; P498-Y527 HydrophobicContact CG-CD2 3.8Å; P498-Y527 HydrophobicContact CG-CE1 4.11Å; P498-Y527 HydrophobicContact CG-CE2 3.52Å; P498-Y527 HydrophobicContact CG-CG 4.2Å; W505-Y527 VanDerWaalsContact CZ3-O 3.3Å; W505-Y527 WeakPolarHBondContact CZ3-O 3.35Å; T525-Y527 HydrophobicContact CG2-CD2 4.3Å; T525-Y527 HydrophobicContact CG2-CE1 4.37Å; T525-Y527 HydrophobicContact CG2-CE2 3.65Å; Y527-Q544 HydrophobicContact CD1-CG 4.05Å; Y527-P546 HydrophobicContact CD1-CB 3.87Å; Y527-P546 HydrophobicContact CE1-CB 3.81Å
528	I	92.9	Very high	85.9	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	135.6	-170.9	-58.6	-177.3	0	0	0	110.1	L463 A465 V475 L492 Y493 L517 L545 I547	L463-I528 HydrophobicContact CD2-CG2 4.47Å; A465-I528 HydrophobicContact CB-CD1 4.31Å; V475-I528 HydrophobicContact CG1-CG2 4.3Å; V475-I528 HydrophobicContact CG2-CD1 3.88Å; L492-I528 HydrophobicContact CD1-CG2 3.46Å; L492-I528 VanDerWaalsContact CD1-CG2 3.46Å; L492-I528 HydrophobicContact CG-CG2 4.43Å; Y493-I528 WeakPolarHBondContact O-CA 3.36Å; L517-I528 HydrophobicContact CD1-CD1 3.91Å; I528-L545 HydrophobicContact CB-CB 4.48Å; I528-L545 PolarHBondContact N-O 2.93Å; I528-L545 PolarHBondContact O-N 2.81Å; I528-I547 HydrophobicContact CD1-CG2 3.55Å; I528-I547 HydrophobicContact CG1-CG2 4.16Å
529	K	93	Very high	85.9	Confident	41 Å²	41	45.8 Å²	45.8	18%	0.178	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	148.4	169.7	-70.8	172.7	-178.4	156.7	0	109.3	Y493 L502 W505 V541 S542 Q544	Y493-K529 PolarHBondContact N-O 3.44Å; Y493-K529 PolarHBondContact O-N 3.44Å; L502-K529 HydrophobicContact CD1-CD 4.12Å; W505-K529 HydrophobicContact CH2-CD 3.82Å; W505-K529 HydrophobicContact CH2-CG 4.26Å; W505-K529 HydrophobicContact CZ3-CB 4.29Å; W505-K529 HydrophobicContact CZ3-CD 3.79Å; W505-K529 HydrophobicContact CZ3-CG 3.88Å; K529-V541 HydrophobicContact CB-CB 4.41Å; K529-S542 WeakPolarHBondContact CA-OG 3.31Å; K529-Q544 HydrophobicContact CG-CB 4.46Å
530	V	93.8	Very high	86.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	141.8	176.2	67.4	0	0	0	0	110.9	P460 L463 W477 Y490 K491 L492 S542	P460-V530 HydrophobicContact CB-CG1 3.88Å; P460-V530 HydrophobicContact CG-CG1 3.95Å; P460-V530 HydrophobicContact CG-CG2 4.44Å; L463-V530 HydrophobicContact CD1-CG1 3.93Å; L463-V530 HydrophobicContact CD2-CG1 4.27Å; W477-V530 HydrophobicContact CD2-CG1 4.38Å; W477-V530 HydrophobicContact CD2-CG2 4.07Å; W477-V530 HydrophobicContact CE3-CG2 4.28Å; W477-V530 HydrophobicContact CG-CG1 4.37Å; W477-V530 HydrophobicContact CH2-CG2 4.28Å; W477-V530 HydrophobicContact CZ2-CG2 4.07Å; W477-V530 HydrophobicContact CZ3-CG2 4.38Å; Y490-V530 HydrophobicContact CD1-CG2 4.46Å; K491-V530 WeakPolarHBondContact O-CA 3.1Å; K491-V530 WeakPolarHBondContact O-CG2 3.43Å; L492-V530 HydrophobicContact CD1-CB 4.09Å; L492-V530 HydrophobicContact CD1-CG2 4.37Å; V530-S542 PolarHBondContact N-OG 3.22Å; V530-S542 PolarHBondContact O-N 3.38Å
531	N	93.8	Very high	86.4	Confident	6 Å²	6	41.7 Å²	41.7	3%	0.032	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	161.2	161.6	71.1	-8.3	0	0	0	111.6	Y490 K491 G539 P540 V541	Y490-N531 CarbonylContact C-O 3.44Å; Y490-N531 VanDerWaalsContact CA-O 3.22Å; Y490-N531 WeakPolarHBondContact CA-O 3.39Å; K491-N531 WeakPolarHBondContact CB-OD1 3.26Å; K491-N531 PolarHBondContact N-O 2.84Å; K491-N531 PolarHBondContact O-N 3.1Å; N531-G539 WeakPolarHBondContact CB-O 3.34Å; N531-G539 PolarHBondContact ND2-O 2.72Å; N531-P540 WeakPolarHBondContact CB-O 3.42Å; N531-V541 HydrophobicContact CB-CG1 3.91Å
532	A	92.4	Very high	86.9	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.008	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	155.6	168.9	0	0	0	0	0	110	P456 P460 P480 I487 G489 Y490 G539	P456-A532 HydrophobicContact CG-CB 4.26Å; P460-A532 HydrophobicContact CG-CB 4.31Å; P480-A532 HydrophobicContact CG-CB 3.62Å; I487-A532 HydrophobicContact CD1-CB 4.09Å; I487-A532 HydrophobicContact CG2-CB 4.15Å; G489-A532 WeakPolarHBondContact O-CA 3.43Å; Y490-A532 HydrophobicContact CD1-CB 3.78Å; Y490-A532 HydrophobicContact CE1-CB 3.65Å; A532-G539 PolarHBondContact O-N 2.98Å
533	F	91.6	Very high	87.4	Confident	38 Å²	38	42.3 Å²	42.3	17%	0.167	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	152.8	170.5	64.6	-91.1	0	0	0	111.3	I487 T488 G489 K491 G537 D538	I487-F533 CarbonylContact C-O 3.56Å; I487-F533 WeakPolarHBondContact CA-O 3.05Å; T488-F533 PolarHBondContact N-O 3.36Å; T488-F533 WeakPolarHBondContact OG1-CD2 3.38Å; T488-F533 VanDerWaalsContact OG1-CE2 3.27Å; T488-F533 WeakPolarHBondContact OG1-CE2 3.2Å; T488-F533 PolarHBondContact OG1-O 2.72Å; G489-F533 VanDerWaalsContact C-CD1 3.49Å; G489-F533 PolarHBondContact N-O 3.11Å; G489-F533 WeakPolarHBondContact O-CD1 3.39Å; G489-F533 PolarHBondContact O-N 2.94Å; K491-F533 HydrophobicContact CD-CD1 4.32Å; K491-F533 HydrophobicContact CG-CD1 3.88Å; K491-F533 HydrophobicContact CG-CE1 3.92Å; F533-G537 VanDerWaalsContact CA-O 3.28Å; F533-G537 WeakPolarHBondContact CA-O 3.42Å; F533-G537 WeakPolarHBondContact CB-O 3.49Å; F533-D538 WeakPolarHBondContact CB-OD1 3.41Å
534	N	90.2	Very high	88.3	Confident	9 Å²	9	40.2 Å²	40.2	5%	0.048	24%	0.235	C	C	.	.			trans	-130.2	-156.5	177.3	66	18.1	0	0	0	110.2	E453 L454 S483 R486 T488 A536 G537	E453-N534 WeakPolarHBondContact OE2-CB 3.47Å; L454-N534 PolarHBondContact O-ND2 2.78Å; S483-N534 PolarHBondContact O-ND2 2.91Å; S483-N534 VanDerWaalsContact O-ND2 3.13Å; R486-N534 VanDerWaalsContact O-CB 3.24Å; R486-N534 WeakPolarHBondContact O-CB 3.17Å; T488-N534 WeakPolarHBondContact OG1-CA 2.97Å; T488-N534 PolarHBondContact OG1-O 3.12Å; N534-A536 VanDerWaalsContact C-N 3.35Å; N534-A536 PolarHBondContact OD1-N 3.01Å; N534-G537 PolarHBondContact N-O 2.87Å; N534-G537 VanDerWaalsContact N-O 3.07Å; N534-G537 PolarHBondContact OD1-N 2.75Å
535	A	84.1	Confident	88.6	Confident	79 Å²	79	41.6 Å²	41.6	65%	0.653	24%	0.24	S	C	*	.	S	Bend	trans	-77.4	-20.7	179.2	0	0	0	0	0	113.5	E453	E453-A535 WeakPolarHBondContact OE2-CB 3.22Å; E453-A535 PolarHBondContact OE2-N 2.81Å
536	A	81	Confident	88.9	Confident	54 Å²	54	42.7 Å²	42.7	45%	0.446	25%	0.248	S	C	.	.	S	Bend	trans	-91.9	-25.4	-178.9	0	0	0	0	0	113.8	E453 N534	E453-A536 HydrophobicContact CB-CB 3.83Å; E453-A536 WeakPolarHBondContact O-CB 3.41Å; N534-A536 VanDerWaalsContact C-N 3.35Å; N534-A536 PolarHBondContact OD1-N 3.01Å
537	G	85.8	Confident	88.5	Confident	26 Å²	26	42.8 Å²	42.8	27%	0.268	25%	0.249	S	C	.	.			trans	162.3	-166.5	172.3	0	0	0	0	0	116	F533 N534	F533-G537 VanDerWaalsContact CA-O 3.28Å; F533-G537 WeakPolarHBondContact CA-O 3.42Å; F533-G537 WeakPolarHBondContact CB-O 3.49Å; N534-G537 PolarHBondContact N-O 2.87Å; N534-G537 VanDerWaalsContact N-O 3.07Å; N534-G537 PolarHBondContact OD1-N 2.75Å
538	D	87.1	Confident	88	Confident	74 Å²	74	42 Å²	42	40%	0.396	25%	0.251	S	S	.	.	B	Isolated β-bridge	trans	-83.1	133.7	172.9	-74.8	-25.1	0	0	0	110.8	K491 F533	K491-D538 VanDerWaalsContact CE-OD1 3.27Å; K491-D538 WeakPolarHBondContact CE-OD1 3.01Å; K491-D538 IonicContact NZ-OD1 3.14Å; K491-D538 PolarHBondContact NZ-OD1 3.46Å; K491-D538 IonicContact NZ-OD2 2.68Å; K491-D538 PolarHBondContact NZ-OD2 3.43Å; F533-D538 WeakPolarHBondContact CB-OD1 3.41Å
539	G	87.1	Confident	86.7	Confident	9 Å²	9	42 Å²	42	9%	0.093	25%	0.251	C	S	.	.			trans	-81.5	175.8	169.1	0	0	0	0	0	112.7	P456 N531 A532	P456-G539 VanDerWaalsContact O-CA 3.28Å; P456-G539 WeakPolarHBondContact O-CA 3.37Å; N531-G539 WeakPolarHBondContact CB-O 3.34Å; N531-G539 PolarHBondContact ND2-O 2.72Å; A532-G539 PolarHBondContact O-N 2.98Å
540	P	88.7	Confident	84.8	Confident	55 Å²	55	40.1 Å²	40.1	36%	0.357	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-64.3	146.4	177.1	28.7	-34.5	0	0	0	111.3	P456 N531	P456-P540 WeakPolarHBondContact O-CD 3.33Å; N531-P540 WeakPolarHBondContact CB-O 3.42Å
541	V	89.1	Confident	82.7	Confident	52 Å²	52	41.5 Å²	41.5	32%	0.315	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-73.7	146.1	172.7	-80.4	0	0	0	0	111.5	Y493 L502 K529 N531	Y493-V541 HydrophobicContact CD2-CG1 4.24Å; Y493-V541 HydrophobicContact CE2-CG1 4.15Å; L502-V541 HydrophobicContact CD2-CG1 4.04Å; L502-V541 HydrophobicContact CD2-CG2 4.34Å; K529-V541 HydrophobicContact CB-CB 4.41Å; N531-V541 HydrophobicContact CB-CG1 3.91Å
542	S	89.8	Confident	80.5	Confident	10 Å²	10	41.4 Å²	41.4	7%	0.07	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-59.4	163.8	171.3	70.6	0	0	0	0	112.6	L463 K529 V530	L463-S542 WeakPolarHBondContact CD2-OG 3.23Å; K529-S542 WeakPolarHBondContact CA-OG 3.31Å; V530-S542 PolarHBondContact N-OG 3.22Å; V530-S542 PolarHBondContact O-N 3.38Å
543	E	82.5	Confident	78.4	Confident	173 Å²	173	43.1 Å²	43.1	81%	0.808	26%	0.262	S	S	*	.	P	Polyproline II helix	trans	-50.6	153.8	159.4	-75.5	-56.7	150.6	0	0	112.4	L545	E543-L545 PolarHBondContact O-N 2.93Å
544	Q	85.3	Confident	76.7	Confident	73 Å²	73	42 Å²	42	34%	0.341	26%	0.258	S	S	.	.			trans	-78.8	112.8	-175.9	-173.7	164.8	-70.6	0	0	110.8	W505 Y527 K529 P546	W505-Q544 HydrophobicContact CH2-CG 4.41Å; Y527-Q544 HydrophobicContact CD1-CG 4.05Å; K529-Q544 HydrophobicContact CG-CB 4.46Å; Q544-P546 WeakPolarHBondContact O-CD 3.14Å
545	L	87.3	Confident	75.4	Confident	49 Å²	49	44.3 Å²	44.3	26%	0.257	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	104.4	172.8	-179	59.7	0	0	0	110.4	L463 A465 I528 E543	L463-L545 HydrophobicContact CD2-CB 3.84Å; L463-L545 HydrophobicContact CD2-CD2 4.37Å; L463-L545 HydrophobicContact CG-CB 4.31Å; L463-L545 HydrophobicContact CG-CD2 3.95Å; A465-L545 HydrophobicContact CB-CD2 3.66Å; I528-L545 HydrophobicContact CB-CB 4.48Å; I528-L545 PolarHBondContact N-O 2.93Å; I528-L545 PolarHBondContact O-N 2.81Å; E543-L545 PolarHBondContact O-N 2.93Å
546	P	88.7	Confident	74.8	Confident	75 Å²	75	42.2 Å²	42.2	49%	0.487	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	131.7	166.6	30.8	-33.7	0	0	0	110.1	Y527 Q544	Y527-P546 HydrophobicContact CD1-CB 3.87Å; Y527-P546 HydrophobicContact CE1-CB 3.81Å; Q544-P546 WeakPolarHBondContact O-CD 3.14Å
547	I	82.5	Confident	74.4	Confident	16 Å²	16	40 Å²	40	8%	0.082	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	126.1	169.1	-173.8	162.9	0	0	0	109.7	A465 V467 V473 Y526 I528	A465-I547 HydrophobicContact CB-CD1 3.54Å; A465-I547 HydrophobicContact CB-CG2 4.42Å; V467-I547 HydrophobicContact CG2-CD1 3.71Å; V467-I547 HydrophobicContact CG2-CG1 3.97Å; V473-I547 HydrophobicContact CG1-CD1 3.96Å; V473-I547 HydrophobicContact CG2-CD1 4.25Å; Y526-I547 PolarHBondContact N-O 2.72Å; Y526-I547 PolarHBondContact O-N 2.72Å; Y526-I547 VanDerWaalsContact O-O 3.12Å; I528-I547 HydrophobicContact CD1-CG2 3.55Å; I528-I547 HydrophobicContact CG1-CG2 4.16Å
548	V	80.6	Confident	74	Confident	42 Å²	42	40.1 Å²	40.1	26%	0.255	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	125	168.8	-174.7	0	0	0	0	107.7	V467 T525 T550 S956	V467-V548 WeakPolarHBondContact CG2-O 3.36Å; T525-V548 HydrophobicContact CG2-CG2 4.33Å; V548-T550 HydrophobicContact CG1-CG2 4.23Å; V548-T550 PolarHBondContact O-N 2.77Å; V548-T550 PolarHBondContact O-OG1 3.33Å; V548-S956 WeakPolarHBondContact CB-OG 3.36Å
549	V	66.4	Low	73.6	Confident	0 Å²	0	38 Å²	38	0%	0	22%	0.221	C	C	.	.			trans	-74	77.2	173.5	-178.3	0	0	0	0	107.8	V467 P470 V473 L520 N523 A524 Y526	V467-V549 HydrophobicContact CG1-CG1 4.42Å; P470-V549 VanDerWaalsContact O-CG1 3.3Å; P470-V549 WeakPolarHBondContact O-CG1 3.5Å; V473-V549 HydrophobicContact CG2-CG2 3.93Å; L520-V549 HydrophobicContact CB-CG1 4.11Å; L520-V549 HydrophobicContact CB-CG2 4.02Å; L520-V549 HydrophobicContact CD1-CG2 3.73Å; N523-V549 WeakPolarHBondContact CA-O 3.01Å; N523-V549 PolarHBondContact N-O 2.89Å; A524-V549 PolarHBondContact O-N 2.83Å; Y526-V549 HydrophobicContact CD2-CB 4.46Å; Y526-V549 HydrophobicContact CD2-CG2 3.46Å; Y526-V549 VanDerWaalsContact CD2-CG2 3.46Å; Y526-V549 HydrophobicContact CE2-CG2 3.9Å; Y526-V549 HydrophobicContact CG-CG2 4.36Å
550	T	52.7	Low	73.4	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.006	22%	0.223	C	C	.	.			trans	-69.2	163.9	175.8	29.3	0	0	0	0	110.7	V467 V548 G552 S956	V467-T550 VanDerWaalsContact CG1-O 3.31Å; V467-T550 WeakPolarHBondContact CG1-O 3.49Å; V548-T550 HydrophobicContact CG1-CG2 4.23Å; V548-T550 PolarHBondContact O-N 2.77Å; V548-T550 PolarHBondContact O-OG1 3.33Å; T550-G552 PolarHBondContact O-N 3.07Å; T550-S956 VanDerWaalsContact CG2-OG 3.26Å; T550-S956 WeakPolarHBondContact CG2-OG 3.04Å
551	P	50.7	Low	72.9	Confident	30 Å²	30	43.3 Å²	43.3	20%	0.195	23%	0.233	C	C	.	.	S	Bend	trans	-69.1	76.7	169.5	29.7	-35.8	0	0	0	111.2	P470 R584	P470-P551 HydrophobicContact CB-CB 4.5Å; P470-P551 HydrophobicContact CG-CB 4.35Å; P551-R584 HydrophobicContact CB-CG 4.03Å; P551-R584 HydrophobicContact CG-CG 4.05Å; P551-R584 WeakPolarHBondContact O-CD 3.28Å; P551-R584 PolarHBondContact O-NE 2.94Å; P551-R584 PolarHBondContact O-NH1 3.15Å
552	G	46.7	Very low	72.1	Confident	4 Å²	4	41.8 Å²	41.8	4%	0.041	23%	0.228	C	C	.	.			trans	67	142.4	173.4	0	0	0	0	0	116.9	T550 N954	T550-G552 PolarHBondContact O-N 3.07Å; G552-N954 PolarHBondContact O-ND2 2.83Å
553	V	48.8	Very low	71.2	Confident	36 Å²	36	45.9 Å²	45.9	22%	0.218	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-62.8	136.3	165	168.6	0	0	0	0	109.8	I466 V467	I466-V553 HydrophobicContact CG2-CG2 3.95Å; V467-V553 HydrophobicContact CB-CG2 4.09Å; V467-V553 WeakPolarHBondContact O-CB 3.22Å; V467-V553 WeakPolarHBondContact O-CG2 3.5Å; V467-V553 PolarHBondContact O-N 2.8Å; V467-V553 VanDerWaalsContact O-N 3.17Å
554	P	55.6	Low	70.4	Confident	14 Å²	14	38.7 Å²	38.7	9%	0.091	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-68	142.1	177.3	-20.5	33.3	0	0	0	113.3	L952 N954 L960	P554-L952 HydrophobicContact CB-CB 3.82Å; P554-L952 HydrophobicContact CB-CD1 4.29Å; P554-L952 HydrophobicContact CG-CB 4.17Å; P554-N954 HydrophobicContact CG-CB 4.02Å; P554-L960 PolarHBondContact O-N 2.94Å
555	T	63.3	Low	69.2	Low	59 Å²	59	40.8 Å²	40.8	36%	0.362	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-62.2	161.4	166.8	35	0	0	0	0	111.4	P577 D579 L952	T555-P577 WeakPolarHBondContact O-CG 3.47Å; T555-P577 WeakPolarHBondContact OG1-CB 3.46Å; T555-D579 PolarHBondContact OG1-OD2 3.41Å; T555-L952 WeakPolarHBondContact O-CD1 3.01Å
556	A	70.2	Confident	67.9	Low	34 Å²	34	42.5 Å²	42.5	28%	0.281	24%	0.236	S	C	.	.	P	Polyproline II helix	trans	-68.7	147.7	-175	0	0	0	0	0	112.5	T558 L960	A556-T558 PolarHBondContact O-N 2.73Å; A556-L960 WeakPolarHBondContact CA-O 3.48Å; A556-L960 HydrophobicContact CB-CB 3.82Å; A556-L960 WeakPolarHBondContact CB-O 2.97Å
557	P	74.3	Confident	66.4	Low	7 Å²	7	40.6 Å²	40.6	5%	0.045	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-57.7	131.1	175.9	-19.1	30	0	0	0	111.7	W574 Y589 V950 L952 A962	P557-W574 HydrophobicContact CB-CB 4.1Å; P557-W574 HydrophobicContact CB-CG 4.2Å; P557-Y589 HydrophobicContact CB-CE1 4.38Å; P557-Y589 HydrophobicContact CG-CD1 4.11Å; P557-Y589 HydrophobicContact CG-CE1 4.2Å; P557-V950 WeakPolarHBondContact CD-O 3.23Å; P557-V950 HydrophobicContact CG-CB 4.33Å; P557-V950 HydrophobicContact CG-CG1 3.98Å; P557-V950 WeakPolarHBondContact CG-O 3.27Å; P557-L952 HydrophobicContact CB-CD1 4.32Å; P557-L952 HydrophobicContact CG-CD1 3.66Å; P557-L952 HydrophobicContact CG-CG 4.13Å; P557-A962 WeakPolarHBondContact O-CB 3.35Å
558	T	75.9	Confident	65.3	Low	30 Å²	30	40.8 Å²	40.8	18%	0.184	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	164.9	175.8	47.1	0	0	0	0	110.8	A556 L560 T575 P576 M751	A556-T558 PolarHBondContact O-N 2.73Å; T558-L560 VanDerWaalsContact C-N 3.26Å; T558-L560 PolarHBondContact O-N 3.35Å; T558-T575 VanDerWaalsContact C-OG1 3.27Å; T558-T575 WeakPolarHBondContact CB-OG1 3.5Å; T558-T575 PolarHBondContact N-O 2.75Å; T558-T575 PolarHBondContact O-N 3.2Å; T558-T575 PolarHBondContact O-OG1 3.17Å; T558-T575 VanDerWaalsContact O-OG1 3.1Å; T558-T575 PolarHBondContact OG1-O 3.04Å; T558-T575 PolarHBondContact OG1-OG1 3.2Å; T558-P576 PolarHBondContact OG1-O 2.7Å; T558-M751 WeakPolarHBondContact CB-O 3.23Å; T558-M751 PolarHBondContact OG1-O 2.9Å
559	N	78.4	Confident	64.6	Low	30 Å²	30	39.7 Å²	39.7	16%	0.16	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	50.4	31.5	174	-58.7	-55.2	0	0	0	116.8	R561 T573 T575 T750 M751 M752	N559-R561 WeakPolarHBondContact O-CG 3.06Å; N559-R561 PolarHBondContact O-N 3.19Å; N559-T573 VanDerWaalsContact O-O 3.04Å; N559-T575 HydrophobicContact CB-CG2 4.1Å; N559-T575 WeakPolarHBondContact CB-OG1 2.99Å; N559-T575 PolarHBondContact ND2-OG1 2.84Å; N559-T750 WeakPolarHBondContact OD1-CG2 3.23Å; N559-M751 PolarHBondContact ND2-O 2.84Å; N559-M752 PolarHBondContact ND2-N 2.82Å
560	L	82.9	Confident	64.7	Low	24 Å²	24	39.7 Å²	39.7	13%	0.126	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	110.6	173.5	-177.3	61.4	0	0	0	110	T558 T573 W574 V950 A962 L964	T558-L560 VanDerWaalsContact C-N 3.26Å; T558-L560 PolarHBondContact O-N 3.35Å; L560-T573 CarbonylContact C-O 3.52Å; L560-T573 WeakPolarHBondContact CA-O 3.11Å; L560-W574 HydrophobicContact CB-CB 4.35Å; L560-W574 HydrophobicContact CD1-CB 4.05Å; L560-W574 HydrophobicContact CD1-CD2 4.46Å; L560-W574 HydrophobicContact CD1-CE3 3.79Å; L560-V950 HydrophobicContact CD1-CB 4.43Å; L560-V950 HydrophobicContact CD1-CG2 3.69Å; L560-V950 HydrophobicContact CD2-CB 4.35Å; L560-V950 HydrophobicContact CD2-CG2 3.99Å; L560-A962 HydrophobicContact CB-CB 4.05Å; L560-A962 HydrophobicContact CD2-CB 3.83Å; L560-A962 WeakPolarHBondContact CD2-O 2.99Å; L560-L964 HydrophobicContact CD2-CB 3.76Å; L560-L964 HydrophobicContact CG-CB 3.86Å; L560-L964 HydrophobicContact CG-CD2 4.22Å
561	R	78.6	Confident	66	Low	150 Å²	150	41.7 Å²	41.7	57%	0.566	23%	0.227	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-129.4	157.7	179.2	-66	173.7	-170.1	-152.3	3.6	108.5	N559 L572 T573	N559-R561 WeakPolarHBondContact O-CG 3.06Å; N559-R561 PolarHBondContact O-N 3.19Å; R561-L572 CarbonylContact O-C 3.59Å; R561-L572 VanDerWaalsContact O-CA 3.32Å; R561-L572 WeakPolarHBondContact O-CA 3.38Å; R561-T573 PolarHBondContact N-O 3.34Å; R561-T573 PolarHBondContact O-N 2.79Å
562	G	72.7	Confident	67.4	Low	21 Å²	21	40.3 Å²	40.3	22%	0.216	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	124.8	-176.1	0	0	0	0	0	109.6	H571	G562-H571 CarbonylContact C-O 3.55Å; G562-H571 VanDerWaalsContact CA-O 3.3Å; G562-H571 WeakPolarHBondContact CA-O 3.29Å
563	I	71	Confident	69.1	Low	95 Å²	95	42.1 Å²	42.1	49%	0.487	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	119.3	-174.5	-46.9	177.1	0	0	0	107.3	L565 H571	I563-L565 HydrophobicContact CB-CD2 4.38Å; I563-L565 HydrophobicContact CG2-CD2 3.69Å; I563-L565 HydrophobicContact CG2-CG 4.34Å; I563-H571 PolarHBondContact N-O 2.93Å; I563-H571 PolarHBondContact O-N 3.47Å
564	S	65.6	Low	70.8	Confident	23 Å²	23	40.5 Å²	40.5	16%	0.161	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	112.1	171.1	-171.4	0	0	0	0	109	K566 N569 P969	S564-K566 PolarHBondContact OG-O 2.93Å; S564-K566 VanDerWaalsContact OG-O 3.08Å; S564-N569 WeakPolarHBondContact CA-O 2.97Å; S564-N569 VanDerWaalsContact CB-O 3.3Å; S564-N569 WeakPolarHBondContact CB-O 3.07Å; S564-N569 PolarHBondContact OG-O 2.58Å; S564-P969 WeakPolarHBondContact OG-CD 3.3Å
565	L	60.6	Low	71.9	Confident	117 Å²	117	40.4 Å²	40.4	61%	0.613	22%	0.217	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	-27	-171	-61	170	0	0	0	112.3	I563 N569 H571	I563-L565 HydrophobicContact CB-CD2 4.38Å; I563-L565 HydrophobicContact CG2-CD2 3.69Å; I563-L565 HydrophobicContact CG2-CG 4.34Å; L565-N569 WeakPolarHBondContact CA-OD1 2.94Å; L565-N569 WeakPolarHBondContact CB-OD1 3.09Å; L565-N569 PolarHBondContact N-OD1 3.04Å; L565-N569 VanDerWaalsContact N-OD1 3.08Å; L565-H571 HydrophobicContact CD1-CB 4.19Å
566	K	58.9	Low	72.3	Confident	85 Å²	85	39.7 Å²	39.7	37%	0.37	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	160.3	168.1	-66.3	-175.7	177.3	-178.5	0	107.9	S564 T568 N569 E650	S564-K566 PolarHBondContact OG-O 2.93Å; S564-K566 VanDerWaalsContact OG-O 3.08Å; K566-T568 WeakPolarHBondContact CB-OG1 3.42Å; K566-T568 PolarHBondContact O-N 2.83Å; K566-N569 PolarHBondContact N-OD1 2.88Å; K566-N569 PolarHBondContact O-N 3.1Å; K566-E650 IonicContact NZ-OE1 3.65Å; K566-E650 PolarHBondContact NZ-OE1 3.19Å; K566-E650 IonicContact NZ-OE2 3.93Å; K566-E650 PolarHBondContact NZ-OE2 3.04Å
567	P	59	Low	72.1	Confident	34 Å²	34	38.5 Å²	38.5	22%	0.221	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-26.5	169.6	-21.7	32	0	0	0	113.4	Y942 P969 D970 A971	P567-Y942 HydrophobicContact CB-CD1 3.56Å; P567-Y942 HydrophobicContact CB-CE1 4.04Å; P567-P969 HydrophobicContact CB-CB 4.35Å; P567-P969 HydrophobicContact CG-CB 4.1Å; P567-D970 WeakPolarHBondContact CG-O 3.17Å; P567-A971 HydrophobicContact CB-CB 3.68Å; P567-A971 HydrophobicContact CG-CB 3.87Å
568	T	58.9	Low	71.5	Confident	21 Å²	21	44.4 Å²	44.4	13%	0.129	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	4.4	-179.9	50.6	0	0	0	0	115.3	K566 T647 D648 I940 Y942	K566-T568 WeakPolarHBondContact CB-OG1 3.42Å; K566-T568 PolarHBondContact O-N 2.83Å; T568-T647 CarbonylContact O-C 3.6Å; T568-T647 VanDerWaalsContact O-CA 3.3Å; T568-T647 WeakPolarHBondContact O-CA 2.91Å; T568-D648 VanDerWaalsContact CA-OD2 3.28Å; T568-D648 WeakPolarHBondContact CA-OD2 3.18Å; T568-D648 HydrophobicContact CG2-CB 4.06Å; T568-D648 PolarHBondContact O-N 2.86Å; T568-I940 WeakPolarHBondContact O-CD1 3.37Å; T568-Y942 HydrophobicContact CG2-CE1 3.64Å
569	N	64.9	Low	70.6	Confident	18 Å²	18	48.1 Å²	48.1	10%	0.096	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	152.9	-176.5	67.7	37.6	0	0	0	116.3	S564 L565 K566 L645 L646 T647	S564-N569 WeakPolarHBondContact CA-O 2.97Å; S564-N569 VanDerWaalsContact CB-O 3.3Å; S564-N569 WeakPolarHBondContact CB-O 3.07Å; S564-N569 PolarHBondContact OG-O 2.58Å; L565-N569 WeakPolarHBondContact CA-OD1 2.94Å; L565-N569 WeakPolarHBondContact CB-OD1 3.09Å; L565-N569 PolarHBondContact N-OD1 3.04Å; L565-N569 VanDerWaalsContact N-OD1 3.08Å; K566-N569 PolarHBondContact N-OD1 2.88Å; K566-N569 PolarHBondContact O-N 3.1Å; N569-L645 HydrophobicContact CB-CD1 4.34Å; N569-L646 CarbonylContact C-O 3.24Å; N569-L646 WeakPolarHBondContact CA-O 2.97Å; N569-L646 WeakPolarHBondContact CB-O 2.75Å; N569-T647 HydrophobicContact CB-CG2 3.53Å
570	I	70.1	Confident	69.4	Low	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	115.4	174.1	-64.4	171.3	0	0	0	108.4	L572 L646 I940 Y946 F948 V966 T968	I570-L572 HydrophobicContact CG2-CD2 3.93Å; I570-L572 HydrophobicContact CG2-CG 4.23Å; I570-L646 HydrophobicContact CB-CB 4.31Å; I570-L646 PolarHBondContact N-O 3.48Å; I570-L646 PolarHBondContact O-N 2.74Å; I570-I940 HydrophobicContact CD1-CG2 4.28Å; I570-Y946 HydrophobicContact CD1-CD2 4.19Å; I570-F948 HydrophobicContact CB-CZ 4.35Å; I570-F948 HydrophobicContact CD1-CE2 3.92Å; I570-F948 HydrophobicContact CD1-CZ 3.64Å; I570-F948 HydrophobicContact CG2-CE2 4.06Å; I570-F948 HydrophobicContact CG2-CZ 3.9Å; I570-V966 HydrophobicContact CD1-CB 4.37Å; I570-V966 HydrophobicContact CD1-CG1 4.41Å; I570-V966 HydrophobicContact CG1-CG1 4.34Å; I570-V966 HydrophobicContact CG2-CB 4.2Å; I570-V966 HydrophobicContact CG2-CG1 4.04Å; I570-V966 HydrophobicContact CG2-CG2 4.19Å; I570-T968 HydrophobicContact CD1-CG2 3.87Å; I570-T968 HydrophobicContact CG1-CG2 4Å
571	H	78.5	Confident	67.5	Low	44 Å²	44	52.7 Å²	52.7	20%	0.204	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	104.4	173.6	-177.7	-138.1	0	0	0	109.8	G562 I563 L565 T573 Q643 L645	G562-H571 CarbonylContact C-O 3.55Å; G562-H571 VanDerWaalsContact CA-O 3.3Å; G562-H571 WeakPolarHBondContact CA-O 3.29Å; I563-H571 PolarHBondContact N-O 2.93Å; I563-H571 PolarHBondContact O-N 3.47Å; L565-H571 HydrophobicContact CD1-CB 4.19Å; H571-T573 VanDerWaalsContact CE1-CG2 3.45Å; H571-T573 WeakPolarHBondContact CE1-CG2 3.37Å; H571-Q643 PolarHBondContact NE2-OE1 2.91Å; H571-L645 HydrophobicContact CB-CD1 3.9Å
572	L	81	Confident	66	Low	0 Å²	0	51 Å²	51	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	142.5	171.3	-56.9	171.7	0	0	0	110.2	R561 I570 W574 L591 Q643 Y644 F948 L964 V966	R561-L572 CarbonylContact O-C 3.59Å; R561-L572 VanDerWaalsContact O-CA 3.32Å; R561-L572 WeakPolarHBondContact O-CA 3.38Å; I570-L572 HydrophobicContact CG2-CD2 3.93Å; I570-L572 HydrophobicContact CG2-CG 4.23Å; L572-W574 HydrophobicContact CB-CE3 4.2Å; L572-W574 HydrophobicContact CB-CZ3 3.77Å; L572-W574 HydrophobicContact CD1-CZ3 4.34Å; L572-L591 HydrophobicContact CD1-CD1 3.63Å; L572-L591 HydrophobicContact CD1-CD2 3.9Å; L572-L591 HydrophobicContact CD1-CG 4.45Å; L572-Q643 CarbonylContact O-C 3.56Å; L572-Q643 WeakPolarHBondContact O-CA 3.31Å; L572-Q643 WeakPolarHBondContact O-CB 3.48Å; L572-Y644 HydrophobicContact CD1-CD1 4.29Å; L572-Y644 PolarHBondContact N-O 2.69Å; L572-Y644 PolarHBondContact O-N 3.16Å; L572-F948 HydrophobicContact CD1-CB 4.48Å; L572-F948 HydrophobicContact CD1-CD1 3.55Å; L572-F948 HydrophobicContact CD1-CE1 3.97Å; L572-F948 HydrophobicContact CD1-CG 4.07Å; L572-F948 HydrophobicContact CD2-CB 4.37Å; L572-F948 HydrophobicContact CD2-CD1 4.1Å; L572-F948 HydrophobicContact CD2-CD2 4Å; L572-F948 HydrophobicContact CD2-CE1 4.44Å; L572-F948 HydrophobicContact CD2-CE2 4.34Å; L572-F948 HydrophobicContact CD2-CG 3.88Å; L572-F948 HydrophobicContact CG-CD1 4.36Å; L572-L964 HydrophobicContact CD2-CD2 4.13Å; L572-V966 HydrophobicContact CD2-CG2 4.38Å
573	T	82.7	Confident	65	Low	42 Å²	42	56.6 Å²	56.6	26%	0.258	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	140.2	169.2	62.2	0	0	0	0	109.1	N559 L560 R561 H571 Q643	N559-T573 VanDerWaalsContact O-O 3.04Å; L560-T573 CarbonylContact C-O 3.52Å; L560-T573 WeakPolarHBondContact CA-O 3.11Å; R561-T573 PolarHBondContact N-O 3.34Å; R561-T573 PolarHBondContact O-N 2.79Å; H571-T573 VanDerWaalsContact CE1-CG2 3.45Å; H571-T573 WeakPolarHBondContact CE1-CG2 3.37Å; T573-Q643 HydrophobicContact CG2-CB 4.07Å
574	W	84.8	Confident	64.1	Low	2 Å²	2	56.2 Å²	56.2	1%	0.008	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	179.5	170.9	56.5	87.6	0	0	0	108.5	P557 L560 L572 Y589 I637 A641 T642 V950	P557-W574 HydrophobicContact CB-CB 4.1Å; P557-W574 HydrophobicContact CB-CG 4.2Å; L560-W574 HydrophobicContact CB-CB 4.35Å; L560-W574 HydrophobicContact CD1-CB 4.05Å; L560-W574 HydrophobicContact CD1-CD2 4.46Å; L560-W574 HydrophobicContact CD1-CE3 3.79Å; L572-W574 HydrophobicContact CB-CE3 4.2Å; L572-W574 HydrophobicContact CB-CZ3 3.77Å; L572-W574 HydrophobicContact CD1-CZ3 4.34Å; W574-Y589 AromaticContact CD1-CD1 3.81Å; W574-Y589 AromaticContact CD1-CE1 3.44Å; W574-Y589 VanDerWaalsContact CD1-CE1 3.44Å; W574-Y589 AromaticContact CD1-CZ 3.83Å; W574-Y589 HydrophobicContact CZ2-CD2 4.29Å; W574-Y589 HydrophobicContact CZ2-CG 4.08Å; W574-Y589 AromaticContact NE1-CD1 3.19Å; W574-Y589 AromaticContact NE1-CD2 3.63Å; W574-Y589 AromaticContact NE1-CE1 3.15Å; W574-Y589 AromaticContact NE1-CE2 3.61Å; W574-Y589 AromaticContact NE1-CG 3.44Å; W574-Y589 AromaticContact NE1-CZ 3.39Å; W574-I637 HydrophobicContact CH2-CD1 3.8Å; W574-I637 HydrophobicContact CZ2-CD1 4.19Å; W574-I637 HydrophobicContact CZ2-CG2 4.32Å; W574-A641 WeakPolarHBondContact CZ2-O 3.3Å; W574-T642 PolarHBondContact N-O 2.93Å; W574-T642 WeakPolarHBondContact O-CB 3.37Å; W574-V950 HydrophobicContact CD2-CG1 4Å; W574-V950 HydrophobicContact CD2-CG2 4.47Å; W574-V950 HydrophobicContact CE3-CG1 4.36Å; W574-V950 HydrophobicContact CE3-CG2 4.07Å; W574-V950 HydrophobicContact CG-CG1 4.4Å; W574-V950 HydrophobicContact CH2-CG1 4.39Å; W574-V950 HydrophobicContact CZ2-CG1 4.06Å; W574-V950 HydrophobicContact CZ3-CG2 4.1Å
575	T	78.5	Confident	63.5	Low	13 Å²	13	63 Å²	63	8%	0.08	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	151.2	-176.1	52.5	0	0	0	0	110.5	T558 N559 M751 M752	T558-T575 VanDerWaalsContact C-OG1 3.27Å; T558-T575 WeakPolarHBondContact CB-OG1 3.5Å; T558-T575 PolarHBondContact N-O 2.75Å; T558-T575 PolarHBondContact O-N 3.2Å; T558-T575 PolarHBondContact O-OG1 3.17Å; T558-T575 VanDerWaalsContact O-OG1 3.1Å; T558-T575 PolarHBondContact OG1-O 3.04Å; T558-T575 PolarHBondContact OG1-OG1 3.2Å; N559-T575 HydrophobicContact CB-CG2 4.1Å; N559-T575 WeakPolarHBondContact CB-OG1 2.99Å; N559-T575 PolarHBondContact ND2-OG1 2.84Å; T575-M751 PolarHBondContact OG1-O 3.39Å; T575-M752 WeakPolarHBondContact CB-O 3.11Å
576	P	70.9	Confident	63.6	Low	44 Å²	44	59.2 Å²	59.2	29%	0.286	31%	0.313	S	S	.	.			trans	-63.9	151.5	176.6	-16.1	29.5	0	0	0	111.5	T558 T642	T558-P576 PolarHBondContact OG1-O 2.7Å; P576-T642 HydrophobicContact CG-CG2 4.41Å
577	P	66.9	Low	63.9	Low	9 Å²	9	59 Å²	59	6%	0.058	32%	0.315	C	S	.	.			trans	-69.1	150.9	169.6	-11.6	26.7	0	0	0	111.5	T555 D579 M580 L952	T555-P577 WeakPolarHBondContact O-CG 3.47Å; T555-P577 WeakPolarHBondContact OG1-CB 3.46Å; P577-D579 VanDerWaalsContact C-N 3.3Å; P577-D579 PolarHBondContact O-N 2.64Å; P577-M580 WeakPolarHBondContact O-CG 3.45Å; P577-L952 HydrophobicContact CG-CD1 3.6Å
578	E	60.3	Low	64.4	Low	130 Å²	130	57.3 Å²	57.3	61%	0.607	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-20.9	-177.3	-61.2	-172.7	123.3	0	0	113.7	M580 M751	E578-M580 PolarHBondContact O-N 2.83Å; E578-M751 HydrophobicContact CG-CB 4.12Å; E578-M751 WeakPolarHBondContact OE1-CE 3.47Å; E578-M751 WeakPolarHBondContact OE1-CG 3.45Å; E578-M751 WeakPolarHBondContact OE2-CG 3.49Å
579	D	57.2	Low	65.4	Low	109 Å²	109	56.4 Å²	56.4	58%	0.583	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	5.2	-176.2	-56.1	-54.1	0	0	0	115	T555 P577 S581	T555-D579 PolarHBondContact OG1-OD2 3.41Å; P577-D579 VanDerWaalsContact C-N 3.3Å; P577-D579 PolarHBondContact O-N 2.64Å; D579-S581 PolarHBondContact O-N 2.89Å; D579-S581 PolarHBondContact O-OG 3.25Å
580	M	53.9	Low	66	Low	76 Å²	76	58 Å²	58	37%	0.374	31%	0.305	S	S	.	.			trans	-73.4	60.7	-178.5	-69.7	-66.1	-64.9	0	0	112.7	P577 E578 R584 L586	P577-M580 WeakPolarHBondContact O-CG 3.45Å; E578-M580 PolarHBondContact O-N 2.83Å; M580-R584 WeakPolarHBondContact CE-O 3.13Å; M580-L586 HydrophobicContact CE-CB 4.16Å
581	S	43.5	Very low	66.5	Low	73 Å²	73	58 Å²	58	51%	0.51	31%	0.305	S	S	.	.			trans	-60.7	153.9	167.1	45.1	0	0	0	0	111.9	D579 D583	D579-S581 PolarHBondContact O-N 2.89Å; D579-S581 PolarHBondContact O-OG 3.25Å; S581-D583 PolarHBondContact O-N 2.83Å
582	S	46.7	Very low	66.5	Low	116 Å²	116	59.8 Å²	59.8	81%	0.811	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-18.1	-152.5	47.2	0	0	0	0	118.7
583	D	50.3	Low	66.3	Low	138 Å²	138	60.1 Å²	60.1	74%	0.738	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	5	-161.1	-59.9	9.7	0	0	0	113	S581	S581-D583 PolarHBondContact O-N 2.83Å
584	R	52.1	Low	65.5	Low	87 Å²	87	61.7 Å²	61.7	33%	0.328	32%	0.315	S	S	.	.			trans	-112.7	101.9	-170.7	-58.1	-172.8	-173.4	-157.1	13.8	112.5	P551 M580 L586	P551-R584 HydrophobicContact CB-CG 4.03Å; P551-R584 HydrophobicContact CG-CG 4.05Å; P551-R584 WeakPolarHBondContact O-CD 3.28Å; P551-R584 PolarHBondContact O-NE 2.94Å; P551-R584 PolarHBondContact O-NH1 3.15Å; M580-R584 WeakPolarHBondContact CE-O 3.13Å; R584-L586 PolarHBondContact O-N 2.57Å
585	K	53.6	Low	64.3	Low	166 Å²	166	64.1 Å²	64.1	72%	0.722	33%	0.331	S	S	*	.			trans	-77.6	112.5	-179.4	-164	172.3	-172.9	176.4	0	112.3
586	L	62.7	Low	63.4	Low	36 Å²	36	64 Å²	64	19%	0.188	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	137.6	171.6	-170.8	66.2	0	0	0	110.6	M580 R584 Y589 A639 L952 M953	M580-L586 HydrophobicContact CE-CB 4.16Å; R584-L586 PolarHBondContact O-N 2.57Å; L586-Y589 HydrophobicContact CD2-CE2 4.33Å; L586-A639 HydrophobicContact CB-CB 4.17Å; L586-A639 HydrophobicContact CD2-CB 3.96Å; L586-A639 WeakPolarHBondContact CD2-O 3.46Å; L586-A639 HydrophobicContact CG-CB 3.87Å; L586-L952 HydrophobicContact CD1-CB 3.93Å; L586-L952 HydrophobicContact CD1-CD2 3.55Å; L586-L952 HydrophobicContact CD1-CG 4.32Å; L586-L952 HydrophobicContact CD2-CD2 3.98Å; L586-L952 HydrophobicContact CG-CD2 4.46Å; L586-M953 WeakPolarHBondContact CD1-O 3.37Å
587	L	64.5	Low	62.3	Low	80 Å²	80	67.7 Å²	67.7	42%	0.419	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	-25.4	172.4	-74.8	-164.2	0	0	0	113.5	M953 T955	L587-M953 WeakPolarHBondContact CA-O 3.23Å; L587-M953 HydrophobicContact CB-CE 3.99Å; L587-M953 HydrophobicContact CB-CG 4.49Å; L587-M953 WeakPolarHBondContact CB-O 3.42Å; L587-M953 HydrophobicContact CD1-CE 4.48Å; L587-M953 PolarHBondContact N-O 2.91Å; L587-T955 HydrophobicContact CD1-CG2 4.22Å; L587-T955 HydrophobicContact CD2-CG2 4.01Å; L587-T955 HydrophobicContact CG-CG2 3.96Å
588	G	70.3	Confident	60.8	Low	0 Å²	0	71.8 Å²	71.8	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.3	-168.6	-174.9	0	0	0	0	0	115.7	I637 L952 M953	G588-I637 CarbonylContact C-O 3.57Å; G588-I637 WeakPolarHBondContact CA-O 3.33Å; G588-L952 CarbonylContact O-C 3.56Å; G588-M953 PolarHBondContact N-O 2.74Å; G588-M953 VanDerWaalsContact N-O 3.09Å; G588-M953 PolarHBondContact O-N 2.65Å
589	Y	79.9	Confident	59.4	Low	1 Å²	1	69.7 Å²	69.7	0%	0.004	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	154.3	161.5	-61.5	-92.5	0	0	0	109.1	P557 W574 L586 I637 V950 A951 L952	P557-Y589 HydrophobicContact CB-CE1 4.38Å; P557-Y589 HydrophobicContact CG-CD1 4.11Å; P557-Y589 HydrophobicContact CG-CE1 4.2Å; W574-Y589 AromaticContact CD1-CD1 3.81Å; W574-Y589 AromaticContact CD1-CE1 3.44Å; W574-Y589 VanDerWaalsContact CD1-CE1 3.44Å; W574-Y589 AromaticContact CD1-CZ 3.83Å; W574-Y589 HydrophobicContact CZ2-CD2 4.29Å; W574-Y589 HydrophobicContact CZ2-CG 4.08Å; W574-Y589 AromaticContact NE1-CD1 3.19Å; W574-Y589 AromaticContact NE1-CD2 3.63Å; W574-Y589 AromaticContact NE1-CE1 3.15Å; W574-Y589 AromaticContact NE1-CE2 3.61Å; W574-Y589 AromaticContact NE1-CG 3.44Å; W574-Y589 AromaticContact NE1-CZ 3.39Å; L586-Y589 HydrophobicContact CD2-CE2 4.33Å; Y589-I637 HydrophobicContact CD2-CG2 4.48Å; Y589-I637 PolarHBondContact N-O 3.19Å; Y589-I637 WeakPolarHBondContact O-CB 3.47Å; Y589-I637 PolarHBondContact O-N 2.82Å; Y589-V950 HydrophobicContact CD1-CG1 4.08Å; Y589-V950 HydrophobicContact CG-CG1 4.46Å; Y589-A951 CarbonylContact C-O 3.4Å; Y589-A951 WeakPolarHBondContact CA-O 3.39Å; Y589-A951 WeakPolarHBondContact CB-O 3.36Å; Y589-L952 HydrophobicContact CD1-CB 4.47Å; Y589-L952 HydrophobicContact CD1-CD2 4.09Å; Y589-L952 HydrophobicContact CD1-CG 3.71Å; Y589-L952 HydrophobicContact CE1-CD1 4.33Å; Y589-L952 HydrophobicContact CE1-CD2 3.4Å; Y589-L952 HydrophobicContact CE1-CG 3.46Å; Y589-L952 VanDerWaalsContact CE1-CG 3.46Å
590	K	78.1	Confident	57.9	Low	52 Å²	52	67.8 Å²	67.8	23%	0.226	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	106.5	174.1	-168.3	169.6	-154.2	87.8	0	109	T634 D636 V950 A951 V958	K590-T634 HydrophobicContact CD-CG2 4.35Å; K590-T634 HydrophobicContact CG-CG2 4Å; K590-D636 VanDerWaalsContact CG-OD1 3.26Å; K590-D636 WeakPolarHBondContact CG-OD1 3.32Å; K590-D636 IonicContact NZ-OD1 3.41Å; K590-D636 PolarHBondContact NZ-OD1 2.67Å; K590-D636 IonicContact NZ-OD2 2.7Å; K590-D636 PolarHBondContact NZ-OD2 2.79Å; K590-V950 WeakPolarHBondContact O-CA 3.35Å; K590-A951 PolarHBondContact N-O 2.79Å; K590-A951 PolarHBondContact O-N 3.4Å; K590-V958 HydrophobicContact CB-CG1 3.98Å; K590-V958 HydrophobicContact CD-CG1 3.98Å; K590-V958 HydrophobicContact CD-CG2 3.87Å
591	L	80.9	Confident	56.8	Low	0 Å²	0	67.5 Å²	67.5	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	116.6	178.6	173.2	71.4	0	0	0	109.7	L572 F593 T634 R635 I637 Y644 F948 E949 V950	L572-L591 HydrophobicContact CD1-CD1 3.63Å; L572-L591 HydrophobicContact CD1-CD2 3.9Å; L572-L591 HydrophobicContact CD1-CG 4.45Å; L591-F593 HydrophobicContact CD2-CD1 4.23Å; L591-F593 HydrophobicContact CG-CD1 4.22Å; L591-T634 CarbonylContact O-C 3.54Å; L591-T634 WeakPolarHBondContact O-CA 3.39Å; L591-R635 HydrophobicContact CB-CB 4.37Å; L591-R635 PolarHBondContact N-O 2.94Å; L591-R635 PolarHBondContact O-N 3.18Å; L591-I637 HydrophobicContact CB-CD1 3.41Å; L591-I637 VanDerWaalsContact CB-CD1 3.41Å; L591-I637 HydrophobicContact CB-CG1 4.39Å; L591-I637 HydrophobicContact CD2-CD1 3.89Å; L591-I637 HydrophobicContact CG-CD1 4.27Å; L591-Y644 HydrophobicContact CD2-CD1 3.62Å; L591-Y644 HydrophobicContact CD2-CD2 3.88Å; L591-Y644 HydrophobicContact CD2-CE1 3.7Å; L591-Y644 HydrophobicContact CD2-CE2 3.88Å; L591-Y644 HydrophobicContact CD2-CG 3.72Å; L591-F948 HydrophobicContact CD1-CB 4.27Å; L591-F948 HydrophobicContact CD1-CD1 4.09Å; L591-E949 CarbonylContact C-O 3.58Å; L591-E949 VanDerWaalsContact CA-O 3.29Å; L591-E949 WeakPolarHBondContact CA-O 3.3Å; L591-V950 HydrophobicContact CD1-CG2 3.55Å
592	K	78.4	Confident	56.2	Low	81 Å²	81	67.2 Å²	67.2	35%	0.352	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	149.8	161.7	-72.1	174.5	171.8	177.8	0	110	E633 T634 F948 E949	K592-E633 CarbonylContact C-O 3.56Å; K592-E633 VanDerWaalsContact CA-O 3.32Å; K592-E633 WeakPolarHBondContact CA-O 3.02Å; K592-T634 HydrophobicContact CG-CG2 3.87Å; K592-F948 CarbonylContact O-C 3.05Å; K592-F948 WeakPolarHBondContact O-CA 3.37Å; K592-E949 HydrophobicContact CB-CB 4.09Å; K592-E949 HydrophobicContact CB-CG 3.99Å; K592-E949 WeakPolarHBondContact CD-OE2 2.81Å; K592-E949 PolarHBondContact N-O 3.15Å; K592-E949 IonicContact NZ-OE2 3.27Å; K592-E949 PolarHBondContact O-N 2.04Å
593	F	75.7	Confident	55.5	Low	7 Å²	7	64.3 Å²	64.3	3%	0.031	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	152.6	162.8	59.6	-85.9	0	0	0	113.6	L591 T632 E633 R635 L646 Y946 L947 F948	L591-F593 HydrophobicContact CD2-CD1 4.23Å; L591-F593 HydrophobicContact CG-CD1 4.22Å; F593-T632 CarbonylContact O-C 3.47Å; F593-E633 HydrophobicContact CD1-CB 4.49Å; F593-E633 HydrophobicContact CD2-CB 4.32Å; F593-E633 HydrophobicContact CE1-CB 4.05Å; F593-E633 HydrophobicContact CE2-CB 3.86Å; F593-E633 HydrophobicContact CE2-CG 4.43Å; F593-E633 WeakPolarHBondContact CE2-OE2 3.4Å; F593-E633 HydrophobicContact CZ-CB 3.71Å; F593-E633 WeakPolarHBondContact CZ-OE2 3.35Å; F593-E633 PolarHBondContact N-O 3.01Å; F593-E633 PolarHBondContact O-N 2.94Å; F593-R635 HydrophobicContact CE1-CG 4.08Å; F593-L646 HydrophobicContact CD2-CD2 4.46Å; F593-L646 HydrophobicContact CE1-CD1 4.12Å; F593-L646 HydrophobicContact CE2-CD1 4.08Å; F593-L646 HydrophobicContact CE2-CD2 4.19Å; F593-L646 HydrophobicContact CZ-CD1 3.65Å; F593-Y946 HydrophobicContact CD2-CD1 4.38Å; F593-L947 CarbonylContact C-O 3.48Å; F593-L947 WeakPolarHBondContact CA-O 3.45Å; F593-F948 HydrophobicContact CB-CD1 3.38Å; F593-F948 HydrophobicContact CB-CE1 3.55Å; F593-F948 HydrophobicContact CB-CG 4.17Å; F593-F948 HydrophobicContact CB-CZ 4.45Å; F593-F948 HydrophobicContact CD1-CD1 4.43Å; F593-F948 HydrophobicContact CD1-CE1 4.35Å; F593-F948 HydrophobicContact CD2-CE1 4.4Å; F593-F948 HydrophobicContact CG-CD1 4.09Å; F593-F948 AromaticContact CG-CE1 3.89Å; F593-F948 HydrophobicContact CG-CE1 3.89Å
594	R	66.9	Low	54.5	Low	76 Å²	76	58.6 Å²	58.6	29%	0.287	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	157.5	177.9	59.8	-179.8	-176.7	85.8	-4.5	110.4	A596 T632 Y946 L947	R594-A596 PolarHBondContact O-N 2.85Å; R594-T632 HydrophobicContact CB-CG2 4.16Å; R594-Y946 CarbonylContact O-C 3.59Å; R594-Y946 WeakPolarHBondContact O-CA 3.34Å; R594-L947 HydrophobicContact CG-CB 4.35Å; R594-L947 PolarHBondContact N-O 3Å; R594-L947 VanDerWaalsContact NH2-CD2 3.26Å; R594-L947 PolarHBondContact O-N 3.2Å
595	P	59.5	Low	53.5	Low	53 Å²	53	59.2 Å²	59.2	34%	0.344	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.8	132.2	164.3	-24.9	35.1	0	0	0	111.1	T597 Y946	P595-T597 PolarHBondContact O-N 2.85Å; P595-Y946 HydrophobicContact CG-CE1 4.3Å
596	A	58.4	Low	52.4	Low	10 Å²	10	56.9 Å²	56.9	8%	0.083	33%	0.328	C	S	.	.			trans	-75	121.7	175.2	0	0	0	0	0	109.1	R594 T598 T945 L947	R594-A596 PolarHBondContact O-N 2.85Å; A596-T598 PolarHBondContact O-N 2.94Å; A596-T945 HydrophobicContact CB-CG2 3.65Å; A596-T945 PolarHBondContact N-O 3.45Å; A596-L947 HydrophobicContact CB-CB 4.45Å
597	T	48.3	Very low	50.9	Low	121 Å²	121	58.2 Å²	58.2	74%	0.742	34%	0.34	S	S	*	.			trans	-82.8	75.1	-169.1	44.2	0	0	0	0	111.9	P595 S599	P595-T597 PolarHBondContact O-N 2.85Å; T597-S599 PolarHBondContact O-N 2.8Å
598	T	35	Very low	49.1	Very low	96 Å²	96	61 Å²	61	59%	0.589	36%	0.355	S	S	*	.			trans	-71.8	110.5	173.5	53.2	0	0	0	0	111.9	A596 S600	A596-T598 PolarHBondContact O-N 2.94Å; T598-S600 PolarHBondContact O-N 3.06Å
599	S	31.7	Very low	47.2	Very low	85 Å²	85	66.8 Å²	66.8	59%	0.594	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	37.5	70.8	148.6	60.7	0	0	0	0	118.5	T597 S601	T597-S599 PolarHBondContact O-N 2.8Å; S599-S601 VanDerWaalsContact C-N 3.28Å; S599-S601 WeakPolarHBondContact O-CB 3.36Å; S599-S601 PolarHBondContact O-N 3.29Å; S599-S601 PolarHBondContact O-OG 3.32Å
600	S	26.3	Very low	44.8	Very low	69 Å²	69	74.6 Å²	74.6	48%	0.483	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.6	32.4	140.9	68.3	0	0	0	0	119.5	T598 C2139	T598-S600 PolarHBondContact O-N 3.06Å; S600-C2139 VanDerWaalsContact O-CB 3.31Å; S600-C2139 WeakPolarHBondContact O-CB 3.38Å
601	S	29.2	Very low	42.4	Very low	71 Å²	71	77.4 Å²	77.4	50%	0.497	45%	0.451	S	S	.	.			trans	-155.1	26	-172.3	56.5	0	0	0	0	114.4	S599 E2166	S599-S601 VanDerWaalsContact C-N 3.28Å; S599-S601 WeakPolarHBondContact O-CB 3.36Å; S599-S601 PolarHBondContact O-N 3.29Å; S599-S601 PolarHBondContact O-OG 3.32Å; S601-E2166 VanDerWaalsContact CA-OE2 3.24Å; S601-E2166 WeakPolarHBondContact CA-OE2 3.5Å
602	A	32.4	Very low	39.8	Very low	66 Å²	66	83.2 Å²	83.2	55%	0.545	49%	0.489	S	S	.	.	S	Bend	trans	-140	20.8	180	0	0	0	0	0	112.8	E2166	A602-E2166 PolarHBondContact N-OE2 3.04Å
603	V	30.5	Very low	37.5	Very low	55 Å²	55	88 Å²	88	33%	0.333	52%	0.517	S	S	.	.	S	Bend	trans	-113.6	-21	-172.1	-176.8	0	0	0	0	112	G2138 E2166	V603-G2138 VanDerWaalsContact CG1-N 3.29Å; V603-E2166 PolarHBondContact N-OE2 2.9Å; V603-E2166 VanDerWaalsContact N-OE2 3.07Å
604	D	30.3	Very low	35.4	Very low	19 Å²	19	92.9 Å²	92.9	10%	0.102	55%	0.552	C	S	.	*	G	3₁₀ helix	trans	-82.6	-28.7	-177.9	-52.9	-7.2	0	0	0	111.5	I606 S607 Q2137 C2139 E2166 G2167	D604-I606 PolarHBondContact O-N 3.31Å; D604-S607 WeakPolarHBondContact O-CB 3.47Å; D604-S607 PolarHBondContact O-N 2.82Å; D604-S607 PolarHBondContact O-OG 2.95Å; D604-Q2137 VanDerWaalsContact CG-CD 3.49Å; D604-Q2137 VanDerWaalsContact OD1-CB 3.23Å; D604-Q2137 WeakPolarHBondContact OD1-CB 3Å; D604-Q2137 VanDerWaalsContact OD1-CD 3.23Å; D604-Q2137 WeakPolarHBondContact OD1-CG 3.27Å; D604-C2139 VanDerWaalsContact CG-SG 3.59Å; D604-C2139 PolarHBondContact OD1-SG 2.82Å; D604-C2139 PolarHBondContact OD2-SG 3.2Å; D604-E2166 VanDerWaalsContact CB-CD 3.44Å; D604-E2166 HydrophobicContact CB-CG 3.85Å; D604-E2166 WeakPolarHBondContact CB-OE1 3.42Å; D604-E2166 PolarHBondContact N-OE1 2.86Å; D604-E2166 VanDerWaalsContact N-OE1 3.1Å; D604-E2166 PolarHBondContact N-OE2 2.86Å; D604-E2166 VanDerWaalsContact OD2-CB 3.23Å; D604-E2166 WeakPolarHBondContact OD2-CB 3.3Å; D604-E2166 WeakPolarHBondContact OD2-CG 3.37Å; D604-G2167 PolarHBondContact OD2-N 2.84Å
605	Q	31.4	Very low	33.5	Very low	99 Å²	99	93.4 Å²	93.4	46%	0.463	57%	0.568	S	S	.	*	G	3₁₀ helix	trans	-61.1	-1.3	178.1	-63.3	-166.1	37.6	0	0	116	R1002 E2166	Q605-R1002 VanDerWaalsContact OE1-NH1 3.13Å; Q605-E2166 WeakPolarHBondContact CG-OE1 3.36Å; Q605-E2166 PolarHBondContact N-OE1 3.42Å
606	I	30.8	Very low	32.1	Very low	117 Å²	117	94 Å²	94	60%	0.6	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-100.1	-1.7	174.6	-59.7	177.2	0	0	0	111.2	D604	D604-I606 PolarHBondContact O-N 3.31Å
607	S	29.7	Very low	30.8	Very low	64 Å²	64	97.4 Å²	97.4	45%	0.448	60%	0.6	S	S	.	*	S	Bend	trans	-76.8	-32.5	-177.9	-47.2	0	0	0	0	114	D604 V609 Q2137	D604-S607 WeakPolarHBondContact O-CB 3.47Å; D604-S607 PolarHBondContact O-N 2.82Å; D604-S607 PolarHBondContact O-OG 2.95Å; S607-V609 VanDerWaalsContact C-N 3.27Å; S607-V609 PolarHBondContact O-N 3.49Å; S607-Q2137 PolarHBondContact OG-NE2 3.01Å; S607-Q2137 VanDerWaalsContact OG-NE2 3.14Å
608	D	28.5	Very low	30.1	Very low	139 Å²	139	95.8 Å²	95.8	74%	0.743	59%	0.587	S	S	*	*			trans	-82	30.4	-159.1	-62.9	-19.3	0	0	0	115.9
609	V	29.1	Very low	30.2	Very low	122 Å²	122	95.7 Å²	95.7	74%	0.739	58%	0.58	S	S	*	*			trans	-127	79.2	-176.6	-168.4	0	0	0	0	112.4	S607	S607-V609 VanDerWaalsContact C-N 3.27Å; S607-V609 PolarHBondContact O-N 3.49Å
610	K	29.2	Very low	30.5	Very low	164 Å²	164	97 Å²	97	71%	0.713	58%	0.576	S	S	*	*			trans	-145.4	115.7	150.5	-82.6	-151	173.6	-160.3	0	111	E619	K610-E619 IonicContact NZ-OE1 3.85Å; K610-E619 PolarHBondContact NZ-OE1 3.3Å
611	S	27.2	Very low	30.8	Very low	111 Å²	111	97.7 Å²	97.7	78%	0.776	57%	0.572	S	S	*	*			trans	-142.1	148.9	162.7	56	0	0	0	0	108.6
612	P	28.3	Very low	31.1	Very low	123 Å²	123	97.4 Å²	97.4	80%	0.799	56%	0.564	S	S	*	*			trans	-99	140.4	-140.4	35.3	-35.6	0	0	0	115.7
613	L	29.7	Very low	31.3	Very low	181 Å²	181	100.7 Å²	100.7	95%	0.948	57%	0.566	S	S	*	*			trans	-159.8	165.4	158.6	-100.7	139.6	0	0	0	108.7
614	S	30.3	Very low	31.6	Very low	109 Å²	109	102.6 Å²	102.6	76%	0.762	57%	0.57	S	S	*	*			trans	-116.6	122.4	-152.7	53.2	0	0	0	0	116.1
615	S	28.3	Very low	31.6	Very low	88 Å²	88	107.4 Å²	107.4	62%	0.615	59%	0.592	S	S	*	*			trans	-172.7	144.3	145	46.5	0	0	0	0	111.4	S617	S615-S617 PolarHBondContact O-N 3.5Å
616	A	29.5	Very low	31.7	Very low	66 Å²	66	109.7 Å²	109.7	55%	0.545	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69	1.3	-169.9	0	0	0	0	0	116.8	D1810	A616-D1810 HydrophobicContact CB-CB 3.68Å
617	S	31.3	Very low	31.7	Very low	81 Å²	81	112.1 Å²	112.1	57%	0.566	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-21.2	-173.4	43.4	0	0	0	0	115.2	S615	S615-S617 PolarHBondContact O-N 3.5Å
618	D	34	Very low	31.8	Very low	87 Å²	87	115.2 Å²	115.2	47%	0.465	61%	0.614	S	S	.	*	H	α-helix	trans	-101.6	-23.5	-152.9	-68.9	19.1	0	0	0	114.9	E620 E621 I622	D618-E620 PolarHBondContact O-N 3.19Å; D618-E621 PolarHBondContact O-N 2.79Å; D618-I622 WeakPolarHBondContact O-CG1 3Å; D618-I622 PolarHBondContact O-N 2.77Å
619	E	36.4	Very low	32.1	Very low	94 Å²	94	112.1 Å²	112.1	44%	0.439	60%	0.604	S	S	.	*	H	α-helix	trans	-59.9	-32.8	179.2	-90.8	-90.1	129.6	0	0	112.6	K610 K623	K610-E619 IonicContact NZ-OE1 3.85Å; K610-E619 PolarHBondContact NZ-OE1 3.3Å; E619-K623 WeakPolarHBondContact O-CG 3.04Å; E619-K623 PolarHBondContact O-N 2.86Å; E619-K623 VanDerWaalsContact O-N 3.13Å
620	E	37.2	Very low	32.4	Very low	112 Å²	112	113.8 Å²	113.8	52%	0.523	60%	0.601	S	S	.	*	H	α-helix	trans	-77.5	-35.9	-178.3	-141.4	-105.4	160.3	0	0	111.3	D618 K623 K624	D618-E620 PolarHBondContact O-N 3.19Å; E620-K623 PolarHBondContact O-N 2.89Å; E620-K624 VanDerWaalsContact CD-CE 3.5Å; E620-K624 WeakPolarHBondContact O-CG 3.46Å; E620-K624 PolarHBondContact O-N 2.63Å; E620-K624 WeakPolarHBondContact OE1-CE 3.13Å; E620-K624 IonicContact OE1-NZ 3.65Å; E620-K624 PolarHBondContact OE1-NZ 3.17Å; E620-K624 WeakPolarHBondContact OE2-CE 3.35Å; E620-K624 IonicContact OE2-NZ 2.77Å; E620-K624 PolarHBondContact OE2-NZ 3.3Å
621	E	33.1	Very low	32.8	Very low	84 Å²	84	109.8 Å²	109.8	39%	0.393	59%	0.587	S	S	.	*	H	α-helix	trans	-71.4	-33.6	171.1	-168.3	158.6	-114.4	0	0	111.9	D618 K623 K624 Q625 R922	D618-E621 PolarHBondContact O-N 2.79Å; E621-K623 PolarHBondContact O-N 3.07Å; E621-K624 CarbonylContact O-C 3.59Å; E621-K624 PolarHBondContact O-N 3.24Å; E621-Q625 HydrophobicContact CG-CG 4.47Å; E621-Q625 WeakPolarHBondContact O-CB 3.01Å; E621-Q625 VanDerWaalsContact O-CG 3.31Å; E621-Q625 WeakPolarHBondContact O-CG 3.35Å; E621-Q625 PolarHBondContact O-N 3.25Å; E621-R922 IonicContact OE1-CZ 3.61Å; E621-R922 IonicContact OE1-NH2 2.77Å; E621-R922 PolarHBondContact OE1-NH2 2.86Å
622	I	35.3	Very low	33.8	Very low	65 Å²	65	107.7 Å²	107.7	33%	0.333	57%	0.57	S	S	.	*	H	α-helix	trans	-62.9	-39.4	172.1	-69.8	165.8	0	0	0	111.6	D618 Q625 K626	D618-I622 WeakPolarHBondContact O-CG1 3Å; D618-I622 PolarHBondContact O-N 2.77Å; I622-Q625 PolarHBondContact O-N 3.09Å; I622-K626 PolarHBondContact O-N 3.25Å; I622-K626 VanDerWaalsContact O-N 3.08Å
623	K	36.9	Very low	35	Very low	134 Å²	134	103.2 Å²	103.2	58%	0.583	54%	0.538	S	S	*	.	H	α-helix	trans	-63.1	-47.3	171.9	-74.4	169.1	-175.6	162.9	0	111.1	E619 E620 E621 Q625 K626 Q627	E619-K623 WeakPolarHBondContact O-CG 3.04Å; E619-K623 PolarHBondContact O-N 2.86Å; E619-K623 VanDerWaalsContact O-N 3.13Å; E620-K623 PolarHBondContact O-N 2.89Å; E621-K623 PolarHBondContact O-N 3.07Å; K623-Q625 VanDerWaalsContact C-N 3.3Å; K623-Q625 PolarHBondContact O-N 3.35Å; K623-K626 PolarHBondContact O-N 2.79Å; K623-Q627 PolarHBondContact O-N 3.16Å
624	K	36.5	Very low	36.4	Very low	95 Å²	95	97.7 Å²	97.7	41%	0.413	51%	0.512	S	S	.	.	H	α-helix	trans	-64.6	-29.9	178.3	-72.1	169.2	178.5	168.8	0	113	E620 E621	E620-K624 VanDerWaalsContact CD-CE 3.5Å; E620-K624 WeakPolarHBondContact O-CG 3.46Å; E620-K624 PolarHBondContact O-N 2.63Å; E620-K624 WeakPolarHBondContact OE1-CE 3.13Å; E620-K624 IonicContact OE1-NZ 3.65Å; E620-K624 PolarHBondContact OE1-NZ 3.17Å; E620-K624 WeakPolarHBondContact OE2-CE 3.35Å; E620-K624 IonicContact OE2-NZ 2.77Å; E620-K624 PolarHBondContact OE2-NZ 3.3Å; E621-K624 CarbonylContact O-C 3.59Å; E621-K624 PolarHBondContact O-N 3.24Å
625	Q	31.8	Very low	37.9	Very low	121 Å²	121	94.5 Å²	94.5	57%	0.565	48%	0.483	S	S	*	.	H	α-helix	trans	-71.2	-46	171.9	-75.1	178.8	19.2	0	0	112.6	E621 I622 K623 Q627 K628	E621-Q625 HydrophobicContact CG-CG 4.47Å; E621-Q625 WeakPolarHBondContact O-CB 3.01Å; E621-Q625 VanDerWaalsContact O-CG 3.31Å; E621-Q625 WeakPolarHBondContact O-CG 3.35Å; E621-Q625 PolarHBondContact O-N 3.25Å; I622-Q625 PolarHBondContact O-N 3.09Å; K623-Q625 VanDerWaalsContact C-N 3.3Å; K623-Q625 PolarHBondContact O-N 3.35Å; Q625-Q627 PolarHBondContact O-N 2.9Å; Q625-Q627 VanDerWaalsContact O-N 3.16Å; Q625-K628 PolarHBondContact O-N 3.36Å; Q625-K628 VanDerWaalsContact O-N 3.13Å
626	K	31.8	Very low	39.8	Very low	147 Å²	147	93.6 Å²	93.6	64%	0.639	47%	0.472	S	S	*	.	H	α-helix	trans	-61.9	-23	180	-78.5	-170.8	174.9	-172.3	0	114	I622 K623	I622-K626 PolarHBondContact O-N 3.25Å; I622-K626 VanDerWaalsContact O-N 3.08Å; K623-K626 PolarHBondContact O-N 2.79Å
627	Q	32.1	Very low	41.6	Very low	167 Å²	167	91 Å²	91	78%	0.78	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-14.2	179	-157	163	3.6	0	0	113.9	K623 Q625	K623-Q627 PolarHBondContact O-N 3.16Å; Q625-Q627 PolarHBondContact O-N 2.9Å; Q625-Q627 VanDerWaalsContact O-N 3.16Å
628	K	32.1	Very low	43.1	Very low	129 Å²	129	91.4 Å²	91.4	56%	0.561	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-22.4	178.3	-89.5	-169.1	169.8	-170.6	0	114.9	Q625 F630 I631	Q625-K628 PolarHBondContact O-N 3.36Å; Q625-K628 VanDerWaalsContact O-N 3.13Å; K628-F630 VanDerWaalsContact C-N 3.32Å; K628-F630 PolarHBondContact O-N 2.79Å; K628-I631 HydrophobicContact CG-CD1 4.49Å
629	S	34.3	Very low	44.4	Very low	74 Å²	74	88.4 Å²	88.4	52%	0.517	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	10.1	-164.7	73.4	0	0	0	0	116.7
630	F	34.9	Very low	45.4	Very low	158 Å²	158	87.2 Å²	87.2	69%	0.693	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.4	20.7	-176.1	-74.5	-76.1	0	0	0	113.3	K628	K628-F630 VanDerWaalsContact C-N 3.32Å; K628-F630 PolarHBondContact O-N 2.79Å
631	I	37.3	Very low	46.5	Very low	79 Å²	79	83.2 Å²	83.2	41%	0.405	42%	0.417	S	S	.	.			trans	-72.7	132.9	-179.4	-60.1	173.3	0	0	0	109.5	K628 E633	K628-I631 HydrophobicContact CG-CD1 4.49Å; I631-E633 HydrophobicContact CG2-CG 3.81Å
632	T	49.7	Very low	48.1	Very low	68 Å²	68	79.8 Å²	79.8	42%	0.417	40%	0.401	S	S	.	.			trans	-90.9	110.3	163.3	-63.3	0	0	0	0	107.2	F593 R594	F593-T632 CarbonylContact O-C 3.47Å; R594-T632 HydrophobicContact CB-CG2 4.16Å
633	E	52.7	Low	50	Low	28 Å²	28	80.2 Å²	80.2	13%	0.131	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	139.6	-175.2	-67	-178.6	170.4	0	0	109.7	K592 F593 I631 D938	K592-E633 CarbonylContact C-O 3.56Å; K592-E633 VanDerWaalsContact CA-O 3.32Å; K592-E633 WeakPolarHBondContact CA-O 3.02Å; F593-E633 HydrophobicContact CD1-CB 4.49Å; F593-E633 HydrophobicContact CD2-CB 4.32Å; F593-E633 HydrophobicContact CE1-CB 4.05Å; F593-E633 HydrophobicContact CE2-CB 3.86Å; F593-E633 HydrophobicContact CE2-CG 4.43Å; F593-E633 WeakPolarHBondContact CE2-OE2 3.4Å; F593-E633 HydrophobicContact CZ-CB 3.71Å; F593-E633 WeakPolarHBondContact CZ-OE2 3.35Å; F593-E633 PolarHBondContact N-O 3.01Å; F593-E633 PolarHBondContact O-N 2.94Å; I631-E633 HydrophobicContact CG2-CG 3.81Å; E633-D938 WeakPolarHBondContact OE2-CB 2.65Å
634	T	58.8	Low	51.6	Low	66 Å²	66	74.5 Å²	74.5	41%	0.405	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	124.9	-179	-53.2	0	0	0	0	108.9	K590 L591 K592	K590-T634 HydrophobicContact CD-CG2 4.35Å; K590-T634 HydrophobicContact CG-CG2 4Å; L591-T634 CarbonylContact O-C 3.54Å; L591-T634 WeakPolarHBondContact O-CA 3.39Å; K592-T634 HydrophobicContact CG-CG2 3.87Å
635	R	62.5	Low	53.1	Low	42 Å²	42	73.7 Å²	73.7	16%	0.158	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	119.9	-177.5	-67.9	-78.1	-176.5	-174	-1.2	108.7	L591 F593 I637 Y644 S935 D938	L591-R635 HydrophobicContact CB-CB 4.37Å; L591-R635 PolarHBondContact N-O 2.94Å; L591-R635 PolarHBondContact O-N 3.18Å; F593-R635 HydrophobicContact CE1-CG 4.08Å; R635-I637 HydrophobicContact CB-CG1 4.46Å; R635-Y644 HydrophobicContact CB-CE2 4.42Å; R635-Y644 WeakPolarHBondContact CG-OH 3.49Å; R635-S935 PolarHBondContact NH2-OG 2.87Å; R635-D938 IonicContact CZ-OD2 3.54Å; R635-D938 IonicContact NE-OD2 3.59Å; R635-D938 IonicContact NH2-OD1 2.68Å; R635-D938 IonicContact NH2-OD2 2.78Å; R635-D938 PolarHBondContact NH2-OD2 3.36Å
636	D	68	Low	54.6	Low	69 Å²	69	68 Å²	68	37%	0.369	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	135	163.2	-70.3	-53.8	0	0	0	109	K590 F932	K590-D636 VanDerWaalsContact CG-OD1 3.26Å; K590-D636 WeakPolarHBondContact CG-OD1 3.32Å; K590-D636 IonicContact NZ-OD1 3.41Å; K590-D636 PolarHBondContact NZ-OD1 2.67Å; K590-D636 IonicContact NZ-OD2 2.7Å; K590-D636 PolarHBondContact NZ-OD2 2.79Å; D636-F932 WeakPolarHBondContact O-CE2 3.06Å
637	I	65.8	Low	55.5	Low	10 Å²	10	62 Å²	62	5%	0.051	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	143.6	-167.9	-68.3	174.7	0	0	0	107.9	W574 G588 Y589 L591 R635 A641 Y644	W574-I637 HydrophobicContact CH2-CD1 3.8Å; W574-I637 HydrophobicContact CZ2-CD1 4.19Å; W574-I637 HydrophobicContact CZ2-CG2 4.32Å; G588-I637 CarbonylContact C-O 3.57Å; G588-I637 WeakPolarHBondContact CA-O 3.33Å; Y589-I637 HydrophobicContact CD2-CG2 4.48Å; Y589-I637 PolarHBondContact N-O 3.19Å; Y589-I637 WeakPolarHBondContact O-CB 3.47Å; Y589-I637 PolarHBondContact O-N 2.82Å; L591-I637 HydrophobicContact CB-CD1 3.41Å; L591-I637 VanDerWaalsContact CB-CD1 3.41Å; L591-I637 HydrophobicContact CB-CG1 4.39Å; L591-I637 HydrophobicContact CD2-CD1 3.89Å; L591-I637 HydrophobicContact CG-CD1 4.27Å; R635-I637 HydrophobicContact CB-CG1 4.46Å; I637-A641 HydrophobicContact CG2-CB 3.44Å; I637-A641 VanDerWaalsContact CG2-CB 3.44Å; I637-Y644 HydrophobicContact CD1-CD2 3.36Å; I637-Y644 HydrophobicContact CD1-CE2 3.82Å; I637-Y644 HydrophobicContact CD1-CG 4.16Å; I637-Y644 HydrophobicContact CG1-CD2 3.97Å; I637-Y644 HydrophobicContact CG1-CE2 4.12Å
638	D	63.5	Low	55.9	Low	90 Å²	90	55.6 Å²	55.6	48%	0.481	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	155.1	-177.1	-161.7	0.1	0	0	0	112.9	T640 A641	D638-T640 PolarHBondContact O-N 2.89Å; D638-T640 VanDerWaalsContact O-N 3.12Å; D638-A641 PolarHBondContact O-N 3.04Å
639	A	61.5	Low	55.7	Low	25 Å²	25	53.4 Å²	53.4	21%	0.207	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-23.9	-173.2	0	0	0	0	0	113.8	L586	L586-A639 HydrophobicContact CB-CB 4.17Å; L586-A639 HydrophobicContact CD2-CB 3.96Å; L586-A639 WeakPolarHBondContact CD2-O 3.46Å; L586-A639 HydrophobicContact CG-CB 3.87Å
640	T	57.3	Low	55.4	Low	69 Å²	69	54.2 Å²	54.2	42%	0.423	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-21.8	177.6	54.4	0	0	0	0	113.1	D638 T642 P756	D638-T640 PolarHBondContact O-N 2.89Å; D638-T640 VanDerWaalsContact O-N 3.12Å; T640-T642 PolarHBondContact O-N 2.96Å; T640-P756 CarbonylContact C-O 3.56Å; T640-P756 CarbonylContact O-C 3.54Å
641	A	60	Low	55.1	Low	27 Å²	27	50.5 Å²	50.5	22%	0.223	28%	0.279	C	S	.	.			trans	-82.7	86.5	-168.2	0	0	0	0	0	112.2	W574 I637 D638 Q643	W574-A641 WeakPolarHBondContact CZ2-O 3.3Å; I637-A641 HydrophobicContact CG2-CB 3.44Å; I637-A641 VanDerWaalsContact CG2-CB 3.44Å; D638-A641 PolarHBondContact O-N 3.04Å; A641-Q643 PolarHBondContact O-N 3.29Å
642	T	68.2	Low	54.8	Low	12 Å²	12	48.7 Å²	48.7	7%	0.074	27%	0.273	C	S	.	.			trans	-80.8	15.1	173.9	79.4	0	0	0	0	113.5	W574 P576 T640 L754 R755	W574-T642 PolarHBondContact N-O 2.93Å; W574-T642 WeakPolarHBondContact O-CB 3.37Å; P576-T642 HydrophobicContact CG-CG2 4.41Å; T640-T642 PolarHBondContact O-N 2.96Å; T642-L754 WeakPolarHBondContact CG2-O 3.22Å; T642-R755 PolarHBondContact OG1-N 3.1Å
643	Q	74.2	Confident	53.9	Low	74 Å²	74	46.1 Å²	46.1	35%	0.346	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	152.1	179.2	58.4	173.7	-9.6	0	0	110.4	H571 L572 T573 A641	H571-Q643 PolarHBondContact NE2-OE1 2.91Å; L572-Q643 CarbonylContact O-C 3.56Å; L572-Q643 WeakPolarHBondContact O-CA 3.31Å; L572-Q643 WeakPolarHBondContact O-CB 3.48Å; T573-Q643 HydrophobicContact CG2-CB 4.07Å; A641-Q643 PolarHBondContact O-N 3.29Å
644	Y	70.7	Confident	52.9	Low	14 Å²	14	49.7 Å²	49.7	6%	0.055	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	137	-179.2	-175.5	-80.1	0	0	0	109.9	L572 L591 R635 I637 L646 F932	L572-Y644 HydrophobicContact CD1-CD1 4.29Å; L572-Y644 PolarHBondContact N-O 2.69Å; L572-Y644 PolarHBondContact O-N 3.16Å; L591-Y644 HydrophobicContact CD2-CD1 3.62Å; L591-Y644 HydrophobicContact CD2-CD2 3.88Å; L591-Y644 HydrophobicContact CD2-CE1 3.7Å; L591-Y644 HydrophobicContact CD2-CE2 3.88Å; L591-Y644 HydrophobicContact CD2-CG 3.72Å; R635-Y644 HydrophobicContact CB-CE2 4.42Å; R635-Y644 WeakPolarHBondContact CG-OH 3.49Å; I637-Y644 HydrophobicContact CD1-CD2 3.36Å; I637-Y644 HydrophobicContact CD1-CE2 3.82Å; I637-Y644 HydrophobicContact CD1-CG 4.16Å; I637-Y644 HydrophobicContact CG1-CD2 3.97Å; I637-Y644 HydrophobicContact CG1-CE2 4.12Å; Y644-L646 HydrophobicContact CE1-CB 4.27Å; Y644-L646 HydrophobicContact CE1-CD1 3.84Å; Y644-F932 HydrophobicContact CD2-CB 4.36Å; Y644-F932 HydrophobicContact CE2-CB 3.44Å; Y644-F932 VanDerWaalsContact CE2-CB 3.44Å; Y644-F932 HydrophobicContact CE2-CG 4.44Å; Y644-F932 VanDerWaalsContact CZ-O 3.25Å; Y644-F932 PolarHBondContact OH-O 3.28Å; Y644-F932 VanDerWaalsContact OH-O 3.13Å
645	L	67.2	Low	51.6	Low	79 Å²	79	53.1 Å²	53.1	41%	0.414	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	101.1	-175.9	178.5	61.6	0	0	0	109.5	N569 H571 T647	N569-L645 HydrophobicContact CB-CD1 4.34Å; H571-L645 HydrophobicContact CB-CD1 3.9Å; L645-T647 HydrophobicContact CD1-CG2 3.97Å; L645-T647 HydrophobicContact CD2-CG2 4.02Å; L645-T647 HydrophobicContact CG-CG2 3.67Å
646	L	64.4	Low	50.2	Low	1 Å²	1	55.5 Å²	55.5	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	126.1	170.2	-157.1	72.4	0	0	0	107.3	N569 I570 F593 Y644 I940 F948	N569-L646 CarbonylContact C-O 3.24Å; N569-L646 WeakPolarHBondContact CA-O 2.97Å; N569-L646 WeakPolarHBondContact CB-O 2.75Å; I570-L646 HydrophobicContact CB-CB 4.31Å; I570-L646 PolarHBondContact N-O 3.48Å; I570-L646 PolarHBondContact O-N 2.74Å; F593-L646 HydrophobicContact CD2-CD2 4.46Å; F593-L646 HydrophobicContact CE1-CD1 4.12Å; F593-L646 HydrophobicContact CE2-CD1 4.08Å; F593-L646 HydrophobicContact CE2-CD2 4.19Å; F593-L646 HydrophobicContact CZ-CD1 3.65Å; Y644-L646 HydrophobicContact CE1-CB 4.27Å; Y644-L646 HydrophobicContact CE1-CD1 3.84Å; L646-I940 HydrophobicContact CB-CD1 3.95Å; L646-I940 HydrophobicContact CD2-CD1 3.74Å; L646-I940 HydrophobicContact CD2-CG1 3.88Å; L646-I940 HydrophobicContact CG-CD1 3.6Å; L646-I940 HydrophobicContact CG-CG1 4Å; L646-F948 HydrophobicContact CD2-CE1 4.21Å; L646-F948 HydrophobicContact CD2-CZ 4.26Å
647	T	50.4	Low	48.5	Very low	22 Å²	22	56 Å²	56	14%	0.135	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	124.8	-177.5	47.1	0	0	0	0	112.2	T568 N569 L645	T568-T647 CarbonylContact O-C 3.6Å; T568-T647 VanDerWaalsContact O-CA 3.3Å; T568-T647 WeakPolarHBondContact O-CA 2.91Å; N569-T647 HydrophobicContact CB-CG2 3.53Å; L645-T647 HydrophobicContact CD1-CG2 3.97Å; L645-T647 HydrophobicContact CD2-CG2 4.02Å; L645-T647 HydrophobicContact CG-CG2 3.67Å
648	D	40.7	Very low	46.9	Very low	31 Å²	31	57.7 Å²	57.7	17%	0.166	30%	0.301	C	S	.	.			trans	-68.4	138	161.5	-54	-72.3	0	0	0	110.3	T568 E650 I940	T568-D648 VanDerWaalsContact CA-OD2 3.28Å; T568-D648 WeakPolarHBondContact CA-OD2 3.18Å; T568-D648 HydrophobicContact CG2-CB 4.06Å; T568-D648 PolarHBondContact O-N 2.86Å; D648-E650 PolarHBondContact O-N 2.99Å; D648-E650 VanDerWaalsContact O-N 3.11Å; D648-I940 PolarHBondContact OD1-N 3.37Å; D648-I940 WeakPolarHBondContact OD2-CB 3Å
649	L	28.5	Very low	45.5	Very low	84 Å²	84	54.3 Å²	54.3	44%	0.44	28%	0.282	S	S	.	.			trans	-91.6	78.8	-173	-92	172.7	0	0	0	111.9	T653	L649-T653 VanDerWaalsContact CA-OG1 3.31Å; L649-T653 WeakPolarHBondContact CA-OG1 3.25Å; L649-T653 HydrophobicContact CB-CG2 4Å; L649-T653 WeakPolarHBondContact CB-OG1 3.35Å; L649-T653 HydrophobicContact CD1-CG2 4.32Å; L649-T653 HydrophobicContact CD2-CG2 4.16Å; L649-T653 VanDerWaalsContact CD2-OG1 3.26Å; L649-T653 WeakPolarHBondContact CD2-OG1 3.2Å; L649-T653 HydrophobicContact CG-CG2 4.37Å; L649-T653 PolarHBondContact O-OG1 2.75Å
650	E	28	Very low	44.2	Very low	90 Å²	90	57.1 Å²	57.1	42%	0.421	31%	0.305	S	S	.	.			trans	-6.7	148	150.1	-136.3	155.3	-133.8	0	0	118	K566 D648 T653	K566-E650 IonicContact NZ-OE1 3.65Å; K566-E650 PolarHBondContact NZ-OE1 3.19Å; K566-E650 IonicContact NZ-OE2 3.93Å; K566-E650 PolarHBondContact NZ-OE2 3.04Å; D648-E650 PolarHBondContact O-N 2.99Å; D648-E650 VanDerWaalsContact O-N 3.11Å; E650-T653 WeakPolarHBondContact O-CB 3.41Å; E650-T653 PolarHBondContact O-N 2.86Å; E650-T653 PolarHBondContact O-OG1 3.18Å
651	P	27.5	Very low	43	Very low	81 Å²	81	54.3 Å²	54.3	53%	0.526	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	145.6	147.6	-22	34.8	0	0	0	109.7	D679	P651-D679 WeakPolarHBondContact CB-OD1 3.45Å; P651-D679 WeakPolarHBondContact CB-OD2 3.39Å
652	S	31.3	Very low	41.7	Very low	41 Å²	41	60 Å²	60	29%	0.287	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	19.1	-159.2	-51	0	0	0	0	115.6	Q676 T677 D679	S652-Q676 WeakPolarHBondContact O-CG 3.1Å; S652-T677 WeakPolarHBondContact CA-O 3.09Å; S652-T677 PolarHBondContact N-O 3.26Å; S652-D679 PolarHBondContact OG-OD2 2.84Å
653	T	30.4	Very low	40	Very low	14 Å²	14	62 Å²	62	9%	0.086	33%	0.325	C	S	.	.			trans	-67.1	144.6	177.1	-90.4	0	0	0	0	115.4	L649 E650 Y655 Q676	L649-T653 VanDerWaalsContact CA-OG1 3.31Å; L649-T653 WeakPolarHBondContact CA-OG1 3.25Å; L649-T653 HydrophobicContact CB-CG2 4Å; L649-T653 WeakPolarHBondContact CB-OG1 3.35Å; L649-T653 HydrophobicContact CD1-CG2 4.32Å; L649-T653 HydrophobicContact CD2-CG2 4.16Å; L649-T653 VanDerWaalsContact CD2-OG1 3.26Å; L649-T653 WeakPolarHBondContact CD2-OG1 3.2Å; L649-T653 HydrophobicContact CG-CG2 4.37Å; L649-T653 PolarHBondContact O-OG1 2.75Å; E650-T653 WeakPolarHBondContact O-CB 3.41Å; E650-T653 PolarHBondContact O-N 2.86Å; E650-T653 PolarHBondContact O-OG1 3.18Å; T653-Y655 HydrophobicContact CG2-CE2 4.45Å; T653-Q676 VanDerWaalsContact O-CA 3.31Å; T653-Q676 WeakPolarHBondContact O-CA 3.41Å
654	R	32.3	Very low	38	Very low	102 Å²	102	65.6 Å²	65.6	39%	0.385	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	110.5	179.1	-68.6	150.7	177.4	-133.2	2.5	111.5	E674 V675 Q676	R654-E674 HydrophobicContact CB-CG 4.03Å; R654-E674 WeakPolarHBondContact CD-OE1 3.22Å; R654-E674 HydrophobicContact CG-CG 4.1Å; R654-E674 IonicContact CZ-OE1 3.37Å; R654-E674 VanDerWaalsContact CZ-OE1 3.27Å; R654-E674 IonicContact NE-OE1 3.32Å; R654-E674 PolarHBondContact NE-OE1 2.88Å; R654-E674 IonicContact NH1-OE1 2.93Å; R654-E674 PolarHBondContact NH1-OE1 2.82Å; R654-V675 CarbonylContact C-O 3.57Å; R654-V675 WeakPolarHBondContact CA-O 3Å; R654-Q676 HydrophobicContact CG-CB 4.01Å; R654-Q676 HydrophobicContact CG-CG 4.22Å
655	Y	30.6	Very low	36	Very low	139 Å²	139	73.2 Å²	73.2	55%	0.545	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	148	169.7	-56.2	-85.5	0	0	0	110.9	T653 E674 V675	T653-Y655 HydrophobicContact CG2-CE2 4.45Å; Y655-E674 CarbonylContact O-C 3.54Å; Y655-E674 VanDerWaalsContact O-CA 3.22Å; Y655-E674 WeakPolarHBondContact O-CA 3.45Å; Y655-V675 HydrophobicContact CD2-CB 4.31Å; Y655-V675 HydrophobicContact CD2-CG1 4.13Å; Y655-V675 WeakPolarHBondContact CD2-O 3.22Å; Y655-V675 PolarHBondContact N-O 3.06Å; Y655-V675 PolarHBondContact O-N 3.11Å
656	Y	33.9	Very low	34.2	Very low	92 Å²	92	71.2 Å²	71.2	36%	0.361	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	121.5	170.2	-64.1	-79.9	0	0	0	110.5	Q672 I673 E674	Y656-Q672 HydrophobicContact CD1-CB 4.48Å; Y656-I673 CarbonylContact C-O 3.48Å; Y656-I673 VanDerWaalsContact CA-O 3.23Å; Y656-I673 WeakPolarHBondContact CA-O 3.01Å; Y656-E674 HydrophobicContact CD1-CB 4.36Å; Y656-E674 HydrophobicContact CE1-CB 4.14Å; Y656-E674 HydrophobicContact CE1-CG 4Å
657	L	31.5	Very low	32.6	Very low	79 Å²	79	81 Å²	81	41%	0.414	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	109.7	179.2	-73.7	156.8	0	0	0	110.7	Q672 I673 L924	L657-Q672 CarbonylContact O-C 3.46Å; L657-Q672 VanDerWaalsContact O-CA 3.24Å; L657-Q672 WeakPolarHBondContact O-CA 3.43Å; L657-I673 HydrophobicContact CB-CB 4.25Å; L657-I673 PolarHBondContact N-O 3.18Å; L657-I673 PolarHBondContact O-N 2.73Å; L657-L924 HydrophobicContact CD2-CD2 4.43Å
658	S	33.8	Very low	31.7	Very low	46 Å²	46	81.9 Å²	81.9	32%	0.322	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	112.5	-177.5	-160.3	0	0	0	0	112.4	A671	S658-A671 CarbonylContact C-O 3.3Å; S658-A671 WeakPolarHBondContact CA-O 3.05Å
659	L	33.7	Very low	31.4	Very low	19 Å²	19	86.3 Å²	86.3	10%	0.099	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	108.9	-171.2	-71.3	133.2	0	0	0	112.3	G661 A670 A671 I673 L766 V881	L659-G661 PolarHBondContact O-N 3.37Å; L659-A670 VanDerWaalsContact O-CA 3.31Å; L659-A670 WeakPolarHBondContact O-CA 3.45Å; L659-A671 HydrophobicContact CB-CB 4.35Å; L659-A671 PolarHBondContact N-O 3.18Å; L659-A671 PolarHBondContact O-N 3.27Å; L659-I673 HydrophobicContact CD1-CD1 3.44Å; L659-I673 VanDerWaalsContact CD1-CD1 3.44Å; L659-I673 HydrophobicContact CD1-CG1 3.61Å; L659-L766 WeakPolarHBondContact CB-O 3.19Å; L659-L766 WeakPolarHBondContact CD1-O 3.32Å; L659-L766 WeakPolarHBondContact CD2-O 3.34Å; L659-V881 HydrophobicContact CD2-CG2 4.18Å
660	A	34	Very low	31.5	Very low	83 Å²	83	84.5 Å²	84.5	69%	0.686	46%	0.455	S	S	*	.			trans	-87.8	89.5	173.3	0	0	0	0	0	111.2	K662	A660-K662 PolarHBondContact O-N 2.69Å
661	G	31.6	Very low	31.8	Very low	10 Å²	10	80.4 Å²	80.4	10%	0.103	44%	0.437	C	S	.	.			trans	-76.9	118.4	178.5	0	0	0	0	0	113.2	L659 S663 G668	L659-G661 PolarHBondContact O-N 3.37Å; G661-S663 PolarHBondContact O-N 2.84Å; G661-G668 PolarHBondContact O-N 3.43Å; G661-G668 VanDerWaalsContact O-N 3.09Å
662	K	33.2	Very low	32.2	Very low	146 Å²	146	78 Å²	78	64%	0.635	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	109.9	169.5	-176.5	174.5	180	174.1	0	110.3	A660	A660-K662 PolarHBondContact O-N 2.69Å
663	S	31.4	Very low	32.2	Very low	56 Å²	56	76.5 Å²	76.5	39%	0.392	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	168	174.9	81.4	0	0	0	0	112	G661 H665 G666	G661-S663 PolarHBondContact O-N 2.84Å; S663-H665 PolarHBondContact O-N 3.14Å; S663-H665 PolarHBondContact OG-N 3.49Å; S663-G666 PolarHBondContact N-O 2.93Å; S663-G666 PolarHBondContact O-N 2.92Å; S663-G666 PolarHBondContact OG-N 2.95Å; S663-G666 VanDerWaalsContact OG-N 3.13Å; S663-G666 PolarHBondContact OG-O 2.94Å
664	I	32.7	Very low	32.3	Very low	148 Å²	148	76.2 Å²	76.2	76%	0.759	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-3	169.4	56.8	166.2	0	0	0	113.9
665	H	28.6	Very low	32.2	Very low	175 Å²	175	72.4 Å²	72.4	81%	0.81	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.8	11.6	-178.7	-65.4	-9.5	0	0	0	113	S663	S663-H665 PolarHBondContact O-N 3.14Å; S663-H665 PolarHBondContact OG-N 3.49Å
666	G	29	Very low	32.3	Very low	36 Å²	36	67.8 Å²	67.8	37%	0.371	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	133.1	-179.7	177	0	0	0	0	0	114.2	S663 G668	S663-G666 PolarHBondContact N-O 2.93Å; S663-G666 PolarHBondContact O-N 2.92Å; S663-G666 PolarHBondContact OG-N 2.95Å; S663-G666 VanDerWaalsContact OG-N 3.13Å; S663-G666 PolarHBondContact OG-O 2.94Å; G666-G668 PolarHBondContact O-N 2.75Å
667	Y	31.2	Very low	32.1	Very low	208 Å²	208	66.6 Å²	66.6	82%	0.816	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	120.2	174.3	-66.7	-84.6	0	0	0	110
668	G	32.2	Very low	32.1	Very low	40 Å²	40	68.7 Å²	68.7	41%	0.412	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-81.8	154.2	173.9	0	0	0	0	0	112.2	G661 G666	G661-G668 PolarHBondContact O-N 3.43Å; G661-G668 VanDerWaalsContact O-N 3.09Å; G666-G668 PolarHBondContact O-N 2.75Å
669	V	33.5	Very low	31.9	Very low	124 Å²	124	71 Å²	71	75%	0.752	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-61.6	140.5	173.1	-177.4	0	0	0	0	109.9
670	A	31.6	Very low	31.6	Very low	46 Å²	46	81.2 Å²	81.2	38%	0.38	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-72.1	141.1	-174.5	0	0	0	0	0	113	L659	L659-A670 VanDerWaalsContact O-CA 3.31Å; L659-A670 WeakPolarHBondContact O-CA 3.45Å
671	A	34.5	Very low	31.4	Very low	4 Å²	4	82.2 Å²	82.2	3%	0.033	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	122.5	-173	0	0	0	0	0	113.9	S658 L659 W763 L764	S658-A671 CarbonylContact C-O 3.3Å; S658-A671 WeakPolarHBondContact CA-O 3.05Å; L659-A671 HydrophobicContact CB-CB 4.35Å; L659-A671 PolarHBondContact N-O 3.18Å; L659-A671 PolarHBondContact O-N 3.27Å; A671-W763 HydrophobicContact CB-CB 4.29Å; A671-W763 HydrophobicContact CB-CD2 4.39Å; A671-W763 HydrophobicContact CB-CE3 3.51Å; A671-W763 HydrophobicContact CB-CZ3 4.11Å; A671-L764 WeakPolarHBondContact CB-O 3.4Å
672	Q	34.2	Very low	31.1	Very low	30 Å²	30	90.6 Å²	90.6	14%	0.14	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	93.2	-178.3	-73.8	-173.2	-25.1	0	0	115.6	Y656 L657 E674 W763 T928	Y656-Q672 HydrophobicContact CD1-CB 4.48Å; L657-Q672 CarbonylContact O-C 3.46Å; L657-Q672 VanDerWaalsContact O-CA 3.24Å; L657-Q672 WeakPolarHBondContact O-CA 3.43Å; Q672-E674 PolarHBondContact O-N 2.79Å; Q672-W763 CarbonylContact C-O 3.6Å; Q672-W763 HydrophobicContact CB-CB 4.3Å; Q672-W763 CarbonylContact O-C 3.49Å; Q672-W763 PolarHBondContact O-N 2.76Å; Q672-T928 PolarHBondContact NE2-O 2.86Å
673	I	31.4	Very low	30.8	Very low	10 Å²	10	90.3 Å²	90.3	5%	0.051	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	127.8	175.4	-58.4	172.1	0	0	0	111.4	Y656 L657 L659 V675 A700 I702 W763	Y656-I673 CarbonylContact C-O 3.48Å; Y656-I673 VanDerWaalsContact CA-O 3.23Å; Y656-I673 WeakPolarHBondContact CA-O 3.01Å; L657-I673 HydrophobicContact CB-CB 4.25Å; L657-I673 PolarHBondContact N-O 3.18Å; L657-I673 PolarHBondContact O-N 2.73Å; L659-I673 HydrophobicContact CD1-CD1 3.44Å; L659-I673 VanDerWaalsContact CD1-CD1 3.44Å; L659-I673 HydrophobicContact CD1-CG1 3.61Å; I673-V675 HydrophobicContact CG2-CG2 4.03Å; I673-A700 HydrophobicContact CG2-CB 4.14Å; I673-I702 HydrophobicContact CB-CG1 4.42Å; I673-I702 HydrophobicContact CG1-CD1 4.28Å; I673-I702 HydrophobicContact CG1-CG1 4.31Å; I673-I702 HydrophobicContact CG2-CD1 3.98Å; I673-I702 HydrophobicContact CG2-CG1 3.96Å; I673-W763 PolarHBondContact N-O 3.3Å
674	E	32.6	Very low	30.5	Very low	7 Å²	7	96 Å²	96	3%	0.033	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	130.2	170.6	-167.3	-174.5	-168.5	0	0	111.6	R654 Y655 Y656 Q672 A700 K701	R654-E674 HydrophobicContact CB-CG 4.03Å; R654-E674 WeakPolarHBondContact CD-OE1 3.22Å; R654-E674 HydrophobicContact CG-CG 4.1Å; R654-E674 IonicContact CZ-OE1 3.37Å; R654-E674 VanDerWaalsContact CZ-OE1 3.27Å; R654-E674 IonicContact NE-OE1 3.32Å; R654-E674 PolarHBondContact NE-OE1 2.88Å; R654-E674 IonicContact NH1-OE1 2.93Å; R654-E674 PolarHBondContact NH1-OE1 2.82Å; Y655-E674 CarbonylContact O-C 3.54Å; Y655-E674 VanDerWaalsContact O-CA 3.22Å; Y655-E674 WeakPolarHBondContact O-CA 3.45Å; Y656-E674 HydrophobicContact CD1-CB 4.36Å; Y656-E674 HydrophobicContact CE1-CB 4.14Å; Y656-E674 HydrophobicContact CE1-CG 4Å; Q672-E674 PolarHBondContact O-N 2.79Å; E674-A700 CarbonylContact O-C 3.6Å; E674-A700 VanDerWaalsContact O-CA 3.3Å; E674-A700 WeakPolarHBondContact O-CA 3.38Å; E674-K701 WeakPolarHBondContact CA-O 3.41Å; E674-K701 HydrophobicContact CB-CB 4.32Å; E674-K701 WeakPolarHBondContact CB-O 3.33Å; E674-K701 PolarHBondContact N-O 2.81Å; E674-K701 PolarHBondContact O-N 2.81Å; E674-K701 WeakPolarHBondContact OE2-CD 3.21Å
675	V	31.4	Very low	30.2	Very low	22 Å²	22	93.8 Å²	93.8	13%	0.133	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	123	177.2	165.9	0	0	0	0	112.1	R654 Y655 I673 V698 A700	R654-V675 CarbonylContact C-O 3.57Å; R654-V675 WeakPolarHBondContact CA-O 3Å; Y655-V675 HydrophobicContact CD2-CB 4.31Å; Y655-V675 HydrophobicContact CD2-CG1 4.13Å; Y655-V675 WeakPolarHBondContact CD2-O 3.22Å; Y655-V675 PolarHBondContact N-O 3.06Å; Y655-V675 PolarHBondContact O-N 3.11Å; I673-V675 HydrophobicContact CG2-CG2 4.03Å; V675-V698 HydrophobicContact CB-CG1 4.46Å; V675-V698 HydrophobicContact CG1-CG1 3.7Å; V675-V698 HydrophobicContact CG1-CG2 4.45Å; V675-V698 HydrophobicContact CG2-CG1 3.98Å; V675-A700 HydrophobicContact CG2-CB 4.48Å
676	Q	32.7	Very low	29.9	Very low	43 Å²	43	91 Å²	91	20%	0.201	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	148.7	-178	-173	173.1	-37.3	0	0	114.8	S652 T653 R654 N678	S652-Q676 WeakPolarHBondContact O-CG 3.1Å; T653-Q676 VanDerWaalsContact O-CA 3.31Å; T653-Q676 WeakPolarHBondContact O-CA 3.41Å; R654-Q676 HydrophobicContact CG-CB 4.01Å; R654-Q676 HydrophobicContact CG-CG 4.22Å; Q676-N678 PolarHBondContact NE2-OD1 3.08Å
677	T	29.5	Very low	29.9	Very low	67 Å²	67	94.5 Å²	94.5	41%	0.411	51%	0.513	S	S	.	.			trans	-136.6	112.8	-178.8	51.8	0	0	0	0	114	S652	S652-T677 WeakPolarHBondContact CA-O 3.09Å; S652-T677 PolarHBondContact N-O 3.26Å
678	N	31.1	Very low	29.6	Very low	122 Å²	122	93.4 Å²	93.4	65%	0.652	51%	0.513	S	S	*	.			trans	-99.1	160.9	-169.8	-59.8	-7.3	0	0	0	115.7	Q676	Q676-N678 PolarHBondContact NE2-OD1 3.08Å
679	D	30.6	Very low	29.3	Very low	95 Å²	95	98.6 Å²	98.6	51%	0.508	53%	0.531	S	S	.	.			trans	-79.1	160.1	-179.2	-58.4	-86.2	0	0	0	117.1	P651 S652	P651-D679 WeakPolarHBondContact CB-OD1 3.45Å; P651-D679 WeakPolarHBondContact CB-OD2 3.39Å; S652-D679 PolarHBondContact OG-OD2 2.84Å
680	Y	27.2	Very low	28.8	Very low	233 Å²	233	98.8 Å²	98.8	91%	0.914	53%	0.532	S	S	*	.			trans	-168.2	171	154.8	-99.5	-56	0	0	0	110.1
681	P	29.7	Very low	28.4	Very low	104 Å²	104	104.8 Å²	104.8	68%	0.675	55%	0.553	S	S	*	*			trans	-132.9	-164.3	-134.4	40.6	-18.1	0	0	0	116.3
682	F	25.5	Very low	27.8	Very low	187 Å²	187	113.3 Å²	113.3	82%	0.82	60%	0.596	S	S	*	*			trans	-0.6	140.9	165.5	-80.3	-91.3	0	0	0	121.8
683	D	25.2	Very low	27.3	Very low	139 Å²	139	123.4 Å²	123.4	74%	0.743	63%	0.633	S	S	*	*			trans	44.5	112.4	150	-60.7	-26.5	0	0	0	120.2
684	L	25.5	Very low	27	Very low	175 Å²	175	127 Å²	127	92%	0.916	66%	0.656	S	S	*	*				-177.9	159.4	126.3	-94.2	159.9	0	0	0	110.2
685	P	26.1	Very low	26.6	Very low	103 Å²	103	134.6 Å²	134.6	67%	0.669	70%	0.696	S	S	*	*			trans	-102.8	168.2	-164.8	39.3	-37.2	0	0	0	116
686	S	23.6	Very low	26.3	Very low	115 Å²	115	138.2 Å²	138.2	80%	0.804	72%	0.718	S	S	*	*			trans	78	153.8	157.7	80.9	0	0	0	0	118.4
687	P	28.4	Very low	25.9	Very low	110 Å²	110	144 Å²	144	71%	0.714	75%	0.751	S	S	*	*			trans	-108.3	157.7	-166.5	39.7	-33	0	0	0	114.5
688	K	24.8	Very low	25.8	Very low	186 Å²	186	145.2 Å²	145.2	81%	0.809	76%	0.757	S	S	*	*				170.8	150.7	128.7	-94.7	157.7	-175.3	177.6	0	113.8
689	N	25.5	Very low	25.6	Very low	148 Å²	148	142.7 Å²	142.7	79%	0.791	75%	0.75	S	S	*	*			trans	73.4	162.4	155.4	-58.5	-14.2	0	0	0	120.4
690	V	23.8	Very low	25.4	Very low	128 Å²	128	139.2 Å²	139.2	78%	0.776	73%	0.734	S	S	*	*			trans	78.4	77.2	164.4	-158.4	0	0	0	0	118.8
691	Q	23.5	Very low	25.4	Very low	173 Å²	173	133.2 Å²	133.2	81%	0.808	71%	0.713	S	S	*	*				41.6	111.6	124.3	-63.3	-177.4	-9.6	0	0	120.6	R693	Q691-R693 PolarHBondContact O-N 3.27Å
692	L	21.1	Very low	25.3	Very low	182 Å²	182	128.9 Å²	128.9	95%	0.953	68%	0.683	S	S	*	*			trans	14.1	91.8	133.5	-73.3	161.4	0	0	0	117
693	R	24.2	Very low	25.5	Very low	242 Å²	242	121.6 Å²	121.6	91%	0.913	66%	0.655	S	S	*	*			trans	-130.7	127.5	157.5	-83.9	-170.3	169	-174.9	-2.5	112.4	Q691	Q691-R693 PolarHBondContact O-N 3.27Å
694	T	24.8	Very low	25.6	Very low	87 Å²	87	120.7 Å²	120.7	53%	0.534	64%	0.642	S	S	.	*			trans	-34.4	126.8	179.7	56.5	0	0	0	0	116.3	T696 K826	T694-T696 PolarHBondContact O-N 2.91Å; T694-T696 PolarHBondContact O-OG1 2.91Å; T694-K826 PolarHBondContact OG1-NZ 3.47Å
695	L	23.5	Very low	25.7	Very low	165 Å²	165	116.1 Å²	116.1	86%	0.864	62%	0.618	S	S	*	*			trans	12.8	76.9	137.5	-68.7	163	0	0	0	116.6
696	T	25.5	Very low	25.8	Very low	98 Å²	98	119.1 Å²	119.1	60%	0.601	62%	0.623	S	S	*	*			trans	-145.4	76.3	174.1	53.3	0	0	0	0	112.6	T694	T694-T696 PolarHBondContact O-N 2.91Å; T694-T696 PolarHBondContact O-OG1 2.91Å
697	N	24.5	Very low	25.9	Very low	166 Å²	166	118.1 Å²	118.1	89%	0.888	61%	0.614	S	S	*	*			trans	-159.4	18.6	148.9	-102.3	-16.5	0	0	0	113.3	S699	N697-S699 PolarHBondContact O-N 3.18Å
698	V	26.9	Very low	26	Very low	91 Å²	91	119.8 Å²	119.8	55%	0.552	62%	0.617	S	S	*	*			trans	-78.4	111.3	173.6	161.8	0	0	0	0	109.3	V675 A700	V675-V698 HydrophobicContact CB-CG1 4.46Å; V675-V698 HydrophobicContact CG1-CG1 3.7Å; V675-V698 HydrophobicContact CG1-CG2 4.45Å; V675-V698 HydrophobicContact CG2-CG1 3.98Å; V698-A700 PolarHBondContact O-N 2.79Å
699	S	27.4	Very low	26.1	Very low	70 Å²	70	118.1 Å²	118.1	49%	0.49	62%	0.616	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.5	93	172.9	65.7	0	0	0	0	110.6	N697 K701	N697-S699 PolarHBondContact O-N 3.18Å; S699-K701 PolarHBondContact O-N 3.11Å
700	A	26.3	Very low	26.3	Very low	21 Å²	21	116 Å²	116	17%	0.174	61%	0.61	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.4	114	173.8	0	0	0	0	0	110.9	I673 E674 V675 V698 I702 P824	I673-A700 HydrophobicContact CG2-CB 4.14Å; E674-A700 CarbonylContact O-C 3.6Å; E674-A700 VanDerWaalsContact O-CA 3.3Å; E674-A700 WeakPolarHBondContact O-CA 3.38Å; V675-A700 HydrophobicContact CG2-CB 4.48Å; V698-A700 PolarHBondContact O-N 2.79Å; A700-I702 HydrophobicContact CB-CD1 3.8Å; A700-I702 HydrophobicContact CB-CG1 4.48Å; A700-P824 HydrophobicContact CB-CG 4.47Å
701	K	28	Very low	26.4	Very low	108 Å²	108	117.9 Å²	117.9	47%	0.47	61%	0.611	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.8	144	172.6	-154.7	-150.4	170.2	-168.4	0	110.8	E674 S699	E674-K701 WeakPolarHBondContact CA-O 3.41Å; E674-K701 HydrophobicContact CB-CB 4.32Å; E674-K701 WeakPolarHBondContact CB-O 3.33Å; E674-K701 PolarHBondContact N-O 2.81Å; E674-K701 PolarHBondContact O-N 2.81Å; E674-K701 WeakPolarHBondContact OE2-CD 3.21Å; S699-K701 PolarHBondContact O-N 3.11Å
702	I	27.6	Very low	26.4	Very low	12 Å²	12	115.8 Å²	115.8	6%	0.062	60%	0.604	C	S	.	*				-172.1	116.5	-126.4	-104	-173.6	0	0	0	104.4	I673 A700 L764 R765 P824	I673-I702 HydrophobicContact CB-CG1 4.42Å; I673-I702 HydrophobicContact CG1-CD1 4.28Å; I673-I702 HydrophobicContact CG1-CG1 4.31Å; I673-I702 HydrophobicContact CG2-CD1 3.98Å; I673-I702 HydrophobicContact CG2-CG1 3.96Å; A700-I702 HydrophobicContact CB-CD1 3.8Å; A700-I702 HydrophobicContact CB-CG1 4.48Å; I702-L764 HydrophobicContact CB-CD2 4.45Å; I702-L764 HydrophobicContact CB-CG 4.06Å; I702-L764 HydrophobicContact CG2-CB 4.3Å; I702-L764 HydrophobicContact CG2-CD1 4.12Å; I702-L764 HydrophobicContact CG2-CD2 3.31Å; I702-L764 HydrophobicContact CG2-CG 3.33Å; I702-L764 WeakPolarHBondContact O-CD1 3.31Å; I702-R765 HydrophobicContact CD1-CG 4.2Å; I702-R765 HydrophobicContact CG2-CG 4.36Å; I702-P824 HydrophobicContact CD1-CG 3.67Å
703	C	29.2	Very low	26.6	Very low	34 Å²	34	114.5 Å²	114.5	23%	0.23	60%	0.595	C	S	.	*			trans	-136.8	113.8	-174	-69.3	0	0	0	0	113.5	I762 W763 L764	C703-I762 HydrophobicContact CB-CB 4.11Å; C703-I762 HydrophobicContact CB-CG2 3.83Å; C703-I762 VanDerWaalsContact SG-CG2 3.6Å; C703-W763 CarbonylContact O-C 3.57Å; C703-W763 WeakPolarHBondContact O-CA 3.22Å; C703-W763 VanDerWaalsContact O-CG 3.24Å; C703-L764 VanDerWaalsContact C-CD1 3.44Å; C703-L764 VanDerWaalsContact C-N 3.32Å; C703-L764 VanDerWaalsContact CA-CD1 3.44Å; C703-L764 VanDerWaalsContact N-CA 3.31Å; C703-L764 VanDerWaalsContact N-CG 3.34Å; C703-L764 VanDerWaalsContact N-N 3.18Å; C703-L764 PolarHBondContact O-N 3.37Å
704	W	26.6	Very low	26.8	Very low	121 Å²	121	112.6 Å²	112.6	46%	0.458	59%	0.589	S	S	.	*			trans	-95.9	121.5	175.5	-76.6	100.8	0	0	0	103.4	W763 L764 R765	W704-W763 HydrophobicContact CB-CH2 4.34Å; W704-W763 HydrophobicContact CB-CZ3 4.45Å; W704-W763 HydrophobicContact CD2-CE3 4.18Å; W704-W763 AromaticContact CD2-CH2 3.8Å; W704-W763 HydrophobicContact CD2-CH2 3.8Å; W704-W763 AromaticContact CD2-CZ3 3.43Å; W704-W763 HydrophobicContact CD2-CZ3 3.43Å; W704-W763 VanDerWaalsContact CD2-CZ3 3.43Å; W704-W763 HydrophobicContact CE3-CE3 4.18Å; W704-W763 AromaticContact CE3-CH2 3.12Å; W704-W763 HydrophobicContact CE3-CH2 3.12Å; W704-W763 HydrophobicContact CE3-CZ2 4.28Å; W704-W763 AromaticContact CE3-CZ3 3.05Å; W704-W763 HydrophobicContact CE3-CZ3 3.05Å; W704-W763 HydrophobicContact CG-CH2 4.36Å; W704-W763 HydrophobicContact CG-CZ3 4.11Å; W704-W763 AromaticContact CH2-CZ3 3.95Å; W704-W763 HydrophobicContact CH2-CZ3 3.95Å; W704-W763 HydrophobicContact CZ2-CZ3 4.35Å; W704-W763 AromaticContact CZ3-CH2 3.63Å; W704-W763 HydrophobicContact CZ3-CH2 3.63Å; W704-W763 AromaticContact CZ3-CZ3 3.34Å; W704-W763 HydrophobicContact CZ3-CZ3 3.34Å; W704-L764 HydrophobicContact CB-CB 4.01Å; W704-L764 HydrophobicContact CB-CD1 4.08Å; W704-L764 HydrophobicContact CB-CG 4.47Å; W704-L764 VanDerWaalsContact CD1-CD1 3.46Å; W704-L764 HydrophobicContact CD2-CB 4.1Å; W704-L764 HydrophobicContact CG-CB 3.43Å; W704-L764 VanDerWaalsContact CG-CB 3.43Å; W704-L764 HydrophobicContact CG-CD1 4.05Å; W704-L764 HydrophobicContact CG-CD2 4.34Å; W704-L764 HydrophobicContact CG-CG 4.03Å; W704-L764 VanDerWaalsContact N-CB 3.3Å; W704-L764 VanDerWaalsContact NE1-CD2 3.35Å; W704-R765 HydrophobicContact CZ2-CB 4.49Å
705	D	29	Very low	26.8	Very low	79 Å²	79	112.8 Å²	112.8	42%	0.422	59%	0.594	S	S	.	*			trans	-151.8	146.1	-172.1	-147.7	-8.7	0	0	0	113.4	R761 W763	D705-R761 HydrophobicContact CB-CG 4.27Å; D705-R761 VanDerWaalsContact CG-NE 3.35Å; D705-R761 IonicContact OD1-CZ 3.94Å; D705-R761 IonicContact OD1-NH2 3.81Å; D705-R761 PolarHBondContact OD1-NH2 3.03Å; D705-R761 IonicContact OD2-CZ 2.67Å; D705-R761 IonicContact OD2-NE 2.75Å; D705-R761 PolarHBondContact OD2-NE 2.88Å; D705-R761 IonicContact OD2-NH2 2.82Å; D705-R761 PolarHBondContact OD2-NH2 2.79Å; D705-W763 WeakPolarHBondContact O-CZ2 3.22Å; D705-W763 PolarHBondContact O-NE1 2.68Å
706	Q	27.6	Very low	26.8	Very low	165 Å²	165	111 Å²	111	77%	0.771	59%	0.591	S	S	*	*			trans	-106.9	169.7	-154	-94.2	-168.8	-17.7	0	0	115.2	R761	Q706-R761 PolarHBondContact O-NH1 3.01Å
707	P	26.4	Very low	26.7	Very low	95 Å²	95	113.3 Å²	113.3	62%	0.617	60%	0.597	S	S	*	*			trans	-101.1	179.1	-159.3	40.6	-38.1	0	0	0	115.8
708	N	29.6	Very low	26.5	Very low	144 Å²	144	110.2 Å²	110.2	77%	0.77	59%	0.589	S	S	*	*			trans	77.6	146.1	174.3	-51.6	-26.4	0	0	0	114.9
709	L	27.2	Very low	26.3	Very low	152 Å²	152	115.9 Å²	115.9	80%	0.796	60%	0.602	S	S	*	*			cis	-150	-165.2	-14.9	-114.7	163.9	0	0	0	107.1
710	P	29	Very low	26	Very low	102 Å²	102	119.1 Å²	119.1	66%	0.662	61%	0.609	S	S	*	*			trans	-89.5	-176.6	-145.8	43.3	-39.1	0	0	0	115.6
711	E	27.3	Very low	26	Very low	169 Å²	169	125.1 Å²	125.1	79%	0.79	64%	0.637	S	S	*	*			trans	78.1	129.5	164.5	-62.9	-171.5	113.8	0	0	119.4
712	L	23.5	Very low	25.8	Very low	128 Å²	128	127.2 Å²	127.2	67%	0.67	65%	0.652	S	S	*	*			trans	31.6	137.1	138.6	-74.6	158.8	0	0	0	122.1
713	M	24.9	Very low	25.5	Very low	155 Å²	155	136 Å²	136	76%	0.764	69%	0.691	S	S	*	*			trans	74.4	-179.2	166.4	-44.6	-162.5	-159	0	0	116.1
714	Y	28	Very low	25.4	Very low	203 Å²	203	137.7 Å²	137.7	80%	0.796	71%	0.713	S	S	*	*			trans	63.8	95.7	178.2	-49	-74.1	0	0	0	115.2
715	S	24.6	Very low	25.4	Very low	91 Å²	91	140.2 Å²	140.2	64%	0.636	74%	0.735	S	S	*	*			cis	75.8	116.7	40.4	93.6	0	0	0	0	115.4
716	T	22.7	Very low	25.2	Very low	128 Å²	128	141 Å²	141	79%	0.785	75%	0.746	S	S	*	*			trans	66	157.1	151.4	11.9	0	0	0	0	116.9
717	I	24.6	Very low	25.2	Very low	145 Å²	145	138.8 Å²	138.8	74%	0.744	74%	0.74	S	S	*	*			cis	-138	153.2	-2	-42.5	168.5	0	0	0	109.2
718	S	20.9	Very low	25.2	Very low	101 Å²	101	141.3 Å²	141.3	71%	0.706	74%	0.743	S	S	*	*			trans	114.5	138.1	140.8	75.1	0	0	0	0	116.8
719	Y	21.9	Very low	25.1	Very low	210 Å²	210	138.7 Å²	138.7	82%	0.824	74%	0.737	S	S	*	*			cis	-70.7	137.8	-7	-72.7	-100.4	0	0	0	110.3
720	E	21.8	Very low	25.1	Very low	139 Å²	139	139.1 Å²	139.1	65%	0.65	74%	0.738	S	S	*	*				76.3	136.2	52.5	-160.2	-172.2	-109	0	0	111.8
721	I	24.9	Very low	25.1	Very low	147 Å²	147	139.4 Å²	139.4	75%	0.754	74%	0.743	S	S	*	*			trans	69	117.3	-178.1	-46	-178.1	0	0	0	114.1
722	L	24.1	Very low	25.3	Very low	152 Å²	152	136.7 Å²	136.7	80%	0.796	74%	0.739	S	S	*	*			cis	-147.6	163.1	-5.7	-123.4	173.4	0	0	0	111.5
723	F	22.3	Very low	25.5	Very low	197 Å²	197	138.5 Å²	138.5	86%	0.864	75%	0.749	S	S	*	*			trans	-64.2	135.3	177	-79.4	-119.9	0	0	0	113.6
724	G	26.6	Very low	25.5	Very low	68 Å²	68	138.2 Å²	138.2	70%	0.701	75%	0.75	S	S	*	*				65.9	175	129.6	0	0	0	0	0	119.3
725	L	26.2	Very low	25.6	Very low	175 Å²	175	132.5 Å²	132.5	92%	0.916	75%	0.745	S	S	*	*			trans	58.8	122.3	169.6	-51.9	177.2	0	0	0	114.8
726	S	25.7	Very low	25.8	Very low	94 Å²	94	134.8 Å²	134.8	66%	0.657	76%	0.756	S	S	*	*			cis	-171.9	-172.3	14	46.4	0	0	0	0	109.8
727	N	26.6	Very low	26.1	Very low	120 Å²	120	130.3 Å²	130.3	64%	0.642	74%	0.735	S	S	*	*			trans	25.9	143.1	132.8	-63.1	30.2	0	0	0	120.3
728	E	27.9	Very low	26.4	Very low	147 Å²	147	129.8 Å²	129.8	69%	0.687	73%	0.732	S	S	*	*			cis	-161.1	142.7	-0.5	-105.9	150.3	164.3	0	0	105.2
729	S	25.9	Very low	26.7	Very low	90 Å²	90	130.7 Å²	130.7	63%	0.629	73%	0.728	S	S	*	*				64.7	156	77.8	113.2	0	0	0	0	115
730	I	28.5	Very low	27.2	Very low	160 Å²	160	124 Å²	124	82%	0.821	71%	0.71	S	S	*	*			trans	76.4	128.7	-177.6	-52.4	146.3	0	0	0	112.6
731	S	27.9	Very low	27.5	Very low	109 Å²	109	123.1 Å²	123.1	76%	0.762	71%	0.709	S	S	*	*			cis	-137.8	147.7	23.5	51.7	0	0	0	0	115.2
732	P	31.2	Very low	28	Very low	111 Å²	111	117.6 Å²	117.6	72%	0.721	68%	0.683	S	S	*	*			trans	-114.9	168	-178.1	42.2	-34	0	0	0	115.6
733	L	29.4	Very low	28.5	Very low	166 Å²	166	115.3 Å²	115.3	87%	0.869	67%	0.668	S	S	*	*			trans	176.4	128.6	152.7	-92.9	145	0	0	0	106.7
734	N	24.9	Very low	28.9	Very low	149 Å²	149	109.5 Å²	109.5	80%	0.797	65%	0.652	S	S	*	*			cis	77	108.3	37.4	-75.2	-9.4	0	0	0	116.5
735	A	30.1	Very low	29.1	Very low	83 Å²	83	113.6 Å²	113.6	69%	0.686	66%	0.656	S	S	*	*				177.1	125.3	112.8	0	0	0	0	0	115.4
736	T	27.3	Very low	29.2	Very low	140 Å²	140	110.1 Å²	110.1	86%	0.859	65%	0.645	S	S	*	*			trans	38.4	134.8	142.6	59.3	0	0	0	0	122.7
737	G	30.6	Very low	29.3	Very low	34 Å²	34	110.3 Å²	110.3	35%	0.351	65%	0.645	S	S	.	*			cis	153.6	-165.9	0.3	0	0	0	0	0	114.6
738	I	30.8	Very low	29.4	Very low	134 Å²	134	109.6 Å²	109.6	69%	0.687	65%	0.649	S	S	*	*			trans	88.3	85.7	163.6	-48.3	174.2	0	0	0	119.4	A1664	I738-A1664 WeakPolarHBondContact O-CB 3.39Å
739	I	26.9	Very low	29.3	Very low	120 Å²	120	111 Å²	111	62%	0.615	65%	0.653	S	S	*	*				60.7	149.7	114.6	-71.4	159	0	0	0	120.1
740	P	30.9	Very low	29.4	Very low	68 Å²	68	110.7 Å²	110.7	44%	0.442	65%	0.648	S	S	.	*			cis	-146.6	157.8	-27	40.2	-20.5	0	0	0	118.1	L1666	P740-L1666 WeakPolarHBondContact O-CB 3.23Å
741	L	29.1	Very low	29.4	Very low	121 Å²	121	106.6 Å²	106.6	63%	0.634	63%	0.626	S	S	*	*			trans	44.8	151.2	147.3	-69.7	165.7	0	0	0	123.3	L1666	L741-L1666 WeakPolarHBondContact O-CB 3.41Å
742	P	35.7	Very low	29.4	Very low	31 Å²	31	106.9 Å²	106.9	20%	0.201	62%	0.616	C	S	.	*			cis	-153.6	160.1	-9.8	40.1	-17.5	0	0	0	121.5	D1667	P742-D1667 WeakPolarHBondContact CD-O 3.18Å
743	Q	34.1	Very low	29.3	Very low	105 Å²	105	107.9 Å²	107.9	49%	0.491	61%	0.611	S	S	.	*			trans	80.6	137.6	140.6	-74.4	147.5	-2.8	0	0	120.5	R1669	Q743-R1669 HydrophobicContact CB-CG 3.91Å; Q743-R1669 VanDerWaalsContact CD-CZ 3.43Å
744	S	31.1	Very low	29.3	Very low	75 Å²	75	104.9 Å²	104.9	52%	0.524	60%	0.596	S	S	.	*			cis	-172	162.4	4.4	44.9	0	0	0	0	114.6
745	I	31.4	Very low	29.5	Very low	153 Å²	153	106.1 Å²	106.1	79%	0.785	59%	0.589	S	S	*	*			trans	71.9	106.2	155.7	-72.1	156.6	0	0	0	114.2
746	C	27.6	Very low	29.5	Very low	103 Å²	103	106 Å²	106	70%	0.696	58%	0.581	S	S	*	*				97.5	136.6	58.1	165.6	0	0	0	0	111
747	C	28.5	Very low	29.6	Very low	97 Å²	97	101 Å²	101	66%	0.655	56%	0.557	S	S	*	*			cis	-148.7	163.9	3.1	-91.1	0	0	0	0	113.9
748	C	28.2	Very low	29.5	Very low	106 Å²	106	104.2 Å²	104.2	72%	0.716	57%	0.571	S	S	*	*			trans	43.8	118.3	149.2	-58.8	0	0	0	0	119.5
749	F	25.8	Very low	29.4	Very low	175 Å²	175	102.7 Å²	102.7	77%	0.768	56%	0.564	S	S	*	*				60.2	110.4	74.7	-80.2	-115.5	0	0	0	112.4	M751	F749-M751 PolarHBondContact O-N 2.78Å
750	T	27.8	Very low	29.3	Very low	85 Å²	85	106.3 Å²	106.3	52%	0.521	57%	0.571	S	S	.	*				62.4	43.9	71	-47.9	0	0	0	0	111.6	N559	N559-T750 WeakPolarHBondContact OD1-CG2 3.23Å
751	M	28.2	Very low	29.1	Very low	73 Å²	73	108.2 Å²	108.2	36%	0.36	57%	0.569	S	S	.	*			trans	-95.1	125.6	171.7	-103.2	-55.8	-135.3	0	0	113.3	T558 N559 T575 E578 F749	T558-M751 WeakPolarHBondContact CB-O 3.23Å; T558-M751 PolarHBondContact OG1-O 2.9Å; N559-M751 PolarHBondContact ND2-O 2.84Å; T575-M751 PolarHBondContact OG1-O 3.39Å; E578-M751 HydrophobicContact CG-CB 4.12Å; E578-M751 WeakPolarHBondContact OE1-CE 3.47Å; E578-M751 WeakPolarHBondContact OE1-CG 3.45Å; E578-M751 WeakPolarHBondContact OE2-CG 3.49Å; F749-M751 PolarHBondContact O-N 2.78Å
752	M	28.1	Very low	29	Very low	115 Å²	115	104 Å²	104	57%	0.567	55%	0.548	S	S	*	.			trans	40	112.6	148.5	-80.6	-175.4	-169.3	0	0	123.3	N559 T575	N559-M752 PolarHBondContact ND2-N 2.82Å; T575-M752 WeakPolarHBondContact CB-O 3.11Å
753	H	29.1	Very low	28.5	Very low	133 Å²	133	104.6 Å²	104.6	62%	0.616	55%	0.546	S	S	*	.				62.6	135.5	113.7	-85.7	-122.4	0	0	0	123.2
754	L	29.3	Very low	28.2	Very low	103 Å²	103	99.6 Å²	99.6	54%	0.539	52%	0.522	S	S	.	.			trans	72.8	134.9	151.2	-58.2	164.4	0	0	0	115.4	T642	T642-L754 WeakPolarHBondContact CG2-O 3.22Å
755	R	28.5	Very low	27.9	Very low	174 Å²	174	96.3 Å²	96.3	66%	0.657	50%	0.498	S	S	*	.				62	140.8	52.4	-60.3	-174.1	-177.1	-177.3	1.3	112.5	T642	T642-R755 PolarHBondContact OG1-N 3.1Å
756	P	30.5	Very low	27.6	Very low	80 Å²	80	89.3 Å²	89.3	52%	0.519	46%	0.463	S	S	.	.			cis	-93.4	162.6	12.8	18.9	-1.1	0	0	0	112.4	T640	T640-P756 CarbonylContact C-O 3.56Å; T640-P756 CarbonylContact O-C 3.54Å
757	G	29.3	Very low	27.7	Very low	35 Å²	35	87.9 Å²	87.9	36%	0.361	45%	0.45	S	S	.	.			cis	94.2	161	28.3	0	0	0	0	0	111.6
758	T	29	Very low	27.8	Very low	103 Å²	103	83.9 Å²	83.9	63%	0.632	42%	0.423	S	S	*	.			trans	58.3	121.4	163.5	47.3	0	0	0	0	117.7
759	D	28.3	Very low	28.1	Very low	102 Å²	102	82.9 Å²	82.9	55%	0.545	41%	0.408	S	S	.	.			cis	-137	156.4	13.1	-78.4	-33.4	0	0	0	113.2
760	Y	24.8	Very low	28.6	Very low	196 Å²	196	80.3 Å²	80.3	77%	0.769	40%	0.397	S	S	*	.			cis	76.9	46.5	31.2	-70.3	-72.1	0	0	0	117.6
761	R	27.2	Very low	28.9	Very low	107 Å²	107	79.8 Å²	79.8	40%	0.404	39%	0.394	S	S	.	.			trans	-151.6	100.4	158.7	-91.7	142.3	179.2	-162.1	3.6	106.6	D705 Q706	D705-R761 HydrophobicContact CB-CG 4.27Å; D705-R761 VanDerWaalsContact CG-NE 3.35Å; D705-R761 IonicContact OD1-CZ 3.94Å; D705-R761 IonicContact OD1-NH2 3.81Å; D705-R761 PolarHBondContact OD1-NH2 3.03Å; D705-R761 IonicContact OD2-CZ 2.67Å; D705-R761 IonicContact OD2-NE 2.75Å; D705-R761 PolarHBondContact OD2-NE 2.88Å; D705-R761 IonicContact OD2-NH2 2.82Å; D705-R761 PolarHBondContact OD2-NH2 2.79Å; Q706-R761 PolarHBondContact O-NH1 3.01Å
762	I	25.7	Very low	29.2	Very low	34 Å²	34	82.8 Å²	82.8	17%	0.174	41%	0.41	C	S	.	.				29.7	119.6	72.5	-44.4	177.1	0	0	0	110.6	C703	C703-I762 HydrophobicContact CB-CB 4.11Å; C703-I762 HydrophobicContact CB-CG2 3.83Å; C703-I762 VanDerWaalsContact SG-CG2 3.6Å
763	W	26.5	Very low	29.7	Very low	42 Å²	42	82 Å²	82	16%	0.159	41%	0.414	C	S	.	.			trans	-137.8	142.7	171.2	-121.4	85.9	0	0	0	118	A671 Q672 I673 C703 W704 D705	A671-W763 HydrophobicContact CB-CB 4.29Å; A671-W763 HydrophobicContact CB-CD2 4.39Å; A671-W763 HydrophobicContact CB-CE3 3.51Å; A671-W763 HydrophobicContact CB-CZ3 4.11Å; Q672-W763 CarbonylContact C-O 3.6Å; Q672-W763 HydrophobicContact CB-CB 4.3Å; Q672-W763 CarbonylContact O-C 3.49Å; Q672-W763 PolarHBondContact O-N 2.76Å; I673-W763 PolarHBondContact N-O 3.3Å; C703-W763 CarbonylContact O-C 3.57Å; C703-W763 WeakPolarHBondContact O-CA 3.22Å; C703-W763 VanDerWaalsContact O-CG 3.24Å; W704-W763 HydrophobicContact CB-CH2 4.34Å; W704-W763 HydrophobicContact CB-CZ3 4.45Å; W704-W763 HydrophobicContact CD2-CE3 4.18Å; W704-W763 AromaticContact CD2-CH2 3.8Å; W704-W763 HydrophobicContact CD2-CH2 3.8Å; W704-W763 AromaticContact CD2-CZ3 3.43Å; W704-W763 HydrophobicContact CD2-CZ3 3.43Å; W704-W763 VanDerWaalsContact CD2-CZ3 3.43Å; W704-W763 HydrophobicContact CE3-CE3 4.18Å; W704-W763 AromaticContact CE3-CH2 3.12Å; W704-W763 HydrophobicContact CE3-CH2 3.12Å; W704-W763 HydrophobicContact CE3-CZ2 4.28Å; W704-W763 AromaticContact CE3-CZ3 3.05Å; W704-W763 HydrophobicContact CE3-CZ3 3.05Å; W704-W763 HydrophobicContact CG-CH2 4.36Å; W704-W763 HydrophobicContact CG-CZ3 4.11Å; W704-W763 AromaticContact CH2-CZ3 3.95Å; W704-W763 HydrophobicContact CH2-CZ3 3.95Å; W704-W763 HydrophobicContact CZ2-CZ3 4.35Å; W704-W763 AromaticContact CZ3-CH2 3.63Å; W704-W763 HydrophobicContact CZ3-CH2 3.63Å; W704-W763 AromaticContact CZ3-CZ3 3.34Å; W704-W763 HydrophobicContact CZ3-CZ3 3.34Å; D705-W763 WeakPolarHBondContact O-CZ2 3.22Å; D705-W763 PolarHBondContact O-NE1 2.68Å
764	L	26.9	Very low	30	Very low	0 Å²	0	81.3 Å²	81.3	0%	0	42%	0.419	C	S	.	.			trans	-70.7	139.4	-166.1	-125.2	136.6	0	0	0	113	A671 I702 C703 W704 P821	A671-L764 WeakPolarHBondContact CB-O 3.4Å; I702-L764 HydrophobicContact CB-CD2 4.45Å; I702-L764 HydrophobicContact CB-CG 4.06Å; I702-L764 HydrophobicContact CG2-CB 4.3Å; I702-L764 HydrophobicContact CG2-CD1 4.12Å; I702-L764 HydrophobicContact CG2-CD2 3.31Å; I702-L764 HydrophobicContact CG2-CG 3.33Å; I702-L764 WeakPolarHBondContact O-CD1 3.31Å; C703-L764 VanDerWaalsContact C-CD1 3.44Å; C703-L764 VanDerWaalsContact C-N 3.32Å; C703-L764 VanDerWaalsContact CA-CD1 3.44Å; C703-L764 VanDerWaalsContact N-CA 3.31Å; C703-L764 VanDerWaalsContact N-CG 3.34Å; C703-L764 VanDerWaalsContact N-N 3.18Å; C703-L764 PolarHBondContact O-N 3.37Å; W704-L764 HydrophobicContact CB-CB 4.01Å; W704-L764 HydrophobicContact CB-CD1 4.08Å; W704-L764 HydrophobicContact CB-CG 4.47Å; W704-L764 VanDerWaalsContact CD1-CD1 3.46Å; W704-L764 HydrophobicContact CD2-CB 4.1Å; W704-L764 HydrophobicContact CG-CB 3.43Å; W704-L764 VanDerWaalsContact CG-CB 3.43Å; W704-L764 HydrophobicContact CG-CD1 4.05Å; W704-L764 HydrophobicContact CG-CD2 4.34Å; W704-L764 HydrophobicContact CG-CG 4.03Å; W704-L764 VanDerWaalsContact N-CB 3.3Å; W704-L764 VanDerWaalsContact NE1-CD2 3.35Å; L764-P821 HydrophobicContact CD1-CB 3.5Å; L764-P821 VanDerWaalsContact CD1-CB 3.5Å; L764-P821 HydrophobicContact CD1-CG 3.6Å
765	R	25.5	Very low	30.4	Very low	6 Å²	6	82.2 Å²	82.2	2%	0.023	43%	0.429	C	S	.	.			trans	48.7	125.6	150.3	-89.9	-179.2	171.1	85.9	10.3	118.7	I702 W704 M822 K823 P824 W865 Y879	I702-R765 HydrophobicContact CD1-CG 4.2Å; I702-R765 HydrophobicContact CG2-CG 4.36Å; W704-R765 HydrophobicContact CZ2-CB 4.49Å; R765-M822 VanDerWaalsContact CZ-SD 3.52Å; R765-M822 PolarHBondContact NH1-O 3.44Å; R765-M822 PolarHBondContact NH1-SD 3.03Å; R765-K823 PolarHBondContact NH2-O 3.32Å; R765-P824 HydrophobicContact CG-CG 4.36Å; R765-W865 VanDerWaalsContact NE-CH2 3.27Å; R765-W865 VanDerWaalsContact NH2-CZ2 3.32Å; R765-Y879 PolarHBondContact O-OH 3.06Å
766	L	24.7	Very low	30.5	Very low	7 Å²	7	80.4 Å²	80.4	4%	0.037	43%	0.431	C	S	.	.			trans	56.4	-152.4	130.4	-45	164.8	0	0	0	114.3	L659 P824 L827 W865 Y879	L659-L766 WeakPolarHBondContact CB-O 3.19Å; L659-L766 WeakPolarHBondContact CD1-O 3.32Å; L659-L766 WeakPolarHBondContact CD2-O 3.34Å; L766-P824 HydrophobicContact CD2-CB 4.45Å; L766-L827 HydrophobicContact CD2-CB 4.25Å; L766-L827 HydrophobicContact CD2-CD1 3.48Å; L766-L827 VanDerWaalsContact CD2-CD1 3.48Å; L766-L827 HydrophobicContact CD2-CG 3.51Å; L766-W865 HydrophobicContact CD1-CB 3.81Å; L766-W865 HydrophobicContact CD1-CD2 3.13Å; L766-W865 HydrophobicContact CD1-CE3 3.19Å; L766-W865 HydrophobicContact CD1-CG 3.35Å; L766-W865 HydrophobicContact CD1-CZ3 4.02Å; L766-W865 HydrophobicContact CD2-CB 4.04Å; L766-W865 HydrophobicContact CD2-CG 4.04Å; L766-W865 HydrophobicContact CG-CD2 4.49Å; L766-W865 HydrophobicContact CG-CG 4.37Å; L766-Y879 VanDerWaalsContact C-CG 3.43Å; L766-Y879 HydrophobicContact CB-CD2 3.73Å; L766-Y879 HydrophobicContact CB-CE2 3.25Å; L766-Y879 HydrophobicContact CD1-CE2 4.46Å; L766-Y879 HydrophobicContact CG-CE2 4.49Å; L766-Y879 WeakPolarHBondContact O-CD1 3.45Å; L766-Y879 WeakPolarHBondContact O-CE1 3.45Å
767	V	30.4	Very low	30.5	Very low	72 Å²	72	82.7 Å²	82.7	44%	0.436	44%	0.438	S	S	.	.			trans	148.4	76.4	148.6	-48.2	0	0	0	0	127.2	Y879	V767-Y879 VanDerWaalsContact C-CE2 3.4Å; V767-Y879 HydrophobicContact CB-CD1 3.8Å; V767-Y879 HydrophobicContact CB-CD2 3.53Å; V767-Y879 HydrophobicContact CB-CE1 3.17Å; V767-Y879 HydrophobicContact CB-CE2 2.84Å; V767-Y879 HydrophobicContact CB-CG 3.96Å; V767-Y879 WeakPolarHBondContact CB-OH 3.41Å; V767-Y879 HydrophobicContact CG1-CD2 4.01Å; V767-Y879 HydrophobicContact CG1-CE1 4.2Å; V767-Y879 HydrophobicContact CG1-CE2 2.86Å; V767-Y879 VanDerWaalsContact CG1-OH 3.25Å; V767-Y879 WeakPolarHBondContact CG1-OH 3.15Å; V767-Y879 HydrophobicContact CG2-CD1 4.22Å; V767-Y879 HydrophobicContact CG2-CE1 3.21Å; V767-Y879 HydrophobicContact CG2-CE2 3.99Å; V767-Y879 WeakPolarHBondContact CG2-OH 3.49Å; V767-Y879 PolarHBondContact N-OH 2.99Å; V767-Y879 VanDerWaalsContact O-CA 3.26Å; V767-Y879 WeakPolarHBondContact O-CA 3.45Å; V767-Y879 WeakPolarHBondContact O-CB 3.44Å; V767-Y879 WeakPolarHBondContact O-CD1 3.49Å
768	S	30.8	Very low	30.5	Very low	13 Å²	13	87.1 Å²	87.1	9%	0.091	45%	0.453	C	S	.	.	B	Isolated β-bridge	cis	141.7	-6.1	36.4	100.5	0	0	0	0	110.4	I877 S878 Y879	S768-I877 CarbonylContact O-C 3.05Å; S768-I877 VanDerWaalsContact O-CA 3.25Å; S768-I877 WeakPolarHBondContact O-CA 3Å; S768-I877 VanDerWaalsContact O-CG2 3.23Å; S768-I877 WeakPolarHBondContact O-CG2 3.41Å; S768-I877 WeakPolarHBondContact OG-CB 3.4Å; S768-I877 WeakPolarHBondContact OG-CG2 3.36Å; S768-S878 VanDerWaalsContact C-N 3.26Å; S768-S878 CarbonylContact C-O 3.4Å; S768-S878 VanDerWaalsContact C-O 3.27Å; S768-S878 VanDerWaalsContact CB-C 3.48Å; S768-S878 VanDerWaalsContact N-C 3.27Å; S768-S878 PolarHBondContact N-O 3.45Å; S768-S878 PolarHBondContact O-N 2.74Å; S768-S878 VanDerWaalsContact O-N 3.17Å; S768-Y879 VanDerWaalsContact N-CA 3.26Å; S768-Y879 VanDerWaalsContact N-CG 3.26Å; S768-Y879 WeakPolarHBondContact OG-CD2 3.32Å; S768-Y879 WeakPolarHBondContact OG-CE2 3.42Å
769	H	34.2	Very low	30.7	Very low	86 Å²	86	88.6 Å²	88.6	40%	0.398	46%	0.457	S	S	.	.			trans	-173.4	147.3	139.5	-109.2	-48.1	0	0	0	110.4	Q876 I877 S878	H769-Q876 PolarHBondContact CD2-O 2.88Å; H769-Q876 PolarHBondContact NE2-O 3.49Å; H769-I877 PolarHBondContact NE2-N 2.94Å; H769-S878 CarbonylContact C-O 3.54Å; H769-S878 WeakPolarHBondContact CA-O 3.33Å; H769-S878 PolarHBondContact N-O 2.84Å; H769-S878 PolarHBondContact ND1-N 2.7Å; H769-S878 PolarHBondContact ND1-OG 3.35Å
770	K	36.3	Very low	31.2	Very low	120 Å²	120	91.7 Å²	91.7	52%	0.522	47%	0.468	S	S	.	.				168.6	103.3	112.4	-89.7	177.4	-175.8	-177.9	0	111.3	E862 S878 Q880	K770-E862 VanDerWaalsContact C-OE2 3.28Å; K770-E862 PolarHBondContact N-OE1 3.07Å; K770-E862 VanDerWaalsContact N-OE1 3.1Å; K770-S878 PolarHBondContact N-O 3.07Å; K770-Q880 PolarHBondContact O-NE2 2.88Å
771	T	33.7	Very low	31.9	Very low	75 Å²	75	88.8 Å²	88.8	46%	0.46	47%	0.466	S	S	.	.				63.4	129.9	89.4	66.7	0	0	0	0	113.3	E862	T771-E862 VanDerWaalsContact N-CD 3.29Å; T771-E862 PolarHBondContact N-OE1 2.82Å; T771-E862 PolarHBondContact N-OE2 3.37Å
772	L	35.4	Very low	32.7	Very low	135 Å²	135	90.6 Å²	90.6	71%	0.707	48%	0.484	S	S	*	.			cis	-167.5	172.8	40.3	-91.6	111.8	0	0	0	108.9
773	P	38.5	Very low	33.2	Very low	100 Å²	100	95.6 Å²	95.6	65%	0.649	51%	0.51	S	S	*	.			cis	-150.4	179.7	-38	45.1	-26.8	0	0	0	116.1
774	T	35.2	Very low	33.6	Very low	117 Å²	117	99.4 Å²	99.4	72%	0.718	53%	0.534	S	S	*	.				26.8	134.7	126.6	-169.1	0	0	0	0	119
775	T	36.7	Very low	33.6	Very low	122 Å²	122	105.5 Å²	105.5	75%	0.748	57%	0.566	S	S	*	*			cis	-149.1	-131.3	27.7	-16.9	0	0	0	0	111.9
776	I	30.6	Very low	33.8	Very low	136 Å²	136	108.2 Å²	108.2	70%	0.697	60%	0.597	S	S	*	*			cis	-159.3	145.9	1.2	-147.4	164.5	0	0	0	113.5
777	I	30.7	Very low	34.3	Very low	129 Å²	129	116.3 Å²	116.3	66%	0.662	63%	0.632	S	S	*	*			trans	58.5	121.7	149.5	-78.2	166.4	0	0	0	123.9
778	N	28.6	Very low	34.5	Very low	128 Å²	128	120 Å²	120	68%	0.684	65%	0.646	S	S	*	*			trans	48.3	166.6	137.4	-54.9	2.9	0	0	0	123.2
779	N	33.6	Very low	35	Very low	134 Å²	134	126.2 Å²	126.2	72%	0.717	68%	0.679	S	S	*	*			cis	178.8	127.6	-37.4	-90.4	-13.1	0	0	0	108
780	H	39.8	Very low	35.3	Very low	166 Å²	166	130.2 Å²	130.2	77%	0.769	70%	0.695	S	S	*	*			trans	170.6	156.7	139.6	-109.2	-85.6	0	0	0	113.8
781	D	39.7	Very low	35	Very low	136 Å²	136	131.6 Å²	131.6	73%	0.727	71%	0.708	S	S	*	*			trans	36.5	117.6	156.6	-49.2	-22.1	0	0	0	119.8
782	D	43.3	Very low	34.5	Very low	145 Å²	145	134.5 Å²	134.5	78%	0.775	73%	0.725	S	S	*	*			cis	94.8	146.5	16.9	-148.7	7.1	0	0	0	116.9
783	N	36.2	Very low	34	Very low	138 Å²	138	132.3 Å²	132.3	74%	0.738	73%	0.727	S	S	*	*			trans	73	144.1	-164.4	-55.5	-80.9	0	0	0	115.2
784	N	34.5	Very low	33.2	Very low	123 Å²	123	132.5 Å²	132.5	66%	0.658	73%	0.73	S	S	*	*			cis	-147.7	153.8	15.9	-154.3	-9	0	0	0	112.7
785	N	28	Very low	32.9	Very low	127 Å²	127	138.1 Å²	138.1	68%	0.679	74%	0.738	S	S	*	*			trans	43.5	108.9	162.7	-65.7	-37.8	0	0	0	119.6
786	G	30	Very low	32.6	Very low	64 Å²	64	136 Å²	136	66%	0.66	73%	0.727	S	S	*	*			cis	149.7	-179.3	-10.2	0	0	0	0	0	114.1
787	F	34.5	Very low	32.7	Very low	176 Å²	176	133.1 Å²	133.1	77%	0.772	72%	0.718	S	S	*	*			trans	59.3	145.1	154.4	-54	-73.1	0	0	0	119.8
788	M	34.6	Very low	32.9	Very low	151 Å²	151	133.3 Å²	133.3	74%	0.744	72%	0.719	S	S	*	*			cis	-142.9	140.3	5	-142.1	-175.8	-157.7	0	0	114	K790	M788-K790 PolarHBondContact O-N 2.93Å
789	N	41.6	Very low	33.1	Very low	143 Å²	143	131.2 Å²	131.2	77%	0.765	71%	0.708	S	S	*	*			trans	-60	119.8	150.4	164.8	8.9	0	0	0	110.1
790	K	39.2	Very low	33.3	Very low	170 Å²	170	129.3 Å²	129.3	74%	0.739	71%	0.706	S	S	*	*			trans	172.6	165.9	136.7	-100.4	172.1	-179.1	179.1	0	115.2	M788	M788-K790 PolarHBondContact O-N 2.93Å
791	N	30.8	Very low	32.8	Very low	149 Å²	149	128.4 Å²	128.4	80%	0.797	70%	0.7	S	S	*	*			trans	-40.8	146.8	147.3	-59.5	-39.5	0	0	0	110.9
792	V	23.5	Very low	32.6	Very low	135 Å²	135	128.7 Å²	128.7	82%	0.818	70%	0.701	S	S	*	*				-145.9	171.3	57.7	160	0	0	0	0	110.3
793	A	25.3	Very low	32.1	Very low	90 Å²	90	129.7 Å²	129.7	74%	0.744	70%	0.698	S	S	*	*			trans	-29.6	149.6	161.9	0	0	0	0	0	114.3
794	S	21.3	Very low	31.8	Very low	103 Å²	103	130.3 Å²	130.3	72%	0.72	70%	0.7	S	S	*	*			cis	-134.4	165.1	33.9	50.8	0	0	0	0	113.4
795	W	29.1	Very low	31.5	Very low	235 Å²	235	129 Å²	129	89%	0.89	70%	0.697	S	S	*	*				23.8	132.8	89.1	-100.9	66.5	0	0	0	114.1
796	P	29.4	Very low	31.6	Very low	79 Å²	79	126.2 Å²	126.2	51%	0.513	70%	0.698	S	S	.	*			cis	-120.8	-147.1	-27.9	38.5	-24.8	0	0	0	110.9	I798	P796-I798 HydrophobicContact CG-CD1 4.16Å; P796-I798 HydrophobicContact CG-CG1 4.25Å
797	S	33.8	Very low	31.5	Very low	74 Å²	74	128.6 Å²	128.6	52%	0.517	70%	0.701	S	S	.	*				38.2	145.1	71	-141	0	0	0	0	111.5	D799	S797-D799 PolarHBondContact OG-OD1 2.7Å; S797-D799 PolarHBondContact OG-OD2 3.04Å
798	I	34.1	Very low	31.1	Very low	133 Å²	133	126.4 Å²	126.4	68%	0.682	70%	0.702	S	S	*	*				-142.9	99.7	51.5	-82.2	150.9	0	0	0	103.1	P796	P796-I798 HydrophobicContact CG-CD1 4.16Å; P796-I798 HydrophobicContact CG-CG1 4.25Å
799	D	32.8	Very low	31	Very low	85 Å²	85	123.6 Å²	123.6	46%	0.455	70%	0.698	S	S	.	*				105.6	147.2	76	-92.6	-38.5	0	0	0	106	S797	S797-D799 PolarHBondContact OG-OD1 2.7Å; S797-D799 PolarHBondContact OG-OD2 3.04Å
800	S	37	Very low	30.4	Very low	94 Å²	94	124.7 Å²	124.7	66%	0.657	70%	0.698	S	S	*	*			cis	60.9	171.5	44.8	127.3	0	0	0	0	111.9
801	K	30.8	Very low	29.7	Very low	147 Å²	147	123 Å²	123	64%	0.639	70%	0.697	S	S	*	*			trans	62.9	102.2	-147.7	-48.7	161.7	-169.9	166.5	0	108.4
802	N	35.7	Very low	29.7	Very low	141 Å²	141	124.9 Å²	124.9	75%	0.754	70%	0.7	S	S	*	*			cis	-133.1	147.4	18.6	-78.1	-24.2	0	0	0	111.2
803	K	31.7	Very low	30.2	Very low	166 Å²	166	121.9 Å²	121.9	72%	0.722	69%	0.69	S	S	*	*			cis	59.7	57.7	14.7	-148	-164.1	-178.4	-178.5	0	114.3	T805	K803-T805 HydrophobicContact CD-CG2 4.41Å; K803-T805 HydrophobicContact CG-CG2 3.91Å
804	I	29.3	Very low	30.3	Very low	151 Å²	151	126.6 Å²	126.6	77%	0.774	69%	0.694	S	S	*	*				-89	112.8	122.6	-70.6	178.4	0	0	0	103.5
805	T	29.8	Very low	30.7	Very low	97 Å²	97	132.2 Å²	132.2	60%	0.595	70%	0.699	S	S	*	*				65.1	34.8	55.7	79.7	0	0	0	0	114.7	K803	K803-T805 HydrophobicContact CD-CG2 4.41Å; K803-T805 HydrophobicContact CG-CG2 3.91Å
806	G	28.8	Very low	30.7	Very low	67 Å²	67	127 Å²	127	69%	0.691	69%	0.693	S	S	*	*			trans	-77.5	132.2	135	0	0	0	0	0	109.1
807	P	28	Very low	31	Very low	114 Å²	114	130.1 Å²	130.1	74%	0.74	71%	0.705	S	S	*	*			trans	-103.3	-171.1	-174	41.3	-36.7	0	0	0	112.9
808	V	27.2	Very low	31.2	Very low	131 Å²	131	134.3 Å²	134.3	79%	0.794	72%	0.72	S	S	*	*			trans	25	118.4	143.2	175.5	0	0	0	0	115.9
809	S	31.6	Very low	30.6	Very low	92 Å²	92	133.4 Å²	133.4	64%	0.643	73%	0.726	S	S	*	*			cis	-145.2	166.3	29.5	62.8	0	0	0	0	110.6
810	E	29.2	Very low	30.2	Very low	165 Å²	165	136.1 Å²	136.1	77%	0.771	75%	0.745	S	S	*	*			cis	61.2	158.2	36.5	-152.1	172.7	-125.8	0	0	112	Q812	E810-Q812 PolarHBondContact O-N 3.26Å
811	L	24.6	Very low	29.9	Very low	136 Å²	136	135 Å²	135	71%	0.712	74%	0.735	S	S	*	*			trans	20.2	99.7	167.5	-65.5	156.5	0	0	0	115.8
812	Q	31.4	Very low	29.8	Very low	187 Å²	187	132.3 Å²	132.3	87%	0.874	73%	0.726	S	S	*	*				-140.4	130.4	51.7	-73	158.7	-8.6	0	0	109.9	E810	E810-Q812 PolarHBondContact O-N 3.26Å
813	A	32.9	Very low	29.4	Very low	72 Å²	72	132.5 Å²	132.5	60%	0.595	72%	0.72	S	S	*	*				64.5	116.7	52	0	0	0	0	0	113.5
814	F	27.8	Very low	29.3	Very low	190 Å²	190	125.9 Å²	125.9	83%	0.833	69%	0.694	S	S	*	*	S	Bend	trans	43.9	121	147.6	-87.6	-97.2	0	0	0	119.8
815	R	29.4	Very low	29.6	Very low	221 Å²	221	126.5 Å²	126.5	83%	0.834	69%	0.687	S	S	*	*			trans	76.2	143.6	176.8	-42.6	138.3	175.1	171	-3.7	111.1
816	T	29.8	Very low	30	Very low	125 Å²	125	125.2 Å²	125.2	77%	0.767	67%	0.673	S	S	*	*			cis	-137.3	91.2	5.4	-42.1	0	0	0	0	107.5
817	L	34.4	Very low	30.5	Very low	144 Å²	144	125.8 Å²	125.8	75%	0.754	66%	0.659	S	S	*	*				67.5	122.2	110	-79.2	150.9	0	0	0	115.2
818	I	38.4	Very low	31.4	Very low	163 Å²	163	123.6 Å²	123.6	84%	0.836	64%	0.639	S	S	*	*			trans	93.6	137.5	171.9	-52.6	156.2	0	0	0	115.3
819	S	22	Very low	32	Very low	114 Å²	114	122.4 Å²	122.4	80%	0.797	63%	0.628	S	S	*	*			trans	68.7	66.8	169.1	68.5	0	0	0	0	123.1
820	V	24.2	Very low	33.2	Very low	141 Å²	141	121.4 Å²	121.4	86%	0.855	62%	0.618	S	S	*	*			trans	-149.3	130.2	159.8	-171.2	0	0	0	0	112.9
821	P	31.7	Very low	34.2	Very low	70 Å²	70	116.5 Å²	116.5	46%	0.455	60%	0.597	S	S	.	*			trans	-119.9	150.3	175.1	41.8	-31.8	0	0	0	115.5	L764	L764-P821 HydrophobicContact CD1-CB 3.5Å; L764-P821 VanDerWaalsContact CD1-CB 3.5Å; L764-P821 HydrophobicContact CD1-CG 3.6Å
822	M	27.7	Very low	35.1	Very low	91 Å²	91	114.2 Å²	114.2	45%	0.448	59%	0.585	S	S	.	*			trans	-95.4	-178.3	-157.2	-0.4	72.3	154.9	0	0	117	R765 L871	R765-M822 VanDerWaalsContact CZ-SD 3.52Å; R765-M822 PolarHBondContact NH1-O 3.44Å; R765-M822 PolarHBondContact NH1-SD 3.03Å; M822-L871 HydrophobicContact CE-CD1 4.17Å; M822-L871 HydrophobicContact CE-CD2 3.75Å
823	K	27.5	Very low	36.1	Very low	146 Å²	146	108.7 Å²	108.7	64%	0.635	56%	0.559	S	S	*	*			trans	-104.8	146.5	169.6	-70.1	-178.8	177.5	177.7	0	113.8	R765	R765-K823 PolarHBondContact NH2-O 3.32Å
824	P	29.2	Very low	36.5	Very low	26 Å²	26	111.4 Å²	111.4	17%	0.169	56%	0.557	C	S	.	*			trans	-84.5	150.6	168.7	34.5	-33.6	0	0	0	112.1	A700 I702 R765 L766	A700-P824 HydrophobicContact CB-CG 4.47Å; I702-P824 HydrophobicContact CD1-CG 3.67Å; R765-P824 HydrophobicContact CG-CG 4.36Å; L766-P824 HydrophobicContact CD2-CB 4.45Å
825	R	35.9	Very low	37.1	Very low	165 Å²	165	108.8 Å²	108.8	62%	0.623	54%	0.541	S	S	*	.	S	Bend	trans	-98.5	-32.1	-179.4	-91.8	-172.4	179.1	176.8	4.5	115.2	P868 E869	R825-P868 HydrophobicContact CG-CB 4.22Å; R825-E869 IonicContact CZ-OE2 3.36Å; R825-E869 IonicContact NH1-OE2 2.64Å; R825-E869 PolarHBondContact NH1-OE2 3.01Å; R825-E869 IonicContact NH2-OE2 3.64Å; R825-E869 PolarHBondContact NH2-OE2 2.92Å; R825-E869 VanDerWaalsContact NH2-OE2 3.11Å
826	K	37.4	Very low	37.2	Very low	70 Å²	70	104.1 Å²	104.1	30%	0.304	54%	0.537	S	S	.	.			trans	-156.1	143	179	-113.4	162.1	174.1	-176.6	0	109.4	T694	T694-K826 PolarHBondContact OG1-NZ 3.47Å
827	L	40.6	Very low	37.1	Very low	78 Å²	78	109.4 Å²	109.4	41%	0.408	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	115.1	-176.1	-165.5	-175	0	0	0	105.8	L766 L863 A864	L766-L827 HydrophobicContact CD2-CB 4.25Å; L766-L827 HydrophobicContact CD2-CD1 3.48Å; L766-L827 VanDerWaalsContact CD2-CD1 3.48Å; L766-L827 HydrophobicContact CD2-CG 3.51Å; L827-L863 HydrophobicContact CD2-CB 3.92Å; L827-L863 HydrophobicContact CD2-CD1 4.42Å; L827-L863 HydrophobicContact CD2-CD2 4.3Å; L827-L863 HydrophobicContact CD2-CG 4.46Å; L827-A864 CarbonylContact C-O 3.41Å; L827-A864 VanDerWaalsContact CA-O 3.27Å; L827-A864 WeakPolarHBondContact CA-O 3.25Å
828	H	45.6	Very low	36.7	Very low	68 Å²	68	110.2 Å²	110.2	32%	0.315	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	143.7	-168.9	-38.3	-87.8	0	0	0	110.8	V830 L863 A864 D866	H828-V830 PolarHBondContact O-N 2.93Å; H828-L863 CarbonylContact O-C 3.59Å; H828-L863 VanDerWaalsContact O-CA 3.27Å; H828-L863 WeakPolarHBondContact O-CA 2.96Å; H828-A864 PolarHBondContact N-O 3.16Å; H828-A864 PolarHBondContact O-N 3.4Å; H828-D866 IonicContact CD2-OD2 2.77Å; H828-D866 IonicContact CE1-OD2 2.75Å; H828-D866 IonicContact NE2-OD2 3.18Å; H828-D866 PolarHBondContact NE2-OD2 3.3Å
829	L	41.3	Very low	36.2	Very low	107 Å²	107	108 Å²	108	56%	0.56	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66	131	165.2	-177.7	66.2	0	0	0	109.3	I832 V861 L863	L829-I832 HydrophobicContact CD1-CD1 4.36Å; L829-I832 HydrophobicContact CD1-CG1 3.98Å; L829-I832 HydrophobicContact CD2-CD1 4.12Å; L829-I832 HydrophobicContact CD2-CG1 4.34Å; L829-V861 HydrophobicContact CD1-CG1 3.47Å; L829-V861 VanDerWaalsContact CD1-CG1 3.47Å; L829-L863 HydrophobicContact CD1-CD2 3.95Å
830	V	55.7	Low	36.3	Very low	71 Å²	71	107.2 Å²	107.2	43%	0.43	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	-48.6	177.3	169.1	0	0	0	0	110.6	H828 E862 A864	H828-V830 PolarHBondContact O-N 2.93Å; V830-E862 HydrophobicContact CB-CB 4.02Å; V830-E862 HydrophobicContact CB-CG 4.33Å; V830-E862 WeakPolarHBondContact CB-O 3.49Å; V830-E862 HydrophobicContact CG1-CB 4.19Å; V830-E862 HydrophobicContact CG1-CG 4.31Å; V830-E862 PolarHBondContact N-O 2.74Å; V830-A864 HydrophobicContact CG2-CB 3.36Å; V830-A864 VanDerWaalsContact CG2-N 3.32Å
831	D	51.3	Low	36.5	Very low	62 Å²	62	106.5 Å²	106.5	33%	0.332	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	167.8	-176.8	-145.1	-45.7	0	0	0	112	H833 E862	D831-H833 VanDerWaalsContact CG-CE1 3.41Å; D831-H833 IonicContact OD1-CE1 2.7Å; D831-H833 PolarHBondContact OD1-CE1 2.76Å; D831-H833 IonicContact OD1-ND1 2.73Å; D831-H833 PolarHBondContact OD1-ND1 3.11Å; D831-H833 IonicContact OD1-NE2 2.84Å; D831-H833 PolarHBondContact OD1-NE2 2.73Å; D831-H833 IonicContact OD2-CE1 2.7Å; D831-H833 IonicContact OD2-ND1 3.99Å; D831-H833 IonicContact OD2-NE2 3.15Å; D831-H833 PolarHBondContact OD2-NE2 3.04Å; D831-E862 HydrophobicContact CB-CB 4.18Å; D831-E862 PolarHBondContact N-O 2.93Å; D831-E862 PolarHBondContact O-N 3.09Å
832	I	43.6	Very low	36.4	Very low	88 Å²	88	110.4 Å²	110.4	45%	0.451	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	105.2	169.3	-57.1	-176.7	0	0	0	109.2	L829 L859 V861	L829-I832 HydrophobicContact CD1-CD1 4.36Å; L829-I832 HydrophobicContact CD1-CG1 3.98Å; L829-I832 HydrophobicContact CD2-CD1 4.12Å; L829-I832 HydrophobicContact CD2-CG1 4.34Å; I832-L859 HydrophobicContact CG2-CD2 3.75Å; I832-V861 HydrophobicContact CG1-CG1 4.37Å; I832-V861 HydrophobicContact CG1-CG2 4.33Å; I832-V861 HydrophobicContact CG2-CG2 4.4Å
833	H	51.6	Low	36.3	Very low	71 Å²	71	111.4 Å²	111.4	33%	0.329	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.7	130.2	-178.5	-49.4	-57.3	0	0	0	113	D831 R835 C860	D831-H833 VanDerWaalsContact CG-CE1 3.41Å; D831-H833 IonicContact OD1-CE1 2.7Å; D831-H833 PolarHBondContact OD1-CE1 2.76Å; D831-H833 IonicContact OD1-ND1 2.73Å; D831-H833 PolarHBondContact OD1-ND1 3.11Å; D831-H833 IonicContact OD1-NE2 2.84Å; D831-H833 PolarHBondContact OD1-NE2 2.73Å; D831-H833 IonicContact OD2-CE1 2.7Å; D831-H833 IonicContact OD2-ND1 3.99Å; D831-H833 IonicContact OD2-NE2 3.15Å; D831-H833 PolarHBondContact OD2-NE2 3.04Å; H833-R835 PolarHBondContact O-N 3.35Å; H833-C860 HydrophobicContact CB-CB 4.32Å; H833-C860 PolarHBondContact N-O 2.89Å; H833-C860 WeakPolarHBondContact O-CB 3.15Å; H833-C860 PolarHBondContact O-N 3.22Å
834	K	41.4	Very low	36.4	Very low	129 Å²	129	107.9 Å²	107.9	56%	0.561	57%	0.57	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.4	113.4	161.9	-172	179.1	-174.9	-178.1	0	108	T896	K834-T896 PolarHBondContact NZ-O 2.86Å
835	R	39.8	Very low	36.4	Very low	135 Å²	135	113 Å²	113	51%	0.509	60%	0.601	S	S	.	*			trans	-118.9	78	-167.9	-154.9	176.1	-164.8	168.7	4.3	113.1	H833 C860	H833-R835 PolarHBondContact O-N 3.35Å; R835-C860 HydrophobicContact CB-CB 4.34Å
836	T	32.5	Very low	35.9	Very low	122 Å²	122	112.8 Å²	112.8	75%	0.748	61%	0.606	S	S	*	*			trans	-60.6	138.8	167.6	29.3	0	0	0	0	111.1
837	R	27.9	Very low	35.3	Very low	237 Å²	237	117.4 Å²	117.4	89%	0.894	63%	0.629	S	S	*	*			trans	-99	96.2	-178.1	-165.8	177.6	-174.2	-168.1	-1.4	111	T839	R837-T839 PolarHBondContact O-N 3.3Å
838	L	24.3	Very low	34.7	Very low	161 Å²	161	119 Å²	119	84%	0.843	65%	0.653	S	S	*	*			trans	-70.8	120.6	170.8	-84.1	159.4	0	0	0	111.6
839	T	28	Very low	33.8	Very low	116 Å²	116	119 Å²	119	71%	0.712	67%	0.673	S	S	*	*			trans	174.5	126.9	148.8	34.7	0	0	0	0	106.6	R837	R837-T839 PolarHBondContact O-N 3.3Å
840	S	26.2	Very low	33.1	Very low	98 Å²	98	120.4 Å²	120.4	69%	0.685	69%	0.685	S	S	*	*			cis	133.2	146.5	-2	58.2	0	0	0	0	108.9
841	V	28	Very low	31.7	Very low	126 Å²	126	126.1 Å²	126.1	76%	0.764	71%	0.707	S	S	*	*			trans	89.4	107.5	159.8	-177.6	0	0	0	0	119
842	L	28.5	Very low	30.5	Very low	151 Å²	151	126.9 Å²	126.9	79%	0.791	73%	0.729	S	S	*	*			trans	74.8	107.7	143.3	-66.4	172	0	0	0	124.3
843	S	26.6	Very low	29.7	Very low	113 Å²	113	131.2 Å²	131.2	79%	0.79	75%	0.747	S	S	*	*				38.7	133	123.6	65.5	0	0	0	0	122.9
844	G	28.8	Very low	28.6	Very low	72 Å²	72	134.7 Å²	134.7	74%	0.742	77%	0.773	S	S	*	*			trans	151.9	94.4	151.8	0	0	0	0	0	117.1
845	T	28.6	Very low	28.3	Very low	134 Å²	134	133.6 Å²	133.6	82%	0.822	77%	0.773	S	S	*	*			trans	15.2	132.1	151.4	51.9	0	0	0	0	122.6
846	E	25.9	Very low	27.9	Very low	159 Å²	159	129.9 Å²	129.9	74%	0.743	76%	0.764	S	S	*	*			trans	84.4	141	139.6	-82.4	-165.8	-144.9	0	0	123.8
847	Q	25.8	Very low	28.2	Very low	168 Å²	168	126.6 Å²	126.6	79%	0.785	74%	0.744	S	S	*	*			trans	65.1	109.9	155.4	-65.5	179.5	47.3	0	0	121.7
848	A	27.2	Very low	28.9	Very low	110 Å²	110	120.4 Å²	120.4	91%	0.909	72%	0.721	S	S	*	*			trans	44.6	110.3	140.9	0	0	0	0	0	121.2
849	G	27.3	Very low	30	Very low	70 Å²	70	114.5 Å²	114.5	72%	0.722	69%	0.691	S	S	*	*			trans	174	123	157.6	0	0	0	0	0	117.4
850	V	26.6	Very low	31.3	Very low	135 Å²	135	109 Å²	109	82%	0.818	66%	0.657	S	S	*	*			trans	48.1	125.5	134.7	-175.2	0	0	0	0	120.8
851	H	26.1	Very low	32.4	Very low	192 Å²	192	105.7 Å²	105.7	89%	0.889	63%	0.633	S	S	*	*			trans	13.1	117.2	156.8	-64.3	-72.3	0	0	0	120.2
852	G	26.4	Very low	33.7	Very low	78 Å²	78	100 Å²	100	80%	0.804	60%	0.597	S	S	*	*			trans	-140	128.8	164.8	0	0	0	0	0	112.4
853	Q	25.6	Very low	34.6	Very low	178 Å²	178	94.6 Å²	94.6	83%	0.832	57%	0.57	S	S	*	*			trans	-92.9	127.8	-176.9	-177.1	174.8	2	0	0	110.6
854	V	29.1	Very low	36	Very low	144 Å²	144	89.6 Å²	89.6	87%	0.873	54%	0.535	S	S	*	.			trans	-79.2	130.2	176.9	-177.1	0	0	0	0	109.6
855	D	35.4	Very low	36.9	Very low	106 Å²	106	87.5 Å²	87.5	57%	0.567	51%	0.505	S	S	*	.			trans	-104.2	153	-164.5	-142.1	-15.9	0	0	0	114	R884	D855-R884 IonicContact OD1-CZ 2.95Å; D855-R884 IonicContact OD1-NH2 2.67Å; D855-R884 PolarHBondContact OD1-NH2 2.83Å
856	L	30.3	Very low	38.1	Very low	58 Å²	58	83.7 Å²	83.7	30%	0.304	48%	0.479	S	S	.	.			trans	-89	150.2	-168.2	-71.6	156.6	0	0	0	113	Y858 I886 I892	L856-Y858 WeakPolarHBondContact O-CD2 3.27Å; L856-Y858 WeakPolarHBondContact O-CE2 3.24Å; L856-I886 HydrophobicContact CD1-CG1 4.27Å; L856-I892 HydrophobicContact CD2-CD1 3.74Å
857	P	39.7	Very low	39	Very low	52 Å²	52	78 Å²	78	34%	0.338	46%	0.456	S	S	.	.			trans	-68.7	149.2	-179.4	27.3	-34.2	0	0	0	113.7	L885 I892	P857-L885 HydrophobicContact CG-CD1 4.4Å; P857-L885 PolarHBondContact O-N 2.68Å; P857-I892 HydrophobicContact CG-CG2 3.61Å
858	Y	43.3	Very low	39.7	Very low	107 Å²	107	71 Å²	71	42%	0.42	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	137.1	177.9	-65.5	-99.8	0	0	0	111.5	L856 V883 R884	L856-Y858 WeakPolarHBondContact O-CD2 3.27Å; L856-Y858 WeakPolarHBondContact O-CE2 3.24Å; Y858-V883 CarbonylContact C-O 3.54Å; Y858-V883 VanDerWaalsContact CA-O 3.31Å; Y858-V883 WeakPolarHBondContact CA-O 3.42Å; Y858-R884 HydrophobicContact CD1-CB 3.99Å; Y858-R884 HydrophobicContact CD1-CG 4.31Å; Y858-R884 HydrophobicContact CE1-CB 3.76Å; Y858-R884 HydrophobicContact CE1-CG 3.85Å
859	L	46.4	Very low	40.3	Very low	38 Å²	38	73.3 Å²	73.3	20%	0.199	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	143.6	170.7	-82.8	156.2	0	0	0	110.5	I832 F882 V883 L885	I832-L859 HydrophobicContact CG2-CD2 3.75Å; L859-F882 CarbonylContact O-C 3.55Å; L859-F882 WeakPolarHBondContact O-CA 3.46Å; L859-V883 HydrophobicContact CB-CB 4.35Å; L859-V883 PolarHBondContact N-O 2.85Å; L859-V883 PolarHBondContact O-N 3.13Å; L859-L885 HydrophobicContact CD1-CD1 4.09Å; L859-L885 HydrophobicContact CD1-CD2 4.05Å; L859-L885 HydrophobicContact CD1-CG 4.2Å
860	C	56.2	Low	41	Very low	1 Å²	1	73.3 Å²	73.3	1%	0.007	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	101.6	-179.2	-173.8	0	0	0	0	110.3	H833 R835 V881 F882	H833-C860 HydrophobicContact CB-CB 4.32Å; H833-C860 PolarHBondContact N-O 2.89Å; H833-C860 WeakPolarHBondContact O-CB 3.15Å; H833-C860 PolarHBondContact O-N 3.22Å; R835-C860 HydrophobicContact CB-CB 4.34Å; C860-V881 CarbonylContact C-O 3.57Å; C860-V881 WeakPolarHBondContact CA-O 3.42Å; C860-F882 HydrophobicContact CB-CD1 4.28Å; C860-F882 HydrophobicContact CB-CE1 4.14Å
861	V	47.8	Very low	41.2	Very low	28 Å²	28	70.5 Å²	70.5	17%	0.17	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	130.5	-175.6	-178.6	0	0	0	0	109.8	L829 I832 L863 Q880 V881 V883	L829-V861 HydrophobicContact CD1-CG1 3.47Å; L829-V861 VanDerWaalsContact CD1-CG1 3.47Å; I832-V861 HydrophobicContact CG1-CG1 4.37Å; I832-V861 HydrophobicContact CG1-CG2 4.33Å; I832-V861 HydrophobicContact CG2-CG2 4.4Å; V861-L863 HydrophobicContact CG1-CD2 3.95Å; V861-L863 HydrophobicContact CG1-CG 4.21Å; V861-Q880 CarbonylContact O-C 3.54Å; V861-Q880 WeakPolarHBondContact O-CA 3.18Å; V861-V881 HydrophobicContact CB-CB 4.45Å; V861-V881 PolarHBondContact N-O 3.15Å; V861-V881 PolarHBondContact O-N 3.11Å; V861-V883 HydrophobicContact CG2-CG2 4.13Å
862	E	56.9	Low	41.7	Very low	5 Å²	5	70.5 Å²	70.5	2%	0.023	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	137.8	176.6	-151.9	-171.1	158.4	0	0	112.2	K770 T771 V830 D831 S878 Y879 Q880	K770-E862 VanDerWaalsContact C-OE2 3.28Å; K770-E862 PolarHBondContact N-OE1 3.07Å; K770-E862 VanDerWaalsContact N-OE1 3.1Å; T771-E862 VanDerWaalsContact N-CD 3.29Å; T771-E862 PolarHBondContact N-OE1 2.82Å; T771-E862 PolarHBondContact N-OE2 3.37Å; V830-E862 HydrophobicContact CB-CB 4.02Å; V830-E862 HydrophobicContact CB-CG 4.33Å; V830-E862 WeakPolarHBondContact CB-O 3.49Å; V830-E862 HydrophobicContact CG1-CB 4.19Å; V830-E862 HydrophobicContact CG1-CG 4.31Å; V830-E862 PolarHBondContact N-O 2.74Å; D831-E862 HydrophobicContact CB-CB 4.18Å; D831-E862 PolarHBondContact N-O 2.93Å; D831-E862 PolarHBondContact O-N 3.09Å; E862-S878 VanDerWaalsContact OE1-CB 3.28Å; E862-S878 WeakPolarHBondContact OE1-CB 3.47Å; E862-S878 PolarHBondContact OE1-OG 3.49Å; E862-Y879 CarbonylContact C-O 3.6Å; E862-Y879 WeakPolarHBondContact CA-O 3.06Å; E862-Q880 HydrophobicContact CG-CG 4.16Å
863	L	47.5	Very low	42	Very low	39 Å²	39	70.5 Å²	70.5	20%	0.204	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	103.3	-166.9	-63.2	176.9	0	0	0	115.4	L827 H828 L829 V861 S878 Y879 V881	L827-L863 HydrophobicContact CD2-CB 3.92Å; L827-L863 HydrophobicContact CD2-CD1 4.42Å; L827-L863 HydrophobicContact CD2-CD2 4.3Å; L827-L863 HydrophobicContact CD2-CG 4.46Å; H828-L863 CarbonylContact O-C 3.59Å; H828-L863 VanDerWaalsContact O-CA 3.27Å; H828-L863 WeakPolarHBondContact O-CA 2.96Å; L829-L863 HydrophobicContact CD1-CD2 3.95Å; V861-L863 HydrophobicContact CG1-CD2 3.95Å; V861-L863 HydrophobicContact CG1-CG 4.21Å; L863-S878 CarbonylContact O-C 3.24Å; L863-S878 WeakPolarHBondContact O-CA 3.19Å; L863-Y879 PolarHBondContact N-O 3.14Å; L863-Y879 PolarHBondContact O-N 3.1Å; L863-V881 HydrophobicContact CD1-CG2 3.87Å
864	A	55.6	Low	42.7	Very low	8 Å²	8	69.1 Å²	69.1	7%	0.066	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	148	179.8	0	0	0	0	0	114.8	L827 H828 V830 I877	L827-A864 CarbonylContact C-O 3.41Å; L827-A864 VanDerWaalsContact CA-O 3.27Å; L827-A864 WeakPolarHBondContact CA-O 3.25Å; H828-A864 PolarHBondContact N-O 3.16Å; H828-A864 PolarHBondContact O-N 3.4Å; V830-A864 HydrophobicContact CG2-CB 3.36Å; V830-A864 VanDerWaalsContact CG2-N 3.32Å; A864-I877 CarbonylContact C-O 3.57Å; A864-I877 WeakPolarHBondContact CA-O 3.05Å
865	W	48.3	Very low	43.1	Very low	28 Å²	28	70.4 Å²	70.4	11%	0.106	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	127.7	170	175.6	31.6	0	0	0	109.9	R765 L766 I877	R765-W865 VanDerWaalsContact NE-CH2 3.27Å; R765-W865 VanDerWaalsContact NH2-CZ2 3.32Å; L766-W865 HydrophobicContact CD1-CB 3.81Å; L766-W865 HydrophobicContact CD1-CD2 3.13Å; L766-W865 HydrophobicContact CD1-CE3 3.19Å; L766-W865 HydrophobicContact CD1-CG 3.35Å; L766-W865 HydrophobicContact CD1-CZ3 4.02Å; L766-W865 HydrophobicContact CD2-CB 4.04Å; L766-W865 HydrophobicContact CD2-CG 4.04Å; L766-W865 HydrophobicContact CG-CD2 4.49Å; L766-W865 HydrophobicContact CG-CG 4.37Å; W865-I877 HydrophobicContact CB-CD1 4.14Å; W865-I877 HydrophobicContact CD2-CD1 3.5Å; W865-I877 HydrophobicContact CE3-CD1 3.11Å; W865-I877 HydrophobicContact CE3-CG1 4.35Å; W865-I877 HydrophobicContact CG-CD1 4Å; W865-I877 HydrophobicContact CH2-CD1 4.38Å; W865-I877 HydrophobicContact CZ3-CD1 3.62Å; W865-I877 PolarHBondContact N-O 2.84Å; W865-I877 WeakPolarHBondContact O-CD1 3.21Å; W865-I877 WeakPolarHBondContact O-CG1 3.42Å
866	D	52.4	Low	43.4	Very low	53 Å²	53	70.2 Å²	70.2	28%	0.283	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-90	120.9	166.4	-63.4	-37.7	0	0	0	110.4	H828 Q876	H828-D866 IonicContact CD2-OD2 2.77Å; H828-D866 IonicContact CE1-OD2 2.75Å; H828-D866 IonicContact NE2-OD2 3.18Å; H828-D866 PolarHBondContact NE2-OD2 3.3Å; D866-Q876 PolarHBondContact OD1-NE2 3.01Å
867	P	45	Very low	43.9	Very low	41 Å²	41	69 Å²	69	27%	0.266	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-63.4	137	176.3	26.8	-32.4	0	0	0	110.3	I877	P867-I877 HydrophobicContact CB-CD1 4.35Å; P867-I877 HydrophobicContact CG-CD1 4.42Å
868	P	41.7	Very low	43.8	Very low	20 Å²	20	66.8 Å²	66.8	13%	0.13	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-68.6	147.4	175.6	30.3	-35.1	0	0	0	111	R825 G870 L871	R825-P868 HydrophobicContact CG-CB 4.22Å; P868-G870 PolarHBondContact O-N 2.9Å; P868-L871 PolarHBondContact O-N 3.02Å
869	E	38.8	Very low	43.6	Very low	159 Å²	159	62.2 Å²	62.2	74%	0.743	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	135.7	173.4	-61.6	163.6	130.2	0	0	111	R825	R825-E869 IonicContact CZ-OE2 3.36Å; R825-E869 IonicContact NH1-OE2 2.64Å; R825-E869 PolarHBondContact NH1-OE2 3.01Å; R825-E869 IonicContact NH2-OE2 3.64Å; R825-E869 PolarHBondContact NH2-OE2 2.92Å; R825-E869 VanDerWaalsContact NH2-OE2 3.11Å
870	G	43.1	Very low	43.6	Very low	69 Å²	69	62.7 Å²	62.7	71%	0.711	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.9	-22.7	-175	0	0	0	0	0	114.3	P868	P868-G870 PolarHBondContact O-N 2.9Å
871	L	28.8	Very low	42.9	Very low	76 Å²	76	64.4 Å²	64.4	40%	0.398	35%	0.348	S	S	.	.			trans	-90.1	110.2	162	-89	90.7	0	0	0	110.5	M822 P868 T873	M822-L871 HydrophobicContact CE-CD1 4.17Å; M822-L871 HydrophobicContact CE-CD2 3.75Å; P868-L871 PolarHBondContact O-N 3.02Å; L871-T873 PolarHBondContact O-N 2.78Å
872	H	36.7	Very low	42.7	Very low	192 Å²	192	68.4 Å²	68.4	89%	0.889	36%	0.363	S	S	*	.			trans	-74.5	63.4	169.8	-70.9	-81.4	0	0	0	111.6
873	T	33.1	Very low	41.9	Very low	78 Å²	78	70.5 Å²	70.5	48%	0.479	38%	0.376	S	S	.	.			trans	-125.5	100.6	174	53.8	0	0	0	0	109.6	L871 K875	L871-T873 PolarHBondContact O-N 2.78Å; T873-K875 PolarHBondContact O-N 3.26Å
874	T	39.9	Very low	41.6	Very low	150 Å²	150	74 Å²	74	92%	0.92	39%	0.387	S	S	*	.			trans	-74.7	29.6	-171.1	51	0	0	0	0	115
875	K	37.4	Very low	40.9	Very low	170 Å²	170	73.8 Å²	73.8	74%	0.739	38%	0.384	S	S	*	.			trans	-123	125.1	179.6	-68.1	-174	177.5	-179.8	0	109.8	T873 I877	T873-K875 PolarHBondContact O-N 3.26Å; K875-I877 WeakPolarHBondContact O-CG1 3.45Å
876	Q	43.4	Very low	40.3	Very low	102 Å²	102	78.7 Å²	78.7	48%	0.477	41%	0.411	S	S	.	.			trans	-71.9	178.4	162.3	-138.4	-174.9	20	0	0	109.6	H769 D866	H769-Q876 PolarHBondContact CD2-O 2.88Å; H769-Q876 PolarHBondContact NE2-O 3.49Å; D866-Q876 PolarHBondContact OD1-NE2 3.01Å
877	I	39.6	Very low	39.7	Very low	33 Å²	33	78 Å²	78	17%	0.169	42%	0.417	C	S	.	.			trans	-167.2	115.2	-149.7	2.6	161	0	0	0	109.2	S768 H769 A864 W865 P867 K875	S768-I877 CarbonylContact O-C 3.05Å; S768-I877 VanDerWaalsContact O-CA 3.25Å; S768-I877 WeakPolarHBondContact O-CA 3Å; S768-I877 VanDerWaalsContact O-CG2 3.23Å; S768-I877 WeakPolarHBondContact O-CG2 3.41Å; S768-I877 WeakPolarHBondContact OG-CB 3.4Å; S768-I877 WeakPolarHBondContact OG-CG2 3.36Å; H769-I877 PolarHBondContact NE2-N 2.94Å; A864-I877 CarbonylContact C-O 3.57Å; A864-I877 WeakPolarHBondContact CA-O 3.05Å; W865-I877 HydrophobicContact CB-CD1 4.14Å; W865-I877 HydrophobicContact CD2-CD1 3.5Å; W865-I877 HydrophobicContact CE3-CD1 3.11Å; W865-I877 HydrophobicContact CE3-CG1 4.35Å; W865-I877 HydrophobicContact CG-CD1 4Å; W865-I877 HydrophobicContact CH2-CD1 4.38Å; W865-I877 HydrophobicContact CZ3-CD1 3.62Å; W865-I877 PolarHBondContact N-O 2.84Å; W865-I877 WeakPolarHBondContact O-CD1 3.21Å; W865-I877 WeakPolarHBondContact O-CG1 3.42Å; P867-I877 HydrophobicContact CB-CD1 4.35Å; P867-I877 HydrophobicContact CG-CD1 4.42Å; K875-I877 WeakPolarHBondContact O-CG1 3.45Å
878	S	38.3	Very low	38.9	Very low	5 Å²	5	79.1 Å²	79.1	4%	0.035	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	128.3	176.2	54	0	0	0	0	120.1	S768 H769 K770 E862 L863	S768-S878 VanDerWaalsContact C-N 3.26Å; S768-S878 CarbonylContact C-O 3.4Å; S768-S878 VanDerWaalsContact C-O 3.27Å; S768-S878 VanDerWaalsContact CB-C 3.48Å; S768-S878 VanDerWaalsContact N-C 3.27Å; S768-S878 PolarHBondContact N-O 3.45Å; S768-S878 PolarHBondContact O-N 2.74Å; S768-S878 VanDerWaalsContact O-N 3.17Å; H769-S878 CarbonylContact C-O 3.54Å; H769-S878 WeakPolarHBondContact CA-O 3.33Å; H769-S878 PolarHBondContact N-O 2.84Å; H769-S878 PolarHBondContact ND1-N 2.7Å; H769-S878 PolarHBondContact ND1-OG 3.35Å; K770-S878 PolarHBondContact N-O 3.07Å; E862-S878 VanDerWaalsContact OE1-CB 3.28Å; E862-S878 WeakPolarHBondContact OE1-CB 3.47Å; E862-S878 PolarHBondContact OE1-OG 3.49Å; L863-S878 CarbonylContact O-C 3.24Å; L863-S878 WeakPolarHBondContact O-CA 3.19Å
879	Y	39	Very low	39	Very low	12 Å²	12	84.5 Å²	84.5	5%	0.047	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	123.4	-177	-85.8	-121.1	0	0	0	115	R765 L766 V767 S768 E862 L863	R765-Y879 PolarHBondContact O-OH 3.06Å; L766-Y879 VanDerWaalsContact C-CG 3.43Å; L766-Y879 HydrophobicContact CB-CD2 3.73Å; L766-Y879 HydrophobicContact CB-CE2 3.25Å; L766-Y879 HydrophobicContact CD1-CE2 4.46Å; L766-Y879 HydrophobicContact CG-CE2 4.49Å; L766-Y879 WeakPolarHBondContact O-CD1 3.45Å; L766-Y879 WeakPolarHBondContact O-CE1 3.45Å; V767-Y879 VanDerWaalsContact C-CE2 3.4Å; V767-Y879 HydrophobicContact CB-CD1 3.8Å; V767-Y879 HydrophobicContact CB-CD2 3.53Å; V767-Y879 HydrophobicContact CB-CE1 3.17Å; V767-Y879 HydrophobicContact CB-CE2 2.84Å; V767-Y879 HydrophobicContact CB-CG 3.96Å; V767-Y879 WeakPolarHBondContact CB-OH 3.41Å; V767-Y879 HydrophobicContact CG1-CD2 4.01Å; V767-Y879 HydrophobicContact CG1-CE1 4.2Å; V767-Y879 HydrophobicContact CG1-CE2 2.86Å; V767-Y879 VanDerWaalsContact CG1-OH 3.25Å; V767-Y879 WeakPolarHBondContact CG1-OH 3.15Å; V767-Y879 HydrophobicContact CG2-CD1 4.22Å; V767-Y879 HydrophobicContact CG2-CE1 3.21Å; V767-Y879 HydrophobicContact CG2-CE2 3.99Å; V767-Y879 WeakPolarHBondContact CG2-OH 3.49Å; V767-Y879 PolarHBondContact N-OH 2.99Å; V767-Y879 VanDerWaalsContact O-CA 3.26Å; V767-Y879 WeakPolarHBondContact O-CA 3.45Å; V767-Y879 WeakPolarHBondContact O-CB 3.44Å; V767-Y879 WeakPolarHBondContact O-CD1 3.49Å; S768-Y879 VanDerWaalsContact N-CA 3.26Å; S768-Y879 VanDerWaalsContact N-CG 3.26Å; S768-Y879 WeakPolarHBondContact OG-CD2 3.32Å; S768-Y879 WeakPolarHBondContact OG-CE2 3.42Å; E862-Y879 CarbonylContact C-O 3.6Å; E862-Y879 WeakPolarHBondContact CA-O 3.06Å; L863-Y879 PolarHBondContact N-O 3.14Å; L863-Y879 PolarHBondContact O-N 3.1Å
880	Q	46.3	Very low	38.8	Very low	48 Å²	48	83.5 Å²	83.5	22%	0.224	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	122.3	162.3	-73.1	-167	0.4	0	0	110	K770 V861 E862	K770-Q880 PolarHBondContact O-NE2 2.88Å; V861-Q880 CarbonylContact O-C 3.54Å; V861-Q880 WeakPolarHBondContact O-CA 3.18Å; E862-Q880 HydrophobicContact CG-CG 4.16Å
881	V	42.4	Very low	38.6	Very low	37 Å²	37	81.8 Å²	81.8	22%	0.224	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	129.6	-177.6	-178.8	0	0	0	0	109.4	L659 C860 V861 L863	L659-V881 HydrophobicContact CD2-CG2 4.18Å; C860-V881 CarbonylContact C-O 3.57Å; C860-V881 WeakPolarHBondContact CA-O 3.42Å; V861-V881 HydrophobicContact CB-CB 4.45Å; V861-V881 PolarHBondContact N-O 3.15Å; V861-V881 PolarHBondContact O-N 3.11Å; L863-V881 HydrophobicContact CD1-CG2 3.87Å
882	F	43.2	Very low	39.5	Very low	112 Å²	112	79.1 Å²	79.1	49%	0.491	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	126.4	179.3	-66.7	-91.8	0	0	0	110.8	L859 C860	L859-F882 CarbonylContact O-C 3.55Å; L859-F882 WeakPolarHBondContact O-CA 3.46Å; C860-F882 HydrophobicContact CB-CD1 4.28Å; C860-F882 HydrophobicContact CB-CE1 4.14Å
883	V	40.1	Very low	40	Very low	49 Å²	49	74.4 Å²	74.4	30%	0.297	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	125	-179.2	-176.5	0	0	0	0	108.8	Y858 L859 V861	Y858-V883 CarbonylContact C-O 3.54Å; Y858-V883 VanDerWaalsContact CA-O 3.31Å; Y858-V883 WeakPolarHBondContact CA-O 3.42Å; L859-V883 HydrophobicContact CB-CB 4.35Å; L859-V883 PolarHBondContact N-O 2.85Å; L859-V883 PolarHBondContact O-N 3.13Å; V861-V883 HydrophobicContact CG2-CG2 4.13Å
884	R	40.4	Very low	40.4	Very low	112 Å²	112	74.8 Å²	74.8	42%	0.423	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	126	174.5	-169.5	-177	-165.8	-170.9	9	109.4	D855 Y858 I886	D855-R884 IonicContact OD1-CZ 2.95Å; D855-R884 IonicContact OD1-NH2 2.67Å; D855-R884 PolarHBondContact OD1-NH2 2.83Å; Y858-R884 HydrophobicContact CD1-CB 3.99Å; Y858-R884 HydrophobicContact CD1-CG 4.31Å; Y858-R884 HydrophobicContact CE1-CB 3.76Å; Y858-R884 HydrophobicContact CE1-CG 3.85Å; R884-I886 HydrophobicContact CG-CG1 4.42Å
885	L	40.5	Very low	40.4	Very low	4 Å²	4	70 Å²	70	2%	0.021	35%	0.346	C	S	.	.			trans	-79.1	133.6	172.3	-65.7	-178.9	0	0	0	110.5	P857 L859 I892 L895 L923	P857-L885 HydrophobicContact CG-CD1 4.4Å; P857-L885 PolarHBondContact O-N 2.68Å; L859-L885 HydrophobicContact CD1-CD1 4.09Å; L859-L885 HydrophobicContact CD1-CD2 4.05Å; L859-L885 HydrophobicContact CD1-CG 4.2Å; L885-I892 HydrophobicContact CB-CG1 4.42Å; L885-L895 HydrophobicContact CD1-CB 4.05Å; L885-L895 HydrophobicContact CD1-CD1 4.01Å; L885-L895 HydrophobicContact CD2-CD1 3.84Å; L885-L923 HydrophobicContact CD2-CD2 3.58Å
886	I	35.4	Very low	40.7	Very low	131 Å²	131	63.4 Å²	63.4	67%	0.672	32%	0.32	S	S	*	.			trans	-140	113.9	171.5	-53.2	179.5	0	0	0	107	L856 R884	L856-I886 HydrophobicContact CD1-CG1 4.27Å; R884-I886 HydrophobicContact CG-CG1 4.42Å
887	G	39.8	Very low	40.6	Very low	39 Å²	39	64.6 Å²	64.6	40%	0.402	33%	0.33	S	S	.	.	S	Bend	trans	-178.1	-175.1	-175.3	0	0	0	0	0	112.1	I892	G887-I892 WeakPolarHBondContact O-CD1 2.99Å
888	P	29.7	Very low	40.2	Very low	63 Å²	63	69.4 Å²	69.4	41%	0.409	36%	0.361	S	S	.	.			trans	-56.8	148.4	170.2	-21	33	0	0	0	111.2	E890 L891 I892	P888-E890 VanDerWaalsContact C-N 3.34Å; P888-E890 WeakPolarHBondContact CB-OE2 3.36Å; P888-E890 PolarHBondContact O-N 3.08Å; P888-L891 HydrophobicContact CB-CB 4.29Å; P888-L891 HydrophobicContact CG-CB 4.46Å; P888-L891 PolarHBondContact O-N 2.87Å; P888-L891 VanDerWaalsContact O-N 3.13Å; P888-I892 WeakPolarHBondContact O-CG1 3.21Å; P888-I892 PolarHBondContact O-N 2.71Å
889	Q	42.2	Very low	39.7	Very low	133 Å²	133	75.2 Å²	75.2	62%	0.621	40%	0.396	S	S	*	.	H	α-helix	trans	-66.9	-36.6	-174.3	-172.1	170.8	-34.8	0	0	111.8	L891 I892 E893	Q889-L891 PolarHBondContact O-N 3.21Å; Q889-I892 CarbonylContact O-C 3.49Å; Q889-I892 WeakPolarHBondContact O-CB 2.8Å; Q889-I892 PolarHBondContact O-N 3.31Å; Q889-E893 HydrophobicContact CG-CG 4.32Å; Q889-E893 WeakPolarHBondContact CG-OE1 3.18Å; Q889-E893 PolarHBondContact NE2-OE1 2.85Å; Q889-E893 WeakPolarHBondContact O-CB 3.46Å; Q889-E893 WeakPolarHBondContact O-CG 3.26Å; Q889-E893 PolarHBondContact O-N 3.47Å
890	E	35.3	Very low	39.1	Very low	138 Å²	138	83.2 Å²	83.2	65%	0.645	44%	0.439	S	S	*	.	H	α-helix	trans	-61.7	-35.9	175	-47.6	90.1	155	0	0	111.3	P888 I892 E893 E894	P888-E890 VanDerWaalsContact C-N 3.34Å; P888-E890 WeakPolarHBondContact CB-OE2 3.36Å; P888-E890 PolarHBondContact O-N 3.08Å; E890-I892 VanDerWaalsContact C-N 3.34Å; E890-E893 PolarHBondContact O-N 2.91Å; E890-E894 WeakPolarHBondContact O-CB 3.37Å; E890-E894 PolarHBondContact O-N 3.4Å
891	L	39.4	Very low	38.2	Very low	34 Å²	34	86.2 Å²	86.2	18%	0.178	47%	0.465	C	S	.	.	H	α-helix	trans	-77.6	-20.6	178.1	-161.6	126.4	0	0	0	112.5	P888 Q889 L895 L919	P888-L891 HydrophobicContact CB-CB 4.29Å; P888-L891 HydrophobicContact CG-CB 4.46Å; P888-L891 PolarHBondContact O-N 2.87Å; P888-L891 VanDerWaalsContact O-N 3.13Å; Q889-L891 PolarHBondContact O-N 3.21Å; L891-L895 HydrophobicContact CD2-CD1 4.22Å; L891-L895 WeakPolarHBondContact O-CB 3.48Å; L891-L895 VanDerWaalsContact O-CD1 3.29Å; L891-L895 WeakPolarHBondContact O-CD1 3.26Å; L891-L895 WeakPolarHBondContact O-CG 3.41Å; L891-L895 PolarHBondContact O-N 3.18Å; L891-L919 HydrophobicContact CD1-CD1 4.41Å; L891-L919 HydrophobicContact CD1-CD2 4.46Å; L891-L919 HydrophobicContact CD1-CG 4.15Å; L891-L919 HydrophobicContact CG-CD2 4.2Å; L891-L919 HydrophobicContact CG-CG 4.37Å
892	I	46.6	Very low	37.4	Very low	20 Å²	20	90.3 Å²	90.3	10%	0.103	50%	0.496	C	S	.	.	H	α-helix	trans	-78.9	-41.2	169.2	-67.5	166.9	0	0	0	109.8	L856 P857 L885 G887 P888 Q889 E890 L895 T896	L856-I892 HydrophobicContact CD2-CD1 3.74Å; P857-I892 HydrophobicContact CG-CG2 3.61Å; L885-I892 HydrophobicContact CB-CG1 4.42Å; G887-I892 WeakPolarHBondContact O-CD1 2.99Å; P888-I892 WeakPolarHBondContact O-CG1 3.21Å; P888-I892 PolarHBondContact O-N 2.71Å; Q889-I892 CarbonylContact O-C 3.49Å; Q889-I892 WeakPolarHBondContact O-CB 2.8Å; Q889-I892 PolarHBondContact O-N 3.31Å; E890-I892 VanDerWaalsContact C-N 3.34Å; I892-L895 CarbonylContact O-C 3.56Å; I892-L895 PolarHBondContact O-N 3.49Å; I892-T896 WeakPolarHBondContact O-CG2 3.5Å; I892-T896 PolarHBondContact O-N 3.22Å; I892-T896 PolarHBondContact O-OG1 2.69Å
893	E	47.9	Very low	36.7	Very low	92 Å²	92	90 Å²	90	43%	0.43	51%	0.508	S	S	.	.	H	α-helix	trans	-67.7	-45.4	179.3	-73.4	169	178.9	0	0	111.5	Q889 E890 L895 T896 D897	Q889-E893 HydrophobicContact CG-CG 4.32Å; Q889-E893 WeakPolarHBondContact CG-OE1 3.18Å; Q889-E893 PolarHBondContact NE2-OE1 2.85Å; Q889-E893 WeakPolarHBondContact O-CB 3.46Å; Q889-E893 WeakPolarHBondContact O-CG 3.26Å; Q889-E893 PolarHBondContact O-N 3.47Å; E890-E893 PolarHBondContact O-N 2.91Å; E893-L895 VanDerWaalsContact C-N 3.25Å; E893-L895 PolarHBondContact O-N 3.16Å; E893-T896 WeakPolarHBondContact CA-OG1 3.18Å; E893-T896 WeakPolarHBondContact O-CA 3.41Å; E893-T896 PolarHBondContact O-N 3.36Å; E893-T896 PolarHBondContact O-OG1 3.3Å; E893-D897 PolarHBondContact O-N 3.3Å; E893-D897 VanDerWaalsContact O-N 3.12Å
894	E	40.9	Very low	36.1	Very low	87 Å²	87	96.9 Å²	96.9	41%	0.407	54%	0.536	S	S	.	.	H	α-helix	trans	-57.7	-35.8	171.2	-173.7	179.5	-112.2	0	0	112.1	E890 T896 H916 L919	E890-E894 WeakPolarHBondContact O-CB 3.37Å; E890-E894 PolarHBondContact O-N 3.4Å; E894-T896 VanDerWaalsContact C-N 3.25Å; E894-T896 PolarHBondContact O-N 3.15Å; E894-H916 IonicContact OE1-CE1 3.04Å; E894-H916 PolarHBondContact OE1-CE1 3.35Å; E894-H916 IonicContact OE1-ND1 3.7Å; E894-H916 IonicContact OE2-CE1 2.7Å; E894-H916 IonicContact OE2-ND1 2.76Å; E894-L919 WeakPolarHBondContact OE2-CD1 3.22Å; E894-L919 WeakPolarHBondContact OE2-CD2 3.14Å
895	L	40.6	Very low	35.5	Very low	49 Å²	49	98.8 Å²	98.8	26%	0.257	55%	0.554	S	S	.	*	H	α-helix	trans	-76.5	-2.1	172.2	-78.7	174.5	0	0	0	114.3	L885 L891 I892 E893 L919	L885-L895 HydrophobicContact CD1-CB 4.05Å; L885-L895 HydrophobicContact CD1-CD1 4.01Å; L885-L895 HydrophobicContact CD2-CD1 3.84Å; L891-L895 HydrophobicContact CD2-CD1 4.22Å; L891-L895 WeakPolarHBondContact O-CB 3.48Å; L891-L895 VanDerWaalsContact O-CD1 3.29Å; L891-L895 WeakPolarHBondContact O-CD1 3.26Å; L891-L895 WeakPolarHBondContact O-CG 3.41Å; L891-L895 PolarHBondContact O-N 3.18Å; I892-L895 CarbonylContact O-C 3.56Å; I892-L895 PolarHBondContact O-N 3.49Å; E893-L895 VanDerWaalsContact C-N 3.25Å; E893-L895 PolarHBondContact O-N 3.16Å; L895-L919 HydrophobicContact CD1-CD2 4.44Å; L895-L919 HydrophobicContact CD2-CD2 3.84Å; L895-L919 HydrophobicContact CG-CD2 3.87Å
896	T	44.1	Very low	34.8	Very low	32 Å²	32	109.4 Å²	109.4	20%	0.196	60%	0.596	C	S	.	*	H	α-helix	trans	-117.6	-20.5	-179.2	54.4	0	0	0	0	116.4	K834 I892 E893 E894	K834-T896 PolarHBondContact NZ-O 2.86Å; I892-T896 WeakPolarHBondContact O-CG2 3.5Å; I892-T896 PolarHBondContact O-N 3.22Å; I892-T896 PolarHBondContact O-OG1 2.69Å; E893-T896 WeakPolarHBondContact CA-OG1 3.18Å; E893-T896 WeakPolarHBondContact O-CA 3.41Å; E893-T896 PolarHBondContact O-N 3.36Å; E893-T896 PolarHBondContact O-OG1 3.3Å; E894-T896 VanDerWaalsContact C-N 3.25Å; E894-T896 PolarHBondContact O-N 3.15Å
897	D	41	Very low	34.4	Very low	127 Å²	127	107 Å²	107	68%	0.679	60%	0.602	S	S	*	*	H	α-helix	trans	-102.7	-15.9	-169.9	-89.3	8.7	0	0	0	116.2	E893 T899	E893-D897 PolarHBondContact O-N 3.3Å; E893-D897 VanDerWaalsContact O-N 3.12Å; D897-T899 PolarHBondContact O-N 2.98Å
898	T	31.8	Very low	33.6	Very low	133 Å²	133	109.9 Å²	109.9	82%	0.816	62%	0.617	S	S	*	*			trans	-74.1	92.8	176.4	32.3	0	0	0	0	112.1
899	T	27.6	Very low	33.3	Very low	127 Å²	127	110.2 Å²	110.2	78%	0.779	62%	0.621	S	S	*	*			trans	-99.6	115.6	173.3	44.3	0	0	0	0	111.4	D897	D897-T899 PolarHBondContact O-N 2.98Å
900	L	26.2	Very low	32.6	Very low	180 Å²	180	108.4 Å²	108.4	94%	0.942	62%	0.615	S	S	*	*			trans	-131.6	129.8	164.9	-91.4	169.9	0	0	0	109.1
901	S	27.8	Very low	32.2	Very low	111 Å²	111	107.2 Å²	107.2	78%	0.776	61%	0.609	S	S	*	*			trans	-91.5	158	-169.6	49.3	0	0	0	0	113.3	S903	S901-S903 PolarHBondContact O-N 3.35Å
902	S	25.2	Very low	31.6	Very low	124 Å²	124	112.8 Å²	112.8	87%	0.867	63%	0.628	S	S	*	*	S	Bend	trans	-73.3	112.2	-174	54	0	0	0	0	114
903	S	27.7	Very low	30.7	Very low	106 Å²	106	121.3 Å²	121.3	74%	0.741	67%	0.667	S	S	*	*			trans	-165.9	-177.3	154.4	51.7	0	0	0	0	110.2	S901	S901-S903 PolarHBondContact O-N 3.35Å
904	E	27.7	Very low	29.6	Very low	193 Å²	193	120.9 Å²	120.9	90%	0.902	69%	0.687	S	S	*	*			trans	61.3	55.1	-180	-59.5	-164	174.1	0	0	116.5
905	L	28	Very low	29	Very low	152 Å²	152	119.7 Å²	119.7	80%	0.796	70%	0.699	S	S	*	*			trans	-85.2	144.6	153.1	-132.8	164	0	0	0	108.6
906	Y	26.9	Very low	28.4	Very low	227 Å²	227	123.2 Å²	123.2	89%	0.89	71%	0.714	S	S	*	*	S	Bend	trans	76.6	97.2	-175	-58.8	-86.5	0	0	0	116.6
907	G	25.9	Very low	27.8	Very low	79 Å²	79	126.7 Å²	126.7	81%	0.814	74%	0.737	S	S	*	*			trans	172.4	132.7	167.6	0	0	0	0	0	112.6
908	S	24.1	Very low	27.2	Very low	100 Å²	100	126.4 Å²	126.4	70%	0.699	74%	0.735	S	S	*	*			trans	-77.7	151.7	-174.9	53.5	0	0	0	0	115	R7	R7-S908 PolarHBondContact NH2-O 3.42Å
909	S	23.5	Very low	27.1	Very low	71 Å²	71	121.4 Å²	121.4	50%	0.497	70%	0.703	S	S	.	*			trans	64.4	92.5	156.9	69.6	0	0	0	0	118.8	R7 N8	R7-S909 PolarHBondContact NE-O 3.14Å; R7-S909 PolarHBondContact NH2-O 2.87Å; N8-S909 PolarHBondContact ND2-O 2.86Å; N8-S909 VanDerWaalsContact ND2-O 3.09Å
910	L	27.6	Very low	27.3	Very low	95 Å²	95	122.9 Å²	122.9	50%	0.497	70%	0.701	S	S	.	*			trans	-154.4	83.2	163.3	-120.3	165.8	0	0	0	113.1	K6 R7 N8	K6-L910 HydrophobicContact CB-CD2 4.05Å; K6-L910 HydrophobicContact CD-CD1 4Å; K6-L910 HydrophobicContact CG-CD1 4.11Å; K6-L910 HydrophobicContact CG-CD2 4.09Å; R7-L910 HydrophobicContact CB-CD2 4.36Å; R7-L910 HydrophobicContact CG-CD1 4.32Å; R7-L910 HydrophobicContact CG-CD2 3.65Å; R7-L910 HydrophobicContact CG-CG 3.57Å; N8-L910 VanDerWaalsContact OD1-CA 3.27Å; N8-L910 WeakPolarHBondContact OD1-CA 3.46Å; N8-L910 PolarHBondContact OD1-N 2.95Å
911	E	26.4	Very low	27.9	Very low	113 Å²	113	124 Å²	124	53%	0.528	69%	0.693	S	S	.	*			trans	-82.5	161.1	167	-53.1	175.5	136.6	0	0	112.2	N8 S9	N8-E911 PolarHBondContact N-O 3.11Å; N8-E911 VanDerWaalsContact N-O 3.16Å; N8-E911 PolarHBondContact OD1-N 3.2Å; S9-E911 VanDerWaalsContact CA-OE2 3.23Å; S9-E911 WeakPolarHBondContact CA-OE2 3.37Å; S9-E911 PolarHBondContact N-OE2 2.79Å
912	R	25.5	Very low	28.1	Very low	150 Å²	150	126 Å²	126	57%	0.566	68%	0.683	S	S	*	*			trans	76.4	85.3	171.8	-52.5	-168.6	-167.7	-169.7	10.1	117	S9	S9-R912 PolarHBondContact O-NH2 2.87Å
913	E	27.8	Very low	28.4	Very low	199 Å²	199	123.6 Å²	123.6	93%	0.93	66%	0.66	S	S	*	*			trans	-161.1	171.2	134.5	-113.5	165.5	-170.4	0	0	109.9
914	G	26.6	Very low	28.7	Very low	83 Å²	83	125 Å²	125	86%	0.856	66%	0.659	S	S	*	*			trans	-89.9	179	-163.4	0	0	0	0	0	117.1
915	G	27.8	Very low	29	Very low	63 Å²	63	119.1 Å²	119.1	65%	0.649	64%	0.643	S	S	*	*			trans	154.9	100.7	173.4	0	0	0	0	0	115.9	P917	G915-P917 WeakPolarHBondContact O-CD 3.06Å
916	H	28.2	Very low	29	Very low	123 Å²	123	119.2 Å²	119.2	57%	0.569	64%	0.644	S	S	*	*			trans	30.9	70.2	158.6	-58.7	-105.2	0	0	0	120.7	E894 L918 L919	E894-H916 IonicContact OE1-CE1 3.04Å; E894-H916 PolarHBondContact OE1-CE1 3.35Å; E894-H916 IonicContact OE1-ND1 3.7Å; E894-H916 IonicContact OE2-CE1 2.7Å; E894-H916 IonicContact OE2-ND1 2.76Å; H916-L918 VanDerWaalsContact C-N 3.3Å; H916-L918 PolarHBondContact O-N 3.02Å; H916-L919 HydrophobicContact CB-CD1 4.48Å
917	P	30.3	Very low	29	Very low	104 Å²	104	113.8 Å²	113.8	68%	0.675	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-10	168.1	-15.7	32.1	0	0	0	115.1	G915	G915-P917 WeakPolarHBondContact O-CD 3.06Å
918	L	28.7	Very low	29.1	Very low	121 Å²	121	115 Å²	115	63%	0.634	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-33.2	-169.5	-72.2	171.3	0	0	0	114.7	H916 Q920 R921	H916-L918 VanDerWaalsContact C-N 3.3Å; H916-L918 PolarHBondContact O-N 3.02Å; L918-Q920 VanDerWaalsContact C-N 3.29Å; L918-Q920 PolarHBondContact O-N 2.84Å; L918-R921 PolarHBondContact O-N 2.72Å
919	L	30.2	Very low	29.2	Very low	29 Å²	29	112.2 Å²	112.2	15%	0.152	61%	0.614	C	S	.	*	G	3₁₀ helix	trans	-60.5	-40.1	178.2	-92.5	75.2	0	0	0	111.9	L891 E894 L895 H916 R921 R922	L891-L919 HydrophobicContact CD1-CD1 4.41Å; L891-L919 HydrophobicContact CD1-CD2 4.46Å; L891-L919 HydrophobicContact CD1-CG 4.15Å; L891-L919 HydrophobicContact CG-CD2 4.2Å; L891-L919 HydrophobicContact CG-CG 4.37Å; E894-L919 WeakPolarHBondContact OE2-CD1 3.22Å; E894-L919 WeakPolarHBondContact OE2-CD2 3.14Å; L895-L919 HydrophobicContact CD1-CD2 4.44Å; L895-L919 HydrophobicContact CD2-CD2 3.84Å; L895-L919 HydrophobicContact CG-CD2 3.87Å; H916-L919 HydrophobicContact CB-CD1 4.48Å; L919-R921 PolarHBondContact O-N 2.79Å; L919-R922 PolarHBondContact O-N 3.34Å
920	Q	32.4	Very low	29.4	Very low	158 Å²	158	115 Å²	115	74%	0.738	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-61.4	-21	-175	-155.4	174.8	45.7	0	0	113.4	L918	L918-Q920 VanDerWaalsContact C-N 3.29Å; L918-Q920 PolarHBondContact O-N 2.84Å
921	R	37.5	Very low	29.4	Very low	203 Å²	203	115.5 Å²	115.5	77%	0.766	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-82.8	-22.6	175.5	-74.4	-178.1	169.9	172.4	-2.9	114.4	L918 L919	L918-R921 PolarHBondContact O-N 2.72Å; L919-R921 PolarHBondContact O-N 2.79Å
922	R	32.9	Very low	29.4	Very low	152 Å²	152	114.4 Å²	114.4	57%	0.574	62%	0.624	S	S	*	*	S	Bend	trans	-86.8	-0.9	-174.3	-72.3	-176.5	174.8	171.4	-0.9	114.5	E621 L919	E621-R922 IonicContact OE1-CZ 3.61Å; E621-R922 IonicContact OE1-NH2 2.77Å; E621-R922 PolarHBondContact OE1-NH2 2.86Å; L919-R922 PolarHBondContact O-N 3.34Å
923	L	30.9	Very low	29.7	Very low	74 Å²	74	111.2 Å²	111.2	39%	0.387	61%	0.611	S	S	.	*	S	Bend	trans	-100.7	-3.3	-162.2	-87.2	163.1	0	0	0	117.5	L885	L885-L923 HydrophobicContact CD2-CD2 3.58Å
924	L	33.9	Very low	29.8	Very low	137 Å²	137	102.7 Å²	102.7	72%	0.717	57%	0.574	S	S	*	*	S	Bend	trans	-123.6	-1	-157.5	-91.4	158.3	0	0	0	118	L657	L657-L924 HydrophobicContact CD2-CD2 4.43Å
925	A	33	Very low	30	Very low	69 Å²	69	101 Å²	101	57%	0.57	55%	0.549	S	S	*	.			trans	-94.9	-0.9	-156.5	0	0	0	0	0	118.7
926	N	28.3	Very low	30.2	Very low	154 Å²	154	105.1 Å²	105.1	82%	0.824	55%	0.551	S	S	*	*			trans	-123.6	21.8	-146.8	-132.8	14.3	0	0	0	118.9
927	V	28.5	Very low	30.7	Very low	112 Å²	112	101.8 Å²	101.8	68%	0.679	54%	0.542	S	S	*	.			trans	-139	105.4	-170.7	-169.6	0	0	0	0	116.1
928	T	27.2	Very low	31.3	Very low	105 Å²	105	97.1 Å²	97.1	64%	0.644	51%	0.512	S	S	*	.			trans	57.8	129.4	152.6	66	0	0	0	0	124.3	Q672	Q672-T928 PolarHBondContact NE2-O 2.86Å
929	G	26.9	Very low	32.1	Very low	42 Å²	42	100.9 Å²	100.9	43%	0.433	52%	0.517	S	S	.	.			trans	136.1	101	134	0	0	0	0	0	119.5	T931	G929-T931 VanDerWaalsContact C-N 3.32Å; G929-T931 PolarHBondContact O-N 3.27Å
930	N	27.5	Very low	33.2	Very low	130 Å²	130	99.7 Å²	99.7	70%	0.695	51%	0.511	S	S	*	.	S	Bend	trans	49.6	12.4	147.5	-69	33.8	0	0	0	122.5
931	T	26.1	Very low	34.2	Very low	105 Å²	105	93.1 Å²	93.1	64%	0.644	49%	0.486	S	S	*	.	S	Bend	trans	-138.6	111.3	143.8	-48.7	0	0	0	0	107.3	G929 R933	G929-T931 VanDerWaalsContact C-N 3.32Å; G929-T931 PolarHBondContact O-N 3.27Å; T931-R933 PolarHBondContact O-N 2.92Å
932	F	26.5	Very low	35.5	Very low	90 Å²	90	87 Å²	87	40%	0.395	46%	0.463	S	S	.	.			trans	-73.4	73.9	-177.1	-82.9	-66.1	0	0	0	111.5	D636 Y644	D636-F932 WeakPolarHBondContact O-CE2 3.06Å; Y644-F932 HydrophobicContact CD2-CB 4.36Å; Y644-F932 HydrophobicContact CE2-CB 3.44Å; Y644-F932 VanDerWaalsContact CE2-CB 3.44Å; Y644-F932 HydrophobicContact CE2-CG 4.44Å; Y644-F932 VanDerWaalsContact CZ-O 3.25Å; Y644-F932 PolarHBondContact OH-O 3.28Å; Y644-F932 VanDerWaalsContact OH-O 3.13Å
933	R	33.3	Very low	37	Very low	82 Å²	82	81 Å²	81	31%	0.309	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-68.4	153.8	157.7	-66	-176.5	176.5	-178.6	-4.5	108.9	T931	T931-R933 PolarHBondContact O-N 2.92Å
934	S	29.9	Very low	38.5	Very low	21 Å²	21	81.3 Å²	81.3	15%	0.147	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-77.4	146.3	-171.6	85.2	0	0	0	0	110.3	D938	S934-D938 WeakPolarHBondContact CA-OD2 2.96Å; S934-D938 PolarHBondContact OG-O 2.84Å
935	S	29.7	Very low	40.2	Very low	48 Å²	48	76.5 Å²	76.5	34%	0.336	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-80.1	173.9	179.8	7	0	0	0	0	111.6	R635 S937 D938	R635-S935 PolarHBondContact NH2-OG 2.87Å; S935-S937 PolarHBondContact O-N 2.98Å; S935-D938 WeakPolarHBondContact CA-OD1 3.43Å; S935-D938 WeakPolarHBondContact CB-OD1 3.42Å; S935-D938 PolarHBondContact N-OD1 3.41Å; S935-D938 VanDerWaalsContact N-OD1 3.13Å; S935-D938 PolarHBondContact N-OD2 2.96Å; S935-D938 WeakPolarHBondContact O-CB 3.12Å; S935-D938 PolarHBondContact O-N 3.07Å; S935-D938 PolarHBondContact OG-OD1 2.89Å; S935-D938 PolarHBondContact OG-OD2 2.8Å
936	E	32.7	Very low	42	Very low	148 Å²	148	74 Å²	74	69%	0.692	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-11.9	177.6	-69.3	-168.2	119.8	0	0	114.8
937	S	37.2	Very low	44.4	Very low	53 Å²	53	67.2 Å²	67.2	37%	0.371	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-41.2	166.2	28.2	0	0	0	0	112.8	S935 R939	S935-S937 PolarHBondContact O-N 2.98Å; S937-R939 PolarHBondContact O-N 3.48Å
938	D	43.1	Very low	46.8	Very low	7 Å²	7	61.9 Å²	61.9	4%	0.037	33%	0.334	C	S	.	.			trans	-85.2	43.8	-160.1	-46.6	34.6	0	0	0	112.3	E633 R635 S934 S935 I940	E633-D938 WeakPolarHBondContact OE2-CB 2.65Å; R635-D938 IonicContact CZ-OD2 3.54Å; R635-D938 IonicContact NE-OD2 3.59Å; R635-D938 IonicContact NH2-OD1 2.68Å; R635-D938 IonicContact NH2-OD2 2.78Å; R635-D938 PolarHBondContact NH2-OD2 3.36Å; S934-D938 WeakPolarHBondContact CA-OD2 2.96Å; S934-D938 PolarHBondContact OG-O 2.84Å; S935-D938 WeakPolarHBondContact CA-OD1 3.43Å; S935-D938 WeakPolarHBondContact CB-OD1 3.42Å; S935-D938 PolarHBondContact N-OD1 3.41Å; S935-D938 VanDerWaalsContact N-OD1 3.13Å; S935-D938 PolarHBondContact N-OD2 2.96Å; S935-D938 WeakPolarHBondContact O-CB 3.12Å; S935-D938 PolarHBondContact O-N 3.07Å; S935-D938 PolarHBondContact OG-OD1 2.89Å; S935-D938 PolarHBondContact OG-OD2 2.8Å; D938-I940 PolarHBondContact O-N 3.08Å
939	R	46.6	Very low	49.4	Very low	200 Å²	200	58.4 Å²	58.4	76%	0.755	31%	0.31	S	S	*	.			trans	-64.5	122.9	179	-67.5	-175	178.5	-164.4	-3	109.5	S937 G941 Y946	S937-R939 PolarHBondContact O-N 3.48Å; R939-G941 PolarHBondContact O-N 3.36Å; R939-Y946 PolarHBondContact O-OH 2.89Å
940	I	52.9	Low	52.1	Low	4 Å²	4	56.4 Å²	56.4	2%	0.021	29%	0.29	C	S	.	.			trans	-78	115.6	173.6	-37.2	179.5	0	0	0	107.5	T568 I570 L646 D648 D938 Y942 Y946 T968	T568-I940 WeakPolarHBondContact O-CD1 3.37Å; I570-I940 HydrophobicContact CD1-CG2 4.28Å; L646-I940 HydrophobicContact CB-CD1 3.95Å; L646-I940 HydrophobicContact CD2-CD1 3.74Å; L646-I940 HydrophobicContact CD2-CG1 3.88Å; L646-I940 HydrophobicContact CG-CD1 3.6Å; L646-I940 HydrophobicContact CG-CG1 4Å; D648-I940 PolarHBondContact OD1-N 3.37Å; D648-I940 WeakPolarHBondContact OD2-CB 3Å; D938-I940 PolarHBondContact O-N 3.08Å; I940-Y942 PolarHBondContact O-N 2.8Å; I940-Y946 WeakPolarHBondContact CA-OH 3.45Å; I940-Y946 HydrophobicContact CG2-CD2 4.24Å; I940-Y946 HydrophobicContact CG2-CE2 3.59Å; I940-T968 HydrophobicContact CG2-CG2 3.46Å; I940-T968 VanDerWaalsContact CG2-CG2 3.46Å
941	G	52.9	Low	54.6	Low	20 Å²	20	50.2 Å²	50.2	21%	0.206	26%	0.257	C	S	.	.			trans	-70.2	118.6	174.7	0	0	0	0	0	109.6	R939 G943 L944 Y946 T968	R939-G941 PolarHBondContact O-N 3.36Å; G941-G943 PolarHBondContact O-N 3.19Å; G941-L944 WeakPolarHBondContact O-CB 3.14Å; G941-L944 PolarHBondContact O-N 3.11Å; G941-Y946 PolarHBondContact N-OH 2.93Å; G941-T968 PolarHBondContact O-OG1 3.05Å
942	Y	64.4	Low	56.9	Low	75 Å²	75	45.2 Å²	45.2	29%	0.294	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	132.5	168.7	-50.6	-75.6	0	0	0	111.2	P567 T568 I940 L944 A971 N1003 G1004	P567-Y942 HydrophobicContact CB-CD1 3.56Å; P567-Y942 HydrophobicContact CB-CE1 4.04Å; T568-Y942 HydrophobicContact CG2-CE1 3.64Å; I940-Y942 PolarHBondContact O-N 2.8Å; Y942-L944 VanDerWaalsContact C-N 3.28Å; Y942-L944 PolarHBondContact O-N 2.96Å; Y942-A971 HydrophobicContact CD1-CB 3.68Å; Y942-A971 HydrophobicContact CE1-CB 3.92Å; Y942-A971 HydrophobicContact CG-CB 4.2Å; Y942-N1003 WeakPolarHBondContact CB-O 3.4Å; Y942-N1003 HydrophobicContact CD2-CB 3.6Å; Y942-N1003 HydrophobicContact CE2-CB 4.17Å; Y942-N1003 HydrophobicContact CG-CB 3.85Å; Y942-G1004 WeakPolarHBondContact O-CA 3.3Å
943	G	65.3	Low	58.7	Low	26 Å²	26	43.2 Å²	43.2	27%	0.268	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	15.2	-177.6	0	0	0	0	0	115.6	G941 T968 P969	G941-G943 PolarHBondContact O-N 3.19Å; G943-T968 WeakPolarHBondContact CA-O 3.42Å; G943-T968 PolarHBondContact N-OG1 3.34Å; G943-P969 PolarHBondContact N-O 3.47Å
944	L	61.7	Low	60	Low	80 Å²	80	40 Å²	40	42%	0.419	21%	0.207	S	C	.	.			trans	-100.5	142.3	177.2	-62.1	-171.4	0	0	0	112.2	G941 Y942 Y946 T967 T968	G941-L944 WeakPolarHBondContact O-CB 3.14Å; G941-L944 PolarHBondContact O-N 3.11Å; Y942-L944 VanDerWaalsContact C-N 3.28Å; Y942-L944 PolarHBondContact O-N 2.96Å; L944-Y946 HydrophobicContact CB-CD2 4.3Å; L944-Y946 HydrophobicContact CB-CE2 3.8Å; L944-Y946 HydrophobicContact CD1-CE2 4.49Å; L944-T967 WeakPolarHBondContact O-CA 3.31Å; L944-T968 PolarHBondContact N-OG1 3.43Å; L944-T968 VanDerWaalsContact N-OG1 3.07Å; L944-T968 PolarHBondContact O-N 3.28Å; L944-T968 PolarHBondContact O-OG1 3.06Å
945	T	71	Confident	61.2	Low	35 Å²	35	42.7 Å²	42.7	22%	0.215	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	131.2	165.9	-52.9	0	0	0	0	110.2	A596 E965 V966 T967	A596-T945 HydrophobicContact CB-CG2 3.65Å; A596-T945 PolarHBondContact N-O 3.45Å; T945-E965 HydrophobicContact CG2-CB 3.95Å; T945-E965 HydrophobicContact CG2-CG 4.48Å; T945-V966 WeakPolarHBondContact CA-O 3.23Å; T945-T967 PolarHBondContact OG1-OG1 2.72Å
946	Y	70.1	Confident	62.3	Low	17 Å²	17	42.8 Å²	42.8	7%	0.067	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	131.9	173.7	-76.3	-97.1	0	0	0	109.8	I570 F593 R594 P595 R939 I940 G941 L944 F948 E965 V966	I570-Y946 HydrophobicContact CD1-CD2 4.19Å; F593-Y946 HydrophobicContact CD2-CD1 4.38Å; R594-Y946 CarbonylContact O-C 3.59Å; R594-Y946 WeakPolarHBondContact O-CA 3.34Å; P595-Y946 HydrophobicContact CG-CE1 4.3Å; R939-Y946 PolarHBondContact O-OH 2.89Å; I940-Y946 WeakPolarHBondContact CA-OH 3.45Å; I940-Y946 HydrophobicContact CG2-CD2 4.24Å; I940-Y946 HydrophobicContact CG2-CE2 3.59Å; G941-Y946 PolarHBondContact N-OH 2.93Å; L944-Y946 HydrophobicContact CB-CD2 4.3Å; L944-Y946 HydrophobicContact CB-CE2 3.8Å; L944-Y946 HydrophobicContact CD1-CE2 4.49Å; Y946-F948 HydrophobicContact CG-CZ 4.32Å; Y946-E965 CarbonylContact O-C 3.57Å; Y946-E965 WeakPolarHBondContact O-CA 3.29Å; Y946-V966 PolarHBondContact N-O 3.35Å; Y946-V966 PolarHBondContact O-N 3Å
947	L	78.4	Confident	63.1	Low	12 Å²	12	37 Å²	37	6%	0.063	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	127.9	165.6	179.8	73.4	0	0	0	108.5	F593 R594 A596 Q963 E965	F593-L947 CarbonylContact C-O 3.48Å; F593-L947 WeakPolarHBondContact CA-O 3.45Å; R594-L947 HydrophobicContact CG-CB 4.35Å; R594-L947 PolarHBondContact N-O 3Å; R594-L947 VanDerWaalsContact NH2-CD2 3.26Å; R594-L947 PolarHBondContact O-N 3.2Å; A596-L947 HydrophobicContact CB-CB 4.45Å; L947-Q963 HydrophobicContact CD1-CB 4.37Å; L947-E965 HydrophobicContact CB-CG 4.37Å; L947-E965 HydrophobicContact CD1-CG 3.63Å
948	F	79.8	Confident	64.3	Low	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	143.5	173.5	-60.9	-88.8	0	0	0	109.8	I570 L572 L591 K592 F593 L646 Y946 Q963 L964 V966	I570-F948 HydrophobicContact CB-CZ 4.35Å; I570-F948 HydrophobicContact CD1-CE2 3.92Å; I570-F948 HydrophobicContact CD1-CZ 3.64Å; I570-F948 HydrophobicContact CG2-CE2 4.06Å; I570-F948 HydrophobicContact CG2-CZ 3.9Å; L572-F948 HydrophobicContact CD1-CB 4.48Å; L572-F948 HydrophobicContact CD1-CD1 3.55Å; L572-F948 HydrophobicContact CD1-CE1 3.97Å; L572-F948 HydrophobicContact CD1-CG 4.07Å; L572-F948 HydrophobicContact CD2-CB 4.37Å; L572-F948 HydrophobicContact CD2-CD1 4.1Å; L572-F948 HydrophobicContact CD2-CD2 4Å; L572-F948 HydrophobicContact CD2-CE1 4.44Å; L572-F948 HydrophobicContact CD2-CE2 4.34Å; L572-F948 HydrophobicContact CD2-CG 3.88Å; L572-F948 HydrophobicContact CG-CD1 4.36Å; L591-F948 HydrophobicContact CD1-CB 4.27Å; L591-F948 HydrophobicContact CD1-CD1 4.09Å; K592-F948 CarbonylContact O-C 3.05Å; K592-F948 WeakPolarHBondContact O-CA 3.37Å; F593-F948 HydrophobicContact CB-CD1 3.38Å; F593-F948 HydrophobicContact CB-CE1 3.55Å; F593-F948 HydrophobicContact CB-CG 4.17Å; F593-F948 HydrophobicContact CB-CZ 4.45Å; F593-F948 HydrophobicContact CD1-CD1 4.43Å; F593-F948 HydrophobicContact CD1-CE1 4.35Å; F593-F948 HydrophobicContact CD2-CE1 4.4Å; F593-F948 HydrophobicContact CG-CD1 4.09Å; F593-F948 AromaticContact CG-CE1 3.89Å; F593-F948 HydrophobicContact CG-CE1 3.89Å; L646-F948 HydrophobicContact CD2-CE1 4.21Å; L646-F948 HydrophobicContact CD2-CZ 4.26Å; Y946-F948 HydrophobicContact CG-CZ 4.32Å; F948-Q963 CarbonylContact O-C 3.59Å; F948-Q963 VanDerWaalsContact O-CA 3.32Å; F948-Q963 WeakPolarHBondContact O-CA 3.32Å; F948-L964 PolarHBondContact N-O 3.33Å; F948-L964 PolarHBondContact O-N 2.78Å; F948-V966 HydrophobicContact CD2-CB 4.39Å; F948-V966 HydrophobicContact CD2-CG2 3.93Å; F948-V966 HydrophobicContact CE2-CB 3.93Å; F948-V966 HydrophobicContact CE2-CG2 3.89Å
949	E	82.2	Confident	65.3	Low	32 Å²	32	37.8 Å²	37.8	15%	0.15	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	122	175.7	-26.6	-174.9	109.6	0	0	109	L591 K592 T961 A962 Q963	L591-E949 CarbonylContact C-O 3.58Å; L591-E949 VanDerWaalsContact CA-O 3.29Å; L591-E949 WeakPolarHBondContact CA-O 3.3Å; K592-E949 HydrophobicContact CB-CB 4.09Å; K592-E949 HydrophobicContact CB-CG 3.99Å; K592-E949 WeakPolarHBondContact CD-OE2 2.81Å; K592-E949 PolarHBondContact N-O 3.15Å; K592-E949 IonicContact NZ-OE2 3.27Å; K592-E949 PolarHBondContact O-N 2.04Å; E949-T961 HydrophobicContact CB-CG2 4.18Å; E949-A962 CarbonylContact C-O 3.44Å; E949-A962 VanDerWaalsContact CA-O 3.28Å; E949-A962 WeakPolarHBondContact CA-O 3.4Å; E949-Q963 HydrophobicContact CB-CG 4.19Å; E949-Q963 HydrophobicContact CG-CG 4.15Å; E949-Q963 PolarHBondContact OE1-NE2 3.3Å
950	V	82.3	Confident	66.4	Low	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	119.7	-179.3	-169.6	0	0	0	0	110.5	P557 L560 W574 Y589 K590 L591 T961 A962	P557-V950 WeakPolarHBondContact CD-O 3.23Å; P557-V950 HydrophobicContact CG-CB 4.33Å; P557-V950 HydrophobicContact CG-CG1 3.98Å; P557-V950 WeakPolarHBondContact CG-O 3.27Å; L560-V950 HydrophobicContact CD1-CB 4.43Å; L560-V950 HydrophobicContact CD1-CG2 3.69Å; L560-V950 HydrophobicContact CD2-CB 4.35Å; L560-V950 HydrophobicContact CD2-CG2 3.99Å; W574-V950 HydrophobicContact CD2-CG1 4Å; W574-V950 HydrophobicContact CD2-CG2 4.47Å; W574-V950 HydrophobicContact CE3-CG1 4.36Å; W574-V950 HydrophobicContact CE3-CG2 4.07Å; W574-V950 HydrophobicContact CG-CG1 4.4Å; W574-V950 HydrophobicContact CH2-CG1 4.39Å; W574-V950 HydrophobicContact CZ2-CG1 4.06Å; W574-V950 HydrophobicContact CZ3-CG2 4.1Å; Y589-V950 HydrophobicContact CD1-CG1 4.08Å; Y589-V950 HydrophobicContact CG-CG1 4.46Å; K590-V950 WeakPolarHBondContact O-CA 3.35Å; L591-V950 HydrophobicContact CD1-CG2 3.55Å; V950-T961 CarbonylContact O-C 2.65Å; V950-T961 WeakPolarHBondContact O-CA 3.45Å; V950-A962 PolarHBondContact N-O 3.18Å; V950-A962 PolarHBondContact O-N 3.31Å
951	A	79.5	Confident	67.4	Low	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	161.3	166.9	0	0	0	0	0	111	Y589 K590 V958 G959 L960 T961	Y589-A951 CarbonylContact C-O 3.4Å; Y589-A951 WeakPolarHBondContact CA-O 3.39Å; Y589-A951 WeakPolarHBondContact CB-O 3.36Å; K590-A951 PolarHBondContact N-O 2.79Å; K590-A951 PolarHBondContact O-N 3.4Å; A951-V958 HydrophobicContact CB-CG1 3.49Å; A951-V958 VanDerWaalsContact CB-CG1 3.49Å; A951-G959 WeakPolarHBondContact CB-O 3.32Å; A951-L960 WeakPolarHBondContact CA-O 3.5Å; A951-T961 HydrophobicContact CB-CG2 3.74Å
952	L	75	Confident	68.6	Low	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	157.5	163.6	-66.4	109.1	0	0	0	110.6	P554 T555 P557 P577 L586 G588 Y589 V958 G959	P554-L952 HydrophobicContact CB-CB 3.82Å; P554-L952 HydrophobicContact CB-CD1 4.29Å; P554-L952 HydrophobicContact CG-CB 4.17Å; T555-L952 WeakPolarHBondContact O-CD1 3.01Å; P557-L952 HydrophobicContact CB-CD1 4.32Å; P557-L952 HydrophobicContact CG-CD1 3.66Å; P557-L952 HydrophobicContact CG-CG 4.13Å; P577-L952 HydrophobicContact CG-CD1 3.6Å; L586-L952 HydrophobicContact CD1-CB 3.93Å; L586-L952 HydrophobicContact CD1-CD2 3.55Å; L586-L952 HydrophobicContact CD1-CG 4.32Å; L586-L952 HydrophobicContact CD2-CD2 3.98Å; L586-L952 HydrophobicContact CG-CD2 4.46Å; G588-L952 CarbonylContact O-C 3.56Å; Y589-L952 HydrophobicContact CD1-CB 4.47Å; Y589-L952 HydrophobicContact CD1-CD2 4.09Å; Y589-L952 HydrophobicContact CD1-CG 3.71Å; Y589-L952 HydrophobicContact CE1-CD1 4.33Å; Y589-L952 HydrophobicContact CE1-CD2 3.4Å; Y589-L952 HydrophobicContact CE1-CG 3.46Å; Y589-L952 VanDerWaalsContact CE1-CG 3.46Å; L952-V958 CarbonylContact O-C 3.54Å; L952-V958 WeakPolarHBondContact O-CA 3.35Å; L952-G959 PolarHBondContact O-N 2.81Å
953	M	65.1	Low	69.5	Low	47 Å²	47	38.9 Å²	38.9	23%	0.232	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	123.4	174.1	-168.3	170.1	77.3	0	0	109.5	L586 L587 G588 S957 V958	L586-M953 WeakPolarHBondContact CD1-O 3.37Å; L587-M953 WeakPolarHBondContact CA-O 3.23Å; L587-M953 HydrophobicContact CB-CE 3.99Å; L587-M953 HydrophobicContact CB-CG 4.49Å; L587-M953 WeakPolarHBondContact CB-O 3.42Å; L587-M953 HydrophobicContact CD1-CE 4.48Å; L587-M953 PolarHBondContact N-O 2.91Å; G588-M953 PolarHBondContact N-O 2.74Å; G588-M953 VanDerWaalsContact N-O 3.09Å; G588-M953 PolarHBondContact O-N 2.65Å; M953-S957 WeakPolarHBondContact CA-O 3.3Å; M953-V958 HydrophobicContact CB-CG2 4.45Å; M953-V958 HydrophobicContact CG-CG2 3.97Å; M953-V958 HydrophobicContact SD-CG2 4.12Å
954	N	60.3	Low	70.3	Confident	15 Å²	15	39.5 Å²	39.5	8%	0.08	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-173.7	169.9	78.6	5.1	0	0	0	109.9	G552 P554 S956 S957	G552-N954 PolarHBondContact O-ND2 2.83Å; P554-N954 HydrophobicContact CG-CB 4.02Å; N954-S956 PolarHBondContact O-N 3.26Å; N954-S956 PolarHBondContact OD1-N 3.4Å; N954-S957 VanDerWaalsContact CG-OG 3.27Å; N954-S957 PolarHBondContact N-O 3.19Å; N954-S957 PolarHBondContact ND2-OG 2.78Å; N954-S957 PolarHBondContact OD1-N 2.57Å; N954-S957 PolarHBondContact OD1-O 3.05Å; N954-S957 PolarHBondContact OD1-OG 2.88Å
955	T	55.9	Low	71.2	Confident	78 Å²	78	41.4 Å²	41.4	48%	0.479	23%	0.23	S	C	.	.	S	Bend	trans	-63.6	-6.5	-177.4	44.7	0	0	0	0	116	L587	L587-T955 HydrophobicContact CD1-CG2 4.22Å; L587-T955 HydrophobicContact CD2-CG2 4.01Å; L587-T955 HydrophobicContact CG-CG2 3.96Å
956	S	52.6	Low	71.3	Confident	50 Å²	50	40.2 Å²	40.2	35%	0.35	22%	0.223	S	C	.	.	S	Bend	trans	-151	8.1	179.9	-51.9	0	0	0	0	115.6	V548 T550 N954	V548-S956 WeakPolarHBondContact CB-OG 3.36Å; T550-S956 VanDerWaalsContact CG2-OG 3.26Å; T550-S956 WeakPolarHBondContact CG2-OG 3.04Å; N954-S956 PolarHBondContact O-N 3.26Å; N954-S956 PolarHBondContact OD1-N 3.4Å
957	S	47.8	Very low	71.5	Confident	25 Å²	25	43.1 Å²	43.1	18%	0.175	24%	0.243	C	C	.	.			trans	-157.4	153.6	-178.9	64.9	0	0	0	0	112.7	M953 N954	M953-S957 WeakPolarHBondContact CA-O 3.3Å; N954-S957 VanDerWaalsContact CG-OG 3.27Å; N954-S957 PolarHBondContact N-O 3.19Å; N954-S957 PolarHBondContact ND2-OG 2.78Å; N954-S957 PolarHBondContact OD1-N 2.57Å; N954-S957 PolarHBondContact OD1-O 3.05Å; N954-S957 PolarHBondContact OD1-OG 2.88Å
958	V	64.2	Low	70.9	Confident	65 Å²	65	42.8 Å²	42.8	39%	0.394	24%	0.241	S	C	.	.	B	Isolated β-bridge	trans	-100.8	126.4	162.1	179	0	0	0	0	106.7	K590 A951 L952 M953	K590-V958 HydrophobicContact CB-CG1 3.98Å; K590-V958 HydrophobicContact CD-CG1 3.98Å; K590-V958 HydrophobicContact CD-CG2 3.87Å; A951-V958 HydrophobicContact CB-CG1 3.49Å; A951-V958 VanDerWaalsContact CB-CG1 3.49Å; L952-V958 CarbonylContact O-C 3.54Å; L952-V958 WeakPolarHBondContact O-CA 3.35Å; M953-V958 HydrophobicContact CB-CG2 4.45Å; M953-V958 HydrophobicContact CG-CG2 3.97Å; M953-V958 HydrophobicContact SD-CG2 4.12Å
959	G	64.3	Low	70.4	Confident	13 Å²	13	45.3 Å²	45.3	13%	0.134	26%	0.257	C	S	.	.			trans	-81.4	-163.8	-175.4	0	0	0	0	0	114.7	A951 L952	A951-G959 WeakPolarHBondContact CB-O 3.32Å; L952-G959 PolarHBondContact O-N 2.81Å
960	L	68	Low	69.8	Low	116 Å²	116	44.4 Å²	44.4	61%	0.607	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-66.5	136.1	-178.6	-70	168.2	0	0	0	111.3	P554 A556 A951	P554-L960 PolarHBondContact O-N 2.94Å; A556-L960 WeakPolarHBondContact CA-O 3.48Å; A556-L960 HydrophobicContact CB-CB 3.82Å; A556-L960 WeakPolarHBondContact CB-O 2.97Å; A951-L960 WeakPolarHBondContact CA-O 3.5Å
961	T	75	Confident	69.1	Low	68 Å²	68	45 Å²	45	42%	0.417	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-85.4	121.8	177.1	46.2	0	0	0	0	112	E949 V950 A951	E949-T961 HydrophobicContact CB-CG2 4.18Å; V950-T961 CarbonylContact O-C 2.65Å; V950-T961 WeakPolarHBondContact O-CA 3.45Å; A951-T961 HydrophobicContact CB-CG2 3.74Å
962	A	77.5	Confident	69.1	Low	18 Å²	18	47.6 Å²	47.6	15%	0.149	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	140.4	157.1	0	0	0	0	0	109.5	P557 L560 E949 V950	P557-A962 WeakPolarHBondContact O-CB 3.35Å; L560-A962 HydrophobicContact CB-CB 4.05Å; L560-A962 HydrophobicContact CD2-CB 3.83Å; L560-A962 WeakPolarHBondContact CD2-O 2.99Å; E949-A962 CarbonylContact C-O 3.44Å; E949-A962 VanDerWaalsContact CA-O 3.28Å; E949-A962 WeakPolarHBondContact CA-O 3.4Å; V950-A962 PolarHBondContact N-O 3.18Å; V950-A962 PolarHBondContact O-N 3.31Å
963	Q	83.1	Confident	69.4	Low	120 Å²	120	47.7 Å²	47.7	56%	0.561	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.8	150.8	179.3	-79.5	-179.5	-21.2	0	0	111.8	L947 F948 E949	L947-Q963 HydrophobicContact CD1-CB 4.37Å; F948-Q963 CarbonylContact O-C 3.59Å; F948-Q963 VanDerWaalsContact O-CA 3.32Å; F948-Q963 WeakPolarHBondContact O-CA 3.32Å; E949-Q963 HydrophobicContact CB-CG 4.19Å; E949-Q963 HydrophobicContact CG-CG 4.15Å; E949-Q963 PolarHBondContact OE1-NE2 3.3Å
964	L	81.9	Confident	69.9	Low	39 Å²	39	48.9 Å²	48.9	20%	0.204	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	135.8	177.5	176.9	73.4	0	0	0	111.4	L560 L572 F948 V966	L560-L964 HydrophobicContact CD2-CB 3.76Å; L560-L964 HydrophobicContact CG-CB 3.86Å; L560-L964 HydrophobicContact CG-CD2 4.22Å; L572-L964 HydrophobicContact CD2-CD2 4.13Å; F948-L964 PolarHBondContact N-O 3.33Å; F948-L964 PolarHBondContact O-N 2.78Å; L964-V966 HydrophobicContact CD2-CG2 3.61Å; L964-V966 HydrophobicContact CG-CG2 3.93Å
965	E	82.1	Confident	70.9	Confident	120 Å²	120	49.6 Å²	49.6	56%	0.561	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	135.8	166	-65.5	-167.8	156.7	0	0	111.2	T945 Y946 L947	T945-E965 HydrophobicContact CG2-CB 3.95Å; T945-E965 HydrophobicContact CG2-CG 4.48Å; Y946-E965 CarbonylContact O-C 3.57Å; Y946-E965 WeakPolarHBondContact O-CA 3.29Å; L947-E965 HydrophobicContact CB-CG 4.37Å; L947-E965 HydrophobicContact CD1-CG 3.63Å
966	V	73.2	Confident	72.2	Confident	9 Å²	9	47.1 Å²	47.1	6%	0.055	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	128.1	173.2	-166.9	0	0	0	0	109.6	I570 L572 T945 Y946 F948 L964	I570-V966 HydrophobicContact CD1-CB 4.37Å; I570-V966 HydrophobicContact CD1-CG1 4.41Å; I570-V966 HydrophobicContact CG1-CG1 4.34Å; I570-V966 HydrophobicContact CG2-CB 4.2Å; I570-V966 HydrophobicContact CG2-CG1 4.04Å; I570-V966 HydrophobicContact CG2-CG2 4.19Å; L572-V966 HydrophobicContact CD2-CG2 4.38Å; T945-V966 WeakPolarHBondContact CA-O 3.23Å; Y946-V966 PolarHBondContact N-O 3.35Å; Y946-V966 PolarHBondContact O-N 3Å; F948-V966 HydrophobicContact CD2-CB 4.39Å; F948-V966 HydrophobicContact CD2-CG2 3.93Å; F948-V966 HydrophobicContact CE2-CB 3.93Å; F948-V966 HydrophobicContact CE2-CG2 3.89Å; L964-V966 HydrophobicContact CD2-CG2 3.61Å; L964-V966 HydrophobicContact CG-CG2 3.93Å
967	T	73.2	Confident	73.8	Confident	79 Å²	79	44.8 Å²	44.8	49%	0.485	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	131.1	172.5	-46.8	0	0	0	0	110.1	L944 T945	L944-T967 WeakPolarHBondContact O-CA 3.31Å; T945-T967 PolarHBondContact OG1-OG1 2.72Å
968	T	66.7	Low	75.3	Confident	5 Å²	5	46.8 Å²	46.8	3%	0.031	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-70.9	146	166.7	46.5	0	0	0	0	110.8	I570 I940 G941 G943 L944	I570-T968 HydrophobicContact CD1-CG2 3.87Å; I570-T968 HydrophobicContact CG1-CG2 4Å; I940-T968 HydrophobicContact CG2-CG2 3.46Å; I940-T968 VanDerWaalsContact CG2-CG2 3.46Å; G941-T968 PolarHBondContact O-OG1 3.05Å; G943-T968 WeakPolarHBondContact CA-O 3.42Å; G943-T968 PolarHBondContact N-OG1 3.34Å; L944-T968 PolarHBondContact N-OG1 3.43Å; L944-T968 VanDerWaalsContact N-OG1 3.07Å; L944-T968 PolarHBondContact O-N 3.28Å; L944-T968 PolarHBondContact O-OG1 3.06Å
969	P	67.8	Low	76.1	Confident	52 Å²	52	48 Å²	48	34%	0.338	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-54.1	153	160.6	-23.7	32.5	0	0	0	111	S564 P567 G943	S564-P969 WeakPolarHBondContact OG-CD 3.3Å; P567-P969 HydrophobicContact CB-CB 4.35Å; P567-P969 HydrophobicContact CG-CB 4.1Å; G943-P969 PolarHBondContact N-O 3.47Å
970	D	70.7	Confident	76.8	Confident	14 Å²	14	48.3 Å²	48.3	8%	0.075	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-61.1	159.4	158.7	-58	-39.1	0	0	0	109.4	P567 N1003 G1004 K1005 T1055 S1056 A1057	P567-D970 WeakPolarHBondContact CG-O 3.17Å; D970-N1003 CarbonylContact C-O 3.52Å; D970-N1003 WeakPolarHBondContact CA-O 3.01Å; D970-G1004 WeakPolarHBondContact OD1-CA 3.27Å; D970-K1005 PolarHBondContact OD1-N 2.96Å; D970-T1055 HydrophobicContact CB-CG2 4.15Å; D970-S1056 VanDerWaalsContact CG-OG 3.3Å; D970-S1056 VanDerWaalsContact OD2-CB 3.25Å; D970-S1056 WeakPolarHBondContact OD2-CB 2.78Å; D970-S1056 PolarHBondContact OD2-N 3.5Å; D970-S1056 PolarHBondContact OD2-OG 3.5Å; D970-A1057 HydrophobicContact CB-CB 4.31Å; D970-A1057 WeakPolarHBondContact O-CB 3.4Å
971	A	66.6	Low	77.2	Confident	12 Å²	12	47.4 Å²	47.4	10%	0.099	26%	0.262	C	S	.	.			trans	-113.4	164.7	157.3	0	0	0	0	0	109.4	P567 Y942 N1003 T1055	P567-A971 HydrophobicContact CB-CB 3.68Å; P567-A971 HydrophobicContact CG-CB 3.87Å; Y942-A971 HydrophobicContact CD1-CB 3.68Å; Y942-A971 HydrophobicContact CE1-CB 3.92Å; Y942-A971 HydrophobicContact CG-CB 4.2Å; A971-N1003 HydrophobicContact CB-CB 3.96Å; A971-N1003 PolarHBondContact N-O 2.89Å; A971-T1055 WeakPolarHBondContact O-CG2 3.43Å; A971-T1055 PolarHBondContact O-OG1 2.82Å
972	P	79.2	Confident	77.6	Confident	54 Å²	54	46.1 Å²	46.1	35%	0.351	25%	0.252	S	S	.	.			trans	-59	142.2	172.3	-21.5	33	0	0	0	111.2	S974 N1003 P1059	P972-S974 PolarHBondContact O-N 2.84Å; P972-N1003 PolarHBondContact O-ND2 3.24Å; P972-P1059 WeakPolarHBondContact CB-O 3.34Å
973	P	82.1	Confident	77.1	Confident	3 Å²	3	47 Å²	47	2%	0.019	26%	0.257	C	S	.	.			trans	-55.1	130.3	177.2	-26.5	33.3	0	0	0	112.1	S975 P997 Y1001 R1002 L1006 A1053 T1055 G1060 P1061	P973-S975 VanDerWaalsContact C-N 3.31Å; P973-P997 HydrophobicContact CB-CG 4.38Å; P973-Y1001 CarbonylContact C-O 3.56Å; P973-Y1001 VanDerWaalsContact CA-O 3.3Å; P973-Y1001 WeakPolarHBondContact CA-O 3.16Å; P973-R1002 WeakPolarHBondContact CG-O 3.42Å; P973-L1006 HydrophobicContact CG-CD2 3.76Å; P973-A1053 HydrophobicContact CB-CB 4.44Å; P973-A1053 HydrophobicContact CG-CB 4Å; P973-T1055 HydrophobicContact CG-CG2 4Å; P973-G1060 WeakPolarHBondContact O-CA 2.91Å; P973-P1061 WeakPolarHBondContact O-CD 3.3Å
974	S	76.5	Confident	76.3	Confident	71 Å²	71	42.3 Å²	42.3	50%	0.497	24%	0.241	S	C	.	.	S	Bend	trans	-85.8	-2.2	-178.7	46.8	0	0	0	0	113.6	P972 Y1001 N1003	P972-S974 PolarHBondContact O-N 2.84Å; S974-Y1001 PolarHBondContact N-O 2.77Å; S974-N1003 VanDerWaalsContact CB-ND2 3.31Å; S974-N1003 WeakPolarHBondContact CB-ND2 3.26Å; S974-N1003 PolarHBondContact N-ND2 2.94Å; S974-N1003 PolarHBondContact OG-ND2 3.39Å; S974-N1003 PolarHBondContact OG-OD1 2.8Å
975	S	79.6	Confident	75	Confident	30 Å²	30	42.3 Å²	42.3	21%	0.21	24%	0.241	C	C	.	.	S	Bend	trans	-134.6	150.4	173.8	-168.1	0	0	0	0	110.6	P973 P997 Y1001	P973-S975 VanDerWaalsContact C-N 3.31Å; S975-P997 WeakPolarHBondContact O-CG 3.12Å; S975-Y1001 VanDerWaalsContact CB-CB 3.42Å
976	S	84.5	Confident	73.9	Confident	26 Å²	26	37.5 Å²	37.5	18%	0.182	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-72.9	160.2	178.2	62.5	0	0	0	0	111.3	L978 P1061	S976-L978 PolarHBondContact O-N 3.06Å; S976-P1061 WeakPolarHBondContact CB-O 3.08Å
977	P	85	Confident	73.6	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.013	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-47.3	135.7	160.6	-27	35.9	0	0	0	111.3	W994 A995 Y1009 V1051 A1053	P977-W994 HydrophobicContact CB-CB 4.02Å; P977-W994 HydrophobicContact CB-CG 4.08Å; P977-A995 CarbonylContact C-O 3.41Å; P977-A995 WeakPolarHBondContact CA-O 3.4Å; P977-A995 WeakPolarHBondContact CB-O 3.44Å; P977-Y1009 HydrophobicContact CG-CD1 4.07Å; P977-Y1009 HydrophobicContact CG-CE1 4.4Å; P977-V1051 HydrophobicContact CB-CB 4.4Å; P977-V1051 HydrophobicContact CB-CG1 4.4Å; P977-V1051 WeakPolarHBondContact CD-O 3.4Å; P977-V1051 HydrophobicContact CG-CB 4.2Å; P977-V1051 HydrophobicContact CG-CG1 3.97Å; P977-A1053 HydrophobicContact CG-CB 4.2Å
978	L	80.6	Confident	73.8	Confident	67 Å²	67	36.1 Å²	36.1	35%	0.351	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	165.5	178.6	-67.8	-178.3	0	0	0	110.6	S976 V980 A995 P998	S976-L978 PolarHBondContact O-N 3.06Å; L978-V980 VanDerWaalsContact C-N 3.26Å; L978-V980 PolarHBondContact O-N 3.02Å; L978-V980 VanDerWaalsContact O-N 3.14Å; L978-A995 HydrophobicContact CB-CB 4.09Å; L978-A995 PolarHBondContact N-O 3.42Å; L978-A995 PolarHBondContact O-N 3.27Å; L978-P998 HydrophobicContact CD1-CG 3.63Å; L978-P998 HydrophobicContact CG-CG 4.44Å
979	H	79.8	Confident	74.2	Confident	89 Å²	89	36.6 Å²	36.6	41%	0.412	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	53.3	38.7	169.2	-50.5	165.8	0	0	0	114	I29 R981 A995	I29-H979 HydrophobicContact CD1-CB 4.06Å; I29-H979 WeakPolarHBondContact CD1-CD2 3.42Å; I29-H979 HydrophobicContact CG1-CB 4.06Å; H979-R981 WeakPolarHBondContact O-CG 3.36Å; H979-R981 PolarHBondContact O-N 3.49Å; H979-R981 VanDerWaalsContact O-N 3.1Å; H979-A995 HydrophobicContact CB-CB 4.23Å
980	V	80.4	Confident	74.8	Confident	21 Å²	21	34.1 Å²	34.1	13%	0.127	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	114.9	175.9	-177.1	0	0	0	0	109	L978 V992 S993 W994 V1051	L978-V980 VanDerWaalsContact C-N 3.26Å; L978-V980 PolarHBondContact O-N 3.02Å; L978-V980 VanDerWaalsContact O-N 3.14Å; V980-V992 HydrophobicContact CG1-CG2 3.87Å; V980-S993 CarbonylContact C-O 3.53Å; V980-S993 VanDerWaalsContact CA-O 3.3Å; V980-S993 WeakPolarHBondContact CA-O 3.23Å; V980-W994 HydrophobicContact CG2-CB 4.07Å; V980-V1051 HydrophobicContact CG1-CG2 3.92Å; V980-V1051 HydrophobicContact CG2-CB 4.34Å; V980-V1051 HydrophobicContact CG2-CG2 4.16Å
981	R	76.4	Confident	75.5	Confident	97 Å²	97	35.3 Å²	35.3	37%	0.366	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	136.6	-174.2	-79.5	172.1	167.9	-176.3	-2.7	109.7	I27 G28 H979 V992 S993	I27-R981 PolarHBondContact O-NH2 2.69Å; G28-R981 PolarHBondContact O-NE 2.86Å; G28-R981 PolarHBondContact O-NH2 2.78Å; H979-R981 WeakPolarHBondContact O-CG 3.36Å; H979-R981 PolarHBondContact O-N 3.49Å; H979-R981 VanDerWaalsContact O-N 3.1Å; R981-V992 WeakPolarHBondContact O-CA 3.18Å; R981-S993 PolarHBondContact N-O 3.19Å; R981-S993 PolarHBondContact O-N 2.84Å; R981-S993 PolarHBondContact O-OG 3.09Å
982	L	82.6	Confident	76.5	Confident	40 Å²	40	34.7 Å²	34.7	21%	0.209	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	122.8	-177.9	-54.8	-178.1	0	0	0	111	V990 E991 V992 F1049 S1066 I1068	L982-V990 HydrophobicContact CB-CG1 4.3Å; L982-V990 HydrophobicContact CD2-CG1 4.33Å; L982-E991 CarbonylContact C-O 3.49Å; L982-E991 WeakPolarHBondContact CA-O 3.37Å; L982-V992 HydrophobicContact CD2-CB 3.48Å; L982-V992 VanDerWaalsContact CD2-CB 3.48Å; L982-V992 HydrophobicContact CD2-CG2 3.55Å; L982-F1049 HydrophobicContact CD1-CB 4.08Å; L982-F1049 HydrophobicContact CD1-CD2 3.78Å; L982-F1049 HydrophobicContact CD1-CG 4.15Å; L982-F1049 HydrophobicContact CD2-CB 3.73Å; L982-F1049 HydrophobicContact CD2-CD1 4.22Å; L982-F1049 HydrophobicContact CD2-CD2 4.1Å; L982-F1049 HydrophobicContact CD2-CG 3.76Å; L982-S1066 WeakPolarHBondContact CD1-O 3.16Å; L982-I1068 HydrophobicContact CB-CB 4.07Å; L982-I1068 HydrophobicContact CB-CD1 3.78Å; L982-I1068 HydrophobicContact CB-CG1 4.49Å; L982-I1068 HydrophobicContact CB-CG2 4.22Å; L982-I1068 HydrophobicContact CD1-CB 3.71Å; L982-I1068 HydrophobicContact CD1-CG2 3.68Å
983	S	67.7	Low	76.9	Confident	37 Å²	37	33.8 Å²	33.8	26%	0.259	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	116.6	172.5	28.4	0	0	0	0	109	L985 V990 E991	S983-L985 PolarHBondContact O-N 2.8Å; S983-V990 CarbonylContact O-C 3.24Å; S983-V990 WeakPolarHBondContact O-CA 3.34Å; S983-E991 PolarHBondContact N-O 3.26Å; S983-E991 PolarHBondContact O-N 3.47Å; S983-E991 VanDerWaalsContact OG-CB 3.31Å; S983-E991 WeakPolarHBondContact OG-CB 3.07Å; S983-E991 WeakPolarHBondContact OG-CG 3.14Å; S983-E991 PolarHBondContact OG-O 2.68Å; S983-E991 PolarHBondContact OG-OE2 3.36Å
984	G	64.9	Low	77.3	Confident	22 Å²	22	34.1 Å²	34.1	23%	0.227	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	111.8	173.2	0	0	0	0	0	110.3
985	L	56.3	Low	77.7	Confident	39 Å²	39	32 Å²	32	20%	0.204	19%	0.185	C	C	.	.			trans	-99.6	-19.3	-175.9	-69.9	-175.4	0	0	0	113.6	S983 S989 E991 T1037 L1074	S983-L985 PolarHBondContact O-N 2.8Å; L985-S989 WeakPolarHBondContact CB-OG 3.38Å; L985-S989 PolarHBondContact N-O 3.23Å; L985-E991 HydrophobicContact CD1-CB 3.5Å; L985-E991 HydrophobicContact CG-CB 3.96Å; L985-T1037 HydrophobicContact CD1-CG2 3.81Å; L985-L1074 WeakPolarHBondContact O-CD1 3.41Å; L985-L1074 WeakPolarHBondContact O-CG 3.47Å
986	S	58	Low	77.9	Confident	18 Å²	18	31.3 Å²	31.3	13%	0.126	18%	0.179	C	C	.	.	S	Bend	trans	-165.8	-172.5	166.8	72.8	0	0	0	0	111.6	S988 S989 S1071	S986-S988 PolarHBondContact O-N 2.89Å; S986-S988 PolarHBondContact OG-N 3.38Å; S986-S988 PolarHBondContact OG-OG 2.99Å; S986-S989 WeakPolarHBondContact CB-OG 3.34Å; S986-S989 PolarHBondContact N-O 2.77Å; S986-S989 PolarHBondContact N-OG 2.7Å; S986-S989 PolarHBondContact OG-N 2.73Å; S986-S989 PolarHBondContact OG-OG 2.81Å; S986-S1071 PolarHBondContact O-N 3.45Å; S986-S1071 PolarHBondContact O-OG 2.59Å; S986-S1071 VanDerWaalsContact O-OG 3.12Å
987	S	67.1	Low	77.8	Confident	12 Å²	12	30 Å²	30	8%	0.084	17%	0.171	C	C	.	.	S	Bend	trans	-59	-25.6	165.4	47.2	0	0	0	0	113.4	K1042 E1043 T1070 S1071 E1073	S987-K1042 CarbonylContact O-C 3.43Å; S987-E1043 VanDerWaalsContact O-CA 3.31Å; S987-E1043 WeakPolarHBondContact O-CA 3.47Å; S987-T1070 WeakPolarHBondContact O-CB 3.3Å; S987-S1071 WeakPolarHBondContact CA-O 3.38Å; S987-E1073 WeakPolarHBondContact OG-CA 3.26Å; S987-E1073 WeakPolarHBondContact OG-CB 3.28Å; S987-E1073 WeakPolarHBondContact OG-CG 3.38Å
988	S	76.8	Confident	77.1	Confident	48 Å²	48	31.3 Å²	31.3	34%	0.336	18%	0.179	S	C	.	.	S	Bend	trans	-121.7	5.6	-177.5	69.5	0	0	0	0	114.2	S986 R1039 G1040 L1041	S986-S988 PolarHBondContact O-N 2.89Å; S986-S988 PolarHBondContact OG-N 3.38Å; S986-S988 PolarHBondContact OG-OG 2.99Å; S988-R1039 CarbonylContact O-C 3.56Å; S988-R1039 VanDerWaalsContact O-C 3.28Å; S988-R1039 VanDerWaalsContact O-CA 3.27Å; S988-R1039 WeakPolarHBondContact O-CA 3.28Å; S988-G1040 PolarHBondContact O-N 2.93Å; S988-L1041 VanDerWaalsContact CA-O 3.23Å; S988-L1041 WeakPolarHBondContact CA-O 3.31Å; S988-L1041 VanDerWaalsContact CB-O 3.25Å; S988-L1041 WeakPolarHBondContact CB-O 3.43Å; S988-L1041 WeakPolarHBondContact O-CB 3.31Å; S988-L1041 PolarHBondContact O-N 2.81Å
989	S	76	Confident	76.5	Confident	14 Å²	14	31 Å²	31	10%	0.098	18%	0.179	C	C	.	.			trans	-138.9	142.7	-178.4	60.4	0	0	0	0	114.6	L985 S986 A1038	L985-S989 WeakPolarHBondContact CB-OG 3.38Å; L985-S989 PolarHBondContact N-O 3.23Å; S986-S989 WeakPolarHBondContact CB-OG 3.34Å; S986-S989 PolarHBondContact N-O 2.77Å; S986-S989 PolarHBondContact N-OG 2.7Å; S986-S989 PolarHBondContact OG-N 2.73Å; S986-S989 PolarHBondContact OG-OG 2.81Å; S989-A1038 WeakPolarHBondContact CA-O 3.47Å; S989-A1038 WeakPolarHBondContact CB-O 3.05Å
990	V	80.2	Confident	75.3	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	128.2	175	168.6	0	0	0	0	106.2	L982 S983 T1037 A1038 L1041 F1049 I1068 T1070	L982-V990 HydrophobicContact CB-CG1 4.3Å; L982-V990 HydrophobicContact CD2-CG1 4.33Å; S983-V990 CarbonylContact O-C 3.24Å; S983-V990 WeakPolarHBondContact O-CA 3.34Å; V990-T1037 CarbonylContact O-C 3.48Å; V990-A1038 PolarHBondContact N-O 3.27Å; V990-A1038 VanDerWaalsContact N-O 3.12Å; V990-A1038 PolarHBondContact O-N 3.17Å; V990-L1041 HydrophobicContact CB-CD1 4Å; V990-L1041 HydrophobicContact CG2-CD1 3.79Å; V990-F1049 HydrophobicContact CB-CE1 4.3Å; V990-F1049 HydrophobicContact CB-CE2 4.08Å; V990-F1049 HydrophobicContact CB-CZ 3.6Å; V990-F1049 HydrophobicContact CG1-CD2 4.43Å; V990-F1049 HydrophobicContact CG1-CE1 4.02Å; V990-F1049 HydrophobicContact CG1-CE2 3.77Å; V990-F1049 HydrophobicContact CG1-CZ 3.56Å; V990-F1049 HydrophobicContact CG2-CE2 4.24Å; V990-F1049 HydrophobicContact CG2-CZ 4.14Å; V990-I1068 HydrophobicContact CB-CG2 4.4Å; V990-I1068 HydrophobicContact CG1-CG2 3.82Å; V990-I1068 HydrophobicContact CG2-CG2 3.68Å; V990-T1070 HydrophobicContact CG2-CG2 4.33Å
991	E	84.7	Confident	75	Confident	39 Å²	39	36.7 Å²	36.7	18%	0.182	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	132.4	161.9	165.8	-179.1	-105.5	0	0	109.6	L982 S983 L985 Q1035 Y1036	L982-E991 CarbonylContact C-O 3.49Å; L982-E991 WeakPolarHBondContact CA-O 3.37Å; S983-E991 PolarHBondContact N-O 3.26Å; S983-E991 PolarHBondContact O-N 3.47Å; S983-E991 VanDerWaalsContact OG-CB 3.31Å; S983-E991 WeakPolarHBondContact OG-CB 3.07Å; S983-E991 WeakPolarHBondContact OG-CG 3.14Å; S983-E991 PolarHBondContact OG-O 2.68Å; S983-E991 PolarHBondContact OG-OE2 3.36Å; L985-E991 HydrophobicContact CD1-CB 3.5Å; L985-E991 HydrophobicContact CG-CB 3.96Å; E991-Q1035 HydrophobicContact CG-CB 4.47Å; E991-Q1035 PolarHBondContact OE1-NE2 2.9Å; E991-Y1036 WeakPolarHBondContact CA-O 3.38Å
992	V	88.6	Confident	75	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	131.1	170.8	47	0	0	0	0	107.4	V980 R981 L982 W994 V1011 Q1035 Y1036 F1049 V1051	V980-V992 HydrophobicContact CG1-CG2 3.87Å; R981-V992 WeakPolarHBondContact O-CA 3.18Å; L982-V992 HydrophobicContact CD2-CB 3.48Å; L982-V992 VanDerWaalsContact CD2-CB 3.48Å; L982-V992 HydrophobicContact CD2-CG2 3.55Å; V992-W994 HydrophobicContact CB-CZ3 4.43Å; V992-W994 HydrophobicContact CG1-CZ3 4.05Å; V992-W994 HydrophobicContact CG2-CE3 3.95Å; V992-W994 HydrophobicContact CG2-CZ3 4.02Å; V992-W994 VanDerWaalsContact O-CZ3 3.22Å; V992-W994 WeakPolarHBondContact O-CZ3 3.37Å; V992-V1011 HydrophobicContact CG1-CG1 3.88Å; V992-V1011 HydrophobicContact CG1-CG2 4.21Å; V992-Q1035 CarbonylContact O-C 3.58Å; V992-Q1035 VanDerWaalsContact O-CA 3.22Å; V992-Q1035 WeakPolarHBondContact O-CA 3.32Å; V992-Y1036 HydrophobicContact CG1-CD1 4.33Å; V992-Y1036 VanDerWaalsContact CG1-O 3.26Å; V992-Y1036 WeakPolarHBondContact CG1-O 3.05Å; V992-Y1036 PolarHBondContact N-O 3.16Å; V992-Y1036 PolarHBondContact O-N 2.67Å; V992-F1049 HydrophobicContact CB-CD1 3.95Å; V992-F1049 HydrophobicContact CB-CE1 4.48Å; V992-F1049 HydrophobicContact CG1-CD1 3.83Å; V992-F1049 HydrophobicContact CG1-CE1 4.16Å; V992-F1049 HydrophobicContact CG2-CD1 4.43Å; V992-V1051 HydrophobicContact CG2-CG2 3.76Å
993	S	88	Confident	74.4	Confident	34 Å²	34	32.9 Å²	32.9	24%	0.238	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	150.7	-178.6	57.7	0	0	0	0	110.6	V980 R981 R1034	V980-S993 CarbonylContact C-O 3.53Å; V980-S993 VanDerWaalsContact CA-O 3.3Å; V980-S993 WeakPolarHBondContact CA-O 3.23Å; R981-S993 PolarHBondContact N-O 3.19Å; R981-S993 PolarHBondContact O-N 2.84Å; R981-S993 PolarHBondContact O-OG 3.09Å; S993-R1034 CarbonylContact C-O 3.36Å; S993-R1034 VanDerWaalsContact CA-O 3.31Å; S993-R1034 WeakPolarHBondContact CA-O 3.38Å
994	W	90.3	Very high	74.6	Confident	11 Å²	11	32.1 Å²	32.1	4%	0.042	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	152.2	-173.2	55.9	91.4	0	0	0	113.1	P977 V980 V992 Y1009 V1011 V1028 R1034 V1051	P977-W994 HydrophobicContact CB-CB 4.02Å; P977-W994 HydrophobicContact CB-CG 4.08Å; V980-W994 HydrophobicContact CG2-CB 4.07Å; V992-W994 HydrophobicContact CB-CZ3 4.43Å; V992-W994 HydrophobicContact CG1-CZ3 4.05Å; V992-W994 HydrophobicContact CG2-CE3 3.95Å; V992-W994 HydrophobicContact CG2-CZ3 4.02Å; V992-W994 VanDerWaalsContact O-CZ3 3.22Å; V992-W994 WeakPolarHBondContact O-CZ3 3.37Å; W994-Y1009 AromaticContact CD1-CD1 3.9Å; W994-Y1009 AromaticContact CD1-CE1 3.78Å; W994-Y1009 AromaticContact CE2-CD2 3.98Å; W994-Y1009 AromaticContact CE2-CG 3.79Å; W994-Y1009 HydrophobicContact CZ2-CD1 4.49Å; W994-Y1009 AromaticContact CZ2-CD2 3.83Å; W994-Y1009 HydrophobicContact CZ2-CD2 3.83Å; W994-Y1009 AromaticContact CZ2-CG 3.8Å; W994-Y1009 HydrophobicContact CZ2-CG 3.8Å; W994-Y1009 AromaticContact NE1-CD1 3.2Å; W994-Y1009 AromaticContact NE1-CD2 3.51Å; W994-Y1009 AromaticContact NE1-CE1 3.32Å; W994-Y1009 VanDerWaalsContact NE1-CE1 3.32Å; W994-Y1009 AromaticContact NE1-CE2 3.63Å; W994-Y1009 AromaticContact NE1-CG 3.32Å; W994-Y1009 VanDerWaalsContact NE1-CG 3.32Å; W994-Y1009 AromaticContact NE1-CZ 3.55Å; W994-V1011 HydrophobicContact CH2-CG2 3.84Å; W994-V1011 HydrophobicContact CZ3-CG2 3.94Å; W994-V1028 HydrophobicContact CH2-CG2 4.13Å; W994-V1028 HydrophobicContact CZ2-CG1 4.42Å; W994-V1028 HydrophobicContact CZ2-CG2 4.47Å; W994-R1034 PolarHBondContact N-O 3.01Å; W994-R1034 WeakPolarHBondContact O-CB 3.39Å; W994-V1051 HydrophobicContact CD2-CB 4.49Å; W994-V1051 HydrophobicContact CD2-CG1 3.76Å; W994-V1051 HydrophobicContact CD2-CG2 4.29Å; W994-V1051 HydrophobicContact CE3-CB 4.5Å; W994-V1051 HydrophobicContact CE3-CG1 3.99Å; W994-V1051 HydrophobicContact CE3-CG2 3.83Å; W994-V1051 HydrophobicContact CG-CG1 4.19Å; W994-V1051 HydrophobicContact CH2-CG1 4.37Å; W994-V1051 HydrophobicContact CZ2-CG1 4.16Å; W994-V1051 HydrophobicContact CZ3-CG1 4.28Å; W994-V1051 HydrophobicContact CZ3-CG2 4.23Å
995	A	83.5	Confident	74.9	Confident	26 Å²	26	38.8 Å²	38.8	22%	0.215	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	147.2	161	0	0	0	0	0	110	P977 L978 H979	P977-A995 CarbonylContact C-O 3.41Å; P977-A995 WeakPolarHBondContact CA-O 3.4Å; P977-A995 WeakPolarHBondContact CB-O 3.44Å; L978-A995 HydrophobicContact CB-CB 4.09Å; L978-A995 PolarHBondContact N-O 3.42Å; L978-A995 PolarHBondContact O-N 3.27Å; H979-A995 HydrophobicContact CB-CB 4.23Å
996	P	83.9	Confident	76.1	Confident	15 Å²	15	37.8 Å²	37.8	10%	0.097	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-62.5	159.9	171.7	29.9	-36.4	0	0	0	110.5	L1006	P996-L1006 HydrophobicContact CB-CD1 4.04Å
997	P	83.1	Confident	77.2	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-51.5	146	165.4	-22.8	31.4	0	0	0	111.3	P973 S975 R1002 A1053	P973-P997 HydrophobicContact CB-CG 4.38Å; S975-P997 WeakPolarHBondContact O-CG 3.12Å; P997-R1002 HydrophobicContact CB-CG 4.17Å; P997-R1002 WeakPolarHBondContact O-CG 3.36Å; P997-R1002 PolarHBondContact O-NE 2.84Å; P997-A1053 HydrophobicContact CG-CB 3.72Å
998	P	70.9	Confident	78.1	Confident	28 Å²	28	39.5 Å²	39.5	18%	0.182	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-52.6	145	171.5	-26.2	35	0	0	0	111.3	L978 Q1000 Y1001 R1002	L978-P998 HydrophobicContact CD1-CG 3.63Å; L978-P998 HydrophobicContact CG-CG 4.44Å; P998-Q1000 VanDerWaalsContact CB-OE1 3.26Å; P998-Q1000 PolarHBondContact O-N 2.8Å; P998-Q1000 VanDerWaalsContact O-N 3.14Å; P998-Y1001 HydrophobicContact CB-CD2 3.84Å; P998-Y1001 HydrophobicContact CB-CE2 4.33Å; P998-Y1001 HydrophobicContact CG-CD2 3.89Å; P998-Y1001 HydrophobicContact CG-CE2 4.34Å; P998-Y1001 CarbonylContact O-C 3.54Å; P998-Y1001 WeakPolarHBondContact O-CA 3.41Å; P998-Y1001 PolarHBondContact O-N 3.04Å; P998-R1002 PolarHBondContact O-N 2.69Å
999	V	67.8	Low	78.8	Confident	60 Å²	60	37.5 Å²	37.5	36%	0.364	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-53.3	-42.2	-170.7	-179.3	0	0	0	0	111.7	Y1001 R1002	V999-Y1001 PolarHBondContact O-N 3.4Å; V999-Y1001 VanDerWaalsContact O-N 3.09Å; V999-R1002 PolarHBondContact O-N 3.46Å
1000	Q	53.3	Low	79.5	Confident	122 Å²	122	37.3 Å²	37.3	57%	0.57	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-64.9	-7.6	177.8	70.3	-86.3	31.3	0	0	115.5	P998	P998-Q1000 VanDerWaalsContact CB-OE1 3.26Å; P998-Q1000 PolarHBondContact O-N 2.8Å; P998-Q1000 VanDerWaalsContact O-N 3.14Å
1001	Y	75.4	Confident	80	Confident	108 Å²	108	37.3 Å²	37.3	42%	0.424	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-125.2	4.9	177.5	-50	-49.4	0	0	0	113.4	P973 S974 S975 P998 V999 N1003	P973-Y1001 CarbonylContact C-O 3.56Å; P973-Y1001 VanDerWaalsContact CA-O 3.3Å; P973-Y1001 WeakPolarHBondContact CA-O 3.16Å; S974-Y1001 PolarHBondContact N-O 2.77Å; S975-Y1001 VanDerWaalsContact CB-CB 3.42Å; P998-Y1001 HydrophobicContact CB-CD2 3.84Å; P998-Y1001 HydrophobicContact CB-CE2 4.33Å; P998-Y1001 HydrophobicContact CG-CD2 3.89Å; P998-Y1001 HydrophobicContact CG-CE2 4.34Å; P998-Y1001 CarbonylContact O-C 3.54Å; P998-Y1001 WeakPolarHBondContact O-CA 3.41Å; P998-Y1001 PolarHBondContact O-N 3.04Å; V999-Y1001 PolarHBondContact O-N 3.4Å; V999-Y1001 VanDerWaalsContact O-N 3.09Å; Y1001-N1003 VanDerWaalsContact C-N 3.31Å
1002	R	76.6	Confident	80.4	Confident	39 Å²	39	38.5 Å²	38.5	15%	0.147	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-28.6	174.1	-68.4	-179.2	-169.5	170.9	7.9	112.3	Q605 P973 P997 P998 V999 G1004 L1006 T1055	Q605-R1002 VanDerWaalsContact OE1-NH1 3.13Å; P973-R1002 WeakPolarHBondContact CG-O 3.42Å; P997-R1002 HydrophobicContact CB-CG 4.17Å; P997-R1002 WeakPolarHBondContact O-CG 3.36Å; P997-R1002 PolarHBondContact O-NE 2.84Å; P998-R1002 PolarHBondContact O-N 2.69Å; V999-R1002 PolarHBondContact O-N 3.46Å; R1002-G1004 PolarHBondContact O-N 3.11Å; R1002-L1006 HydrophobicContact CB-CD2 4.06Å; R1002-L1006 HydrophobicContact CB-CG 4.39Å; R1002-L1006 HydrophobicContact CG-CD1 4.14Å; R1002-L1006 HydrophobicContact CG-CD2 4.2Å; R1002-L1006 HydrophobicContact CG-CG 4.22Å; R1002-T1055 VanDerWaalsContact O-CG2 3.23Å; R1002-T1055 WeakPolarHBondContact O-CG2 3.33Å
1003	N	69.8	Low	80.5	Confident	18 Å²	18	38.7 Å²	38.7	10%	0.096	20%	0.197	C	C	.	.			trans	51.4	39.8	-178.5	-51.8	-19.8	0	0	0	114	Y942 D970 A971 P972 S974 Y1001	Y942-N1003 WeakPolarHBondContact CB-O 3.4Å; Y942-N1003 HydrophobicContact CD2-CB 3.6Å; Y942-N1003 HydrophobicContact CE2-CB 4.17Å; Y942-N1003 HydrophobicContact CG-CB 3.85Å; D970-N1003 CarbonylContact C-O 3.52Å; D970-N1003 WeakPolarHBondContact CA-O 3.01Å; A971-N1003 HydrophobicContact CB-CB 3.96Å; A971-N1003 PolarHBondContact N-O 2.89Å; P972-N1003 PolarHBondContact O-ND2 3.24Å; S974-N1003 VanDerWaalsContact CB-ND2 3.31Å; S974-N1003 WeakPolarHBondContact CB-ND2 3.26Å; S974-N1003 PolarHBondContact N-ND2 2.94Å; S974-N1003 PolarHBondContact OG-ND2 3.39Å; S974-N1003 PolarHBondContact OG-OD1 2.8Å; Y1001-N1003 VanDerWaalsContact C-N 3.31Å
1004	G	70.8	Confident	80.7	Confident	21 Å²	21	37.9 Å²	37.9	22%	0.216	19%	0.19	C	C	.	.	S	Bend	trans	129.7	-164.2	178	0	0	0	0	0	112.9	Y942 D970 R1002 L1006	Y942-G1004 WeakPolarHBondContact O-CA 3.3Å; D970-G1004 WeakPolarHBondContact OD1-CA 3.27Å; R1002-G1004 PolarHBondContact O-N 3.11Å; G1004-L1006 PolarHBondContact O-N 2.65Å
1005	K	72.2	Confident	80.5	Confident	163 Å²	163	39 Å²	39	71%	0.709	20%	0.196	S	C	*	.			trans	-80.9	115.5	-177.8	-168.9	172	-175.3	174.5	0	110.4	D970 T1007 T1055	D970-K1005 PolarHBondContact OD1-N 2.96Å; K1005-T1007 PolarHBondContact O-N 3.26Å; K1005-T1055 WeakPolarHBondContact O-CA 3.18Å
1006	L	81	Confident	80.2	Confident	17 Å²	17	41.1 Å²	41.1	9%	0.089	21%	0.205	C	C	.	.			trans	-61.6	124.5	175.2	-58.6	-176.9	0	0	0	110.2	P973 P996 R1002 G1004 Y1009 P1031 A1053 F1054 T1055	P973-L1006 HydrophobicContact CG-CD2 3.76Å; P996-L1006 HydrophobicContact CB-CD1 4.04Å; R1002-L1006 HydrophobicContact CB-CD2 4.06Å; R1002-L1006 HydrophobicContact CB-CG 4.39Å; R1002-L1006 HydrophobicContact CG-CD1 4.14Å; R1002-L1006 HydrophobicContact CG-CD2 4.2Å; R1002-L1006 HydrophobicContact CG-CG 4.22Å; G1004-L1006 PolarHBondContact O-N 2.65Å; L1006-Y1009 HydrophobicContact CD1-CE1 4.37Å; L1006-P1031 VanDerWaalsContact O-CB 3.32Å; L1006-P1031 WeakPolarHBondContact O-CB 3.47Å; L1006-P1031 WeakPolarHBondContact O-CG 3.33Å; L1006-A1053 HydrophobicContact CD1-CB 4.49Å; L1006-A1053 HydrophobicContact CD2-CB 4.05Å; L1006-F1054 CarbonylContact C-O 3.56Å; L1006-F1054 WeakPolarHBondContact CA-O 3.46Å; L1006-T1055 HydrophobicContact CD2-CG2 3.99Å
1007	T	81.5	Confident	79.8	Confident	61 Å²	61	43.7 Å²	43.7	37%	0.374	24%	0.235	S	C	.	.			trans	-95.4	-20.4	-180	52.1	0	0	0	0	112.3	K1005 F1054 T1055	K1005-T1007 PolarHBondContact O-N 3.26Å; T1007-F1054 PolarHBondContact N-O 3.48Å; T1007-F1054 WeakPolarHBondContact OG1-CB 3.22Å; T1007-F1054 PolarHBondContact OG1-O 2.74Å; T1007-T1055 VanDerWaalsContact OG1-C 3.22Å; T1007-T1055 PolarHBondContact OG1-O 3.5Å
1008	G	85.5	Confident	79.5	Confident	5 Å²	5	44.6 Å²	44.6	5%	0.052	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.5	-163	177.2	0	0	0	0	0	112.2	V1028 F1054	G1008-V1028 CarbonylContact C-O 3.53Å; G1008-V1028 WeakPolarHBondContact CA-O 3.08Å; G1008-F1054 PolarHBondContact O-N 3.14Å
1009	Y	91	Very high	79.6	Confident	6 Å²	6	48.2 Å²	48.2	2%	0.024	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	158.4	174.8	-51.7	-92.3	0	0	0	110.3	P977 W994 L1006 V1028 R1052 A1053	P977-Y1009 HydrophobicContact CG-CD1 4.07Å; P977-Y1009 HydrophobicContact CG-CE1 4.4Å; W994-Y1009 AromaticContact CD1-CD1 3.9Å; W994-Y1009 AromaticContact CD1-CE1 3.78Å; W994-Y1009 AromaticContact CE2-CD2 3.98Å; W994-Y1009 AromaticContact CE2-CG 3.79Å; W994-Y1009 HydrophobicContact CZ2-CD1 4.49Å; W994-Y1009 AromaticContact CZ2-CD2 3.83Å; W994-Y1009 HydrophobicContact CZ2-CD2 3.83Å; W994-Y1009 AromaticContact CZ2-CG 3.8Å; W994-Y1009 HydrophobicContact CZ2-CG 3.8Å; W994-Y1009 AromaticContact NE1-CD1 3.2Å; W994-Y1009 AromaticContact NE1-CD2 3.51Å; W994-Y1009 AromaticContact NE1-CE1 3.32Å; W994-Y1009 VanDerWaalsContact NE1-CE1 3.32Å; W994-Y1009 AromaticContact NE1-CE2 3.63Å; W994-Y1009 AromaticContact NE1-CG 3.32Å; W994-Y1009 VanDerWaalsContact NE1-CG 3.32Å; W994-Y1009 AromaticContact NE1-CZ 3.55Å; L1006-Y1009 HydrophobicContact CD1-CE1 4.37Å; Y1009-V1028 PolarHBondContact N-O 2.97Å; Y1009-V1028 PolarHBondContact O-N 3.43Å; Y1009-R1052 CarbonylContact C-O 3.52Å; Y1009-R1052 WeakPolarHBondContact CA-O 3.43Å; Y1009-R1052 WeakPolarHBondContact CB-O 3.29Å; Y1009-A1053 HydrophobicContact CD1-CB 3.72Å; Y1009-A1053 HydrophobicContact CE1-CB 3.75Å
1010	E	92.3	Very high	79.9	Confident	11 Å²	11	51.6 Å²	51.6	5%	0.051	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	144.3	159.1	-81.9	174.8	172.6	0	0	110.2	I1025 I1026 K1027 V1051 R1052 F1054 W1062	E1010-I1025 HydrophobicContact CB-CG2 4.06Å; E1010-I1025 HydrophobicContact CG-CG2 3.85Å; E1010-I1026 CarbonylContact C-O 3.59Å; E1010-I1026 VanDerWaalsContact CA-O 3.3Å; E1010-I1026 WeakPolarHBondContact CA-O 3.35Å; E1010-K1027 HydrophobicContact CG-CG 3.6Å; E1010-K1027 WeakPolarHBondContact OE1-CE 3.47Å; E1010-K1027 IonicContact OE1-NZ 3.79Å; E1010-V1051 CarbonylContact O-C 3.58Å; E1010-V1051 VanDerWaalsContact O-CA 3.27Å; E1010-V1051 WeakPolarHBondContact O-CA 3.38Å; E1010-V1051 WeakPolarHBondContact O-CG1 3.46Å; E1010-R1052 HydrophobicContact CB-CG 4.06Å; E1010-R1052 PolarHBondContact N-O 2.74Å; E1010-R1052 PolarHBondContact O-N 3.37Å; E1010-R1052 IonicContact OE2-CZ 3.62Å; E1010-R1052 IonicContact OE2-NE 3.79Å; E1010-R1052 PolarHBondContact OE2-NE 3.39Å; E1010-R1052 IonicContact OE2-NH2 2.78Å; E1010-R1052 PolarHBondContact OE2-NH2 3.25Å; E1010-F1054 HydrophobicContact CB-CE2 3.81Å; E1010-F1054 HydrophobicContact CG-CD2 4.33Å; E1010-F1054 HydrophobicContact CG-CE2 3.43Å; E1010-F1054 VanDerWaalsContact CG-CE2 3.43Å; E1010-F1054 HydrophobicContact CG-CZ 3.89Å; E1010-F1054 WeakPolarHBondContact OE1-CZ 3.2Å; E1010-F1054 WeakPolarHBondContact OE2-CE2 3.2Å; E1010-F1054 WeakPolarHBondContact OE2-CZ 3.42Å; E1010-W1062 HydrophobicContact CB-CH2 3.8Å; E1010-W1062 HydrophobicContact CB-CZ3 4.12Å; E1010-W1062 WeakPolarHBondContact O-CZ3 3.23Å
1011	V	90.7	Very high	80.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	121.7	168	-175.5	0	0	0	0	107.9	V992 W994 I1013 I1025 I1026 V1028 Y1036 F1049 M1050 V1051	V992-V1011 HydrophobicContact CG1-CG1 3.88Å; V992-V1011 HydrophobicContact CG1-CG2 4.21Å; W994-V1011 HydrophobicContact CH2-CG2 3.84Å; W994-V1011 HydrophobicContact CZ3-CG2 3.94Å; V1011-I1013 HydrophobicContact CG1-CD1 4.15Å; V1011-I1013 HydrophobicContact CG1-CG1 3.74Å; V1011-I1025 CarbonylContact O-C 3.5Å; V1011-I1025 WeakPolarHBondContact O-CA 3.23Å; V1011-I1026 PolarHBondContact N-O 3.12Å; V1011-I1026 PolarHBondContact O-N 2.95Å; V1011-V1028 HydrophobicContact CG2-CG2 4.35Å; V1011-Y1036 HydrophobicContact CG2-CD1 4.43Å; V1011-F1049 HydrophobicContact CG1-CD1 3.95Å; V1011-M1050 CarbonylContact C-O 3.47Å; V1011-M1050 WeakPolarHBondContact CA-O 3.42Å; V1011-V1051 HydrophobicContact CG2-CG1 4.36Å; V1011-V1051 HydrophobicContact CG2-CG2 4.35Å
1012	R	92.5	Very high	81	Confident	63 Å²	63	50.1 Å²	50.1	24%	0.238	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	127.7	170.2	-176.5	176.5	-169.8	-132.3	-3.5	108.5	F1014 E1023 T1024 I1025 F1049 M1050 W1062	R1012-F1014 HydrophobicContact CG-CD1 4.35Å; R1012-E1023 HydrophobicContact CG-CG 4.28Å; R1012-E1023 IonicContact CZ-OE1 3.05Å; R1012-E1023 IonicContact CZ-OE2 3.45Å; R1012-E1023 IonicContact NE-OE1 2.62Å; R1012-E1023 PolarHBondContact NE-OE1 3.43Å; R1012-E1023 IonicContact NE-OE2 2.71Å; R1012-E1023 PolarHBondContact NE-OE2 3.43Å; R1012-E1023 VanDerWaalsContact NH2-CD 3.31Å; R1012-E1023 IonicContact NH2-OE1 3.87Å; R1012-E1023 PolarHBondContact NH2-OE1 3.03Å; R1012-E1023 IonicContact NH2-OE2 2.68Å; R1012-E1023 PolarHBondContact NH2-OE2 2.93Å; R1012-T1024 WeakPolarHBondContact CA-O 3.14Å; R1012-I1025 HydrophobicContact CB-CG1 4.36Å; R1012-I1025 HydrophobicContact CG-CG1 4.21Å; R1012-F1049 WeakPolarHBondContact O-CA 3.41Å; R1012-M1050 HydrophobicContact CG-CE 4.45Å; R1012-M1050 PolarHBondContact N-O 3.04Å; R1012-M1050 PolarHBondContact O-N 3.12Å; R1012-W1062 HydrophobicContact CB-CD2 4.49Å; R1012-W1062 HydrophobicContact CB-CE3 4.06Å; R1012-W1062 HydrophobicContact CB-CH2 3.5Å; R1012-W1062 VanDerWaalsContact CB-CH2 3.5Å; R1012-W1062 HydrophobicContact CB-CZ2 3.92Å; R1012-W1062 HydrophobicContact CB-CZ3 3.55Å; R1012-W1062 HydrophobicContact CG-CH2 4.5Å; R1012-W1062 HydrophobicContact CG-CZ2 4.5Å
1013	I	91.6	Very high	81.4	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.021	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	133.2	-175.7	-46.3	175.5	0	0	0	108.3	V1011 E1023 T1024 I1026 A1038 L1041 Y1047 T1048 F1049	V1011-I1013 HydrophobicContact CG1-CD1 4.15Å; V1011-I1013 HydrophobicContact CG1-CG1 3.74Å; I1013-E1023 CarbonylContact O-C 3.4Å; I1013-E1023 WeakPolarHBondContact O-CA 3.38Å; I1013-T1024 PolarHBondContact N-O 2.99Å; I1013-T1024 PolarHBondContact O-N 3.22Å; I1013-I1026 HydrophobicContact CD1-CD1 3.71Å; I1013-A1038 HydrophobicContact CD1-CB 3.59Å; I1013-L1041 HydrophobicContact CG2-CD2 4.29Å; I1013-Y1047 HydrophobicContact CG2-CD1 3.98Å; I1013-T1048 VanDerWaalsContact CA-O 3.31Å; I1013-T1048 WeakPolarHBondContact CA-O 3.38Å; I1013-F1049 HydrophobicContact CB-CE1 4.44Å; I1013-F1049 HydrophobicContact CD1-CD1 4.14Å; I1013-F1049 HydrophobicContact CD1-CE1 3.59Å; I1013-F1049 HydrophobicContact CD1-CZ 4.3Å; I1013-F1049 HydrophobicContact CG1-CD1 3.81Å; I1013-F1049 HydrophobicContact CG1-CE1 3.72Å; I1013-F1049 HydrophobicContact CG1-CZ 4.44Å; I1013-F1049 HydrophobicContact CG2-CD1 4.34Å; I1013-F1049 HydrophobicContact CG2-CE1 3.91Å; I1013-F1049 HydrophobicContact CG2-CE2 4.1Å; I1013-F1049 HydrophobicContact CG2-CZ 3.75Å
1014	F	90.9	Very high	82.1	Confident	17 Å²	17	54.5 Å²	54.5	8%	0.075	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	157.1	171.3	53.7	-97.4	0	0	0	111.6	R1012 E1019 Y1047 T1048 M1050	R1012-F1014 HydrophobicContact CG-CD1 4.35Å; F1014-E1019 HydrophobicContact CD2-CB 4.16Å; F1014-E1019 HydrophobicContact CD2-CG 3.45Å; F1014-E1019 VanDerWaalsContact CD2-CG 3.45Å; F1014-E1019 HydrophobicContact CE2-CB 4.4Å; F1014-E1019 HydrophobicContact CE2-CG 3.34Å; F1014-E1019 HydrophobicContact CG-CG 4.28Å; F1014-E1019 HydrophobicContact CZ-CG 4.09Å; F1014-Y1047 CarbonylContact O-C 3.54Å; F1014-Y1047 WeakPolarHBondContact O-CA 3.36Å; F1014-Y1047 WeakPolarHBondContact O-CD1 3.25Å; F1014-T1048 HydrophobicContact CE1-CG2 3.94Å; F1014-T1048 HydrophobicContact CE2-CG2 3.82Å; F1014-T1048 WeakPolarHBondContact CE2-OG1 3.17Å; F1014-T1048 VanDerWaalsContact CZ-CB 3.49Å; F1014-T1048 HydrophobicContact CZ-CG2 3.42Å; F1014-T1048 VanDerWaalsContact CZ-CG2 3.42Å; F1014-T1048 PolarHBondContact N-O 3.24Å; F1014-T1048 VanDerWaalsContact N-O 3.11Å; F1014-T1048 PolarHBondContact O-N 3Å; F1014-M1050 HydrophobicContact CE1-CE 4Å
1015	E	85.9	Confident	82.9	Confident	35 Å²	35	57.2 Å²	57.2	16%	0.164	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	130.5	174.7	176.9	168.3	-179.4	0	0	110.1	G1017 A1018 E1019 T1022 K1042 T1045 F1046 Y1047	E1015-G1017 PolarHBondContact O-N 2.85Å; E1015-A1018 HydrophobicContact CB-CB 4.2Å; E1015-A1018 HydrophobicContact CG-CB 4.21Å; E1015-A1018 CarbonylContact O-C 3.5Å; E1015-A1018 WeakPolarHBondContact O-CA 3.46Å; E1015-A1018 PolarHBondContact O-N 3.35Å; E1015-E1019 PolarHBondContact O-N 2.9Å; E1015-T1022 HydrophobicContact CB-CG2 3.92Å; E1015-T1022 WeakPolarHBondContact CB-OG1 3.47Å; E1015-T1022 PolarHBondContact N-OG1 3.45Å; E1015-K1042 VanDerWaalsContact CD-NZ 3.25Å; E1015-K1042 IonicContact OE1-NZ 3.46Å; E1015-K1042 PolarHBondContact OE1-NZ 3.34Å; E1015-K1042 WeakPolarHBondContact OE2-CD 3.12Å; E1015-K1042 WeakPolarHBondContact OE2-CE 3.32Å; E1015-K1042 IonicContact OE2-NZ 2.89Å; E1015-K1042 PolarHBondContact OE2-NZ 3.22Å; E1015-T1045 HydrophobicContact CB-CG2 4.33Å; E1015-T1045 VanDerWaalsContact CD-CG2 3.43Å; E1015-T1045 HydrophobicContact CG-CG2 3.48Å; E1015-T1045 VanDerWaalsContact CG-CG2 3.48Å; E1015-T1045 WeakPolarHBondContact OE1-CG2 3.24Å; E1015-F1046 WeakPolarHBondContact CA-O 3.32Å; E1015-Y1047 HydrophobicContact CB-CD1 4.24Å; E1015-Y1047 HydrophobicContact CB-CE1 3.94Å
1016	V	77.2	Confident	83.6	Confident	70 Å²	70	51.2 Å²	51.2	42%	0.424	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	122.1	-174.9	176.4	0	0	0	0	109.8	A1018 F1046 T1048	V1016-A1018 VanDerWaalsContact C-N 3.34Å; V1016-F1046 HydrophobicContact CB-CB 3.92Å; V1016-F1046 HydrophobicContact CG2-CB 3.8Å; V1016-F1046 PolarHBondContact N-O 3.13Å; V1016-T1048 WeakPolarHBondContact CG2-OG1 3.49Å
1017	G	75.7	Confident	83.9	Confident	69 Å²	69	57.3 Å²	57.3	71%	0.711	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.3	-2.4	-173.8	0	0	0	0	0	115.1	E1015	E1015-G1017 PolarHBondContact O-N 2.85Å
1018	A	76.2	Confident	83.9	Confident	20 Å²	20	54.6 Å²	54.6	17%	0.165	30%	0.297	C	S	.	.			trans	-126.9	31.3	172.9	0	0	0	0	0	111.7	E1015 V1016 T1020 Q1021 T1022	E1015-A1018 HydrophobicContact CB-CB 4.2Å; E1015-A1018 HydrophobicContact CG-CB 4.21Å; E1015-A1018 CarbonylContact O-C 3.5Å; E1015-A1018 WeakPolarHBondContact O-CA 3.46Å; E1015-A1018 PolarHBondContact O-N 3.35Å; V1016-A1018 VanDerWaalsContact C-N 3.34Å; A1018-T1020 PolarHBondContact O-N 2.82Å; A1018-Q1021 PolarHBondContact O-N 3.16Å; A1018-T1022 HydrophobicContact CB-CG2 3.91Å; A1018-T1022 PolarHBondContact O-N 3.43Å; A1018-T1022 VanDerWaalsContact O-N 3.13Å; A1018-T1022 PolarHBondContact O-OG1 3.36Å
1019	E	73.7	Confident	83.5	Confident	104 Å²	104	59.6 Å²	59.6	49%	0.486	33%	0.327	S	S	.	.	H	α-helix	trans	-42	-55.4	-174	-76.8	140.8	-135.3	0	0	113.9	F1014 E1015 Q1021 E1023	F1014-E1019 HydrophobicContact CD2-CB 4.16Å; F1014-E1019 HydrophobicContact CD2-CG 3.45Å; F1014-E1019 VanDerWaalsContact CD2-CG 3.45Å; F1014-E1019 HydrophobicContact CE2-CB 4.4Å; F1014-E1019 HydrophobicContact CE2-CG 3.34Å; F1014-E1019 HydrophobicContact CG-CG 4.28Å; F1014-E1019 HydrophobicContact CZ-CG 4.09Å; E1015-E1019 PolarHBondContact O-N 2.9Å; E1019-Q1021 VanDerWaalsContact C-N 3.3Å; E1019-Q1021 PolarHBondContact O-N 3.07Å; E1019-E1023 PolarHBondContact O-N 3Å
1020	T	73.8	Confident	82.6	Confident	131 Å²	131	63 Å²	63	80%	0.804	35%	0.348	S	S	*	.	H	α-helix	trans	-76.7	-11.2	-175.9	53.7	0	0	0	0	114.6	A1018	A1018-T1020 PolarHBondContact O-N 2.82Å
1021	Q	74.3	Confident	81	Confident	167 Å²	167	65.4 Å²	65.4	78%	0.78	37%	0.365	S	S	*	.	H	α-helix	trans	-106.5	-15.1	-174.4	-61.4	-178.5	4.6	0	0	113.2	A1018 E1019	A1018-Q1021 PolarHBondContact O-N 3.16Å; E1019-Q1021 VanDerWaalsContact C-N 3.3Å; E1019-Q1021 PolarHBondContact O-N 3.07Å
1022	T	78.3	Confident	79.6	Confident	31 Å²	31	68.4 Å²	68.4	19%	0.19	40%	0.395	C	S	.	.	H	α-helix	trans	-130	6.2	-169.8	59.5	0	0	0	0	113.1	E1015 A1018 T1024	E1015-T1022 HydrophobicContact CB-CG2 3.92Å; E1015-T1022 WeakPolarHBondContact CB-OG1 3.47Å; E1015-T1022 PolarHBondContact N-OG1 3.45Å; A1018-T1022 HydrophobicContact CB-CG2 3.91Å; A1018-T1022 PolarHBondContact O-N 3.43Å; A1018-T1022 VanDerWaalsContact O-N 3.13Å; A1018-T1022 PolarHBondContact O-OG1 3.36Å; T1022-T1024 PolarHBondContact O-N 3Å; T1022-T1024 PolarHBondContact O-OG1 2.65Å
1023	E	85.1	Confident	78.9	Confident	77 Å²	77	69 Å²	69	36%	0.36	40%	0.401	S	S	.	.			trans	-59.8	123.2	177.6	-180	168.8	177.2	0	0	112.4	R1012 I1013 E1019 I1025	R1012-E1023 HydrophobicContact CG-CG 4.28Å; R1012-E1023 IonicContact CZ-OE1 3.05Å; R1012-E1023 IonicContact CZ-OE2 3.45Å; R1012-E1023 IonicContact NE-OE1 2.62Å; R1012-E1023 PolarHBondContact NE-OE1 3.43Å; R1012-E1023 IonicContact NE-OE2 2.71Å; R1012-E1023 PolarHBondContact NE-OE2 3.43Å; R1012-E1023 VanDerWaalsContact NH2-CD 3.31Å; R1012-E1023 IonicContact NH2-OE1 3.87Å; R1012-E1023 PolarHBondContact NH2-OE1 3.03Å; R1012-E1023 IonicContact NH2-OE2 2.68Å; R1012-E1023 PolarHBondContact NH2-OE2 2.93Å; I1013-E1023 CarbonylContact O-C 3.4Å; I1013-E1023 WeakPolarHBondContact O-CA 3.38Å; E1019-E1023 PolarHBondContact O-N 3Å; E1023-I1025 HydrophobicContact CG-CG1 4.38Å; E1023-I1025 WeakPolarHBondContact OE1-CD1 3.43Å
1024	T	85	Confident	78.5	Confident	73 Å²	73	74.4 Å²	74.4	45%	0.448	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	120.2	173.6	-49.9	0	0	0	0	108.4	R1012 I1013 T1022 I1026	R1012-T1024 WeakPolarHBondContact CA-O 3.14Å; I1013-T1024 PolarHBondContact N-O 2.99Å; I1013-T1024 PolarHBondContact O-N 3.22Å; T1022-T1024 PolarHBondContact O-N 3Å; T1022-T1024 PolarHBondContact O-OG1 2.65Å; T1024-I1026 HydrophobicContact CG2-CD1 4.04Å; T1024-I1026 HydrophobicContact CG2-CG1 3.86Å
1025	I	87.6	Confident	78.3	Confident	77 Å²	77	78.4 Å²	78.4	40%	0.395	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	126.7	173	-60.6	178.6	0	0	0	109.1	E1010 V1011 R1012 E1023 W1062	E1010-I1025 HydrophobicContact CB-CG2 4.06Å; E1010-I1025 HydrophobicContact CG-CG2 3.85Å; V1011-I1025 CarbonylContact O-C 3.5Å; V1011-I1025 WeakPolarHBondContact O-CA 3.23Å; R1012-I1025 HydrophobicContact CB-CG1 4.36Å; R1012-I1025 HydrophobicContact CG-CG1 4.21Å; E1023-I1025 HydrophobicContact CG-CG1 4.38Å; E1023-I1025 WeakPolarHBondContact OE1-CD1 3.43Å; I1025-W1062 HydrophobicContact CD1-CZ2 4.48Å; I1025-W1062 HydrophobicContact CG2-CH2 4.41Å
1026	I	86.6	Confident	78.4	Confident	37 Å²	37	79.6 Å²	79.6	19%	0.19	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	123.2	-173.8	-52.2	-178.1	0	0	0	110	E1010 V1011 I1013 T1024 Y1036	E1010-I1026 CarbonylContact C-O 3.59Å; E1010-I1026 VanDerWaalsContact CA-O 3.3Å; E1010-I1026 WeakPolarHBondContact CA-O 3.35Å; V1011-I1026 PolarHBondContact N-O 3.12Å; V1011-I1026 PolarHBondContact O-N 2.95Å; I1013-I1026 HydrophobicContact CD1-CD1 3.71Å; T1024-I1026 HydrophobicContact CG2-CD1 4.04Å; T1024-I1026 HydrophobicContact CG2-CG1 3.86Å; I1026-Y1036 HydrophobicContact CB-CE1 4.43Å; I1026-Y1036 HydrophobicContact CD1-CE1 3.61Å; I1026-Y1036 HydrophobicContact CG2-CE1 4.03Å; I1026-Y1036 HydrophobicContact CG2-CE2 3.96Å
1027	K	85.9	Confident	78.8	Confident	145 Å²	145	78 Å²	78	63%	0.63	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.8	122.4	180	-74.2	175.6	175.8	177.8	0	111.5	E1010 T1029	E1010-K1027 HydrophobicContact CG-CG 3.6Å; E1010-K1027 WeakPolarHBondContact OE1-CE 3.47Å; E1010-K1027 IonicContact OE1-NZ 3.79Å; K1027-T1029 HydrophobicContact CB-CG2 4.22Å
1028	V	82.8	Confident	79.1	Confident	5 Å²	5	74.8 Å²	74.8	3%	0.03	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	93	172.8	-178.9	0	0	0	0	107.6	W994 G1008 Y1009 V1011 V1030 Q1033 Y1036	W994-V1028 HydrophobicContact CH2-CG2 4.13Å; W994-V1028 HydrophobicContact CZ2-CG1 4.42Å; W994-V1028 HydrophobicContact CZ2-CG2 4.47Å; G1008-V1028 CarbonylContact C-O 3.53Å; G1008-V1028 WeakPolarHBondContact CA-O 3.08Å; Y1009-V1028 PolarHBondContact N-O 2.97Å; Y1009-V1028 PolarHBondContact O-N 3.43Å; V1011-V1028 HydrophobicContact CG2-CG2 4.35Å; V1028-V1030 VanDerWaalsContact C-N 3.31Å; V1028-V1030 PolarHBondContact O-N 2.89Å; V1028-Q1033 HydrophobicContact CG1-CB 3.82Å; V1028-Q1033 HydrophobicContact CG1-CG 3.68Å; V1028-Y1036 HydrophobicContact CG2-CD2 4.1Å; V1028-Y1036 HydrophobicContact CG2-CG 4.1Å
1029	T	76.5	Confident	79.4	Confident	110 Å²	110	83.3 Å²	83.3	68%	0.675	43%	0.428	S	S	*	.			trans	-84.9	6.2	-167	54.5	0	0	0	0	115	K1027	K1027-T1029 HydrophobicContact CB-CG2 4.22Å
1030	V	71.9	Confident	79.7	Confident	77 Å²	77	81.7 Å²	81.7	47%	0.467	44%	0.44	S	S	.	.			trans	-105.6	111.7	178.4	179.4	0	0	0	0	108.4	V1028 G1032 Q1033	V1028-V1030 VanDerWaalsContact C-N 3.31Å; V1028-V1030 PolarHBondContact O-N 2.89Å; V1030-G1032 PolarHBondContact O-N 3.22Å; V1030-G1032 VanDerWaalsContact O-N 3.08Å; V1030-Q1033 HydrophobicContact CB-CB 3.86Å; V1030-Q1033 HydrophobicContact CG1-CB 4.15Å; V1030-Q1033 WeakPolarHBondContact O-CB 3.01Å; V1030-Q1033 PolarHBondContact O-N 2.9Å
1031	P	59.7	Low	80.2	Confident	62 Å²	62	76.5 Å²	76.5	40%	0.403	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-31.4	-174.6	-32	36.8	0	0	0	115.9	L1006	L1006-P1031 VanDerWaalsContact O-CB 3.32Å; L1006-P1031 WeakPolarHBondContact O-CB 3.47Å; L1006-P1031 WeakPolarHBondContact O-CG 3.33Å
1032	G	60.9	Low	80.3	Confident	62 Å²	62	73.7 Å²	73.7	64%	0.639	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-14	176.8	0	0	0	0	0	114.7	V1030 R1034	V1030-G1032 PolarHBondContact O-N 3.22Å; V1030-G1032 VanDerWaalsContact O-N 3.08Å; G1032-R1034 PolarHBondContact O-N 2.86Å
1033	Q	76.7	Confident	79.9	Confident	77 Å²	77	76 Å²	76	36%	0.36	40%	0.401	S	S	.	.			trans	-79.2	104.8	-178.5	-177.7	174.4	-9.3	0	0	110.2	V1028 V1030 Q1035	V1028-Q1033 HydrophobicContact CG1-CB 3.82Å; V1028-Q1033 HydrophobicContact CG1-CG 3.68Å; V1030-Q1033 HydrophobicContact CB-CB 3.86Å; V1030-Q1033 HydrophobicContact CG1-CB 4.15Å; V1030-Q1033 WeakPolarHBondContact O-CB 3.01Å; V1030-Q1033 PolarHBondContact O-N 2.9Å; Q1033-Q1035 WeakPolarHBondContact CG-O 3.07Å; Q1033-Q1035 PolarHBondContact NE2-O 2.81Å
1034	R	84.2	Confident	79.1	Confident	117 Å²	117	76.9 Å²	76.9	44%	0.442	40%	0.403	S	S	.	.			trans	-100.2	12.2	-177	-71.1	-179.3	-167.7	-176.8	6	113.7	S993 W994 G1032	S993-R1034 CarbonylContact C-O 3.36Å; S993-R1034 VanDerWaalsContact CA-O 3.31Å; S993-R1034 WeakPolarHBondContact CA-O 3.38Å; W994-R1034 PolarHBondContact N-O 3.01Å; W994-R1034 WeakPolarHBondContact O-CB 3.39Å; G1032-R1034 PolarHBondContact O-N 2.86Å
1035	Q	85.7	Confident	78.7	Confident	101 Å²	101	74.6 Å²	74.6	47%	0.472	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	149.4	177.6	72.7	-160.2	82.9	0	0	111.6	E991 V992 Q1033	E991-Q1035 HydrophobicContact CG-CB 4.47Å; E991-Q1035 PolarHBondContact OE1-NE2 2.9Å; V992-Q1035 CarbonylContact O-C 3.58Å; V992-Q1035 VanDerWaalsContact O-CA 3.22Å; V992-Q1035 WeakPolarHBondContact O-CA 3.32Å; Q1033-Q1035 WeakPolarHBondContact CG-O 3.07Å; Q1033-Q1035 PolarHBondContact NE2-O 2.81Å
1036	Y	88.1	Confident	78.6	Confident	59 Å²	59	76 Å²	76	23%	0.231	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	131	176.7	174	-97.6	0	0	0	111.1	E991 V992 V1011 I1026 V1028 A1038	E991-Y1036 WeakPolarHBondContact CA-O 3.38Å; V992-Y1036 HydrophobicContact CG1-CD1 4.33Å; V992-Y1036 VanDerWaalsContact CG1-O 3.26Å; V992-Y1036 WeakPolarHBondContact CG1-O 3.05Å; V992-Y1036 PolarHBondContact N-O 3.16Å; V992-Y1036 PolarHBondContact O-N 2.67Å; V1011-Y1036 HydrophobicContact CG2-CD1 4.43Å; I1026-Y1036 HydrophobicContact CB-CE1 4.43Å; I1026-Y1036 HydrophobicContact CD1-CE1 3.61Å; I1026-Y1036 HydrophobicContact CG2-CE1 4.03Å; I1026-Y1036 HydrophobicContact CG2-CE2 3.96Å; V1028-Y1036 HydrophobicContact CG2-CD2 4.1Å; V1028-Y1036 HydrophobicContact CG2-CG 4.1Å; Y1036-A1038 VanDerWaalsContact CE1-CA 3.5Å; Y1036-A1038 HydrophobicContact CE1-CB 3.98Å; Y1036-A1038 VanDerWaalsContact CE1-N 3.34Å
1037	T	86.6	Confident	78.7	Confident	37 Å²	37	75.1 Å²	75.1	23%	0.227	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	104	173.2	-48.4	0	0	0	0	110.6	L985 V990 R1039	L985-T1037 HydrophobicContact CD1-CG2 3.81Å; V990-T1037 CarbonylContact O-C 3.48Å; T1037-R1039 HydrophobicContact CG2-CG 4.03Å
1038	A	82.4	Confident	78.7	Confident	2 Å²	2	68.5 Å²	68.5	2%	0.017	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	141.1	163.5	0	0	0	0	0	109.8	S989 V990 I1013 Y1036 L1041 F1049	S989-A1038 WeakPolarHBondContact CA-O 3.47Å; S989-A1038 WeakPolarHBondContact CB-O 3.05Å; V990-A1038 PolarHBondContact N-O 3.27Å; V990-A1038 VanDerWaalsContact N-O 3.12Å; V990-A1038 PolarHBondContact O-N 3.17Å; I1013-A1038 HydrophobicContact CD1-CB 3.59Å; Y1036-A1038 VanDerWaalsContact CE1-CA 3.5Å; Y1036-A1038 HydrophobicContact CE1-CB 3.98Å; Y1036-A1038 VanDerWaalsContact CE1-N 3.34Å; A1038-L1041 HydrophobicContact CB-CD1 4.13Å; A1038-F1049 HydrophobicContact CB-CE1 3.83Å; A1038-F1049 HydrophobicContact CB-CZ 4.12Å
1039	R	82.6	Confident	79.1	Confident	199 Å²	199	68.3 Å²	68.3	75%	0.751	36%	0.357	S	S	*	.			trans	-138.2	158.3	-178.3	-60.3	-175.6	-179	-157.8	-2.3	109.7	S988 T1037	S988-R1039 CarbonylContact O-C 3.56Å; S988-R1039 VanDerWaalsContact O-C 3.28Å; S988-R1039 VanDerWaalsContact O-CA 3.27Å; S988-R1039 WeakPolarHBondContact O-CA 3.28Å; T1037-R1039 HydrophobicContact CG2-CG 4.03Å
1040	G	79.3	Confident	79.8	Confident	70 Å²	70	64.1 Å²	64.1	72%	0.722	33%	0.331	S	S	*	.	S	Bend	trans	78.9	15.4	-179.1	0	0	0	0	0	114.7	S988	S988-G1040 PolarHBondContact O-N 2.93Å
1041	L	84	Confident	80.8	Confident	22 Å²	22	60.5 Å²	60.5	12%	0.115	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-70.3	153.6	174.5	-54.2	174.7	0	0	0	110.6	S988 V990 I1013 A1038 Y1047 F1049 T1070	S988-L1041 VanDerWaalsContact CA-O 3.23Å; S988-L1041 WeakPolarHBondContact CA-O 3.31Å; S988-L1041 VanDerWaalsContact CB-O 3.25Å; S988-L1041 WeakPolarHBondContact CB-O 3.43Å; S988-L1041 WeakPolarHBondContact O-CB 3.31Å; S988-L1041 PolarHBondContact O-N 2.81Å; V990-L1041 HydrophobicContact CB-CD1 4Å; V990-L1041 HydrophobicContact CG2-CD1 3.79Å; I1013-L1041 HydrophobicContact CG2-CD2 4.29Å; A1038-L1041 HydrophobicContact CB-CD1 4.13Å; L1041-Y1047 HydrophobicContact CB-CD2 4.27Å; L1041-Y1047 HydrophobicContact CB-CE2 3.72Å; L1041-Y1047 HydrophobicContact CD1-CD2 4.47Å; L1041-Y1047 HydrophobicContact CD2-CD1 4.13Å; L1041-Y1047 HydrophobicContact CD2-CD2 4.46Å; L1041-Y1047 HydrophobicContact CD2-CE1 3.94Å; L1041-Y1047 HydrophobicContact CD2-CE2 4.25Å; L1041-Y1047 HydrophobicContact CD2-CG 4.39Å; L1041-Y1047 HydrophobicContact CG-CE2 4.43Å; L1041-F1049 HydrophobicContact CD1-CZ 4.05Å; L1041-T1070 HydrophobicContact CB-CG2 3.61Å; L1041-T1070 HydrophobicContact CD1-CG2 3.89Å; L1041-T1070 HydrophobicContact CG-CG2 4.42Å
1042	K	76.5	Confident	82.4	Confident	108 Å²	108	60 Å²	60	47%	0.47	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-70.7	140.3	176.6	-69	169.3	175.3	171.4	0	111.3	S987 E1015 T1045 Y1047 T1070	S987-K1042 CarbonylContact O-C 3.43Å; E1015-K1042 VanDerWaalsContact CD-NZ 3.25Å; E1015-K1042 IonicContact OE1-NZ 3.46Å; E1015-K1042 PolarHBondContact OE1-NZ 3.34Å; E1015-K1042 WeakPolarHBondContact OE2-CD 3.12Å; E1015-K1042 WeakPolarHBondContact OE2-CE 3.32Å; E1015-K1042 IonicContact OE2-NZ 2.89Å; E1015-K1042 PolarHBondContact OE2-NZ 3.22Å; K1042-T1045 HydrophobicContact CB-CG2 4.26Å; K1042-T1045 VanDerWaalsContact CB-OG1 3.26Å; K1042-T1045 WeakPolarHBondContact CB-OG1 3.23Å; K1042-T1045 HydrophobicContact CD-CG2 4.35Å; K1042-T1045 WeakPolarHBondContact O-CB 3.3Å; K1042-Y1047 HydrophobicContact CB-CE2 4.43Å; K1042-Y1047 WeakPolarHBondContact CB-OH 3.29Å; K1042-Y1047 WeakPolarHBondContact CG-OH 3.26Å; K1042-Y1047 PolarHBondContact N-OH 3.27Å; K1042-T1070 PolarHBondContact O-OG1 2.93Å
1043	E	69.1	Low	83.7	Confident	79 Å²	79	57.1 Å²	57.1	37%	0.369	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	145.3	176.6	74.6	160.7	144.2	0	0	112.7	S987 T1045 K1109	S987-E1043 VanDerWaalsContact O-CA 3.31Å; S987-E1043 WeakPolarHBondContact O-CA 3.47Å; E1043-T1045 PolarHBondContact O-N 3.07Å; E1043-T1045 PolarHBondContact O-OG1 3.3Å; E1043-T1045 VanDerWaalsContact O-OG1 3.08Å; E1043-K1109 IonicContact OE1-NZ 3.33Å; E1043-K1109 PolarHBondContact OE1-NZ 3.01Å; E1043-K1109 IonicContact OE2-NZ 2.85Å
1044	K	68.9	Low	84.1	Confident	95 Å²	95	55.1 Å²	55.1	41%	0.413	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	18.4	176.2	-52.9	177	-175.9	176.8	0	115.4	R1069 T1070 I1072	K1044-R1069 PolarHBondContact O-NE 3.04Å; K1044-R1069 PolarHBondContact O-NH2 2.71Å; K1044-R1069 VanDerWaalsContact O-NH2 3.1Å; K1044-T1070 PolarHBondContact N-OG1 3.04Å; K1044-I1072 HydrophobicContact CG-CG1 4.39Å
1045	T	77.7	Confident	84	Confident	25 Å²	25	49.7 Å²	49.7	15%	0.153	24%	0.239	C	C	.	.			trans	-94.8	146.7	-177.4	-63.9	0	0	0	0	110.2	E1015 K1042 E1043 Y1047 R1069 T1070	E1015-T1045 HydrophobicContact CB-CG2 4.33Å; E1015-T1045 VanDerWaalsContact CD-CG2 3.43Å; E1015-T1045 HydrophobicContact CG-CG2 3.48Å; E1015-T1045 VanDerWaalsContact CG-CG2 3.48Å; E1015-T1045 WeakPolarHBondContact OE1-CG2 3.24Å; K1042-T1045 HydrophobicContact CB-CG2 4.26Å; K1042-T1045 VanDerWaalsContact CB-OG1 3.26Å; K1042-T1045 WeakPolarHBondContact CB-OG1 3.23Å; K1042-T1045 HydrophobicContact CD-CG2 4.35Å; K1042-T1045 WeakPolarHBondContact O-CB 3.3Å; E1043-T1045 PolarHBondContact O-N 3.07Å; E1043-T1045 PolarHBondContact O-OG1 3.3Å; E1043-T1045 VanDerWaalsContact O-OG1 3.08Å; T1045-Y1047 HydrophobicContact CG2-CD2 4.01Å; T1045-Y1047 HydrophobicContact CG2-CE2 3.5Å; T1045-Y1047 VanDerWaalsContact CG2-CE2 3.5Å; T1045-R1069 WeakPolarHBondContact O-CA 3.03Å; T1045-T1070 PolarHBondContact N-OG1 2.85Å; T1045-T1070 PolarHBondContact O-N 2.8Å; T1045-T1070 PolarHBondContact O-OG1 2.75Å; T1045-T1070 VanDerWaalsContact O-OG1 3.1Å
1046	F	84.2	Confident	83.5	Confident	108 Å²	108	49.2 Å²	49.2	47%	0.474	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	125.7	174.7	-73.9	-88	0	0	0	109.6	E1015 V1016 R1069	E1015-F1046 WeakPolarHBondContact CA-O 3.32Å; V1016-F1046 HydrophobicContact CB-CB 3.92Å; V1016-F1046 HydrophobicContact CG2-CB 3.8Å; V1016-F1046 PolarHBondContact N-O 3.13Å; F1046-R1069 HydrophobicContact CD1-CB 3.82Å; F1046-R1069 HydrophobicContact CD1-CG 4.13Å; F1046-R1069 HydrophobicContact CD2-CG 4.21Å; F1046-R1069 HydrophobicContact CE1-CB 3.79Å; F1046-R1069 HydrophobicContact CE1-CG 4.11Å; F1046-R1069 HydrophobicContact CE2-CG 4.19Å; F1046-R1069 HydrophobicContact CG-CB 4.34Å; F1046-R1069 HydrophobicContact CG-CG 4.2Å; F1046-R1069 HydrophobicContact CZ-CB 4.27Å; F1046-R1069 HydrophobicContact CZ-CG 4.15Å
1047	Y	88.5	Confident	82.8	Confident	18 Å²	18	48.8 Å²	48.8	7%	0.071	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	136.2	175.2	-73.8	-88.6	0	0	0	110.7	I1013 F1014 E1015 L1041 K1042 T1045 I1068 T1070	I1013-Y1047 HydrophobicContact CG2-CD1 3.98Å; F1014-Y1047 CarbonylContact O-C 3.54Å; F1014-Y1047 WeakPolarHBondContact O-CA 3.36Å; F1014-Y1047 WeakPolarHBondContact O-CD1 3.25Å; E1015-Y1047 HydrophobicContact CB-CD1 4.24Å; E1015-Y1047 HydrophobicContact CB-CE1 3.94Å; L1041-Y1047 HydrophobicContact CB-CD2 4.27Å; L1041-Y1047 HydrophobicContact CB-CE2 3.72Å; L1041-Y1047 HydrophobicContact CD1-CD2 4.47Å; L1041-Y1047 HydrophobicContact CD2-CD1 4.13Å; L1041-Y1047 HydrophobicContact CD2-CD2 4.46Å; L1041-Y1047 HydrophobicContact CD2-CE1 3.94Å; L1041-Y1047 HydrophobicContact CD2-CE2 4.25Å; L1041-Y1047 HydrophobicContact CD2-CG 4.39Å; L1041-Y1047 HydrophobicContact CG-CE2 4.43Å; K1042-Y1047 HydrophobicContact CB-CE2 4.43Å; K1042-Y1047 WeakPolarHBondContact CB-OH 3.29Å; K1042-Y1047 WeakPolarHBondContact CG-OH 3.26Å; K1042-Y1047 PolarHBondContact N-OH 3.27Å; T1045-Y1047 HydrophobicContact CG2-CD2 4.01Å; T1045-Y1047 HydrophobicContact CG2-CE2 3.5Å; T1045-Y1047 VanDerWaalsContact CG2-CE2 3.5Å; Y1047-I1068 PolarHBondContact N-O 3.28Å; Y1047-I1068 PolarHBondContact O-N 3.15Å; Y1047-T1070 HydrophobicContact CD2-CG2 3.77Å; Y1047-T1070 HydrophobicContact CE2-CG2 3.92Å
1048	T	85.8	Confident	82.4	Confident	6 Å²	6	47.6 Å²	47.6	4%	0.037	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	137.3	167	-61.7	0	0	0	0	109.5	I1013 F1014 V1016 M1050 A1065 S1066 N1067	I1013-T1048 VanDerWaalsContact CA-O 3.31Å; I1013-T1048 WeakPolarHBondContact CA-O 3.38Å; F1014-T1048 HydrophobicContact CE1-CG2 3.94Å; F1014-T1048 HydrophobicContact CE2-CG2 3.82Å; F1014-T1048 WeakPolarHBondContact CE2-OG1 3.17Å; F1014-T1048 VanDerWaalsContact CZ-CB 3.49Å; F1014-T1048 HydrophobicContact CZ-CG2 3.42Å; F1014-T1048 VanDerWaalsContact CZ-CG2 3.42Å; F1014-T1048 PolarHBondContact N-O 3.24Å; F1014-T1048 VanDerWaalsContact N-O 3.11Å; F1014-T1048 PolarHBondContact O-N 3Å; V1016-T1048 WeakPolarHBondContact CG2-OG1 3.49Å; T1048-M1050 HydrophobicContact CG2-CG 4.37Å; T1048-A1065 HydrophobicContact CG2-CB 3.62Å; T1048-S1066 WeakPolarHBondContact CA-O 3.33Å; T1048-N1067 WeakPolarHBondContact CA-OD1 3.39Å; T1048-N1067 WeakPolarHBondContact CB-OD1 3.43Å; T1048-N1067 WeakPolarHBondContact CG2-OD1 3.25Å; T1048-N1067 PolarHBondContact OG1-OD1 2.99Å
1049	F	91.7	Very high	82.5	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	135	172.9	-70.7	-105.9	0	0	0	109.3	L982 V990 V992 V1011 R1012 I1013 A1038 L1041 S1066 I1068	L982-F1049 HydrophobicContact CD1-CB 4.08Å; L982-F1049 HydrophobicContact CD1-CD2 3.78Å; L982-F1049 HydrophobicContact CD1-CG 4.15Å; L982-F1049 HydrophobicContact CD2-CB 3.73Å; L982-F1049 HydrophobicContact CD2-CD1 4.22Å; L982-F1049 HydrophobicContact CD2-CD2 4.1Å; L982-F1049 HydrophobicContact CD2-CG 3.76Å; V990-F1049 HydrophobicContact CB-CE1 4.3Å; V990-F1049 HydrophobicContact CB-CE2 4.08Å; V990-F1049 HydrophobicContact CB-CZ 3.6Å; V990-F1049 HydrophobicContact CG1-CD2 4.43Å; V990-F1049 HydrophobicContact CG1-CE1 4.02Å; V990-F1049 HydrophobicContact CG1-CE2 3.77Å; V990-F1049 HydrophobicContact CG1-CZ 3.56Å; V990-F1049 HydrophobicContact CG2-CE2 4.24Å; V990-F1049 HydrophobicContact CG2-CZ 4.14Å; V992-F1049 HydrophobicContact CB-CD1 3.95Å; V992-F1049 HydrophobicContact CB-CE1 4.48Å; V992-F1049 HydrophobicContact CG1-CD1 3.83Å; V992-F1049 HydrophobicContact CG1-CE1 4.16Å; V992-F1049 HydrophobicContact CG2-CD1 4.43Å; V1011-F1049 HydrophobicContact CG1-CD1 3.95Å; R1012-F1049 WeakPolarHBondContact O-CA 3.41Å; I1013-F1049 HydrophobicContact CB-CE1 4.44Å; I1013-F1049 HydrophobicContact CD1-CD1 4.14Å; I1013-F1049 HydrophobicContact CD1-CE1 3.59Å; I1013-F1049 HydrophobicContact CD1-CZ 4.3Å; I1013-F1049 HydrophobicContact CG1-CD1 3.81Å; I1013-F1049 HydrophobicContact CG1-CE1 3.72Å; I1013-F1049 HydrophobicContact CG1-CZ 4.44Å; I1013-F1049 HydrophobicContact CG2-CD1 4.34Å; I1013-F1049 HydrophobicContact CG2-CE1 3.91Å; I1013-F1049 HydrophobicContact CG2-CE2 4.1Å; I1013-F1049 HydrophobicContact CG2-CZ 3.75Å; A1038-F1049 HydrophobicContact CB-CE1 3.83Å; A1038-F1049 HydrophobicContact CB-CZ 4.12Å; L1041-F1049 HydrophobicContact CD1-CZ 4.05Å; F1049-S1066 PolarHBondContact N-O 3.49Å; F1049-S1066 PolarHBondContact O-N 2.65Å; F1049-I1068 HydrophobicContact CD2-CG2 4.07Å; F1049-I1068 HydrophobicContact CE2-CG2 3.76Å
1050	M	91.7	Very high	82.5	Confident	23 Å²	23	40.8 Å²	40.8	11%	0.113	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	145	167.8	-64.4	-177.4	-54.7	0	0	109.3	V1011 R1012 F1014 T1048 W1062 S1063 A1065	V1011-M1050 CarbonylContact C-O 3.47Å; V1011-M1050 WeakPolarHBondContact CA-O 3.42Å; R1012-M1050 HydrophobicContact CG-CE 4.45Å; R1012-M1050 PolarHBondContact N-O 3.04Å; R1012-M1050 PolarHBondContact O-N 3.12Å; F1014-M1050 HydrophobicContact CE1-CE 4Å; T1048-M1050 HydrophobicContact CG2-CG 4.37Å; M1050-W1062 HydrophobicContact CB-CB 4.25Å; M1050-W1062 HydrophobicContact CB-CD2 4.4Å; M1050-W1062 HydrophobicContact CB-CE3 3.94Å; M1050-W1062 HydrophobicContact CE-CG 4.46Å; M1050-W1062 HydrophobicContact SD-CB 4.4Å; M1050-S1063 WeakPolarHBondContact CA-OG 3.38Å; M1050-S1063 WeakPolarHBondContact CG-O 3.49Å; M1050-A1065 HydrophobicContact CG-CB 4.32Å; M1050-A1065 HydrophobicContact SD-CB 4.23Å
1051	V	91.8	Very high	82.8	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	139.3	-179.1	-165.3	0	0	0	0	109.7	P977 V980 V992 W994 E1010 V1011 S1063	P977-V1051 HydrophobicContact CB-CB 4.4Å; P977-V1051 HydrophobicContact CB-CG1 4.4Å; P977-V1051 WeakPolarHBondContact CD-O 3.4Å; P977-V1051 HydrophobicContact CG-CB 4.2Å; P977-V1051 HydrophobicContact CG-CG1 3.97Å; V980-V1051 HydrophobicContact CG1-CG2 3.92Å; V980-V1051 HydrophobicContact CG2-CB 4.34Å; V980-V1051 HydrophobicContact CG2-CG2 4.16Å; V992-V1051 HydrophobicContact CG2-CG2 3.76Å; W994-V1051 HydrophobicContact CD2-CB 4.49Å; W994-V1051 HydrophobicContact CD2-CG1 3.76Å; W994-V1051 HydrophobicContact CD2-CG2 4.29Å; W994-V1051 HydrophobicContact CE3-CB 4.5Å; W994-V1051 HydrophobicContact CE3-CG1 3.99Å; W994-V1051 HydrophobicContact CE3-CG2 3.83Å; W994-V1051 HydrophobicContact CG-CG1 4.19Å; W994-V1051 HydrophobicContact CH2-CG1 4.37Å; W994-V1051 HydrophobicContact CZ2-CG1 4.16Å; W994-V1051 HydrophobicContact CZ3-CG1 4.28Å; W994-V1051 HydrophobicContact CZ3-CG2 4.23Å; E1010-V1051 CarbonylContact O-C 3.58Å; E1010-V1051 VanDerWaalsContact O-CA 3.27Å; E1010-V1051 WeakPolarHBondContact O-CA 3.38Å; E1010-V1051 WeakPolarHBondContact O-CG1 3.46Å; V1011-V1051 HydrophobicContact CG2-CG1 4.36Å; V1011-V1051 HydrophobicContact CG2-CG2 4.35Å; V1051-S1063 PolarHBondContact N-OG 3.45Å; V1051-S1063 WeakPolarHBondContact O-CB 3.23Å; V1051-S1063 PolarHBondContact O-N 3.29Å
1052	R	93.2	Very high	83.1	Confident	52 Å²	52	42.4 Å²	42.4	20%	0.196	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	146.7	168.2	66.8	-174.3	178.8	174.5	-4.7	111	Y1009 E1010 F1054 P1059 G1060 P1061 W1062	Y1009-R1052 CarbonylContact C-O 3.52Å; Y1009-R1052 WeakPolarHBondContact CA-O 3.43Å; Y1009-R1052 WeakPolarHBondContact CB-O 3.29Å; E1010-R1052 HydrophobicContact CB-CG 4.06Å; E1010-R1052 PolarHBondContact N-O 2.74Å; E1010-R1052 PolarHBondContact O-N 3.37Å; E1010-R1052 IonicContact OE2-CZ 3.62Å; E1010-R1052 IonicContact OE2-NE 3.79Å; E1010-R1052 PolarHBondContact OE2-NE 3.39Å; E1010-R1052 IonicContact OE2-NH2 2.78Å; E1010-R1052 PolarHBondContact OE2-NH2 3.25Å; R1052-F1054 HydrophobicContact CG-CD2 4.47Å; R1052-F1054 HydrophobicContact CG-CE2 3.96Å; R1052-P1059 HydrophobicContact CG-CB 4.34Å; R1052-P1059 VanDerWaalsContact CZ-CB 3.5Å; R1052-G1060 WeakPolarHBondContact CD-O 3Å; R1052-P1061 WeakPolarHBondContact CB-O 3.22Å; R1052-W1062 HydrophobicContact CB-CD2 4.15Å; R1052-W1062 HydrophobicContact CB-CE3 3.82Å; R1052-W1062 HydrophobicContact CB-CZ3 4.16Å; R1052-W1062 HydrophobicContact CG-CD2 4.08Å; R1052-W1062 HydrophobicContact CG-CE3 3.74Å; R1052-W1062 HydrophobicContact CG-CH2 3.83Å; R1052-W1062 HydrophobicContact CG-CZ2 4.2Å; R1052-W1062 HydrophobicContact CG-CZ3 3.61Å; R1052-W1062 VanDerWaalsContact CZ-CZ2 3.48Å
1053	A	88.6	Confident	83.6	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.008	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	153.3	174.1	0	0	0	0	0	110.8	P973 P977 P997 L1006 Y1009 G1060	P973-A1053 HydrophobicContact CB-CB 4.44Å; P973-A1053 HydrophobicContact CG-CB 4Å; P977-A1053 HydrophobicContact CG-CB 4.2Å; P997-A1053 HydrophobicContact CG-CB 3.72Å; L1006-A1053 HydrophobicContact CD1-CB 4.49Å; L1006-A1053 HydrophobicContact CD2-CB 4.05Å; Y1009-A1053 HydrophobicContact CD1-CB 3.72Å; Y1009-A1053 HydrophobicContact CE1-CB 3.75Å; A1053-G1060 PolarHBondContact O-N 2.95Å
1054	F	85.4	Confident	83.8	Confident	36 Å²	36	36.7 Å²	36.7	16%	0.158	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	146.4	173.4	-82.1	-111.1	0	0	0	110.6	L1006 T1007 G1008 E1010 R1052 G1058 P1059	L1006-F1054 CarbonylContact C-O 3.56Å; L1006-F1054 WeakPolarHBondContact CA-O 3.46Å; T1007-F1054 PolarHBondContact N-O 3.48Å; T1007-F1054 WeakPolarHBondContact OG1-CB 3.22Å; T1007-F1054 PolarHBondContact OG1-O 2.74Å; G1008-F1054 PolarHBondContact O-N 3.14Å; E1010-F1054 HydrophobicContact CB-CE2 3.81Å; E1010-F1054 HydrophobicContact CG-CD2 4.33Å; E1010-F1054 HydrophobicContact CG-CE2 3.43Å; E1010-F1054 VanDerWaalsContact CG-CE2 3.43Å; E1010-F1054 HydrophobicContact CG-CZ 3.89Å; E1010-F1054 WeakPolarHBondContact OE1-CZ 3.2Å; E1010-F1054 WeakPolarHBondContact OE2-CE2 3.2Å; E1010-F1054 WeakPolarHBondContact OE2-CZ 3.42Å; R1052-F1054 HydrophobicContact CG-CD2 4.47Å; R1052-F1054 HydrophobicContact CG-CE2 3.96Å; F1054-G1058 WeakPolarHBondContact CA-O 3.32Å; F1054-P1059 HydrophobicContact CD1-CB 4.24Å; F1054-P1059 HydrophobicContact CD2-CB 4.23Å; F1054-P1059 HydrophobicContact CE1-CB 3.79Å; F1054-P1059 HydrophobicContact CE1-CG 3.94Å; F1054-P1059 HydrophobicContact CE2-CB 3.73Å; F1054-P1059 HydrophobicContact CG-CB 4.46Å; F1054-P1059 HydrophobicContact CZ-CB 3.52Å; F1054-P1059 HydrophobicContact CZ-CG 3.96Å
1055	T	83.1	Confident	84.3	Confident	3 Å²	3	35 Å²	35	2%	0.018	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	-170.6	157.1	56.6	0	0	0	0	109.9	D970 A971 P973 R1002 K1005 L1006 T1007 A1057 G1058	D970-T1055 HydrophobicContact CB-CG2 4.15Å; A971-T1055 WeakPolarHBondContact O-CG2 3.43Å; A971-T1055 PolarHBondContact O-OG1 2.82Å; P973-T1055 HydrophobicContact CG-CG2 4Å; R1002-T1055 VanDerWaalsContact O-CG2 3.23Å; R1002-T1055 WeakPolarHBondContact O-CG2 3.33Å; K1005-T1055 WeakPolarHBondContact O-CA 3.18Å; L1006-T1055 HydrophobicContact CD2-CG2 3.99Å; T1007-T1055 VanDerWaalsContact OG1-C 3.22Å; T1007-T1055 PolarHBondContact OG1-O 3.5Å; T1055-A1057 PolarHBondContact O-N 2.93Å; T1055-A1057 PolarHBondContact OG1-N 3.24Å; T1055-G1058 PolarHBondContact N-O 3.32Å; T1055-G1058 VanDerWaalsContact N-O 3.12Å; T1055-G1058 PolarHBondContact O-N 3.3Å
1056	S	74.6	Confident	84.3	Confident	90 Å²	90	35 Å²	35	63%	0.629	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-22.1	172	64.1	0	0	0	0	113.4	D970	D970-S1056 VanDerWaalsContact CG-OG 3.3Å; D970-S1056 VanDerWaalsContact OD2-CB 3.25Å; D970-S1056 WeakPolarHBondContact OD2-CB 2.78Å; D970-S1056 PolarHBondContact OD2-N 3.5Å; D970-S1056 PolarHBondContact OD2-OG 3.5Å
1057	A	73.4	Confident	84.2	Confident	51 Å²	51	34.5 Å²	34.5	42%	0.421	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-8.5	179	0	0	0	0	0	115.1	D970 T1055	D970-A1057 HydrophobicContact CB-CB 4.31Å; D970-A1057 WeakPolarHBondContact O-CB 3.4Å; T1055-A1057 PolarHBondContact O-N 2.93Å; T1055-A1057 PolarHBondContact OG1-N 3.24Å
1058	G	77	Confident	83.7	Confident	12 Å²	12	35 Å²	35	12%	0.124	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	134	-168.2	168	0	0	0	0	0	116.5	F1054 T1055	F1054-G1058 WeakPolarHBondContact CA-O 3.32Å; T1055-G1058 PolarHBondContact N-O 3.32Å; T1055-G1058 VanDerWaalsContact N-O 3.12Å; T1055-G1058 PolarHBondContact O-N 3.3Å
1059	P	85	Confident	83.4	Confident	51 Å²	51	41.2 Å²	41.2	33%	0.331	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	136.5	-176.1	23.9	-27.1	0	0	0	113.7	P972 R1052 F1054	P972-P1059 WeakPolarHBondContact CB-O 3.34Å; R1052-P1059 HydrophobicContact CG-CB 4.34Å; R1052-P1059 VanDerWaalsContact CZ-CB 3.5Å; F1054-P1059 HydrophobicContact CD1-CB 4.24Å; F1054-P1059 HydrophobicContact CD2-CB 4.23Å; F1054-P1059 HydrophobicContact CE1-CB 3.79Å; F1054-P1059 HydrophobicContact CE1-CG 3.94Å; F1054-P1059 HydrophobicContact CE2-CB 3.73Å; F1054-P1059 HydrophobicContact CG-CB 4.46Å; F1054-P1059 HydrophobicContact CZ-CB 3.52Å; F1054-P1059 HydrophobicContact CZ-CG 3.96Å
1060	G	82.6	Confident	82.3	Confident	7 Å²	7	41.3 Å²	41.3	7%	0.072	25%	0.249	C	C	.	.			trans	-77.2	-175.6	161.8	0	0	0	0	0	113.1	P973 R1052 A1053	P973-G1060 WeakPolarHBondContact O-CA 2.91Å; R1052-G1060 WeakPolarHBondContact CD-O 3Å; A1053-G1060 PolarHBondContact O-N 2.95Å
1061	P	85.6	Confident	80.4	Confident	61 Å²	61	40.5 Å²	40.5	40%	0.396	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-67.1	150.1	177.6	28.9	-33.7	0	0	0	111.5	P973 S976 R1052	P973-P1061 WeakPolarHBondContact O-CD 3.3Å; S976-P1061 WeakPolarHBondContact CB-O 3.08Å; R1052-P1061 WeakPolarHBondContact CB-O 3.22Å
1062	W	90.4	Very high	78.7	Confident	65 Å²	65	44.3 Å²	44.3	25%	0.246	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-63.9	144	169.1	-67.2	110.7	0	0	0	110.7	E1010 R1012 I1025 M1050 R1052	E1010-W1062 HydrophobicContact CB-CH2 3.8Å; E1010-W1062 HydrophobicContact CB-CZ3 4.12Å; E1010-W1062 WeakPolarHBondContact O-CZ3 3.23Å; R1012-W1062 HydrophobicContact CB-CD2 4.49Å; R1012-W1062 HydrophobicContact CB-CE3 4.06Å; R1012-W1062 HydrophobicContact CB-CH2 3.5Å; R1012-W1062 VanDerWaalsContact CB-CH2 3.5Å; R1012-W1062 HydrophobicContact CB-CZ2 3.92Å; R1012-W1062 HydrophobicContact CB-CZ3 3.55Å; R1012-W1062 HydrophobicContact CG-CH2 4.5Å; R1012-W1062 HydrophobicContact CG-CZ2 4.5Å; I1025-W1062 HydrophobicContact CD1-CZ2 4.48Å; I1025-W1062 HydrophobicContact CG2-CH2 4.41Å; M1050-W1062 HydrophobicContact CB-CB 4.25Å; M1050-W1062 HydrophobicContact CB-CD2 4.4Å; M1050-W1062 HydrophobicContact CB-CE3 3.94Å; M1050-W1062 HydrophobicContact CE-CG 4.46Å; M1050-W1062 HydrophobicContact SD-CB 4.4Å; R1052-W1062 HydrophobicContact CB-CD2 4.15Å; R1052-W1062 HydrophobicContact CB-CE3 3.82Å; R1052-W1062 HydrophobicContact CB-CZ3 4.16Å; R1052-W1062 HydrophobicContact CG-CD2 4.08Å; R1052-W1062 HydrophobicContact CG-CE3 3.74Å; R1052-W1062 HydrophobicContact CG-CH2 3.83Å; R1052-W1062 HydrophobicContact CG-CZ2 4.2Å; R1052-W1062 HydrophobicContact CG-CZ3 3.61Å; R1052-W1062 VanDerWaalsContact CZ-CZ2 3.48Å
1063	S	87.4	Confident	76.9	Confident	7 Å²	7	44.5 Å²	44.5	5%	0.049	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-60.7	163	165.3	70.7	0	0	0	0	111.1	M1050 V1051	M1050-S1063 WeakPolarHBondContact CA-OG 3.38Å; M1050-S1063 WeakPolarHBondContact CG-O 3.49Å; V1051-S1063 PolarHBondContact N-OG 3.45Å; V1051-S1063 WeakPolarHBondContact O-CB 3.23Å; V1051-S1063 PolarHBondContact O-N 3.29Å
1064	G	74.1	Confident	75.5	Confident	59 Å²	59	45.6 Å²	45.6	61%	0.608	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-53.2	146.5	164.4	0	0	0	0	0	112	S1066	G1064-S1066 PolarHBondContact O-N 3.06Å; G1064-S1066 VanDerWaalsContact O-N 3.12Å
1065	A	79	Confident	74.9	Confident	61 Å²	61	44 Å²	44	50%	0.504	27%	0.268	S	S	.	.			trans	-60.6	108.8	177.3	0	0	0	0	0	111	T1048 M1050	T1048-A1065 HydrophobicContact CG2-CB 3.62Å; M1050-A1065 HydrophobicContact CG-CB 4.32Å; M1050-A1065 HydrophobicContact SD-CB 4.23Å
1066	S	77.1	Confident	74.3	Confident	25 Å²	25	45.1 Å²	45.1	18%	0.175	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	120.4	170.8	-62.5	0	0	0	0	108.2	L982 T1048 F1049 G1064	L982-S1066 WeakPolarHBondContact CD1-O 3.16Å; T1048-S1066 WeakPolarHBondContact CA-O 3.33Å; F1049-S1066 PolarHBondContact N-O 3.49Å; F1049-S1066 PolarHBondContact O-N 2.65Å; G1064-S1066 PolarHBondContact O-N 3.06Å; G1064-S1066 VanDerWaalsContact O-N 3.12Å
1067	N	83	Confident	74.6	Confident	97 Å²	97	43 Å²	43	52%	0.519	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	132.9	-177.4	-67.9	-13.2	0	0	0	110.5	T1048	T1048-N1067 WeakPolarHBondContact CA-OD1 3.39Å; T1048-N1067 WeakPolarHBondContact CB-OD1 3.43Å; T1048-N1067 WeakPolarHBondContact CG2-OD1 3.25Å; T1048-N1067 PolarHBondContact OG1-OD1 2.99Å
1068	I	77.2	Confident	75	Confident	29 Å²	29	40.9 Å²	40.9	15%	0.149	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	144.5	171.2	-165.9	168	0	0	0	110.5	L982 V990 Y1047 F1049	L982-I1068 HydrophobicContact CB-CB 4.07Å; L982-I1068 HydrophobicContact CB-CD1 3.78Å; L982-I1068 HydrophobicContact CB-CG1 4.49Å; L982-I1068 HydrophobicContact CB-CG2 4.22Å; L982-I1068 HydrophobicContact CD1-CB 3.71Å; L982-I1068 HydrophobicContact CD1-CG2 3.68Å; V990-I1068 HydrophobicContact CB-CG2 4.4Å; V990-I1068 HydrophobicContact CG1-CG2 3.82Å; V990-I1068 HydrophobicContact CG2-CG2 3.68Å; Y1047-I1068 PolarHBondContact N-O 3.28Å; Y1047-I1068 PolarHBondContact O-N 3.15Å; F1049-I1068 HydrophobicContact CD2-CG2 4.07Å; F1049-I1068 HydrophobicContact CE2-CG2 3.76Å
1069	R	80.5	Confident	75.2	Confident	136 Å²	136	43 Å²	43	51%	0.513	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	122.3	164.9	-159.2	-179.5	-172.5	171.7	4.5	108.3	K1044 T1045 F1046 S1071	K1044-R1069 PolarHBondContact O-NE 3.04Å; K1044-R1069 PolarHBondContact O-NH2 2.71Å; K1044-R1069 VanDerWaalsContact O-NH2 3.1Å; T1045-R1069 WeakPolarHBondContact O-CA 3.03Å; F1046-R1069 HydrophobicContact CD1-CB 3.82Å; F1046-R1069 HydrophobicContact CD1-CG 4.13Å; F1046-R1069 HydrophobicContact CD2-CG 4.21Å; F1046-R1069 HydrophobicContact CE1-CB 3.79Å; F1046-R1069 HydrophobicContact CE1-CG 4.11Å; F1046-R1069 HydrophobicContact CE2-CG 4.19Å; F1046-R1069 HydrophobicContact CG-CB 4.34Å; F1046-R1069 HydrophobicContact CG-CG 4.2Å; F1046-R1069 HydrophobicContact CZ-CB 4.27Å; F1046-R1069 HydrophobicContact CZ-CG 4.15Å; R1069-S1071 PolarHBondContact O-N 2.94Å
1070	T	67.2	Low	75.1	Confident	1 Å²	1	45 Å²	45	1%	0.006	26%	0.257	C	S	.	.			trans	-48.9	137	165.6	50.4	0	0	0	0	108.6	S987 V990 L1041 K1042 K1044 T1045 Y1047	S987-T1070 WeakPolarHBondContact O-CB 3.3Å; V990-T1070 HydrophobicContact CG2-CG2 4.33Å; L1041-T1070 HydrophobicContact CB-CG2 3.61Å; L1041-T1070 HydrophobicContact CD1-CG2 3.89Å; L1041-T1070 HydrophobicContact CG-CG2 4.42Å; K1042-T1070 PolarHBondContact O-OG1 2.93Å; K1044-T1070 PolarHBondContact N-OG1 3.04Å; T1045-T1070 PolarHBondContact N-OG1 2.85Å; T1045-T1070 PolarHBondContact O-N 2.8Å; T1045-T1070 PolarHBondContact O-OG1 2.75Å; T1045-T1070 VanDerWaalsContact O-OG1 3.1Å; Y1047-T1070 HydrophobicContact CD2-CG2 3.77Å; Y1047-T1070 HydrophobicContact CE2-CG2 3.92Å
1071	S	52.4	Low	75.3	Confident	6 Å²	6	45.7 Å²	45.7	4%	0.042	26%	0.259	C	S	.	.			trans	-73.2	-170.1	-171.9	61.1	0	0	0	0	111.7	S986 S987 R1069	S986-S1071 PolarHBondContact O-N 3.45Å; S986-S1071 PolarHBondContact O-OG 2.59Å; S986-S1071 VanDerWaalsContact O-OG 3.12Å; S987-S1071 WeakPolarHBondContact CA-O 3.38Å; R1069-S1071 PolarHBondContact O-N 2.94Å
1072	I	56.3	Low	75.2	Confident	81 Å²	81	48.7 Å²	48.7	42%	0.415	27%	0.268	S	S	.	.	S	Bend	trans	-75.4	158	151	-68.6	172.7	0	0	0	107.2	K1044 L1074	K1044-I1072 HydrophobicContact CG-CG1 4.39Å; I1072-L1074 PolarHBondContact O-N 3.03Å; I1072-L1074 VanDerWaalsContact O-N 3.12Å
1073	E	54	Low	74.8	Confident	55 Å²	55	46 Å²	46	26%	0.257	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-53.3	116.7	-178	-158.4	167.4	-170.4	0	0	109.5	S987 S1108 K1109 I1111	S987-E1073 WeakPolarHBondContact OG-CA 3.26Å; S987-E1073 WeakPolarHBondContact OG-CB 3.28Å; S987-E1073 WeakPolarHBondContact OG-CG 3.38Å; E1073-S1108 WeakPolarHBondContact OE1-CB 3.35Å; E1073-K1109 PolarHBondContact OE2-N 3.29Å; E1073-I1111 HydrophobicContact CB-CD1 3.73Å; E1073-I1111 HydrophobicContact CB-CG1 3.96Å; E1073-I1111 HydrophobicContact CG-CD1 3.63Å; E1073-I1111 HydrophobicContact CG-CG1 4.39Å
1074	L	60.4	Low	74.2	Confident	24 Å²	24	48.5 Å²	48.5	13%	0.126	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-64.9	143.6	179.4	-74.3	-164.4	0	0	0	108.6	L985 I1072 R1166	L985-L1074 WeakPolarHBondContact O-CD1 3.41Å; L985-L1074 WeakPolarHBondContact O-CG 3.47Å; I1072-L1074 PolarHBondContact O-N 3.03Å; I1072-L1074 VanDerWaalsContact O-N 3.12Å; L1074-R1166 HydrophobicContact CD2-CB 3.74Å; L1074-R1166 HydrophobicContact CD2-CG 4.44Å
1075	P	73	Confident	74	Confident	3 Å²	3	48 Å²	48	2%	0.019	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-60.2	139.3	-178.9	30.7	-40.1	0	0	0	110	I1111 I1113 S1160	P1075-I1111 HydrophobicContact CB-CG2 4.19Å; P1075-I1113 HydrophobicContact CB-CD1 4.46Å; P1075-I1113 HydrophobicContact CB-CG1 3.96Å; P1075-S1160 WeakPolarHBondContact CB-OG 3.49Å; P1075-S1160 WeakPolarHBondContact CG-O 3.25Å; P1075-S1160 WeakPolarHBondContact CG-OG 3.3Å; P1075-S1160 PolarHBondContact O-OG 3.25Å; P1075-S1160 VanDerWaalsContact O-OG 3.06Å
1076	P	70.9	Confident	73.5	Confident	27 Å²	27	46.9 Å²	46.9	18%	0.175	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-62.7	144.1	179.7	24.8	-34.2	0	0	0	110.9	P1098 I1113 S1160	P1076-P1098 HydrophobicContact CB-CB 4.09Å; P1076-P1098 HydrophobicContact CB-CG 4.09Å; P1076-P1098 HydrophobicContact CG-CB 3.74Å; P1076-P1098 HydrophobicContact CG-CG 3.93Å; P1076-I1113 HydrophobicContact CG-CD1 4.39Å; P1076-S1160 WeakPolarHBondContact O-CB 3.11Å; P1076-S1160 PolarHBondContact O-OG 3.24Å
1077	P	79.2	Confident	72.8	Confident	46 Å²	46	48 Å²	48	30%	0.299	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-62.3	140.2	178.8	26	-34.3	0	0	0	110.6	P1098 D1169	P1077-P1098 VanDerWaalsContact O-CG 3.24Å; P1077-P1098 WeakPolarHBondContact O-CG 3.38Å; P1077-D1169 HydrophobicContact CB-CB 4.43Å
1078	P	82.2	Confident	72	Confident	5 Å²	5	48.4 Å²	48.4	3%	0.032	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-57.3	138.3	175.3	19.3	-29.8	0	0	0	112.9	I1081 W1095 F1116 I1158	P1078-I1081 HydrophobicContact CB-CD1 4.04Å; P1078-I1081 HydrophobicContact CG-CD1 3.93Å; P1078-W1095 HydrophobicContact CB-CB 3.99Å; P1078-W1095 HydrophobicContact CB-CG 3.82Å; P1078-F1116 HydrophobicContact CB-CD1 4.1Å; P1078-F1116 HydrophobicContact CB-CE1 3.77Å; P1078-F1116 HydrophobicContact CG-CD1 3.82Å; P1078-F1116 HydrophobicContact CG-CE1 3.95Å; P1078-I1158 WeakPolarHBondContact CD-O 3.14Å; P1078-I1158 HydrophobicContact CG-CB 3.73Å; P1078-I1158 HydrophobicContact CG-CG2 3.8Å; P1078-I1158 WeakPolarHBondContact CG-O 3.23Å
1079	L	81.6	Confident	71.6	Confident	57 Å²	57	51.7 Å²	51.7	30%	0.298	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	169.7	-174.7	-64.4	169.2	0	0	0	111.5	I1081 W1095 R1096 P1098 D1102	L1079-I1081 VanDerWaalsContact C-N 3.27Å; L1079-I1081 PolarHBondContact O-N 3.2Å; L1079-I1081 VanDerWaalsContact O-N 3.11Å; L1079-W1095 CarbonylContact O-C 3.32Å; L1079-W1095 WeakPolarHBondContact O-CA 3.05Å; L1079-W1095 WeakPolarHBondContact O-CB 3.39Å; L1079-R1096 HydrophobicContact CB-CB 4.29Å; L1079-R1096 PolarHBondContact N-O 2.9Å; L1079-R1096 PolarHBondContact O-N 2.73Å; L1079-P1098 HydrophobicContact CD1-CB 4.13Å; L1079-P1098 HydrophobicContact CD1-CG 4.36Å; L1079-P1098 HydrophobicContact CG-CG 4.22Å; L1079-D1102 HydrophobicContact CD1-CB 3.63Å
1080	D	82.3	Confident	71.3	Confident	92 Å²	92	46.3 Å²	46.3	49%	0.492	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	47.6	44.8	169.2	-52.8	-30	0	0	0	114.4	Q1082 R1096	D1080-Q1082 PolarHBondContact O-N 3.22Å; D1080-R1096 HydrophobicContact CB-CB 4.17Å; D1080-R1096 IonicContact OD2-CZ 3.67Å; D1080-R1096 VanDerWaalsContact OD2-CZ 3.32Å; D1080-R1096 IonicContact OD2-NE 3.5Å; D1080-R1096 PolarHBondContact OD2-NE 3.46Å; D1080-R1096 IonicContact OD2-NH2 2.68Å; D1080-R1096 PolarHBondContact OD2-NH2 2.73Å; D1080-R1096 VanDerWaalsContact OD2-NH2 3.11Å
1081	I	87.4	Confident	72	Confident	22 Å²	22	46.2 Å²	46.2	11%	0.113	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	131.2	-175.8	-51.5	-134.9	0	0	0	109.9	P1078 L1079 V1093 T1094 W1095 I1158 S1171 V1174	P1078-I1081 HydrophobicContact CB-CD1 4.04Å; P1078-I1081 HydrophobicContact CG-CD1 3.93Å; L1079-I1081 VanDerWaalsContact C-N 3.27Å; L1079-I1081 PolarHBondContact O-N 3.2Å; L1079-I1081 VanDerWaalsContact O-N 3.11Å; I1081-V1093 HydrophobicContact CG2-CG1 3.96Å; I1081-T1094 CarbonylContact C-O 3.55Å; I1081-T1094 VanDerWaalsContact CA-O 3.31Å; I1081-T1094 WeakPolarHBondContact CA-O 3.3Å; I1081-W1095 HydrophobicContact CB-CB 4.48Å; I1081-W1095 HydrophobicContact CD1-CB 3.71Å; I1081-W1095 HydrophobicContact CD1-CG 4.4Å; I1081-W1095 HydrophobicContact CG1-CB 3.78Å; I1081-I1158 HydrophobicContact CD1-CB 3.76Å; I1081-I1158 HydrophobicContact CD1-CD1 3.68Å; I1081-I1158 HydrophobicContact CD1-CG1 3.63Å; I1081-I1158 HydrophobicContact CG2-CD1 4.4Å; I1081-S1171 WeakPolarHBondContact CD1-OG 3.41Å; I1081-V1174 HydrophobicContact CB-CG2 3.75Å; I1081-V1174 HydrophobicContact CG2-CB 4.36Å; I1081-V1174 HydrophobicContact CG2-CG2 3.64Å
1082	Q	83	Confident	73.5	Confident	124 Å²	124	48.7 Å²	48.7	58%	0.579	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-131.3	132.5	176.1	-55.8	180	6.9	0	0	108.8	D1080 V1093 T1094	D1080-Q1082 PolarHBondContact O-N 3.22Å; Q1082-V1093 WeakPolarHBondContact O-CA 2.91Å; Q1082-T1094 PolarHBondContact N-O 2.7Å; Q1082-T1094 PolarHBondContact O-N 3.3Å
1083	A	83.6	Confident	75	Confident	10 Å²	10	44.8 Å²	44.8	8%	0.083	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	92.3	177.7	0	0	0	0	0	109.5	I1091 I1156 V1174 S1176	A1083-I1091 HydrophobicContact CB-CG2 4.1Å; A1083-I1156 HydrophobicContact CB-CD1 3.74Å; A1083-V1174 HydrophobicContact CB-CB 4.28Å; A1083-V1174 HydrophobicContact CB-CG1 3.95Å; A1083-S1176 WeakPolarHBondContact O-CA 3.32Å
1084	S	74.3	Confident	76.6	Confident	59 Å²	59	43.9 Å²	43.9	41%	0.413	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	119.7	177.6	58.3	0	0	0	0	110.2	I1086 K1092	S1084-I1086 PolarHBondContact O-N 2.77Å; S1084-K1092 PolarHBondContact N-O 2.66Å; S1084-K1092 PolarHBondContact O-N 3.24Å; S1084-K1092 PolarHBondContact OG-O 3.31Å
1085	R	70.4	Confident	78.1	Confident	47 Å²	47	43.2 Å²	43.2	18%	0.177	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	125.1	170.7	-175	-177.3	-67.4	-87.9	5.9	109.2	N1087 Q1088 I1091 K1151 T1152	R1085-N1087 WeakPolarHBondContact CD-O 3.21Å; R1085-N1087 WeakPolarHBondContact CG-O 3.46Å; R1085-Q1088 PolarHBondContact NH1-O 2.98Å; R1085-I1091 HydrophobicContact CB-CG1 4.43Å; R1085-K1151 PolarHBondContact NH2-O 2.57Å; R1085-T1152 PolarHBondContact NH2-O 3.28Å
1086	I	68.2	Low	78.7	Confident	39 Å²	39	47.8 Å²	47.8	20%	0.2	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-52	175.9	-45.1	-178.2	0	0	0	109.2	S1084 Q1090 K1092 I1144	S1084-I1086 PolarHBondContact O-N 2.77Å; I1086-Q1090 HydrophobicContact CB-CB 4.15Å; I1086-Q1090 HydrophobicContact CD1-CB 4.04Å; I1086-Q1090 HydrophobicContact CG1-CB 4.25Å; I1086-Q1090 PolarHBondContact N-O 3.39Å; I1086-K1092 HydrophobicContact CD1-CB 3.77Å; I1086-K1092 HydrophobicContact CG1-CB 3.62Å; I1086-I1144 HydrophobicContact CD1-CB 4.43Å; I1086-I1144 HydrophobicContact CD1-CD1 3.71Å; I1086-I1144 HydrophobicContact CD1-CG1 3.9Å; I1086-I1144 HydrophobicContact CD1-CG2 3.71Å
1087	N	62.5	Low	79.4	Confident	47 Å²	47	49.4 Å²	49.4	25%	0.251	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	-172.5	179.3	58.4	53.5	0	0	0	108.4	R1085 H1089 Q1090	R1085-N1087 WeakPolarHBondContact CD-O 3.21Å; R1085-N1087 WeakPolarHBondContact CG-O 3.46Å; N1087-H1089 PolarHBondContact O-N 2.84Å; N1087-H1089 VanDerWaalsContact O-N 3.11Å; N1087-H1089 PolarHBondContact OD1-N 2.87Å; N1087-Q1090 PolarHBondContact N-O 3.17Å; N1087-Q1090 PolarHBondContact ND2-OE1 2.71Å; N1087-Q1090 PolarHBondContact O-N 2.76Å; N1087-Q1090 WeakPolarHBondContact OD1-CB 2.87Å; N1087-Q1090 PolarHBondContact OD1-N 2.84Å
1088	Q	64.7	Low	79.2	Confident	107 Å²	107	47.9 Å²	47.9	50%	0.5	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-24	-173.2	-61.4	-173.5	10.4	0	0	113.7	R1085 S1150	R1085-Q1088 PolarHBondContact NH1-O 2.98Å; Q1088-S1150 WeakPolarHBondContact O-CA 3.25Å
1089	H	70.2	Confident	78.5	Confident	98 Å²	98	50.7 Å²	50.7	45%	0.454	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	3	-174.8	-58.2	-66.5	0	0	0	115.1	N1087 S1146 H1147 L1148	N1087-H1089 PolarHBondContact O-N 2.84Å; N1087-H1089 VanDerWaalsContact O-N 3.11Å; N1087-H1089 PolarHBondContact OD1-N 2.87Å; H1089-S1146 CarbonylContact O-C 3.48Å; H1089-H1147 PolarHBondContact O-N 3.25Å; H1089-L1148 WeakPolarHBondContact CA-O 3.33Å; H1089-L1148 PolarHBondContact ND1-O 3.05Å; H1089-L1148 PolarHBondContact O-N 3.08Å; H1089-L1148 VanDerWaalsContact O-N 3.07Å
1090	Q	74.2	Confident	77.5	Confident	22 Å²	22	57.6 Å²	57.6	10%	0.103	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	134.1	-177.9	-71.4	171.3	-17.8	0	0	112.1	I1086 N1087 I1144 I1145 T1288	I1086-Q1090 HydrophobicContact CB-CB 4.15Å; I1086-Q1090 HydrophobicContact CD1-CB 4.04Å; I1086-Q1090 HydrophobicContact CG1-CB 4.25Å; I1086-Q1090 PolarHBondContact N-O 3.39Å; N1087-Q1090 PolarHBondContact N-O 3.17Å; N1087-Q1090 PolarHBondContact ND2-OE1 2.71Å; N1087-Q1090 PolarHBondContact O-N 2.76Å; N1087-Q1090 WeakPolarHBondContact OD1-CB 2.87Å; N1087-Q1090 PolarHBondContact OD1-N 2.84Å; Q1090-I1144 HydrophobicContact CB-CG2 4.04Å; Q1090-I1144 HydrophobicContact CG-CG2 4.13Å; Q1090-I1145 CarbonylContact C-O 3.54Å; Q1090-I1145 VanDerWaalsContact CA-O 3.26Å; Q1090-I1145 WeakPolarHBondContact CA-O 3.45Å; Q1090-T1288 PolarHBondContact OE1-O 2.98Å
1091	I	81.9	Confident	76.5	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	123.2	169.6	-63.7	165.1	0	0	0	108.5	A1083 R1085 V1093 I1144 I1145 L1148 Y1154 I1156 S1176	A1083-I1091 HydrophobicContact CB-CG2 4.1Å; R1085-I1091 HydrophobicContact CB-CG1 4.43Å; I1091-V1093 HydrophobicContact CG2-CG2 4.05Å; I1091-I1144 WeakPolarHBondContact O-CA 3.36Å; I1091-I1145 PolarHBondContact N-O 3.27Å; I1091-I1145 PolarHBondContact O-N 3.2Å; I1091-L1148 HydrophobicContact CB-CD1 3.84Å; I1091-L1148 HydrophobicContact CD1-CD1 3.43Å; I1091-L1148 VanDerWaalsContact CD1-CD1 3.43Å; I1091-L1148 HydrophobicContact CG1-CD1 3.46Å; I1091-L1148 VanDerWaalsContact CG1-CD1 3.46Å; I1091-Y1154 HydrophobicContact CD1-CD2 3.78Å; I1091-Y1154 HydrophobicContact CD1-CG 4.11Å; I1091-I1156 HydrophobicContact CD1-CD1 4.11Å; I1091-I1156 HydrophobicContact CG2-CD1 3.82Å; I1091-S1176 VanDerWaalsContact CD1-CB 3.43Å; I1091-S1176 WeakPolarHBondContact CD1-OG 3.32Å
1092	K	84.4	Confident	75.2	Confident	57 Å²	57	62.9 Å²	62.9	25%	0.248	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	124	167.4	177	-179.6	-179.4	-177.8	0	107.7	S1084 I1086 T1094 M1142	S1084-K1092 PolarHBondContact N-O 2.66Å; S1084-K1092 PolarHBondContact O-N 3.24Å; S1084-K1092 PolarHBondContact OG-O 3.31Å; I1086-K1092 HydrophobicContact CD1-CB 3.77Å; I1086-K1092 HydrophobicContact CG1-CB 3.62Å; K1092-T1094 HydrophobicContact CD-CG2 4.3Å; K1092-T1094 HydrophobicContact CG-CG2 4.06Å; K1092-M1142 HydrophobicContact CG-CE 4.38Å
1093	V	87.5	Confident	73.7	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.8	174.1	-161.7	0	0	0	0	107.5	I1081 Q1082 I1091 W1095 L1118 M1142 A1143 I1145 I1156 I1158	I1081-V1093 HydrophobicContact CG2-CG1 3.96Å; Q1082-V1093 WeakPolarHBondContact O-CA 2.91Å; I1091-V1093 HydrophobicContact CG2-CG2 4.05Å; V1093-W1095 HydrophobicContact CB-CE3 4.48Å; V1093-W1095 HydrophobicContact CB-CZ3 4.23Å; V1093-W1095 HydrophobicContact CG1-CE3 4.25Å; V1093-W1095 HydrophobicContact CG1-CZ3 4.41Å; V1093-W1095 VanDerWaalsContact O-CZ3 3.31Å; V1093-W1095 WeakPolarHBondContact O-CZ3 3.45Å; V1093-L1118 HydrophobicContact CB-CD2 4.07Å; V1093-L1118 HydrophobicContact CG2-CD2 4.03Å; V1093-M1142 CarbonylContact O-C 3.46Å; V1093-M1142 WeakPolarHBondContact O-CA 3.35Å; V1093-M1142 WeakPolarHBondContact O-CB 3.41Å; V1093-A1143 PolarHBondContact N-O 3.43Å; V1093-A1143 PolarHBondContact O-N 3.09Å; V1093-A1143 VanDerWaalsContact O-O 3.13Å; V1093-I1145 HydrophobicContact CG2-CD1 3.76Å; V1093-I1145 HydrophobicContact CG2-CG1 3.91Å; V1093-I1156 HydrophobicContact CG1-CG2 3.97Å; V1093-I1156 HydrophobicContact CG2-CD1 4.08Å; V1093-I1156 HydrophobicContact CG2-CG2 4.1Å; V1093-I1158 HydrophobicContact CG1-CD1 3.78Å
1094	T	87	Confident	71.6	Confident	36 Å²	36	64.9 Å²	64.9	22%	0.221	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	147.9	176.4	60.1	0	0	0	0	109.6	I1081 Q1082 K1092 N1141 M1142	I1081-T1094 CarbonylContact C-O 3.55Å; I1081-T1094 VanDerWaalsContact CA-O 3.31Å; I1081-T1094 WeakPolarHBondContact CA-O 3.3Å; Q1082-T1094 PolarHBondContact N-O 2.7Å; Q1082-T1094 PolarHBondContact O-N 3.3Å; K1092-T1094 HydrophobicContact CD-CG2 4.3Å; K1092-T1094 HydrophobicContact CG-CG2 4.06Å; T1094-N1141 CarbonylContact C-O 3.6Å; T1094-N1141 WeakPolarHBondContact CA-O 3.33Å; T1094-M1142 HydrophobicContact CG2-CB 3.88Å
1095	W	91.2	Very high	70	Confident	9 Å²	9	64.3 Å²	64.3	3%	0.034	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	151.2	179.4	59.6	90.8	0	0	0	110.8	P1078 L1079 I1081 V1093 F1116 L1118 V1137 V1140 N1141 M1142 A1143 I1158	P1078-W1095 HydrophobicContact CB-CB 3.99Å; P1078-W1095 HydrophobicContact CB-CG 3.82Å; L1079-W1095 CarbonylContact O-C 3.32Å; L1079-W1095 WeakPolarHBondContact O-CA 3.05Å; L1079-W1095 WeakPolarHBondContact O-CB 3.39Å; I1081-W1095 HydrophobicContact CB-CB 4.48Å; I1081-W1095 HydrophobicContact CD1-CB 3.71Å; I1081-W1095 HydrophobicContact CD1-CG 4.4Å; I1081-W1095 HydrophobicContact CG1-CB 3.78Å; V1093-W1095 HydrophobicContact CB-CE3 4.48Å; V1093-W1095 HydrophobicContact CB-CZ3 4.23Å; V1093-W1095 HydrophobicContact CG1-CE3 4.25Å; V1093-W1095 HydrophobicContact CG1-CZ3 4.41Å; V1093-W1095 VanDerWaalsContact O-CZ3 3.31Å; V1093-W1095 WeakPolarHBondContact O-CZ3 3.45Å; W1095-F1116 AromaticContact CE2-CD2 3.96Å; W1095-F1116 HydrophobicContact CZ2-CB 4.13Å; W1095-F1116 AromaticContact CZ2-CD2 3.84Å; W1095-F1116 HydrophobicContact CZ2-CD2 3.84Å; W1095-F1116 HydrophobicContact CZ2-CG 4Å; W1095-F1116 AromaticContact NE1-CD1 3.68Å; W1095-F1116 AromaticContact NE1-CD2 3.5Å; W1095-F1116 AromaticContact NE1-CE1 3.62Å; W1095-F1116 AromaticContact NE1-CE2 3.44Å; W1095-F1116 AromaticContact NE1-CG 3.65Å; W1095-F1116 AromaticContact NE1-CZ 3.5Å; W1095-L1118 HydrophobicContact CH2-CD1 3.74Å; W1095-L1118 HydrophobicContact CZ2-CD1 4.44Å; W1095-L1118 HydrophobicContact CZ3-CD1 4.15Å; W1095-L1118 HydrophobicContact CZ3-CD2 4.29Å; W1095-V1137 HydrophobicContact CH2-CG2 4.07Å; W1095-V1137 HydrophobicContact CZ2-CG2 4.04Å; W1095-V1140 WeakPolarHBondContact CZ2-O 3.09Å; W1095-V1140 PolarHBondContact NE1-O 3.13Å; W1095-N1141 PolarHBondContact N-O 3.17Å; W1095-N1141 WeakPolarHBondContact O-CA 2.83Å; W1095-N1141 VanDerWaalsContact O-CB 3.26Å; W1095-N1141 WeakPolarHBondContact O-CB 3.36Å; W1095-N1141 VanDerWaalsContact O-O 3.08Å; W1095-M1142 VanDerWaalsContact CZ3-C 3.45Å; W1095-M1142 VanDerWaalsContact CZ3-CA 3.48Å; W1095-A1143 HydrophobicContact CH2-CB 3.73Å; W1095-A1143 HydrophobicContact CZ3-CB 4.01Å; W1095-A1143 VanDerWaalsContact CZ3-N 3.35Å; W1095-I1158 HydrophobicContact CD2-CD1 3.55Å; W1095-I1158 HydrophobicContact CE3-CD1 3.13Å; W1095-I1158 HydrophobicContact CG-CD1 4.18Å; W1095-I1158 HydrophobicContact CH2-CD1 4.2Å; W1095-I1158 HydrophobicContact CZ3-CD1 3.49Å; W1095-I1158 VanDerWaalsContact CZ3-CD1 3.49Å
1096	R	87.2	Confident	68.4	Low	100 Å²	100	70 Å²	70	38%	0.377	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	125	173.8	-167.2	158.9	61.8	84.9	8.9	109.7	L1079 D1080 D1102	L1079-R1096 HydrophobicContact CB-CB 4.29Å; L1079-R1096 PolarHBondContact N-O 2.9Å; L1079-R1096 PolarHBondContact O-N 2.73Å; D1080-R1096 HydrophobicContact CB-CB 4.17Å; D1080-R1096 IonicContact OD2-CZ 3.67Å; D1080-R1096 VanDerWaalsContact OD2-CZ 3.32Å; D1080-R1096 IonicContact OD2-NE 3.5Å; D1080-R1096 PolarHBondContact OD2-NE 3.46Å; D1080-R1096 IonicContact OD2-NH2 2.68Å; D1080-R1096 PolarHBondContact OD2-NH2 2.73Å; D1080-R1096 VanDerWaalsContact OD2-NH2 3.11Å; R1096-D1102 IonicContact CZ-OD1 3.79Å; R1096-D1102 IonicContact CZ-OD2 2.77Å; R1096-D1102 IonicContact NH1-OD1 2.62Å; R1096-D1102 PolarHBondContact NH1-OD1 2.58Å; R1096-D1102 IonicContact NH1-OD2 3.79Å; R1096-D1102 PolarHBondContact NH1-OD2 2.67Å; R1096-D1102 IonicContact NH2-OD1 2.66Å; R1096-D1102 PolarHBondContact NH2-OD1 3.04Å
1097	I	84	Confident	67.3	Low	60 Å²	60	71.7 Å²	71.7	31%	0.308	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-65.6	123.9	171.3	-55.9	-174.7	0	0	0	107	T1099 I1113 F1116 P1139 N1141	I1097-T1099 PolarHBondContact O-N 3.37Å; I1097-I1113 HydrophobicContact CG2-CD1 4.23Å; I1097-F1116 HydrophobicContact CB-CZ 4.43Å; I1097-F1116 HydrophobicContact CD1-CE2 4.17Å; I1097-F1116 HydrophobicContact CD1-CZ 4.32Å; I1097-F1116 HydrophobicContact CG1-CE2 4.11Å; I1097-F1116 HydrophobicContact CG1-CZ 3.86Å; I1097-F1116 HydrophobicContact CG2-CZ 4.24Å; I1097-P1139 WeakPolarHBondContact CD1-O 2.99Å; I1097-N1141 HydrophobicContact CG1-CB 4.27Å
1098	P	75.5	Confident	66.2	Low	14 Å²	14	71.6 Å²	71.6	9%	0.091	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-62.5	121.5	-175.4	-22.7	33.9	0	0	0	110.9	P1076 P1077 L1079	P1076-P1098 HydrophobicContact CB-CB 4.09Å; P1076-P1098 HydrophobicContact CB-CG 4.09Å; P1076-P1098 HydrophobicContact CG-CB 3.74Å; P1076-P1098 HydrophobicContact CG-CG 3.93Å; P1077-P1098 VanDerWaalsContact O-CG 3.24Å; P1077-P1098 WeakPolarHBondContact O-CG 3.38Å; L1079-P1098 HydrophobicContact CD1-CB 4.13Å; L1079-P1098 HydrophobicContact CD1-CG 4.36Å; L1079-P1098 HydrophobicContact CG-CG 4.22Å
1099	T	68.6	Low	65.5	Low	64 Å²	64	72.5 Å²	72.5	39%	0.393	40%	0.395	S	S	.	.			trans	-84.7	179.2	-178.9	74	0	0	0	0	111	I1097 E1101 D1102	I1097-T1099 PolarHBondContact O-N 3.37Å; T1099-E1101 PolarHBondContact O-N 3.35Å; T1099-E1101 PolarHBondContact OG1-N 3.39Å; T1099-D1102 WeakPolarHBondContact CA-OD2 3.11Å; T1099-D1102 VanDerWaalsContact CB-OD2 3.31Å; T1099-D1102 WeakPolarHBondContact CB-OD2 2.96Å; T1099-D1102 PolarHBondContact N-OD2 2.61Å; T1099-D1102 PolarHBondContact OG1-N 2.8Å; T1099-D1102 PolarHBondContact OG1-OD2 3.43Å
1100	R	59.9	Low	64.7	Low	202 Å²	202	75.4 Å²	75.4	76%	0.762	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-18.9	176.7	-151.7	179.2	-169	-175.1	4	113.2
1101	E	61.9	Low	64	Low	176 Å²	176	75.5 Å²	75.5	82%	0.822	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-28.3	-179	-64.8	174.2	-177.1	0	0	111.9	T1099 Q1103	T1099-E1101 PolarHBondContact O-N 3.35Å; T1099-E1101 PolarHBondContact OG1-N 3.39Å; E1101-Q1103 PolarHBondContact O-N 2.84Å
1102	D	58.4	Low	63.3	Low	49 Å²	49	78.8 Å²	78.8	26%	0.262	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-23.3	173.2	-62.2	-72.2	0	0	0	113	L1079 R1096 T1099 S1104	L1079-D1102 HydrophobicContact CD1-CB 3.63Å; R1096-D1102 IonicContact CZ-OD1 3.79Å; R1096-D1102 IonicContact CZ-OD2 2.77Å; R1096-D1102 IonicContact NH1-OD1 2.62Å; R1096-D1102 PolarHBondContact NH1-OD1 2.58Å; R1096-D1102 IonicContact NH1-OD2 3.79Å; R1096-D1102 PolarHBondContact NH1-OD2 2.67Å; R1096-D1102 IonicContact NH2-OD1 2.66Å; R1096-D1102 PolarHBondContact NH2-OD1 3.04Å; T1099-D1102 WeakPolarHBondContact CA-OD2 3.11Å; T1099-D1102 VanDerWaalsContact CB-OD2 3.31Å; T1099-D1102 WeakPolarHBondContact CB-OD2 2.96Å; T1099-D1102 PolarHBondContact N-OD2 2.61Å; T1099-D1102 PolarHBondContact OG1-N 2.8Å; T1099-D1102 PolarHBondContact OG1-OD2 3.43Å; D1102-S1104 PolarHBondContact O-N 3.25Å
1103	Q	52.6	Low	62.9	Low	53 Å²	53	77.4 Å²	77.4	25%	0.248	43%	0.428	C	S	.	.			trans	-78.2	70.1	177.2	-64.8	-179	33.7	0	0	110	E1101 G1105 S1108	E1101-Q1103 PolarHBondContact O-N 2.84Å; Q1103-G1105 PolarHBondContact O-N 3.47Å; Q1103-S1108 PolarHBondContact OE1-OG 2.88Å
1104	S	39.2	Very low	62.5	Low	124 Å²	124	81.2 Å²	81.2	87%	0.867	45%	0.446	S	S	*	.			trans	-71.6	55.7	176.1	-67.8	0	0	0	0	112.3	D1102	D1102-S1104 PolarHBondContact O-N 3.25Å
1105	G	41.3	Very low	62.4	Low	47 Å²	47	79.5 Å²	79.5	49%	0.485	44%	0.436	S	S	.	.	S	Bend	trans	-148.9	118.8	177.7	0	0	0	0	0	109.7	Q1103 G1107	Q1103-G1105 PolarHBondContact O-N 3.47Å; G1105-G1107 PolarHBondContact O-N 3.28Å
1106	V	36.8	Very low	62.3	Low	167 Å²	167	79.1 Å²	79.1	100%	1.012	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	105.7	-170.7	-179.2	0	0	0	0	111.1
1107	G	44.2	Very low	62.4	Low	73 Å²	73	78 Å²	78	75%	0.753	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	128.3	1	161.9	0	0	0	0	0	118.1	G1105	G1105-G1107 PolarHBondContact O-N 3.28Å
1108	S	40	Very low	62.7	Low	46 Å²	46	75.1 Å²	75.1	32%	0.322	42%	0.416	S	S	.	.			trans	-61	145.1	-178	57	0	0	0	0	113.5	E1073 Q1103	E1073-S1108 WeakPolarHBondContact OE1-CB 3.35Å; Q1103-S1108 PolarHBondContact OE1-OG 2.88Å
1109	K	49.9	Very low	63.2	Low	125 Å²	125	75.8 Å²	75.8	54%	0.543	42%	0.418	S	S	.	.			trans	-86.1	150	172.8	-80	170.9	-176.4	161.9	0	109.7	E1043 E1073 I1111	E1043-K1109 IonicContact OE1-NZ 3.33Å; E1043-K1109 PolarHBondContact OE1-NZ 3.01Å; E1043-K1109 IonicContact OE2-NZ 2.85Å; E1073-K1109 PolarHBondContact OE2-N 3.29Å; K1109-I1111 PolarHBondContact O-N 2.83Å
1110	Q	53.7	Low	64.1	Low	160 Å²	160	74.4 Å²	74.4	75%	0.748	41%	0.406	S	S	*	.			trans	-70.6	90.9	-178.1	-174.3	176.2	-7.9	0	0	111.5	S1112	Q1110-S1112 PolarHBondContact O-N 3.49Å
1111	I	58.6	Low	65	Low	23 Å²	23	65.1 Å²	65.1	12%	0.118	37%	0.372	C	S	.	.			trans	-73.7	116.1	173.5	-49.7	129.2	0	0	0	108.3	E1073 P1075 K1109 I1113 P1163	E1073-I1111 HydrophobicContact CB-CD1 3.73Å; E1073-I1111 HydrophobicContact CB-CG1 3.96Å; E1073-I1111 HydrophobicContact CG-CD1 3.63Å; E1073-I1111 HydrophobicContact CG-CG1 4.39Å; P1075-I1111 HydrophobicContact CB-CG2 4.19Å; K1109-I1111 PolarHBondContact O-N 2.83Å; I1111-I1113 PolarHBondContact O-N 3.33Å; I1111-P1163 HydrophobicContact CG2-CG 4.49Å
1112	S	68.3	Low	65.5	Low	70 Å²	70	58.8 Å²	58.8	49%	0.49	35%	0.35	S	S	.	.			trans	-76.3	106.7	173.9	48.7	0	0	0	0	110.5	Q1110 Q1114 P1163	Q1110-S1112 PolarHBondContact O-N 3.49Å; S1112-Q1114 PolarHBondContact O-N 3.47Å; S1112-Q1114 VanDerWaalsContact O-N 3.15Å; S1112-P1163 VanDerWaalsContact O-CD 3.31Å; S1112-P1163 WeakPolarHBondContact O-CD 3.4Å
1113	I	75.1	Confident	65.5	Low	28 Å²	28	57.6 Å²	57.6	14%	0.144	34%	0.343	C	S	.	.			trans	-65.9	113.9	174	-58.1	178.9	0	0	0	108.4	P1075 P1076 I1097 I1111 G1115 F1116 P1139 R1161	P1075-I1113 HydrophobicContact CB-CD1 4.46Å; P1075-I1113 HydrophobicContact CB-CG1 3.96Å; P1076-I1113 HydrophobicContact CG-CD1 4.39Å; I1097-I1113 HydrophobicContact CG2-CD1 4.23Å; I1111-I1113 PolarHBondContact O-N 3.33Å; I1113-G1115 WeakPolarHBondContact CG2-O 3.24Å; I1113-F1116 HydrophobicContact CD1-CZ 4.46Å; I1113-F1116 HydrophobicContact CG2-CE1 3.98Å; I1113-F1116 HydrophobicContact CG2-CE2 4.03Å; I1113-F1116 HydrophobicContact CG2-CZ 3.68Å; I1113-P1139 WeakPolarHBondContact O-CB 3.07Å; I1113-R1161 CarbonylContact C-O 3.4Å; I1113-R1161 WeakPolarHBondContact CA-O 3.4Å
1114	Q	78.7	Confident	65.7	Low	79 Å²	79	59.7 Å²	59.7	37%	0.369	36%	0.356	S	S	.	.			trans	-87.8	-11.4	178.5	-79.2	-169.4	0	0	0	113.5	S1112 P1139 R1161 P1163	S1112-Q1114 PolarHBondContact O-N 3.47Å; S1112-Q1114 VanDerWaalsContact O-N 3.15Å; Q1114-P1139 WeakPolarHBondContact O-CD 3.29Å; Q1114-R1161 PolarHBondContact N-O 2.84Å; Q1114-P1163 HydrophobicContact CG-CB 4.37Å
1115	G	84.5	Confident	66.2	Low	1 Å²	1	56.3 Å²	56.3	1%	0.01	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.4	-167.6	177.6	0	0	0	0	0	113.7	I1113 V1137 G1138 R1161	I1113-G1115 WeakPolarHBondContact CG2-O 3.24Å; G1115-V1137 VanDerWaalsContact CA-O 3.29Å; G1115-V1137 WeakPolarHBondContact CA-O 3.01Å; G1115-G1138 VanDerWaalsContact CA-C 3.5Å; G1115-R1161 WeakPolarHBondContact O-CB 3.27Å; G1115-R1161 PolarHBondContact O-N 3.23Å
1116	F	89.7	Confident	66.5	Low	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	144.7	176.5	-59.5	-90	0	0	0	110.5	P1078 W1095 I1097 I1113 D1136 V1137 V1140 I1158 K1159	P1078-F1116 HydrophobicContact CB-CD1 4.1Å; P1078-F1116 HydrophobicContact CB-CE1 3.77Å; P1078-F1116 HydrophobicContact CG-CD1 3.82Å; P1078-F1116 HydrophobicContact CG-CE1 3.95Å; W1095-F1116 AromaticContact CE2-CD2 3.96Å; W1095-F1116 HydrophobicContact CZ2-CB 4.13Å; W1095-F1116 AromaticContact CZ2-CD2 3.84Å; W1095-F1116 HydrophobicContact CZ2-CD2 3.84Å; W1095-F1116 HydrophobicContact CZ2-CG 4Å; W1095-F1116 AromaticContact NE1-CD1 3.68Å; W1095-F1116 AromaticContact NE1-CD2 3.5Å; W1095-F1116 AromaticContact NE1-CE1 3.62Å; W1095-F1116 AromaticContact NE1-CE2 3.44Å; W1095-F1116 AromaticContact NE1-CG 3.65Å; W1095-F1116 AromaticContact NE1-CZ 3.5Å; I1097-F1116 HydrophobicContact CB-CZ 4.43Å; I1097-F1116 HydrophobicContact CD1-CE2 4.17Å; I1097-F1116 HydrophobicContact CD1-CZ 4.32Å; I1097-F1116 HydrophobicContact CG1-CE2 4.11Å; I1097-F1116 HydrophobicContact CG1-CZ 3.86Å; I1097-F1116 HydrophobicContact CG2-CZ 4.24Å; I1113-F1116 HydrophobicContact CD1-CZ 4.46Å; I1113-F1116 HydrophobicContact CG2-CE1 3.98Å; I1113-F1116 HydrophobicContact CG2-CE2 4.03Å; I1113-F1116 HydrophobicContact CG2-CZ 3.68Å; F1116-D1136 WeakPolarHBondContact O-CA 3.35Å; F1116-V1137 HydrophobicContact CB-CG2 3.79Å; F1116-V1137 PolarHBondContact N-O 2.93Å; F1116-V1137 WeakPolarHBondContact O-CG2 3.46Å; F1116-V1137 PolarHBondContact O-N 3.45Å; F1116-V1140 VanDerWaalsContact CD2-O 3.28Å; F1116-V1140 WeakPolarHBondContact CD2-O 3.11Å; F1116-V1140 WeakPolarHBondContact CE2-O 3.44Å; F1116-I1158 HydrophobicContact CB-CG2 3.7Å; F1116-I1158 HydrophobicContact CD1-CG2 4.13Å; F1116-I1158 HydrophobicContact CG-CG2 4.28Å; F1116-K1159 CarbonylContact C-O 3.6Å; F1116-K1159 WeakPolarHBondContact CA-O 3.34Å
1117	R	89.1	Confident	67.2	Low	77 Å²	77	56.6 Å²	56.6	29%	0.291	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	114.6	165.9	-177.4	165.4	-69.9	-165.9	-4.9	108.7	L1119 F1135 D1136 I1158 K1159 Y1167	R1117-L1119 HydrophobicContact CG-CD1 4.11Å; R1117-L1119 HydrophobicContact CG-CG 4.33Å; R1117-F1135 WeakPolarHBondContact CA-O 3.31Å; R1117-D1136 WeakPolarHBondContact CB-OD1 3.39Å; R1117-D1136 IonicContact CZ-OD1 3.96Å; R1117-D1136 IonicContact CZ-OD2 3.43Å; R1117-D1136 IonicContact NE-OD1 3.71Å; R1117-D1136 PolarHBondContact NE-OD1 3.09Å; R1117-D1136 IonicContact NE-OD2 2.7Å; R1117-D1136 IonicContact NH2-OD1 2.69Å; R1117-D1136 PolarHBondContact NH2-OD1 2.85Å; R1117-D1136 IonicContact NH2-OD2 3.5Å; R1117-D1136 PolarHBondContact NH2-OD2 3.14Å; R1117-I1158 WeakPolarHBondContact O-CA 3.33Å; R1117-I1158 WeakPolarHBondContact O-CG2 3.47Å; R1117-K1159 HydrophobicContact CB-CB 4.5Å; R1117-K1159 PolarHBondContact N-O 2.97Å; R1117-K1159 PolarHBondContact O-N 3.32Å; R1117-Y1167 HydrophobicContact CB-CD1 3.71Å; R1117-Y1167 HydrophobicContact CB-CE1 3.56Å; R1117-Y1167 PolarHBondContact NH2-OH 2.81Å
1118	L	89.9	Confident	67.5	Low	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	136.5	166.6	-79.2	79.4	0	0	0	108	V1093 W1095 S1134 F1135 V1137 A1143 I1145 I1158	V1093-L1118 HydrophobicContact CB-CD2 4.07Å; V1093-L1118 HydrophobicContact CG2-CD2 4.03Å; W1095-L1118 HydrophobicContact CH2-CD1 3.74Å; W1095-L1118 HydrophobicContact CZ2-CD1 4.44Å; W1095-L1118 HydrophobicContact CZ3-CD1 4.15Å; W1095-L1118 HydrophobicContact CZ3-CD2 4.29Å; L1118-S1134 CarbonylContact O-C 3.51Å; L1118-S1134 WeakPolarHBondContact O-CA 3.38Å; L1118-S1134 WeakPolarHBondContact O-CB 3.17Å; L1118-F1135 HydrophobicContact CB-CD1 4.23Å; L1118-F1135 HydrophobicContact CB-CE1 3.84Å; L1118-F1135 HydrophobicContact CB-CZ 4.02Å; L1118-F1135 HydrophobicContact CD1-CE2 4.42Å; L1118-F1135 HydrophobicContact CD1-CZ 4.48Å; L1118-F1135 HydrophobicContact CD2-CE1 4.29Å; L1118-F1135 HydrophobicContact CD2-CE2 4.49Å; L1118-F1135 HydrophobicContact CD2-CZ 3.82Å; L1118-F1135 HydrophobicContact CG-CZ 4.31Å; L1118-F1135 PolarHBondContact N-O 3.11Å; L1118-F1135 PolarHBondContact O-N 3.2Å; L1118-V1137 HydrophobicContact CD1-CG1 4.1Å; L1118-V1137 HydrophobicContact CD1-CG2 3.67Å; L1118-A1143 HydrophobicContact CD1-CB 4.07Å; L1118-A1143 HydrophobicContact CD2-CB 3.9Å; L1118-I1145 HydrophobicContact CD2-CD1 4.24Å; L1118-I1145 HydrophobicContact CD2-CG1 4.04Å; L1118-I1158 HydrophobicContact CD1-CD1 4.3Å; L1118-I1158 HydrophobicContact CD1-CG2 4.26Å; L1118-I1158 HydrophobicContact CD2-CD1 4.27Å; L1118-I1158 HydrophobicContact CG-CD1 3.87Å; L1118-I1158 HydrophobicContact CG-CG1 4.02Å; L1118-I1158 HydrophobicContact CG-CG2 4.34Å
1119	L	86.4	Confident	67.8	Low	27 Å²	27	59.7 Å²	59.7	14%	0.141	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	133.2	167.5	-57.4	95.8	0	0	0	107.9	R1117 W1132 T1133 I1156 C1157 K1159	R1117-L1119 HydrophobicContact CG-CD1 4.11Å; R1117-L1119 HydrophobicContact CG-CG 4.33Å; L1119-W1132 HydrophobicContact CB-CE3 3.73Å; L1119-W1132 HydrophobicContact CB-CZ3 4.42Å; L1119-W1132 HydrophobicContact CD2-CB 4.49Å; L1119-T1133 CarbonylContact C-O 3.57Å; L1119-T1133 WeakPolarHBondContact CA-O 2.97Å; L1119-I1156 CarbonylContact O-C 3.53Å; L1119-I1156 WeakPolarHBondContact O-CA 3.31Å; L1119-C1157 PolarHBondContact N-O 3.13Å; L1119-C1157 PolarHBondContact O-N 3.13Å; L1119-C1157 VanDerWaalsContact O-O 3.07Å; L1119-K1159 HydrophobicContact CD1-CD 4.05Å; L1119-K1159 HydrophobicContact CD1-CG 3.82Å
1120	Y	87.6	Confident	67.8	Low	36 Å²	36	57.2 Å²	57.2	14%	0.141	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	146.9	177.2	66.2	-79.6	0	0	0	111.5	W1132 T1133 F1135 I1145 L1148 Y1154 V1155	Y1120-W1132 VanDerWaalsContact C-CE3 3.47Å; Y1120-T1133 WeakPolarHBondContact CD1-O 3.46Å; Y1120-T1133 HydrophobicContact CE1-CG2 3.65Å; Y1120-T1133 HydrophobicContact CE2-CG2 4.14Å; Y1120-T1133 VanDerWaalsContact CZ-CG2 3.45Å; Y1120-T1133 PolarHBondContact N-O 3.48Å; Y1120-T1133 PolarHBondContact O-N 2.79Å; Y1120-T1133 WeakPolarHBondContact OH-CG2 3.31Å; Y1120-F1135 HydrophobicContact CD1-CD1 4.41Å; Y1120-F1135 HydrophobicContact CD1-CE1 4.17Å; Y1120-F1135 AromaticContact CE1-CD1 3.9Å; Y1120-F1135 HydrophobicContact CE1-CD1 3.9Å; Y1120-F1135 AromaticContact CE1-CE1 3.85Å; Y1120-F1135 HydrophobicContact CE1-CE1 3.85Å; Y1120-I1145 HydrophobicContact CD1-CD1 4.01Å; Y1120-I1145 HydrophobicContact CD1-CG2 3.93Å; Y1120-I1145 HydrophobicContact CD2-CG2 4.08Å; Y1120-I1145 HydrophobicContact CE1-CG2 3.61Å; Y1120-I1145 HydrophobicContact CE2-CG2 3.78Å; Y1120-I1145 HydrophobicContact CG-CD1 3.97Å; Y1120-I1145 HydrophobicContact CG-CG2 4.15Å; Y1120-L1148 HydrophobicContact CD2-CD2 3.8Å; Y1120-L1148 HydrophobicContact CE2-CD2 3.49Å; Y1120-L1148 VanDerWaalsContact CE2-CD2 3.49Å; Y1120-Y1154 AromaticContact CD2-CD1 3.81Å; Y1120-Y1154 HydrophobicContact CD2-CD1 3.81Å; Y1120-Y1154 HydrophobicContact CD2-CE1 4.1Å; Y1120-Y1154 HydrophobicContact CE2-CE1 4.45Å; Y1120-V1155 VanDerWaalsContact CA-O 3.31Å; Y1120-V1155 WeakPolarHBondContact CA-O 3.42Å
1121	S	78.4	Confident	67.8	Low	7 Å²	7	54.5 Å²	54.5	5%	0.049	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	147.4	170.7	-165.2	0	0	0	0	111.3	N1123 Q1131 Y1154 V1155	S1121-N1123 VanDerWaalsContact OG-CG 3.3Å; S1121-N1123 PolarHBondContact OG-N 3.12Å; S1121-N1123 VanDerWaalsContact OG-N 3.09Å; S1121-N1123 PolarHBondContact OG-OD1 3.02Å; S1121-Q1131 VanDerWaalsContact CB-O 3.3Å; S1121-Q1131 WeakPolarHBondContact CB-O 3.46Å; S1121-Q1131 PolarHBondContact OG-O 2.85Å; S1121-Y1154 VanDerWaalsContact C-CD1 3.44Å; S1121-Y1154 VanDerWaalsContact O-CA 3.32Å; S1121-Y1154 WeakPolarHBondContact O-CA 3.32Å; S1121-Y1154 WeakPolarHBondContact O-CD1 3.47Å; S1121-V1155 PolarHBondContact N-O 2.64Å; S1121-V1155 PolarHBondContact O-N 3.28Å
1122	A	72.4	Confident	68.4	Low	43 Å²	43	55.9 Å²	55.9	36%	0.355	31%	0.309	S	S	.	.	S	Bend	trans	-73.3	-16.3	165.3	0	0	0	0	0	111.6	T1152 Y1154	A1122-T1152 HydrophobicContact CB-CG2 3.73Å; A1122-Y1154 HydrophobicContact CB-CD1 4.26Å; A1122-Y1154 HydrophobicContact CB-CE1 3.71Å
1123	N	59.6	Low	68.9	Low	24 Å²	24	56.2 Å²	56.2	13%	0.128	31%	0.308	C	S	.	.	S	Bend	trans	-73.2	143.4	170.9	87.5	19.6	0	0	0	110.1	S1121 N1125 Q1131 V1155	S1121-N1123 VanDerWaalsContact OG-CG 3.3Å; S1121-N1123 PolarHBondContact OG-N 3.12Å; S1121-N1123 VanDerWaalsContact OG-N 3.09Å; S1121-N1123 PolarHBondContact OG-OD1 3.02Å; N1123-N1125 PolarHBondContact O-N 3.07Å; N1123-N1125 PolarHBondContact OD1-N 3.32Å; N1123-N1125 PolarHBondContact OD1-O 2.9Å; N1123-N1125 VanDerWaalsContact OD1-O 3.06Å; N1123-Q1131 PolarHBondContact ND2-OE1 2.81Å; N1123-V1155 WeakPolarHBondContact O-CG2 3.32Å
1124	N	55.8	Low	69.4	Low	97 Å²	97	57.5 Å²	57.5	52%	0.519	32%	0.319	S	S	.	.	S	Bend	trans	-82.5	16.9	175.1	-78	-39.5	0	0	0	112.4	P1126	N1124-P1126 WeakPolarHBondContact O-CD 3.11Å
1125	N	50.2	Low	69.5	Low	52 Å²	52	56.8 Å²	56.8	28%	0.278	32%	0.315	S	S	.	.			trans	-118.6	90.5	-171	-169	3.7	0	0	0	112.6	N1123 Y1127 E1128	N1123-N1125 PolarHBondContact O-N 3.07Å; N1123-N1125 PolarHBondContact OD1-N 3.32Å; N1123-N1125 PolarHBondContact OD1-O 2.9Å; N1123-N1125 VanDerWaalsContact OD1-O 3.06Å; N1125-Y1127 PolarHBondContact O-N 3.3Å; N1125-Y1127 PolarHBondContact OD1-N 2.84Å; N1125-E1128 PolarHBondContact ND2-OE1 2.95Å; N1125-E1128 PolarHBondContact O-N 3.07Å
1126	P	47.7	Very low	69.4	Low	46 Å²	46	59.2 Å²	59.2	30%	0.299	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	1.6	178.5	19.4	-29.5	0	0	0	117	N1124 W1132 V1155 P1173	N1124-P1126 WeakPolarHBondContact O-CD 3.11Å; P1126-W1132 HydrophobicContact CB-CZ2 4.45Å; P1126-V1155 HydrophobicContact CB-CG1 4.36Å; P1126-P1173 HydrophobicContact CB-CB 4.02Å; P1126-P1173 HydrophobicContact CB-CG 3.95Å; P1126-P1173 HydrophobicContact CG-CB 4.48Å; P1126-P1173 HydrophobicContact CG-CG 4.11Å
1127	Y	51.5	Low	69	Low	175 Å²	175	60.4 Å²	60.4	69%	0.686	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.6	-5.1	-174.5	-54.4	-72.9	0	0	0	114.9	N1125 S1129	N1125-Y1127 PolarHBondContact O-N 3.3Å; N1125-Y1127 PolarHBondContact OD1-N 2.84Å; Y1127-S1129 PolarHBondContact O-N 3.44Å
1128	E	50.5	Low	68.6	Low	56 Å²	56	57.2 Å²	57.2	26%	0.262	33%	0.326	S	S	.	.			trans	-87.4	102.4	176	-90.3	172.4	-125.7	0	0	111.9	N1125 G1130 W1132	N1125-E1128 PolarHBondContact ND2-OE1 2.95Å; N1125-E1128 PolarHBondContact O-N 3.07Å; E1128-G1130 PolarHBondContact O-N 3.36Å; E1128-W1132 PolarHBondContact O-NE1 2.67Å; E1128-W1132 VanDerWaalsContact O-NE1 3.14Å
1129	S	46.4	Very low	68.1	Low	127 Å²	127	60.2 Å²	60.2	89%	0.888	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	2.9	-172.8	61.6	0	0	0	0	116.2	Y1127	Y1127-S1129 PolarHBondContact O-N 3.44Å
1130	G	49	Very low	67.9	Low	74 Å²	74	60 Å²	60	76%	0.763	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	-5	-175.9	0	0	0	0	0	116.1	E1128	E1128-G1130 PolarHBondContact O-N 3.36Å
1131	Q	54.9	Low	67.8	Low	102 Å²	102	62.8 Å²	62.8	48%	0.477	36%	0.363	S	S	.	.	S	Bend	trans	-130.4	27.3	-168	-64.3	-178	2.3	0	0	114.2	S1121 N1123	S1121-Q1131 VanDerWaalsContact CB-O 3.3Å; S1121-Q1131 WeakPolarHBondContact CB-O 3.46Å; S1121-Q1131 PolarHBondContact OG-O 2.85Å; N1123-Q1131 PolarHBondContact ND2-OE1 2.81Å
1132	W	71.1	Confident	68.3	Low	53 Å²	53	64.5 Å²	64.5	20%	0.201	37%	0.37	C	S	.	.			trans	-104.5	113.7	-178	-73	81	0	0	0	112.4	L1119 Y1120 P1126 E1128 V1155	L1119-W1132 HydrophobicContact CB-CE3 3.73Å; L1119-W1132 HydrophobicContact CB-CZ3 4.42Å; L1119-W1132 HydrophobicContact CD2-CB 4.49Å; Y1120-W1132 VanDerWaalsContact C-CE3 3.47Å; P1126-W1132 HydrophobicContact CB-CZ2 4.45Å; E1128-W1132 PolarHBondContact O-NE1 2.67Å; E1128-W1132 VanDerWaalsContact O-NE1 3.14Å; W1132-V1155 HydrophobicContact CH2-CB 3.85Å; W1132-V1155 HydrophobicContact CH2-CG1 3.85Å; W1132-V1155 WeakPolarHBondContact CH2-O 3.35Å; W1132-V1155 VanDerWaalsContact CZ3-O 3.22Å; W1132-V1155 WeakPolarHBondContact CZ3-O 3.34Å
1133	T	78.7	Confident	68.7	Low	77 Å²	77	63 Å²	63	47%	0.472	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	140.3	167.5	-48.1	0	0	0	0	108.7	L1119 Y1120	L1119-T1133 CarbonylContact C-O 3.57Å; L1119-T1133 WeakPolarHBondContact CA-O 2.97Å; Y1120-T1133 WeakPolarHBondContact CD1-O 3.46Å; Y1120-T1133 HydrophobicContact CE1-CG2 3.65Å; Y1120-T1133 HydrophobicContact CE2-CG2 4.14Å; Y1120-T1133 VanDerWaalsContact CZ-CG2 3.45Å; Y1120-T1133 PolarHBondContact N-O 3.48Å; Y1120-T1133 PolarHBondContact O-N 2.79Å; Y1120-T1133 WeakPolarHBondContact OH-CG2 3.31Å
1134	S	84.7	Confident	69.7	Low	54 Å²	54	63 Å²	63	38%	0.378	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	153.4	-177.7	65.9	0	0	0	0	114.2	L1118	L1118-S1134 CarbonylContact O-C 3.51Å; L1118-S1134 WeakPolarHBondContact O-CA 3.38Å; L1118-S1134 WeakPolarHBondContact O-CB 3.17Å
1135	F	81.7	Confident	71	Confident	64 Å²	64	58.4 Å²	58.4	28%	0.281	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	154.2	178.3	64.6	-82.3	0	0	0	112.9	R1117 L1118 Y1120 V1137 A1143 I1145	R1117-F1135 WeakPolarHBondContact CA-O 3.31Å; L1118-F1135 HydrophobicContact CB-CD1 4.23Å; L1118-F1135 HydrophobicContact CB-CE1 3.84Å; L1118-F1135 HydrophobicContact CB-CZ 4.02Å; L1118-F1135 HydrophobicContact CD1-CE2 4.42Å; L1118-F1135 HydrophobicContact CD1-CZ 4.48Å; L1118-F1135 HydrophobicContact CD2-CE1 4.29Å; L1118-F1135 HydrophobicContact CD2-CE2 4.49Å; L1118-F1135 HydrophobicContact CD2-CZ 3.82Å; L1118-F1135 HydrophobicContact CG-CZ 4.31Å; L1118-F1135 PolarHBondContact N-O 3.11Å; L1118-F1135 PolarHBondContact O-N 3.2Å; Y1120-F1135 HydrophobicContact CD1-CD1 4.41Å; Y1120-F1135 HydrophobicContact CD1-CE1 4.17Å; Y1120-F1135 AromaticContact CE1-CD1 3.9Å; Y1120-F1135 HydrophobicContact CE1-CD1 3.9Å; Y1120-F1135 AromaticContact CE1-CE1 3.85Å; Y1120-F1135 HydrophobicContact CE1-CE1 3.85Å; F1135-V1137 HydrophobicContact CD2-CG1 3.82Å; F1135-V1137 HydrophobicContact CE2-CG1 3.59Å; F1135-A1143 HydrophobicContact CE2-CB 4.4Å; F1135-I1145 HydrophobicContact CE1-CB 4.44Å; F1135-I1145 HydrophobicContact CE1-CG1 3.94Å; F1135-I1145 HydrophobicContact CE1-CG2 4.12Å; F1135-I1145 HydrophobicContact CZ-CG1 3.95Å
1136	D	83	Confident	72.2	Confident	52 Å²	52	58 Å²	58	28%	0.278	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	114.8	-174.7	-68.4	-47.4	0	0	0	113.1	F1116 R1117 Y1167 K1226	F1116-D1136 WeakPolarHBondContact O-CA 3.35Å; R1117-D1136 WeakPolarHBondContact CB-OD1 3.39Å; R1117-D1136 IonicContact CZ-OD1 3.96Å; R1117-D1136 IonicContact CZ-OD2 3.43Å; R1117-D1136 IonicContact NE-OD1 3.71Å; R1117-D1136 PolarHBondContact NE-OD1 3.09Å; R1117-D1136 IonicContact NE-OD2 2.7Å; R1117-D1136 IonicContact NH2-OD1 2.69Å; R1117-D1136 PolarHBondContact NH2-OD1 2.85Å; R1117-D1136 IonicContact NH2-OD2 3.5Å; R1117-D1136 PolarHBondContact NH2-OD2 3.14Å; D1136-Y1167 VanDerWaalsContact OD1-CE1 3.28Å; D1136-Y1167 WeakPolarHBondContact OD1-CE1 3Å; D1136-Y1167 VanDerWaalsContact OD1-CZ 3.27Å; D1136-Y1167 PolarHBondContact OD1-OH 3.44Å; D1136-Y1167 PolarHBondContact OD2-OH 2.81Å; D1136-K1226 PolarHBondContact O-NZ 3.2Å
1137	V	81	Confident	73.1	Confident	26 Å²	26	64.1 Å²	64.1	16%	0.158	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	160.1	171.6	-59.4	0	0	0	0	111.5	W1095 G1115 F1116 L1118 F1135 V1140 A1143	W1095-V1137 HydrophobicContact CH2-CG2 4.07Å; W1095-V1137 HydrophobicContact CZ2-CG2 4.04Å; G1115-V1137 VanDerWaalsContact CA-O 3.29Å; G1115-V1137 WeakPolarHBondContact CA-O 3.01Å; F1116-V1137 HydrophobicContact CB-CG2 3.79Å; F1116-V1137 PolarHBondContact N-O 2.93Å; F1116-V1137 WeakPolarHBondContact O-CG2 3.46Å; F1116-V1137 PolarHBondContact O-N 3.45Å; L1118-V1137 HydrophobicContact CD1-CG1 4.1Å; L1118-V1137 HydrophobicContact CD1-CG2 3.67Å; F1135-V1137 HydrophobicContact CD2-CG1 3.82Å; F1135-V1137 HydrophobicContact CE2-CG1 3.59Å; V1137-V1140 HydrophobicContact CB-CG2 4.24Å; V1137-V1140 HydrophobicContact CG2-CG2 4.21Å; V1137-A1143 HydrophobicContact CG1-CB 3.96Å
1138	G	79.4	Confident	74	Confident	9 Å²	9	56 Å²	56	9%	0.093	33%	0.327	C	S	.	.			trans	-68.8	-171.4	172.2	0	0	0	0	0	112.4	G1115 V1140	G1115-G1138 VanDerWaalsContact CA-C 3.5Å; G1138-V1140 WeakPolarHBondContact O-CG2 3.41Å; G1138-V1140 PolarHBondContact O-N 3.06Å
1139	P	81	Confident	74.8	Confident	64 Å²	64	58.5 Å²	58.5	42%	0.416	34%	0.339	S	S	.	.	S	Bend	trans	-78.8	53.7	-175.3	34.2	-35.3	0	0	0	112.3	I1097 I1113 Q1114	I1097-P1139 WeakPolarHBondContact CD1-O 2.99Å; I1113-P1139 WeakPolarHBondContact O-CB 3.07Å; Q1114-P1139 WeakPolarHBondContact O-CD 3.29Å
1140	V	81.6	Confident	75.5	Confident	21 Å²	21	54.7 Å²	54.7	13%	0.127	31%	0.312	C	S	.	.			trans	-96.6	163.4	176.8	-89.6	0	0	0	0	112.4	W1095 F1116 V1137 G1138 M1142	W1095-V1140 WeakPolarHBondContact CZ2-O 3.09Å; W1095-V1140 PolarHBondContact NE1-O 3.13Å; F1116-V1140 VanDerWaalsContact CD2-O 3.28Å; F1116-V1140 WeakPolarHBondContact CD2-O 3.11Å; F1116-V1140 WeakPolarHBondContact CE2-O 3.44Å; V1137-V1140 HydrophobicContact CB-CG2 4.24Å; V1137-V1140 HydrophobicContact CG2-CG2 4.21Å; G1138-V1140 WeakPolarHBondContact O-CG2 3.41Å; G1138-V1140 PolarHBondContact O-N 3.06Å; V1140-M1142 WeakPolarHBondContact CG2-O 3.27Å
1141	N	85.8	Confident	76	Confident	95 Å²	95	58.1 Å²	58.1	51%	0.508	31%	0.306	S	S	.	.	S	Bend	trans	-96.3	3.4	174.8	62.8	-11.3	0	0	0	113.5	T1094 W1095 I1097	T1094-N1141 CarbonylContact C-O 3.6Å; T1094-N1141 WeakPolarHBondContact CA-O 3.33Å; W1095-N1141 PolarHBondContact N-O 3.17Å; W1095-N1141 WeakPolarHBondContact O-CA 2.83Å; W1095-N1141 VanDerWaalsContact O-CB 3.26Å; W1095-N1141 WeakPolarHBondContact O-CB 3.36Å; W1095-N1141 VanDerWaalsContact O-O 3.08Å; I1097-N1141 HydrophobicContact CG1-CB 4.27Å
1142	M	87.6	Confident	76.5	Confident	43 Å²	43	55.1 Å²	55.1	21%	0.212	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	158.9	174.6	65.7	164.3	-85.5	0	0	113.3	K1092 V1093 T1094 W1095 V1140 I1144	K1092-M1142 HydrophobicContact CG-CE 4.38Å; V1093-M1142 CarbonylContact O-C 3.46Å; V1093-M1142 WeakPolarHBondContact O-CA 3.35Å; V1093-M1142 WeakPolarHBondContact O-CB 3.41Å; T1094-M1142 HydrophobicContact CG2-CB 3.88Å; W1095-M1142 VanDerWaalsContact CZ3-C 3.45Å; W1095-M1142 VanDerWaalsContact CZ3-CA 3.48Å; V1140-M1142 WeakPolarHBondContact CG2-O 3.27Å; M1142-I1144 HydrophobicContact CE-CD1 4.44Å; M1142-I1144 HydrophobicContact CE-CG1 4.21Å
1143	A	81.7	Confident	76.4	Confident	11 Å²	11	54.8 Å²	54.8	9%	0.091	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	160.6	167.9	0	0	0	0	0	110.3	V1093 W1095 L1118 F1135 V1137	V1093-A1143 PolarHBondContact N-O 3.43Å; V1093-A1143 PolarHBondContact O-N 3.09Å; V1093-A1143 VanDerWaalsContact O-O 3.13Å; W1095-A1143 HydrophobicContact CH2-CB 3.73Å; W1095-A1143 HydrophobicContact CZ3-CB 4.01Å; W1095-A1143 VanDerWaalsContact CZ3-N 3.35Å; L1118-A1143 HydrophobicContact CD1-CB 4.07Å; L1118-A1143 HydrophobicContact CD2-CB 3.9Å; F1135-A1143 HydrophobicContact CE2-CB 4.4Å; V1137-A1143 HydrophobicContact CG1-CB 3.96Å
1144	I	81.2	Confident	76.5	Confident	24 Å²	24	51.8 Å²	51.8	12%	0.123	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	123	171.9	-60.9	177.1	0	0	0	107.3	I1086 Q1090 I1091 M1142 T1288	I1086-I1144 HydrophobicContact CD1-CB 4.43Å; I1086-I1144 HydrophobicContact CD1-CD1 3.71Å; I1086-I1144 HydrophobicContact CD1-CG1 3.9Å; I1086-I1144 HydrophobicContact CD1-CG2 3.71Å; Q1090-I1144 HydrophobicContact CB-CG2 4.04Å; Q1090-I1144 HydrophobicContact CG-CG2 4.13Å; I1091-I1144 WeakPolarHBondContact O-CA 3.36Å; M1142-I1144 HydrophobicContact CE-CD1 4.44Å; M1142-I1144 HydrophobicContact CE-CG1 4.21Å; I1144-T1288 HydrophobicContact CD1-CG2 3.58Å
1145	I	81.6	Confident	76.4	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	113.9	168.1	-43.8	176.6	0	0	0	106.4	Q1090 I1091 V1093 L1118 Y1120 F1135 L1148 I1156	Q1090-I1145 CarbonylContact C-O 3.54Å; Q1090-I1145 VanDerWaalsContact CA-O 3.26Å; Q1090-I1145 WeakPolarHBondContact CA-O 3.45Å; I1091-I1145 PolarHBondContact N-O 3.27Å; I1091-I1145 PolarHBondContact O-N 3.2Å; V1093-I1145 HydrophobicContact CG2-CD1 3.76Å; V1093-I1145 HydrophobicContact CG2-CG1 3.91Å; L1118-I1145 HydrophobicContact CD2-CD1 4.24Å; L1118-I1145 HydrophobicContact CD2-CG1 4.04Å; Y1120-I1145 HydrophobicContact CD1-CD1 4.01Å; Y1120-I1145 HydrophobicContact CD1-CG2 3.93Å; Y1120-I1145 HydrophobicContact CD2-CG2 4.08Å; Y1120-I1145 HydrophobicContact CE1-CG2 3.61Å; Y1120-I1145 HydrophobicContact CE2-CG2 3.78Å; Y1120-I1145 HydrophobicContact CG-CD1 3.97Å; Y1120-I1145 HydrophobicContact CG-CG2 4.15Å; F1135-I1145 HydrophobicContact CE1-CB 4.44Å; F1135-I1145 HydrophobicContact CE1-CG1 3.94Å; F1135-I1145 HydrophobicContact CE1-CG2 4.12Å; F1135-I1145 HydrophobicContact CZ-CG1 3.95Å; I1145-L1148 HydrophobicContact CB-CD1 4.14Å; I1145-L1148 HydrophobicContact CG2-CD1 4.19Å; I1145-L1148 HydrophobicContact CG2-CD2 3.72Å; I1145-L1148 HydrophobicContact CG2-CG 4.07Å; I1145-L1148 WeakPolarHBondContact O-CD1 3.43Å; I1145-I1156 HydrophobicContact CD1-CD1 3.91Å; I1145-I1156 HydrophobicContact CD1-CG1 3.91Å; I1145-I1156 HydrophobicContact CD1-CG2 4.28Å
1146	S	75.1	Confident	76.7	Confident	43 Å²	43	46.4 Å²	46.4	30%	0.301	25%	0.251	S	S	.	.			trans	-103.4	175.4	177.6	57.3	0	0	0	0	112	H1089 L1148	H1089-S1146 CarbonylContact O-C 3.48Å; S1146-L1148 PolarHBondContact O-N 3.22Å
1147	H	68	Low	76.9	Confident	175 Å²	175	44.8 Å²	44.8	81%	0.81	24%	0.244	S	C	*	.	S	Bend	trans	59.3	31	179.8	-45.8	-75	0	0	0	113.8	H1089	H1089-H1147 PolarHBondContact O-N 3.25Å
1148	L	70	Confident	77.3	Confident	5 Å²	5	43.6 Å²	43.6	3%	0.026	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-80.5	154.9	174.9	-62.1	171.1	0	0	0	111.4	H1089 I1091 Y1120 I1145 S1146 Y1154	H1089-L1148 WeakPolarHBondContact CA-O 3.33Å; H1089-L1148 PolarHBondContact ND1-O 3.05Å; H1089-L1148 PolarHBondContact O-N 3.08Å; H1089-L1148 VanDerWaalsContact O-N 3.07Å; I1091-L1148 HydrophobicContact CB-CD1 3.84Å; I1091-L1148 HydrophobicContact CD1-CD1 3.43Å; I1091-L1148 VanDerWaalsContact CD1-CD1 3.43Å; I1091-L1148 HydrophobicContact CG1-CD1 3.46Å; I1091-L1148 VanDerWaalsContact CG1-CD1 3.46Å; Y1120-L1148 HydrophobicContact CD2-CD2 3.8Å; Y1120-L1148 HydrophobicContact CE2-CD2 3.49Å; Y1120-L1148 VanDerWaalsContact CE2-CD2 3.49Å; I1145-L1148 HydrophobicContact CB-CD1 4.14Å; I1145-L1148 HydrophobicContact CG2-CD1 4.19Å; I1145-L1148 HydrophobicContact CG2-CD2 3.72Å; I1145-L1148 HydrophobicContact CG2-CG 4.07Å; I1145-L1148 WeakPolarHBondContact O-CD1 3.43Å; S1146-L1148 PolarHBondContact O-N 3.22Å; L1148-Y1154 HydrophobicContact CB-CD2 4.43Å; L1148-Y1154 HydrophobicContact CB-CE2 3.75Å; L1148-Y1154 HydrophobicContact CD1-CD2 4.26Å; L1148-Y1154 HydrophobicContact CD1-CE2 4.37Å; L1148-Y1154 HydrophobicContact CD2-CD1 3.99Å; L1148-Y1154 HydrophobicContact CD2-CD2 4.02Å; L1148-Y1154 HydrophobicContact CD2-CE1 3.72Å; L1148-Y1154 HydrophobicContact CD2-CE2 3.75Å; L1148-Y1154 HydrophobicContact CD2-CG 4.15Å; L1148-Y1154 HydrophobicContact CG-CD2 4.49Å; L1148-Y1154 HydrophobicContact CG-CE2 4.18Å
1149	E	67.5	Low	77.7	Confident	108 Å²	108	46.6 Å²	46.6	51%	0.505	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-64.2	143.5	173	-67.5	170.1	179.1	0	0	111.2	K1151 T1152 Y1154	E1149-K1151 PolarHBondContact O-N 2.96Å; E1149-T1152 VanDerWaalsContact CB-OG1 3.27Å; E1149-T1152 WeakPolarHBondContact CB-OG1 3.42Å; E1149-T1152 WeakPolarHBondContact OE2-CB 3.27Å; E1149-T1152 WeakPolarHBondContact OE2-CG2 3.39Å; E1149-T1152 PolarHBondContact OE2-OG1 2.93Å; E1149-Y1154 WeakPolarHBondContact CB-OH 3.41Å; E1149-Y1154 WeakPolarHBondContact CG-OH 3.49Å; E1149-Y1154 PolarHBondContact N-OH 2.97Å
1150	S	60.3	Low	78	Confident	47 Å²	47	43.5 Å²	43.5	33%	0.329	23%	0.227	S	C	.	.	S	Bend	trans	-62.2	131.3	176	110.6	0	0	0	0	109.3	Q1088 T1152	Q1088-S1150 WeakPolarHBondContact O-CA 3.25Å; S1150-T1152 PolarHBondContact O-N 2.81Å
1151	K	61.1	Low	78	Confident	145 Å²	145	46.3 Å²	46.3	63%	0.63	24%	0.235	S	C	*	.	S	Bend	trans	67.3	-24.1	174.7	-48.7	161.1	-168.7	163.4	0	116.2	R1085 E1149 S1153	R1085-K1151 PolarHBondContact NH2-O 2.57Å; E1149-K1151 PolarHBondContact O-N 2.96Å; K1151-S1153 PolarHBondContact O-N 3.42Å
1152	T	64.1	Low	77.3	Confident	39 Å²	39	41.8 Å²	41.8	24%	0.239	21%	0.211	C	C	.	.			trans	-53.1	122.9	176	-57.6	0	0	0	0	111.3	R1085 A1122 E1149 S1150 Y1154	R1085-T1152 PolarHBondContact NH2-O 3.28Å; A1122-T1152 HydrophobicContact CB-CG2 3.73Å; E1149-T1152 VanDerWaalsContact CB-OG1 3.27Å; E1149-T1152 WeakPolarHBondContact CB-OG1 3.42Å; E1149-T1152 WeakPolarHBondContact OE2-CB 3.27Å; E1149-T1152 WeakPolarHBondContact OE2-CG2 3.39Å; E1149-T1152 PolarHBondContact OE2-OG1 2.93Å; S1150-T1152 PolarHBondContact O-N 2.81Å; T1152-Y1154 HydrophobicContact CG2-CD2 4.46Å; T1152-Y1154 HydrophobicContact CG2-CE2 3.92Å; T1152-Y1154 WeakPolarHBondContact O-CD2 3.18Å; T1152-Y1154 VanDerWaalsContact O-CE2 3.3Å; T1152-Y1154 WeakPolarHBondContact O-CE2 3.04Å
1153	S	70	Confident	76.3	Confident	47 Å²	47	42.5 Å²	42.5	33%	0.329	22%	0.219	S	C	.	.			trans	-77	129.9	175.5	-69	0	0	0	0	109.8	K1151	K1151-S1153 PolarHBondContact O-N 3.42Å
1154	Y	79.7	Confident	75.2	Confident	14 Å²	14	45.5 Å²	45.5	6%	0.055	23%	0.233	C	C	.	.			trans	-105.3	136.3	179.2	-71.9	-92.8	0	0	0	110.8	I1091 Y1120 S1121 A1122 L1148 E1149 T1152 I1175 S1176	I1091-Y1154 HydrophobicContact CD1-CD2 3.78Å; I1091-Y1154 HydrophobicContact CD1-CG 4.11Å; Y1120-Y1154 AromaticContact CD2-CD1 3.81Å; Y1120-Y1154 HydrophobicContact CD2-CD1 3.81Å; Y1120-Y1154 HydrophobicContact CD2-CE1 4.1Å; Y1120-Y1154 HydrophobicContact CE2-CE1 4.45Å; S1121-Y1154 VanDerWaalsContact C-CD1 3.44Å; S1121-Y1154 VanDerWaalsContact O-CA 3.32Å; S1121-Y1154 WeakPolarHBondContact O-CA 3.32Å; S1121-Y1154 WeakPolarHBondContact O-CD1 3.47Å; A1122-Y1154 HydrophobicContact CB-CD1 4.26Å; A1122-Y1154 HydrophobicContact CB-CE1 3.71Å; L1148-Y1154 HydrophobicContact CB-CD2 4.43Å; L1148-Y1154 HydrophobicContact CB-CE2 3.75Å; L1148-Y1154 HydrophobicContact CD1-CD2 4.26Å; L1148-Y1154 HydrophobicContact CD1-CE2 4.37Å; L1148-Y1154 HydrophobicContact CD2-CD1 3.99Å; L1148-Y1154 HydrophobicContact CD2-CD2 4.02Å; L1148-Y1154 HydrophobicContact CD2-CE1 3.72Å; L1148-Y1154 HydrophobicContact CD2-CE2 3.75Å; L1148-Y1154 HydrophobicContact CD2-CG 4.15Å; L1148-Y1154 HydrophobicContact CG-CD2 4.49Å; L1148-Y1154 HydrophobicContact CG-CE2 4.18Å; E1149-Y1154 WeakPolarHBondContact CB-OH 3.41Å; E1149-Y1154 WeakPolarHBondContact CG-OH 3.49Å; E1149-Y1154 PolarHBondContact N-OH 2.97Å; T1152-Y1154 HydrophobicContact CG2-CD2 4.46Å; T1152-Y1154 HydrophobicContact CG2-CE2 3.92Å; T1152-Y1154 WeakPolarHBondContact O-CD2 3.18Å; T1152-Y1154 VanDerWaalsContact O-CE2 3.3Å; T1152-Y1154 WeakPolarHBondContact O-CE2 3.04Å; Y1154-I1175 WeakPolarHBondContact O-CA 3.15Å; Y1154-S1176 PolarHBondContact N-OG 2.78Å; Y1154-S1176 PolarHBondContact O-N 2.71Å; Y1154-S1176 PolarHBondContact O-OG 2.78Å
1155	V	83	Confident	74.2	Confident	4 Å²	4	45.6 Å²	45.6	2%	0.024	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	129.8	166.1	-172.4	0	0	0	0	107.7	Y1120 S1121 N1123 P1126 W1132 P1173 I1175	Y1120-V1155 VanDerWaalsContact CA-O 3.31Å; Y1120-V1155 WeakPolarHBondContact CA-O 3.42Å; S1121-V1155 PolarHBondContact N-O 2.64Å; S1121-V1155 PolarHBondContact O-N 3.28Å; N1123-V1155 WeakPolarHBondContact O-CG2 3.32Å; P1126-V1155 HydrophobicContact CB-CG1 4.36Å; W1132-V1155 HydrophobicContact CH2-CB 3.85Å; W1132-V1155 HydrophobicContact CH2-CG1 3.85Å; W1132-V1155 WeakPolarHBondContact CH2-O 3.35Å; W1132-V1155 VanDerWaalsContact CZ3-O 3.22Å; W1132-V1155 WeakPolarHBondContact CZ3-O 3.34Å; V1155-P1173 HydrophobicContact CG1-CB 3.75Å; V1155-I1175 HydrophobicContact CG2-CG1 4.26Å
1156	I	87.3	Confident	73.1	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	128.1	-171.7	-63.8	151.1	0	0	0	109.9	A1083 I1091 V1093 L1119 I1145 P1173 V1174	A1083-I1156 HydrophobicContact CB-CD1 3.74Å; I1091-I1156 HydrophobicContact CD1-CD1 4.11Å; I1091-I1156 HydrophobicContact CG2-CD1 3.82Å; V1093-I1156 HydrophobicContact CG1-CG2 3.97Å; V1093-I1156 HydrophobicContact CG2-CD1 4.08Å; V1093-I1156 HydrophobicContact CG2-CG2 4.1Å; L1119-I1156 CarbonylContact O-C 3.53Å; L1119-I1156 WeakPolarHBondContact O-CA 3.31Å; I1145-I1156 HydrophobicContact CD1-CD1 3.91Å; I1145-I1156 HydrophobicContact CD1-CG1 3.91Å; I1145-I1156 HydrophobicContact CD1-CG2 4.28Å; I1156-P1173 CarbonylContact O-C 3.57Å; I1156-P1173 WeakPolarHBondContact O-CA 3.37Å; I1156-V1174 PolarHBondContact N-O 3.47Å; I1156-V1174 PolarHBondContact O-N 2.97Å
1157	C	87.7	Confident	73.1	Confident	19 Å²	19	51.9 Å²	51.9	13%	0.128	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	155.8	167.7	83.4	0	0	0	0	110.6	L1119 C1170 S1171 P1173	L1119-C1157 PolarHBondContact N-O 3.13Å; L1119-C1157 PolarHBondContact O-N 3.13Å; L1119-C1157 VanDerWaalsContact O-O 3.07Å; C1157-C1170 HydrophobicContact CB-CB 3.85Å; C1157-C1170 WeakPolarHBondContact CB-SG 3.27Å; C1157-C1170 WeakPolarHBondContact SG-CB 3.21Å; C1157-C1170 CovalentContact SG-SG 2.04Å; C1157-C1170 PolarHBondContact SG-SG 3.45Å; C1157-S1171 WeakPolarHBondContact CA-OG 3.26Å; C1157-P1173 HydrophobicContact CB-CB 4.28Å
1158	I	89.2	Confident	73.3	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	133.4	-174.8	-45.6	-171.6	0	0	0	110.7	P1078 I1081 V1093 W1095 F1116 R1117 L1118 C1170 S1171	P1078-I1158 WeakPolarHBondContact CD-O 3.14Å; P1078-I1158 HydrophobicContact CG-CB 3.73Å; P1078-I1158 HydrophobicContact CG-CG2 3.8Å; P1078-I1158 WeakPolarHBondContact CG-O 3.23Å; I1081-I1158 HydrophobicContact CD1-CB 3.76Å; I1081-I1158 HydrophobicContact CD1-CD1 3.68Å; I1081-I1158 HydrophobicContact CD1-CG1 3.63Å; I1081-I1158 HydrophobicContact CG2-CD1 4.4Å; V1093-I1158 HydrophobicContact CG1-CD1 3.78Å; W1095-I1158 HydrophobicContact CD2-CD1 3.55Å; W1095-I1158 HydrophobicContact CE3-CD1 3.13Å; W1095-I1158 HydrophobicContact CG-CD1 4.18Å; W1095-I1158 HydrophobicContact CH2-CD1 4.2Å; W1095-I1158 HydrophobicContact CZ3-CD1 3.49Å; W1095-I1158 VanDerWaalsContact CZ3-CD1 3.49Å; F1116-I1158 HydrophobicContact CB-CG2 3.7Å; F1116-I1158 HydrophobicContact CD1-CG2 4.13Å; F1116-I1158 HydrophobicContact CG-CG2 4.28Å; R1117-I1158 WeakPolarHBondContact O-CA 3.33Å; R1117-I1158 WeakPolarHBondContact O-CG2 3.47Å; L1118-I1158 HydrophobicContact CD1-CD1 4.3Å; L1118-I1158 HydrophobicContact CD1-CG2 4.26Å; L1118-I1158 HydrophobicContact CD2-CD1 4.27Å; L1118-I1158 HydrophobicContact CG-CD1 3.87Å; L1118-I1158 HydrophobicContact CG-CG1 4.02Å; L1118-I1158 HydrophobicContact CG-CG2 4.34Å; I1158-C1170 PolarHBondContact N-SG 2.96Å; I1158-C1170 VanDerWaalsContact N-SG 3.4Å; I1158-C1170 WeakPolarHBondContact O-CA 3.42Å; I1158-S1171 PolarHBondContact N-OG 2.9Å; I1158-S1171 PolarHBondContact O-N 2.78Å
1159	K	87.9	Confident	73.5	Confident	72 Å²	72	47.7 Å²	47.7	31%	0.313	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	134.7	171.2	-57.4	-173.4	174.4	-161.3	0	109.7	F1116 R1117 L1119 Y1167 G1168 D1169 C1170	F1116-K1159 CarbonylContact C-O 3.6Å; F1116-K1159 WeakPolarHBondContact CA-O 3.34Å; R1117-K1159 HydrophobicContact CB-CB 4.5Å; R1117-K1159 PolarHBondContact N-O 2.97Å; R1117-K1159 PolarHBondContact O-N 3.32Å; L1119-K1159 HydrophobicContact CD1-CD 4.05Å; L1119-K1159 HydrophobicContact CD1-CG 3.82Å; K1159-Y1167 HydrophobicContact CB-CD1 4.42Å; K1159-G1168 WeakPolarHBondContact CD-O 3.4Å; K1159-G1168 WeakPolarHBondContact CG-O 3.34Å; K1159-D1169 WeakPolarHBondContact CA-O 3.5Å; K1159-C1170 HydrophobicContact CG-CB 4.09Å; K1159-C1170 VanDerWaalsContact CG-SG 3.6Å
1160	S	87.1	Confident	73.8	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	155.9	168.1	47.5	0	0	0	0	111	P1075 P1076 Y1167 G1168	P1075-S1160 WeakPolarHBondContact CB-OG 3.49Å; P1075-S1160 WeakPolarHBondContact CG-O 3.25Å; P1075-S1160 WeakPolarHBondContact CG-OG 3.3Å; P1075-S1160 PolarHBondContact O-OG 3.25Å; P1075-S1160 VanDerWaalsContact O-OG 3.06Å; P1076-S1160 WeakPolarHBondContact O-CB 3.11Å; P1076-S1160 PolarHBondContact O-OG 3.24Å; S1160-Y1167 CarbonylContact O-C 3.57Å; S1160-Y1167 WeakPolarHBondContact O-CA 3.27Å; S1160-G1168 PolarHBondContact O-N 2.83Å
1161	R	81.9	Confident	74.9	Confident	80 Å²	80	42.7 Å²	42.7	30%	0.302	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126	179.3	179.4	-178.2	161.3	139.9	-7.9	110.5	I1113 Q1114 G1115 R1166 Y1167	I1113-R1161 CarbonylContact C-O 3.4Å; I1113-R1161 WeakPolarHBondContact CA-O 3.4Å; Q1114-R1161 PolarHBondContact N-O 2.84Å; G1115-R1161 WeakPolarHBondContact O-CB 3.27Å; G1115-R1161 PolarHBondContact O-N 3.23Å; R1161-R1166 CarbonylContact C-O 3.6Å; R1161-R1166 WeakPolarHBondContact CA-O 3.13Å; R1161-Y1167 HydrophobicContact CB-CD1 3.86Å; R1161-Y1167 HydrophobicContact CB-CE1 3.69Å; R1161-Y1167 HydrophobicContact CG-CD1 4.32Å; R1161-Y1167 HydrophobicContact CG-CE1 3.91Å; R1161-Y1167 PolarHBondContact NH1-OH 2.94Å; R1161-Y1167 VanDerWaalsContact NH1-OH 3.12Å
1162	G	71.7	Confident	75.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.225	C	C	.	.			trans	-80.3	173.6	-179.2	0	0	0	0	0	113	D1164 G1165 R1166	G1162-D1164 PolarHBondContact O-N 3.04Å; G1162-G1165 PolarHBondContact O-N 2.88Å; G1162-G1165 VanDerWaalsContact O-N 3.08Å; G1162-R1166 PolarHBondContact N-O 3.45Å
1163	P	66	Low	76.5	Confident	58 Å²	58	43.8 Å²	43.8	38%	0.377	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-13	180	31.4	-32.9	0	0	0	113.4	I1111 S1112 Q1114 G1165	I1111-P1163 HydrophobicContact CG2-CG 4.49Å; S1112-P1163 VanDerWaalsContact O-CD 3.31Å; S1112-P1163 WeakPolarHBondContact O-CD 3.4Å; Q1114-P1163 HydrophobicContact CG-CB 4.37Å; P1163-G1165 VanDerWaalsContact C-N 3.32Å
1164	D	59	Low	77	Confident	73 Å²	73	43.2 Å²	43.2	39%	0.39	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	6.3	170.3	70.9	-19.2	0	0	0	112.9	G1162 R1166	G1162-D1164 PolarHBondContact O-N 3.04Å; D1164-R1166 VanDerWaalsContact C-N 3.26Å; D1164-R1166 PolarHBondContact O-N 3.01Å; D1164-R1166 WeakPolarHBondContact OD1-CB 3.47Å; D1164-R1166 PolarHBondContact OD1-N 3.31Å; D1164-R1166 VanDerWaalsContact OD1-N 3.1Å; D1164-R1166 WeakPolarHBondContact OD2-CD 3.43Å; D1164-R1166 VanDerWaalsContact OD2-CG 3.25Å; D1164-R1166 WeakPolarHBondContact OD2-CG 3.38Å; D1164-R1166 IonicContact OD2-NE 3.13Å; D1164-R1166 PolarHBondContact OD2-NE 2.74Å
1165	G	61.2	Low	76.8	Confident	26 Å²	26	46 Å²	46	27%	0.268	24%	0.236	S	C	.	.	S	Bend	trans	77.3	-1.3	-178.8	0	0	0	0	0	115.5	G1162 P1163	G1162-G1165 PolarHBondContact O-N 2.88Å; G1162-G1165 VanDerWaalsContact O-N 3.08Å; P1163-G1165 VanDerWaalsContact C-N 3.32Å
1166	R	57.6	Low	76.3	Confident	124 Å²	124	45.9 Å²	45.9	47%	0.468	24%	0.235	S	C	.	.			trans	-72.7	153.9	175.2	-63.9	-177.2	-164.4	-127.4	-8.7	111.2	L1074 R1161 G1162 D1164	L1074-R1166 HydrophobicContact CD2-CB 3.74Å; L1074-R1166 HydrophobicContact CD2-CG 4.44Å; R1161-R1166 CarbonylContact C-O 3.6Å; R1161-R1166 WeakPolarHBondContact CA-O 3.13Å; G1162-R1166 PolarHBondContact N-O 3.45Å; D1164-R1166 VanDerWaalsContact C-N 3.26Å; D1164-R1166 PolarHBondContact O-N 3.01Å; D1164-R1166 WeakPolarHBondContact OD1-CB 3.47Å; D1164-R1166 PolarHBondContact OD1-N 3.31Å; D1164-R1166 VanDerWaalsContact OD1-N 3.1Å; D1164-R1166 WeakPolarHBondContact OD2-CD 3.43Å; D1164-R1166 VanDerWaalsContact OD2-CG 3.25Å; D1164-R1166 WeakPolarHBondContact OD2-CG 3.38Å; D1164-R1166 IonicContact OD2-NE 3.13Å; D1164-R1166 PolarHBondContact OD2-NE 2.74Å
1167	Y	75	Confident	74.7	Confident	53 Å²	53	55.5 Å²	55.5	21%	0.208	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	136.9	174.5	-63.3	-89.5	0	0	0	110.5	R1117 D1136 K1159 S1160 R1161	R1117-Y1167 HydrophobicContact CB-CD1 3.71Å; R1117-Y1167 HydrophobicContact CB-CE1 3.56Å; R1117-Y1167 PolarHBondContact NH2-OH 2.81Å; D1136-Y1167 VanDerWaalsContact OD1-CE1 3.28Å; D1136-Y1167 WeakPolarHBondContact OD1-CE1 3Å; D1136-Y1167 VanDerWaalsContact OD1-CZ 3.27Å; D1136-Y1167 PolarHBondContact OD1-OH 3.44Å; D1136-Y1167 PolarHBondContact OD2-OH 2.81Å; K1159-Y1167 HydrophobicContact CB-CD1 4.42Å; S1160-Y1167 CarbonylContact O-C 3.57Å; S1160-Y1167 WeakPolarHBondContact O-CA 3.27Å; R1161-Y1167 HydrophobicContact CB-CD1 3.86Å; R1161-Y1167 HydrophobicContact CB-CE1 3.69Å; R1161-Y1167 HydrophobicContact CG-CD1 4.32Å; R1161-Y1167 HydrophobicContact CG-CE1 3.91Å; R1161-Y1167 PolarHBondContact NH1-OH 2.94Å; R1161-Y1167 VanDerWaalsContact NH1-OH 3.12Å
1168	G	72.5	Confident	72.8	Confident	3 Å²	3	60.5 Å²	60.5	3%	0.031	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	-170.3	172.8	0	0	0	0	0	113.2	K1159 S1160	K1159-G1168 WeakPolarHBondContact CD-O 3.4Å; K1159-G1168 WeakPolarHBondContact CG-O 3.34Å; S1160-G1168 PolarHBondContact O-N 2.83Å
1169	D	73.2	Confident	70.6	Confident	89 Å²	89	65.6 Å²	65.6	48%	0.476	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	157.7	175.2	-72.1	-40	0	0	0	112.1	P1077 K1159	P1077-D1169 HydrophobicContact CB-CB 4.43Å; K1159-D1169 WeakPolarHBondContact CA-O 3.5Å
1170	C	75.2	Confident	68	Low	38 Å²	38	67.9 Å²	67.9	26%	0.257	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	145.9	167.9	-122.5	0	0	0	0	110.3	C1157 I1158 K1159	C1157-C1170 HydrophobicContact CB-CB 3.85Å; C1157-C1170 WeakPolarHBondContact CB-SG 3.27Å; C1157-C1170 WeakPolarHBondContact SG-CB 3.21Å; C1157-C1170 CovalentContact SG-SG 2.04Å; C1157-C1170 PolarHBondContact SG-SG 3.45Å; I1158-C1170 PolarHBondContact N-SG 2.96Å; I1158-C1170 VanDerWaalsContact N-SG 3.4Å; I1158-C1170 WeakPolarHBondContact O-CA 3.42Å; K1159-C1170 HydrophobicContact CG-CB 4.09Å; K1159-C1170 VanDerWaalsContact CG-SG 3.6Å
1171	S	83.6	Confident	65.3	Low	13 Å²	13	71.1 Å²	71.1	9%	0.091	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-52.5	168.2	161.9	68.5	0	0	0	0	112.5	I1081 C1157 I1158	I1081-S1171 WeakPolarHBondContact CD1-OG 3.41Å; C1157-S1171 WeakPolarHBondContact CA-OG 3.26Å; I1158-S1171 PolarHBondContact N-OG 2.9Å; I1158-S1171 PolarHBondContact O-N 2.78Å
1172	Q	77.3	Confident	62.7	Low	163 Å²	163	75.6 Å²	75.6	76%	0.762	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-47.5	132.2	155.2	-84	-75.5	-23.6	0	0	109.8
1173	P	80.8	Confident	60.9	Low	44 Å²	44	78.9 Å²	78.9	29%	0.286	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-74.7	129.6	176.9	28.9	-32.7	0	0	0	110.4	P1126 V1155 I1156 C1157	P1126-P1173 HydrophobicContact CB-CB 4.02Å; P1126-P1173 HydrophobicContact CB-CG 3.95Å; P1126-P1173 HydrophobicContact CG-CB 4.48Å; P1126-P1173 HydrophobicContact CG-CG 4.11Å; V1155-P1173 HydrophobicContact CG1-CB 3.75Å; I1156-P1173 CarbonylContact O-C 3.57Å; I1156-P1173 WeakPolarHBondContact O-CA 3.37Å; C1157-P1173 HydrophobicContact CB-CB 4.28Å
1174	V	80.4	Confident	59.5	Low	34 Å²	34	83 Å²	83	21%	0.206	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	126.3	-175.8	-169.2	0	0	0	0	109.4	I1081 A1083 I1156	I1081-V1174 HydrophobicContact CB-CG2 3.75Å; I1081-V1174 HydrophobicContact CG2-CB 4.36Å; I1081-V1174 HydrophobicContact CG2-CG2 3.64Å; A1083-V1174 HydrophobicContact CB-CB 4.28Å; A1083-V1174 HydrophobicContact CB-CG1 3.95Å; I1156-V1174 PolarHBondContact N-O 3.47Å; I1156-V1174 PolarHBondContact O-N 2.97Å
1175	I	76.2	Confident	58.9	Low	74 Å²	74	81.4 Å²	81.4	38%	0.379	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	134.4	174.8	-47.5	-175	0	0	0	108.9	Y1154 V1155 R1177	Y1154-I1175 WeakPolarHBondContact O-CA 3.15Å; V1155-I1175 HydrophobicContact CG2-CG1 4.26Å; I1175-R1177 VanDerWaalsContact C-N 3.32Å; I1175-R1177 PolarHBondContact O-N 2.72Å
1176	S	71.1	Confident	58.2	Low	0 Å²	0	82.7 Å²	82.7	0%	0	47%	0.47	C	S	.	.			trans	-71.5	80.3	175.8	68.4	0	0	0	0	112.6	A1083 I1091 Y1154	A1083-S1176 WeakPolarHBondContact O-CA 3.32Å; I1091-S1176 VanDerWaalsContact CD1-CB 3.43Å; I1091-S1176 WeakPolarHBondContact CD1-OG 3.32Å; Y1154-S1176 PolarHBondContact N-OG 2.78Å; Y1154-S1176 PolarHBondContact O-N 2.71Å; Y1154-S1176 PolarHBondContact O-OG 2.78Å
1177	R	55.2	Low	58.1	Low	202 Å²	202	80.1 Å²	80.1	76%	0.762	46%	0.463	S	S	*	.			trans	-68.5	143.5	-179.1	-62.3	-178.7	-175.8	177.7	1.5	111.3	I1175	I1175-R1177 VanDerWaalsContact C-N 3.32Å; I1175-R1177 PolarHBondContact O-N 2.72Å
1178	L	47.4	Very low	57.2	Low	124 Å²	124	78.8 Å²	78.8	65%	0.649	46%	0.461	S	S	*	.			trans	-65.7	146.1	158.7	-91	71	0	0	0	109	S1180	L1178-S1180 PolarHBondContact O-N 3.12Å; L1178-S1180 VanDerWaalsContact O-N 3.13Å
1179	A	43.2	Very low	56.8	Low	108 Å²	108	78.7 Å²	78.7	89%	0.893	46%	0.46	S	S	*	.			trans	-67.7	108.7	169.7	0	0	0	0	0	109.2
1180	S	32.1	Very low	56.2	Low	119 Å²	119	78.1 Å²	78.1	83%	0.832	45%	0.451	S	S	*	.			trans	-88.3	121	-175.6	56.5	0	0	0	0	112	L1178	L1178-S1180 PolarHBondContact O-N 3.12Å; L1178-S1180 VanDerWaalsContact O-N 3.13Å
1181	G	29.9	Very low	55.8	Low	68 Å²	68	77.6 Å²	77.6	70%	0.701	45%	0.452	S	S	*	.	S	Bend	trans	110.6	119.8	165.7	0	0	0	0	0	114.7
1182	N	28.3	Very low	55.6	Low	174 Å²	174	77.5 Å²	77.5	93%	0.93	45%	0.45	S	S	*	.	S	Bend	trans	50.8	91.5	159	-59.6	-7.7	0	0	0	117.4
1183	G	34.8	Very low	55.4	Low	69 Å²	69	76.1 Å²	76.1	71%	0.711	44%	0.442	S	S	*	.			trans	96.5	82.3	165.4	0	0	0	0	0	114	S1185	G1183-S1185 PolarHBondContact O-N 3.27Å
1184	E	36.1	Very low	55.4	Low	146 Å²	146	75.4 Å²	75.4	68%	0.682	44%	0.438	S	S	*	.			trans	-60.2	94.5	149.9	-179.6	-175.9	-86.9	0	0	106.3	D1186 R1190	E1184-D1186 PolarHBondContact O-N 2.91Å; E1184-R1190 IonicContact OE2-CZ 2.78Å; E1184-R1190 VanDerWaalsContact OE2-CZ 3.29Å; E1184-R1190 IonicContact OE2-NH1 2.96Å; E1184-R1190 PolarHBondContact OE2-NH1 3.01Å; E1184-R1190 VanDerWaalsContact OE2-NH1 3.08Å; E1184-R1190 IonicContact OE2-NH2 3.42Å; E1184-R1190 PolarHBondContact OE2-NH2 3.26Å
1185	S	45.3	Very low	55.3	Low	38 Å²	38	77.2 Å²	77.2	27%	0.266	45%	0.452	S	S	.	.			trans	-53.6	125	-158.9	60.3	0	0	0	0	111.8	G1183 F1187 S1188	G1183-S1185 PolarHBondContact O-N 3.27Å; S1185-F1187 PolarHBondContact O-N 2.86Å; S1185-S1188 WeakPolarHBondContact O-CB 3.43Å; S1185-S1188 PolarHBondContact O-N 2.9Å
1186	D	47.6	Very low	55.1	Low	54 Å²	54	74.6 Å²	74.6	29%	0.289	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-12.7	-176.7	-58.7	-70.3	0	0	0	114	E1184 P1208 K1209 R1210	E1184-D1186 PolarHBondContact O-N 2.91Å; D1186-P1208 CarbonylContact O-C 3.29Å; D1186-P1208 WeakPolarHBondContact O-CB 3.27Å; D1186-K1209 PolarHBondContact O-N 3.15Å; D1186-K1209 VanDerWaalsContact O-N 3.07Å; D1186-R1210 HydrophobicContact CB-CB 3.65Å; D1186-R1210 HydrophobicContact CB-CG 3.61Å; D1186-R1210 PolarHBondContact O-N 2.73Å; D1186-R1210 WeakPolarHBondContact OD2-CD 3.1Å; D1186-R1210 IonicContact OD2-CZ 3.32Å; D1186-R1210 IonicContact OD2-NE 2.65Å; D1186-R1210 IonicContact OD2-NH1 3.11Å; D1186-R1210 PolarHBondContact OD2-NH1 2.87Å
1187	F	54.3	Low	55.4	Low	70 Å²	70	76.4 Å²	76.4	31%	0.307	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-3.6	176.7	-50.5	-63.7	0	0	0	114.1	S1185 V1189 P1208 R1210 T1211 Y1276 M1282 S1284	S1185-F1187 PolarHBondContact O-N 2.86Å; F1187-V1189 PolarHBondContact O-N 2.82Å; F1187-P1208 WeakPolarHBondContact O-CG 3.13Å; F1187-R1210 HydrophobicContact CE1-CB 4.34Å; F1187-T1211 HydrophobicContact CD1-CG2 4.17Å; F1187-Y1276 HydrophobicContact CD1-CE1 4.31Å; F1187-Y1276 AromaticContact CD1-CZ 3.83Å; F1187-Y1276 WeakPolarHBondContact CD1-OH 3.22Å; F1187-M1282 HydrophobicContact CD1-CE 4.41Å; F1187-M1282 HydrophobicContact CD2-CE 3.97Å; F1187-M1282 HydrophobicContact CE1-CE 4.11Å; F1187-M1282 HydrophobicContact CE2-CE 3.63Å; F1187-M1282 HydrophobicContact CG-CE 4.35Å; F1187-M1282 HydrophobicContact CZ-CE 3.71Å; F1187-S1284 WeakPolarHBondContact O-CB 3.47Å
1188	S	56.6	Low	56.2	Low	25 Å²	25	67.1 Å²	67.1	18%	0.175	42%	0.419	C	S	.	.			trans	-70.4	129.7	179.4	-168.8	0	0	0	0	111.7	S1185 P1208	S1185-S1188 WeakPolarHBondContact O-CB 3.43Å; S1185-S1188 PolarHBondContact O-N 2.9Å; S1188-P1208 WeakPolarHBondContact O-CB 3.29Å; S1188-P1208 WeakPolarHBondContact O-CG 3.42Å
1189	V	64.2	Low	57.7	Low	1 Å²	1	63.2 Å²	63.2	1%	0.006	40%	0.4	C	S	.	.			trans	-45.3	143.9	161.3	-173.2	0	0	0	0	108.7	F1187 L1192 W1205 L1272 S1284 E1287	F1187-V1189 PolarHBondContact O-N 2.82Å; V1189-L1192 HydrophobicContact CG1-CB 4.46Å; V1189-W1205 HydrophobicContact CB-CE3 4.35Å; V1189-W1205 HydrophobicContact CB-CZ3 4.3Å; V1189-W1205 HydrophobicContact CG1-CB 4.32Å; V1189-W1205 HydrophobicContact CG1-CD2 4.18Å; V1189-W1205 HydrophobicContact CG1-CE3 3.45Å; V1189-W1205 VanDerWaalsContact CG1-CE3 3.45Å; V1189-W1205 HydrophobicContact CG1-CZ3 3.86Å; V1189-W1205 HydrophobicContact CG2-CE3 4.48Å; V1189-W1205 HydrophobicContact CG2-CZ3 4.07Å; V1189-L1272 HydrophobicContact CG1-CD2 4.01Å; V1189-L1272 HydrophobicContact CG2-CD2 3.85Å; V1189-S1284 WeakPolarHBondContact CG2-OG 3.41Å; V1189-E1287 VanDerWaalsContact C-OE2 3.28Å; V1189-E1287 HydrophobicContact CB-CB 4.19Å; V1189-E1287 HydrophobicContact CB-CG 3.92Å; V1189-E1287 WeakPolarHBondContact CB-OE2 3.23Å; V1189-E1287 HydrophobicContact CG1-CB 4.26Å; V1189-E1287 HydrophobicContact CG1-CG 4.31Å; V1189-E1287 WeakPolarHBondContact CG1-OE2 3.33Å; V1189-E1287 VanDerWaalsContact O-CD 3.24Å
1190	R	61.4	Low	59.6	Low	76 Å²	76	58.8 Å²	58.8	29%	0.287	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	153.6	172.2	-63	-173.4	-176.3	-116.1	-6.8	109.7	E1184 L1192 Q1206 E1287	E1184-R1190 IonicContact OE2-CZ 2.78Å; E1184-R1190 VanDerWaalsContact OE2-CZ 3.29Å; E1184-R1190 IonicContact OE2-NH1 2.96Å; E1184-R1190 PolarHBondContact OE2-NH1 3.01Å; E1184-R1190 VanDerWaalsContact OE2-NH1 3.08Å; E1184-R1190 IonicContact OE2-NH2 3.42Å; E1184-R1190 PolarHBondContact OE2-NH2 3.26Å; R1190-L1192 VanDerWaalsContact C-N 3.31Å; R1190-L1192 PolarHBondContact O-N 3.36Å; R1190-Q1206 HydrophobicContact CB-CB 4.36Å; R1190-Q1206 PolarHBondContact N-O 3.32Å; R1190-Q1206 WeakPolarHBondContact O-CA 3.49Å; R1190-Q1206 WeakPolarHBondContact O-CB 3.45Å; R1190-Q1206 PolarHBondContact O-N 2.82Å; R1190-E1287 PolarHBondContact N-OE2 3.07Å
1191	G	66	Low	61.9	Low	27 Å²	27	53.1 Å²	53.1	28%	0.278	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	61.9	35	167.7	0	0	0	0	0	114.1	F1193 W1205	G1191-F1193 WeakPolarHBondContact O-CD2 3.38Å; G1191-F1193 WeakPolarHBondContact O-CE2 3.4Å; G1191-F1193 PolarHBondContact O-N 2.99Å; G1191-W1205 WeakPolarHBondContact O-CA 3.15Å
1192	L	78.7	Confident	64.4	Low	11 Å²	11	55 Å²	55	6%	0.058	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	118.2	173.3	-176.8	67.7	0	0	0	111.3	V1189 R1190 V1203 T1204 W1205 L1272 E1287 T1289	V1189-L1192 HydrophobicContact CG1-CB 4.46Å; R1190-L1192 VanDerWaalsContact C-N 3.31Å; R1190-L1192 PolarHBondContact O-N 3.36Å; L1192-V1203 HydrophobicContact CD1-CG1 3.49Å; L1192-V1203 VanDerWaalsContact CD1-CG1 3.49Å; L1192-T1204 CarbonylContact C-O 3.57Å; L1192-T1204 WeakPolarHBondContact CA-O 3.24Å; L1192-W1205 HydrophobicContact CD1-CB 3.92Å; L1192-L1272 HydrophobicContact CD1-CB 3.85Å; L1192-L1272 HydrophobicContact CD1-CD1 3.73Å; L1192-L1272 HydrophobicContact CD1-CG 4.4Å; L1192-L1272 HydrophobicContact CD2-CB 4.03Å; L1192-E1287 HydrophobicContact CB-CB 4.24Å; L1192-E1287 VanDerWaalsContact CB-OE2 3.3Å; L1192-E1287 WeakPolarHBondContact CB-OE2 3.24Å; L1192-E1287 HydrophobicContact CD2-CB 3.63Å; L1192-T1289 HydrophobicContact CD2-CG2 3.87Å; L1192-T1289 HydrophobicContact CG-CG2 3.73Å
1193	F	74.4	Confident	66.9	Low	134 Å²	134	46.7 Å²	46.7	59%	0.588	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.6	156.3	175.9	-57.6	-76.4	0	0	0	110.7	G1191 V1203 T1204	G1191-F1193 WeakPolarHBondContact O-CD2 3.38Å; G1191-F1193 WeakPolarHBondContact O-CE2 3.4Å; G1191-F1193 PolarHBondContact O-N 2.99Å; F1193-V1203 CarbonylContact O-C 3.41Å; F1193-V1203 WeakPolarHBondContact O-CA 3.39Å; F1193-T1204 PolarHBondContact N-O 3.47Å; F1193-T1204 PolarHBondContact O-N 3.26Å
1194	C	80.7	Confident	69	Low	29 Å²	29	45.8 Å²	45.8	20%	0.196	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	141.4	173.6	57.7	0	0	0	0	112.3	V1201 K1202 V1270 T1289 S1290 C1291	C1194-V1201 HydrophobicContact CB-CG1 4.31Å; C1194-K1202 CarbonylContact C-O 3.56Å; C1194-K1202 VanDerWaalsContact CA-O 3.26Å; C1194-K1202 WeakPolarHBondContact CA-O 3.42Å; C1194-V1270 HydrophobicContact CB-CG2 4.37Å; C1194-T1289 HydrophobicContact CB-CG2 3.82Å; C1194-T1289 WeakPolarHBondContact SG-CG2 3.32Å; C1194-T1289 PolarHBondContact SG-OG1 2.61Å; C1194-S1290 PolarHBondContact SG-O 2.88Å; C1194-S1290 VanDerWaalsContact SG-O 3.4Å; C1194-C1291 HydrophobicContact CB-CB 4.05Å; C1194-C1291 VanDerWaalsContact SG-CB 3.56Å
1195	S	77.1	Confident	71	Confident	72 Å²	72	39.1 Å²	39.1	50%	0.503	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	159.5	170	60.7	0	0	0	0	110.8	V1201 K1202	S1195-V1201 CarbonylContact O-C 3.49Å; S1195-V1201 VanDerWaalsContact O-CA 3.32Å; S1195-V1201 WeakPolarHBondContact O-CA 2.96Å; S1195-K1202 PolarHBondContact N-O 3.34Å; S1195-K1202 PolarHBondContact O-N 2.91Å
1196	G	72.9	Confident	72.1	Confident	19 Å²	19	43.2 Å²	43.2	20%	0.196	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	145.8	-174.5	0	0	0	0	0	114.9	S1200 Q1294	G1196-S1200 WeakPolarHBondContact CA-O 3.32Å; G1196-Q1294 PolarHBondContact O-NE2 2.77Å
1197	D	76.8	Confident	73	Confident	38 Å²	38	44 Å²	44	20%	0.203	23%	0.234	C	C	.	.			trans	-109.1	-171.8	163.8	69.9	65.8	0	0	0	109.9	T1199 S1200 T1293 Q1294 R1360	D1197-T1199 PolarHBondContact O-N 2.82Å; D1197-T1199 VanDerWaalsContact O-N 3.09Å; D1197-T1199 PolarHBondContact OD1-N 2.86Å; D1197-T1199 PolarHBondContact OD1-OG1 2.9Å; D1197-S1200 PolarHBondContact N-O 2.8Å; D1197-S1200 PolarHBondContact OD1-N 3.17Å; D1197-S1200 WeakPolarHBondContact OD2-CB 3.48Å; D1197-S1200 PolarHBondContact OD2-OG 3.21Å; D1197-T1293 CarbonylContact O-C 3.51Å; D1197-T1293 WeakPolarHBondContact O-CA 3.37Å; D1197-T1293 VanDerWaalsContact O-CB 3.31Å; D1197-T1293 WeakPolarHBondContact O-CB 3.5Å; D1197-Q1294 PolarHBondContact O-N 3Å; D1197-R1360 IonicContact OD1-CZ 3.82Å; D1197-R1360 IonicContact OD1-NH1 2.84Å; D1197-R1360 PolarHBondContact OD1-NH1 3.44Å; D1197-R1360 IonicContact OD1-NH2 3.67Å; D1197-R1360 IonicContact OD2-NH1 2.75Å
1198	D	72.8	Confident	73.4	Confident	8 Å²	8	40.9 Å²	40.9	4%	0.043	22%	0.22	C	C	.	.	S	Bend	trans	-60.1	-24	-176	-24.2	-24.5	0	0	0	114.2	P1264 Q1294 Q1296 R1360	D1198-P1264 WeakPolarHBondContact O-CA 3.48Å; D1198-P1264 WeakPolarHBondContact O-CB 3.48Å; D1198-Q1294 WeakPolarHBondContact CA-O 3.25Å; D1198-Q1294 HydrophobicContact CB-CB 4.4Å; D1198-Q1294 WeakPolarHBondContact OD1-CB 3.28Å; D1198-Q1296 HydrophobicContact CB-CB 3.82Å; D1198-Q1296 HydrophobicContact CB-CG 4.48Å; D1198-R1360 VanDerWaalsContact CB-NH2 3.33Å; D1198-R1360 WeakPolarHBondContact OD1-CD 3.47Å; D1198-R1360 VanDerWaalsContact OD1-CG 3.28Å; D1198-R1360 WeakPolarHBondContact OD1-CG 3.36Å; D1198-R1360 IonicContact OD1-CZ 3.32Å; D1198-R1360 IonicContact OD1-NE 3.78Å; D1198-R1360 PolarHBondContact OD1-NE 2.91Å; D1198-R1360 IonicContact OD1-NH2 3.67Å; D1198-R1360 IonicContact OD2-CZ 3.42Å; D1198-R1360 IonicContact OD2-NE 2.36Å; D1198-R1360 PolarHBondContact OD2-NE 2.73Å; D1198-R1360 IonicContact OD2-NH2 3.31Å; D1198-R1360 PolarHBondContact OD2-NH2 2.85Å
1199	T	79.6	Confident	73.3	Confident	41 Å²	41	47.6 Å²	47.6	25%	0.252	25%	0.246	S	C	.	.	S	Bend	trans	-140.3	-2.8	-167.7	45.5	0	0	0	0	114.1	D1197 S1260 D1261 L1262 R1360	D1197-T1199 PolarHBondContact O-N 2.82Å; D1197-T1199 VanDerWaalsContact O-N 3.09Å; D1197-T1199 PolarHBondContact OD1-N 2.86Å; D1197-T1199 PolarHBondContact OD1-OG1 2.9Å; T1199-S1260 CarbonylContact O-C 3.51Å; T1199-D1261 PolarHBondContact O-N 2.79Å; T1199-D1261 VanDerWaalsContact O-N 3.14Å; T1199-L1262 WeakPolarHBondContact CA-O 3.33Å; T1199-L1262 PolarHBondContact O-N 3.11Å; T1199-R1360 PolarHBondContact OG1-NH2 2.98Å
1200	S	81.4	Confident	72.8	Confident	16 Å²	16	55.8 Å²	55.8	11%	0.112	28%	0.277	C	S	.	.			trans	-136.7	157.1	178.3	105	0	0	0	0	113.7	G1196 D1197 T1258 V1259	G1196-S1200 WeakPolarHBondContact CA-O 3.32Å; D1197-S1200 PolarHBondContact N-O 2.8Å; D1197-S1200 PolarHBondContact OD1-N 3.17Å; D1197-S1200 WeakPolarHBondContact OD2-CB 3.48Å; D1197-S1200 PolarHBondContact OD2-OG 3.21Å; S1200-T1258 VanDerWaalsContact OG-CG2 3.27Å; S1200-T1258 WeakPolarHBondContact OG-CG2 3.44Å; S1200-V1259 CarbonylContact C-O 3.6Å; S1200-V1259 WeakPolarHBondContact CA-O 3.28Å; S1200-V1259 WeakPolarHBondContact CB-O 3.39Å
1201	V	81.2	Confident	72.5	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	120.4	175	162.2	0	0	0	0	109.4	C1194 S1195 V1203 I1221 T1258 V1259 L1262 V1270 C1291 T1293	C1194-V1201 HydrophobicContact CB-CG1 4.31Å; S1195-V1201 CarbonylContact O-C 3.49Å; S1195-V1201 VanDerWaalsContact O-CA 3.32Å; S1195-V1201 WeakPolarHBondContact O-CA 2.96Å; V1201-V1203 HydrophobicContact CG1-CG2 3.82Å; V1201-I1221 HydrophobicContact CB-CD1 4.39Å; V1201-I1221 HydrophobicContact CG1-CD1 4.02Å; V1201-T1258 CarbonylContact O-C 3.34Å; V1201-T1258 WeakPolarHBondContact O-CA 3.32Å; V1201-V1259 PolarHBondContact N-O 3.05Å; V1201-V1259 PolarHBondContact O-N 2.72Å; V1201-L1262 HydrophobicContact CB-CD1 3.62Å; V1201-L1262 HydrophobicContact CG2-CD1 3.47Å; V1201-L1262 VanDerWaalsContact CG2-CD1 3.47Å; V1201-V1270 HydrophobicContact CG1-CG2 3.94Å; V1201-C1291 WeakPolarHBondContact CG1-SG 3.36Å; V1201-C1291 HydrophobicContact CG2-CB 4.41Å; V1201-C1291 WeakPolarHBondContact CG2-SG 2.99Å; V1201-T1293 HydrophobicContact CG2-CG2 4.39Å
1202	K	82.3	Confident	71.9	Confident	106 Å²	106	60.5 Å²	60.5	46%	0.461	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	118.9	178.3	-176.5	173.3	-179.7	175.2	0	109.9	C1194 S1195 T1256	C1194-K1202 CarbonylContact C-O 3.56Å; C1194-K1202 VanDerWaalsContact CA-O 3.26Å; C1194-K1202 WeakPolarHBondContact CA-O 3.42Å; S1195-K1202 PolarHBondContact N-O 3.34Å; S1195-K1202 PolarHBondContact O-N 2.91Å; K1202-T1256 HydrophobicContact CD-CG2 4.18Å; K1202-T1256 VanDerWaalsContact CE-CG2 3.41Å; K1202-T1256 HydrophobicContact CG-CG2 3.66Å
1203	V	81.5	Confident	70.8	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	118.6	-173.2	-170.8	0	0	0	0	109.7	L1192 F1193 V1201 L1219 I1221 T1256 Y1257 V1270 L1272	L1192-V1203 HydrophobicContact CD1-CG1 3.49Å; L1192-V1203 VanDerWaalsContact CD1-CG1 3.49Å; F1193-V1203 CarbonylContact O-C 3.41Å; F1193-V1203 WeakPolarHBondContact O-CA 3.39Å; V1201-V1203 HydrophobicContact CG1-CG2 3.82Å; V1203-L1219 HydrophobicContact CB-CD1 4.4Å; V1203-L1219 HydrophobicContact CG1-CD1 4Å; V1203-L1219 HydrophobicContact CG2-CD1 4.31Å; V1203-L1219 HydrophobicContact CG2-CD2 4.31Å; V1203-I1221 HydrophobicContact CG2-CD1 4.32Å; V1203-T1256 CarbonylContact O-C 3.56Å; V1203-T1256 WeakPolarHBondContact O-CA 2.91Å; V1203-Y1257 WeakPolarHBondContact CB-O 3.41Å; V1203-Y1257 PolarHBondContact N-O 3.4Å; V1203-Y1257 PolarHBondContact O-N 2.88Å; V1203-V1270 HydrophobicContact CB-CG1 4.36Å; V1203-V1270 HydrophobicContact CG1-CG1 3.81Å; V1203-V1270 HydrophobicContact CG2-CG1 3.58Å; V1203-L1272 HydrophobicContact CG1-CD1 4.33Å
1204	T	79	Confident	70.3	Confident	51 Å²	51	63.3 Å²	63.3	31%	0.313	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	141.7	-179.1	-65.4	0	0	0	0	110	L1192 F1193 Y1255 T1256	L1192-T1204 CarbonylContact C-O 3.57Å; L1192-T1204 WeakPolarHBondContact CA-O 3.24Å; F1193-T1204 PolarHBondContact N-O 3.47Å; F1193-T1204 PolarHBondContact O-N 3.26Å; T1204-Y1255 CarbonylContact C-O 3.54Å; T1204-Y1255 WeakPolarHBondContact CA-O 3.18Å; T1204-T1256 WeakPolarHBondContact CG2-OG1 3.47Å; T1204-T1256 VanDerWaalsContact OG1-CG2 3.24Å; T1204-T1256 WeakPolarHBondContact OG1-CG2 3.44Å; T1204-T1256 PolarHBondContact OG1-OG1 2.92Å
1205	W	76.6	Confident	69.8	Low	6 Å²	6	65.4 Å²	65.4	2%	0.023	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	175.3	-176.6	72.9	-80.7	0	0	0	114.3	V1189 G1191 L1192 F1217 Y1248 Y1255 L1272 A1274	V1189-W1205 HydrophobicContact CB-CE3 4.35Å; V1189-W1205 HydrophobicContact CB-CZ3 4.3Å; V1189-W1205 HydrophobicContact CG1-CB 4.32Å; V1189-W1205 HydrophobicContact CG1-CD2 4.18Å; V1189-W1205 HydrophobicContact CG1-CE3 3.45Å; V1189-W1205 VanDerWaalsContact CG1-CE3 3.45Å; V1189-W1205 HydrophobicContact CG1-CZ3 3.86Å; V1189-W1205 HydrophobicContact CG2-CE3 4.48Å; V1189-W1205 HydrophobicContact CG2-CZ3 4.07Å; G1191-W1205 WeakPolarHBondContact O-CA 3.15Å; L1192-W1205 HydrophobicContact CD1-CB 3.92Å; W1205-F1217 AromaticContact CE2-CD1 4Å; W1205-F1217 HydrophobicContact CH2-CB 4.34Å; W1205-F1217 HydrophobicContact CZ2-CB 3.75Å; W1205-F1217 AromaticContact CZ2-CD1 3.54Å; W1205-F1217 HydrophobicContact CZ2-CD1 3.54Å; W1205-F1217 HydrophobicContact CZ2-CE1 4.28Å; W1205-F1217 AromaticContact CZ2-CG 3.74Å; W1205-F1217 HydrophobicContact CZ2-CG 3.74Å; W1205-F1217 AromaticContact NE1-CD1 3.84Å; W1205-F1217 AromaticContact NE1-CE1 3.75Å; W1205-F1217 AromaticContact NE1-CZ 3.99Å; W1205-Y1248 WeakPolarHBondContact CH2-OH 3.33Å; W1205-Y1248 HydrophobicContact CZ2-CE1 4.29Å; W1205-Y1248 AromaticContact CZ2-CZ 3.88Å; W1205-Y1248 WeakPolarHBondContact CZ2-OH 2.93Å; W1205-Y1255 PolarHBondContact N-O 2.94Å; W1205-Y1255 WeakPolarHBondContact O-CB 3.38Å; W1205-L1272 HydrophobicContact CB-CD1 4.29Å; W1205-L1272 VanDerWaalsContact CD1-CD1 3.44Å; W1205-L1272 HydrophobicContact CD2-CD1 4.1Å; W1205-L1272 HydrophobicContact CD2-CD2 3.91Å; W1205-L1272 HydrophobicContact CE3-CD2 4.18Å; W1205-L1272 HydrophobicContact CG-CD1 3.74Å; W1205-L1272 HydrophobicContact CG-CD2 4.38Å; W1205-L1272 HydrophobicContact CH2-CD2 3.99Å; W1205-L1272 HydrophobicContact CZ2-CD2 3.8Å; W1205-L1272 HydrophobicContact CZ3-CD2 4.21Å; W1205-A1274 HydrophobicContact CH2-CB 3.81Å; W1205-A1274 HydrophobicContact CZ3-CB 4.44Å
1206	Q	68.5	Low	69.6	Low	123 Å²	123	62 Å²	62	58%	0.575	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.3	132.2	177.2	-63.5	-174.3	-17.6	0	0	113	R1190	R1190-Q1206 HydrophobicContact CB-CB 4.36Å; R1190-Q1206 PolarHBondContact N-O 3.32Å; R1190-Q1206 WeakPolarHBondContact O-CA 3.49Å; R1190-Q1206 WeakPolarHBondContact O-CB 3.45Å; R1190-Q1206 PolarHBondContact O-N 2.82Å
1207	Q	66.9	Low	69.9	Low	72 Å²	72	61 Å²	61	34%	0.336	28%	0.281	S	S	.	.			trans	-55.6	140.5	177.7	178.7	178	14.9	0	0	112.9	T1211 L1214 Y1255	Q1207-T1211 WeakPolarHBondContact CG-OG1 3.5Å; Q1207-T1211 PolarHBondContact NE2-O 3.41Å; Q1207-T1211 PolarHBondContact NE2-OG1 2.67Å; Q1207-L1214 HydrophobicContact CG-CD1 4.31Å; Q1207-Y1255 HydrophobicContact CB-CD2 4.24Å; Q1207-Y1255 HydrophobicContact CB-CE2 3.58Å; Q1207-Y1255 PolarHBondContact OE1-OH 3.2Å
1208	P	63.3	Low	70.2	Confident	4 Å²	4	62 Å²	62	3%	0.026	28%	0.284	C	S	.	.			trans	-72.4	156.7	-179.6	-13.6	29.4	0	0	0	113.5	D1186 F1187 S1188 R1210 T1211 L1214	D1186-P1208 CarbonylContact O-C 3.29Å; D1186-P1208 WeakPolarHBondContact O-CB 3.27Å; F1187-P1208 WeakPolarHBondContact O-CG 3.13Å; S1188-P1208 WeakPolarHBondContact O-CB 3.29Å; S1188-P1208 WeakPolarHBondContact O-CG 3.42Å; P1208-R1210 PolarHBondContact O-N 3.1Å; P1208-T1211 HydrophobicContact CB-CG2 3.58Å; P1208-T1211 WeakPolarHBondContact CD-OG1 2.92Å; P1208-T1211 HydrophobicContact CG-CG2 3.88Å; P1208-T1211 PolarHBondContact O-OG1 2.69Å; P1208-L1214 HydrophobicContact CG-CD1 4.26Å
1209	K	54.8	Low	70.8	Confident	165 Å²	165	61.7 Å²	61.7	72%	0.717	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-23.6	-166.4	-77.1	-169	173	-174.3	0	116.8	D1186	D1186-K1209 PolarHBondContact O-N 3.15Å; D1186-K1209 VanDerWaalsContact O-N 3.07Å
1210	R	53.7	Low	70.9	Confident	174 Å²	174	64.6 Å²	64.6	66%	0.657	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	41.5	-179.5	-81.3	-169.7	164.1	151.1	-15.8	113.9	D1186 F1187 P1208	D1186-R1210 HydrophobicContact CB-CB 3.65Å; D1186-R1210 HydrophobicContact CB-CG 3.61Å; D1186-R1210 PolarHBondContact O-N 2.73Å; D1186-R1210 WeakPolarHBondContact OD2-CD 3.1Å; D1186-R1210 IonicContact OD2-CZ 3.32Å; D1186-R1210 IonicContact OD2-NE 2.65Å; D1186-R1210 IonicContact OD2-NH1 3.11Å; D1186-R1210 PolarHBondContact OD2-NH1 2.87Å; F1187-R1210 HydrophobicContact CE1-CB 4.34Å; P1208-R1210 PolarHBondContact O-N 3.1Å
1211	T	54	Low	71.1	Confident	4 Å²	4	64 Å²	64	3%	0.025	28%	0.284	C	S	.	.			trans	-127	40.2	-161.2	68.2	0	0	0	0	116.3	F1187 Q1207 P1208 K1213 L1214 Y1276	F1187-T1211 HydrophobicContact CD1-CG2 4.17Å; Q1207-T1211 WeakPolarHBondContact CG-OG1 3.5Å; Q1207-T1211 PolarHBondContact NE2-O 3.41Å; Q1207-T1211 PolarHBondContact NE2-OG1 2.67Å; P1208-T1211 HydrophobicContact CB-CG2 3.58Å; P1208-T1211 WeakPolarHBondContact CD-OG1 2.92Å; P1208-T1211 HydrophobicContact CG-CG2 3.88Å; P1208-T1211 PolarHBondContact O-OG1 2.69Å; T1211-K1213 PolarHBondContact O-N 3.46Å; T1211-L1214 HydrophobicContact CG2-CD1 3.91Å; T1211-L1214 HydrophobicContact CG2-CG 4.2Å; T1211-L1214 PolarHBondContact O-N 3.13Å; T1211-Y1276 HydrophobicContact CG2-CE1 3.9Å; T1211-Y1276 WeakPolarHBondContact CG2-OH 3.34Å
1212	E	53.9	Low	71.1	Confident	198 Å²	198	64.7 Å²	64.7	93%	0.925	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-11.4	175.1	-59.1	176.7	160.7	0	0	114.4
1213	K	55.8	Low	71	Confident	183 Å²	183	60.1 Å²	60.1	80%	0.796	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.5	43.9	176.6	-64.1	-168.8	174.9	-169.1	0	113	T1211	T1211-K1213 PolarHBondContact O-N 3.46Å
1214	L	63.2	Low	71	Confident	20 Å²	20	60.5 Å²	60.5	11%	0.105	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	131.3	171.7	-109.4	178.6	0	0	0	110.6	Q1207 P1208 T1211 Y1248 A1274 Y1275 Y1276	Q1207-L1214 HydrophobicContact CG-CD1 4.31Å; P1208-L1214 HydrophobicContact CG-CD1 4.26Å; T1211-L1214 HydrophobicContact CG2-CD1 3.91Å; T1211-L1214 HydrophobicContact CG2-CG 4.2Å; T1211-L1214 PolarHBondContact O-N 3.13Å; L1214-Y1248 HydrophobicContact CB-CD2 4.13Å; L1214-Y1248 HydrophobicContact CB-CE2 3.6Å; L1214-Y1248 HydrophobicContact CD1-CE2 4.21Å; L1214-Y1248 HydrophobicContact CD2-CE2 4.34Å; L1214-Y1248 HydrophobicContact CG-CE2 4.23Å; L1214-Y1248 WeakPolarHBondContact O-CD2 3.49Å; L1214-A1274 HydrophobicContact CD1-CB 3.72Å; L1214-A1274 HydrophobicContact CD2-CB 3.61Å; L1214-A1274 HydrophobicContact CG-CB 4.35Å; L1214-Y1275 VanDerWaalsContact CD2-C 3.49Å; L1214-Y1275 WeakPolarHBondContact CD2-O 3.14Å; L1214-Y1276 HydrophobicContact CB-CE1 4.5Å; L1214-Y1276 HydrophobicContact CD2-CD1 3.88Å; L1214-Y1276 HydrophobicContact CD2-CD2 4.27Å; L1214-Y1276 HydrophobicContact CD2-CE1 3.59Å; L1214-Y1276 HydrophobicContact CD2-CE2 3.97Å; L1214-Y1276 HydrophobicContact CD2-CG 4.19Å; L1214-Y1276 HydrophobicContact CG-CD1 4.08Å; L1214-Y1276 HydrophobicContact CG-CE1 3.54Å
1215	E	70.4	Confident	70.8	Confident	73 Å²	73	59 Å²	59	34%	0.341	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	-33	-173.9	-164.6	179.4	-111.6	0	0	111.9	T1247 Y1248 Y1275	E1215-T1247 CarbonylContact O-C 3.59Å; E1215-T1247 VanDerWaalsContact O-CA 3.3Å; E1215-T1247 WeakPolarHBondContact O-CA 3.12Å; E1215-Y1248 PolarHBondContact O-N 3.11Å; E1215-Y1275 HydrophobicContact CB-CD2 4.38Å; E1215-Y1275 HydrophobicContact CB-CE2 4.22Å; E1215-Y1275 HydrophobicContact CG-CE2 4.47Å; E1215-Y1275 PolarHBondContact N-O 3.35Å
1216	G	74.2	Confident	70.2	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.7	-164.2	170	0	0	0	0	0	114.8	V1246 Y1248 Y1275	G1216-V1246 CarbonylContact C-O 3.45Å; G1216-V1246 WeakPolarHBondContact CA-O 3.49Å; G1216-Y1248 VanDerWaalsContact CA-CD2 3.44Å; G1216-Y1275 VanDerWaalsContact C-CD1 3.45Å; G1216-Y1275 PolarHBondContact N-O 2.88Å; G1216-Y1275 VanDerWaalsContact N-O 3.08Å; G1216-Y1275 PolarHBondContact O-N 3.33Å
1217	F	79.1	Confident	69.6	Low	0 Å²	0	60.7 Å²	60.7	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	148.2	167.1	61.6	-86.7	0	0	0	112.3	W1205 L1219 V1246 L1251 Y1257 L1272 S1273 Y1275	W1205-F1217 AromaticContact CE2-CD1 4Å; W1205-F1217 HydrophobicContact CH2-CB 4.34Å; W1205-F1217 HydrophobicContact CZ2-CB 3.75Å; W1205-F1217 AromaticContact CZ2-CD1 3.54Å; W1205-F1217 HydrophobicContact CZ2-CD1 3.54Å; W1205-F1217 HydrophobicContact CZ2-CE1 4.28Å; W1205-F1217 AromaticContact CZ2-CG 3.74Å; W1205-F1217 HydrophobicContact CZ2-CG 3.74Å; W1205-F1217 AromaticContact NE1-CD1 3.84Å; W1205-F1217 AromaticContact NE1-CE1 3.75Å; W1205-F1217 AromaticContact NE1-CZ 3.99Å; F1217-L1219 HydrophobicContact CD2-CB 4.34Å; F1217-L1219 HydrophobicContact CE2-CB 4.31Å; F1217-V1246 HydrophobicContact CD1-CB 4.4Å; F1217-V1246 HydrophobicContact CD2-CB 4.46Å; F1217-V1246 HydrophobicContact CD2-CG2 4.44Å; F1217-V1246 HydrophobicContact CE1-CB 3.97Å; F1217-V1246 HydrophobicContact CE1-CG1 4.27Å; F1217-V1246 HydrophobicContact CE2-CB 4.01Å; F1217-V1246 HydrophobicContact CE2-CG2 3.81Å; F1217-V1246 HydrophobicContact CZ-CB 3.74Å; F1217-V1246 HydrophobicContact CZ-CG1 4.1Å; F1217-V1246 HydrophobicContact CZ-CG2 3.92Å; F1217-V1246 PolarHBondContact N-O 2.68Å; F1217-V1246 PolarHBondContact O-N 3.01Å; F1217-L1251 HydrophobicContact CE1-CD1 3.61Å; F1217-L1251 HydrophobicContact CE1-CD2 3.7Å; F1217-L1251 HydrophobicContact CE1-CG 4.32Å; F1217-L1251 HydrophobicContact CZ-CD1 4.23Å; F1217-L1251 HydrophobicContact CZ-CD2 3.97Å; F1217-Y1257 HydrophobicContact CE2-CG 4.4Å; F1217-Y1257 HydrophobicContact CZ-CD2 4.31Å; F1217-Y1257 HydrophobicContact CZ-CG 4.29Å; F1217-L1272 HydrophobicContact CB-CD2 3.83Å; F1217-L1272 HydrophobicContact CB-CG 4.43Å; F1217-L1272 HydrophobicContact CD2-CD1 3.9Å; F1217-L1272 HydrophobicContact CD2-CD2 4.17Å; F1217-L1272 HydrophobicContact CD2-CG 3.92Å; F1217-L1272 HydrophobicContact CE2-CD1 4.2Å; F1217-L1272 HydrophobicContact CG-CD2 4.18Å; F1217-L1272 HydrophobicContact CG-CG 4.44Å; F1217-S1273 CarbonylContact C-O 3.5Å; F1217-S1273 VanDerWaalsContact CA-O 3.28Å; F1217-S1273 WeakPolarHBondContact CA-O 3.44Å; F1217-S1273 WeakPolarHBondContact CB-O 3.35Å; F1217-Y1275 VanDerWaalsContact N-CE1 3.26Å
1218	K	82.2	Confident	68.5	Low	59 Å²	59	58.8 Å²	58.8	26%	0.257	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	116.7	167.6	-70.5	175.2	-177.4	172.1	0	108.2	V1244 L1272 S1273 Y1275 W1286	K1218-V1244 CarbonylContact C-O 3.27Å; K1218-V1244 WeakPolarHBondContact CA-O 3.22Å; K1218-L1272 WeakPolarHBondContact O-CA 3.18Å; K1218-S1273 PolarHBondContact N-O 3.26Å; K1218-S1273 PolarHBondContact O-N 3.04Å; K1218-Y1275 HydrophobicContact CG-CD1 3.94Å; K1218-Y1275 HydrophobicContact CG-CE1 4.22Å; K1218-W1286 HydrophobicContact CB-CH2 3.64Å; K1218-W1286 HydrophobicContact CB-CZ2 4.22Å; K1218-W1286 HydrophobicContact CB-CZ3 4.2Å; K1218-W1286 VanDerWaalsContact O-CZ3 3.27Å; K1218-W1286 WeakPolarHBondContact O-CZ3 3.45Å
1219	L	84.4	Confident	68.1	Low	1 Å²	1	59 Å²	59	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	144.7	167.3	-168	72	0	0	0	108.6	V1203 F1217 I1221 S1243 V1244 Y1257 V1259 V1270 Q1271 L1272	V1203-L1219 HydrophobicContact CB-CD1 4.4Å; V1203-L1219 HydrophobicContact CG1-CD1 4Å; V1203-L1219 HydrophobicContact CG2-CD1 4.31Å; V1203-L1219 HydrophobicContact CG2-CD2 4.31Å; F1217-L1219 HydrophobicContact CD2-CB 4.34Å; F1217-L1219 HydrophobicContact CE2-CB 4.31Å; L1219-I1221 HydrophobicContact CD2-CD1 4.22Å; L1219-I1221 HydrophobicContact CD2-CG1 4.35Å; L1219-I1221 HydrophobicContact CG-CG1 4.28Å; L1219-S1243 CarbonylContact O-C 3.49Å; L1219-S1243 VanDerWaalsContact O-CA 3.31Å; L1219-S1243 WeakPolarHBondContact O-CA 3.17Å; L1219-V1244 PolarHBondContact N-O 2.83Å; L1219-V1244 PolarHBondContact O-N 2.93Å; L1219-Y1257 HydrophobicContact CD2-CD1 3.52Å; L1219-Y1257 HydrophobicContact CD2-CE1 4.14Å; L1219-Y1257 HydrophobicContact CD2-CG 4.4Å; L1219-V1259 HydrophobicContact CD2-CG2 3.43Å; L1219-V1259 VanDerWaalsContact CD2-CG2 3.43Å; L1219-V1270 HydrophobicContact CD1-CG1 3.75Å; L1219-Q1271 CarbonylContact C-O 3.59Å; L1219-Q1271 WeakPolarHBondContact CA-O 3.46Å; L1219-L1272 HydrophobicContact CD1-CB 4.13Å; L1219-L1272 HydrophobicContact CD1-CD1 3.87Å; L1219-L1272 HydrophobicContact CD1-CG 4.11Å
1220	R	83.6	Confident	67.5	Low	102 Å²	102	56.4 Å²	56.4	39%	0.385	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	113.3	175.6	-179.1	173.5	-176.4	-140.1	10.3	110.5	A1241 R1242 S1243 Q1271 W1286	R1220-A1241 HydrophobicContact CG-CB 4.02Å; R1220-R1242 CarbonylContact C-O 3.59Å; R1220-R1242 VanDerWaalsContact CA-O 3.3Å; R1220-R1242 WeakPolarHBondContact CA-O 3.3Å; R1220-S1243 WeakPolarHBondContact CG-OG 3.31Å; R1220-Q1271 HydrophobicContact CB-CB 4.23Å; R1220-Q1271 PolarHBondContact N-O 3.28Å; R1220-Q1271 VanDerWaalsContact NH1-OE1 3.1Å; R1220-Q1271 PolarHBondContact O-N 2.89Å; R1220-W1286 HydrophobicContact CB-CE3 4.47Å; R1220-W1286 HydrophobicContact CB-CH2 3.89Å; R1220-W1286 HydrophobicContact CB-CZ3 3.56Å
1221	I	84	Confident	67	Low	4 Å²	4	50.8 Å²	50.8	2%	0.021	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	110.7	-177.9	-62.3	-162.7	0	0	0	109.7	V1201 V1203 L1219 A1241 R1242 V1259 L1262 Y1268 D1269 V1270	V1201-I1221 HydrophobicContact CB-CD1 4.39Å; V1201-I1221 HydrophobicContact CG1-CD1 4.02Å; V1203-I1221 HydrophobicContact CG2-CD1 4.32Å; L1219-I1221 HydrophobicContact CD2-CD1 4.22Å; L1219-I1221 HydrophobicContact CD2-CG1 4.35Å; L1219-I1221 HydrophobicContact CG-CG1 4.28Å; I1221-A1241 CarbonylContact O-C 3.41Å; I1221-A1241 VanDerWaalsContact O-CA 3.3Å; I1221-A1241 WeakPolarHBondContact O-CA 3.27Å; I1221-R1242 PolarHBondContact N-O 2.78Å; I1221-R1242 PolarHBondContact O-N 2.89Å; I1221-V1259 HydrophobicContact CD1-CB 3.71Å; I1221-V1259 HydrophobicContact CD1-CG1 4.12Å; I1221-V1259 HydrophobicContact CD1-CG2 3.46Å; I1221-V1259 VanDerWaalsContact CD1-CG2 3.46Å; I1221-V1259 HydrophobicContact CG1-CG2 4.29Å; I1221-L1262 HydrophobicContact CG2-CD1 4.4Å; I1221-L1262 HydrophobicContact CG2-CD2 4.29Å; I1221-Y1268 HydrophobicContact CG2-CD1 3.42Å; I1221-Y1268 VanDerWaalsContact CG2-CD1 3.42Å; I1221-Y1268 HydrophobicContact CG2-CE1 4.22Å; I1221-Y1268 HydrophobicContact CG2-CG 4.02Å; I1221-D1269 WeakPolarHBondContact CA-O 3.39Å; I1221-V1270 HydrophobicContact CD1-CB 4.45Å; I1221-V1270 HydrophobicContact CD1-CG1 4.07Å; I1221-V1270 HydrophobicContact CD1-CG2 3.82Å; I1221-V1270 HydrophobicContact CG1-CB 4.28Å; I1221-V1270 HydrophobicContact CG1-CG1 4Å; I1221-V1270 HydrophobicContact CG1-CG2 4.02Å
1222	G	82.3	Confident	66.2	Low	13 Å²	13	52.2 Å²	52.2	13%	0.134	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	166.7	164.4	0	0	0	0	0	110.1	Y1268 D1269	G1222-Y1268 CarbonylContact O-C 3.56Å; G1222-Y1268 WeakPolarHBondContact O-CA 2.99Å; G1222-Y1268 VanDerWaalsContact O-CD1 3.31Å; G1222-Y1268 WeakPolarHBondContact O-CD1 3.46Å; G1222-D1269 PolarHBondContact N-O 2.84Å; G1222-D1269 VanDerWaalsContact N-O 3.09Å; G1222-D1269 PolarHBondContact O-N 3.18Å
1223	G	80.4	Confident	65.6	Low	11 Å²	11	46 Å²	46	11%	0.113	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	-175.2	-178.6	0	0	0	0	0	115.1	E1238 F1239 V1267	G1223-E1238 CarbonylContact O-C 3.45Å; G1223-E1238 WeakPolarHBondContact O-CA 3.46Å; G1223-F1239 PolarHBondContact N-O 3.43Å; G1223-F1239 PolarHBondContact O-N 2.9Å; G1223-V1267 CarbonylContact C-O 3.38Å; G1223-V1267 WeakPolarHBondContact CA-O 3.48Å
1224	S	81	Confident	65.1	Low	8 Å²	8	43.2 Å²	43.2	6%	0.056	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	149.8	176.8	66.6	0	0	0	0	114.2	R1236 L1237 V1267	S1224-R1236 VanDerWaalsContact OG-CZ 3.29Å; S1224-R1236 PolarHBondContact OG-NE 2.65Å; S1224-R1236 PolarHBondContact OG-NH2 3.02Å; S1224-L1237 CarbonylContact C-O 3.57Å; S1224-L1237 WeakPolarHBondContact CA-O 3.32Å; S1224-L1237 VanDerWaalsContact CB-O 3.26Å; S1224-L1237 WeakPolarHBondContact CB-O 3.25Å; S1224-V1267 PolarHBondContact N-O 2.77Å; S1224-V1267 PolarHBondContact O-N 3.13Å
1225	K	74.5	Confident	64.8	Low	19 Å²	19	46.6 Å²	46.6	8%	0.083	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	116.3	179.5	-170.2	165.3	-171.4	158.8	0	108.1	R1236 L1237 F1239 E1263 P1264 S1266 Y1327	K1225-R1236 WeakPolarHBondContact O-CA 3.17Å; K1225-L1237 HydrophobicContact CB-CB 4.46Å; K1225-L1237 PolarHBondContact N-O 3.32Å; K1225-L1237 PolarHBondContact O-N 3.16Å; K1225-F1239 HydrophobicContact CB-CE2 3.71Å; K1225-F1239 HydrophobicContact CB-CZ 3.61Å; K1225-F1239 HydrophobicContact CD-CZ 3.9Å; K1225-F1239 HydrophobicContact CG-CZ 4.45Å; K1225-E1263 IonicContact NZ-OE2 3.14Å; K1225-E1263 PolarHBondContact NZ-OE2 3.35Å; K1225-P1264 WeakPolarHBondContact CE-O 3.21Å; K1225-P1264 PolarHBondContact NZ-O 2.97Å; K1225-S1266 WeakPolarHBondContact CD-OG 3.32Å; K1225-Y1327 HydrophobicContact CD-CD1 4.17Å; K1225-Y1327 HydrophobicContact CD-CG 4.37Å
1226	K	64.1	Low	64.6	Low	122 Å²	122	46.6 Å²	46.6	53%	0.53	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	124.9	171	-74.3	-177.3	177.6	179.2	0	107.8	D1136 I1234	D1136-K1226 PolarHBondContact O-NZ 3.2Å; K1226-I1234 HydrophobicContact CB-CG2 4.08Å; K1226-I1234 HydrophobicContact CG-CG2 4.46Å
1227	F	54.9	Low	64.4	Low	42 Å²	42	49.5 Å²	49.5	18%	0.184	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	145.9	-179.4	67.6	-83.3	0	0	0	111	D1229 I1234 K1235 L1237 Y1327	F1227-D1229 HydrophobicContact CE2-CB 4.13Å; F1227-D1229 PolarHBondContact O-N 2.94Å; F1227-I1234 CarbonylContact O-C 3.6Å; F1227-I1234 WeakPolarHBondContact O-CA 3.22Å; F1227-K1235 HydrophobicContact CD1-CB 4.21Å; F1227-K1235 HydrophobicContact CD2-CB 4.32Å; F1227-K1235 HydrophobicContact CE1-CB 3.63Å; F1227-K1235 HydrophobicContact CE2-CB 3.78Å; F1227-K1235 HydrophobicContact CE2-CD 4.14Å; F1227-K1235 HydrophobicContact CZ-CB 3.41Å; F1227-K1235 VanDerWaalsContact CZ-CB 3.41Å; F1227-K1235 HydrophobicContact CZ-CD 3.91Å; F1227-K1235 HydrophobicContact CZ-CG 4.28Å; F1227-K1235 PolarHBondContact N-O 2.83Å; F1227-K1235 PolarHBondContact O-N 2.94Å; F1227-K1235 VanDerWaalsContact O-O 3.12Å; F1227-L1237 HydrophobicContact CD1-CB 4.37Å; F1227-L1237 HydrophobicContact CE1-CB 3.89Å; F1227-Y1327 VanDerWaalsContact CB-O 3.25Å; F1227-Y1327 WeakPolarHBondContact CB-O 3.37Å; F1227-Y1327 WeakPolarHBondContact CD2-O 3.37Å; F1227-Y1327 WeakPolarHBondContact CG-O 3.19Å
1228	A	45.2	Very low	64.2	Low	32 Å²	32	54.3 Å²	54.3	26%	0.264	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	124.3	167.4	0	0	0	0	0	108.6	K1329	A1228-K1329 PolarHBondContact O-N 3.1Å
1229	D	53.7	Low	64	Low	9 Å²	9	52.9 Å²	52.9	5%	0.048	28%	0.279	C	S	.	.			trans	-79.9	-162.2	-179.6	76.2	-1.9	0	0	0	112.4	F1227 A1231 G1232 V1233 K1235 Y1378	F1227-D1229 HydrophobicContact CE2-CB 4.13Å; F1227-D1229 PolarHBondContact O-N 2.94Å; D1229-A1231 VanDerWaalsContact OD1-C 3.3Å; D1229-A1231 WeakPolarHBondContact OD1-CA 3.23Å; D1229-A1231 PolarHBondContact OD1-N 2.86Å; D1229-G1232 PolarHBondContact OD1-N 3.08Å; D1229-V1233 WeakPolarHBondContact CB-O 3.46Å; D1229-V1233 PolarHBondContact N-O 3.21Å; D1229-V1233 PolarHBondContact OD1-N 2.94Å; D1229-V1233 VanDerWaalsContact OD1-O 3.13Å; D1229-K1235 HydrophobicContact CB-CB 4.21Å; D1229-K1235 HydrophobicContact CB-CD 3.59Å; D1229-K1235 HydrophobicContact CB-CG 3.72Å; D1229-K1235 VanDerWaalsContact OD2-CE 3.27Å; D1229-K1235 WeakPolarHBondContact OD2-CE 3.41Å; D1229-K1235 IonicContact OD2-NZ 2.86Å; D1229-K1235 PolarHBondContact OD2-NZ 3.07Å; D1229-Y1378 PolarHBondContact O-OH 2.76Å
1230	D	43	Very low	63.5	Low	110 Å²	110	58.2 Å²	58.2	59%	0.588	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-8.1	178.3	56	-47.7	0	0	0	115.4	K1235 K1329 Y1378	D1230-K1235 IonicContact OD1-NZ 3.53Å; D1230-K1235 PolarHBondContact OD1-NZ 3.1Å; D1230-K1329 PolarHBondContact O-NZ 3.45Å; D1230-Y1378 WeakPolarHBondContact CA-OH 3.26Å; D1230-Y1378 VanDerWaalsContact O-CE1 3.26Å; D1230-Y1378 WeakPolarHBondContact O-CE1 3.29Å; D1230-Y1378 PolarHBondContact O-OH 2.75Å
1231	A	42.4	Very low	63.1	Low	57 Å²	57	55.5 Å²	55.5	47%	0.471	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	4.5	171.6	0	0	0	0	0	113.6	D1229 V1233 Y1378	D1229-A1231 VanDerWaalsContact OD1-C 3.3Å; D1229-A1231 WeakPolarHBondContact OD1-CA 3.23Å; D1229-A1231 PolarHBondContact OD1-N 2.86Å; A1231-V1233 HydrophobicContact CB-CG2 4.19Å; A1231-V1233 PolarHBondContact O-N 2.72Å; A1231-Y1378 PolarHBondContact N-OH 2.79Å
1232	G	37.2	Very low	62.8	Low	34 Å²	34	61.1 Å²	61.1	35%	0.351	33%	0.334	S	S	.	.	S	Bend	trans	80.9	-0.9	-177.6	0	0	0	0	0	113.7	D1229 Y1378	D1229-G1232 PolarHBondContact OD1-N 3.08Å; G1232-Y1378 PolarHBondContact N-OH 2.78Å
1233	V	41.4	Very low	62.7	Low	66 Å²	66	64.2 Å²	64.2	40%	0.4	35%	0.354	S	S	.	.			trans	-74.9	135.9	177.2	-178.4	0	0	0	0	108.5	D1229 A1231 K1235	D1229-V1233 WeakPolarHBondContact CB-O 3.46Å; D1229-V1233 PolarHBondContact N-O 3.21Å; D1229-V1233 PolarHBondContact OD1-N 2.94Å; D1229-V1233 VanDerWaalsContact OD1-O 3.13Å; A1231-V1233 HydrophobicContact CB-CG2 4.19Å; A1231-V1233 PolarHBondContact O-N 2.72Å; V1233-K1235 PolarHBondContact O-N 2.79Å
1234	I	46.1	Very low	62.7	Low	125 Å²	125	65.8 Å²	65.8	64%	0.641	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	93.1	175.1	-56.5	176.7	0	0	0	108.1	K1226 F1227	K1226-I1234 HydrophobicContact CB-CG2 4.08Å; K1226-I1234 HydrophobicContact CG-CG2 4.46Å; F1227-I1234 CarbonylContact O-C 3.6Å; F1227-I1234 WeakPolarHBondContact O-CA 3.22Å
1235	K	55.7	Low	62.6	Low	91 Å²	91	69 Å²	69	40%	0.396	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	154.5	167.7	-78.8	-173.8	176.5	106.8	0	109.4	F1227 D1229 D1230 V1233	F1227-K1235 HydrophobicContact CD1-CB 4.21Å; F1227-K1235 HydrophobicContact CD2-CB 4.32Å; F1227-K1235 HydrophobicContact CE1-CB 3.63Å; F1227-K1235 HydrophobicContact CE2-CB 3.78Å; F1227-K1235 HydrophobicContact CE2-CD 4.14Å; F1227-K1235 HydrophobicContact CZ-CB 3.41Å; F1227-K1235 VanDerWaalsContact CZ-CB 3.41Å; F1227-K1235 HydrophobicContact CZ-CD 3.91Å; F1227-K1235 HydrophobicContact CZ-CG 4.28Å; F1227-K1235 PolarHBondContact N-O 2.83Å; F1227-K1235 PolarHBondContact O-N 2.94Å; F1227-K1235 VanDerWaalsContact O-O 3.12Å; D1229-K1235 HydrophobicContact CB-CB 4.21Å; D1229-K1235 HydrophobicContact CB-CD 3.59Å; D1229-K1235 HydrophobicContact CB-CG 3.72Å; D1229-K1235 VanDerWaalsContact OD2-CE 3.27Å; D1229-K1235 WeakPolarHBondContact OD2-CE 3.41Å; D1229-K1235 IonicContact OD2-NZ 2.86Å; D1229-K1235 PolarHBondContact OD2-NZ 3.07Å; D1230-K1235 IonicContact OD1-NZ 3.53Å; D1230-K1235 PolarHBondContact OD1-NZ 3.1Å; V1233-K1235 PolarHBondContact O-N 2.79Å
1236	R	67	Low	62.5	Low	73 Å²	73	68.6 Å²	68.6	28%	0.275	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	120.1	170.5	-170.9	-176.6	-167.8	-163.2	5.6	107.8	S1224 K1225 E1238	S1224-R1236 VanDerWaalsContact OG-CZ 3.29Å; S1224-R1236 PolarHBondContact OG-NE 2.65Å; S1224-R1236 PolarHBondContact OG-NH2 3.02Å; K1225-R1236 WeakPolarHBondContact O-CA 3.17Å; R1236-E1238 WeakPolarHBondContact CD-OE1 3.27Å; R1236-E1238 HydrophobicContact CG-CG 4.12Å; R1236-E1238 IonicContact CZ-OE1 3.52Å; R1236-E1238 IonicContact NE-OE1 2.66Å; R1236-E1238 PolarHBondContact NE-OE1 2.78Å; R1236-E1238 IonicContact NH1-OE1 3.65Å; R1236-E1238 PolarHBondContact NH1-OE1 2.88Å
1237	L	69.7	Low	62.8	Low	61 Å²	61	66 Å²	66	32%	0.319	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	137.3	163.5	-175.7	60.7	0	0	0	107.6	S1224 K1225 F1227 F1239 Y1327	S1224-L1237 CarbonylContact C-O 3.57Å; S1224-L1237 WeakPolarHBondContact CA-O 3.32Å; S1224-L1237 VanDerWaalsContact CB-O 3.26Å; S1224-L1237 WeakPolarHBondContact CB-O 3.25Å; K1225-L1237 HydrophobicContact CB-CB 4.46Å; K1225-L1237 PolarHBondContact N-O 3.32Å; K1225-L1237 PolarHBondContact O-N 3.16Å; F1227-L1237 HydrophobicContact CD1-CB 4.37Å; F1227-L1237 HydrophobicContact CE1-CB 3.89Å; L1237-F1239 HydrophobicContact CD2-CD1 4.44Å; L1237-F1239 HydrophobicContact CD2-CE1 3.51Å; L1237-F1239 HydrophobicContact CD2-CZ 4Å; L1237-F1239 HydrophobicContact CG-CD1 4.43Å; L1237-F1239 HydrophobicContact CG-CE1 3.81Å; L1237-F1239 HydrophobicContact CG-CZ 4.25Å; L1237-Y1327 HydrophobicContact CD2-CD1 3.58Å; L1237-Y1327 HydrophobicContact CD2-CE1 3.43Å; L1237-Y1327 VanDerWaalsContact CD2-CE1 3.43Å
1238	E	75.1	Confident	63.2	Low	101 Å²	101	65.9 Å²	65.9	47%	0.472	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	135.9	175.5	-59.5	-165.7	161.1	0	0	109.4	G1223 R1236	G1223-E1238 CarbonylContact O-C 3.45Å; G1223-E1238 WeakPolarHBondContact O-CA 3.46Å; R1236-E1238 WeakPolarHBondContact CD-OE1 3.27Å; R1236-E1238 HydrophobicContact CG-CG 4.12Å; R1236-E1238 IonicContact CZ-OE1 3.52Å; R1236-E1238 IonicContact NE-OE1 2.66Å; R1236-E1238 PolarHBondContact NE-OE1 2.78Å; R1236-E1238 IonicContact NH1-OE1 3.65Å; R1236-E1238 PolarHBondContact NH1-OE1 2.88Å
1239	F	77.9	Confident	63.8	Low	30 Å²	30	68.3 Å²	68.3	13%	0.132	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	127.6	-176.2	-55	-60.1	0	0	0	109.6	G1223 K1225 L1237 A1241 E1263 S1266 Y1268 Y1327	G1223-F1239 PolarHBondContact N-O 3.43Å; G1223-F1239 PolarHBondContact O-N 2.9Å; K1225-F1239 HydrophobicContact CB-CE2 3.71Å; K1225-F1239 HydrophobicContact CB-CZ 3.61Å; K1225-F1239 HydrophobicContact CD-CZ 3.9Å; K1225-F1239 HydrophobicContact CG-CZ 4.45Å; L1237-F1239 HydrophobicContact CD2-CD1 4.44Å; L1237-F1239 HydrophobicContact CD2-CE1 3.51Å; L1237-F1239 HydrophobicContact CD2-CZ 4Å; L1237-F1239 HydrophobicContact CG-CD1 4.43Å; L1237-F1239 HydrophobicContact CG-CE1 3.81Å; L1237-F1239 HydrophobicContact CG-CZ 4.25Å; F1239-A1241 PolarHBondContact O-N 2.81Å; F1239-E1263 HydrophobicContact CD1-CG 4.15Å; F1239-E1263 HydrophobicContact CD2-CB 4.5Å; F1239-E1263 HydrophobicContact CE1-CB 4.02Å; F1239-E1263 HydrophobicContact CE1-CG 3.6Å; F1239-E1263 HydrophobicContact CE2-CB 3.9Å; F1239-E1263 HydrophobicContact CE2-CG 4.39Å; F1239-E1263 HydrophobicContact CZ-CB 3.62Å; F1239-E1263 HydrophobicContact CZ-CG 3.73Å; F1239-S1266 WeakPolarHBondContact CE2-OG 3.07Å; F1239-Y1268 HydrophobicContact CB-CE1 4.24Å; F1239-Y1268 HydrophobicContact CD2-CE1 4.07Å; F1239-Y1268 AromaticContact CD2-CZ 3.83Å; F1239-Y1268 WeakPolarHBondContact CD2-OH 3.31Å; F1239-Y1268 HydrophobicContact CG-CE1 4.48Å; F1239-Y1327 HydrophobicContact CE1-CE1 4.5Å
1240	P	74	Confident	63.6	Low	112 Å²	112	71 Å²	71	73%	0.727	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.1	136.4	-174.8	25.7	-34.5	0	0	0	110.9	R1242	P1240-R1242 PolarHBondContact O-N 3.5Å
1241	A	75.7	Confident	64	Low	45 Å²	45	67 Å²	67	37%	0.372	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	103.3	-174.1	0	0	0	0	0	112.1	R1220 I1221 F1239	R1220-A1241 HydrophobicContact CG-CB 4.02Å; I1221-A1241 CarbonylContact O-C 3.41Å; I1221-A1241 VanDerWaalsContact O-CA 3.3Å; I1221-A1241 WeakPolarHBondContact O-CA 3.27Å; F1239-A1241 PolarHBondContact O-N 2.81Å
1242	R	78	Confident	63.9	Low	122 Å²	122	72.7 Å²	72.7	46%	0.46	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	124.4	174.4	-61.4	-175.3	-173.4	160.1	6.3	109.1	R1220 I1221 P1240 S1260 D1261	R1220-R1242 CarbonylContact C-O 3.59Å; R1220-R1242 VanDerWaalsContact CA-O 3.3Å; R1220-R1242 WeakPolarHBondContact CA-O 3.3Å; I1221-R1242 PolarHBondContact N-O 2.78Å; I1221-R1242 PolarHBondContact O-N 2.89Å; P1240-R1242 PolarHBondContact O-N 3.5Å; R1242-S1260 PolarHBondContact NH1-O 3.11Å; R1242-D1261 VanDerWaalsContact CZ-O 3.24Å; R1242-D1261 PolarHBondContact NH1-O 3.02Å; R1242-D1261 PolarHBondContact NH2-O 3.36Å
1243	S	80.2	Confident	64.1	Low	78 Å²	78	76.2 Å²	76.2	55%	0.545	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	129.5	174.2	-59.3	0	0	0	0	110.2	L1219 R1220	L1219-S1243 CarbonylContact O-C 3.49Å; L1219-S1243 VanDerWaalsContact O-CA 3.31Å; L1219-S1243 WeakPolarHBondContact O-CA 3.17Å; R1220-S1243 WeakPolarHBondContact CG-OG 3.31Å
1244	V	79.2	Confident	64.5	Low	45 Å²	45	75.5 Å²	75.5	27%	0.273	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	130.3	177.6	-173	0	0	0	0	108.5	K1218 L1219 V1246 Y1257	K1218-V1244 CarbonylContact C-O 3.27Å; K1218-V1244 WeakPolarHBondContact CA-O 3.22Å; L1219-V1244 PolarHBondContact N-O 2.83Å; L1219-V1244 PolarHBondContact O-N 2.93Å; V1244-V1246 HydrophobicContact CG1-CG2 3.8Å; V1244-Y1257 HydrophobicContact CG1-CE1 4.32Å
1245	S	79.3	Confident	65.4	Low	76 Å²	76	72.8 Å²	72.8	53%	0.531	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.3	169.6	-53.8	0	0	0	0	108.4
1246	V	72.5	Confident	66.2	Low	10 Å²	10	70.5 Å²	70.5	6%	0.061	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	121.2	-176.3	-165.3	0	0	0	0	108.2	G1216 F1217 V1244 A1250 L1251 Y1257	G1216-V1246 CarbonylContact C-O 3.45Å; G1216-V1246 WeakPolarHBondContact CA-O 3.49Å; F1217-V1246 HydrophobicContact CD1-CB 4.4Å; F1217-V1246 HydrophobicContact CD2-CB 4.46Å; F1217-V1246 HydrophobicContact CD2-CG2 4.44Å; F1217-V1246 HydrophobicContact CE1-CB 3.97Å; F1217-V1246 HydrophobicContact CE1-CG1 4.27Å; F1217-V1246 HydrophobicContact CE2-CB 4.01Å; F1217-V1246 HydrophobicContact CE2-CG2 3.81Å; F1217-V1246 HydrophobicContact CZ-CB 3.74Å; F1217-V1246 HydrophobicContact CZ-CG1 4.1Å; F1217-V1246 HydrophobicContact CZ-CG2 3.92Å; F1217-V1246 PolarHBondContact N-O 2.68Å; F1217-V1246 PolarHBondContact O-N 3.01Å; V1244-V1246 HydrophobicContact CG1-CG2 3.8Å; V1246-A1250 HydrophobicContact CG1-CB 4.21Å; V1246-L1251 HydrophobicContact CG1-CD1 3.66Å; V1246-Y1257 HydrophobicContact CB-CE2 4.43Å; V1246-Y1257 HydrophobicContact CG1-CD2 4.05Å; V1246-Y1257 HydrophobicContact CG1-CE2 3.94Å; V1246-Y1257 HydrophobicContact CG2-CD2 3.81Å; V1246-Y1257 HydrophobicContact CG2-CE1 4.39Å; V1246-Y1257 HydrophobicContact CG2-CE2 3.56Å; V1246-Y1257 HydrophobicContact CG2-CG 4.35Å
1247	T	70.8	Confident	66.8	Low	67 Å²	67	70.4 Å²	70.4	41%	0.411	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	149.3	174.6	46.9	0	0	0	0	110.7	E1215 A1249 A1250 L1251 Y1275	E1215-T1247 CarbonylContact O-C 3.59Å; E1215-T1247 VanDerWaalsContact O-CA 3.3Å; E1215-T1247 WeakPolarHBondContact O-CA 3.12Å; T1247-A1249 PolarHBondContact O-N 3.43Å; T1247-A1250 WeakPolarHBondContact O-CB 3.26Å; T1247-A1250 PolarHBondContact O-N 2.97Å; T1247-L1251 WeakPolarHBondContact O-CD1 3.31Å; T1247-Y1275 WeakPolarHBondContact CG2-OH 3.42Å
1248	Y	64.3	Low	67.4	Low	39 Å²	39	70.8 Å²	70.8	15%	0.153	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-64.1	-23.4	-178.1	-80.7	-77.4	0	0	0	114.1	W1205 L1214 E1215 G1216 A1250 L1251 Y1255	W1205-Y1248 WeakPolarHBondContact CH2-OH 3.33Å; W1205-Y1248 HydrophobicContact CZ2-CE1 4.29Å; W1205-Y1248 AromaticContact CZ2-CZ 3.88Å; W1205-Y1248 WeakPolarHBondContact CZ2-OH 2.93Å; L1214-Y1248 HydrophobicContact CB-CD2 4.13Å; L1214-Y1248 HydrophobicContact CB-CE2 3.6Å; L1214-Y1248 HydrophobicContact CD1-CE2 4.21Å; L1214-Y1248 HydrophobicContact CD2-CE2 4.34Å; L1214-Y1248 HydrophobicContact CG-CE2 4.23Å; L1214-Y1248 WeakPolarHBondContact O-CD2 3.49Å; E1215-Y1248 PolarHBondContact O-N 3.11Å; G1216-Y1248 VanDerWaalsContact CA-CD2 3.44Å; Y1248-A1250 PolarHBondContact O-N 3.34Å; Y1248-L1251 PolarHBondContact O-N 3.36Å; Y1248-Y1255 HydrophobicContact CD1-CD1 4.21Å; Y1248-Y1255 AromaticContact CD1-CE1 3.75Å; Y1248-Y1255 HydrophobicContact CD1-CE1 3.75Å; Y1248-Y1255 AromaticContact CE1-CD1 3.71Å; Y1248-Y1255 HydrophobicContact CE1-CD1 3.71Å; Y1248-Y1255 AromaticContact CE1-CE1 3.43Å; Y1248-Y1255 HydrophobicContact CE1-CE1 3.43Å; Y1248-Y1255 VanDerWaalsContact CE1-CE1 3.43Å
1249	A	55.9	Low	67.7	Low	84 Å²	84	66.6 Å²	66.6	69%	0.694	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-55.1	-16.8	170.7	0	0	0	0	0	113.9	T1247 H1252	T1247-A1249 PolarHBondContact O-N 3.43Å; A1249-H1252 PolarHBondContact O-CE1 3.06Å; A1249-H1252 VanDerWaalsContact O-CE1 3.24Å
1250	A	51.3	Low	67.9	Low	65 Å²	65	68 Å²	68	54%	0.537	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-91.6	-13.6	176.5	0	0	0	0	0	114.9	V1246 T1247 Y1248	V1246-A1250 HydrophobicContact CG1-CB 4.21Å; T1247-A1250 WeakPolarHBondContact O-CB 3.26Å; T1247-A1250 PolarHBondContact O-N 2.97Å; Y1248-A1250 PolarHBondContact O-N 3.34Å
1251	L	50.4	Low	68.2	Low	26 Å²	26	68.3 Å²	68.3	14%	0.136	41%	0.411	C	S	.	.			trans	-105.6	76.4	-170	-69.1	96.8	0	0	0	113.6	F1217 V1246 T1247 Y1248 S1253	F1217-L1251 HydrophobicContact CE1-CD1 3.61Å; F1217-L1251 HydrophobicContact CE1-CD2 3.7Å; F1217-L1251 HydrophobicContact CE1-CG 4.32Å; F1217-L1251 HydrophobicContact CZ-CD1 4.23Å; F1217-L1251 HydrophobicContact CZ-CD2 3.97Å; V1246-L1251 HydrophobicContact CG1-CD1 3.66Å; T1247-L1251 WeakPolarHBondContact O-CD1 3.31Å; Y1248-L1251 PolarHBondContact O-N 3.36Å; L1251-S1253 PolarHBondContact O-N 3.42Å
1252	H	41	Very low	68.5	Low	177 Å²	177	66.5 Å²	66.5	82%	0.819	40%	0.395	S	S	*	.	S	Bend	trans	-74.6	2.3	177.9	-70.4	78.1	0	0	0	114.7	A1249	A1249-H1252 PolarHBondContact O-CE1 3.06Å; A1249-H1252 VanDerWaalsContact O-CE1 3.24Å
1253	S	41.1	Very low	68.5	Low	108 Å²	108	62.9 Å²	62.9	76%	0.755	38%	0.383	S	S	*	.	S	Bend	trans	-150.8	60.6	-174	51.9	0	0	0	0	114.3	L1251	L1251-S1253 PolarHBondContact O-N 3.42Å
1254	G	48.5	Very low	68.2	Low	51 Å²	51	60.1 Å²	60.1	53%	0.526	36%	0.364	S	S	.	.	S	Bend	trans	70.5	69.9	158.8	0	0	0	0	0	115.9	T1256	G1254-T1256 PolarHBondContact O-N 3.09Å; G1254-T1256 PolarHBondContact O-OG1 3.23Å
1255	Y	65.5	Low	67.9	Low	68 Å²	68	62.4 Å²	62.4	27%	0.267	37%	0.374	S	S	.	.	S	Bend	trans	44	43.1	159.1	-53.4	-30.8	0	0	0	115.5	T1204 W1205 Q1207 Y1248	T1204-Y1255 CarbonylContact C-O 3.54Å; T1204-Y1255 WeakPolarHBondContact CA-O 3.18Å; W1205-Y1255 PolarHBondContact N-O 2.94Å; W1205-Y1255 WeakPolarHBondContact O-CB 3.38Å; Q1207-Y1255 HydrophobicContact CB-CD2 4.24Å; Q1207-Y1255 HydrophobicContact CB-CE2 3.58Å; Q1207-Y1255 PolarHBondContact OE1-OH 3.2Å; Y1248-Y1255 HydrophobicContact CD1-CD1 4.21Å; Y1248-Y1255 AromaticContact CD1-CE1 3.75Å; Y1248-Y1255 HydrophobicContact CD1-CE1 3.75Å; Y1248-Y1255 AromaticContact CE1-CD1 3.71Å; Y1248-Y1255 HydrophobicContact CE1-CD1 3.71Å; Y1248-Y1255 AromaticContact CE1-CE1 3.43Å; Y1248-Y1255 HydrophobicContact CE1-CE1 3.43Å; Y1248-Y1255 VanDerWaalsContact CE1-CE1 3.43Å
1256	T	72.9	Confident	67.9	Low	42 Å²	42	58.9 Å²	58.9	26%	0.258	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	130.8	179.5	-61	0	0	0	0	110	K1202 V1203 T1204 G1254	K1202-T1256 HydrophobicContact CD-CG2 4.18Å; K1202-T1256 VanDerWaalsContact CE-CG2 3.41Å; K1202-T1256 HydrophobicContact CG-CG2 3.66Å; V1203-T1256 CarbonylContact O-C 3.56Å; V1203-T1256 WeakPolarHBondContact O-CA 2.91Å; T1204-T1256 WeakPolarHBondContact CG2-OG1 3.47Å; T1204-T1256 VanDerWaalsContact OG1-CG2 3.24Å; T1204-T1256 WeakPolarHBondContact OG1-CG2 3.44Å; T1204-T1256 PolarHBondContact OG1-OG1 2.92Å; G1254-T1256 PolarHBondContact O-N 3.09Å; G1254-T1256 PolarHBondContact O-OG1 3.23Å
1257	Y	79.9	Confident	68.4	Low	71 Å²	71	61.9 Å²	61.9	28%	0.278	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	127.1	-178.5	-166.6	-94.8	0	0	0	110.5	V1203 F1217 L1219 V1244 V1246 V1259	V1203-Y1257 WeakPolarHBondContact CB-O 3.41Å; V1203-Y1257 PolarHBondContact N-O 3.4Å; V1203-Y1257 PolarHBondContact O-N 2.88Å; F1217-Y1257 HydrophobicContact CE2-CG 4.4Å; F1217-Y1257 HydrophobicContact CZ-CD2 4.31Å; F1217-Y1257 HydrophobicContact CZ-CG 4.29Å; L1219-Y1257 HydrophobicContact CD2-CD1 3.52Å; L1219-Y1257 HydrophobicContact CD2-CE1 4.14Å; L1219-Y1257 HydrophobicContact CD2-CG 4.4Å; V1244-Y1257 HydrophobicContact CG1-CE1 4.32Å; V1246-Y1257 HydrophobicContact CB-CE2 4.43Å; V1246-Y1257 HydrophobicContact CG1-CD2 4.05Å; V1246-Y1257 HydrophobicContact CG1-CE2 3.94Å; V1246-Y1257 HydrophobicContact CG2-CD2 3.81Å; V1246-Y1257 HydrophobicContact CG2-CE1 4.39Å; V1246-Y1257 HydrophobicContact CG2-CE2 3.56Å; V1246-Y1257 HydrophobicContact CG2-CG 4.35Å; Y1257-V1259 HydrophobicContact CD1-CG2 3.84Å; Y1257-V1259 HydrophobicContact CE1-CG2 3.81Å
1258	T	81.7	Confident	69.1	Low	69 Å²	69	59 Å²	59	42%	0.423	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	126.1	176.6	-54.9	0	0	0	0	109.7	S1200 V1201	S1200-T1258 VanDerWaalsContact OG-CG2 3.27Å; S1200-T1258 WeakPolarHBondContact OG-CG2 3.44Å; V1201-T1258 CarbonylContact O-C 3.34Å; V1201-T1258 WeakPolarHBondContact O-CA 3.32Å
1259	V	81.4	Confident	69.9	Low	13 Å²	13	59.5 Å²	59.5	8%	0.079	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	113.8	171	180	0	0	0	0	108.6	S1200 V1201 L1219 I1221 Y1257 L1262	S1200-V1259 CarbonylContact C-O 3.6Å; S1200-V1259 WeakPolarHBondContact CA-O 3.28Å; S1200-V1259 WeakPolarHBondContact CB-O 3.39Å; V1201-V1259 PolarHBondContact N-O 3.05Å; V1201-V1259 PolarHBondContact O-N 2.72Å; L1219-V1259 HydrophobicContact CD2-CG2 3.43Å; L1219-V1259 VanDerWaalsContact CD2-CG2 3.43Å; I1221-V1259 HydrophobicContact CD1-CB 3.71Å; I1221-V1259 HydrophobicContact CD1-CG1 4.12Å; I1221-V1259 HydrophobicContact CD1-CG2 3.46Å; I1221-V1259 VanDerWaalsContact CD1-CG2 3.46Å; I1221-V1259 HydrophobicContact CG1-CG2 4.29Å; Y1257-V1259 HydrophobicContact CD1-CG2 3.84Å; Y1257-V1259 HydrophobicContact CE1-CG2 3.81Å; V1259-L1262 HydrophobicContact CB-CD1 4.39Å; V1259-L1262 HydrophobicContact CG1-CD1 4.18Å; V1259-L1262 HydrophobicContact CG1-CD2 3.94Å; V1259-L1262 HydrophobicContact CG1-CG 4.15Å
1260	S	82.6	Confident	71.2	Confident	61 Å²	61	55.5 Å²	55.5	43%	0.427	32%	0.322	S	S	.	.			trans	-83.7	-178.7	174	54	0	0	0	0	112.6	T1199 R1242 L1262	T1199-S1260 CarbonylContact O-C 3.51Å; R1242-S1260 PolarHBondContact NH1-O 3.11Å; S1260-L1262 PolarHBondContact O-N 3.04Å
1261	D	79.6	Confident	72.8	Confident	118 Å²	118	54 Å²	54	63%	0.631	30%	0.304	S	S	*	.	S	Bend	trans	61.3	33.8	168.8	-44.1	-65.9	0	0	0	112.8	T1199 R1242	T1199-D1261 PolarHBondContact O-N 2.79Å; T1199-D1261 VanDerWaalsContact O-N 3.14Å; R1242-D1261 VanDerWaalsContact CZ-O 3.24Å; R1242-D1261 PolarHBondContact NH1-O 3.02Å; R1242-D1261 PolarHBondContact NH2-O 3.36Å
1262	L	82.6	Confident	74.4	Confident	7 Å²	7	52.8 Å²	52.8	4%	0.037	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-94.4	149.1	175.3	-60.2	-177.3	0	0	0	110.1	T1199 V1201 I1221 V1259 S1260 Y1268 T1293	T1199-L1262 WeakPolarHBondContact CA-O 3.33Å; T1199-L1262 PolarHBondContact O-N 3.11Å; V1201-L1262 HydrophobicContact CB-CD1 3.62Å; V1201-L1262 HydrophobicContact CG2-CD1 3.47Å; V1201-L1262 VanDerWaalsContact CG2-CD1 3.47Å; I1221-L1262 HydrophobicContact CG2-CD1 4.4Å; I1221-L1262 HydrophobicContact CG2-CD2 4.29Å; V1259-L1262 HydrophobicContact CB-CD1 4.39Å; V1259-L1262 HydrophobicContact CG1-CD1 4.18Å; V1259-L1262 HydrophobicContact CG1-CD2 3.94Å; V1259-L1262 HydrophobicContact CG1-CG 4.15Å; S1260-L1262 PolarHBondContact O-N 3.04Å; L1262-Y1268 HydrophobicContact CB-CD2 4.39Å; L1262-Y1268 HydrophobicContact CB-CE2 3.71Å; L1262-Y1268 HydrophobicContact CD1-CD1 4.5Å; L1262-Y1268 HydrophobicContact CD1-CD2 4.21Å; L1262-Y1268 HydrophobicContact CD1-CE2 4.31Å; L1262-Y1268 HydrophobicContact CD1-CG 4.3Å; L1262-Y1268 HydrophobicContact CD2-CD1 4.31Å; L1262-Y1268 HydrophobicContact CD2-CE1 3.83Å; L1262-Y1268 HydrophobicContact CD2-CE2 4.48Å; L1262-Y1268 HydrophobicContact CG-CE2 4.39Å; L1262-T1293 HydrophobicContact CB-CG2 3.98Å
1263	E	78.9	Confident	76.3	Confident	45 Å²	45	44.3 Å²	44.3	21%	0.21	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-71.2	137.4	-178.1	-84.1	-77.3	147.7	0	0	111.5	K1225 F1239 S1266 Y1268 T1293 Y1327	K1225-E1263 IonicContact NZ-OE2 3.14Å; K1225-E1263 PolarHBondContact NZ-OE2 3.35Å; F1239-E1263 HydrophobicContact CD1-CG 4.15Å; F1239-E1263 HydrophobicContact CD2-CB 4.5Å; F1239-E1263 HydrophobicContact CE1-CB 4.02Å; F1239-E1263 HydrophobicContact CE1-CG 3.6Å; F1239-E1263 HydrophobicContact CE2-CB 3.9Å; F1239-E1263 HydrophobicContact CE2-CG 4.39Å; F1239-E1263 HydrophobicContact CZ-CB 3.62Å; F1239-E1263 HydrophobicContact CZ-CG 3.73Å; E1263-S1266 VanDerWaalsContact O-CB 3.25Å; E1263-S1266 WeakPolarHBondContact O-CB 3.4Å; E1263-S1266 PolarHBondContact O-OG 3Å; E1263-Y1268 WeakPolarHBondContact CB-OH 3.34Å; E1263-Y1268 PolarHBondContact N-OH 3.3Å; E1263-T1293 WeakPolarHBondContact O-CB 3.36Å; E1263-T1293 PolarHBondContact O-OG1 3.47Å; E1263-Y1327 PolarHBondContact OE1-OH 3.28Å; E1263-Y1327 WeakPolarHBondContact OE2-CE2 3.34Å
1264	P	72.3	Confident	78	Confident	21 Å²	21	39.2 Å²	39.2	14%	0.136	22%	0.222	C	C	.	.	S	Bend	trans	-70	158.2	178.4	28.7	-36.6	0	0	0	113	D1198 K1225 S1266 Q1294 Q1296	D1198-P1264 WeakPolarHBondContact O-CA 3.48Å; D1198-P1264 WeakPolarHBondContact O-CB 3.48Å; K1225-P1264 WeakPolarHBondContact CE-O 3.21Å; K1225-P1264 PolarHBondContact NZ-O 2.97Å; P1264-S1266 VanDerWaalsContact C-N 3.31Å; P1264-S1266 PolarHBondContact O-N 3.17Å; P1264-S1266 PolarHBondContact O-OG 3.36Å; P1264-Q1294 WeakPolarHBondContact CB-O 3.27Å; P1264-Q1296 HydrophobicContact CB-CB 3.54Å; P1264-Q1296 HydrophobicContact CG-CB 3.87Å
1265	N	74.4	Confident	79.2	Confident	92 Å²	92	38.1 Å²	38.1	49%	0.492	20%	0.203	S	C	.	.	S	Bend	trans	50.4	48.4	-179	-169.3	18.7	0	0	0	112.6	T1293 Q1294 M1295	N1265-T1293 WeakPolarHBondContact CA-O 3.3Å; N1265-T1293 PolarHBondContact N-O 2.89Å; N1265-T1293 PolarHBondContact N-OG1 2.86Å; N1265-Q1294 PolarHBondContact N-O 3.39Å; N1265-M1295 HydrophobicContact CB-CB 4.32Å; N1265-M1295 HydrophobicContact CB-CG 4.45Å
1266	S	78.1	Confident	79.1	Confident	3 Å²	3	35.9 Å²	35.9	2%	0.021	19%	0.194	C	C	.	.			trans	-135.4	142.7	-171	-61	0	0	0	0	111.7	K1225 F1239 E1263 P1264 F1292 T1293	K1225-S1266 WeakPolarHBondContact CD-OG 3.32Å; F1239-S1266 WeakPolarHBondContact CE2-OG 3.07Å; E1263-S1266 VanDerWaalsContact O-CB 3.25Å; E1263-S1266 WeakPolarHBondContact O-CB 3.4Å; E1263-S1266 PolarHBondContact O-OG 3Å; P1264-S1266 VanDerWaalsContact C-N 3.31Å; P1264-S1266 PolarHBondContact O-N 3.17Å; P1264-S1266 PolarHBondContact O-OG 3.36Å; S1266-F1292 CarbonylContact O-C 3.57Å; S1266-F1292 WeakPolarHBondContact O-CA 3.39Å; S1266-T1293 WeakPolarHBondContact CB-OG1 3.44Å; S1266-T1293 PolarHBondContact N-OG1 3.34Å; S1266-T1293 PolarHBondContact O-N 2.89Å; S1266-T1293 PolarHBondContact O-OG1 3.42Å; S1266-T1293 VanDerWaalsContact O-OG1 3.14Å
1267	V	82.6	Confident	78.4	Confident	72 Å²	72	37.2 Å²	37.2	44%	0.436	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	128.8	174.5	-178.2	0	0	0	0	109	G1223 S1224 C1291	G1223-V1267 CarbonylContact C-O 3.38Å; G1223-V1267 WeakPolarHBondContact CA-O 3.48Å; S1224-V1267 PolarHBondContact N-O 2.77Å; S1224-V1267 PolarHBondContact O-N 3.13Å; V1267-C1291 CarbonylContact C-O 3.53Å; V1267-C1291 WeakPolarHBondContact CA-O 3.22Å
1268	Y	85.4	Confident	76.9	Confident	6 Å²	6	41.7 Å²	41.7	2%	0.024	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	127.5	179.8	-79.9	-77.1	0	0	0	111.3	I1221 G1222 F1239 L1262 E1263 S1290 C1291 T1293	I1221-Y1268 HydrophobicContact CG2-CD1 3.42Å; I1221-Y1268 VanDerWaalsContact CG2-CD1 3.42Å; I1221-Y1268 HydrophobicContact CG2-CE1 4.22Å; I1221-Y1268 HydrophobicContact CG2-CG 4.02Å; G1222-Y1268 CarbonylContact O-C 3.56Å; G1222-Y1268 WeakPolarHBondContact O-CA 2.99Å; G1222-Y1268 VanDerWaalsContact O-CD1 3.31Å; G1222-Y1268 WeakPolarHBondContact O-CD1 3.46Å; F1239-Y1268 HydrophobicContact CB-CE1 4.24Å; F1239-Y1268 HydrophobicContact CD2-CE1 4.07Å; F1239-Y1268 AromaticContact CD2-CZ 3.83Å; F1239-Y1268 WeakPolarHBondContact CD2-OH 3.31Å; F1239-Y1268 HydrophobicContact CG-CE1 4.48Å; L1262-Y1268 HydrophobicContact CB-CD2 4.39Å; L1262-Y1268 HydrophobicContact CB-CE2 3.71Å; L1262-Y1268 HydrophobicContact CD1-CD1 4.5Å; L1262-Y1268 HydrophobicContact CD1-CD2 4.21Å; L1262-Y1268 HydrophobicContact CD1-CE2 4.31Å; L1262-Y1268 HydrophobicContact CD1-CG 4.3Å; L1262-Y1268 HydrophobicContact CD2-CD1 4.31Å; L1262-Y1268 HydrophobicContact CD2-CE1 3.83Å; L1262-Y1268 HydrophobicContact CD2-CE2 4.48Å; L1262-Y1268 HydrophobicContact CG-CE2 4.39Å; E1263-Y1268 WeakPolarHBondContact CB-OH 3.34Å; E1263-Y1268 PolarHBondContact N-OH 3.3Å; Y1268-S1290 CarbonylContact O-C 3.48Å; Y1268-S1290 VanDerWaalsContact O-CA 3.26Å; Y1268-S1290 WeakPolarHBondContact O-CA 3.15Å; Y1268-C1291 PolarHBondContact N-O 3.02Å; Y1268-C1291 PolarHBondContact O-N 3.43Å; Y1268-T1293 HydrophobicContact CD2-CG2 3.9Å; Y1268-T1293 HydrophobicContact CE2-CG2 3.86Å
1269	D	81.6	Confident	75.3	Confident	50 Å²	50	44 Å²	44	27%	0.267	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	117.8	172.2	-67.4	-40	0	0	0	109	I1221 G1222 S1290	I1221-D1269 WeakPolarHBondContact CA-O 3.39Å; G1222-D1269 PolarHBondContact N-O 2.84Å; G1222-D1269 VanDerWaalsContact N-O 3.09Å; G1222-D1269 PolarHBondContact O-N 3.18Å; D1269-S1290 WeakPolarHBondContact OD1-CB 3.35Å; D1269-S1290 PolarHBondContact OD1-OG 2.88Å
1270	V	84.1	Confident	73.6	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	114.8	-171.7	-177.3	0	0	0	0	109.5	C1194 V1201 V1203 L1219 I1221 T1288 T1289	C1194-V1270 HydrophobicContact CB-CG2 4.37Å; V1201-V1270 HydrophobicContact CG1-CG2 3.94Å; V1203-V1270 HydrophobicContact CB-CG1 4.36Å; V1203-V1270 HydrophobicContact CG1-CG1 3.81Å; V1203-V1270 HydrophobicContact CG2-CG1 3.58Å; L1219-V1270 HydrophobicContact CD1-CG1 3.75Å; I1221-V1270 HydrophobicContact CD1-CB 4.45Å; I1221-V1270 HydrophobicContact CD1-CG1 4.07Å; I1221-V1270 HydrophobicContact CD1-CG2 3.82Å; I1221-V1270 HydrophobicContact CG1-CB 4.28Å; I1221-V1270 HydrophobicContact CG1-CG1 4Å; I1221-V1270 HydrophobicContact CG1-CG2 4.02Å; V1270-T1288 CarbonylContact O-C 3.5Å; V1270-T1288 VanDerWaalsContact O-CA 3.23Å; V1270-T1288 WeakPolarHBondContact O-CA 3.19Å; V1270-T1289 WeakPolarHBondContact CA-O 3.29Å; V1270-T1289 HydrophobicContact CB-CG2 4.06Å; V1270-T1289 WeakPolarHBondContact CB-O 3.33Å; V1270-T1289 HydrophobicContact CG1-CG2 4.45Å; V1270-T1289 PolarHBondContact N-O 3.25Å; V1270-T1289 PolarHBondContact O-N 2.8Å
1271	Q	84	Confident	72.1	Confident	33 Å²	33	53.1 Å²	53.1	15%	0.154	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	140	176.9	-33.7	-168.1	-69.1	0	0	110.2	L1219 R1220 W1286 E1287 T1288	L1219-Q1271 CarbonylContact C-O 3.59Å; L1219-Q1271 WeakPolarHBondContact CA-O 3.46Å; R1220-Q1271 HydrophobicContact CB-CB 4.23Å; R1220-Q1271 PolarHBondContact N-O 3.28Å; R1220-Q1271 VanDerWaalsContact NH1-OE1 3.1Å; R1220-Q1271 PolarHBondContact O-N 2.89Å; Q1271-W1286 HydrophobicContact CB-CD2 4.36Å; Q1271-W1286 HydrophobicContact CB-CE3 3.49Å; Q1271-W1286 VanDerWaalsContact CB-CE3 3.49Å; Q1271-W1286 HydrophobicContact CB-CZ3 4.04Å; Q1271-E1287 CarbonylContact C-O 3.43Å; Q1271-E1287 VanDerWaalsContact CA-O 3.23Å; Q1271-E1287 WeakPolarHBondContact CA-O 3.21Å; Q1271-T1288 HydrophobicContact CG-CG2 4.08Å
1272	L	84.3	Confident	70.8	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	129.5	177.1	-160.5	156	0	0	0	111.7	V1189 L1192 V1203 W1205 F1217 K1218 L1219 W1286 E1287	V1189-L1272 HydrophobicContact CG1-CD2 4.01Å; V1189-L1272 HydrophobicContact CG2-CD2 3.85Å; L1192-L1272 HydrophobicContact CD1-CB 3.85Å; L1192-L1272 HydrophobicContact CD1-CD1 3.73Å; L1192-L1272 HydrophobicContact CD1-CG 4.4Å; L1192-L1272 HydrophobicContact CD2-CB 4.03Å; V1203-L1272 HydrophobicContact CG1-CD1 4.33Å; W1205-L1272 HydrophobicContact CB-CD1 4.29Å; W1205-L1272 VanDerWaalsContact CD1-CD1 3.44Å; W1205-L1272 HydrophobicContact CD2-CD1 4.1Å; W1205-L1272 HydrophobicContact CD2-CD2 3.91Å; W1205-L1272 HydrophobicContact CE3-CD2 4.18Å; W1205-L1272 HydrophobicContact CG-CD1 3.74Å; W1205-L1272 HydrophobicContact CG-CD2 4.38Å; W1205-L1272 HydrophobicContact CH2-CD2 3.99Å; W1205-L1272 HydrophobicContact CZ2-CD2 3.8Å; W1205-L1272 HydrophobicContact CZ3-CD2 4.21Å; F1217-L1272 HydrophobicContact CB-CD2 3.83Å; F1217-L1272 HydrophobicContact CB-CG 4.43Å; F1217-L1272 HydrophobicContact CD2-CD1 3.9Å; F1217-L1272 HydrophobicContact CD2-CD2 4.17Å; F1217-L1272 HydrophobicContact CD2-CG 3.92Å; F1217-L1272 HydrophobicContact CE2-CD1 4.2Å; F1217-L1272 HydrophobicContact CG-CD2 4.18Å; F1217-L1272 HydrophobicContact CG-CG 4.44Å; K1218-L1272 WeakPolarHBondContact O-CA 3.18Å; L1219-L1272 HydrophobicContact CD1-CB 4.13Å; L1219-L1272 HydrophobicContact CD1-CD1 3.87Å; L1219-L1272 HydrophobicContact CD1-CG 4.11Å; L1272-W1286 CarbonylContact O-C 3.5Å; L1272-W1286 WeakPolarHBondContact O-CA 3.39Å; L1272-E1287 PolarHBondContact N-O 2.85Å; L1272-E1287 PolarHBondContact O-N 2.74Å
1273	S	80.7	Confident	69.8	Low	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	129.1	174.9	170.2	0	0	0	0	111	F1217 K1218 S1284 W1286	F1217-S1273 CarbonylContact C-O 3.5Å; F1217-S1273 VanDerWaalsContact CA-O 3.28Å; F1217-S1273 WeakPolarHBondContact CA-O 3.44Å; F1217-S1273 WeakPolarHBondContact CB-O 3.35Å; K1218-S1273 PolarHBondContact N-O 3.26Å; K1218-S1273 PolarHBondContact O-N 3.04Å; S1273-S1284 VanDerWaalsContact CA-OG 3.28Å; S1273-S1284 WeakPolarHBondContact CA-OG 3.47Å; S1273-S1284 PolarHBondContact OG-O 3.25Å; S1273-S1284 PolarHBondContact OG-OG 2.96Å; S1273-W1286 VanDerWaalsContact CB-CD2 3.5Å
1274	A	76	Confident	69.2	Low	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	142	178.5	0	0	0	0	0	111.5	W1205 L1214 Q1283 S1284	W1205-A1274 HydrophobicContact CH2-CB 3.81Å; W1205-A1274 HydrophobicContact CZ3-CB 4.44Å; L1214-A1274 HydrophobicContact CD1-CB 3.72Å; L1214-A1274 HydrophobicContact CD2-CB 3.61Å; L1214-A1274 HydrophobicContact CG-CB 4.35Å; A1274-Q1283 CarbonylContact O-C 3.52Å; A1274-Q1283 WeakPolarHBondContact O-CA 3.33Å; A1274-S1284 PolarHBondContact N-OG 3.08Å; A1274-S1284 PolarHBondContact O-N 3.25Å
1275	Y	74.4	Confident	68.9	Low	29 Å²	29	57.4 Å²	57.4	11%	0.114	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	148.7	-178.8	70.4	-94.6	0	0	0	113.5	L1214 E1215 G1216 F1217 K1218 T1247	L1214-Y1275 VanDerWaalsContact CD2-C 3.49Å; L1214-Y1275 WeakPolarHBondContact CD2-O 3.14Å; E1215-Y1275 HydrophobicContact CB-CD2 4.38Å; E1215-Y1275 HydrophobicContact CB-CE2 4.22Å; E1215-Y1275 HydrophobicContact CG-CE2 4.47Å; E1215-Y1275 PolarHBondContact N-O 3.35Å; G1216-Y1275 VanDerWaalsContact C-CD1 3.45Å; G1216-Y1275 PolarHBondContact N-O 2.88Å; G1216-Y1275 VanDerWaalsContact N-O 3.08Å; G1216-Y1275 PolarHBondContact O-N 3.33Å; F1217-Y1275 VanDerWaalsContact N-CE1 3.26Å; K1218-Y1275 HydrophobicContact CG-CD1 3.94Å; K1218-Y1275 HydrophobicContact CG-CE1 4.22Å; T1247-Y1275 WeakPolarHBondContact CG2-OH 3.42Å
1276	Y	63.1	Low	68.9	Low	20 Å²	20	57.6 Å²	57.6	8%	0.078	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	171.1	-176	-51.2	-95	0	0	0	110.1	F1187 T1211 L1214 M1282	F1187-Y1276 HydrophobicContact CD1-CE1 4.31Å; F1187-Y1276 AromaticContact CD1-CZ 3.83Å; F1187-Y1276 WeakPolarHBondContact CD1-OH 3.22Å; T1211-Y1276 HydrophobicContact CG2-CE1 3.9Å; T1211-Y1276 WeakPolarHBondContact CG2-OH 3.34Å; L1214-Y1276 HydrophobicContact CB-CE1 4.5Å; L1214-Y1276 HydrophobicContact CD2-CD1 3.88Å; L1214-Y1276 HydrophobicContact CD2-CD2 4.27Å; L1214-Y1276 HydrophobicContact CD2-CE1 3.59Å; L1214-Y1276 HydrophobicContact CD2-CE2 3.97Å; L1214-Y1276 HydrophobicContact CD2-CG 4.19Å; L1214-Y1276 HydrophobicContact CG-CD1 4.08Å; L1214-Y1276 HydrophobicContact CG-CE1 3.54Å; Y1276-M1282 HydrophobicContact CD2-CB 3.62Å; Y1276-M1282 WeakPolarHBondContact CD2-O 3.21Å; Y1276-M1282 HydrophobicContact CE2-CB 4.2Å; Y1276-M1282 HydrophobicContact CG-CB 4.44Å
1277	D	59.3	Low	68.8	Low	70 Å²	70	58.6 Å²	58.6	37%	0.374	30%	0.302	S	S	.	.			trans	-27.6	138.7	174.2	-174.9	-53	0	0	0	114.7	T1279 L1280	D1277-T1279 VanDerWaalsContact CG-OG1 3.29Å; D1277-T1279 PolarHBondContact O-N 3.46Å; D1277-T1279 WeakPolarHBondContact OD1-CB 3.21Å; D1277-T1279 WeakPolarHBondContact OD1-CG2 3.48Å; D1277-T1279 PolarHBondContact OD1-N 3.02Å; D1277-T1279 PolarHBondContact OD1-OG1 3.41Å; D1277-L1280 PolarHBondContact O-N 2.96Å
1278	L	48.8	Very low	68.7	Low	166 Å²	166	55.5 Å²	55.5	87%	0.869	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.8	-22.6	175.8	-75.3	164.3	0	0	0	115.7
1279	T	46.7	Very low	68.3	Low	118 Å²	118	55.6 Å²	55.6	72%	0.724	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-15.2	175.2	60.2	0	0	0	0	114.6	D1277	D1277-T1279 VanDerWaalsContact CG-OG1 3.29Å; D1277-T1279 PolarHBondContact O-N 3.46Å; D1277-T1279 WeakPolarHBondContact OD1-CB 3.21Å; D1277-T1279 WeakPolarHBondContact OD1-CG2 3.48Å; D1277-T1279 PolarHBondContact OD1-N 3.02Å; D1277-T1279 PolarHBondContact OD1-OG1 3.41Å
1280	L	45	Very low	68.2	Low	93 Å²	93	55.2 Å²	55.2	49%	0.487	29%	0.286	S	S	.	.			trans	-119.3	104.6	-176.4	-72.5	168.8	0	0	0	110.5	D1277 M1282	D1277-L1280 PolarHBondContact O-N 2.96Å; L1280-M1282 PolarHBondContact O-N 3.05Å
1281	N	52.5	Low	67.9	Low	171 Å²	171	55.5 Å²	55.5	91%	0.914	29%	0.288	S	S	*	.			trans	-70.5	39	179.8	-109.1	-35.4	0	0	0	114.2
1282	M	51.4	Low	67.8	Low	78 Å²	78	60.9 Å²	60.9	38%	0.384	31%	0.311	S	S	.	.			trans	-98.3	133.7	179.6	-67.4	180	66.6	0	0	110.6	F1187 Y1276 L1280	F1187-M1282 HydrophobicContact CD1-CE 4.41Å; F1187-M1282 HydrophobicContact CD2-CE 3.97Å; F1187-M1282 HydrophobicContact CE1-CE 4.11Å; F1187-M1282 HydrophobicContact CE2-CE 3.63Å; F1187-M1282 HydrophobicContact CG-CE 4.35Å; F1187-M1282 HydrophobicContact CZ-CE 3.71Å; Y1276-M1282 HydrophobicContact CD2-CB 3.62Å; Y1276-M1282 WeakPolarHBondContact CD2-O 3.21Å; Y1276-M1282 HydrophobicContact CE2-CB 4.2Å; Y1276-M1282 HydrophobicContact CG-CB 4.44Å; L1280-M1282 PolarHBondContact O-N 3.05Å
1283	Q	62	Low	67.5	Low	89 Å²	89	61 Å²	61	42%	0.416	31%	0.312	S	S	.	.	B	Isolated β-bridge	trans	-130.8	145.4	167.1	-95.9	155.6	73.3	0	0	107.2	A1274	A1274-Q1283 CarbonylContact O-C 3.52Å; A1274-Q1283 WeakPolarHBondContact O-CA 3.33Å
1284	S	66.3	Low	67	Low	7 Å²	7	64 Å²	64	5%	0.049	33%	0.326	C	S	.	.			trans	-66.5	162.9	169.6	77.2	0	0	0	0	110.4	F1187 V1189 S1273 A1274	F1187-S1284 WeakPolarHBondContact O-CB 3.47Å; V1189-S1284 WeakPolarHBondContact CG2-OG 3.41Å; S1273-S1284 VanDerWaalsContact CA-OG 3.28Å; S1273-S1284 WeakPolarHBondContact CA-OG 3.47Å; S1273-S1284 PolarHBondContact OG-O 3.25Å; S1273-S1284 PolarHBondContact OG-OG 2.96Å; A1274-S1284 PolarHBondContact N-OG 3.08Å; A1274-S1284 PolarHBondContact O-N 3.25Å
1285	N	65	Low	66.3	Low	107 Å²	107	70.5 Å²	70.5	57%	0.572	36%	0.358	S	S	*	.			trans	-51.8	144	159.3	-64.6	-36.6	0	0	0	110.1	E1287	N1285-E1287 PolarHBondContact O-N 3.26Å
1286	W	76.4	Confident	65.5	Low	96 Å²	96	73.6 Å²	73.6	36%	0.364	37%	0.373	S	S	.	.			trans	-77.3	103.6	173.1	-69.7	85.8	0	0	0	109.1	K1218 R1220 Q1271 L1272 S1273	K1218-W1286 HydrophobicContact CB-CH2 3.64Å; K1218-W1286 HydrophobicContact CB-CZ2 4.22Å; K1218-W1286 HydrophobicContact CB-CZ3 4.2Å; K1218-W1286 VanDerWaalsContact O-CZ3 3.27Å; K1218-W1286 WeakPolarHBondContact O-CZ3 3.45Å; R1220-W1286 HydrophobicContact CB-CE3 4.47Å; R1220-W1286 HydrophobicContact CB-CH2 3.89Å; R1220-W1286 HydrophobicContact CB-CZ3 3.56Å; Q1271-W1286 HydrophobicContact CB-CD2 4.36Å; Q1271-W1286 HydrophobicContact CB-CE3 3.49Å; Q1271-W1286 VanDerWaalsContact CB-CE3 3.49Å; Q1271-W1286 HydrophobicContact CB-CZ3 4.04Å; L1272-W1286 CarbonylContact O-C 3.5Å; L1272-W1286 WeakPolarHBondContact O-CA 3.39Å; S1273-W1286 VanDerWaalsContact CB-CD2 3.5Å
1287	E	75.2	Confident	64.8	Low	25 Å²	25	77.6 Å²	77.6	12%	0.117	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	153.4	160.9	-84.3	-162.4	133.4	0	0	108.7	V1189 R1190 L1192 Q1271 L1272 N1285	V1189-E1287 VanDerWaalsContact C-OE2 3.28Å; V1189-E1287 HydrophobicContact CB-CB 4.19Å; V1189-E1287 HydrophobicContact CB-CG 3.92Å; V1189-E1287 WeakPolarHBondContact CB-OE2 3.23Å; V1189-E1287 HydrophobicContact CG1-CB 4.26Å; V1189-E1287 HydrophobicContact CG1-CG 4.31Å; V1189-E1287 WeakPolarHBondContact CG1-OE2 3.33Å; V1189-E1287 VanDerWaalsContact O-CD 3.24Å; R1190-E1287 PolarHBondContact N-OE2 3.07Å; L1192-E1287 HydrophobicContact CB-CB 4.24Å; L1192-E1287 VanDerWaalsContact CB-OE2 3.3Å; L1192-E1287 WeakPolarHBondContact CB-OE2 3.24Å; L1192-E1287 HydrophobicContact CD2-CB 3.63Å; Q1271-E1287 CarbonylContact C-O 3.43Å; Q1271-E1287 VanDerWaalsContact CA-O 3.23Å; Q1271-E1287 WeakPolarHBondContact CA-O 3.21Å; L1272-E1287 PolarHBondContact N-O 2.85Å; L1272-E1287 PolarHBondContact O-N 2.74Å; N1285-E1287 PolarHBondContact O-N 3.26Å
1288	T	79.3	Confident	64	Low	6 Å²	6	78.3 Å²	78.3	4%	0.037	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	139.2	178	-56.2	0	0	0	0	110.6	Q1090 I1144 V1270 Q1271	Q1090-T1288 PolarHBondContact OE1-O 2.98Å; I1144-T1288 HydrophobicContact CD1-CG2 3.58Å; V1270-T1288 CarbonylContact O-C 3.5Å; V1270-T1288 VanDerWaalsContact O-CA 3.23Å; V1270-T1288 WeakPolarHBondContact O-CA 3.19Å; Q1271-T1288 HydrophobicContact CG-CG2 4.08Å
1289	T	77.6	Confident	63.6	Low	9 Å²	9	75.1 Å²	75.1	6%	0.055	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	165.1	174	-174.6	0	0	0	0	109.3	L1192 C1194 V1270	L1192-T1289 HydrophobicContact CD2-CG2 3.87Å; L1192-T1289 HydrophobicContact CG-CG2 3.73Å; C1194-T1289 HydrophobicContact CB-CG2 3.82Å; C1194-T1289 WeakPolarHBondContact SG-CG2 3.32Å; C1194-T1289 PolarHBondContact SG-OG1 2.61Å; V1270-T1289 WeakPolarHBondContact CA-O 3.29Å; V1270-T1289 HydrophobicContact CB-CG2 4.06Å; V1270-T1289 WeakPolarHBondContact CB-O 3.33Å; V1270-T1289 HydrophobicContact CG1-CG2 4.45Å; V1270-T1289 PolarHBondContact N-O 3.25Å; V1270-T1289 PolarHBondContact O-N 2.8Å
1290	S	80.9	Confident	63.3	Low	41 Å²	41	76.7 Å²	76.7	29%	0.287	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	140.8	-176.3	-48.8	0	0	0	0	112	C1194 Y1268 D1269	C1194-S1290 PolarHBondContact SG-O 2.88Å; C1194-S1290 VanDerWaalsContact SG-O 3.4Å; Y1268-S1290 CarbonylContact O-C 3.48Å; Y1268-S1290 VanDerWaalsContact O-CA 3.26Å; Y1268-S1290 WeakPolarHBondContact O-CA 3.15Å; D1269-S1290 WeakPolarHBondContact OD1-CB 3.35Å; D1269-S1290 PolarHBondContact OD1-OG 2.88Å
1291	C	76.8	Confident	63.4	Low	7 Å²	7	75.9 Å²	75.9	5%	0.047	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	166	-178.2	46.3	0	0	0	0	111	C1194 V1201 V1267 Y1268	C1194-C1291 HydrophobicContact CB-CB 4.05Å; C1194-C1291 VanDerWaalsContact SG-CB 3.56Å; V1201-C1291 WeakPolarHBondContact CG1-SG 3.36Å; V1201-C1291 HydrophobicContact CG2-CB 4.41Å; V1201-C1291 WeakPolarHBondContact CG2-SG 2.99Å; V1267-C1291 CarbonylContact C-O 3.53Å; V1267-C1291 WeakPolarHBondContact CA-O 3.22Å; Y1268-C1291 PolarHBondContact N-O 3.02Å; Y1268-C1291 PolarHBondContact O-N 3.43Å
1292	F	82.5	Confident	63.3	Low	146 Å²	146	71.6 Å²	71.6	64%	0.64	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	136.5	173.2	44.9	-92.6	0	0	0	109.9	S1266	S1266-F1292 CarbonylContact O-C 3.57Å; S1266-F1292 WeakPolarHBondContact O-CA 3.39Å
1293	T	78.4	Confident	62.9	Low	4 Å²	4	73.9 Å²	73.9	3%	0.025	38%	0.382	C	S	.	.			trans	-76.4	142.3	161.4	48.5	0	0	0	0	109.6	D1197 V1201 L1262 E1263 N1265 S1266 Y1268	D1197-T1293 CarbonylContact O-C 3.51Å; D1197-T1293 WeakPolarHBondContact O-CA 3.37Å; D1197-T1293 VanDerWaalsContact O-CB 3.31Å; D1197-T1293 WeakPolarHBondContact O-CB 3.5Å; V1201-T1293 HydrophobicContact CG2-CG2 4.39Å; L1262-T1293 HydrophobicContact CB-CG2 3.98Å; E1263-T1293 WeakPolarHBondContact O-CB 3.36Å; E1263-T1293 PolarHBondContact O-OG1 3.47Å; N1265-T1293 WeakPolarHBondContact CA-O 3.3Å; N1265-T1293 PolarHBondContact N-O 2.89Å; N1265-T1293 PolarHBondContact N-OG1 2.86Å; S1266-T1293 WeakPolarHBondContact CB-OG1 3.44Å; S1266-T1293 PolarHBondContact N-OG1 3.34Å; S1266-T1293 PolarHBondContact O-N 2.89Å; S1266-T1293 PolarHBondContact O-OG1 3.42Å; S1266-T1293 VanDerWaalsContact O-OG1 3.14Å; Y1268-T1293 HydrophobicContact CD2-CG2 3.9Å; Y1268-T1293 HydrophobicContact CE2-CG2 3.86Å
1294	Q	68.4	Low	62.4	Low	62 Å²	62	71.9 Å²	71.9	29%	0.29	38%	0.377	S	S	.	.			trans	-72.3	171.1	177.9	-59.3	-178.4	37.5	0	0	111	G1196 D1197 D1198 P1264 N1265 Q1296	G1196-Q1294 PolarHBondContact O-NE2 2.77Å; D1197-Q1294 PolarHBondContact O-N 3Å; D1198-Q1294 WeakPolarHBondContact CA-O 3.25Å; D1198-Q1294 HydrophobicContact CB-CB 4.4Å; D1198-Q1294 WeakPolarHBondContact OD1-CB 3.28Å; P1264-Q1294 WeakPolarHBondContact CB-O 3.27Å; N1265-Q1294 PolarHBondContact N-O 3.39Å; Q1294-Q1296 PolarHBondContact O-N 3.41Å
1295	M	62.2	Low	62	Low	136 Å²	136	76.2 Å²	76.2	67%	0.67	40%	0.398	S	S	*	.			trans	-85.6	106.8	-179.9	-174.8	168.6	176.2	0	0	110.3	N1265 R1297	N1265-M1295 HydrophobicContact CB-CB 4.32Å; N1265-M1295 HydrophobicContact CB-CG 4.45Å; M1295-R1297 PolarHBondContact O-N 3.36Å
1296	Q	57	Low	61.6	Low	94 Å²	94	75.2 Å²	75.2	44%	0.439	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-56.8	131.1	178.6	-176	174.1	17.3	0	0	111.1	D1198 P1264 Q1294	D1198-Q1296 HydrophobicContact CB-CB 3.82Å; D1198-Q1296 HydrophobicContact CB-CG 4.48Å; P1264-Q1296 HydrophobicContact CB-CB 3.54Å; P1264-Q1296 HydrophobicContact CG-CB 3.87Å; Q1294-Q1296 PolarHBondContact O-N 3.41Å
1297	R	48.6	Very low	61.1	Low	104 Å²	104	74.5 Å²	74.5	39%	0.392	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-58.5	126.6	171.5	177.2	167.1	-74	166.2	11.1	108.5	M1295 T1355 A1358 S1359	M1295-R1297 PolarHBondContact O-N 3.36Å; R1297-T1355 PolarHBondContact NH1-O 3.37Å; R1297-A1358 PolarHBondContact NH1-O 3.37Å; R1297-A1358 PolarHBondContact NH2-O 3.19Å; R1297-S1359 WeakPolarHBondContact CD-OG 3.02Å; R1297-S1359 PolarHBondContact NE-OG 2.94Å; R1297-S1359 PolarHBondContact NH1-OG 3.36Å; R1297-S1359 PolarHBondContact NH2-OG 2.92Å
1298	P	42.2	Very low	60.3	Low	86 Å²	86	75.8 Å²	75.8	56%	0.558	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-54.6	140	-175.8	-29	35.4	0	0	0	112.5
1299	P	41.1	Very low	59.4	Low	99 Å²	99	80.2 Å²	80.2	64%	0.643	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-61.2	149.3	175.4	26.9	-34.3	0	0	0	110.6	V1301	P1299-V1301 PolarHBondContact O-N 3.49Å
1300	F	40.3	Very low	58.1	Low	150 Å²	150	81.5 Å²	81.5	66%	0.658	46%	0.455	S	S	*	.			trans	-50.9	108.8	-176.5	-103.6	-101.2	0	0	0	111.8	I1352 I1356	F1300-I1352 HydrophobicContact CE2-CG2 4.35Å; F1300-I1356 HydrophobicContact CD2-CD1 3.99Å; F1300-I1356 HydrophobicContact CE2-CD1 3.89Å; F1300-I1356 HydrophobicContact CE2-CG1 4.26Å
1301	V	47	Very low	56.5	Low	77 Å²	77	85.3 Å²	85.3	47%	0.467	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-67.2	132.9	174.3	-177.8	0	0	0	0	108.3	P1299 V1323	P1299-V1301 PolarHBondContact O-N 3.49Å; V1301-V1323 HydrophobicContact CG1-CG2 4.17Å; V1301-V1323 HydrophobicContact CG2-CG2 4.47Å
1302	P	50.9	Low	55.1	Low	81 Å²	81	90.2 Å²	90.2	53%	0.526	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-54.4	145.2	177.2	-27.8	35.7	0	0	0	112.5
1303	T	43.3	Very low	53.1	Low	125 Å²	125	91.7 Å²	91.7	77%	0.767	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-59.7	137.3	-178.1	34.9	0	0	0	0	111.9	I1305	T1303-I1305 PolarHBondContact O-N 3.47Å
1304	P	50	Low	51.5	Low	48 Å²	48	99.7 Å²	99.7	31%	0.312	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-58.2	131.5	177.8	-22.5	31.3	0	0	0	112	L1318 L1320 L1335	P1304-L1318 HydrophobicContact CB-CB 4.18Å; P1304-L1318 HydrophobicContact CB-CD1 3.99Å; P1304-L1318 HydrophobicContact CB-CD2 4.11Å; P1304-L1318 HydrophobicContact CB-CG 4.32Å; P1304-L1320 HydrophobicContact CB-CD2 3.78Å; P1304-L1320 HydrophobicContact CG-CD2 3.75Å; P1304-L1335 HydrophobicContact CB-CD1 4.26Å; P1304-L1335 HydrophobicContact CG-CD1 3.44Å; P1304-L1335 VanDerWaalsContact CG-CD1 3.44Å
1305	I	58.6	Low	50.3	Low	98 Å²	98	102.1 Å²	102.1	50%	0.503	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.3	121.3	-177.4	-58.5	172.4	0	0	0	109.2	T1303 V1307 L1318 Q1319	T1303-I1305 PolarHBondContact O-N 3.47Å; I1305-V1307 PolarHBondContact O-N 3.22Å; I1305-L1318 CarbonylContact O-C 3.56Å; I1305-L1318 WeakPolarHBondContact O-CA 3.21Å; I1305-Q1319 HydrophobicContact CB-CB 4.3Å; I1305-Q1319 PolarHBondContact N-O 2.88Å; I1305-Q1319 PolarHBondContact O-N 3.02Å
1306	P	56.4	Low	49.7	Very low	85 Å²	85	99.6 Å²	99.6	55%	0.552	56%	0.559	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-71.4	117.2	173	28.4	-32.8	0	0	0	111.1	V1316 L1317 L1318	P1306-V1316 HydrophobicContact CB-CG1 3.9Å; P1306-L1317 CarbonylContact C-O 3.56Å; P1306-L1317 WeakPolarHBondContact CA-O 3.42Å; P1306-L1318 HydrophobicContact CB-CD2 4.27Å
1307	V	66	Low	49.6	Very low	82 Å²	82	100.2 Å²	100.2	50%	0.497	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.2	-35	-176.8	-173.6	0	0	0	0	111.8	I1305 L1317 Q1319	I1305-V1307 PolarHBondContact O-N 3.22Å; V1307-L1317 HydrophobicContact CB-CB 4.39Å; V1307-L1317 HydrophobicContact CB-CD2 4.06Å; V1307-L1317 HydrophobicContact CB-CG 4.14Å; V1307-L1317 HydrophobicContact CG1-CD2 4.13Å; V1307-L1317 PolarHBondContact N-O 2.88Å; V1307-Q1319 HydrophobicContact CG2-CB 3.41Å; V1307-Q1319 VanDerWaalsContact CG2-CB 3.41Å
1308	A	58.6	Low	50	Low	52 Å²	52	98.7 Å²	98.7	43%	0.43	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-153	148.2	178.2	0	0	0	0	0	110.4	V1316 L1317	A1308-V1316 WeakPolarHBondContact O-CA 3.36Å; A1308-L1317 HydrophobicContact CB-CB 4.03Å; A1308-L1317 HydrophobicContact CB-CD2 4.26Å; A1308-L1317 PolarHBondContact O-N 2.84Å
1309	V	60.8	Low	50.8	Low	99 Å²	99	100 Å²	100	60%	0.6	56%	0.563	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-128.2	132.7	174.8	-178.2	0	0	0	0	107.9	Q1315 V1316	V1309-Q1315 WeakPolarHBondContact CA-O 3.37Å; V1309-V1316 HydrophobicContact CG1-CG2 4.38Å; V1309-V1316 HydrophobicContact CG2-CG1 4.38Å; V1309-V1316 HydrophobicContact CG2-CG2 4.3Å
1310	S	49.3	Very low	51.2	Low	36 Å²	36	99.1 Å²	99.1	25%	0.252	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.5	97.5	-179.8	-172.5	0	0	0	0	110.5	S1312 R1313 L1314 Q1315	S1310-S1312 PolarHBondContact O-N 2.88Å; S1310-R1313 PolarHBondContact O-N 3.45Å; S1310-L1314 PolarHBondContact O-N 3.19Å; S1310-L1314 VanDerWaalsContact O-N 3.11Å; S1310-Q1315 PolarHBondContact N-O 3.28Å
1311	P	47.2	Very low	51.8	Low	120 Å²	120	94.8 Å²	94.8	78%	0.779	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-31.2	-174.6	-25.6	35	0	0	0	113.8
1312	S	49	Very low	51.8	Low	110 Å²	110	103 Å²	103	77%	0.769	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-2.2	179.6	54.5	0	0	0	0	114.5	S1310	S1310-S1312 PolarHBondContact O-N 2.88Å
1313	R	40.2	Very low	51.6	Low	177 Å²	177	101.5 Å²	101.5	67%	0.668	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.2	1.9	179.9	-60.4	-171.4	175.3	-161.2	-4.5	114.4	S1310 Q1315	S1310-R1313 PolarHBondContact O-N 3.45Å; R1313-Q1315 HydrophobicContact CB-CB 4.31Å; R1313-Q1315 HydrophobicContact CB-CG 4.23Å; R1313-Q1315 WeakPolarHBondContact O-CG 3.18Å; R1313-Q1315 PolarHBondContact O-N 3.07Å; R1313-Q1315 VanDerWaalsContact O-N 3.11Å
1314	L	45	Very low	51.3	Low	172 Å²	172	100.9 Å²	100.9	90%	0.901	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	51.6	31.1	-175.2	-58.5	174.9	0	0	0	113.4	S1310	S1310-L1314 PolarHBondContact O-N 3.19Å; S1310-L1314 VanDerWaalsContact O-N 3.11Å
1315	Q	42.1	Very low	50.8	Low	113 Å²	113	103 Å²	103	53%	0.528	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.7	134.5	-173.9	-81.9	165.6	-0.1	0	0	111.5	V1309 S1310 R1313	V1309-Q1315 WeakPolarHBondContact CA-O 3.37Å; S1310-Q1315 PolarHBondContact N-O 3.28Å; R1313-Q1315 HydrophobicContact CB-CB 4.31Å; R1313-Q1315 HydrophobicContact CB-CG 4.23Å; R1313-Q1315 WeakPolarHBondContact O-CG 3.18Å; R1313-Q1315 PolarHBondContact O-N 3.07Å; R1313-Q1315 VanDerWaalsContact O-N 3.11Å
1316	V	49.2	Very low	49.9	Very low	83 Å²	83	106.3 Å²	106.3	50%	0.503	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.9	122.4	169.2	-178.4	0	0	0	0	108.4	P1306 A1308 V1309 L1318	P1306-V1316 HydrophobicContact CB-CG1 3.9Å; A1308-V1316 WeakPolarHBondContact O-CA 3.36Å; V1309-V1316 HydrophobicContact CG1-CG2 4.38Å; V1309-V1316 HydrophobicContact CG2-CG1 4.38Å; V1309-V1316 HydrophobicContact CG2-CG2 4.3Å; V1316-L1318 HydrophobicContact CG1-CD2 3.84Å; V1316-L1318 HydrophobicContact CG1-CG 4.4Å
1317	L	56	Low	49.3	Very low	107 Å²	107	104.6 Å²	104.6	56%	0.56	56%	0.555	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.8	126.1	174.2	-176.3	66.1	0	0	0	108.9	P1306 V1307 A1308	P1306-L1317 CarbonylContact C-O 3.56Å; P1306-L1317 WeakPolarHBondContact CA-O 3.42Å; V1307-L1317 HydrophobicContact CB-CB 4.39Å; V1307-L1317 HydrophobicContact CB-CD2 4.06Å; V1307-L1317 HydrophobicContact CB-CG 4.14Å; V1307-L1317 HydrophobicContact CG1-CD2 4.13Å; V1307-L1317 PolarHBondContact N-O 2.88Å; A1308-L1317 HydrophobicContact CB-CB 4.03Å; A1308-L1317 HydrophobicContact CB-CD2 4.26Å; A1308-L1317 PolarHBondContact O-N 2.84Å
1318	L	56.7	Low	47.9	Very low	72 Å²	72	102.2 Å²	102.2	38%	0.377	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	137.6	-177.2	-62.9	176.9	0	0	0	112.2	P1304 I1305 P1306 V1316 L1335	P1304-L1318 HydrophobicContact CB-CB 4.18Å; P1304-L1318 HydrophobicContact CB-CD1 3.99Å; P1304-L1318 HydrophobicContact CB-CD2 4.11Å; P1304-L1318 HydrophobicContact CB-CG 4.32Å; I1305-L1318 CarbonylContact O-C 3.56Å; I1305-L1318 WeakPolarHBondContact O-CA 3.21Å; P1306-L1318 HydrophobicContact CB-CD2 4.27Å; V1316-L1318 HydrophobicContact CG1-CD2 3.84Å; V1316-L1318 HydrophobicContact CG1-CG 4.4Å; L1318-L1335 HydrophobicContact CD1-CD1 4.34Å; L1318-L1335 HydrophobicContact CD1-CD2 4.19Å
1319	Q	58.5	Low	46.8	Very low	113 Å²	113	103.2 Å²	103.2	53%	0.528	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	124.6	170.7	170.2	175	7.5	0	0	109.9	I1305 V1307	I1305-Q1319 HydrophobicContact CB-CB 4.3Å; I1305-Q1319 PolarHBondContact N-O 2.88Å; I1305-Q1319 PolarHBondContact O-N 3.02Å; V1307-Q1319 HydrophobicContact CG2-CB 3.41Å; V1307-Q1319 VanDerWaalsContact CG2-CB 3.41Å
1320	L	50.9	Low	46	Very low	81 Å²	81	101.6 Å²	101.6	42%	0.424	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-101.6	140.8	175.2	-59.8	175	0	0	0	110	P1304 L1335 Y1374	P1304-L1320 HydrophobicContact CB-CD2 3.78Å; P1304-L1320 HydrophobicContact CG-CD2 3.75Å; L1320-L1335 HydrophobicContact CD2-CD1 4.22Å; L1320-Y1374 HydrophobicContact CD1-CE2 4.48Å
1321	S	51.9	Low	45.6	Very low	60 Å²	60	106.3 Å²	106.3	42%	0.42	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-73.4	140.6	172	45.4	0	0	0	0	110.8	V1323	S1321-V1323 PolarHBondContact O-N 3.25Å; S1321-V1323 VanDerWaalsContact O-N 3.16Å
1322	R	48.2	Very low	45.4	Very low	250 Å²	250	104.5 Å²	104.5	94%	0.943	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-63.8	116	175.2	-83.3	-176.1	172.2	175.1	-2.3	110
1323	V	45.8	Very low	45.1	Very low	49 Å²	49	102.5 Å²	102.5	30%	0.297	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-95.1	120.5	167.7	-174.3	0	0	0	0	108.2	V1301 S1321 Y1333	V1301-V1323 HydrophobicContact CG1-CG2 4.17Å; V1301-V1323 HydrophobicContact CG2-CG2 4.47Å; S1321-V1323 PolarHBondContact O-N 3.25Å; S1321-V1323 VanDerWaalsContact O-N 3.16Å; V1323-Y1333 HydrophobicContact CB-CE1 4.21Å; V1323-Y1333 HydrophobicContact CG2-CE1 4.35Å; V1323-Y1333 PolarHBondContact O-OH 2.99Å
1324	S	37	Very low	45.2	Very low	112 Å²	112	99.3 Å²	99.3	78%	0.783	49%	0.49	S	S	*	.			trans	-126	103.3	178.2	58.8	0	0	0	0	110.7
1325	E	39.8	Very low	45.2	Very low	91 Å²	91	93.3 Å²	93.3	43%	0.425	46%	0.458	S	S	.	.			trans	-89.5	147.3	170.9	-68	-175.1	-172.2	0	0	110.9	Y1327 I1330	E1325-Y1327 PolarHBondContact O-N 2.68Å; E1325-I1330 HydrophobicContact CG-CD1 4.3Å
1326	Q	39.6	Very low	45.2	Very low	168 Å²	168	91.7 Å²	91.7	79%	0.785	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	13.3	-177.5	-64.1	169.9	-97.1	0	0	113.4
1327	Y	43.1	Very low	45	Very low	50 Å²	50	91.5 Å²	91.5	20%	0.196	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-133.8	11	-153.4	-58.6	-55.8	0	0	0	116.6	K1225 F1227 L1237 F1239 E1263 E1325	K1225-Y1327 HydrophobicContact CD-CD1 4.17Å; K1225-Y1327 HydrophobicContact CD-CG 4.37Å; F1227-Y1327 VanDerWaalsContact CB-O 3.25Å; F1227-Y1327 WeakPolarHBondContact CB-O 3.37Å; F1227-Y1327 WeakPolarHBondContact CD2-O 3.37Å; F1227-Y1327 WeakPolarHBondContact CG-O 3.19Å; L1237-Y1327 HydrophobicContact CD2-CD1 3.58Å; L1237-Y1327 HydrophobicContact CD2-CE1 3.43Å; L1237-Y1327 VanDerWaalsContact CD2-CE1 3.43Å; F1239-Y1327 HydrophobicContact CE1-CE1 4.5Å; E1263-Y1327 PolarHBondContact OE1-OH 3.28Å; E1263-Y1327 WeakPolarHBondContact OE2-CE2 3.34Å; E1325-Y1327 PolarHBondContact O-N 2.68Å
1328	G	37.6	Very low	44.2	Very low	31 Å²	31	89.7 Å²	89.7	32%	0.32	46%	0.455	S	S	.	.			trans	119.6	175.2	172.2	0	0	0	0	0	115	I1330	G1328-I1330 PolarHBondContact O-N 3.14Å
1329	K	35.3	Very low	43.2	Very low	74 Å²	74	89.5 Å²	89.5	32%	0.322	46%	0.458	S	S	.	.			trans	-73.1	106.4	-178.1	-83.7	-178.3	175.4	165.7	0	111.2	A1228 D1230 R1331 Y1378	A1228-K1329 PolarHBondContact O-N 3.1Å; D1230-K1329 PolarHBondContact O-NZ 3.45Å; K1329-R1331 PolarHBondContact O-N 3.06Å; K1329-R1331 VanDerWaalsContact O-N 3.08Å; K1329-Y1378 HydrophobicContact CD-CE2 3.99Å; K1329-Y1378 WeakPolarHBondContact CD-OH 3.32Å; K1329-Y1378 PolarHBondContact NZ-OH 3.08Å; K1329-Y1378 VanDerWaalsContact NZ-OH 3.09Å
1330	I	43.6	Very low	42.1	Very low	65 Å²	65	89.9 Å²	89.9	33%	0.333	47%	0.468	S	S	.	.			trans	-62.9	106.3	161.5	-58.4	174.3	0	0	0	107.5	E1325 G1328 Q1332	E1325-I1330 HydrophobicContact CG-CD1 4.3Å; G1328-I1330 PolarHBondContact O-N 3.14Å; I1330-Q1332 VanDerWaalsContact C-N 3.28Å; I1330-Q1332 WeakPolarHBondContact CG2-O 3.48Å; I1330-Q1332 PolarHBondContact O-N 3.43Å
1331	R	41.9	Very low	41.5	Very low	135 Å²	135	94.1 Å²	94.1	51%	0.509	49%	0.486	S	S	.	.			trans	-76.5	-10.3	-173.4	-67.8	-172.9	175.8	-163.5	-3.5	114.4	K1329	K1329-R1331 PolarHBondContact O-N 3.06Å; K1329-R1331 VanDerWaalsContact O-N 3.08Å
1332	Q	41.6	Very low	40.7	Very low	81 Å²	81	99.6 Å²	99.6	38%	0.379	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	116	-173.9	-58.4	179.1	12.2	0	0	110.1	I1330 F1334 R1373 Y1374 L1375	I1330-Q1332 VanDerWaalsContact C-N 3.28Å; I1330-Q1332 WeakPolarHBondContact CG2-O 3.48Å; I1330-Q1332 PolarHBondContact O-N 3.43Å; Q1332-F1334 HydrophobicContact CB-CE2 3.97Å; Q1332-F1334 HydrophobicContact CB-CZ 4.3Å; Q1332-F1334 VanDerWaalsContact OE1-CZ 3.28Å; Q1332-R1373 HydrophobicContact CB-CG 4.44Å; Q1332-R1373 HydrophobicContact CG-CG 4.48Å; Q1332-Y1374 WeakPolarHBondContact CA-O 3.12Å; Q1332-L1375 HydrophobicContact CG-CD2 4.43Å
1333	Y	43.3	Very low	39.9	Very low	69 Å²	69	91.1 Å²	91.1	27%	0.271	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	158.8	157	-61.9	-95.5	0	0	0	109.2	V1323 R1373 Y1374	V1323-Y1333 HydrophobicContact CB-CE1 4.21Å; V1323-Y1333 HydrophobicContact CG2-CE1 4.35Å; V1323-Y1333 PolarHBondContact O-OH 2.99Å; Y1333-R1373 CarbonylContact O-C 3.44Å; Y1333-R1373 VanDerWaalsContact O-CA 3.28Å; Y1333-R1373 WeakPolarHBondContact O-CA 3.19Å; Y1333-Y1374 PolarHBondContact N-O 3.36Å; Y1333-Y1374 PolarHBondContact O-N 2.77Å
1334	F	42.3	Very low	39.3	Very low	110 Å²	110	96 Å²	96	48%	0.482	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	103.2	175.2	-71.6	-78.2	0	0	0	110.3	Q1332 V1336 A1371 R1373	Q1332-F1334 HydrophobicContact CB-CE2 3.97Å; Q1332-F1334 HydrophobicContact CB-CZ 4.3Å; Q1332-F1334 VanDerWaalsContact OE1-CZ 3.28Å; F1334-V1336 PolarHBondContact O-N 2.71Å; F1334-A1371 HydrophobicContact CB-CB 4.05Å; F1334-A1371 HydrophobicContact CD1-CB 3.75Å; F1334-A1371 HydrophobicContact CG-CB 4.24Å; F1334-R1373 HydrophobicContact CD1-CB 3.93Å; F1334-R1373 HydrophobicContact CD1-CG 4.39Å; F1334-R1373 HydrophobicContact CE1-CB 3.75Å; F1334-R1373 HydrophobicContact CE1-CG 3.92Å; F1334-R1373 HydrophobicContact CZ-CG 4.33Å
1335	L	45.1	Very low	39.2	Very low	46 Å²	46	96.2 Å²	96.2	24%	0.241	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	93.8	175.1	174.6	81.4	0	0	0	108.8	P1304 L1318 L1320 V1337 A1372	P1304-L1335 HydrophobicContact CB-CD1 4.26Å; P1304-L1335 HydrophobicContact CG-CD1 3.44Å; P1304-L1335 VanDerWaalsContact CG-CD1 3.44Å; L1318-L1335 HydrophobicContact CD1-CD1 4.34Å; L1318-L1335 HydrophobicContact CD1-CD2 4.19Å; L1320-L1335 HydrophobicContact CD2-CD1 4.22Å; L1335-V1337 HydrophobicContact CD2-CG2 3.94Å; L1335-V1337 HydrophobicContact CG-CG2 3.87Å; L1335-V1337 PolarHBondContact O-N 2.76Å; L1335-A1372 HydrophobicContact CB-CB 4.13Å; L1335-A1372 HydrophobicContact CD2-CB 4.33Å; L1335-A1372 PolarHBondContact N-O 2.86Å; L1335-A1372 WeakPolarHBondContact O-CB 3.39Å; L1335-A1372 PolarHBondContact O-N 2.88Å
1336	V	42.2	Very low	38.9	Very low	78 Å²	78	96.3 Å²	96.3	47%	0.473	53%	0.529	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	105.7	-179.9	176.1	0	0	0	0	111.1	F1334 Y1369 V1370 A1371	F1334-V1336 PolarHBondContact O-N 2.71Å; V1336-Y1369 HydrophobicContact CG1-CD1 4.13Å; V1336-Y1369 HydrophobicContact CG1-CG 4.43Å; V1336-V1370 CarbonylContact C-O 3.5Å; V1336-V1370 WeakPolarHBondContact CA-O 3.24Å; V1336-A1371 HydrophobicContact CG2-CB 4.1Å
1337	V	44.8	Very low	38.3	Very low	79 Å²	79	95.5 Å²	95.5	48%	0.479	54%	0.536	S	S	.	.			trans	-103.1	75.3	179.2	-171	0	0	0	0	110.4	L1335 P1339 V1370	L1335-V1337 HydrophobicContact CD2-CG2 3.94Å; L1335-V1337 HydrophobicContact CG-CG2 3.87Å; L1335-V1337 PolarHBondContact O-N 2.76Å; V1337-P1339 WeakPolarHBondContact O-CD 3.3Å; V1337-V1370 PolarHBondContact N-O 2.76Å; V1337-V1370 WeakPolarHBondContact O-CB 3.32Å
1338	A	38.2	Very low	37.9	Very low	70 Å²	70	100.8 Å²	100.8	58%	0.579	56%	0.562	S	S	*	*			trans	-57.8	124.1	178.3	0	0	0	0	0	111.5
1339	P	35.8	Very low	38	Very low	67 Å²	67	108.1 Å²	108.1	44%	0.435	59%	0.586	S	S	.	*			trans	-66.2	140.8	176.5	-21.4	34.2	0	0	0	111.7	V1337 H1341 V1370	V1337-P1339 WeakPolarHBondContact O-CD 3.3Å; P1339-H1341 VanDerWaalsContact CB-NE2 3.34Å; P1339-H1341 WeakPolarHBondContact CB-NE2 3.25Å; P1339-H1341 PolarHBondContact O-N 3.36Å; P1339-V1370 HydrophobicContact CG-CG2 4Å
1340	V	35.4	Very low	38	Very low	121 Å²	121	111.7 Å²	111.7	73%	0.733	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-68.7	-6.7	-165.3	176.6	0	0	0	0	114	L1342 A1343	V1340-L1342 VanDerWaalsContact C-N 3.29Å; V1340-L1342 PolarHBondContact O-N 3.21Å; V1340-A1343 WeakPolarHBondContact O-CB 3.24Å; V1340-A1343 PolarHBondContact O-N 2.97Å
1341	H	38.7	Very low	37.8	Very low	171 Å²	171	111.1 Å²	111.1	79%	0.792	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-76	-6.5	-171.4	-22.5	-59	0	0	0	115.4	P1339	P1339-H1341 VanDerWaalsContact CB-NE2 3.34Å; P1339-H1341 WeakPolarHBondContact CB-NE2 3.25Å; P1339-H1341 PolarHBondContact O-N 3.36Å
1342	L	36	Very low	37.4	Very low	174 Å²	174	109.8 Å²	109.8	91%	0.911	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-96.7	8.3	171.6	-72.4	171.6	0	0	0	112.8	V1340 D1344	V1340-L1342 VanDerWaalsContact C-N 3.29Å; V1340-L1342 PolarHBondContact O-N 3.21Å; L1342-D1344 PolarHBondContact O-N 3.29Å
1343	A	31	Very low	37.2	Very low	72 Å²	72	111 Å²	111	60%	0.595	62%	0.619	S	S	*	*			trans	-90.6	76.5	171.3	0	0	0	0	0	111	V1340	V1340-A1343 WeakPolarHBondContact O-CB 3.24Å; V1340-A1343 PolarHBondContact O-N 2.97Å
1344	D	33.7	Very low	37	Very low	152 Å²	152	111.6 Å²	111.6	81%	0.813	63%	0.63	S	S	*	*			trans	-157	104.6	152.3	-107.5	-29.7	0	0	0	113.2	L1342	L1342-D1344 PolarHBondContact O-N 3.29Å
1345	S	34.8	Very low	36.6	Very low	117 Å²	117	110.1 Å²	110.1	82%	0.818	63%	0.63	S	S	*	*	S	Bend	trans	66.3	139	165.8	73.9	0	0	0	0	119.7
1346	S	33.1	Very low	36	Very low	93 Å²	93	111 Å²	111	65%	0.65	64%	0.635	S	S	*	*			cis	-153.5	98.4	-16.6	55.6	0	0	0	0	112.9	E1348	S1346-E1348 PolarHBondContact O-N 2.79Å
1347	T	27.5	Very low	35.6	Very low	150 Å²	150	111.9 Å²	111.9	92%	0.92	64%	0.64	S	S	*	*				56.8	19.7	116.7	61.3	0	0	0	0	122.8
1348	E	35.2	Very low	35	Very low	161 Å²	161	111.7 Å²	111.7	75%	0.752	65%	0.647	S	S	*	*			trans	-126.6	130.9	162.9	-74.8	-161.8	-175.9	0	0	113.6	S1346	S1346-E1348 PolarHBondContact O-N 2.79Å
1349	K	38.7	Very low	34.6	Very low	186 Å²	186	109.5 Å²	109.5	81%	0.809	63%	0.627	S	S	*	*			trans	63	100.6	173.4	-54.2	163.3	-169.2	159.5	0	116.4
1350	I	36.1	Very low	34.1	Very low	148 Å²	148	111.2 Å²	111.2	76%	0.759	63%	0.625	S	S	*	*				-169.6	142.3	118.7	-94.6	151.3	0	0	0	106.8
1351	S	37.8	Very low	33.6	Very low	53 Å²	53	107.9 Å²	107.9	37%	0.371	62%	0.615	S	S	.	*			trans	-91.8	159.7	-166.3	76.5	0	0	0	0	113.5	D1353 T1354 T1355	S1351-D1353 PolarHBondContact O-N 3.48Å; S1351-D1353 PolarHBondContact OG-N 3Å; S1351-T1354 WeakPolarHBondContact CA-OG1 3.43Å; S1351-T1354 PolarHBondContact N-OG1 2.96Å; S1351-T1354 PolarHBondContact O-N 3.45Å; S1351-T1354 PolarHBondContact O-OG1 2.98Å; S1351-T1354 PolarHBondContact OG-N 3.46Å; S1351-T1354 PolarHBondContact OG-OG1 3.43Å; S1351-T1355 PolarHBondContact O-N 3.12Å; S1351-T1355 PolarHBondContact O-OG1 3.33Å
1352	I	34.3	Very low	33.3	Very low	108 Å²	108	107.9 Å²	107.9	55%	0.554	62%	0.62	S	S	*	*	H	α-helix	trans	-54.3	-40.5	167.2	-76.2	174	0	0	0	109.8	F1300 T1355 I1356	F1300-I1352 HydrophobicContact CE2-CG2 4.35Å; I1352-T1355 CarbonylContact O-C 3.58Å; I1352-T1355 VanDerWaalsContact O-C 3.27Å; I1352-T1355 WeakPolarHBondContact O-CA 3.32Å; I1352-T1355 WeakPolarHBondContact O-CB 3.13Å; I1352-T1355 PolarHBondContact O-N 2.71Å; I1352-T1355 VanDerWaalsContact O-N 3.08Å; I1352-I1356 HydrophobicContact CG2-CD1 3.54Å; I1352-I1356 HydrophobicContact CG2-CG1 4.32Å; I1352-I1356 WeakPolarHBondContact O-CB 2.73Å; I1352-I1356 VanDerWaalsContact O-CG1 3.29Å; I1352-I1356 WeakPolarHBondContact O-CG1 3.06Å; I1352-I1356 PolarHBondContact O-N 2.86Å
1353	D	36.5	Very low	33.1	Very low	107 Å²	107	105.4 Å²	105.4	57%	0.572	61%	0.614	S	S	*	*	H	α-helix	trans	-68.4	-36.2	177.9	-48	-75.2	0	0	0	113.3	S1351 T1355 I1356 T1357	S1351-D1353 PolarHBondContact O-N 3.48Å; S1351-D1353 PolarHBondContact OG-N 3Å; D1353-T1355 PolarHBondContact O-N 2.77Å; D1353-I1356 CarbonylContact O-C 3.57Å; D1353-I1356 PolarHBondContact O-N 3.1Å; D1353-I1356 VanDerWaalsContact O-N 3.13Å; D1353-T1357 WeakPolarHBondContact O-CB 3.2Å; D1353-T1357 PolarHBondContact O-N 2.74Å; D1353-T1357 PolarHBondContact O-OG1 2.72Å
1354	T	39.8	Very low	32.9	Very low	80 Å²	80	106.2 Å²	106.2	49%	0.491	62%	0.615	S	S	.	*	H	α-helix	trans	-65.9	-31.9	171.1	10.2	0	0	0	0	110.8	S1351 I1356	S1351-T1354 WeakPolarHBondContact CA-OG1 3.43Å; S1351-T1354 PolarHBondContact N-OG1 2.96Å; S1351-T1354 PolarHBondContact O-N 3.45Å; S1351-T1354 PolarHBondContact O-OG1 2.98Å; S1351-T1354 PolarHBondContact OG-N 3.46Å; S1351-T1354 PolarHBondContact OG-OG1 3.43Å; T1354-I1356 VanDerWaalsContact C-N 3.31Å; T1354-I1356 PolarHBondContact O-N 2.79Å
1355	T	33.2	Very low	32.8	Very low	79 Å²	79	103.9 Å²	103.9	49%	0.485	61%	0.611	S	S	.	*	H	α-helix	trans	-79.6	-8.1	174.8	-42.1	0	0	0	0	113.4	R1297 S1351 I1352 D1353	R1297-T1355 PolarHBondContact NH1-O 3.37Å; S1351-T1355 PolarHBondContact O-N 3.12Å; S1351-T1355 PolarHBondContact O-OG1 3.33Å; I1352-T1355 CarbonylContact O-C 3.58Å; I1352-T1355 VanDerWaalsContact O-C 3.27Å; I1352-T1355 WeakPolarHBondContact O-CA 3.32Å; I1352-T1355 WeakPolarHBondContact O-CB 3.13Å; I1352-T1355 PolarHBondContact O-N 2.71Å; I1352-T1355 VanDerWaalsContact O-N 3.08Å; D1353-T1355 PolarHBondContact O-N 2.77Å
1356	I	33.8	Very low	32.8	Very low	66 Å²	66	104.6 Å²	104.6	34%	0.338	60%	0.602	S	S	.	*	H	α-helix	trans	-114.9	-16.7	177	-69.7	176	0	0	0	112.8	F1300 I1352 D1353 T1354 S1359	F1300-I1356 HydrophobicContact CD2-CD1 3.99Å; F1300-I1356 HydrophobicContact CE2-CD1 3.89Å; F1300-I1356 HydrophobicContact CE2-CG1 4.26Å; I1352-I1356 HydrophobicContact CG2-CD1 3.54Å; I1352-I1356 HydrophobicContact CG2-CG1 4.32Å; I1352-I1356 WeakPolarHBondContact O-CB 2.73Å; I1352-I1356 VanDerWaalsContact O-CG1 3.29Å; I1352-I1356 WeakPolarHBondContact O-CG1 3.06Å; I1352-I1356 PolarHBondContact O-N 2.86Å; D1353-I1356 CarbonylContact O-C 3.57Å; D1353-I1356 PolarHBondContact O-N 3.1Å; D1353-I1356 VanDerWaalsContact O-N 3.13Å; T1354-I1356 VanDerWaalsContact C-N 3.31Å; T1354-I1356 PolarHBondContact O-N 2.79Å; I1356-S1359 WeakPolarHBondContact O-CB 3.43Å; I1356-S1359 PolarHBondContact O-OG 2.74Å
1357	T	34	Very low	32.8	Very low	96 Å²	96	105.3 Å²	105.3	59%	0.589	60%	0.602	S	S	*	*	H	α-helix	trans	-97.6	-22	-176.8	-51.6	0	0	0	0	113.1	D1353 S1359	D1353-T1357 WeakPolarHBondContact O-CB 3.2Å; D1353-T1357 PolarHBondContact O-N 2.74Å; D1353-T1357 PolarHBondContact O-OG1 2.72Å; T1357-S1359 PolarHBondContact O-N 2.83Å
1358	A	32.4	Very low	33.1	Very low	75 Å²	75	109 Å²	109	62%	0.62	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	53.7	165.5	0	0	0	0	0	111.7	R1297	R1297-A1358 PolarHBondContact NH1-O 3.37Å; R1297-A1358 PolarHBondContact NH2-O 3.19Å
1359	S	28.6	Very low	32.8	Very low	23 Å²	23	109 Å²	109	16%	0.161	59%	0.594	C	S	.	*	T	Hydrogen-bonded Turn	trans	-127.3	-22.7	-170.9	-59.3	0	0	0	0	113.7	R1297 I1356 T1357 G1361	R1297-S1359 WeakPolarHBondContact CD-OG 3.02Å; R1297-S1359 PolarHBondContact NE-OG 2.94Å; R1297-S1359 PolarHBondContact NH1-OG 3.36Å; R1297-S1359 PolarHBondContact NH2-OG 2.92Å; I1356-S1359 WeakPolarHBondContact O-CB 3.43Å; I1356-S1359 PolarHBondContact O-OG 2.74Å; T1357-S1359 PolarHBondContact O-N 2.83Å; S1359-G1361 PolarHBondContact O-N 3.49Å
1360	R	25.8	Very low	32.6	Very low	104 Å²	104	103.5 Å²	103.5	39%	0.392	58%	0.575	S	S	.	*	S	Bend	trans	-98.4	69.3	-165.5	-54.4	-162.4	163.6	-166.9	-16.5	110.4	D1197 D1198 T1199	D1197-R1360 IonicContact OD1-CZ 3.82Å; D1197-R1360 IonicContact OD1-NH1 2.84Å; D1197-R1360 PolarHBondContact OD1-NH1 3.44Å; D1197-R1360 IonicContact OD1-NH2 3.67Å; D1197-R1360 IonicContact OD2-NH1 2.75Å; D1198-R1360 VanDerWaalsContact CB-NH2 3.33Å; D1198-R1360 WeakPolarHBondContact OD1-CD 3.47Å; D1198-R1360 VanDerWaalsContact OD1-CG 3.28Å; D1198-R1360 WeakPolarHBondContact OD1-CG 3.36Å; D1198-R1360 IonicContact OD1-CZ 3.32Å; D1198-R1360 IonicContact OD1-NE 3.78Å; D1198-R1360 PolarHBondContact OD1-NE 2.91Å; D1198-R1360 IonicContact OD1-NH2 3.67Å; D1198-R1360 IonicContact OD2-CZ 3.42Å; D1198-R1360 IonicContact OD2-NE 2.36Å; D1198-R1360 PolarHBondContact OD2-NE 2.73Å; D1198-R1360 IonicContact OD2-NH2 3.31Å; D1198-R1360 PolarHBondContact OD2-NH2 2.85Å; T1199-R1360 PolarHBondContact OG1-NH2 2.98Å
1361	G	25.4	Very low	32.4	Very low	51 Å²	51	98.5 Å²	98.5	53%	0.526	56%	0.556	S	S	.	*	S	Bend	trans	97.6	143.9	-178.2	0	0	0	0	0	114.6	S1359	S1359-G1361 PolarHBondContact O-N 3.49Å
1362	L	31.4	Very low	32.5	Very low	170 Å²	170	98.3 Å²	98.3	89%	0.89	56%	0.557	S	S	*	*			trans	63.9	175.5	175.1	-55.7	-177.8	0	0	0	113.7
1363	P	31.5	Very low	32.7	Very low	122 Å²	122	99.6 Å²	99.6	79%	0.792	56%	0.555	S	S	*	*			cis	-122.1	-87.3	-1.5	34.6	-14.9	0	0	0	115.7
1364	S	28.1	Very low	32.7	Very low	89 Å²	89	101.2 Å²	101.2	62%	0.622	55%	0.554	S	S	*	*			trans	-163.9	174.5	-152	58	0	0	0	0	113
1365	S	30	Very low	32.4	Very low	103 Å²	103	101.7 Å²	101.7	72%	0.72	55%	0.553	S	S	*	*			trans	66	146.6	158.5	45.1	0	0	0	0	119.3	T1367	S1365-T1367 PolarHBondContact O-N 2.71Å
1366	E	34.8	Very low	32.4	Very low	133 Å²	133	104.3 Å²	104.3	62%	0.621	56%	0.56	S	S	*	*			trans	-89	98.9	-169.8	-62.8	177.7	-175.4	0	0	113.5
1367	T	33.2	Very low	32.3	Very low	107 Å²	107	105.6 Å²	105.6	66%	0.656	57%	0.568	S	S	*	*			trans	-99.5	114.5	155.6	-49.6	0	0	0	0	108.3	S1365 Y1369	S1365-T1367 PolarHBondContact O-N 2.71Å; T1367-Y1369 HydrophobicContact CG2-CE2 4.34Å; T1367-Y1369 VanDerWaalsContact O-CD2 3.28Å; T1367-Y1369 WeakPolarHBondContact O-CD2 3.38Å; T1367-Y1369 PolarHBondContact O-N 2.77Å
1368	R	33.6	Very low	32	Very low	227 Å²	227	105 Å²	105	86%	0.857	56%	0.555	S	S	*	*			trans	-76.4	86.4	-167.9	-82.6	-175.9	-83.6	178.7	-7.1	113.8
1369	Y	29.6	Very low	31.8	Very low	163 Å²	163	107.3 Å²	107.3	64%	0.639	55%	0.551	S	S	*	*			trans	-76.1	124.5	157.9	-60.6	-76.6	0	0	0	109.5	V1336 T1367 A1371	V1336-Y1369 HydrophobicContact CG1-CD1 4.13Å; V1336-Y1369 HydrophobicContact CG1-CG 4.43Å; T1367-Y1369 HydrophobicContact CG2-CE2 4.34Å; T1367-Y1369 VanDerWaalsContact O-CD2 3.28Å; T1367-Y1369 WeakPolarHBondContact O-CD2 3.38Å; T1367-Y1369 PolarHBondContact O-N 2.77Å; Y1369-A1371 PolarHBondContact O-N 2.85Å
1370	V	35.6	Very low	31.7	Very low	70 Å²	70	111.6 Å²	111.6	42%	0.424	57%	0.573	S	S	.	*			trans	-78	72.6	-177	-173.9	0	0	0	0	110.4	V1336 V1337 P1339 A1372	V1336-V1370 CarbonylContact C-O 3.5Å; V1336-V1370 WeakPolarHBondContact CA-O 3.24Å; V1337-V1370 PolarHBondContact N-O 2.76Å; V1337-V1370 WeakPolarHBondContact O-CB 3.32Å; P1339-V1370 HydrophobicContact CG-CG2 4Å; V1370-A1372 PolarHBondContact O-N 3.36Å; V1370-A1372 VanDerWaalsContact O-N 3.09Å
1371	A	32	Very low	31.7	Very low	42 Å²	42	112 Å²	112	35%	0.347	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78	82.2	-173	0	0	0	0	0	112.1	F1334 V1336 Y1369 R1373	F1334-A1371 HydrophobicContact CB-CB 4.05Å; F1334-A1371 HydrophobicContact CD1-CB 3.75Å; F1334-A1371 HydrophobicContact CG-CB 4.24Å; V1336-A1371 HydrophobicContact CG2-CB 4.1Å; Y1369-A1371 PolarHBondContact O-N 2.85Å; A1371-R1373 PolarHBondContact O-N 2.78Å; A1371-R1373 VanDerWaalsContact O-N 3.1Å
1372	A	38.9	Very low	31.8	Very low	49 Å²	49	114.8 Å²	114.8	41%	0.405	60%	0.597	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-68.5	108.9	178.9	0	0	0	0	0	111	L1335 V1370 Y1374	L1335-A1372 HydrophobicContact CB-CB 4.13Å; L1335-A1372 HydrophobicContact CD2-CB 4.33Å; L1335-A1372 PolarHBondContact N-O 2.86Å; L1335-A1372 WeakPolarHBondContact O-CB 3.39Å; L1335-A1372 PolarHBondContact O-N 2.88Å; V1370-A1372 PolarHBondContact O-N 3.36Å; V1370-A1372 VanDerWaalsContact O-N 3.09Å; A1372-Y1374 PolarHBondContact O-N 2.82Å
1373	R	37.8	Very low	31.5	Very low	135 Å²	135	112.5 Å²	112.5	51%	0.509	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.1	112.2	-170	178	168.7	144.3	-172.4	-9.2	112.4	Q1332 Y1333 F1334 A1371 L1375	Q1332-R1373 HydrophobicContact CB-CG 4.44Å; Q1332-R1373 HydrophobicContact CG-CG 4.48Å; Y1333-R1373 CarbonylContact O-C 3.44Å; Y1333-R1373 VanDerWaalsContact O-CA 3.28Å; Y1333-R1373 WeakPolarHBondContact O-CA 3.19Å; F1334-R1373 HydrophobicContact CD1-CB 3.93Å; F1334-R1373 HydrophobicContact CD1-CG 4.39Å; F1334-R1373 HydrophobicContact CE1-CB 3.75Å; F1334-R1373 HydrophobicContact CE1-CG 3.92Å; F1334-R1373 HydrophobicContact CZ-CG 4.33Å; A1371-R1373 PolarHBondContact O-N 2.78Å; A1371-R1373 VanDerWaalsContact O-N 3.1Å; R1373-L1375 HydrophobicContact CG-CG 4.42Å
1374	Y	38.2	Very low	31.2	Very low	141 Å²	141	118 Å²	118	55%	0.553	60%	0.598	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.5	109.6	170.2	-132.7	-86.7	0	0	0	109.1	L1320 Q1332 Y1333 A1372	L1320-Y1374 HydrophobicContact CD1-CE2 4.48Å; Q1332-Y1374 WeakPolarHBondContact CA-O 3.12Å; Y1333-Y1374 PolarHBondContact N-O 3.36Å; Y1333-Y1374 PolarHBondContact O-N 2.77Å; A1372-Y1374 PolarHBondContact O-N 2.82Å
1375	L	32.4	Very low	31.1	Very low	90 Å²	90	122.3 Å²	122.3	47%	0.471	61%	0.608	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.9	140.6	168.1	-80.2	152.9	0	0	0	109.1	Q1332 R1373	Q1332-L1375 HydrophobicContact CG-CD2 4.43Å; R1373-L1375 HydrophobicContact CG-CG 4.42Å
1376	Q	33.8	Very low	30.9	Very low	135 Å²	135	121.2 Å²	121.2	63%	0.631	60%	0.6	S	S	*	*			trans	-117.2	108.6	169.9	-167.6	172.2	13	0	0	109.2
1377	D	31.3	Very low	30.4	Very low	92 Å²	92	125.9 Å²	125.9	49%	0.492	61%	0.612	S	S	.	*			trans	-69.6	159.7	-165.7	-73.3	-52.9	0	0	0	115.3	F1379	D1377-F1379 VanDerWaalsContact C-N 3.29Å; D1377-F1379 HydrophobicContact CB-CD2 4.11Å; D1377-F1379 HydrophobicContact CB-CE2 4.35Å; D1377-F1379 PolarHBondContact O-N 2.87Å; D1377-F1379 VanDerWaalsContact O-N 3.15Å
1378	Y	28.5	Very low	30.1	Very low	83 Å²	83	126.6 Å²	126.6	33%	0.325	61%	0.612	S	S	.	*			trans	-78.4	80.4	156.3	-95.7	-88.1	0	0	0	110.8	D1229 D1230 A1231 G1232 K1329 D1380	D1229-Y1378 PolarHBondContact O-OH 2.76Å; D1230-Y1378 WeakPolarHBondContact CA-OH 3.26Å; D1230-Y1378 VanDerWaalsContact O-CE1 3.26Å; D1230-Y1378 WeakPolarHBondContact O-CE1 3.29Å; D1230-Y1378 PolarHBondContact O-OH 2.75Å; A1231-Y1378 PolarHBondContact N-OH 2.79Å; G1232-Y1378 PolarHBondContact N-OH 2.78Å; K1329-Y1378 HydrophobicContact CD-CE2 3.99Å; K1329-Y1378 WeakPolarHBondContact CD-OH 3.32Å; K1329-Y1378 PolarHBondContact NZ-OH 3.08Å; K1329-Y1378 VanDerWaalsContact NZ-OH 3.09Å; Y1378-D1380 PolarHBondContact O-N 2.78Å
1379	F	26.7	Very low	29.7	Very low	124 Å²	124	124.3 Å²	124.3	54%	0.544	61%	0.608	S	S	.	*			trans	-75.7	106.3	143.9	-79.3	-87.9	0	0	0	107.9	D1377	D1377-F1379 VanDerWaalsContact C-N 3.29Å; D1377-F1379 HydrophobicContact CB-CD2 4.11Å; D1377-F1379 HydrophobicContact CB-CE2 4.35Å; D1377-F1379 PolarHBondContact O-N 2.87Å; D1377-F1379 VanDerWaalsContact O-N 3.15Å
1380	D	26.9	Very low	29.5	Very low	113 Å²	113	121.3 Å²	121.3	60%	0.604	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-66	143.4	160.2	-101.9	-30.6	0	0	0	109.5	Y1378 P1382	Y1378-D1380 PolarHBondContact O-N 2.78Å; D1380-P1382 VanDerWaalsContact O-CD 3.24Å; D1380-P1382 WeakPolarHBondContact O-CD 3.46Å
1381	P	26.8	Very low	29.1	Very low	114 Å²	114	125.7 Å²	125.7	74%	0.74	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-85.1	121.7	-154.1	29.8	-36	0	0	0	115.7
1382	P	27.5	Very low	28.8	Very low	108 Å²	108	126.9 Å²	126.9	70%	0.701	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-77.3	172.1	158.7	33.5	-32.9	0	0	0	111.6	D1380	D1380-P1382 VanDerWaalsContact O-CD 3.24Å; D1380-P1382 WeakPolarHBondContact O-CD 3.46Å
1383	P	25.3	Very low	28.1	Very low	123 Å²	123	128.9 Å²	128.9	80%	0.799	66%	0.655	S	S	*	*			trans	-92.8	176.8	-132.1	-12	29.4	0	0	0	118.6	H1385	P1383-H1385 PolarHBondContact O-N 2.99Å
1384	R	23.6	Very low	27.5	Very low	238 Å²	238	132.3 Å²	132.3	90%	0.898	67%	0.669	S	S	*	*			trans	-42.8	120.1	161.7	-56.1	169.2	179.6	176.3	-1.5	112
1385	H	27.6	Very low	27	Very low	178 Å²	178	132 Å²	132	82%	0.824	68%	0.678	S	S	*	*			trans	-173.3	95.1	140.2	-94.5	-60.8	0	0	0	107.5	P1383	P1383-H1385 PolarHBondContact O-N 2.99Å
1386	S	23.9	Very low	26.6	Very low	80 Å²	80	133.7 Å²	133.7	56%	0.559	69%	0.691	S	S	*	*				73.9	124.3	80.5	74.5	0	0	0	0	114.2
1387	R	25.3	Very low	26.1	Very low	231 Å²	231	135.7 Å²	135.7	87%	0.872	70%	0.698	S	S	*	*			trans	68.2	130.2	172	-53.5	165.6	179.3	172	-1.9	113.6
1388	N	27	Very low	25.9	Very low	123 Å²	123	136 Å²	136	66%	0.658	71%	0.707	S	S	*	*			cis	-139.9	-164.8	-7.5	-86.7	-10	0	0	0	106
1389	F	25.1	Very low	25.7	Very low	178 Å²	178	139.7 Å²	139.7	78%	0.781	73%	0.732	S	S	*	*			cis	-144.8	-177.6	12.2	-111.8	-65	0	0	0	112.2
1390	T	26.2	Very low	25.9	Very low	100 Å²	100	144.9 Å²	144.9	61%	0.613	75%	0.748	S	S	*	*			trans	-42.4	152.8	172.2	45.5	0	0	0	0	117.5
1391	L	25.6	Very low	25.8	Very low	163 Å²	163	145.2 Å²	145.2	85%	0.853	76%	0.757	S	S	*	*				66.6	142.1	52	-74.1	140.6	0	0	0	113.7
1392	G	25.8	Very low	25.8	Very low	67 Å²	67	147.4 Å²	147.4	69%	0.691	76%	0.757	S	S	*	*			trans	109.3	92.8	-163	0	0	0	0	0	110.1
1393	S	24.8	Very low	25.6	Very low	91 Å²	91	151.6 Å²	151.6	64%	0.636	76%	0.759	S	S	*	*			cis	74.6	143.1	23.7	-40.5	0	0	0	0	114.4
1394	Y	24.8	Very low	25.7	Very low	206 Å²	206	153.3 Å²	153.3	81%	0.808	76%	0.756	S	S	*	*			trans	75	111.4	-174.4	-58	-88.3	0	0	0	114.5
1395	N	27.7	Very low	25.8	Very low	136 Å²	136	147.5 Å²	147.5	73%	0.727	75%	0.746	S	S	*	*				84.2	158.3	56.8	-77.7	-45.2	0	0	0	113.1
1396	V	24.3	Very low	25.7	Very low	124 Å²	124	146.3 Å²	146.3	75%	0.752	75%	0.746	S	S	*	*			trans	74	121.4	170.9	-169.7	0	0	0	0	112.7
1397	K	24.2	Very low	26	Very low	178 Å²	178	147.2 Å²	147.2	77%	0.774	75%	0.752	S	S	*	*			cis	-134	140.9	3.8	-94.9	135.4	-173.8	174.6	0	107.3
1398	S	25.4	Very low	26.2	Very low	99 Å²	99	140.5 Å²	140.5	69%	0.692	74%	0.741	S	S	*	*				53.5	78.7	65.6	80.8	0	0	0	0	115.4
1399	N	26.2	Very low	26.4	Very low	159 Å²	159	145.6 Å²	145.6	85%	0.85	75%	0.751	S	S	*	*			trans	-171.7	132	155.4	-95.1	-6.7	0	0	0	105.7
1400	R	30.1	Very low	26.5	Very low	234 Å²	234	144.2 Å²	144.2	88%	0.883	75%	0.75	S	S	*	*			cis	51.8	123.9	17.8	-81.9	-168.9	177	-168.5	0.9	113.7
1401	P	25.3	Very low	26.7	Very low	120 Å²	120	144.1 Å²	144.1	78%	0.779	75%	0.751	S	S	*	*			cis	-128	-168	3.2	41.1	-23.2	0	0	0	114
1402	Q	25.4	Very low	26.6	Very low	159 Å²	159	146.8 Å²	146.8	74%	0.743	75%	0.75	S	S	*	*			trans	-41.5	154.2	157.3	-52.5	157.9	-28.6	0	0	113.7
1403	R	24.1	Very low	26.5	Very low	196 Å²	196	151 Å²	151	74%	0.74	75%	0.752	S	S	*	*				166.5	155.5	104.9	-95.1	-179.9	176.7	-164.9	-1.8	115.8
1404	H	26.3	Very low	26.4	Very low	159 Å²	159	152.2 Å²	152.2	74%	0.736	76%	0.755	S	S	*	*			trans	68.5	142.8	165.3	-56	-57.3	0	0	0	115.9
1405	V	25.7	Very low	26.4	Very low	116 Å²	116	149.5 Å²	149.5	70%	0.703	75%	0.752	S	S	*	*			cis	-134.1	132.9	17.7	174.2	0	0	0	0	111.9
1406	N	26.1	Very low	26.3	Very low	153 Å²	153	147.8 Å²	147.8	82%	0.818	75%	0.747	S	S	*	*			trans	59.2	141.7	160.3	-62.3	-4.8	0	0	0	119.9
1407	S	30.6	Very low	26.3	Very low	99 Å²	99	146.7 Å²	146.7	69%	0.692	74%	0.74	S	S	*	*			cis	-155.7	155.2	-4.3	-173.4	0	0	0	0	112.1
1408	S	30.5	Very low	26.4	Very low	90 Å²	90	144.5 Å²	144.5	63%	0.629	74%	0.737	S	S	*	*			trans	28	129.1	149.5	61	0	0	0	0	120.9
1409	R	31	Very low	26.3	Very low	230 Å²	230	146.4 Å²	146.4	87%	0.868	74%	0.739	S	S	*	*			cis	-145.7	158.8	5.6	-45.7	174.9	167.2	157.3	-5.8	107.2
1410	I	26.3	Very low	26.3	Very low	150 Å²	150	146.7 Å²	146.7	77%	0.769	74%	0.736	S	S	*	*			cis	67.4	133.9	32.9	-36.9	160	0	0	0	113
1411	P	29.7	Very low	26.1	Very low	97 Å²	97	144.4 Å²	144.4	63%	0.63	73%	0.732	S	S	*	*			cis	-129.4	157.9	-47.1	39	-23.1	0	0	0	113.3
1412	R	24.7	Very low	26.1	Very low	219 Å²	219	145.5 Å²	145.5	83%	0.826	73%	0.731	S	S	*	*			trans	166.9	124.6	141.1	-94.5	160.4	-179.3	179.5	-0.8	107.1
1413	Q	23.6	Very low	26.1	Very low	156 Å²	156	147.3 Å²	147.3	73%	0.729	73%	0.732	S	S	*	*			cis	65.2	146.6	49.4	-57.7	176.6	-62.8	0	0	113
1414	T	23.3	Very low	26.3	Very low	116 Å²	116	144.8 Å²	144.8	71%	0.712	73%	0.729	S	S	*	*			trans	64.4	138.4	167.6	55.8	0	0	0	0	115.3
1415	M	24.6	Very low	26.4	Very low	150 Å²	150	141.6 Å²	141.6	74%	0.739	71%	0.714	S	S	*	*			cis	-158.5	166.3	1	-126.7	162	100.2	0	0	111.4
1416	T	25.6	Very low	26.6	Very low	100 Å²	100	140 Å²	140	61%	0.613	70%	0.702	S	S	*	*			trans	62	155.5	156.3	57.6	0	0	0	0	113.8
1417	T	23.3	Very low	26.7	Very low	101 Å²	101	136 Å²	136	62%	0.62	69%	0.686	S	S	*	*			cis	57	144.5	40.3	94.8	0	0	0	0	111.1
1418	D	26.5	Very low	26.4	Very low	132 Å²	132	136.3 Å²	136.3	71%	0.706	68%	0.676	S	S	*	*			cis	-108.9	162.6	-7.2	-74.2	-82.6	0	0	0	107.3
1419	D	23.7	Very low	26.2	Very low	139 Å²	139	136.8 Å²	136.8	74%	0.743	67%	0.671	S	S	*	*				50.1	159.6	77.1	-132.3	-23.3	0	0	0	114.1
1420	E	25.8	Very low	26	Very low	164 Å²	164	133.1 Å²	133.1	77%	0.766	67%	0.665	S	S	*	*			trans	62.6	98.3	175.6	-62	-164.2	138.3	0	0	115.8
1421	F	25.2	Very low	26.1	Very low	186 Å²	186	132.1 Å²	132.1	82%	0.816	66%	0.656	S	S	*	*				91.5	165.3	79.1	-99.2	-127.9	0	0	0	112.6
1422	L	25.6	Very low	25.9	Very low	143 Å²	143	130.4 Å²	130.4	75%	0.749	64%	0.641	S	S	*	*			trans	72.4	126.7	174.3	-62.2	157.2	0	0	0	113.3
1423	Y	26.9	Very low	26.2	Very low	198 Å²	198	121 Å²	121	78%	0.776	61%	0.608	S	S	*	*				54	113.8	71.2	-75	-103.9	0	0	0	108.5
1424	E	26.7	Very low	26.3	Very low	142 Å²	142	119.2 Å²	119.2	66%	0.664	60%	0.597	S	S	*	*			cis	-165.5	174.8	39.2	-104.2	157.1	178	0	0	110
1425	Q	29.6	Very low	26.5	Very low	92 Å²	92	116.7 Å²	116.7	43%	0.43	59%	0.589	S	S	.	*			cis	-154	163.2	6.2	-138.1	134.2	28.1	0	0	109.8
1426	D	28.5	Very low	26.7	Very low	83 Å²	83	112.2 Å²	112.2	44%	0.444	57%	0.567	S	S	.	*			trans	15	135.6	137.9	-53.2	-13.8	0	0	0	118.4	E1428 G1612 S1613 S1614	D1426-E1428 HydrophobicContact CB-CG 4.12Å; D1426-G1612 WeakPolarHBondContact O-CA 2.98Å; D1426-S1613 WeakPolarHBondContact O-CA 2.94Å; D1426-S1614 WeakPolarHBondContact OD2-CA 3.23Å; D1426-S1614 VanDerWaalsContact OD2-CB 3.22Å; D1426-S1614 WeakPolarHBondContact OD2-CB 3.42Å
1427	S	28.9	Very low	26.7	Very low	70 Å²	70	112 Å²	112	49%	0.49	57%	0.565	S	S	.	*				-160.9	160.4	72.6	54.8	0	0	0	0	116	G1612	S1427-G1612 WeakPolarHBondContact CB-O 3.2Å; S1427-G1612 VanDerWaalsContact OG-CA 3.31Å; S1427-G1612 WeakPolarHBondContact OG-CA 3.47Å; S1427-G1612 PolarHBondContact OG-N 2.85Å; S1427-G1612 VanDerWaalsContact OG-N 3.15Å; S1427-G1612 PolarHBondContact OG-O 2.81Å
1428	E	25.4	Very low	27	Very low	104 Å²	104	113.9 Å²	113.9	49%	0.486	57%	0.571	S	S	.	*			cis	-152.7	148.3	-26.8	-110.1	-165.9	134.8	0	0	107.8	D1426 S1614	D1426-E1428 HydrophobicContact CB-CG 4.12Å; E1428-S1614 VanDerWaalsContact CD-N 3.28Å; E1428-S1614 WeakPolarHBondContact OE1-CA 3.38Å; E1428-S1614 PolarHBondContact OE1-N 3.22Å; E1428-S1614 VanDerWaalsContact OE1-N 3.17Å
1429	I	25.8	Very low	27	Very low	101 Å²	101	109.8 Å²	109.8	52%	0.518	56%	0.56	S	S	.	*			trans	25.7	105.6	131.3	-50.5	177.4	0	0	0	113.8	F1431	I1429-F1431 HydrophobicContact CG1-CD2 4.44Å
1430	M	27.1	Very low	27.1	Very low	152 Å²	152	110.3 Å²	110.3	75%	0.749	56%	0.558	S	S	*	*				-135.3	139.9	57.4	-76.5	-175.7	-167.2	0	0	112
1431	F	27.7	Very low	27.1	Very low	129 Å²	129	108.6 Å²	108.6	57%	0.566	55%	0.55	S	S	*	*			cis	49.8	66.5	27.7	-75.5	-37.2	0	0	0	113.7	P284 I1429 N1433	P284-F1431 HydrophobicContact CG-CE1 4.19Å; I1429-F1431 HydrophobicContact CG1-CD2 4.44Å; F1431-N1433 WeakPolarHBondContact CA-ND2 3.02Å; F1431-N1433 WeakPolarHBondContact CB-ND2 3.22Å; F1431-N1433 WeakPolarHBondContact CD1-ND2 3.1Å; F1431-N1433 VanDerWaalsContact CD1-OD1 3.32Å; F1431-N1433 WeakPolarHBondContact CD1-OD1 3.49Å
1432	D	26.3	Very low	27.1	Very low	61 Å²	61	106.8 Å²	106.8	33%	0.326	54%	0.539	S	S	.	.				-137.6	124.2	110.7	-105	7.2	0	0	0	109.4	R280 S282	R280-D1432 WeakPolarHBondContact CD-OD2 3.43Å; R280-D1432 WeakPolarHBondContact CG-OD2 3.1Å; R280-D1432 IonicContact CZ-OD2 3.51Å; R280-D1432 IonicContact NE-OD2 2.68Å; R280-D1432 PolarHBondContact NE-OD2 3.34Å; R280-D1432 IonicContact NH2-OD2 3.35Å; S282-D1432 WeakPolarHBondContact CA-OD1 3.19Å; S282-D1432 PolarHBondContact N-OD1 2.83Å
1433	N	30.2	Very low	27.1	Very low	23 Å²	23	106.9 Å²	106.9	12%	0.123	53%	0.533	C	S	.	.			cis	65.1	137.6	39.7	-44.4	-42.2	0	0	0	112.4	S282 G283 P284 F1431	S282-N1433 WeakPolarHBondContact CA-ND2 3.31Å; G283-N1433 VanDerWaalsContact C-CB 3.46Å; G283-N1433 PolarHBondContact N-ND2 3.41Å; G283-N1433 VanDerWaalsContact O-CB 3.23Å; G283-N1433 WeakPolarHBondContact O-CB 3.49Å; P284-N1433 WeakPolarHBondContact CA-OD1 3.04Å; P284-N1433 VanDerWaalsContact CB-OD1 3.25Å; P284-N1433 WeakPolarHBondContact CB-OD1 3.14Å; P284-N1433 VanDerWaalsContact CD-OD1 3.24Å; P284-N1433 WeakPolarHBondContact CD-OD1 3.49Å; F1431-N1433 WeakPolarHBondContact CA-ND2 3.02Å; F1431-N1433 WeakPolarHBondContact CB-ND2 3.22Å; F1431-N1433 WeakPolarHBondContact CD1-ND2 3.1Å; F1431-N1433 VanDerWaalsContact CD1-OD1 3.32Å; F1431-N1433 WeakPolarHBondContact CD1-OD1 3.49Å
1434	K	25.9	Very low	26.9	Very low	117 Å²	117	102.6 Å²	102.6	51%	0.509	53%	0.533	S	S	.	.			trans	63.7	137.7	179.5	-46.7	-172.7	-179.3	-172.4	0	112.5	P281 S282	P281-K1434 WeakPolarHBondContact O-CE 3.31Å; P281-K1434 PolarHBondContact O-NZ 3.24Å; S282-K1434 WeakPolarHBondContact O-CE 3.38Å
1435	A	28.2	Very low	26.8	Very low	64 Å²	64	105.1 Å²	105.1	53%	0.529	54%	0.542	S	S	.	.			cis	-132.1	157.7	0.8	0	0	0	0	0	109.3	V1437	A1435-V1437 HydrophobicContact CB-CB 4.08Å; A1435-V1437 HydrophobicContact CB-CG2 4.26Å
1436	L	27.6	Very low	26.6	Very low	55 Å²	55	106.7 Å²	106.7	29%	0.288	56%	0.557	S	S	.	*			cis	61	175.1	29	-133.8	-177.7	0	0	0	110.3	I285 L287	I285-L1436 HydrophobicContact CB-CD1 4.14Å; I285-L1436 HydrophobicContact CG2-CD1 4.2Å; L287-L1436 HydrophobicContact CB-CB 4.43Å; L287-L1436 HydrophobicContact CB-CD2 3.86Å; L287-L1436 HydrophobicContact CB-CG 3.79Å; L287-L1436 HydrophobicContact CD1-CD1 4.05Å; L287-L1436 HydrophobicContact CD1-CD2 3.83Å; L287-L1436 HydrophobicContact CD1-CG 3.59Å; L287-L1436 HydrophobicContact CD2-CD2 4.09Å; L287-L1436 HydrophobicContact CG-CD2 4.13Å; L287-L1436 HydrophobicContact CG-CG 4.18Å; L287-L1436 WeakPolarHBondContact O-CA 3.22Å; L287-L1436 PolarHBondContact O-N 2.9Å; L287-L1436 VanDerWaalsContact O-N 3.09Å
1437	V	26.8	Very low	26.4	Very low	95 Å²	95	113.5 Å²	113.5	58%	0.576	58%	0.577	S	S	*	*			trans	57.1	94.1	167.7	-175.6	0	0	0	0	113.3	A1435	A1435-V1437 HydrophobicContact CB-CB 4.08Å; A1435-V1437 HydrophobicContact CB-CG2 4.26Å
1438	L	27.9	Very low	26.3	Very low	141 Å²	141	114.1 Å²	114.1	74%	0.738	59%	0.586	S	S	*	*				61.8	128	102.8	-59.4	156.4	0	0	0	112.2
1439	G	28.2	Very low	26.2	Very low	47 Å²	47	115 Å²	115	49%	0.485	60%	0.602	S	S	.	*				83	124.6	52.2	0	0	0	0	0	108.7
1440	Q	24.9	Very low	26.1	Very low	149 Å²	149	116 Å²	116	70%	0.696	61%	0.613	S	S	*	*			trans	71.9	149.7	-172.2	-59.6	158.7	-103.3	0	0	113.2	T275	T275-Q1440 PolarHBondContact OG1-O 3.24Å
1441	E	25	Very low	26	Very low	128 Å²	128	116.6 Å²	116.6	60%	0.598	61%	0.612	S	S	*	*			cis	-145.4	150.7	-4.4	-107.7	140.3	-142.5	0	0	106.6	T275	T275-E1441 VanDerWaalsContact CG2-O 3.26Å; T275-E1441 WeakPolarHBondContact CG2-O 3.28Å
1442	Y	25.2	Very low	26	Very low	148 Å²	148	117 Å²	117	58%	0.58	62%	0.615	S	S	*	*				64.8	125.1	70.5	-108.8	-118.8	0	0	0	115.4	T308 E309	T308-Y1442 PolarHBondContact OG1-OH 2.85Å; E309-Y1442 VanDerWaalsContact CD-CD1 3.46Å; E309-Y1442 HydrophobicContact CG-CE1 4.4Å; E309-Y1442 VanDerWaalsContact OE1-CD1 3.3Å; E309-Y1442 WeakPolarHBondContact OE1-CD1 3.17Å; E309-Y1442 WeakPolarHBondContact OE1-CE1 3.48Å; E309-Y1442 WeakPolarHBondContact OE2-CA 3.31Å; E309-Y1442 WeakPolarHBondContact OE2-CD1 3.38Å
1443	K	25.5	Very low	26	Very low	145 Å²	145	120.6 Å²	120.6	63%	0.63	63%	0.63	S	S	*	*			trans	58.8	116.4	168.4	-57.2	-178.4	-180	170.3	0	120.8	E309	E309-K1443 WeakPolarHBondContact OE1-CE 3.45Å; E309-K1443 WeakPolarHBondContact OE1-CG 3.48Å; E309-K1443 IonicContact OE1-NZ 2.7Å; E309-K1443 WeakPolarHBondContact OE2-CA 3.27Å; E309-K1443 WeakPolarHBondContact OE2-CG 3.23Å; E309-K1443 PolarHBondContact OE2-N 3.39Å
1444	S	24.6	Very low	25.9	Very low	109 Å²	109	125 Å²	125	76%	0.762	65%	0.654	S	S	*	*				160.8	121.3	104.9	-71.7	0	0	0	0	115.5
1445	F	22.9	Very low	26	Very low	195 Å²	195	126.5 Å²	126.5	86%	0.855	66%	0.662	S	S	*	*			trans	-150.4	78.9	141.3	-167	-97.2	0	0	0	111.9
1446	V	25.3	Very low	26	Very low	124 Å²	124	127.8 Å²	127.8	75%	0.752	67%	0.668	S	S	*	*	S	Bend	trans	-142.9	122.9	160.7	173.1	0	0	0	0	107.4
1447	R	24.3	Very low	26	Very low	226 Å²	226	130 Å²	130	85%	0.853	68%	0.683	S	S	*	*			trans	66.3	125.3	-171.3	-60	164.3	-179.7	150.1	0.9	112.4
1448	A	27	Very low	26	Very low	83 Å²	83	128.9 Å²	128.9	69%	0.686	68%	0.68	S	S	*	*			cis	77.6	139.8	32	0	0	0	0	0	115.1
1449	C	24.4	Very low	26.1	Very low	123 Å²	123	126.4 Å²	126.4	83%	0.831	67%	0.668	S	S	*	*			trans	84.6	134.7	173	-62.1	0	0	0	0	118.8
1450	V	23.9	Very low	26.2	Very low	122 Å²	122	125 Å²	125	74%	0.739	65%	0.653	S	S	*	*			trans	94.6	89.7	152.3	177.5	0	0	0	0	119.3
1451	F	25.2	Very low	26.7	Very low	164 Å²	164	120.2 Å²	120.2	72%	0.719	64%	0.635	S	S	*	*				54.6	136.2	124.9	-69	-81.8	0	0	0	123.1
1452	Q	26	Very low	26.9	Very low	137 Å²	137	117.5 Å²	117.5	64%	0.64	62%	0.622	S	S	*	*			trans	63.8	144	131.7	-72.1	173.3	-58	0	0	119.4
1453	E	27.8	Very low	27	Very low	138 Å²	138	111 Å²	111	65%	0.645	60%	0.599	S	S	*	*			cis	-161	170.5	-3.4	-133.1	154.6	-161.9	0	0	110.4
1454	D	27	Very low	27	Very low	115 Å²	115	108.1 Å²	108.1	62%	0.615	60%	0.596	S	S	*	*			trans	46.2	146.1	137.5	-76.4	4	0	0	0	123.5
1455	Q	29	Very low	27.1	Very low	148 Å²	148	107.2 Å²	107.2	69%	0.692	59%	0.586	S	S	*	*			cis	-171.2	-169	-16.8	-129	178.6	66.7	0	0	107.4
1456	S	28.2	Very low	27.2	Very low	92 Å²	92	99.9 Å²	99.9	64%	0.643	56%	0.559	S	S	*	*			trans	76.2	114.4	152.3	85.2	0	0	0	0	115.1
1457	T	26.7	Very low	27.2	Very low	100 Å²	100	97 Å²	97	61%	0.613	55%	0.545	S	S	*	.				59.7	145.1	79.8	68.6	0	0	0	0	113.8
1458	S	27.4	Very low	27.4	Very low	73 Å²	73	90 Å²	90	51%	0.51	54%	0.535	S	S	.	.			cis	-159	180	-1.4	43.2	0	0	0	0	107.3	F1552	S1458-F1552 VanDerWaalsContact CB-CE1 3.47Å
1459	D	30	Very low	27.3	Very low	89 Å²	89	96 Å²	96	48%	0.476	54%	0.54	S	S	.	.			cis	178.9	-170.7	46.6	-141.1	-49	0	0	0	113.4	I1553 R1554	D1459-I1553 WeakPolarHBondContact O-CG2 3.33Å; D1459-R1554 IonicContact OD1-NH1 3.6Å; D1459-R1554 PolarHBondContact OD1-NH1 2.8Å
1460	G	31	Very low	27.5	Very low	17 Å²	17	93.7 Å²	93.7	18%	0.175	53%	0.525	C	S	.	.			trans	118.1	78.3	156.1	0	0	0	0	0	115.1	R1554 R1555	G1460-R1554 VanDerWaalsContact C-CD 3.47Å; G1460-R1554 WeakPolarHBondContact O-CB 3.36Å; G1460-R1554 WeakPolarHBondContact O-CD 3.37Å; G1460-R1555 WeakPolarHBondContact O-CG 3.48Å; G1460-R1555 PolarHBondContact O-NE 3.09Å
1461	P	35	Very low	27.6	Very low	49 Å²	49	94.6 Å²	94.6	32%	0.318	52%	0.521	S	S	.	.			trans	-46.1	159.2	-169	-28.1	34.1	0	0	0	117.7	R1554 K1556	P1461-R1554 VanDerWaalsContact CA-CD 3.44Å; P1461-K1556 WeakPolarHBondContact O-CE 3.1Å
1462	E	28.5	Very low	27.7	Very low	70 Å²	70	90 Å²	90	33%	0.327	52%	0.52	S	S	.	.			cis	-177.8	-168.5	28.2	-152.9	159.1	-111.8	0	0	112.3	K1556 R1557 R1558	E1462-K1556 WeakPolarHBondContact O-CA 3.15Å; E1462-R1557 IonicContact OE2-CZ 2.7Å; E1462-R1557 IonicContact OE2-NE 2.58Å; E1462-R1557 IonicContact OE2-NH2 3.4Å; E1462-R1557 PolarHBondContact OE2-NH2 3.27Å; E1462-R1558 IonicContact OE2-CZ 3.49Å; E1462-R1558 IonicContact OE2-NH1 3.32Å; E1462-R1558 PolarHBondContact OE2-NH1 2.84Å; E1462-R1558 IonicContact OE2-NH2 3.45Å; E1462-R1558 PolarHBondContact OE2-NH2 3.21Å
1463	A	27.8	Very low	27.8	Very low	11 Å²	11	92.4 Å²	92.4	9%	0.091	53%	0.529	C	S	.	.			trans	80.6	93.1	134	0	0	0	0	0	117.4	R1557 R1558	A1463-R1557 HydrophobicContact CB-CB 4.29Å; A1463-R1557 VanDerWaalsContact CB-CD 3.49Å; A1463-R1557 HydrophobicContact CB-CG 3.76Å; A1463-R1557 WeakPolarHBondContact O-CA 3.42Å; A1463-R1558 HydrophobicContact CB-CB 3.81Å; A1463-R1558 HydrophobicContact CB-CG 3.51Å
1464	C	25.8	Very low	27.8	Very low	85 Å²	85	89.2 Å²	89.2	57%	0.574	53%	0.532	S	S	*	.			cis	95.4	115.5	20.2	-48.9	0	0	0	0	117
1465	T	26.1	Very low	28.1	Very low	91 Å²	91	89 Å²	89	56%	0.558	54%	0.537	S	S	*	.			trans	79.9	159.5	156.7	79.7	0	0	0	0	116.6	P1559 K1560	T1465-P1559 CarbonylContact O-C 3.27Å; T1465-P1559 WeakPolarHBondContact O-CA 3.31Å; T1465-K1560 PolarHBondContact O-N 3.14Å; T1465-K1560 WeakPolarHBondContact OG1-CE 3.45Å
1466	S	24.9	Very low	27.9	Very low	40 Å²	40	87 Å²	87	28%	0.28	53%	0.531	S	S	.	.			cis	-155.9	154.2	6.5	65.6	0	0	0	0	111.3	K1560 L1561	S1466-K1560 WeakPolarHBondContact OG-CA 3.43Å; S1466-K1560 WeakPolarHBondContact OG-CG 3.25Å; S1466-L1561 WeakPolarHBondContact OG-CB 3.41Å; S1466-L1561 WeakPolarHBondContact OG-CD1 3.38Å; S1466-L1561 WeakPolarHBondContact OG-CG 3.49Å
1467	S	26.1	Very low	27.7	Very low	64 Å²	64	92 Å²	92	45%	0.448	54%	0.536	S	S	.	.			trans	21	141.2	137.4	65.7	0	0	0	0	119.6	L1561	S1467-L1561 WeakPolarHBondContact OG-CG 3.44Å
1468	A	27.9	Very low	27.7	Very low	78 Å²	78	95 Å²	95	65%	0.645	54%	0.543	S	S	*	.				-168.3	165.7	57.6	0	0	0	0	0	111.7
1469	W	25.1	Very low	28.1	Very low	209 Å²	209	99 Å²	99	79%	0.792	56%	0.558	S	S	*	*			cis	-159.4	133.2	-9.4	-109.5	15.6	0	0	0	105.2
1470	S	28.5	Very low	28.2	Very low	75 Å²	75	100.1 Å²	100.1	52%	0.524	57%	0.57	S	S	.	*				68.9	149.8	84.3	83.4	0	0	0	0	115.9
1471	H	26.6	Very low	28.3	Very low	141 Å²	141	104.3 Å²	104.3	65%	0.653	59%	0.594	S	S	*	*			trans	71.6	117.3	-174.5	-45.2	-74	0	0	0	114.7	F1473	H1471-F1473 HydrophobicContact CB-CE2 4.35Å; H1471-F1473 AromaticContact ND1-CE2 3.58Å
1472	G	26.1	Very low	27.8	Very low	67 Å²	67	113.4 Å²	113.4	69%	0.691	62%	0.622	S	S	*	*			cis	112.7	-170	-6.1	0	0	0	0	0	114.4
1473	F	27.6	Very low	27.6	Very low	189 Å²	189	114.1 Å²	114.1	83%	0.829	64%	0.635	S	S	*	*			trans	70.6	138.3	-172.7	-55.2	-82.1	0	0	0	116	H1471	H1471-F1473 HydrophobicContact CB-CE2 4.35Å; H1471-F1473 AromaticContact ND1-CE2 3.58Å
1474	G	29.1	Very low	27.6	Very low	70 Å²	70	121 Å²	121	72%	0.722	67%	0.665	S	S	*	*			trans	-90.1	-129.6	150.7	0	0	0	0	0	108.5
1475	P	32.7	Very low	27.7	Very low	111 Å²	111	123.8 Å²	123.8	72%	0.721	67%	0.671	S	S	*	*			cis	-131.9	-159.3	3.2	38.8	-18.2	0	0	0	112.5
1476	D	24.9	Very low	27.7	Very low	105 Å²	105	125.7 Å²	125.7	56%	0.561	68%	0.675	S	S	*	*			trans	53.1	109.6	145.2	-73.9	-52	0	0	0	122.2
1477	R	24.5	Very low	27.8	Very low	197 Å²	197	130.1 Å²	130.1	74%	0.743	70%	0.696	S	S	*	*				75.2	170.4	125.5	-58	170.4	-158	-165.6	7	120.5
1478	H	27	Very low	27.9	Very low	163 Å²	163	133.9 Å²	133.9	76%	0.755	70%	0.704	S	S	*	*			trans	77.5	80.5	158.2	-63.7	-61.1	0	0	0	119.3
1479	L	35	Very low	27.9	Very low	158 Å²	158	136.5 Å²	136.5	83%	0.827	70%	0.703	S	S	*	*				-22.8	151.1	113.2	-71.4	163.3	0	0	0	113.8
1480	P	32.1	Very low	28	Very low	112 Å²	112	131.4 Å²	131.4	73%	0.727	69%	0.691	S	S	*	*			cis	-136.7	-137.8	12.1	43.5	-22.1	0	0	0	109.7
1481	P	32.4	Very low	28	Very low	105 Å²	105	136.9 Å²	136.9	68%	0.682	70%	0.7	S	S	*	*			cis	-126.3	-151.9	-27.5	39.3	-20.2	0	0	0	112.1
1482	W	24.8	Very low	28.1	Very low	240 Å²	240	135.7 Å²	135.7	91%	0.909	70%	0.698	S	S	*	*			trans	-30.9	159.5	153.2	-44.6	-28.1	0	0	0	114.6
1483	S	25.2	Very low	28.2	Very low	86 Å²	86	137.5 Å²	137.5	60%	0.601	70%	0.701	S	S	*	*			cis	-156.7	168.3	35	63.2	0	0	0	0	115.3
1484	E	27.7	Very low	28.4	Very low	155 Å²	155	135.8 Å²	135.8	72%	0.724	70%	0.695	S	S	*	*			trans	68.3	136.3	141.1	-77.1	161	152.9	0	0	121.3
1485	M	26.5	Very low	28.4	Very low	143 Å²	143	140.5 Å²	140.5	70%	0.704	70%	0.696	S	S	*	*				49.2	131	124.3	-58.8	173.3	33	0	0	119.8
1486	M	27.5	Very low	28.2	Very low	131 Å²	131	146.1 Å²	146.1	65%	0.645	70%	0.703	S	S	*	*			cis	-147.7	153.8	-7	-103.4	-174.9	-162.3	0	0	104.9
1487	N	27.6	Very low	28.5	Very low	133 Å²	133	148 Å²	148	71%	0.711	71%	0.713	S	S	*	*				45.2	147.1	74.2	-157.4	-9.7	0	0	0	112.4
1488	K	26.7	Very low	29	Very low	144 Å²	144	147.6 Å²	147.6	63%	0.626	72%	0.717	S	S	*	*			trans	71.8	140.9	176.4	-54.8	-173	168.3	-178.2	0	115
1489	H	27.7	Very low	29.2	Very low	132 Å²	132	145.4 Å²	145.4	61%	0.611	71%	0.71	S	S	*	*			cis	-163.1	160.6	-2.6	-119.6	-11.1	0	0	0	115.6
1490	L	27.3	Very low	29.1	Very low	103 Å²	103	143.6 Å²	143.6	54%	0.539	70%	0.702	S	S	.	*			trans	67.8	124.2	151.4	-59.5	161.2	0	0	0	116
1491	R	29.1	Very low	29.1	Very low	189 Å²	189	144.6 Å²	144.6	71%	0.713	70%	0.7	S	S	*	*				70.6	160.9	50.1	-61.3	-166.5	-141.6	148.7	0.4	112.2
1492	D	28.8	Very low	28.9	Very low	116 Å²	116	146.1 Å²	146.1	62%	0.62	70%	0.702	S	S	*	*			cis	-126.6	157.6	9.6	-63.3	-90.2	0	0	0	110.2
1493	S	28.6	Very low	29.3	Very low	106 Å²	106	140.3 Å²	140.3	74%	0.741	69%	0.694	S	S	*	*				156.7	159.4	78.1	46.5	0	0	0	0	107.1
1494	E	31.1	Very low	29.5	Very low	152 Å²	152	140.5 Å²	140.5	71%	0.71	70%	0.695	S	S	*	*			cis	-162.7	156.1	-6.7	-120.6	-179.3	-174.8	0	0	111.3
1495	F	28.8	Very low	29.7	Very low	170 Å²	170	139.5 Å²	139.5	75%	0.746	70%	0.695	S	S	*	*			trans	55.1	145.9	158.3	-66.1	-58	0	0	0	121
1496	R	29.9	Very low	29.8	Very low	228 Å²	228	139 Å²	139	86%	0.86	70%	0.695	S	S	*	*			cis	-151	146.7	7.1	-148.6	167.7	-167.8	173.3	3.9	112.7
1497	N	30.1	Very low	29.9	Very low	145 Å²	145	143.4 Å²	143.4	78%	0.775	70%	0.704	S	S	*	*			trans	-66.7	152.5	174.5	-66.2	-26.7	0	0	0	113.9
1498	K	34.7	Very low	29.9	Very low	188 Å²	188	143.5 Å²	143.5	82%	0.817	71%	0.705	S	S	*	*				-175.2	124.7	104.9	-101.2	178.3	177.6	-174.3	0	115
1499	N	32.2	Very low	29.8	Very low	117 Å²	117	141.3 Å²	141.3	63%	0.626	71%	0.707	S	S	*	*				56.3	145.3	119.5	-64	46	0	0	0	120
1500	N	32.2	Very low	29.6	Very low	121 Å²	121	141.9 Å²	141.9	65%	0.647	72%	0.715	S	S	*	*			cis	-167.2	161.3	13	-124.8	10.8	0	0	0	113.4
1501	L	31.5	Very low	29.5	Very low	133 Å²	133	141.9 Å²	141.9	70%	0.696	72%	0.724	S	S	*	*			trans	63.8	160.2	157.4	-88.3	68.2	0	0	0	117.4
1502	D	29.9	Very low	29.3	Very low	136 Å²	136	141 Å²	141	73%	0.727	73%	0.732	S	S	*	*			cis	175.2	169.4	-32.2	-98.9	7.3	0	0	0	105.5
1503	T	32.4	Very low	29.1	Very low	118 Å²	118	138.5 Å²	138.5	72%	0.724	73%	0.734	S	S	*	*			cis	-168.1	160.8	-1.1	23	0	0	0	0	105.1
1504	S	29.4	Very low	28.9	Very low	91 Å²	91	143.4 Å²	143.4	64%	0.636	74%	0.743	S	S	*	*			cis	-175.6	-163.5	-15.4	57.2	0	0	0	0	107.3
1505	D	32	Very low	28.6	Very low	133 Å²	133	140.2 Å²	140.2	71%	0.711	74%	0.737	S	S	*	*			trans	75	101.4	164.2	-65.7	32.3	0	0	0	116.9
1506	N	28.3	Very low	28.4	Very low	132 Å²	132	138.9 Å²	138.9	71%	0.706	74%	0.737	S	S	*	*			cis	80.9	91.6	11.2	-163.5	13.9	0	0	0	117.9
1507	R	29.8	Very low	28.2	Very low	225 Å²	225	133.5 Å²	133.5	85%	0.849	73%	0.729	S	S	*	*			trans	-174.2	137.7	141.8	-89.6	142.9	-152.6	-137.6	10.1	107.9
1508	N	26.7	Very low	28	Very low	135 Å²	135	138.4 Å²	138.4	72%	0.722	74%	0.737	S	S	*	*			cis	85.2	106.9	38.4	-81.5	-16.4	0	0	0	117
1509	S	25.2	Very low	27.7	Very low	97 Å²	97	132.7 Å²	132.7	68%	0.678	73%	0.731	S	S	*	*			trans	84.8	137.7	131.5	77.1	0	0	0	0	121.7
1510	N	24.5	Very low	27.5	Very low	144 Å²	144	134.9 Å²	134.9	77%	0.77	74%	0.742	S	S	*	*			trans	75.8	117.6	142.2	-64.2	-11.9	0	0	0	121.7
1511	S	24.1	Very low	27.2	Very low	103 Å²	103	135.4 Å²	135.4	72%	0.72	75%	0.75	S	S	*	*				101.6	135.2	119.8	75.7	0	0	0	0	121.8
1512	L	24.2	Very low	27.2	Very low	171 Å²	171	132.1 Å²	132.1	90%	0.895	75%	0.749	S	S	*	*			trans	60.2	102.4	137.6	-70	165.8	0	0	0	121
1513	G	24.8	Very low	27.1	Very low	64 Å²	64	130.7 Å²	130.7	66%	0.66	75%	0.749	S	S	*	*				114.5	157.9	118.2	0	0	0	0	0	117.5
1514	F	25.4	Very low	26.9	Very low	209 Å²	209	131 Å²	131	92%	0.917	75%	0.747	S	S	*	*			trans	64.7	139.8	179	-70.5	-98.5	0	0	0	116.2
1515	S	24.6	Very low	26.9	Very low	85 Å²	85	136.6 Å²	136.6	59%	0.594	75%	0.753	S	S	*	*			cis	-163.8	164	-22.5	-131.9	0	0	0	0	112.5
1516	L	24.9	Very low	26.8	Very low	142 Å²	142	137 Å²	137	74%	0.743	76%	0.755	S	S	*	*			trans	44	88.9	148.6	-63.8	163.6	0	0	0	117.5
1517	T	25.7	Very low	27.1	Very low	114 Å²	114	137 Å²	137	70%	0.699	76%	0.755	S	S	*	*				74.3	142.9	76.1	66.6	0	0	0	0	117.2
1518	R	25.8	Very low	27.1	Very low	248 Å²	248	136.8 Å²	136.8	94%	0.936	76%	0.761	S	S	*	*			trans	81.6	113.2	170.8	-59.8	178.5	168.9	178.8	-4.3	115.3
1519	G	28.3	Very low	27.4	Very low	68 Å²	68	135.9 Å²	135.9	70%	0.701	76%	0.755	S	S	*	*			cis	137	-161.3	-12.3	0	0	0	0	0	113.9
1520	L	27.4	Very low	27.8	Very low	163 Å²	163	137 Å²	137	85%	0.853	75%	0.752	S	S	*	*			trans	74.8	138.9	174.3	-49.6	171.5	0	0	0	115
1521	T	26.6	Very low	28.3	Very low	133 Å²	133	132.6 Å²	132.6	82%	0.816	74%	0.741	S	S	*	*			cis	-163.5	161.6	-16.1	8	0	0	0	0	109.8
1522	G	30.4	Very low	29.1	Very low	64 Å²	64	134.4 Å²	134.4	66%	0.66	74%	0.741	S	S	*	*			trans	107	107	172.3	0	0	0	0	0	112.7
1523	S	28.3	Very low	29.8	Very low	106 Å²	106	129 Å²	129	74%	0.741	72%	0.716	S	S	*	*			cis	52.5	114.5	32.7	82.2	0	0	0	0	112.4
1524	N	29.1	Very low	30.5	Very low	125 Å²	125	128.5 Å²	128.5	67%	0.668	71%	0.705	S	S	*	*			cis	-142.2	141.4	48.9	-84.1	-46.5	0	0	0	111.8
1525	R	29	Very low	31.4	Very low	207 Å²	207	122.9 Å²	122.9	78%	0.781	69%	0.688	S	S	*	*				67.3	142.9	87.3	-59.5	-178.9	172.7	170.5	-2.2	115.4
1526	D	30.9	Very low	32.6	Very low	141 Å²	141	123.7 Å²	123.7	75%	0.754	68%	0.684	S	S	*	*			trans	67.4	132.4	160.5	-45	-38.2	0	0	0	117.1
1527	L	33.1	Very low	33.7	Very low	133 Å²	133	121.2 Å²	121.2	70%	0.696	67%	0.671	S	S	*	*			cis	-117.2	141.8	-1	-87.4	90.3	0	0	0	113.1	I1529	L1527-I1529 PolarHBondContact O-N 3.08Å; L1527-I1529 VanDerWaalsContact O-N 3.13Å
1528	F	30.4	Very low	34.7	Very low	220 Å²	220	119.4 Å²	119.4	97%	0.965	66%	0.663	S	S	*	*	S	Bend	trans	-74	9.8	170.1	-156.4	-111.6	0	0	0	113.4
1529	I	33.7	Very low	36	Very low	116 Å²	116	113.4 Å²	113.4	60%	0.595	65%	0.648	S	S	*	*	S	Bend	trans	-143.9	92.7	-172.5	-52.4	175.9	0	0	0	108	L1527 V1533	L1527-I1529 PolarHBondContact O-N 3.08Å; L1527-I1529 VanDerWaalsContact O-N 3.13Å; I1529-V1533 HydrophobicContact CG2-CG2 4.27Å
1530	I	33.3	Very low	36.9	Very low	121 Å²	121	112.3 Å²	112.3	62%	0.621	63%	0.633	S	S	*	*	S	Bend	trans	-177.1	-39.8	158.5	-100.4	151	0	0	0	110.5	V1533 A1534	I1530-V1533 CarbonylContact O-C 3.6Å; I1530-V1533 WeakPolarHBondContact O-CA 3.14Å; I1530-V1533 WeakPolarHBondContact O-CB 3.49Å; I1530-V1533 PolarHBondContact O-N 3.33Å; I1530-V1533 VanDerWaalsContact O-N 3.16Å; I1530-A1534 PolarHBondContact O-N 2.77Å
1531	G	34.7	Very low	38	Very low	52 Å²	52	109 Å²	109	54%	0.536	62%	0.616	S	S	.	*	H	α-helix	trans	-67.1	-46.5	-177.5	0	0	0	0	0	114.3	V1533 A1534 V1535	G1531-V1533 PolarHBondContact O-N 2.71Å; G1531-A1534 WeakPolarHBondContact O-CB 3.33Å; G1531-A1534 PolarHBondContact O-N 3.14Å; G1531-V1535 PolarHBondContact O-N 3.29Å
1532	L	40.6	Very low	38.9	Very low	140 Å²	140	108.2 Å²	108.2	73%	0.733	61%	0.605	S	S	*	*	H	α-helix	trans	-63.5	-30	172	-148.8	81.2	0	0	0	111.4	I1536	L1532-I1536 HydrophobicContact CD2-CD1 4.37Å; L1532-I1536 HydrophobicContact CG-CD1 4.31Å; L1532-I1536 WeakPolarHBondContact O-CB 3.28Å; L1532-I1536 VanDerWaalsContact O-CG1 3.26Å; L1532-I1536 WeakPolarHBondContact O-CG1 3.39Å; L1532-I1536 PolarHBondContact O-N 2.85Å
1533	V	38	Very low	39.6	Very low	59 Å²	59	107.4 Å²	107.4	36%	0.358	59%	0.593	S	S	.	*	H	α-helix	trans	-74.8	-25.2	174.4	175.9	0	0	0	0	111.4	I1529 I1530 G1531 I1537	I1529-V1533 HydrophobicContact CG2-CG2 4.27Å; I1530-V1533 CarbonylContact O-C 3.6Å; I1530-V1533 WeakPolarHBondContact O-CA 3.14Å; I1530-V1533 WeakPolarHBondContact O-CB 3.49Å; I1530-V1533 PolarHBondContact O-N 3.33Å; I1530-V1533 VanDerWaalsContact O-N 3.16Å; G1531-V1533 PolarHBondContact O-N 2.71Å; V1533-I1537 HydrophobicContact CG1-CD1 3.52Å; V1533-I1537 HydrophobicContact CG1-CG1 3.91Å; V1533-I1537 WeakPolarHBondContact O-CA 3.48Å; V1533-I1537 WeakPolarHBondContact O-CB 3.44Å; V1533-I1537 WeakPolarHBondContact O-CG1 3.22Å; V1533-I1537 PolarHBondContact O-N 2.66Å
1534	A	41.2	Very low	40.3	Very low	53 Å²	53	106.7 Å²	106.7	44%	0.438	58%	0.583	S	S	.	*	H	α-helix	trans	-70.3	-42.3	173.4	0	0	0	0	0	111.4	I1530 G1531 S1538	I1530-A1534 PolarHBondContact O-N 2.77Å; G1531-A1534 WeakPolarHBondContact O-CB 3.33Å; G1531-A1534 PolarHBondContact O-N 3.14Å; A1534-S1538 WeakPolarHBondContact O-CB 3.4Å; A1534-S1538 PolarHBondContact O-N 2.84Å; A1534-S1538 PolarHBondContact O-OG 3.15Å
1535	V	44.3	Very low	40.9	Very low	91 Å²	91	106.6 Å²	106.6	55%	0.552	58%	0.582	S	S	*	*	H	α-helix	trans	-67.9	-42.5	173.7	179.5	0	0	0	0	111.1	G1531 S1538 L1539	G1531-V1535 PolarHBondContact O-N 3.29Å; V1535-S1538 PolarHBondContact O-N 3.42Å; V1535-L1539 HydrophobicContact CG1-CD1 4.08Å; V1535-L1539 WeakPolarHBondContact O-CB 3.16Å; V1535-L1539 WeakPolarHBondContact O-CG 3.47Å; V1535-L1539 PolarHBondContact O-N 3.14Å
1536	I	48.8	Very low	41.4	Very low	102 Å²	102	101.6 Å²	101.6	52%	0.523	58%	0.577	S	S	.	*	H	α-helix	trans	-70.3	-33.2	178.6	-68.4	169.7	0	0	0	111.6	L1532 A1540	L1532-I1536 HydrophobicContact CD2-CD1 4.37Å; L1532-I1536 HydrophobicContact CG-CD1 4.31Å; L1532-I1536 WeakPolarHBondContact O-CB 3.28Å; L1532-I1536 VanDerWaalsContact O-CG1 3.26Å; L1532-I1536 WeakPolarHBondContact O-CG1 3.39Å; L1532-I1536 PolarHBondContact O-N 2.85Å; I1536-A1540 WeakPolarHBondContact O-CB 3.19Å; I1536-A1540 PolarHBondContact O-N 2.88Å
1537	I	49.1	Very low	41.7	Very low	89 Å²	89	101.7 Å²	101.7	46%	0.456	58%	0.576	S	S	.	*	H	α-helix	trans	-72.6	-41.2	170.3	-72.5	175.9	0	0	0	110.9	V1533 L1539 A1540 L1541	V1533-I1537 HydrophobicContact CG1-CD1 3.52Å; V1533-I1537 HydrophobicContact CG1-CG1 3.91Å; V1533-I1537 WeakPolarHBondContact O-CA 3.48Å; V1533-I1537 WeakPolarHBondContact O-CB 3.44Å; V1533-I1537 WeakPolarHBondContact O-CG1 3.22Å; V1533-I1537 PolarHBondContact O-N 2.66Å; I1537-L1539 VanDerWaalsContact C-N 3.29Å; I1537-L1539 PolarHBondContact O-N 2.82Å; I1537-A1540 PolarHBondContact O-N 3.29Å; I1537-L1541 HydrophobicContact CG2-CB 4.29Å; I1537-L1541 HydrophobicContact CG2-CD1 4.15Å; I1537-L1541 WeakPolarHBondContact O-CA 3.22Å; I1537-L1541 WeakPolarHBondContact O-CB 3.23Å; I1537-L1541 PolarHBondContact O-N 2.96Å
1538	S	46.3	Very low	41.8	Very low	76 Å²	76	98.6 Å²	98.6	53%	0.531	57%	0.57	S	S	.	*	H	α-helix	trans	-61.1	-39.3	176.7	-68.2	0	0	0	0	112.1	A1534 V1535 I1542	A1534-S1538 WeakPolarHBondContact O-CB 3.4Å; A1534-S1538 PolarHBondContact O-N 2.84Å; A1534-S1538 PolarHBondContact O-OG 3.15Å; V1535-S1538 PolarHBondContact O-N 3.42Å; S1538-I1542 WeakPolarHBondContact O-CG1 3.27Å; S1538-I1542 PolarHBondContact O-N 3.07Å
1539	L	52.3	Low	42	Very low	122 Å²	122	97 Å²	97	64%	0.639	56%	0.563	S	S	*	*	H	α-helix	trans	-74.9	-40.2	174.7	-67.6	171	0	0	0	112.5	V1535 I1537 A1543	V1535-L1539 HydrophobicContact CG1-CD1 4.08Å; V1535-L1539 WeakPolarHBondContact O-CB 3.16Å; V1535-L1539 WeakPolarHBondContact O-CG 3.47Å; V1535-L1539 PolarHBondContact O-N 3.14Å; I1537-L1539 VanDerWaalsContact C-N 3.29Å; I1537-L1539 PolarHBondContact O-N 2.82Å; L1539-A1543 WeakPolarHBondContact O-CB 3.49Å; L1539-A1543 PolarHBondContact O-N 2.87Å; L1539-A1543 VanDerWaalsContact O-N 3.12Å
1540	A	48.6	Very low	42	Very low	45 Å²	45	93.9 Å²	93.9	37%	0.372	56%	0.56	S	S	.	*	H	α-helix	trans	-72.4	-29.5	177.8	0	0	0	0	0	113.4	I1536 I1537 A1543 V1544	I1536-A1540 WeakPolarHBondContact O-CB 3.19Å; I1536-A1540 PolarHBondContact O-N 2.88Å; I1537-A1540 PolarHBondContact O-N 3.29Å; A1540-A1543 CarbonylContact O-C 3.57Å; A1540-A1543 PolarHBondContact O-N 2.82Å; A1540-V1544 VanDerWaalsContact O-CB 3.32Å; A1540-V1544 WeakPolarHBondContact O-CB 3.3Å; A1540-V1544 WeakPolarHBondContact O-CG2 3.43Å; A1540-V1544 PolarHBondContact O-N 3.45Å
1541	L	49	Very low	42	Very low	94 Å²	94	92.2 Å²	92.2	49%	0.492	56%	0.558	S	S	.	*	H	α-helix	trans	-82.3	-31.8	-176.8	-162.9	147.2	0	0	0	111.3	I1537 V1544 I1545	I1537-L1541 HydrophobicContact CG2-CB 4.29Å; I1537-L1541 HydrophobicContact CG2-CD1 4.15Å; I1537-L1541 WeakPolarHBondContact O-CA 3.22Å; I1537-L1541 WeakPolarHBondContact O-CB 3.23Å; I1537-L1541 PolarHBondContact O-N 2.96Å; L1541-V1544 PolarHBondContact O-N 3.29Å; L1541-I1545 HydrophobicContact CD2-CD1 3.73Å; L1541-I1545 HydrophobicContact CD2-CG1 4.38Å; L1541-I1545 WeakPolarHBondContact O-CB 3.35Å; L1541-I1545 VanDerWaalsContact O-CG1 3.29Å; L1541-I1545 WeakPolarHBondContact O-CG1 3.38Å; L1541-I1545 PolarHBondContact O-N 3.41Å
1542	I	45.9	Very low	41.7	Very low	116 Å²	116	94.7 Å²	94.7	60%	0.595	55%	0.554	S	S	*	*	H	α-helix	trans	-66.9	-40.3	164.3	-65.6	174.9	0	0	0	110.2	S1538 V1544 I1545 C1546	S1538-I1542 WeakPolarHBondContact O-CG1 3.27Å; S1538-I1542 PolarHBondContact O-N 3.07Å; I1542-V1544 VanDerWaalsContact C-N 3.35Å; I1542-V1544 PolarHBondContact O-N 3.4Å; I1542-I1545 PolarHBondContact O-N 2.89Å; I1542-C1546 PolarHBondContact O-N 3.39Å; I1542-C1546 PolarHBondContact O-SG 2.83Å
1543	A	44.3	Very low	41.1	Very low	48 Å²	48	90.9 Å²	90.9	40%	0.397	53%	0.533	S	S	.	.	H	α-helix	trans	-65.9	-30.8	173.4	0	0	0	0	0	113.9	L1539 A1540 C1546	L1539-A1543 WeakPolarHBondContact O-CB 3.49Å; L1539-A1543 PolarHBondContact O-N 2.87Å; L1539-A1543 VanDerWaalsContact O-N 3.12Å; A1540-A1543 CarbonylContact O-C 3.57Å; A1540-A1543 PolarHBondContact O-N 2.82Å; A1543-C1546 WeakPolarHBondContact O-CB 3.48Å; A1543-C1546 PolarHBondContact O-N 2.01Å
1544	V	44.3	Very low	40.7	Very low	91 Å²	91	92.9 Å²	92.9	55%	0.552	54%	0.535	S	S	*	.	H	α-helix	trans	-78.5	-37.6	176.8	162.6	0	0	0	0	111.8	A1540 L1541 I1542 C1546 I1547 A1548	A1540-V1544 VanDerWaalsContact O-CB 3.32Å; A1540-V1544 WeakPolarHBondContact O-CB 3.3Å; A1540-V1544 WeakPolarHBondContact O-CG2 3.43Å; A1540-V1544 PolarHBondContact O-N 3.45Å; L1541-V1544 PolarHBondContact O-N 3.29Å; I1542-V1544 VanDerWaalsContact C-N 3.35Å; I1542-V1544 PolarHBondContact O-N 3.4Å; V1544-C1546 PolarHBondContact O-N 3.31Å; V1544-I1547 PolarHBondContact O-N 2.91Å; V1544-A1548 PolarHBondContact O-N 2.82Å
1545	I	41.3	Very low	40	Very low	123 Å²	123	98.9 Å²	98.9	63%	0.631	55%	0.546	S	S	*	.	H	α-helix	trans	-59.7	-22.5	167.6	-72.4	171.4	0	0	0	111.2	L1541 I1542	L1541-I1545 HydrophobicContact CD2-CD1 3.73Å; L1541-I1545 HydrophobicContact CD2-CG1 4.38Å; L1541-I1545 WeakPolarHBondContact O-CB 3.35Å; L1541-I1545 VanDerWaalsContact O-CG1 3.29Å; L1541-I1545 WeakPolarHBondContact O-CG1 3.38Å; L1541-I1545 PolarHBondContact O-N 3.41Å; I1542-I1545 PolarHBondContact O-N 2.89Å
1546	C	40.5	Very low	39.2	Very low	101 Å²	101	101 Å²	101	68%	0.682	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-1.8	173.7	-64.7	0	0	0	0	115.6	I1542 A1543 V1544	I1542-C1546 PolarHBondContact O-N 3.39Å; I1542-C1546 PolarHBondContact O-SG 2.83Å; A1543-C1546 WeakPolarHBondContact O-CB 3.48Å; A1543-C1546 PolarHBondContact O-N 2.01Å; V1544-C1546 PolarHBondContact O-N 3.31Å
1547	I	36.2	Very low	38.1	Very low	143 Å²	143	103 Å²	103	73%	0.733	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.3	-36.3	-172.2	-68.5	-179.6	0	0	0	115	V1544	V1544-I1547 PolarHBondContact O-N 2.91Å
1548	A	34.8	Very low	37	Very low	68 Å²	68	105.2 Å²	105.2	56%	0.562	55%	0.551	S	S	*	*	S	Bend	trans	-158	127.4	173.2	0	0	0	0	0	112	V1544	V1544-A1548 PolarHBondContact O-N 2.82Å
1549	F	35.7	Very low	36.4	Very low	186 Å²	186	105.5 Å²	105.5	82%	0.816	55%	0.551	S	S	*	*			cis	-96	136	2	-71.6	-116.8	0	0	0	111.1
1550	G	33.8	Very low	35.1	Very low	52 Å²	52	106.4 Å²	106.4	54%	0.536	55%	0.55	S	S	.	.			cis	78.2	82.3	-0	0	0	0	0	0	114
1551	C	32.1	Very low	34.1	Very low	85 Å²	85	108.3 Å²	108.3	57%	0.574	55%	0.553	S	S	*	*			trans	65.4	117.8	171	-61	0	0	0	0	115.2	I1553	C1551-I1553 HydrophobicContact CB-CD1 3.92Å; C1551-I1553 HydrophobicContact CB-CG1 4.44Å
1552	F	28.3	Very low	33	Very low	104 Å²	104	110.1 Å²	110.1	46%	0.456	56%	0.562	S	S	.	*				-161.4	141.9	67.2	-111.3	-107.6	0	0	0	114.6	S1458 R1554	S1458-F1552 VanDerWaalsContact CB-CE1 3.47Å; F1552-R1554 VanDerWaalsContact CE1-NH1 3.31Å
1553	I	28.9	Very low	32	Very low	60 Å²	60	110.5 Å²	110.5	31%	0.308	57%	0.566	S	S	.	*			cis	-176.8	165.8	-17.9	-135.3	157.7	0	0	0	121	D1459 C1551	D1459-I1553 WeakPolarHBondContact O-CG2 3.33Å; C1551-I1553 HydrophobicContact CB-CD1 3.92Å; C1551-I1553 HydrophobicContact CB-CG1 4.44Å
1554	R	28.4	Very low	31.1	Very low	101 Å²	101	115.6 Å²	115.6	38%	0.381	58%	0.581	S	S	.	*			trans	56.2	147.9	151.9	-73.1	126.4	-179	-174.1	7.2	118.8	D1459 G1460 P1461 F1552	D1459-R1554 IonicContact OD1-NH1 3.6Å; D1459-R1554 PolarHBondContact OD1-NH1 2.8Å; G1460-R1554 VanDerWaalsContact C-CD 3.47Å; G1460-R1554 WeakPolarHBondContact O-CB 3.36Å; G1460-R1554 WeakPolarHBondContact O-CD 3.37Å; P1461-R1554 VanDerWaalsContact CA-CD 3.44Å; F1552-R1554 VanDerWaalsContact CE1-NH1 3.31Å
1555	R	27.6	Very low	30.3	Very low	180 Å²	180	118 Å²	118	68%	0.679	59%	0.59	S	S	*	*				-152.1	167.3	51	-75	163.2	-171.5	166.6	7.9	110	G1460	G1460-R1555 WeakPolarHBondContact O-CG 3.48Å; G1460-R1555 PolarHBondContact O-NE 3.09Å
1556	K	26.5	Very low	29.7	Very low	134 Å²	134	117.8 Å²	117.8	58%	0.583	59%	0.594	S	S	*	*			cis	-171.5	179.7	-5.3	-97.2	166.7	-174.7	176.1	0	105	P1461 E1462	P1461-K1556 WeakPolarHBondContact O-CE 3.1Å; E1462-K1556 WeakPolarHBondContact O-CA 3.15Å
1557	R	26.4	Very low	29.3	Very low	146 Å²	146	117.8 Å²	117.8	55%	0.551	59%	0.593	S	S	*	*			cis	-171.2	148.4	-18.8	-93.6	-110.2	170.1	118.3	-12.9	104.3	E1462 A1463	E1462-R1557 IonicContact OE2-CZ 2.7Å; E1462-R1557 IonicContact OE2-NE 2.58Å; E1462-R1557 IonicContact OE2-NH2 3.4Å; E1462-R1557 PolarHBondContact OE2-NH2 3.27Å; A1463-R1557 HydrophobicContact CB-CB 4.29Å; A1463-R1557 VanDerWaalsContact CB-CD 3.49Å; A1463-R1557 HydrophobicContact CB-CG 3.76Å; A1463-R1557 WeakPolarHBondContact O-CA 3.42Å
1558	R	26.8	Very low	28.9	Very low	135 Å²	135	117.6 Å²	117.6	51%	0.509	59%	0.594	S	S	.	*			cis	-141.7	-105.9	-9.7	-170.2	166.1	-156.5	137.2	19	114.3	E1462 A1463	E1462-R1558 IonicContact OE2-CZ 3.49Å; E1462-R1558 IonicContact OE2-NH1 3.32Å; E1462-R1558 PolarHBondContact OE2-NH1 2.84Å; E1462-R1558 IonicContact OE2-NH2 3.45Å; E1462-R1558 PolarHBondContact OE2-NH2 3.21Å; A1463-R1558 HydrophobicContact CB-CB 3.81Å; A1463-R1558 HydrophobicContact CB-CG 3.51Å
1559	P	33.5	Very low	28.4	Very low	81 Å²	81	121 Å²	121	53%	0.526	60%	0.602	S	S	.	*			trans	-144.6	171.7	-142	51.4	-33.1	0	0	0	124.7	T1465	T1465-P1559 CarbonylContact O-C 3.27Å; T1465-P1559 WeakPolarHBondContact O-CA 3.31Å
1560	K	25	Very low	27.9	Very low	141 Å²	141	116 Å²	116	61%	0.613	59%	0.59	S	S	*	*				72.6	120.5	129.8	-84.7	169	172.5	-162.5	0	125.8	T1465 S1466	T1465-K1560 PolarHBondContact O-N 3.14Å; T1465-K1560 WeakPolarHBondContact OG1-CE 3.45Å; S1466-K1560 WeakPolarHBondContact OG-CA 3.43Å; S1466-K1560 WeakPolarHBondContact OG-CG 3.25Å
1561	L	27.3	Very low	27.5	Very low	85 Å²	85	118.8 Å²	118.8	45%	0.445	60%	0.597	S	S	.	*				57.4	153.1	114.6	-114.9	175.9	0	0	0	123.1	S1466 S1467	S1466-L1561 WeakPolarHBondContact OG-CB 3.41Å; S1466-L1561 WeakPolarHBondContact OG-CD1 3.38Å; S1466-L1561 WeakPolarHBondContact OG-CG 3.49Å; S1467-L1561 WeakPolarHBondContact OG-CG 3.44Å
1562	I	25.8	Very low	27.2	Very low	133 Å²	133	122 Å²	122	68%	0.682	61%	0.605	S	S	*	*			trans	100.8	98.5	154.5	-67.1	169.6	0	0	0	118.5
1563	N	25.4	Very low	27.2	Very low	124 Å²	124	125.7 Å²	125.7	66%	0.663	62%	0.621	S	S	*	*				65.5	145.8	129.7	-61.3	9.9	0	0	0	124.8
1564	H	25.3	Very low	27.2	Very low	154 Å²	154	130 Å²	130	71%	0.713	64%	0.64	S	S	*	*			trans	73.5	121.6	141.9	-76	-47.4	0	0	0	121.2
1565	L	26	Very low	27.2	Very low	142 Å²	142	131.1 Å²	131.1	74%	0.743	66%	0.661	S	S	*	*			trans	70.1	119.3	133.2	-62.1	168.7	0	0	0	118.8
1566	T	30.4	Very low	27.2	Very low	118 Å²	118	128.7 Å²	128.7	72%	0.724	66%	0.66	S	S	*	*				1.8	147.4	125.2	58.2	0	0	0	0	117.7
1567	P	31.6	Very low	27.2	Very low	102 Å²	102	130.9 Å²	130.9	66%	0.662	68%	0.675	S	S	*	*			cis	-141	-165.5	25.9	42.6	-23.5	0	0	0	114.3
1568	N	26.8	Very low	27.1	Very low	139 Å²	139	133.9 Å²	133.9	74%	0.743	69%	0.686	S	S	*	*			trans	52.4	119.9	148.1	-66.6	7.2	0	0	0	119.5
1569	D	24.6	Very low	27.2	Very low	139 Å²	139	135.2 Å²	135.2	74%	0.743	70%	0.7	S	S	*	*				76.1	153.2	63.5	-176.7	43.5	0	0	0	113.5
1570	S	25.9	Very low	26.9	Very low	80 Å²	80	136.4 Å²	136.4	56%	0.559	70%	0.702	S	S	*	*			trans	71.2	92.2	169.4	75.6	0	0	0	0	116.5
1571	T	25.4	Very low	27	Very low	111 Å²	111	135.9 Å²	135.9	68%	0.681	71%	0.706	S	S	*	*				87.9	159.7	83.3	65.3	0	0	0	0	115
1572	M	25	Very low	27	Very low	152 Å²	152	137.6 Å²	137.6	75%	0.749	72%	0.724	S	S	*	*			trans	73.7	151.5	159.3	-67.6	179.7	-166.7	0	0	116.6
1573	K	27.5	Very low	27.1	Very low	182 Å²	182	134.8 Å²	134.8	79%	0.791	73%	0.728	S	S	*	*			cis	-143.8	160.3	10.8	-126.1	139.3	-166.6	149.1	0	112
1574	Q	29.4	Very low	27.5	Very low	150 Å²	150	135.1 Å²	135.1	70%	0.701	74%	0.737	S	S	*	*			trans	-73.4	176.3	173.5	-57.3	176.3	-35.2	0	0	111.9	L1576	Q1574-L1576 HydrophobicContact CB-CG 4.32Å
1575	P	29.3	Very low	27.5	Very low	125 Å²	125	131.8 Å²	131.8	81%	0.812	74%	0.736	S	S	*	*				-127.3	158.4	87.9	36.3	-30.5	0	0	0	112.5
1576	L	26.4	Very low	27.3	Very low	129 Å²	129	132.6 Å²	132.6	68%	0.675	74%	0.741	S	S	*	*			cis	163.1	104.7	-21.3	-116.3	162.8	0	0	0	103.6	Q1574	Q1574-L1576 HydrophobicContact CB-CG 4.32Å
1577	M	27.7	Very low	27.1	Very low	180 Å²	180	130.3 Å²	130.3	89%	0.887	74%	0.74	S	S	*	*			trans	-151.7	145.2	139.9	-103.8	-157.2	-179.5	0	0	112.2
1578	R	25.2	Very low	26.7	Very low	209 Å²	209	132.9 Å²	132.9	79%	0.789	75%	0.749	S	S	*	*			trans	-45.4	155.7	172.7	-62.2	156.7	-177.2	167.9	-0.8	112
1579	M	27.1	Very low	26.6	Very low	164 Å²	164	130.9 Å²	130.9	81%	0.808	75%	0.746	S	S	*	*			cis	-159.3	159.2	25.8	-116.4	135.6	167.3	0	0	107.1
1580	N	27.3	Very low	26.6	Very low	105 Å²	105	133.4 Å²	133.4	56%	0.561	75%	0.75	S	S	*	*			cis	-164.4	158.7	-11.2	-132.6	47.1	0	0	0	108.4
1581	D	27.7	Very low	27.1	Very low	131 Å²	131	134.3 Å²	134.3	70%	0.701	75%	0.754	S	S	*	*			trans	63	150.9	154.1	-57	-36.1	0	0	0	120.4
1582	C	27.3	Very low	27.1	Very low	121 Å²	121	136.4 Å²	136.4	82%	0.818	76%	0.76	S	S	*	*			cis	-166.5	166	-23.5	-112.8	0	0	0	0	109.9
1583	G	28	Very low	27.3	Very low	74 Å²	74	136.9 Å²	136.9	76%	0.763	76%	0.763	S	S	*	*			trans	104.3	121.8	152.5	0	0	0	0	0	118.6
1584	P	34.8	Very low	27.4	Very low	130 Å²	130	133.5 Å²	133.5	84%	0.844	76%	0.758	S	S	*	*			trans	-115.3	-175.2	172.1	41.7	-32.6	0	0	0	114
1585	A	23.5	Very low	27.4	Very low	84 Å²	84	132 Å²	132	69%	0.694	76%	0.763	S	S	*	*			trans	99.7	140.4	150.9	0	0	0	0	0	120.8
1586	N	23.4	Very low	27.6	Very low	160 Å²	160	129.5 Å²	129.5	86%	0.856	76%	0.761	S	S	*	*			trans	53.1	102.9	145.5	-58.8	-9.5	0	0	0	121.3
1587	G	24.4	Very low	27.8	Very low	69 Å²	69	130.4 Å²	130.4	71%	0.711	77%	0.765	S	S	*	*				87.8	137.8	111.6	0	0	0	0	0	120.4
1588	N	24	Very low	27.9	Very low	157 Å²	157	129.8 Å²	129.8	84%	0.84	76%	0.76	S	S	*	*			trans	62.8	102.7	153.4	-62.5	-7.6	0	0	0	119.8
1589	S	24.1	Very low	27.9	Very low	97 Å²	97	125.5 Å²	125.5	68%	0.678	76%	0.756	S	S	*	*				122.8	134.9	101.5	73.2	0	0	0	0	120.3
1590	F	24.9	Very low	28	Very low	192 Å²	192	125.6 Å²	125.6	84%	0.842	76%	0.759	S	S	*	*			trans	69.5	154.3	159	-63.7	-65.1	0	0	0	119.5
1591	P	36	Very low	27.9	Very low	99 Å²	99	126.2 Å²	126.2	64%	0.643	76%	0.762	S	S	*	*				-142.2	-178.7	-69	37.5	-17.2	0	0	0	115.9
1592	L	27.2	Very low	27.8	Very low	154 Å²	154	124.7 Å²	124.7	81%	0.806	76%	0.757	S	S	*	*			trans	66.5	146.1	175.8	-78.6	75.1	0	0	0	116.2
1593	M	27.9	Very low	27.9	Very low	162 Å²	162	126.5 Å²	126.5	80%	0.798	76%	0.759	S	S	*	*			cis	-178.1	141.3	-31	-114	173.4	168.2	0	0	107.1
1594	T	29.6	Very low	27.8	Very low	112 Å²	112	131.2 Å²	131.2	69%	0.687	76%	0.759	S	S	*	*			cis	-168	140.8	-17.7	10.2	0	0	0	0	109
1595	S	30.7	Very low	27.4	Very low	117 Å²	117	130.9 Å²	130.9	82%	0.818	75%	0.754	S	S	*	*			trans	46.7	129.8	152.6	57.6	0	0	0	0	121.1
1596	G	32.7	Very low	27.6	Very low	73 Å²	73	132 Å²	132	75%	0.753	76%	0.757	S	S	*	*			cis	119.1	156.2	18.4	0	0	0	0	0	110.1
1597	I	29.7	Very low	27.7	Very low	148 Å²	148	130.1 Å²	130.1	76%	0.759	76%	0.757	S	S	*	*			cis	-152.9	146.1	5.8	-99.9	162	0	0	0	105.9
1598	E	29.9	Very low	27.9	Very low	168 Å²	168	133 Å²	133	79%	0.785	76%	0.76	S	S	*	*			cis	91.8	165.5	35.6	-150.1	-161.5	-56.6	0	0	113.7
1599	V	26.8	Very low	28.1	Very low	119 Å²	119	131 Å²	131	72%	0.721	75%	0.749	S	S	*	*			trans	76.6	134.2	-177.4	-176.6	0	0	0	0	115.4
1600	I	28.8	Very low	28.4	Very low	166 Å²	166	134.4 Å²	134.4	85%	0.851	75%	0.752	S	S	*	*			cis	-162.8	177.9	-25.5	-156.6	163.8	0	0	0	109
1601	N	24.7	Very low	28.6	Very low	117 Å²	117	137.1 Å²	137.1	63%	0.626	76%	0.756	S	S	*	*			trans	-139.9	155.4	-167.4	-154.9	2.8	0	0	0	116.9
1602	T	26.3	Very low	28.3	Very low	99 Å²	99	134.7 Å²	134.7	61%	0.607	75%	0.749	S	S	*	*			trans	60.9	138.4	159.1	46	0	0	0	0	125.3
1603	N	28.9	Very low	28.5	Very low	159 Å²	159	130.2 Å²	130.2	85%	0.85	73%	0.731	S	S	*	*			trans	-162.8	172.6	159.6	-123.8	-98.3	0	0	0	114.6
1604	F	26.3	Very low	28.6	Very low	173 Å²	173	124.3 Å²	124.3	76%	0.759	71%	0.706	S	S	*	*			trans	-153.1	163.9	-158.4	-85.3	-80.6	0	0	0	120.8
1605	T	25.4	Very low	28.7	Very low	123 Å²	123	124.2 Å²	124.2	76%	0.755	71%	0.705	S	S	*	*			trans	79.4	105.7	145.9	41.2	0	0	0	0	126.9
1606	S	27	Very low	28.8	Very low	109 Å²	109	125.2 Å²	125.2	76%	0.762	71%	0.706	S	S	*	*				94.9	140.9	118.3	74.4	0	0	0	0	127.6
1607	S	26.4	Very low	28.8	Very low	120 Å²	120	125.1 Å²	125.1	84%	0.839	71%	0.705	S	S	*	*			trans	94.7	159.5	155.2	85	0	0	0	0	122.1
1608	V	28.9	Very low	29	Very low	129 Å²	129	125 Å²	125	78%	0.782	71%	0.705	S	S	*	*			cis	-171.6	151.6	-21.3	134.3	0	0	0	0	116
1609	D	28.4	Very low	29	Very low	115 Å²	115	123.1 Å²	123.1	62%	0.615	70%	0.701	S	S	*	*			trans	54.6	121.1	154.8	-82.1	-9.3	0	0	0	131
1610	K	29.9	Very low	29.2	Very low	168 Å²	168	121.9 Å²	121.9	73%	0.73	70%	0.698	S	S	*	*				73.9	138.3	121.2	-63.2	171.6	-177.9	137.3	0	130.4
1611	R	28.7	Very low	29.2	Very low	249 Å²	249	120.9 Å²	120.9	94%	0.94	69%	0.693	S	S	*	*			trans	105.9	132.1	143.8	-66.6	-168.6	-175.5	-167.4	0.7	126.5
1612	G	31.2	Very low	29.4	Very low	48 Å²	48	124.2 Å²	124.2	50%	0.495	70%	0.702	S	S	.	*			trans	87.3	152.8	137.8	0	0	0	0	0	123.7	D1426 S1427	D1426-G1612 WeakPolarHBondContact O-CA 2.98Å; S1427-G1612 WeakPolarHBondContact CB-O 3.2Å; S1427-G1612 VanDerWaalsContact OG-CA 3.31Å; S1427-G1612 WeakPolarHBondContact OG-CA 3.47Å; S1427-G1612 PolarHBondContact OG-N 2.85Å; S1427-G1612 VanDerWaalsContact OG-N 3.15Å; S1427-G1612 PolarHBondContact OG-O 2.81Å
1613	S	30.3	Very low	29.4	Very low	61 Å²	61	125.9 Å²	125.9	43%	0.427	72%	0.718	S	S	.	*			cis	-171	122.5	-27.9	-169.3	0	0	0	0	117.5	D1426	D1426-S1613 WeakPolarHBondContact O-CA 2.94Å
1614	S	30.6	Very low	29.7	Very low	37 Å²	37	121.2 Å²	121.2	26%	0.259	71%	0.708	S	S	.	*			trans	62.1	151.9	141	78.3	0	0	0	0	129.1	D1426 E1428	D1426-S1614 WeakPolarHBondContact OD2-CA 3.23Å; D1426-S1614 VanDerWaalsContact OD2-CB 3.22Å; D1426-S1614 WeakPolarHBondContact OD2-CB 3.42Å; E1428-S1614 VanDerWaalsContact CD-N 3.28Å; E1428-S1614 WeakPolarHBondContact OE1-CA 3.38Å; E1428-S1614 PolarHBondContact OE1-N 3.22Å; E1428-S1614 VanDerWaalsContact OE1-N 3.17Å
1615	V	31.9	Very low	29.8	Very low	110 Å²	110	119.3 Å²	119.3	67%	0.667	71%	0.71	S	S	*	*			trans	123	113.2	130	149.2	0	0	0	0	125.1
1616	V	32	Very low	29.8	Very low	139 Å²	139	120.3 Å²	120.3	84%	0.842	71%	0.71	S	S	*	*			trans	63.7	130.5	137.2	-179.2	0	0	0	0	128
1617	G	33.8	Very low	30	Very low	71 Å²	71	122.5 Å²	122.5	73%	0.732	71%	0.712	S	S	*	*				118.8	148	130	0	0	0	0	0	119.8
1618	N	32.1	Very low	30	Very low	144 Å²	144	120.9 Å²	120.9	77%	0.77	71%	0.706	S	S	*	*			cis	-164.1	174.1	-21.9	-161.8	44.5	0	0	0	111.8
1619	D	31.3	Very low	30.1	Very low	129 Å²	129	118.7 Å²	118.7	69%	0.69	70%	0.701	S	S	*	*			trans	70.4	163	165.6	-79.1	-71.7	0	0	0	120.6
1620	S	31.4	Very low	30.2	Very low	94 Å²	94	118.7 Å²	118.7	66%	0.657	71%	0.71	S	S	*	*				-174.5	174.5	-51.3	63	0	0	0	0	108.6
1621	L	27.7	Very low	30.1	Very low	144 Å²	144	116.1 Å²	116.1	75%	0.754	71%	0.713	S	S	*	*			cis	-166.6	163.6	-3.7	-132.7	175	0	0	0	110.6
1622	K	29.9	Very low	30.5	Very low	188 Å²	188	110.6 Å²	110.6	82%	0.817	71%	0.71	S	S	*	*			trans	76.9	138.6	167.6	-53.5	171.6	-172.6	174.2	0	118.4
1623	S	26.2	Very low	30.5	Very low	133 Å²	133	111.7 Å²	111.7	93%	0.93	72%	0.721	S	S	*	*			cis	111.1	133.2	-5.1	-161.6	0	0	0	0	119.3
1624	G	33.3	Very low	30.5	Very low	62 Å²	62	115.1 Å²	115.1	64%	0.639	74%	0.742	S	S	*	*			trans	162.1	-179.8	166.8	0	0	0	0	0	112.5
1625	T	28.8	Very low	30.8	Very low	132 Å²	132	118.8 Å²	118.8	81%	0.81	77%	0.765	S	S	*	*			cis	164.7	130.4	-46.3	-85.3	0	0	0	0	108.7
1626	L	26.9	Very low	30.6	Very low	144 Å²	144	122.1 Å²	122.1	75%	0.754	77%	0.773	S	S	*	*			cis	-171.3	176	-16.9	-120.1	177.7	0	0	0	109.3
1627	I	30.5	Very low	30.4	Very low	156 Å²	156	120.7 Å²	120.7	80%	0.8	77%	0.769	S	S	*	*			trans	70.7	154.7	156	-73.9	158.1	0	0	0	117.7
1628	A	27	Very low	30	Very low	86 Å²	86	121.8 Å²	121.8	71%	0.711	77%	0.765	S	S	*	*			cis	-173.7	-171.2	-35.4	0	0	0	0	0	107
1629	A	29.5	Very low	29.9	Very low	83 Å²	83	121.7 Å²	121.7	69%	0.686	76%	0.764	S	S	*	*			cis	-168.4	168.9	-12	0	0	0	0	0	109.9
1630	S	32	Very low	29.9	Very low	114 Å²	114	122.8 Å²	122.8	80%	0.797	77%	0.768	S	S	*	*			trans	68.7	153.7	160.5	75.9	0	0	0	0	119.4
1631	S	27.5	Very low	29.8	Very low	115 Å²	115	123 Å²	123	80%	0.804	77%	0.77	S	S	*	*			cis	-162.8	167.8	-18.2	-100.4	0	0	0	0	111.5
1632	P	35.7	Very low	29.8	Very low	133 Å²	133	120.8 Å²	120.8	86%	0.864	77%	0.767	S	S	*	*			trans	-109.6	172.2	-164.6	40.9	-35.4	0	0	0	117.3
1633	G	31.4	Very low	30	Very low	71 Å²	71	119 Å²	119	73%	0.732	77%	0.765	S	S	*	*			trans	-163.1	145.5	170.1	0	0	0	0	0	114.3
1634	P	31.8	Very low	30.1	Very low	133 Å²	133	117.5 Å²	117.5	86%	0.864	75%	0.754	S	S	*	*			trans	-119.5	-156.6	-168.7	47.7	-34.1	0	0	0	113.8
1635	P	36.2	Very low	30	Very low	114 Å²	114	119.6 Å²	119.6	74%	0.74	77%	0.765	S	S	*	*			trans	-101.6	163.4	-146.7	41.3	-42.7	0	0	0	118
1636	Q	27.6	Very low	29.9	Very low	179 Å²	179	120.4 Å²	120.4	84%	0.836	77%	0.77	S	S	*	*			trans	178	159.9	138.6	-107.7	-179	28.1	0	0	114.5
1637	S	27.3	Very low	30.2	Very low	110 Å²	110	117 Å²	117	77%	0.769	77%	0.77	S	S	*	*			trans	65.9	166.3	155.2	83	0	0	0	0	117.7
1638	S	25.9	Very low	30.1	Very low	93 Å²	93	121.3 Å²	121.3	65%	0.65	78%	0.776	S	S	*	*			cis	-176	-165.2	-35.8	63.9	0	0	0	0	107.3
1639	L	30.9	Very low	30.4	Very low	143 Å²	143	122 Å²	122	75%	0.749	77%	0.774	S	S	*	*			trans	78.4	122.3	178.6	-46.6	178.7	0	0	0	114.3
1640	I	30	Very low	30.3	Very low	151 Å²	151	124.3 Å²	124.3	77%	0.774	77%	0.774	S	S	*	*				78.5	125.2	51.1	-63.3	170.6	0	0	0	109.8
1641	S	29.7	Very low	30	Very low	99 Å²	99	126.2 Å²	126.2	69%	0.692	77%	0.774	S	S	*	*			cis	-160.5	166.6	41.4	26.8	0	0	0	0	115
1642	S	27.9	Very low	30.1	Very low	98 Å²	98	127.4 Å²	127.4	69%	0.685	77%	0.771	S	S	*	*			trans	18.6	144	150.6	62.6	0	0	0	0	121.3
1643	I	34.3	Very low	29.8	Very low	150 Å²	150	126.8 Å²	126.8	77%	0.769	76%	0.764	S	S	*	*			cis	-146.4	134.2	43.2	-69.4	167.8	0	0	0	107.6
1644	S	27.3	Very low	29.5	Very low	102 Å²	102	128.6 Å²	128.6	71%	0.713	77%	0.766	S	S	*	*			cis	84	77.8	32.1	84.4	0	0	0	0	116.4
1645	A	31.6	Very low	29.5	Very low	105 Å²	105	126.6 Å²	126.6	87%	0.868	76%	0.76	S	S	*	*			trans	-139	110.2	162.6	0	0	0	0	0	110.4
1646	T	27.7	Very low	29.1	Very low	150 Å²	150	127.3 Å²	127.3	92%	0.92	76%	0.763	S	S	*	*			trans	-112.1	141.7	-179.3	47.1	0	0	0	0	111.8
1647	G	32.6	Very low	29.4	Very low	72 Å²	72	124.6 Å²	124.6	74%	0.742	76%	0.761	S	S	*	*			trans	120.4	155	170.6	0	0	0	0	0	114.1
1648	R	28.2	Very low	29.5	Very low	247 Å²	247	124.4 Å²	124.4	93%	0.932	76%	0.76	S	S	*	*			cis	-148.7	164.3	-5	-111.4	-172.1	172.9	179.4	-1.8	110.1
1649	P	33.1	Very low	30	Very low	101 Å²	101	125.1 Å²	125.1	66%	0.656	76%	0.762	S	S	*	*			trans	-95.9	-166.7	-174	40.8	-37.2	0	0	0	113.1
1650	N	28.3	Very low	29.9	Very low	131 Å²	131	125.3 Å²	125.3	70%	0.701	76%	0.763	S	S	*	*			trans	84.5	123.1	170.5	-57.2	-11.5	0	0	0	113.7
1651	L	25.8	Very low	29.8	Very low	153 Å²	153	124 Å²	124	80%	0.801	76%	0.762	S	S	*	*				63	140.7	90.9	-58.1	156.3	0	0	0	111.6
1652	I	28.6	Very low	29.7	Very low	141 Å²	141	121.6 Å²	121.6	72%	0.723	75%	0.753	S	S	*	*				-162.8	146.8	57.8	-75.9	174.4	0	0	0	109.7
1653	T	29	Very low	29.8	Very low	120 Å²	120	123.6 Å²	123.6	74%	0.736	76%	0.755	S	S	*	*			trans	57.5	126.2	166.4	52	0	0	0	0	118.9
1654	S	26.7	Very low	29.6	Very low	108 Å²	108	118.5 Å²	118.5	76%	0.755	74%	0.735	S	S	*	*				68.8	135	61.6	85.3	0	0	0	0	114.4
1655	A	30.5	Very low	29.8	Very low	91 Å²	91	119.5 Å²	119.5	75%	0.752	73%	0.729	S	S	*	*			cis	-153.1	-168.9	14.4	0	0	0	0	0	113.9
1656	T	27.5	Very low	29.7	Very low	130 Å²	130	118.9 Å²	118.9	80%	0.798	71%	0.71	S	S	*	*			trans	-47	166.1	169.2	49.9	0	0	0	0	116.7
1657	P	33.9	Very low	29.9	Very low	122 Å²	122	115.6 Å²	115.6	79%	0.792	69%	0.687	S	S	*	*			cis	-134	-155.4	-1.5	37.4	-15.1	0	0	0	113.9
1658	S	29	Very low	30.1	Very low	106 Å²	106	117.4 Å²	117.4	74%	0.741	69%	0.686	S	S	*	*			trans	-68.5	178.8	167.8	-15.6	0	0	0	0	113.9
1659	P	37	Very low	30.1	Very low	108 Å²	108	111.7 Å²	111.7	70%	0.701	66%	0.664	S	S	*	*			cis	-140.2	-164.1	-10.9	41.6	-21.8	0	0	0	115
1660	L	28.3	Very low	30	Very low	147 Å²	147	114.4 Å²	114.4	77%	0.77	67%	0.668	S	S	*	*			trans	71.2	118.7	148.7	-77.8	172.2	0	0	0	123.9
1661	T	28.5	Very low	30	Very low	122 Å²	122	116.1 Å²	116.1	75%	0.748	67%	0.671	S	S	*	*			trans	50.9	118.8	138.3	54.7	0	0	0	0	123.5
1662	G	28.5	Very low	30.1	Very low	50 Å²	50	114.3 Å²	114.3	52%	0.515	67%	0.666	S	S	.	*				128.6	143.3	82.7	0	0	0	0	0	120.4
1663	I	29.7	Very low	30	Very low	139 Å²	139	112.9 Å²	112.9	71%	0.713	66%	0.664	S	S	*	*			trans	76.3	141.3	153.5	-61.2	157.5	0	0	0	114.3
1664	A	30.5	Very low	30	Very low	44 Å²	44	115.6 Å²	115.6	36%	0.364	67%	0.668	S	S	.	*			cis	-147.5	157.6	20.3	0	0	0	0	0	113.3	I738	I738-A1664 WeakPolarHBondContact O-CB 3.39Å
1665	Q	29.8	Very low	30.2	Very low	123 Å²	123	115 Å²	115	58%	0.575	67%	0.671	S	S	*	*				82.2	147.5	80.8	-64.9	-178.3	-16.1	0	0	116
1666	L	30.3	Very low	30.3	Very low	92 Å²	92	116.5 Å²	116.5	48%	0.482	67%	0.672	S	S	.	*			cis	-163.9	145	-15.8	-99.9	161.9	0	0	0	106.5	P740 L741	P740-L1666 WeakPolarHBondContact O-CB 3.23Å; L741-L1666 WeakPolarHBondContact O-CB 3.41Å
1667	D	32.9	Very low	30.3	Very low	81 Å²	81	114.4 Å²	114.4	43%	0.433	66%	0.663	S	S	.	*				81.8	131.5	84.1	-160.6	6	0	0	0	116.4	P742	P742-D1667 WeakPolarHBondContact CD-O 3.18Å
1668	P	36.1	Very low	30.4	Very low	109 Å²	109	114.1 Å²	114.1	71%	0.708	66%	0.661	S	S	*	*				-149.9	160.8	122.6	39.6	-23.7	0	0	0	118.5
1669	R	28.1	Very low	30.4	Very low	127 Å²	127	114.3 Å²	114.3	48%	0.479	65%	0.653	S	S	.	*			trans	-37.6	166.3	167.6	-64.4	168.9	145.9	171.9	-1	120	Q743	Q743-R1669 HydrophobicContact CB-CG 3.91Å; Q743-R1669 VanDerWaalsContact CD-CZ 3.43Å
1670	H	31.5	Very low	30.2	Very low	159 Å²	159	117.2 Å²	117.2	74%	0.736	66%	0.66	S	S	*	*			trans	87.3	143.7	164.7	-64.4	-82.1	0	0	0	115.8
1671	H	28.2	Very low	30.8	Very low	166 Å²	166	115.3 Å²	115.3	77%	0.769	65%	0.651	S	S	*	*			cis	124.3	134.8	5.5	-99.1	-72.6	0	0	0	110.6
1672	V	26.6	Very low	31.2	Very low	116 Å²	116	117.2 Å²	117.2	70%	0.703	65%	0.654	S	S	*	*			trans	87.8	98.3	141.5	168.5	0	0	0	0	121
1673	T	27.4	Very low	31.3	Very low	110 Å²	110	120 Å²	120	68%	0.675	67%	0.665	S	S	*	*				78.2	136.4	129.6	61.7	0	0	0	0	126.4
1674	Q	28.5	Very low	31.4	Very low	177 Å²	177	119.8 Å²	119.8	83%	0.827	67%	0.67	S	S	*	*			trans	82.4	107.7	135.7	-79.5	171.5	18.9	0	0	122.8
1675	A	30.9	Very low	31.4	Very low	97 Å²	97	125.9 Å²	125.9	80%	0.802	69%	0.691	S	S	*	*				66.6	160.4	128.6	0	0	0	0	0	120.3
1676	P	33.1	Very low	31.7	Very low	122 Å²	122	126.8 Å²	126.8	79%	0.792	69%	0.694	S	S	*	*			cis	-119.2	173.6	2.2	42.5	-30.6	0	0	0	115.1
1677	S	28.2	Very low	31.8	Very low	85 Å²	85	125.7 Å²	125.7	59%	0.594	71%	0.705	S	S	*	*			trans	-74.2	160.3	158.5	53.6	0	0	0	0	110.6
1678	P	35.1	Very low	31.9	Very low	116 Å²	116	131.6 Å²	131.6	75%	0.753	72%	0.723	S	S	*	*				-114.9	143.9	80	39.5	-37.5	0	0	0	111.4
1679	I	29.3	Very low	31.6	Very low	110 Å²	110	131.2 Å²	131.2	56%	0.564	72%	0.723	S	S	*	*	S	Bend		55.5	106	65.6	-60.1	172.9	0	0	0	108.8
1680	I	33.7	Very low	31.9	Very low	169 Å²	169	133.3 Å²	133.3	87%	0.867	74%	0.743	S	S	*	*	S	Bend	cis	-135.3	112.1	24.5	-43.4	163.1	0	0	0	109.6
1681	D	40	Very low	32	Very low	107 Å²	107	129.1 Å²	129.1	57%	0.572	74%	0.742	S	S	*	*	S	Bend	cis	-150.9	115.1	-16	-144.1	-3.8	0	0	0	111
1682	M	37.6	Very low	32.2	Very low	163 Å²	163	129.2 Å²	129.2	80%	0.803	75%	0.748	S	S	*	*			trans	59.6	127.8	171.4	-54.4	-171.9	-69.5	0	0	121.2
1683	S	30.3	Very low	32.5	Very low	107 Å²	107	129.5 Å²	129.5	75%	0.748	75%	0.75	S	S	*	*			cis	-171.9	124.4	-40.6	42	0	0	0	0	113.4
1684	V	31.1	Very low	32.6	Very low	136 Å²	136	130.3 Å²	130.3	82%	0.824	75%	0.75	S	S	*	*			trans	31.2	124	140.2	-174.4	0	0	0	0	121.9
1685	H	30.2	Very low	32.6	Very low	172 Å²	172	128 Å²	128	80%	0.796	74%	0.743	S	S	*	*			trans	-166.3	163.5	135.1	-129.6	-89.5	0	0	0	116.4
1686	H	36.9	Very low	32.6	Very low	141 Å²	141	130 Å²	130	65%	0.653	74%	0.74	S	S	*	*			trans	-146.8	178.8	173.3	-93.5	15.7	0	0	0	109.8	Y1688	H1686-Y1688 HydrophobicContact CB-CD2 4.31Å; H1686-Y1688 HydrophobicContact CB-CE2 4.19Å; H1686-Y1688 AromaticContact CD2-CE2 3.64Å; H1686-Y1688 AromaticContact CD2-CZ 3.55Å
1687	G	32	Very low	32.5	Very low	69 Å²	69	129.6 Å²	129.6	71%	0.711	74%	0.74	S	S	*	*			cis	-171.8	-155.9	4	0	0	0	0	0	108.8
1688	Y	34.9	Very low	32.9	Very low	205 Å²	205	131.2 Å²	131.2	80%	0.804	75%	0.749	S	S	*	*			cis	-167.6	160.9	-1.7	-117.4	-59.2	0	0	0	109.1	H1686	H1686-Y1688 HydrophobicContact CB-CD2 4.31Å; H1686-Y1688 HydrophobicContact CB-CE2 4.19Å; H1686-Y1688 AromaticContact CD2-CE2 3.64Å; H1686-Y1688 AromaticContact CD2-CZ 3.55Å
1689	S	31.1	Very low	32.9	Very low	102 Å²	102	131.2 Å²	131.2	71%	0.713	75%	0.748	S	S	*	*			trans	-155.1	110	153.6	-165.6	0	0	0	0	113.3
1690	L	32.5	Very low	32.9	Very low	171 Å²	171	130.4 Å²	130.4	90%	0.895	76%	0.758	S	S	*	*			trans	50.9	128.4	151.9	-61.2	167.4	0	0	0	120.7
1691	G	33.6	Very low	32.9	Very low	70 Å²	70	129.6 Å²	129.6	72%	0.722	75%	0.754	S	S	*	*			trans	-163.9	-38	178.8	0	0	0	0	0	121.4
1692	L	32.5	Very low	32.5	Very low	168 Å²	168	131.5 Å²	131.5	88%	0.88	76%	0.759	S	S	*	*			trans	67.3	151.5	-172.7	-52.4	167.1	0	0	0	113.7
1693	T	33.4	Very low	32.2	Very low	123 Å²	123	131.8 Å²	131.8	76%	0.755	76%	0.759	S	S	*	*			cis	-173.9	161.6	-7	24.2	0	0	0	0	106.8
1694	N	29.3	Very low	32.4	Very low	127 Å²	127	132 Å²	132	68%	0.679	76%	0.758	S	S	*	*			cis	-173.2	179.9	-12.3	-175	21.7	0	0	0	108.5
1695	L	29.7	Very low	32.2	Very low	129 Å²	129	134.1 Å²	134.1	68%	0.675	76%	0.761	S	S	*	*			trans	78.2	110	166	-50.9	173.5	0	0	0	116.5
1696	N	31.3	Very low	32.2	Very low	139 Å²	139	133.6 Å²	133.6	74%	0.743	76%	0.764	S	S	*	*				86.8	138.5	77.2	-67.1	1.8	0	0	0	112.6
1697	S	30	Very low	32	Very low	112 Å²	112	131.6 Å²	131.6	78%	0.783	76%	0.763	S	S	*	*			cis	-155.7	174.7	24.8	-43.6	0	0	0	0	113.7
1698	P	35.9	Very low	31.6	Very low	120 Å²	120	137.6 Å²	137.6	78%	0.779	77%	0.77	S	S	*	*			trans	-116.2	-144.8	179.7	45.7	-33.1	0	0	0	112.1
1699	P	35.1	Very low	31.2	Very low	115 Å²	115	135.2 Å²	135.2	75%	0.747	77%	0.77	S	S	*	*			cis	-130.7	172.1	-33.9	38	-20.9	0	0	0	116
1700	A	31	Very low	30.9	Very low	93 Å²	93	134.9 Å²	134.9	77%	0.769	77%	0.767	S	S	*	*			trans	38.3	129.1	147.5	0	0	0	0	0	124.5
1701	I	33	Very low	30.7	Very low	152 Å²	152	134.4 Å²	134.4	78%	0.779	76%	0.76	S	S	*	*			trans	-164.9	129.9	155.6	-113.6	161.4	0	0	0	115.9
1702	Q	31.2	Very low	30.3	Very low	147 Å²	147	142.5 Å²	142.5	69%	0.687	77%	0.769	S	S	*	*			trans	64.4	140.6	140.5	-68.6	175.6	17.9	0	0	128.7
1703	Q	32.2	Very low	30	Very low	170 Å²	170	138.2 Å²	138.2	79%	0.794	77%	0.766	S	S	*	*			trans	104.8	148	130.4	-87.4	174.6	59.1	0	0	123.2
1704	P	34.2	Very low	29.8	Very low	111 Å²	111	135.5 Å²	135.5	72%	0.721	76%	0.762	S	S	*	*			trans	-136	-165.7	-162.7	45.7	-26	0	0	0	116.3
1705	M	26.1	Very low	29.6	Very low	180 Å²	180	136.2 Å²	136.2	89%	0.887	77%	0.771	S	S	*	*			trans	31.6	121.6	156.2	-73.8	-169.3	174.1	0	0	121.1
1706	N	29.6	Very low	29.3	Very low	162 Å²	162	134.8 Å²	134.8	87%	0.866	77%	0.772	S	S	*	*			trans	-156.6	131.7	133.7	-142.8	2.4	0	0	0	113.2
1707	P	33	Very low	29	Very low	99 Å²	99	132.4 Å²	132.4	64%	0.643	77%	0.766	S	S	*	*			trans	-110.9	-171.5	173.6	33.5	-20.1	0	0	0	114.3
1708	F	24	Very low	28.7	Very low	195 Å²	195	131.5 Å²	131.5	86%	0.855	76%	0.76	S	S	*	*			trans	89.9	138.6	166.3	-86.1	-83.8	0	0	0	122
1709	I	26.3	Very low	28.3	Very low	155 Å²	155	133.2 Å²	133.2	80%	0.795	76%	0.757	S	S	*	*			trans	99.1	115	154.7	-65.3	150.3	0	0	0	120.7
1710	S	24.3	Very low	27.7	Very low	94 Å²	94	133.9 Å²	133.9	66%	0.657	76%	0.759	S	S	*	*			trans	55.8	144.5	158.3	-107.1	0	0	0	0	121
1711	H	29.2	Very low	27.6	Very low	162 Å²	162	132.7 Å²	132.7	75%	0.75	76%	0.756	S	S	*	*			cis	-139.4	160.3	7.9	-102.8	-67.3	0	0	0	111.8
1712	R	25.7	Very low	27.2	Very low	239 Å²	239	130.2 Å²	130.2	90%	0.902	75%	0.752	S	S	*	*			trans	15.3	137	156.4	-59.5	178	176.6	-177.5	-0.7	119.7
1713	G	26	Very low	27	Very low	79 Å²	79	131.8 Å²	131.8	81%	0.814	76%	0.759	S	S	*	*			cis	147.2	147.5	0.9	0	0	0	0	0	112.6
1714	G	28.3	Very low	27	Very low	66 Å²	66	128.3 Å²	128.3	68%	0.68	75%	0.751	S	S	*	*			trans	99.8	132.9	-176.6	0	0	0	0	0	112.3
1715	T	25.3	Very low	26.6	Very low	141 Å²	141	127.6 Å²	127.6	87%	0.865	75%	0.749	S	S	*	*			cis	65.2	126.7	30	82.6	0	0	0	0	113.3
1716	S	23.9	Very low	26.6	Very low	99 Å²	99	123.6 Å²	123.6	69%	0.692	74%	0.739	S	S	*	*			cis	-164.7	170.6	5.6	49.2	0	0	0	0	113.2
1717	S	24.9	Very low	26.5	Very low	90 Å²	90	122.9 Å²	122.9	63%	0.629	73%	0.734	S	S	*	*			trans	57	124	136.9	64.1	0	0	0	0	122.2
1718	S	24.5	Very low	26.1	Very low	92 Å²	92	124.2 Å²	124.2	64%	0.643	74%	0.74	S	S	*	*				72.6	167.5	129.6	69	0	0	0	0	121.2
1719	H	26.4	Very low	26.3	Very low	157 Å²	157	118.1 Å²	118.1	73%	0.727	73%	0.733	S	S	*	*			trans	72.8	116.6	-180	-58.5	-66	0	0	0	115.5
1720	T	23.6	Very low	26.3	Very low	129 Å²	129	117 Å²	117	79%	0.791	74%	0.739	S	S	*	*				65.4	115.1	50.8	76.5	0	0	0	0	112.9
1721	G	26.9	Very low	26.4	Very low	68 Å²	68	115.6 Å²	115.6	70%	0.701	74%	0.739	S	S	*	*			trans	153.7	52.9	-171.5	0	0	0	0	0	111.3
1722	S	26.3	Very low	26.1	Very low	99 Å²	99	115.2 Å²	115.2	69%	0.692	75%	0.748	S	S	*	*				57	116.8	68.3	82.7	0	0	0	0	114.6
1723	H	26.5	Very low	26.1	Very low	180 Å²	180	107.2 Å²	107.2	83%	0.833	74%	0.74	S	S	*	*			trans	77.8	162.7	145	-75.8	-50.2	0	0	0	118.3
1724	P	30.8	Very low	26.1	Very low	97 Å²	97	108.1 Å²	108.1	63%	0.63	74%	0.74	S	S	*	*				-147.3	-161.3	-77.9	38.3	-14.8	0	0	0	114.2
1725	S	26.7	Very low	25.8	Very low	96 Å²	96	109.2 Å²	109.2	67%	0.671	74%	0.743	S	S	*	*			trans	60.8	131.5	134.4	-65.4	0	0	0	0	122.6
1726	S	25.6	Very low	26	Very low	96 Å²	96	113.3 Å²	113.3	67%	0.671	74%	0.744	S	S	*	*				74.5	158.7	128.6	72.2	0	0	0	0	118.9
1727	L	28.9	Very low	26.1	Very low	148 Å²	148	115.8 Å²	115.8	78%	0.775	75%	0.75	S	S	*	*			cis	-116.5	149.7	-2.1	-79.7	85.7	0	0	0	108.2
1728	T	24.4	Very low	26.3	Very low	126 Å²	126	118.4 Å²	118.4	77%	0.773	76%	0.762	S	S	*	*			cis	59.8	81.1	48	69.4	0	0	0	0	115.5
1729	G	27.5	Very low	26.3	Very low	68 Å²	68	123.1 Å²	123.1	70%	0.701	78%	0.776	S	S	*	*			trans	171.2	113.3	166.1	0	0	0	0	0	109.6
1730	S	25.6	Very low	26.4	Very low	131 Å²	131	118.8 Å²	118.8	92%	0.916	77%	0.773	S	S	*	*			cis	76.1	91	34.3	91.6	0	0	0	0	114.6
1731	G	26.8	Very low	26.5	Very low	64 Å²	64	120.1 Å²	120.1	66%	0.66	77%	0.774	S	S	*	*			trans	164.7	116.2	169.1	0	0	0	0	0	108.4
1732	T	23.8	Very low	26.4	Very low	154 Å²	154	123.5 Å²	123.5	95%	0.945	78%	0.776	S	S	*	*				68.1	98.1	53.1	74.4	0	0	0	0	114
1733	G	26.1	Very low	26.4	Very low	71 Å²	71	125.2 Å²	125.2	73%	0.732	78%	0.778	S	S	*	*			trans	164.5	114	174.1	0	0	0	0	0	108.5
1734	A	24.6	Very low	26.4	Very low	99 Å²	99	123.3 Å²	123.3	82%	0.818	77%	0.773	S	S	*	*				65.1	92.3	76.3	0	0	0	0	0	111.1
1735	A	23.8	Very low	26.1	Very low	89 Å²	89	124.3 Å²	124.3	74%	0.736	78%	0.781	S	S	*	*				85.8	101.5	62.9	0	0	0	0	0	114.5
1736	Y	28.8	Very low	26.2	Very low	226 Å²	226	126 Å²	126	89%	0.886	79%	0.787	S	S	*	*			trans	-147.9	118.1	151.7	-78	-76.2	0	0	0	105.5
1737	N	25.2	Very low	26.2	Very low	152 Å²	152	125.9 Å²	125.9	81%	0.813	79%	0.786	S	S	*	*				53.1	109	61.8	-77.5	-13.5	0	0	0	114.5
1738	V	29.7	Very low	26.2	Very low	145 Å²	145	126.3 Å²	126.3	88%	0.879	79%	0.785	S	S	*	*				-163.2	133.7	117.8	146	0	0	0	0	108.4
1739	M	24.8	Very low	26.4	Very low	190 Å²	190	125.7 Å²	125.7	94%	0.936	78%	0.776	S	S	*	*			trans	-98.5	150.1	164.7	-67.6	-172.6	-72.9	0	0	109.4
1740	G	27.3	Very low	26.3	Very low	66 Å²	66	129.5 Å²	129.5	68%	0.68	78%	0.781	S	S	*	*			trans	-179.7	101.1	170.4	0	0	0	0	0	119
1741	I	27.2	Very low	26.2	Very low	158 Å²	158	127.8 Å²	127.8	81%	0.81	78%	0.775	S	S	*	*			trans	66.8	104.9	132.3	-56.7	167.7	0	0	0	119.3
1742	N	24.8	Very low	26.2	Very low	138 Å²	138	129.2 Å²	129.2	74%	0.738	78%	0.781	S	S	*	*			trans	47.1	131.6	131.2	-60.2	-2.9	0	0	0	123.9
1743	N	25.4	Very low	26.2	Very low	136 Å²	136	126.8 Å²	126.8	73%	0.727	77%	0.765	S	S	*	*			trans	87.5	130	135.4	-68.9	-1.6	0	0	0	122.1
1744	N	26.6	Very low	26.1	Very low	139 Å²	139	127.3 Å²	127.3	74%	0.743	75%	0.75	S	S	*	*			trans	75.6	112.3	147.7	-66.2	-1.4	0	0	0	120.7
1745	C	25	Very low	26	Very low	118 Å²	118	127.8 Å²	127.8	80%	0.797	73%	0.731	S	S	*	*			trans	66.8	131.5	147.3	-51.5	0	0	0	0	116.1
1746	V	27.6	Very low	26	Very low	132 Å²	132	128.9 Å²	128.9	80%	0.8	73%	0.725	S	S	*	*				-160.2	154.2	59.5	159.1	0	0	0	0	110.5
1747	S	25.9	Very low	25.9	Very low	93 Å²	93	120.4 Å²	120.4	65%	0.65	71%	0.706	S	S	*	*			trans	-40.2	166.1	-179.7	55.3	0	0	0	0	122.1
1748	E	28.5	Very low	26.2	Very low	157 Å²	157	120.9 Å²	120.9	73%	0.734	71%	0.708	S	S	*	*			trans	133.1	98.1	135.3	-63.8	-132.2	117.3	0	0	117.4
1749	N	28.7	Very low	25.8	Very low	113 Å²	113	121 Å²	121	60%	0.604	70%	0.702	S	S	*	*				72.2	94.2	122.6	-55.1	-25.6	0	0	0	122.3
1750	N	25.4	Very low	26	Very low	148 Å²	148	119.1 Å²	119.1	79%	0.791	69%	0.694	S	S	*	*				69	98.5	115.8	-63.6	-22.9	0	0	0	121.5
1751	A	24.6	Very low	25.9	Very low	95 Å²	95	120 Å²	120	79%	0.785	70%	0.695	S	S	*	*				100	124.3	107.1	0	0	0	0	0	121.2
1752	A	25.8	Very low	25.9	Very low	95 Å²	95	122.7 Å²	122.7	79%	0.785	70%	0.695	S	S	*	*			trans	68.8	82.1	143.4	0	0	0	0	0	120.2
1753	T	24	Very low	26	Very low	102 Å²	102	123.7 Å²	123.7	63%	0.626	70%	0.7	S	S	*	*			trans	-154.9	160.5	146.9	2.1	0	0	0	0	112
1754	M	24.9	Very low	26.1	Very low	82 Å²	82	120.8 Å²	120.8	40%	0.404	70%	0.703	S	S	.	*			trans	77	131.2	163.5	-55.2	150.2	-170.1	0	0	114.4	L2107 D2108 A2109	M1754-L2107 VanDerWaalsContact CE-O 3.26Å; M1754-L2107 WeakPolarHBondContact CE-O 3.48Å; M1754-D2108 HydrophobicContact CB-CB 4.01Å; M1754-D2108 HydrophobicContact CG-CB 3.47Å; M1754-D2108 VanDerWaalsContact CG-CB 3.47Å; M1754-D2108 HydrophobicContact SD-CB 4.15Å; M1754-A2109 HydrophobicContact SD-CB 4.21Å; M1754-A2109 PolarHBondContact SD-N 2.81Å; M1754-A2109 VanDerWaalsContact SD-N 3.42Å
1755	Y	22.5	Very low	26.1	Very low	109 Å²	109	121.4 Å²	121.4	43%	0.427	71%	0.705	S	S	.	*				64	119.9	53.2	-60.7	-148	0	0	0	108	D2108 L2117	Y1755-D2108 HydrophobicContact CD1-CB 4.28Å; Y1755-D2108 VanDerWaalsContact CD1-OD2 3.25Å; Y1755-D2108 WeakPolarHBondContact CD1-OD2 3.3Å; Y1755-D2108 HydrophobicContact CG-CB 4.41Å; Y1755-L2117 HydrophobicContact CD1-CB 4.4Å; Y1755-L2117 HydrophobicContact CD1-CD2 3.9Å; Y1755-L2117 HydrophobicContact CD2-CD2 4.45Å; Y1755-L2117 HydrophobicContact CE1-CB 3.62Å; Y1755-L2117 HydrophobicContact CE1-CD2 3.38Å; Y1755-L2117 HydrophobicContact CE1-CG 4.07Å; Y1755-L2117 HydrophobicContact CE2-CD2 3.97Å; Y1755-L2117 HydrophobicContact CG-CD2 4.43Å; Y1755-L2117 VanDerWaalsContact CZ-CD2 3.42Å
1756	D	23.9	Very low	26.3	Very low	113 Å²	113	122.1 Å²	122.1	60%	0.604	71%	0.708	S	S	*	*			cis	-136.3	-160	42	-165.7	4.2	0	0	0	112.5	T2110	D1756-T2110 HydrophobicContact CB-CG2 3.67Å; D1756-T2110 WeakPolarHBondContact CB-OG1 3.35Å; D1756-T2110 PolarHBondContact OD2-OG1 2.83Å
1757	G	25.1	Very low	26.3	Very low	48 Å²	48	117.9 Å²	117.9	50%	0.495	69%	0.691	S	S	.	*	S	Bend	trans	-78.3	-174.7	178.2	0	0	0	0	0	116.1
1758	L	31.6	Very low	26.1	Very low	161 Å²	161	118.9 Å²	118.9	84%	0.843	70%	0.698	S	S	*	*			trans	59.1	57	159.5	-148.9	166.5	0	0	0	115.7	I1760	L1758-I1760 HydrophobicContact CD2-CG1 4.46Å
1759	I	22.8	Very low	25.9	Very low	148 Å²	148	120.1 Å²	120.1	76%	0.759	70%	0.704	S	S	*	*			trans	-102.6	91.2	177.1	-54.3	-173.4	0	0	0	112.5
1760	I	28.7	Very low	25.6	Very low	151 Å²	151	120.6 Å²	120.6	77%	0.774	72%	0.716	S	S	*	*			trans	-24.5	124.6	151.9	-61	158.9	0	0	0	112.5	L1758	L1758-I1760 HydrophobicContact CD2-CG1 4.46Å
1761	A	23.7	Very low	26.2	Very low	83 Å²	83	116.9 Å²	116.9	69%	0.686	71%	0.713	S	S	*	*			trans	-143.4	86.1	-179.3	0	0	0	0	0	114.1
1762	R	27.6	Very low	26.8	Very low	216 Å²	216	118.4 Å²	118.4	82%	0.815	72%	0.715	S	S	*	*				147.5	118.8	124	-80.4	159	175.3	169.9	-1.5	114.8
1763	N	27.5	Very low	27	Very low	158 Å²	158	122.7 Å²	122.7	85%	0.845	72%	0.719	S	S	*	*			trans	65.1	132.3	141.3	-46	-5.3	0	0	0	118.5
1764	G	27.6	Very low	27.1	Very low	76 Å²	76	123.4 Å²	123.4	78%	0.784	73%	0.728	S	S	*	*			trans	-179.6	-21.6	170.9	0	0	0	0	0	121.4
1765	L	25.9	Very low	27.2	Very low	151 Å²	151	123.1 Å²	123.1	79%	0.791	74%	0.738	S	S	*	*			trans	-148.7	153.9	174.9	-91.4	172	0	0	0	108.5	G1767	L1765-G1767 WeakPolarHBondContact CD2-O 3.48Å
1766	P	30.7	Very low	27.5	Very low	133 Å²	133	128 Å²	128	86%	0.864	76%	0.762	S	S	*	*			cis	-106	151.8	22.8	38.3	-33.6	0	0	0	116.4
1767	G	26.6	Very low	27.5	Very low	43 Å²	43	129.5 Å²	129.5	44%	0.443	77%	0.77	S	S	.	*			trans	158.6	142.1	169.1	0	0	0	0	0	110.3	L1765	L1765-G1767 WeakPolarHBondContact CD2-O 3.48Å
1768	S	21.8	Very low	28	Very low	114 Å²	114	133.5 Å²	133.5	80%	0.797	78%	0.777	S	S	*	*			cis	45.8	81	-1.4	71.9	0	0	0	0	113.9
1769	E	24.3	Very low	27.9	Very low	183 Å²	183	131.3 Å²	131.3	86%	0.855	77%	0.773	S	S	*	*				-107.3	167.8	65.6	-54.9	-173.8	139.8	0	0	116.2
1770	S	22.6	Very low	28	Very low	123 Å²	123	131 Å²	131	86%	0.86	77%	0.768	S	S	*	*			trans	-68.1	124.2	153.3	50.3	0	0	0	0	109.5
1771	G	37.5	Very low	27.8	Very low	70 Å²	70	132 Å²	132	72%	0.722	77%	0.774	S	S	*	*			cis	138.2	95.1	-3.6	0	0	0	0	0	111.6
1772	P	37.4	Very low	27.8	Very low	128 Å²	128	132.3 Å²	132.3	83%	0.831	77%	0.769	S	S	*	*			trans	-127.2	158.2	172.3	38	-23.8	0	0	0	114
1773	E	31.3	Very low	27.7	Very low	185 Å²	185	132 Å²	132	86%	0.864	77%	0.773	S	S	*	*			trans	-81.6	179.7	167.6	-57.4	177.3	120.3	0	0	111.9
1774	S	25.6	Very low	27.6	Very low	117 Å²	117	132 Å²	132	82%	0.818	77%	0.769	S	S	*	*			trans	89.3	155.8	156.8	82.9	0	0	0	0	120.2
1775	A	25.7	Very low	27.6	Very low	75 Å²	75	134.8 Å²	134.8	62%	0.62	76%	0.764	S	S	*	*			trans	58.1	106.9	163.5	0	0	0	0	0	119.3
1776	F	29.3	Very low	27.4	Very low	212 Å²	212	136 Å²	136	93%	0.93	76%	0.763	S	S	*	*				-143.8	142.3	101.7	-113.6	-76.3	0	0	0	111.1
1777	D	25.3	Very low	27	Very low	144 Å²	144	133 Å²	133	77%	0.77	76%	0.756	S	S	*	*			trans	-83.3	159.9	-171.2	-76.1	-77.7	0	0	0	114.9
1778	M	34.6	Very low	26.9	Very low	133 Å²	133	139.5 Å²	139.5	66%	0.655	77%	0.774	S	S	*	*			trans	-10.8	150.5	139.6	-99.1	-125.6	-62.4	0	0	117.6	H1780	M1778-H1780 WeakPolarHBondContact CE-NE2 3.47Å
1779	P	29	Very low	27.4	Very low	114 Å²	114	138.3 Å²	138.3	74%	0.74	77%	0.766	S	S	*	*				-145.4	170.8	63.4	40.5	-22.5	0	0	0	119.1
1780	H	25.9	Very low	27.9	Very low	143 Å²	143	136.3 Å²	136.3	66%	0.662	76%	0.758	S	S	*	*			trans	-36.1	143.7	163.9	-37.2	-91.8	0	0	0	115.8	M1778	M1778-H1780 WeakPolarHBondContact CE-NE2 3.47Å
1781	L	25.1	Very low	29.6	Very low	172 Å²	172	133 Å²	133	90%	0.901	73%	0.729	S	S	*	*			trans	-141.4	156.4	134.3	-85.7	179.9	0	0	0	108.6
1782	P	23.3	Very low	31.1	Very low	89 Å²	89	135.9 Å²	135.9	58%	0.578	72%	0.723	S	S	*	*			trans	-120.8	174.4	-137.5	37.5	-25	0	0	0	116.6	E1784	P1782-E1784 VanDerWaalsContact C-N 3.33Å; P1782-E1784 HydrophobicContact CG-CG 4.16Å; P1782-E1784 PolarHBondContact O-N 3.25Å
1783	F	26	Very low	33.4	Very low	208 Å²	208	132.1 Å²	132.1	91%	0.912	70%	0.699	S	S	*	*			trans	-70.8	79.6	166.3	-129.3	-97	0	0	0	110.7
1784	E	24.3	Very low	36.2	Very low	160 Å²	160	124.2 Å²	124.2	75%	0.748	66%	0.663	S	S	*	*			trans	-121.2	109.2	167	-70.6	-170.4	133.2	0	0	108.9	P1782	P1782-E1784 VanDerWaalsContact C-N 3.33Å; P1782-E1784 HydrophobicContact CG-CG 4.16Å; P1782-E1784 PolarHBondContact O-N 3.25Å
1785	I	28.4	Very low	39.1	Very low	133 Å²	133	121.1 Å²	121.1	68%	0.682	64%	0.64	S	S	*	*				57.3	88.7	71.4	-53.7	178.9	0	0	0	111.9
1786	K	21.3	Very low	42	Very low	177 Å²	177	119.2 Å²	119.2	77%	0.77	62%	0.621	S	S	*	*			trans	79.1	82.8	169.1	-49.2	158.8	-176.9	172.5	0	116.3
1787	G	22.6	Very low	44.7	Very low	69 Å²	69	114.9 Å²	114.9	71%	0.711	61%	0.607	S	S	*	*			trans	-165.8	143.4	163.6	0	0	0	0	0	111.4
1788	H	23.8	Very low	47.6	Very low	181 Å²	181	112 Å²	112	84%	0.838	59%	0.591	S	S	*	*			trans	-50.7	131.3	-174	-48.8	-69.9	0	0	0	114.1	M1790	H1788-M1790 PolarHBondContact O-N 3.22Å; H1788-M1790 VanDerWaalsContact O-N 3.09Å
1789	S	31.7	Very low	50.2	Low	88 Å²	88	105.6 Å²	105.6	62%	0.615	56%	0.56	S	S	*	*			trans	-66.8	105	163.1	46.2	0	0	0	0	108.7	H1791	S1789-H1791 PolarHBondContact O-CD2 2.77Å; S1789-H1791 PolarHBondContact O-N 3.2Å; S1789-H1791 VanDerWaalsContact O-N 3.11Å; S1789-H1791 PolarHBondContact OG-NE2 3Å
1790	M	35.4	Very low	52.9	Low	142 Å²	142	102.8 Å²	102.8	70%	0.7	54%	0.541	S	S	*	.			trans	-77.2	99.4	175.6	-72.8	-168.6	171.8	0	0	109.9	H1788 H1792	H1788-M1790 PolarHBondContact O-N 3.22Å; H1788-M1790 VanDerWaalsContact O-N 3.09Å; M1790-H1792 WeakPolarHBondContact CB-CE1 3.2Å; M1790-H1792 WeakPolarHBondContact CB-ND1 3.44Å; M1790-H1792 PolarHBondContact O-N 2.73Å; M1790-H1792 PolarHBondContact O-ND1 2.96Å
1791	H	59.4	Low	55.6	Low	54 Å²	54	101 Å²	101	25%	0.25	54%	0.537	C	S	.	.			trans	-69.7	93.3	169	-57.8	-99.5	0	0	0	108.4	S1789 E1817 Y2054	S1789-H1791 PolarHBondContact O-CD2 2.77Å; S1789-H1791 PolarHBondContact O-N 3.2Å; S1789-H1791 VanDerWaalsContact O-N 3.11Å; S1789-H1791 PolarHBondContact OG-NE2 3Å; H1791-E1817 IonicContact CE1-OE2 3.83Å; H1791-E1817 PolarHBondContact CE1-OE2 3.18Å; H1791-E1817 IonicContact ND1-OE2 3.04Å; H1791-E1817 PolarHBondContact ND1-OE2 3.36Å; H1791-Y2054 HydrophobicContact CB-CD1 3.29Å; H1791-Y2054 HydrophobicContact CB-CD2 4.47Å; H1791-Y2054 HydrophobicContact CB-CE1 3.76Å; H1791-Y2054 HydrophobicContact CB-CG 3.7Å; H1791-Y2054 AromaticContact CD2-CD1 3.99Å; H1791-Y2054 AromaticContact CD2-CE1 3.61Å; H1791-Y2054 AromaticContact CD2-CE2 4Å; H1791-Y2054 AromaticContact CD2-CZ 3.61Å; H1791-Y2054 AromaticContact CG-CD1 3.55Å; H1791-Y2054 AromaticContact CG-CD2 3.97Å; H1791-Y2054 AromaticContact CG-CE1 3.69Å; H1791-Y2054 AromaticContact CG-CG 3.7Å; H1791-Y2054 AromaticContact CG-CZ 3.96Å; H1791-Y2054 AromaticContact ND1-CD2 3.81Å; H1791-Y2054 AromaticContact ND1-CG 3.86Å; H1791-Y2054 AromaticContact NE2-CZ 3.97Å
1792	H	67.9	Low	58.6	Low	129 Å²	129	94 Å²	94	60%	0.597	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-87.4	156.7	178.7	-68.7	87	0	0	0	111.3	M1790 I1794	M1790-H1792 WeakPolarHBondContact CB-CE1 3.2Å; M1790-H1792 WeakPolarHBondContact CB-ND1 3.44Å; M1790-H1792 PolarHBondContact O-N 2.73Å; M1790-H1792 PolarHBondContact O-ND1 2.96Å; H1792-I1794 PolarHBondContact O-N 2.49Å
1793	P	86.7	Confident	61.7	Low	50 Å²	50	90.5 Å²	90.5	33%	0.325	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-54.5	126.1	168.3	-24.5	33.7	0	0	0	112.4	T2050 D2052	P1793-T2050 HydrophobicContact CB-CG2 4.38Å; P1793-D2052 HydrophobicContact CB-CB 4.16Å; P1793-D2052 HydrophobicContact CG-CB 4.32Å
1794	I	89	Confident	64.5	Low	18 Å²	18	83.5 Å²	83.5	9%	0.092	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	123	-176.9	-52.9	161.3	0	0	0	109.1	H1792 L1798 L1799 H1802 T2050 V2051	H1792-I1794 PolarHBondContact O-N 2.49Å; I1794-L1798 HydrophobicContact CG2-CB 4.49Å; I1794-L1799 HydrophobicContact CD1-CD1 4.16Å; I1794-L1799 HydrophobicContact CG2-CD1 4.23Å; I1794-H1802 VanDerWaalsContact CD1-CE1 3.46Å; I1794-H1802 WeakPolarHBondContact CD1-CE1 3.36Å; I1794-H1802 HydrophobicContact CG2-CB 4.2Å; I1794-T2050 CarbonylContact O-C 3.48Å; I1794-T2050 VanDerWaalsContact O-CA 3.24Å; I1794-T2050 WeakPolarHBondContact O-CA 3.28Å; I1794-V2051 WeakPolarHBondContact CA-O 3.33Å; I1794-V2051 WeakPolarHBondContact CB-O 3.47Å; I1794-V2051 PolarHBondContact N-O 2.78Å; I1794-V2051 PolarHBondContact O-N 2.78Å
1795	P	86.9	Confident	67.4	Low	53 Å²	53	81.8 Å²	81.8	34%	0.344	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	139.3	170.8	-25.1	36	0	0	0	112.1	N1797 L1798 L1799	P1795-N1797 VanDerWaalsContact C-N 3.26Å; P1795-N1797 VanDerWaalsContact CB-OD1 3.3Å; P1795-N1797 WeakPolarHBondContact CB-OD1 3.43Å; P1795-N1797 PolarHBondContact O-N 2.75Å; P1795-N1797 VanDerWaalsContact O-N 3.16Å; P1795-L1798 HydrophobicContact CB-CD1 4.31Å; P1795-L1798 HydrophobicContact CB-CG 4.33Å; P1795-L1798 HydrophobicContact CG-CD1 4.1Å; P1795-L1798 WeakPolarHBondContact O-CA 3.41Å; P1795-L1798 PolarHBondContact O-N 3.32Å; P1795-L1799 PolarHBondContact O-N 2.85Å
1796	V	86	Confident	70.1	Confident	35 Å²	35	75.9 Å²	75.9	21%	0.212	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-53.1	-39.7	-175.8	158.5	0	0	0	0	113.9	L1798 L1799 L2045 K2049 V2051 I2085	V1796-L1798 PolarHBondContact O-N 2.7Å; V1796-L1799 PolarHBondContact O-N 3.4Å; V1796-L2045 HydrophobicContact CG2-CD2 3.13Å; V1796-K2049 WeakPolarHBondContact CB-O 3.45Å; V1796-K2049 WeakPolarHBondContact CG2-O 3.02Å; V1796-K2049 PolarHBondContact N-O 2.36Å; V1796-V2051 HydrophobicContact CG2-CG2 4.4Å; V1796-I2085 HydrophobicContact CB-CD1 4.5Å; V1796-I2085 HydrophobicContact CG1-CD1 4.06Å; V1796-I2085 HydrophobicContact CG1-CG1 3.99Å; V1796-I2085 HydrophobicContact CG1-CG2 3.77Å; V1796-I2085 HydrophobicContact CG2-CD1 4.1Å
1797	N	85.7	Confident	73.1	Confident	121 Å²	121	69.8 Å²	69.8	65%	0.647	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-69.4	-15.6	178.9	63.8	-59.7	0	0	0	113.8	P1795	P1795-N1797 VanDerWaalsContact C-N 3.26Å; P1795-N1797 VanDerWaalsContact CB-OD1 3.3Å; P1795-N1797 WeakPolarHBondContact CB-OD1 3.43Å; P1795-N1797 PolarHBondContact O-N 2.75Å; P1795-N1797 VanDerWaalsContact O-N 3.16Å
1798	L	87.5	Confident	75.3	Confident	82 Å²	82	68.9 Å²	68.9	43%	0.429	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-104.1	-3.9	178.1	-58.3	-178.7	0	0	0	112.8	I1794 P1795 V1796 H1802	I1794-L1798 HydrophobicContact CG2-CB 4.49Å; P1795-L1798 HydrophobicContact CB-CD1 4.31Å; P1795-L1798 HydrophobicContact CB-CG 4.33Å; P1795-L1798 HydrophobicContact CG-CD1 4.1Å; P1795-L1798 WeakPolarHBondContact O-CA 3.41Å; P1795-L1798 PolarHBondContact O-N 3.32Å; V1796-L1798 PolarHBondContact O-N 2.7Å; L1798-H1802 VanDerWaalsContact O-CB 3.26Å; L1798-H1802 WeakPolarHBondContact O-CB 3.49Å; L1798-H1802 PolarHBondContact O-N 2.84Å
1799	L	87.5	Confident	77.7	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-62.1	-40.3	178.1	-168.9	71	0	0	0	113.5	I1794 P1795 V1796 D1801 H1802 V1803 V2051 L2081 L2082 I2085	I1794-L1799 HydrophobicContact CD1-CD1 4.16Å; I1794-L1799 HydrophobicContact CG2-CD1 4.23Å; P1795-L1799 PolarHBondContact O-N 2.85Å; V1796-L1799 PolarHBondContact O-N 3.4Å; L1799-D1801 PolarHBondContact O-N 2.82Å; L1799-H1802 PolarHBondContact O-N 2.94Å; L1799-V1803 HydrophobicContact CD1-CG2 4.25Å; L1799-V1803 HydrophobicContact CG-CG2 4.21Å; L1799-V1803 WeakPolarHBondContact O-CG2 3.39Å; L1799-V1803 PolarHBondContact O-N 3.44Å; L1799-V2051 HydrophobicContact CD1-CB 4.46Å; L1799-V2051 HydrophobicContact CD1-CG1 4.27Å; L1799-V2051 HydrophobicContact CD2-CG2 4.39Å; L1799-L2081 HydrophobicContact CD2-CB 4.32Å; L1799-L2082 HydrophobicContact CD2-CB 4.47Å; L1799-I2085 HydrophobicContact CB-CD1 4.41Å; L1799-I2085 HydrophobicContact CD2-CD1 3.47Å; L1799-I2085 VanDerWaalsContact CD2-CD1 3.47Å
1800	P	85.7	Confident	79.6	Confident	55 Å²	55	64.5 Å²	64.5	36%	0.357	37%	0.365	S	S	.	.	H	α-helix	trans	-58.3	-49.9	177.5	-22.7	33.2	0	0	0	112.1	H1802 V1803 A1804 L2082	P1800-H1802 VanDerWaalsContact C-N 3.29Å; P1800-H1802 PolarHBondContact O-N 3.02Å; P1800-V1803 PolarHBondContact O-N 3.01Å; P1800-A1804 WeakPolarHBondContact O-CB 3.49Å; P1800-A1804 PolarHBondContact O-N 3.4Å; P1800-L2082 HydrophobicContact CB-CD1 4.03Å; P1800-L2082 HydrophobicContact CG-CD1 3.78Å
1801	D	84	Confident	81.9	Confident	105 Å²	105	59.9 Å²	59.9	56%	0.561	34%	0.343	S	S	*	.	H	α-helix	trans	-64.9	-34.9	177.9	-57.8	-27.1	0	0	0	111.7	L1799 R1805	L1799-D1801 PolarHBondContact O-N 2.82Å; D1801-R1805 WeakPolarHBondContact O-CB 3.31Å; D1801-R1805 PolarHBondContact O-N 3Å
1802	H	87.8	Confident	82.7	Confident	26 Å²	26	61.5 Å²	61.5	12%	0.12	35%	0.353	C	S	.	.	H	α-helix	trans	-65.5	-46.1	175.9	-167.6	116.9	0	0	0	111.8	I1794 L1798 L1799 P1800 R1805 L1806	I1794-H1802 VanDerWaalsContact CD1-CE1 3.46Å; I1794-H1802 WeakPolarHBondContact CD1-CE1 3.36Å; I1794-H1802 HydrophobicContact CG2-CB 4.2Å; L1798-H1802 VanDerWaalsContact O-CB 3.26Å; L1798-H1802 WeakPolarHBondContact O-CB 3.49Å; L1798-H1802 PolarHBondContact O-N 2.84Å; L1799-H1802 PolarHBondContact O-N 2.94Å; P1800-H1802 VanDerWaalsContact C-N 3.29Å; P1800-H1802 PolarHBondContact O-N 3.02Å; H1802-R1805 PolarHBondContact ND1-NH1 2.82Å; H1802-R1805 PolarHBondContact O-N 3Å; H1802-L1806 WeakPolarHBondContact NE2-CD1 3.2Å; H1802-L1806 WeakPolarHBondContact O-CG 3.44Å; H1802-L1806 PolarHBondContact O-N 2.88Å
1803	V	88.3	Confident	83.2	Confident	15 Å²	15	58.4 Å²	58.4	9%	0.091	34%	0.341	C	S	.	.	H	α-helix	trans	-67.7	-38.4	177.2	173.3	0	0	0	0	111.1	L1799 P1800 R1805 L1806 S1807 F1814 H2078 L2082	L1799-V1803 HydrophobicContact CD1-CG2 4.25Å; L1799-V1803 HydrophobicContact CG-CG2 4.21Å; L1799-V1803 WeakPolarHBondContact O-CG2 3.39Å; L1799-V1803 PolarHBondContact O-N 3.44Å; P1800-V1803 PolarHBondContact O-N 3.01Å; V1803-R1805 VanDerWaalsContact C-N 3.31Å; V1803-R1805 PolarHBondContact O-N 2.83Å; V1803-L1806 PolarHBondContact O-N 3.04Å; V1803-S1807 WeakPolarHBondContact O-CB 3.22Å; V1803-S1807 PolarHBondContact O-N 2.66Å; V1803-S1807 PolarHBondContact O-OG 2.62Å; V1803-F1814 HydrophobicContact CG1-CZ 4.29Å; V1803-H2078 HydrophobicContact CG2-CB 3.99Å; V1803-L2082 HydrophobicContact CB-CD2 4.41Å; V1803-L2082 HydrophobicContact CG1-CD2 4.23Å
1804	A	84.2	Confident	83.4	Confident	61 Å²	61	56 Å²	56	50%	0.504	33%	0.325	S	S	.	.	H	α-helix	trans	-61.3	-38.6	173.4	0	0	0	0	0	112.1	P1800 S1807 A1808	P1800-A1804 WeakPolarHBondContact O-CB 3.49Å; P1800-A1804 PolarHBondContact O-N 3.4Å; A1804-S1807 PolarHBondContact O-OG 3.38Å; A1804-A1808 PolarHBondContact O-N 3.43Å
1805	R	84.7	Confident	83.2	Confident	123 Å²	123	56.4 Å²	56.4	46%	0.464	33%	0.329	S	S	.	.	H	α-helix	trans	-68.2	-44.6	174.2	-160.5	-156	-39.5	100.2	4.7	112.2	D1801 H1802 V1803 A1808 L1813	D1801-R1805 WeakPolarHBondContact O-CB 3.31Å; D1801-R1805 PolarHBondContact O-N 3Å; H1802-R1805 PolarHBondContact ND1-NH1 2.82Å; H1802-R1805 PolarHBondContact O-N 3Å; V1803-R1805 VanDerWaalsContact C-N 3.31Å; V1803-R1805 PolarHBondContact O-N 2.83Å; R1805-A1808 WeakPolarHBondContact O-CB 3.31Å; R1805-A1808 PolarHBondContact O-N 3.2Å; R1805-L1813 HydrophobicContact CG-CD1 4.43Å
1806	L	86.8	Confident	83.1	Confident	9 Å²	9	58.9 Å²	58.9	5%	0.047	34%	0.336	C	S	.	.	H	α-helix	trans	-70.8	-32.1	-177.2	-69.9	-171.6	0	0	0	113.5	H1802 V1803 A1808 L1813 F1814	H1802-L1806 WeakPolarHBondContact NE2-CD1 3.2Å; H1802-L1806 WeakPolarHBondContact O-CG 3.44Å; H1802-L1806 PolarHBondContact O-N 2.88Å; V1803-L1806 PolarHBondContact O-N 3.04Å; L1806-A1808 VanDerWaalsContact C-N 3.34Å; L1806-L1813 HydrophobicContact CD2-CB 3.7Å; L1806-F1814 VanDerWaalsContact C-CD2 3.44Å; L1806-F1814 HydrophobicContact CB-CD1 3.78Å; L1806-F1814 HydrophobicContact CB-CD2 3.63Å; L1806-F1814 HydrophobicContact CB-CE1 3.72Å; L1806-F1814 HydrophobicContact CB-CE2 3.57Å; L1806-F1814 HydrophobicContact CB-CG 3.73Å; L1806-F1814 HydrophobicContact CB-CZ 3.62Å; L1806-F1814 HydrophobicContact CD1-CD1 3.59Å; L1806-F1814 HydrophobicContact CD1-CE1 3.38Å; L1806-F1814 HydrophobicContact CD1-CG 4.35Å; L1806-F1814 HydrophobicContact CD1-CZ 4.02Å; L1806-F1814 HydrophobicContact CG-CD1 4.31Å; L1806-F1814 HydrophobicContact CG-CE1 4.21Å; L1806-F1814 HydrophobicContact CG-CZ 4.47Å; L1806-F1814 WeakPolarHBondContact O-CD2 3.4Å; L1806-F1814 PolarHBondContact O-N 3.28Å
1807	S	82.6	Confident	83.2	Confident	50 Å²	50	58.2 Å²	58.2	35%	0.35	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-8.3	176.6	52.7	0	0	0	0	114.5	V1803 A1804 N1811	V1803-S1807 WeakPolarHBondContact O-CB 3.22Å; V1803-S1807 PolarHBondContact O-N 2.66Å; V1803-S1807 PolarHBondContact O-OG 2.62Å; A1804-S1807 PolarHBondContact O-OG 3.38Å; S1807-N1811 PolarHBondContact O-N 3.08Å
1808	A	69.8	Low	83.5	Confident	50 Å²	50	54.1 Å²	54.1	41%	0.413	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	153.3	174.7	0	0	0	0	0	112	A1804 R1805 L1806 D1810 N1811	A1804-A1808 PolarHBondContact O-N 3.43Å; R1805-A1808 WeakPolarHBondContact O-CB 3.31Å; R1805-A1808 PolarHBondContact O-N 3.2Å; L1806-A1808 VanDerWaalsContact C-N 3.34Å; A1808-D1810 PolarHBondContact O-N 3.42Å; A1808-N1811 PolarHBondContact O-N 3.32Å
1809	A	74.5	Confident	83.5	Confident	73 Å²	73	57.6 Å²	57.6	60%	0.603	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	50.1	-178.2	0	0	0	0	0	113.8	N1811 L1812	A1809-N1811 PolarHBondContact O-N 2.95Å; A1809-L1812 HydrophobicContact CB-CB 4.21Å; A1809-L1812 HydrophobicContact CB-CD2 4.4Å; A1809-L1812 WeakPolarHBondContact O-CB 3.44Å; A1809-L1812 PolarHBondContact O-N 2.59Å
1810	D	72	Confident	83.5	Confident	104 Å²	104	59.6 Å²	59.6	56%	0.556	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	44.4	179	-152.2	20.6	0	0	0	113.3	A616 A1808 L1812	A616-D1810 HydrophobicContact CB-CB 3.68Å; A1808-D1810 PolarHBondContact O-N 3.42Å; D1810-L1812 VanDerWaalsContact C-N 3.31Å; D1810-L1812 PolarHBondContact O-N 2.88Å
1811	N	83.4	Confident	83.6	Confident	45 Å²	45	57.2 Å²	57.2	24%	0.241	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	13.7	-179.8	-48.4	-76.8	0	0	0	116.2	S1807 A1808 A1809 L1813 F1814 S1815 I2075	S1807-N1811 PolarHBondContact O-N 3.08Å; A1808-N1811 PolarHBondContact O-N 3.32Å; A1809-N1811 PolarHBondContact O-N 2.95Å; N1811-L1813 PolarHBondContact O-N 2.94Å; N1811-F1814 HydrophobicContact CB-CB 4.18Å; N1811-F1814 HydrophobicContact CB-CD2 4.23Å; N1811-F1814 WeakPolarHBondContact O-CA 3.12Å; N1811-F1814 WeakPolarHBondContact O-CB 3.47Å; N1811-F1814 PolarHBondContact O-N 3.2Å; N1811-S1815 PolarHBondContact O-N 3.29Å; N1811-S1815 PolarHBondContact O-OG 3.24Å; N1811-S1815 VanDerWaalsContact O-OG 3.12Å; N1811-I2075 HydrophobicContact CB-CD1 3.97Å
1812	L	75.7	Confident	83	Confident	87 Å²	87	59 Å²	59	46%	0.455	32%	0.324	S	S	.	.	H	α-helix	trans	-45.7	-38.2	-178.2	176.2	63.2	0	0	0	115.1	A1809 D1810 Q1816	A1809-L1812 HydrophobicContact CB-CB 4.21Å; A1809-L1812 HydrophobicContact CB-CD2 4.4Å; A1809-L1812 WeakPolarHBondContact O-CB 3.44Å; A1809-L1812 PolarHBondContact O-N 2.59Å; D1810-L1812 VanDerWaalsContact C-N 3.31Å; D1810-L1812 PolarHBondContact O-N 2.88Å; L1812-Q1816 WeakPolarHBondContact O-CG 3.23Å; L1812-Q1816 PolarHBondContact O-N 3.04Å
1813	L	77.7	Confident	81.8	Confident	65 Å²	65	60.4 Å²	60.4	34%	0.34	33%	0.334	S	S	.	.	H	α-helix	trans	-82.2	-27.2	179.3	-67.2	-178.4	0	0	0	113.2	R1805 L1806 N1811 E1817	R1805-L1813 HydrophobicContact CG-CD1 4.43Å; L1806-L1813 HydrophobicContact CD2-CB 3.7Å; N1811-L1813 PolarHBondContact O-N 2.94Å; L1813-E1817 WeakPolarHBondContact O-CB 3.43Å; L1813-E1817 PolarHBondContact O-N 3.13Å
1814	F	91.3	Very high	80.6	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-64.1	-42.5	165.6	-86.1	-58.6	0	0	0	111.2	V1803 L1806 N1811 E1817 Y1818 Y2074 I2075 H2078	V1803-F1814 HydrophobicContact CG1-CZ 4.29Å; L1806-F1814 VanDerWaalsContact C-CD2 3.44Å; L1806-F1814 HydrophobicContact CB-CD1 3.78Å; L1806-F1814 HydrophobicContact CB-CD2 3.63Å; L1806-F1814 HydrophobicContact CB-CE1 3.72Å; L1806-F1814 HydrophobicContact CB-CE2 3.57Å; L1806-F1814 HydrophobicContact CB-CG 3.73Å; L1806-F1814 HydrophobicContact CB-CZ 3.62Å; L1806-F1814 HydrophobicContact CD1-CD1 3.59Å; L1806-F1814 HydrophobicContact CD1-CE1 3.38Å; L1806-F1814 HydrophobicContact CD1-CG 4.35Å; L1806-F1814 HydrophobicContact CD1-CZ 4.02Å; L1806-F1814 HydrophobicContact CG-CD1 4.31Å; L1806-F1814 HydrophobicContact CG-CE1 4.21Å; L1806-F1814 HydrophobicContact CG-CZ 4.47Å; L1806-F1814 WeakPolarHBondContact O-CD2 3.4Å; L1806-F1814 PolarHBondContact O-N 3.28Å; N1811-F1814 HydrophobicContact CB-CB 4.18Å; N1811-F1814 HydrophobicContact CB-CD2 4.23Å; N1811-F1814 WeakPolarHBondContact O-CA 3.12Å; N1811-F1814 WeakPolarHBondContact O-CB 3.47Å; N1811-F1814 PolarHBondContact O-N 3.2Å; F1814-E1817 PolarHBondContact O-N 3.42Å; F1814-Y1818 VanDerWaalsContact O-CB 3.25Å; F1814-Y1818 WeakPolarHBondContact O-CB 3.39Å; F1814-Y1818 PolarHBondContact O-N 3.18Å; F1814-Y2074 HydrophobicContact CD1-CD1 4.04Å; F1814-Y2074 HydrophobicContact CD1-CE1 4.2Å; F1814-I2075 HydrophobicContact CB-CD1 4.08Å; F1814-I2075 HydrophobicContact CB-CG1 3.92Å; F1814-I2075 HydrophobicContact CD1-CG1 4Å; F1814-I2075 HydrophobicContact CD2-CD1 4.1Å; F1814-I2075 HydrophobicContact CD2-CG1 3.74Å; F1814-I2075 HydrophobicContact CD2-CG2 4.49Å; F1814-I2075 HydrophobicContact CE1-CG1 4.44Å; F1814-I2075 HydrophobicContact CE2-CG1 4.19Å; F1814-I2075 HydrophobicContact CE2-CG2 4.23Å; F1814-I2075 HydrophobicContact CG-CD1 4.18Å; F1814-I2075 HydrophobicContact CG-CG1 3.64Å; F1814-H2078 HydrophobicContact CE1-CB 4.17Å; F1814-H2078 AromaticContact CE1-CD2 3.85Å; F1814-H2078 AromaticContact CE1-CE1 3.77Å; F1814-H2078 AromaticContact CE1-CG 3.6Å; F1814-H2078 AromaticContact CE1-ND1 3.55Å; F1814-H2078 AromaticContact CE1-NE2 3.97Å; F1814-H2078 HydrophobicContact CZ-CB 4.05Å; F1814-H2078 AromaticContact CZ-CG 3.94Å
1815	S	86	Confident	79.8	Confident	26 Å²	26	68.3 Å²	68.3	18%	0.182	36%	0.36	C	S	.	.	H	α-helix	trans	-60.8	-48.7	177.8	-32.8	0	0	0	0	110.6	N1811 E1817 Y1818 E1819 E2071	N1811-S1815 PolarHBondContact O-N 3.29Å; N1811-S1815 PolarHBondContact O-OG 3.24Å; N1811-S1815 VanDerWaalsContact O-OG 3.12Å; S1815-E1817 PolarHBondContact O-N 2.8Å; S1815-Y1818 PolarHBondContact O-N 3.38Å; S1815-E1819 WeakPolarHBondContact O-CB 3.46Å; S1815-E1819 WeakPolarHBondContact O-CG 3.34Å; S1815-E1819 PolarHBondContact O-N 3.47Å; S1815-E2071 VanDerWaalsContact CA-OE1 3.27Å; S1815-E2071 WeakPolarHBondContact CA-OE1 3.24Å; S1815-E2071 WeakPolarHBondContact CB-OE1 3.43Å; S1815-E2071 PolarHBondContact N-OE1 2.94Å; S1815-E2071 VanDerWaalsContact N-OE1 3.13Å; S1815-E2071 PolarHBondContact OG-OE1 3.05Å; S1815-E2071 PolarHBondContact OG-OE2 3.06Å
1816	Q	82.8	Confident	79.4	Confident	104 Å²	104	71.8 Å²	71.8	49%	0.486	38%	0.381	S	S	.	.	H	α-helix	trans	-62.5	-40.3	177.3	-71.6	174.9	25.1	0	0	113.3	L1812 S1820	L1812-Q1816 WeakPolarHBondContact O-CG 3.23Å; L1812-Q1816 PolarHBondContact O-N 3.04Å; Q1816-S1820 WeakPolarHBondContact O-CB 3.44Å; Q1816-S1820 PolarHBondContact O-N 3.47Å; Q1816-S1820 PolarHBondContact O-OG 3.41Å
1817	E	88.9	Confident	79.4	Confident	22 Å²	22	73 Å²	73	10%	0.103	39%	0.387	C	S	.	.	H	α-helix	trans	-67.6	-41.7	175.8	-175.3	169.4	90.2	0	0	111.3	H1791 L1813 F1814 S1815 S1820 I1821 Y2054 Y2074	H1791-E1817 IonicContact CE1-OE2 3.83Å; H1791-E1817 PolarHBondContact CE1-OE2 3.18Å; H1791-E1817 IonicContact ND1-OE2 3.04Å; H1791-E1817 PolarHBondContact ND1-OE2 3.36Å; L1813-E1817 WeakPolarHBondContact O-CB 3.43Å; L1813-E1817 PolarHBondContact O-N 3.13Å; F1814-E1817 PolarHBondContact O-N 3.42Å; S1815-E1817 PolarHBondContact O-N 2.8Å; E1817-S1820 PolarHBondContact O-N 2.75Å; E1817-S1820 PolarHBondContact O-OG 3.48Å; E1817-I1821 WeakPolarHBondContact O-CG1 3.38Å; E1817-Y2054 HydrophobicContact CG-CD2 3.64Å; E1817-Y2054 HydrophobicContact CG-CE2 4.28Å; E1817-Y2054 HydrophobicContact CG-CG 4.49Å; E1817-Y2074 HydrophobicContact CG-CE1 4.2Å; E1817-Y2074 WeakPolarHBondContact OE1-CE1 3.18Å; E1817-Y2074 PolarHBondContact OE1-OH 2.97Å
1818	Y	92.5	Very high	79.5	Confident	35 Å²	35	74 Å²	74	14%	0.137	39%	0.39	C	S	.	.	H	α-helix	trans	-67.4	-39.8	179.7	-179.3	-103.3	0	0	0	113.3	F1814 S1815 S1820 I1821 R2061 V2068 Q2069 T2070 E2071 Y2074	F1814-Y1818 VanDerWaalsContact O-CB 3.25Å; F1814-Y1818 WeakPolarHBondContact O-CB 3.39Å; F1814-Y1818 PolarHBondContact O-N 3.18Å; S1815-Y1818 PolarHBondContact O-N 3.38Å; Y1818-S1820 VanDerWaalsContact C-N 3.3Å; Y1818-S1820 PolarHBondContact O-N 2.62Å; Y1818-I1821 HydrophobicContact CD2-CD1 4.17Å; Y1818-I1821 WeakPolarHBondContact O-CG1 3.45Å; Y1818-I1821 PolarHBondContact O-N 2.88Å; Y1818-R2061 VanDerWaalsContact CE2-NH2 3.29Å; Y1818-R2061 VanDerWaalsContact CZ-NH2 3.34Å; Y1818-R2061 PolarHBondContact OH-NH2 3.14Å; Y1818-V2068 HydrophobicContact CE2-CG1 4.33Å; Y1818-V2068 PolarHBondContact OH-O 2.96Å; Y1818-V2068 VanDerWaalsContact OH-O 3.08Å; Y1818-Q2069 PolarHBondContact OH-O 2.97Å; Y1818-T2070 PolarHBondContact OH-N 3.2Å; Y1818-E2071 HydrophobicContact CD1-CB 4.05Å; Y1818-E2071 HydrophobicContact CE1-CB 4.47Å; Y1818-E2071 HydrophobicContact CG-CB 4.36Å; Y1818-Y2074 HydrophobicContact CD2-CD1 4.4Å; Y1818-Y2074 AromaticContact CD2-CD2 3.98Å; Y1818-Y2074 HydrophobicContact CD2-CD2 3.98Å; Y1818-Y2074 AromaticContact CD2-CG 3.78Å; Y1818-Y2074 HydrophobicContact CD2-CG 3.78Å
1819	E	87.3	Confident	80.5	Confident	155 Å²	155	73.7 Å²	73.7	72%	0.724	38%	0.378	S	S	*	.	H	α-helix	trans	-65.8	-31.2	174.9	-75.2	-177	168.7	0	0	112.4	S1815 I1821	S1815-E1819 WeakPolarHBondContact O-CB 3.46Å; S1815-E1819 WeakPolarHBondContact O-CG 3.34Å; S1815-E1819 PolarHBondContact O-N 3.47Å; E1819-I1821 VanDerWaalsContact C-N 3.26Å; E1819-I1821 PolarHBondContact O-N 3.13Å
1820	S	87.2	Confident	81.2	Confident	42 Å²	42	75.5 Å²	75.5	29%	0.294	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	1	-178.6	75.2	0	0	0	0	115.3	Q1816 E1817 Y1818 E1822 Y2054	Q1816-S1820 WeakPolarHBondContact O-CB 3.44Å; Q1816-S1820 PolarHBondContact O-N 3.47Å; Q1816-S1820 PolarHBondContact O-OG 3.41Å; E1817-S1820 PolarHBondContact O-N 2.75Å; E1817-S1820 PolarHBondContact O-OG 3.48Å; Y1818-S1820 VanDerWaalsContact C-N 3.3Å; Y1818-S1820 PolarHBondContact O-N 2.62Å; S1820-E1822 PolarHBondContact O-N 3.08Å; S1820-Y2054 PolarHBondContact O-OH 3.18Å; S1820-Y2054 VanDerWaalsContact O-OH 3.13Å; S1820-Y2054 WeakPolarHBondContact OG-CE2 3.46Å
1821	I	87.3	Confident	82.2	Confident	5 Å²	5	72.3 Å²	72.3	3%	0.026	36%	0.357	C	S	.	.			trans	-81.3	65.8	179.9	-44.5	176.7	0	0	0	110.9	E1817 Y1818 E1819 Y2054 V2057 K2058 R2061 Y2074	E1817-I1821 WeakPolarHBondContact O-CG1 3.38Å; Y1818-I1821 HydrophobicContact CD2-CD1 4.17Å; Y1818-I1821 WeakPolarHBondContact O-CG1 3.45Å; Y1818-I1821 PolarHBondContact O-N 2.88Å; E1819-I1821 VanDerWaalsContact C-N 3.26Å; E1819-I1821 PolarHBondContact O-N 3.13Å; I1821-Y2054 HydrophobicContact CB-CE2 4.45Å; I1821-Y2054 HydrophobicContact CD1-CD2 4.34Å; I1821-Y2054 HydrophobicContact CG1-CD2 3.81Å; I1821-Y2054 HydrophobicContact CG1-CE2 3.66Å; I1821-V2057 HydrophobicContact CD1-CB 4.23Å; I1821-V2057 HydrophobicContact CD1-CG1 3.87Å; I1821-V2057 HydrophobicContact CG2-CG1 4.16Å; I1821-K2058 HydrophobicContact CG2-CB 3.92Å; I1821-K2058 HydrophobicContact CG2-CG 4.38Å; I1821-R2061 PolarHBondContact O-NH1 3.16Å; I1821-R2061 VanDerWaalsContact O-NH1 3.11Å; I1821-Y2074 HydrophobicContact CD1-CD2 4.16Å; I1821-Y2074 HydrophobicContact CD1-CE2 3.65Å
1822	E	73	Confident	82.6	Confident	141 Å²	141	70.1 Å²	70.1	66%	0.659	35%	0.346	S	S	*	.			trans	-80.9	144.4	173.7	-66.8	-173.2	171.5	0	0	112.5	S1820 K2058	S1820-E1822 PolarHBondContact O-N 3.08Å; E1822-K2058 WeakPolarHBondContact O-CE 3.31Å
1823	T	62.4	Low	83.3	Confident	56 Å²	56	66.2 Å²	66.2	34%	0.344	33%	0.325	S	S	.	.			trans	-90.1	97.7	167.4	49.9	0	0	0	0	110	Q1825 F1827 R2061	T1823-Q1825 PolarHBondContact O-N 3.27Å; T1823-F1827 HydrophobicContact CG2-CE2 4.29Å; T1823-R2061 HydrophobicContact CG2-CB 3.82Å; T1823-R2061 VanDerWaalsContact CG2-O 3.31Å; T1823-R2061 WeakPolarHBondContact CG2-O 3.23Å
1824	E	62.6	Low	83.8	Confident	145 Å²	145	65.4 Å²	65.4	68%	0.678	32%	0.321	S	S	*	.			trans	-59.4	-13.3	177.2	-68.1	157.3	-152.4	0	0	114.5	K2058	E1824-K2058 WeakPolarHBondContact OE1-CE 3.34Å; E1824-K2058 IonicContact OE1-NZ 2.82Å; E1824-K2058 PolarHBondContact OE1-NZ 2.94Å
1825	Q	67.1	Low	83.5	Confident	98 Å²	98	66.4 Å²	66.4	46%	0.458	33%	0.327	S	S	.	.	S	Bend	trans	-108.1	134.6	-179.7	-67.6	172.4	-74.9	0	0	109.6	T1823 F1827 K2062	T1823-Q1825 PolarHBondContact O-N 3.27Å; Q1825-F1827 HydrophobicContact CB-CE1 4.04Å; Q1825-F1827 HydrophobicContact CB-CE2 4.31Å; Q1825-F1827 HydrophobicContact CB-CZ 3.7Å; Q1825-F1827 VanDerWaalsContact O-CE2 3.27Å; Q1825-F1827 WeakPolarHBondContact O-CE2 3.39Å; Q1825-K2062 VanDerWaalsContact OE1-CE 3.3Å
1826	Q	75.9	Confident	83.6	Confident	196 Å²	196	68.9 Å²	68.9	92%	0.916	34%	0.336	S	S	*	.			trans	-77.1	142.3	165.7	-65.6	-178.2	-3.5	0	0	109.2
1827	F	86.7	Confident	84.1	Confident	35 Å²	35	63.9 Å²	63.9	15%	0.154	31%	0.313	C	S	.	.			trans	-119.5	163.4	175.2	-56.9	-69.1	0	0	0	109.4	T1823 Q1825 W1829 Y1849 H1851 K2062	T1823-F1827 HydrophobicContact CG2-CE2 4.29Å; Q1825-F1827 HydrophobicContact CB-CE1 4.04Å; Q1825-F1827 HydrophobicContact CB-CE2 4.31Å; Q1825-F1827 HydrophobicContact CB-CZ 3.7Å; Q1825-F1827 VanDerWaalsContact O-CE2 3.27Å; Q1825-F1827 WeakPolarHBondContact O-CE2 3.39Å; F1827-W1829 HydrophobicContact CB-CE3 4.21Å; F1827-W1829 HydrophobicContact CB-CZ3 4.16Å; F1827-W1829 VanDerWaalsContact O-CE3 3.28Å; F1827-W1829 WeakPolarHBondContact O-CZ3 3.28Å; F1827-Y1849 HydrophobicContact CB-CD1 3.63Å; F1827-Y1849 HydrophobicContact CB-CD2 4.35Å; F1827-Y1849 HydrophobicContact CB-CE1 3.84Å; F1827-Y1849 HydrophobicContact CB-CG 3.9Å; F1827-Y1849 HydrophobicContact CD2-CD1 4.44Å; F1827-Y1849 HydrophobicContact CD2-CD2 4.17Å; F1827-Y1849 HydrophobicContact CD2-CE1 4Å; F1827-Y1849 AromaticContact CD2-CE2 3.71Å; F1827-Y1849 HydrophobicContact CD2-CE2 3.71Å; F1827-Y1849 AromaticContact CD2-CZ 3.61Å; F1827-Y1849 HydrophobicContact CE2-CE2 4.21Å; F1827-Y1849 HydrophobicContact CG-CD1 4.27Å; F1827-Y1849 HydrophobicContact CG-CD2 4.18Å; F1827-Y1849 HydrophobicContact CG-CE1 4.26Å; F1827-Y1849 HydrophobicContact CG-CE2 4.18Å; F1827-Y1849 HydrophobicContact CG-CG 4.23Å; F1827-H1851 AromaticContact CD1-CE1 3.32Å; F1827-H1851 WeakPolarHBondContact CD1-CE1 3.42Å; F1827-H1851 AromaticContact CD1-ND1 3.59Å; F1827-H1851 AromaticContact CE1-CE1 3.74Å; F1827-H1851 AromaticContact CG-CE1 3.94Å; F1827-K2062 HydrophobicContact CE1-CB 4.32Å; F1827-K2062 HydrophobicContact CE2-CB 4.21Å; F1827-K2062 HydrophobicContact CE2-CG 4.41Å; F1827-K2062 HydrophobicContact CZ-CB 3.58Å; F1827-K2062 HydrophobicContact CZ-CG 3.83Å
1828	T	85.5	Confident	84.1	Confident	70 Å²	70	62.9 Å²	62.9	43%	0.429	31%	0.308	S	S	.	.			trans	-102.3	157.6	166.3	63.6	0	0	0	0	109.2	Y1849 D1850	T1828-Y1849 CarbonylContact O-C 3.4Å; T1828-Y1849 VanDerWaalsContact O-CA 3.25Å; T1828-Y1849 WeakPolarHBondContact O-CA 3.3Å; T1828-D1850 WeakPolarHBondContact CB-OD2 3.42Å; T1828-D1850 PolarHBondContact O-N 2.96Å; T1828-D1850 PolarHBondContact OG1-OD2 2.94Å
1829	W	90.5	Very high	84.1	Confident	43 Å²	43	62 Å²	62	16%	0.163	31%	0.306	C	S	.	.			trans	-147.5	30.2	173.3	46.4	89.8	0	0	0	111.3	H159 V192 V198 F1827 N1831 S1832 N1833 I1847 A1848 Y1849 D1850	H159-W1829 AromaticContact CE1-CD1 3.9Å; H159-W1829 AromaticContact CE1-NE1 3.44Å; H159-W1829 PolarHBondContact CE1-NE1 3.39Å; H159-W1829 AromaticContact CG-CD1 3.75Å; H159-W1829 AromaticContact CG-NE1 3.61Å; H159-W1829 AromaticContact ND1-CD1 2.97Å; H159-W1829 AromaticContact ND1-CE2 3.96Å; H159-W1829 AromaticContact ND1-NE1 2.84Å; H159-W1829 PolarHBondContact ND1-NE1 2.97Å; V192-W1829 HydrophobicContact CB-CZ2 4.42Å; V192-W1829 HydrophobicContact CG1-CZ2 4.04Å; V192-W1829 HydrophobicContact CG2-CZ2 3.9Å; V198-W1829 HydrophobicContact CG2-CZ2 3.64Å; V198-W1829 VanDerWaalsContact CG2-NE1 3.27Å; F1827-W1829 HydrophobicContact CB-CE3 4.21Å; F1827-W1829 HydrophobicContact CB-CZ3 4.16Å; F1827-W1829 VanDerWaalsContact O-CE3 3.28Å; F1827-W1829 WeakPolarHBondContact O-CZ3 3.28Å; W1829-N1831 PolarHBondContact O-N 3.47Å; W1829-S1832 WeakPolarHBondContact O-CA 3.38Å; W1829-S1832 WeakPolarHBondContact O-CB 3.13Å; W1829-S1832 PolarHBondContact O-N 2.9Å; W1829-S1832 PolarHBondContact O-OG 3.12Å; W1829-N1833 PolarHBondContact O-N 3.41Å; W1829-N1833 PolarHBondContact O-OD1 3.02Å; W1829-I1847 HydrophobicContact CB-CB 3.85Å; W1829-I1847 HydrophobicContact CB-CD1 4.34Å; W1829-I1847 HydrophobicContact CB-CG1 4.13Å; W1829-I1847 HydrophobicContact CB-CG2 3.82Å; W1829-I1847 VanDerWaalsContact CD1-CG2 3.44Å; W1829-I1847 HydrophobicContact CD2-CD1 3.97Å; W1829-I1847 HydrophobicContact CD2-CG1 3.97Å; W1829-I1847 HydrophobicContact CE3-CD1 4.18Å; W1829-I1847 HydrophobicContact CG-CB 3.92Å; W1829-I1847 HydrophobicContact CG-CD1 4.06Å; W1829-I1847 HydrophobicContact CG-CG1 3.71Å; W1829-I1847 HydrophobicContact CG-CG2 3.77Å; W1829-A1848 WeakPolarHBondContact CB-O 3.38Å; W1829-Y1849 HydrophobicContact CB-CD1 4.42Å; W1829-Y1849 HydrophobicContact CD2-CD1 4.29Å; W1829-Y1849 HydrophobicContact CD2-CE1 4.47Å; W1829-Y1849 AromaticContact CE3-CD1 3.52Å; W1829-Y1849 HydrophobicContact CE3-CD1 3.52Å; W1829-Y1849 AromaticContact CE3-CE1 3.6Å; W1829-Y1849 HydrophobicContact CE3-CE1 3.6Å; W1829-Y1849 HydrophobicContact CZ3-CD1 4.17Å; W1829-Y1849 AromaticContact CZ3-CE1 3.81Å; W1829-Y1849 HydrophobicContact CZ3-CE1 3.81Å; W1829-D1850 VanDerWaalsContact C-OD1 3.31Å; W1829-D1850 WeakPolarHBondContact CA-OD2 3.35Å; W1829-D1850 PolarHBondContact N-OD2 3.27Å
1830	E	89.7	Confident	84.4	Confident	112 Å²	112	55.6 Å²	55.6	52%	0.523	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-52.9	-36.6	-174.6	-66.6	168	-160.7	0	0	113.1	S1832 N1833 L1834 D1850	E1830-S1832 PolarHBondContact O-N 3.35Å; E1830-N1833 VanDerWaalsContact CA-OD1 3.3Å; E1830-N1833 WeakPolarHBondContact CA-OD1 2.98Å; E1830-N1833 WeakPolarHBondContact O-CA 3.22Å; E1830-N1833 WeakPolarHBondContact O-CB 3.2Å; E1830-N1833 PolarHBondContact O-N 2.85Å; E1830-L1834 PolarHBondContact O-N 3.07Å; E1830-D1850 PolarHBondContact N-OD1 2.84Å; E1830-D1850 PolarHBondContact N-OD2 3.36Å
1831	N	93.2	Very high	84.7	Confident	36 Å²	36	53.6 Å²	53.6	19%	0.193	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-68.9	-27.6	177.9	-66.3	-88.9	0	0	0	111.7	W1829 N1833 N1837 D1850 R1853 Y1867	W1829-N1831 PolarHBondContact O-N 3.47Å; N1831-N1833 PolarHBondContact O-N 2.82Å; N1831-N1837 WeakPolarHBondContact O-CB 3.25Å; N1831-N1837 PolarHBondContact O-ND2 3.32Å; N1831-D1850 VanDerWaalsContact CB-OD1 3.3Å; N1831-D1850 WeakPolarHBondContact CB-OD1 3.17Å; N1831-D1850 PolarHBondContact N-OD1 3.43Å; N1831-D1850 VanDerWaalsContact ND2-CG 3.34Å; N1831-D1850 PolarHBondContact ND2-OD1 3.24Å; N1831-R1853 VanDerWaalsContact CG-CZ 3.46Å; N1831-R1853 VanDerWaalsContact CG-NE 3.27Å; N1831-R1853 PolarHBondContact ND2-NE 2.94Å; N1831-R1853 PolarHBondContact OD1-NH2 3.28Å; N1831-Y1867 HydrophobicContact CB-CD2 3.99Å; N1831-Y1867 HydrophobicContact CB-CE2 4.42Å; N1831-Y1867 WeakPolarHBondContact O-CD2 3.41Å
1832	S	92.4	Very high	85	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-71.4	-16	168.8	-51.6	0	0	0	0	112.6	S157 W1829 E1830 N1841 A1848 Y1867	S157-S1832 WeakPolarHBondContact O-CB 3.4Å; W1829-S1832 WeakPolarHBondContact O-CA 3.38Å; W1829-S1832 WeakPolarHBondContact O-CB 3.13Å; W1829-S1832 PolarHBondContact O-N 2.9Å; W1829-S1832 PolarHBondContact O-OG 3.12Å; E1830-S1832 PolarHBondContact O-N 3.35Å; S1832-N1841 PolarHBondContact O-ND2 3.2Å; S1832-A1848 PolarHBondContact OG-N 2.96Å; S1832-A1848 PolarHBondContact OG-O 3.22Å; S1832-Y1867 VanDerWaalsContact CA-CE2 3.49Å; S1832-Y1867 WeakPolarHBondContact CA-OH 3.35Å; S1832-Y1867 VanDerWaalsContact CB-OH 3.28Å; S1832-Y1867 WeakPolarHBondContact CB-OH 3.37Å; S1832-Y1867 WeakPolarHBondContact OG-CE2 3.46Å; S1832-Y1867 PolarHBondContact OG-OH 3Å
1833	N	90.2	Very high	85.8	Confident	5 Å²	5	47.7 Å²	47.7	3%	0.027	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-31.5	178	-47.1	21.7	0	0	0	114.8	H159 Q161 W1829 E1830 N1831 D1835 K1838	H159-N1833 HydrophobicContact CB-CB 4.17Å; H159-N1833 VanDerWaalsContact CB-OD1 3.23Å; H159-N1833 WeakPolarHBondContact CB-OD1 3.49Å; H159-N1833 PolarHBondContact CE1-ND2 2.6Å; H159-N1833 VanDerWaalsContact CG-ND2 3.29Å; H159-N1833 PolarHBondContact ND1-ND2 3.16Å; H159-N1833 PolarHBondContact ND1-OD1 2.87Å; H159-N1833 PolarHBondContact NE2-ND2 3.38Å; H159-N1833 WeakPolarHBondContact O-CA 3.45Å; H159-N1833 VanDerWaalsContact O-CB 3.22Å; H159-N1833 WeakPolarHBondContact O-CB 3.45Å; Q161-N1833 HydrophobicContact CG-CB 3.3Å; W1829-N1833 PolarHBondContact O-N 3.41Å; W1829-N1833 PolarHBondContact O-OD1 3.02Å; E1830-N1833 VanDerWaalsContact CA-OD1 3.3Å; E1830-N1833 WeakPolarHBondContact CA-OD1 2.98Å; E1830-N1833 WeakPolarHBondContact O-CA 3.22Å; E1830-N1833 WeakPolarHBondContact O-CB 3.2Å; E1830-N1833 PolarHBondContact O-N 2.85Å; N1831-N1833 PolarHBondContact O-N 2.82Å; N1833-D1835 PolarHBondContact O-N 3.35Å; N1833-K1838 WeakPolarHBondContact O-CE 3.15Å; N1833-K1838 WeakPolarHBondContact O-CG 3.43Å
1834	L	87.5	Confident	87	Confident	47 Å²	47	45 Å²	45	25%	0.246	22%	0.218	C	C	.	.	S	Bend	trans	-52.2	137.9	-168.8	-59.8	179.7	0	0	0	108.8	E1830 M1836 N1837 K1838	E1830-L1834 PolarHBondContact O-N 3.07Å; L1834-M1836 HydrophobicContact CB-CG 3.87Å; L1834-M1836 HydrophobicContact CB-SD 4.42Å; L1834-M1836 PolarHBondContact O-N 2.84Å; L1834-N1837 HydrophobicContact CB-CB 4.16Å; L1834-N1837 CarbonylContact O-C 3.49Å; L1834-N1837 WeakPolarHBondContact O-CA 3.22Å; L1834-N1837 WeakPolarHBondContact O-CB 3.49Å; L1834-N1837 PolarHBondContact O-N 3.33Å; L1834-K1838 WeakPolarHBondContact O-CG 3.39Å; L1834-K1838 PolarHBondContact O-N 2.83Å
1835	D	84.8	Confident	88.2	Confident	22 Å²	22	38.1 Å²	38.1	12%	0.118	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	15.9	-169.7	-57.8	-63.8	0	0	0	115.3	S148 A149 T150 N1833 K1838	S148-D1835 VanDerWaalsContact CA-CG 3.43Å; S148-D1835 WeakPolarHBondContact CA-OD1 3.33Å; S148-D1835 WeakPolarHBondContact CB-OD2 3.48Å; S148-D1835 PolarHBondContact N-OD1 3.08Å; S148-D1835 PolarHBondContact N-OD2 2.95Å; S148-D1835 VanDerWaalsContact N-OD2 3.12Å; S148-D1835 PolarHBondContact OG-OD2 3.05Å; A149-D1835 VanDerWaalsContact O-O 3.06Å; T150-D1835 HydrophobicContact CG2-CB 4.21Å; T150-D1835 WeakPolarHBondContact CG2-O 3.38Å; N1833-D1835 PolarHBondContact O-N 3.35Å; D1835-K1838 WeakPolarHBondContact OD1-CD 3.23Å; D1835-K1838 WeakPolarHBondContact OD1-CE 3.11Å; D1835-K1838 IonicContact OD1-NZ 2.62Å; D1835-K1838 PolarHBondContact OD1-NZ 3.49Å
1836	M	87.8	Confident	89.3	Confident	77 Å²	77	33.5 Å²	33.5	38%	0.379	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-12.7	173.7	54.9	-159.9	69.3	0	0	111.5	L1834 P1839 P1863 G1864	L1834-M1836 HydrophobicContact CB-CG 3.87Å; L1834-M1836 HydrophobicContact CB-SD 4.42Å; L1834-M1836 PolarHBondContact O-N 2.84Å; M1836-P1839 WeakPolarHBondContact O-CD 3.35Å; M1836-P1839 WeakPolarHBondContact O-CG 3.08Å; M1836-P1863 HydrophobicContact CE-CB 3.91Å; M1836-P1863 HydrophobicContact SD-CB 3.33Å; M1836-P1863 WeakPolarHBondContact SD-CB 3.36Å; M1836-G1864 PolarHBondContact SD-N 2.89Å
1837	N	93.4	Very high	90.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-27.2	-178.1	-66	-8.4	0	0	0	113.3	N1831 L1834 P1839 K1840 N1841 G1864 Y1867	N1831-N1837 WeakPolarHBondContact O-CB 3.25Å; N1831-N1837 PolarHBondContact O-ND2 3.32Å; L1834-N1837 HydrophobicContact CB-CB 4.16Å; L1834-N1837 CarbonylContact O-C 3.49Å; L1834-N1837 WeakPolarHBondContact O-CA 3.22Å; L1834-N1837 WeakPolarHBondContact O-CB 3.49Å; L1834-N1837 PolarHBondContact O-N 3.33Å; N1837-P1839 VanDerWaalsContact CA-CD 3.42Å; N1837-P1839 WeakPolarHBondContact O-CD 3.22Å; N1837-P1839 VanDerWaalsContact O-N 3.13Å; N1837-K1840 WeakPolarHBondContact O-CA 3.49Å; N1837-K1840 WeakPolarHBondContact O-CB 3.25Å; N1837-K1840 PolarHBondContact O-N 2.6Å; N1837-N1841 PolarHBondContact O-ND2 3.14Å; N1837-G1864 WeakPolarHBondContact OD1-CA 3.37Å; N1837-G1864 PolarHBondContact OD1-O 2.83Å; N1837-G1864 VanDerWaalsContact OD1-O 3.04Å; N1837-Y1867 HydrophobicContact CB-CD1 3.64Å; N1837-Y1867 HydrophobicContact CB-CD2 4.29Å; N1837-Y1867 HydrophobicContact CB-CE1 4.08Å; N1837-Y1867 HydrophobicContact CB-CG 3.75Å; N1837-Y1867 WeakPolarHBondContact ND2-CB 3.39Å; N1837-Y1867 WeakPolarHBondContact OD1-CB 3.39Å
1838	K	89.9	Confident	90.5	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-8.5	159.6	5.1	143.3	148.8	167.2	0	116.9	S148 T150 S152 T158 H159 L160 N1833 L1834 D1835 K1840	S148-K1838 PolarHBondContact O-NZ 3.07Å; T150-K1838 VanDerWaalsContact CB-C 3.42Å; T150-K1838 HydrophobicContact CG2-CB 3.5Å; T150-K1838 HydrophobicContact CG2-CD 3.37Å; T150-K1838 HydrophobicContact CG2-CG 3.49Å; T150-K1838 VanDerWaalsContact CG2-CG 3.49Å; T150-K1838 WeakPolarHBondContact OG1-CD 2.89Å; S152-K1838 PolarHBondContact OG-O 2.86Å; T158-K1838 HydrophobicContact CG2-CB 3.38Å; T158-K1838 HydrophobicContact CG2-CD 3.81Å; T158-K1838 HydrophobicContact CG2-CG 3.88Å; T158-K1838 WeakPolarHBondContact OG1-CA 3.42Å; T158-K1838 WeakPolarHBondContact OG1-CB 3.37Å; T158-K1838 PolarHBondContact OG1-O 3.32Å; H159-K1838 WeakPolarHBondContact O-CE 3.3Å; L160-K1838 VanDerWaalsContact CA-CE 3.47Å; L160-K1838 HydrophobicContact CD2-CD 4.2Å; L160-K1838 VanDerWaalsContact CD2-NZ 3.3Å; N1833-K1838 WeakPolarHBondContact O-CE 3.15Å; N1833-K1838 WeakPolarHBondContact O-CG 3.43Å; L1834-K1838 WeakPolarHBondContact O-CG 3.39Å; L1834-K1838 PolarHBondContact O-N 2.83Å; D1835-K1838 WeakPolarHBondContact OD1-CD 3.23Å; D1835-K1838 WeakPolarHBondContact OD1-CE 3.11Å; D1835-K1838 IonicContact OD1-NZ 2.62Å; D1835-K1838 PolarHBondContact OD1-NZ 3.49Å; K1838-K1840 VanDerWaalsContact C-N 3.28Å
1839	P	90.8	Very high	91	Very high	16 Å²	16	20 Å²	20	10%	0.104	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-32	159.5	-18.9	34.1	0	0	0	113.5	T150 I151 S152 M1836 N1837 N1841	T150-P1839 VanDerWaalsContact CG2-CD 3.49Å; T150-P1839 HydrophobicContact CG2-CG 3.99Å; I151-P1839 CarbonylContact C-O 3.39Å; I151-P1839 VanDerWaalsContact C-O 3.3Å; I151-P1839 HydrophobicContact CB-CB 3.88Å; I151-P1839 HydrophobicContact CG1-CB 4.34Å; I151-P1839 VanDerWaalsContact N-CB 3.31Å; I151-P1839 CarbonylContact O-C 3.4Å; I151-P1839 WeakPolarHBondContact O-CA 3.43Å; S152-P1839 WeakPolarHBondContact CA-O 3.29Å; S152-P1839 PolarHBondContact N-O 3.44Å; M1836-P1839 WeakPolarHBondContact O-CD 3.35Å; M1836-P1839 WeakPolarHBondContact O-CG 3.08Å; N1837-P1839 VanDerWaalsContact CA-CD 3.42Å; N1837-P1839 WeakPolarHBondContact O-CD 3.22Å; N1837-P1839 VanDerWaalsContact O-N 3.13Å; P1839-N1841 PolarHBondContact O-N 3.44Å
1840	K	94.2	Very high	91.2	Very high	22 Å²	22	19.2 Å²	19.2	10%	0.096	10%	0.095	C	C	.	.	S	Bend	trans	-91.9	36.2	-159.5	-57.1	-176.6	177.3	-160.4	0	111.7	N1837 K1838 G1864 Y1867 N1869 Q1886 T1892 D1895	N1837-K1840 WeakPolarHBondContact O-CA 3.49Å; N1837-K1840 WeakPolarHBondContact O-CB 3.25Å; N1837-K1840 PolarHBondContact O-N 2.6Å; K1838-K1840 VanDerWaalsContact C-N 3.28Å; K1840-G1864 PolarHBondContact NZ-O 2.68Å; K1840-Y1867 HydrophobicContact CB-CD1 3.73Å; K1840-Y1867 HydrophobicContact CB-CE1 3.74Å; K1840-Y1867 HydrophobicContact CD-CD1 3.9Å; K1840-Y1867 VanDerWaalsContact CD-O 3.25Å; K1840-Y1867 WeakPolarHBondContact CD-O 3.34Å; K1840-Y1867 HydrophobicContact CG-CD1 4.39Å; K1840-Y1867 PolarHBondContact NZ-O 2.84Å; K1840-N1869 WeakPolarHBondContact O-CB 3.46Å; K1840-Q1886 PolarHBondContact O-NE2 3.03Å; K1840-T1892 HydrophobicContact CB-CG2 3.42Å; K1840-T1892 VanDerWaalsContact CB-CG2 3.42Å; K1840-T1892 HydrophobicContact CG-CG2 3.86Å; K1840-D1895 WeakPolarHBondContact CD-OD2 3.17Å; K1840-D1895 WeakPolarHBondContact CE-OD2 3.29Å; K1840-D1895 IonicContact NZ-OD1 3.18Å; K1840-D1895 IonicContact NZ-OD2 3.38Å; K1840-D1895 PolarHBondContact NZ-OD2 2.7Å
1841	N	93.6	Very high	91.4	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.094	C	C	.	.			trans	-151.4	90.7	-144.7	-93.9	-33.7	0	0	0	110.3	S152 Q153 D156 S157 T158 S1832 N1837 P1839 Y1843 Y1867 N1869	S152-N1841 CarbonylContact C-O 3.34Å; S152-N1841 WeakPolarHBondContact CA-O 3.17Å; S152-N1841 WeakPolarHBondContact CB-O 3.42Å; S152-N1841 PolarHBondContact OG-O 3.39Å; Q153-N1841 PolarHBondContact N-O 3.22Å; Q153-N1841 VanDerWaalsContact N-O 3.1Å; D156-N1841 WeakPolarHBondContact OD2-CA 2.99Å; D156-N1841 PolarHBondContact OD2-N 3.49Å; S157-N1841 VanDerWaalsContact C-ND2 3.34Å; S157-N1841 PolarHBondContact N-OD1 3.43Å; S157-N1841 PolarHBondContact O-ND2 3.13Å; S157-N1841 PolarHBondContact O-OD1 2.71Å; T158-N1841 VanDerWaalsContact N-CB 3.27Å; T158-N1841 WeakPolarHBondContact OG1-CB 3.16Å; S1832-N1841 PolarHBondContact O-ND2 3.2Å; N1837-N1841 PolarHBondContact O-ND2 3.14Å; P1839-N1841 PolarHBondContact O-N 3.44Å; N1841-Y1843 CarbonylContact C-O 3.55Å; N1841-Y1867 PolarHBondContact ND2-OH 2.97Å; N1841-Y1867 PolarHBondContact OD1-OH 2.68Å; N1841-N1869 WeakPolarHBondContact OD1-CB 3.14Å; N1841-N1869 PolarHBondContact OD1-ND2 2.85Å
1842	R	93.1	Very high	91.5	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.087	C	C	.	.	S	Bend	trans	-71.1	-46.7	-165.5	-145.1	-145.6	-172.8	-37.8	-46	109.7	Q153 V154 G155 D156 G1887 P1888 T1889 K1921 D1923 S2026	Q153-R1842 VanDerWaalsContact C-C 3.43Å; Q153-R1842 CarbonylContact C-O 3.5Å; Q153-R1842 HydrophobicContact CB-CB 3.7Å; Q153-R1842 HydrophobicContact CB-CG 3.58Å; Q153-R1842 HydrophobicContact CG-CB 4.07Å; Q153-R1842 HydrophobicContact CG-CG 4.26Å; V154-R1842 CarbonylContact C-O 3.56Å; V154-R1842 WeakPolarHBondContact CA-O 3.18Å; V154-R1842 VanDerWaalsContact N-C 3.35Å; V154-R1842 VanDerWaalsContact N-CG 3.26Å; V154-R1842 PolarHBondContact N-O 2.93Å; V154-R1842 WeakPolarHBondContact O-CD 3.07Å; V154-R1842 WeakPolarHBondContact O-CG 3.44Å; V154-R1842 PolarHBondContact O-NE 2.97Å; V154-R1842 PolarHBondContact O-NH1 2.88Å; G155-R1842 VanDerWaalsContact CA-CB 3.47Å; G155-R1842 VanDerWaalsContact CA-CD 3.43Å; G155-R1842 VanDerWaalsContact N-CG 3.34Å; G155-R1842 PolarHBondContact N-O 3.29Å; D156-R1842 VanDerWaalsContact CG-CB 3.43Å; D156-R1842 WeakPolarHBondContact OD1-CB 3.26Å; D156-R1842 PolarHBondContact OD1-N 3.5Å; D156-R1842 PolarHBondContact OD2-N 3.29Å; R1842-G1887 WeakPolarHBondContact CD-O 3.49Å; R1842-G1887 PolarHBondContact NE-O 2.69Å; R1842-G1887 PolarHBondContact NH2-O 2.78Å; R1842-P1888 PolarHBondContact NH2-O 3.31Å; R1842-T1889 HydrophobicContact CG-CG2 3.83Å; R1842-K1921 PolarHBondContact NE-O 2.88Å; R1842-K1921 PolarHBondContact NH1-O 2.99Å; R1842-D1923 IonicContact CZ-OD2 2.59Å; R1842-D1923 IonicContact NH1-OD2 3.63Å; R1842-D1923 PolarHBondContact NH1-OD2 3.31Å; R1842-D1923 VanDerWaalsContact NH2-CB 3.29Å; R1842-D1923 IonicContact NH2-OD2 3.1Å; R1842-D1923 PolarHBondContact NH2-OD2 3.24Å; R1842-S2026 WeakPolarHBondContact CD-O 3.43Å
1843	Y	90.8	Very high	91.7	Very high	22 Å²	22	19 Å²	19	9%	0.086	9%	0.092	C	C	.	.	S	Bend	trans	-96.7	176.5	159.7	-61.8	-33	0	0	0	102.8	V154 G155 D156 S157 T158 T201 L202 N1841 S2026 A2027	V154-Y1843 HydrophobicContact CB-CE1 4.21Å; V154-Y1843 HydrophobicContact CG1-CD1 4.33Å; V154-Y1843 HydrophobicContact CG1-CE1 3.52Å; G155-Y1843 VanDerWaalsContact CA-CD1 3.5Å; G155-Y1843 VanDerWaalsContact CA-N 3.33Å; G155-Y1843 WeakPolarHBondContact O-CB 3.2Å; G155-Y1843 WeakPolarHBondContact O-CD2 3.5Å; G155-Y1843 VanDerWaalsContact O-CG 3.22Å; D156-Y1843 VanDerWaalsContact C-C 3.42Å; D156-Y1843 CarbonylContact C-O 3.41Å; D156-Y1843 CarbonylContact O-C 3.53Å; D156-Y1843 WeakPolarHBondContact O-CA 3.31Å; D156-Y1843 WeakPolarHBondContact O-CB 3.36Å; D156-Y1843 PolarHBondContact O-N 2.9Å; S157-Y1843 WeakPolarHBondContact CA-O 3.19Å; S157-Y1843 PolarHBondContact N-O 3Å; T158-Y1843 PolarHBondContact N-O 3.17Å; T201-Y1843 HydrophobicContact CG2-CD2 4.09Å; T201-Y1843 HydrophobicContact CG2-CE1 4.5Å; T201-Y1843 HydrophobicContact CG2-CE2 3.85Å; L202-Y1843 HydrophobicContact CB-CD1 3.76Å; L202-Y1843 HydrophobicContact CB-CG 4.24Å; L202-Y1843 VanDerWaalsContact N-CB 3.33Å; L202-Y1843 VanDerWaalsContact N-CG 3.3Å; L202-Y1843 WeakPolarHBondContact O-CD1 3.25Å; L202-Y1843 WeakPolarHBondContact O-CE1 3.41Å; N1841-Y1843 CarbonylContact C-O 3.55Å; Y1843-S2026 PolarHBondContact OH-OG 2.95Å; Y1843-A2027 HydrophobicContact CD2-CB 4.24Å; Y1843-A2027 HydrophobicContact CE2-CB 4.07Å
1844	A	87.2	Confident	92	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.091	C	C	.	.	B	Isolated β-bridge	trans	-95.5	16.5	163.7	0	0	0	0	0	108.5	D156 S157 T158 I199 L202 L228	D156-A1844 PolarHBondContact O-N 3.31Å; S157-A1844 WeakPolarHBondContact CB-O 3.03Å; S157-A1844 PolarHBondContact OG-O 3.33Å; T158-A1844 HydrophobicContact CG2-CB 4.03Å; T158-A1844 VanDerWaalsContact N-CA 3.28Å; T158-A1844 CarbonylContact O-C 3.57Å; T158-A1844 VanDerWaalsContact O-C 3.24Å; T158-A1844 VanDerWaalsContact O-CA 3.3Å; T158-A1844 WeakPolarHBondContact O-CA 3.42Å; T158-A1844 WeakPolarHBondContact O-CB 3.42Å; I199-A1844 CarbonylContact C-O 3.52Å; I199-A1844 WeakPolarHBondContact CA-O 3.39Å; I199-A1844 HydrophobicContact CB-CB 3.61Å; I199-A1844 VanDerWaalsContact CB-O 3.23Å; I199-A1844 WeakPolarHBondContact CB-O 3.42Å; I199-A1844 HydrophobicContact CD1-CB 3.45Å; I199-A1844 VanDerWaalsContact CD1-CB 3.45Å; I199-A1844 HydrophobicContact CG1-CB 3.51Å; I199-A1844 HydrophobicContact CG2-CB 4.27Å; I199-A1844 PolarHBondContact N-O 2.94Å; L202-A1844 HydrophobicContact CD1-CB 4.21Å; L202-A1844 HydrophobicContact CD2-CB 3.57Å; L202-A1844 HydrophobicContact CG-CB 3.81Å; L228-A1844 HydrophobicContact CD2-CB 4.39Å
1845	N	87.4	Confident	92.4	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.101	C	C	.	.	S	Bend	trans	-149.1	21.3	-144.8	-28	38.5	0	0	0	117.7	D156 S157 I199 E200 T201 L202	D156-N1845 CarbonylContact O-C 3.58Å; D156-N1845 WeakPolarHBondContact O-CA 3.43Å; D156-N1845 PolarHBondContact O-N 3.03Å; S157-N1845 VanDerWaalsContact CB-N 3.28Å; S157-N1845 WeakPolarHBondContact OG-CA 3.45Å; S157-N1845 PolarHBondContact OG-N 3.01Å; I199-N1845 VanDerWaalsContact C-CA 3.48Å; I199-N1845 HydrophobicContact CB-CB 4.08Å; I199-N1845 WeakPolarHBondContact CB-ND2 3.39Å; I199-N1845 HydrophobicContact CG2-CB 4.48Å; I199-N1845 WeakPolarHBondContact CG2-ND2 3.44Å; I199-N1845 WeakPolarHBondContact CG2-OD1 3.48Å; I199-N1845 WeakPolarHBondContact O-CA 3.26Å; I199-N1845 WeakPolarHBondContact O-CB 2.81Å; E200-N1845 WeakPolarHBondContact CA-ND2 3.25Å; E200-N1845 WeakPolarHBondContact CA-O 3.48Å; E200-N1845 HydrophobicContact CB-CB 4.3Å; E200-N1845 PolarHBondContact N-ND2 2.85Å; E200-N1845 PolarHBondContact O-ND2 2.88Å; T201-N1845 VanDerWaalsContact CA-CB 3.48Å; T201-N1845 WeakPolarHBondContact CA-ND2 2.89Å; T201-N1845 VanDerWaalsContact N-CG 3.26Å; T201-N1845 PolarHBondContact N-ND2 3.4Å; T201-N1845 VanDerWaalsContact N-ND2 3.19Å; T201-N1845 PolarHBondContact N-O 2.79Å; T201-N1845 PolarHBondContact O-ND2 3.41Å; L202-N1845 WeakPolarHBondContact CA-OD1 3.35Å; L202-N1845 WeakPolarHBondContact CB-OD1 3.46Å; L202-N1845 VanDerWaalsContact CD2-OD1 3.26Å; L202-N1845 WeakPolarHBondContact CD2-OD1 3.08Å; L202-N1845 WeakPolarHBondContact CG-OD1 3.28Å; L202-N1845 PolarHBondContact N-ND2 3.3Å; L202-N1845 PolarHBondContact N-OD1 3.08Å
1846	V	90.9	Very high	92.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.096	C	C	.	.	S	Bend	trans	-152	87.9	166.7	163.9	0	0	0	0	109.9	G155 D156 S157 N1869 A2027 V2029 N2065	G155-V1846 WeakPolarHBondContact O-CB 2.9Å; D156-V1846 VanDerWaalsContact C-N 3.3Å; D156-V1846 CarbonylContact C-O 3.54Å; D156-V1846 VanDerWaalsContact CA-O 3.26Å; D156-V1846 WeakPolarHBondContact CA-O 3.34Å; D156-V1846 PolarHBondContact O-N 3.47Å; S157-V1846 VanDerWaalsContact CB-C 3.42Å; S157-V1846 PolarHBondContact N-O 3.4Å; S157-V1846 VanDerWaalsContact OG-C 3.3Å; S157-V1846 WeakPolarHBondContact OG-CA 3.29Å; S157-V1846 PolarHBondContact OG-N 2.78Å; V1846-N1869 PolarHBondContact O-ND2 2.87Å; V1846-N1869 PolarHBondContact O-OD1 2.96Å; V1846-A2027 HydrophobicContact CB-CB 4.41Å; V1846-A2027 HydrophobicContact CG1-CB 4.32Å; V1846-A2027 WeakPolarHBondContact CG1-O 3.34Å; V1846-A2027 HydrophobicContact CG2-CB 3.99Å; V1846-V2029 HydrophobicContact CB-CG2 4.43Å; V1846-V2029 HydrophobicContact CG1-CB 4.2Å; V1846-V2029 HydrophobicContact CG1-CG1 3.28Å; V1846-V2029 HydrophobicContact CG1-CG2 3.86Å; V1846-V2029 HydrophobicContact CG2-CG2 3.64Å; V1846-N2065 WeakPolarHBondContact CA-OD1 3.45Å
1847	I	92.8	Very high	92.9	Very high	3 Å²	3	22.2 Å²	22.2	2%	0.015	11%	0.109	C	C	.	.			trans	-81.5	150.3	-169.1	22.8	74.5	0	0	0	115.5	S157 V198 W1829 Y1849 N2065	S157-I1847 VanDerWaalsContact CB-CA 3.43Å; S157-I1847 VanDerWaalsContact CB-N 3.34Å; S157-I1847 WeakPolarHBondContact O-CG2 3.5Å; S157-I1847 PolarHBondContact OG-N 2.78Å; S157-I1847 VanDerWaalsContact OG-N 3.16Å; V198-I1847 HydrophobicContact CG1-CG1 4.22Å; W1829-I1847 HydrophobicContact CB-CB 3.85Å; W1829-I1847 HydrophobicContact CB-CD1 4.34Å; W1829-I1847 HydrophobicContact CB-CG1 4.13Å; W1829-I1847 HydrophobicContact CB-CG2 3.82Å; W1829-I1847 VanDerWaalsContact CD1-CG2 3.44Å; W1829-I1847 HydrophobicContact CD2-CD1 3.97Å; W1829-I1847 HydrophobicContact CD2-CG1 3.97Å; W1829-I1847 HydrophobicContact CE3-CD1 4.18Å; W1829-I1847 HydrophobicContact CG-CB 3.92Å; W1829-I1847 HydrophobicContact CG-CD1 4.06Å; W1829-I1847 HydrophobicContact CG-CG1 3.71Å; W1829-I1847 HydrophobicContact CG-CG2 3.77Å; I1847-Y1849 HydrophobicContact CD1-CD1 3.46Å; I1847-Y1849 VanDerWaalsContact CD1-CD1 3.46Å; I1847-Y1849 HydrophobicContact CD1-CE1 3.24Å; I1847-Y1849 HydrophobicContact CD1-CG 4.46Å; I1847-Y1849 PolarHBondContact O-N 2.98Å; I1847-N2065 HydrophobicContact CD1-CB 3.7Å; I1847-N2065 WeakPolarHBondContact CD1-ND2 3.43Å; I1847-N2065 WeakPolarHBondContact CG1-ND2 3.32Å; I1847-N2065 PolarHBondContact N-ND2 2.76Å; I1847-N2065 VanDerWaalsContact N-ND2 3.15Å; I1847-N2065 PolarHBondContact N-OD1 2.93Å
1848	A	95.2	Very high	92.6	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.139	C	C	.	.			trans	-80.4	107.4	156.4	0	0	0	0	0	109.5	W1829 S1832 R1853 Y1867 N1869 N1871	W1829-A1848 WeakPolarHBondContact CB-O 3.38Å; S1832-A1848 PolarHBondContact OG-N 2.96Å; S1832-A1848 PolarHBondContact OG-O 3.22Å; A1848-R1853 HydrophobicContact CB-CB 4.04Å; A1848-Y1867 HydrophobicContact CB-CE2 4.22Å; A1848-N1869 PolarHBondContact N-ND2 3.05Å; A1848-N1871 WeakPolarHBondContact CA-ND2 3.46Å; A1848-N1871 WeakPolarHBondContact CA-OD1 3.26Å
1849	Y	95.7	Very high	92.3	Very high	15 Å²	15	29.4 Å²	29.4	6%	0.059	15%	0.154	C	C	.	.			trans	-59.6	137.1	166.8	-60.9	-43	0	0	0	110.5	F1827 T1828 W1829 I1847 H1851 S1852 R1853 N1871 R2061 K2062 Q2063 N2065	F1827-Y1849 HydrophobicContact CB-CD1 3.63Å; F1827-Y1849 HydrophobicContact CB-CD2 4.35Å; F1827-Y1849 HydrophobicContact CB-CE1 3.84Å; F1827-Y1849 HydrophobicContact CB-CG 3.9Å; F1827-Y1849 HydrophobicContact CD2-CD1 4.44Å; F1827-Y1849 HydrophobicContact CD2-CD2 4.17Å; F1827-Y1849 HydrophobicContact CD2-CE1 4Å; F1827-Y1849 AromaticContact CD2-CE2 3.71Å; F1827-Y1849 HydrophobicContact CD2-CE2 3.71Å; F1827-Y1849 AromaticContact CD2-CZ 3.61Å; F1827-Y1849 HydrophobicContact CE2-CE2 4.21Å; F1827-Y1849 HydrophobicContact CG-CD1 4.27Å; F1827-Y1849 HydrophobicContact CG-CD2 4.18Å; F1827-Y1849 HydrophobicContact CG-CE1 4.26Å; F1827-Y1849 HydrophobicContact CG-CE2 4.18Å; F1827-Y1849 HydrophobicContact CG-CG 4.23Å; T1828-Y1849 CarbonylContact O-C 3.4Å; T1828-Y1849 VanDerWaalsContact O-CA 3.25Å; T1828-Y1849 WeakPolarHBondContact O-CA 3.3Å; W1829-Y1849 HydrophobicContact CB-CD1 4.42Å; W1829-Y1849 HydrophobicContact CD2-CD1 4.29Å; W1829-Y1849 HydrophobicContact CD2-CE1 4.47Å; W1829-Y1849 AromaticContact CE3-CD1 3.52Å; W1829-Y1849 HydrophobicContact CE3-CD1 3.52Å; W1829-Y1849 AromaticContact CE3-CE1 3.6Å; W1829-Y1849 HydrophobicContact CE3-CE1 3.6Å; W1829-Y1849 HydrophobicContact CZ3-CD1 4.17Å; W1829-Y1849 AromaticContact CZ3-CE1 3.81Å; W1829-Y1849 HydrophobicContact CZ3-CE1 3.81Å; I1847-Y1849 HydrophobicContact CD1-CD1 3.46Å; I1847-Y1849 VanDerWaalsContact CD1-CD1 3.46Å; I1847-Y1849 HydrophobicContact CD1-CE1 3.24Å; I1847-Y1849 HydrophobicContact CD1-CG 4.46Å; I1847-Y1849 PolarHBondContact O-N 2.98Å; Y1849-H1851 VanDerWaalsContact C-N 3.34Å; Y1849-H1851 AromaticContact CD2-CE1 3.85Å; Y1849-H1851 PolarHBondContact O-N 3.37Å; Y1849-S1852 PolarHBondContact O-N 3.02Å; Y1849-S1852 PolarHBondContact O-OG 3.26Å; Y1849-R1853 WeakPolarHBondContact O-CB 3.32Å; Y1849-R1853 PolarHBondContact O-N 3.1Å; Y1849-N1871 PolarHBondContact N-ND2 2.99Å; Y1849-N1871 PolarHBondContact O-ND2 3.48Å; Y1849-N1871 VanDerWaalsContact O-ND2 3.16Å; Y1849-R2061 WeakPolarHBondContact CE2-O 3.33Å; Y1849-R2061 PolarHBondContact OH-O 2.86Å; Y1849-K2062 WeakPolarHBondContact CD2-O 3.1Å; Y1849-K2062 VanDerWaalsContact CE2-O 3.26Å; Y1849-K2062 WeakPolarHBondContact CE2-O 2.72Å; Y1849-Q2063 WeakPolarHBondContact CD2-O 3.42Å; Y1849-N2065 HydrophobicContact CE1-CB 4.31Å
1850	D	93.6	Very high	91.7	Very high	26 Å²	26	34.9 Å²	34.9	14%	0.139	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-64.6	-38.7	-170.9	-58.2	-54.2	0	0	0	112.9	T1828 W1829 E1830 N1831 S1852 R1853	T1828-D1850 WeakPolarHBondContact CB-OD2 3.42Å; T1828-D1850 PolarHBondContact O-N 2.96Å; T1828-D1850 PolarHBondContact OG1-OD2 2.94Å; W1829-D1850 VanDerWaalsContact C-OD1 3.31Å; W1829-D1850 WeakPolarHBondContact CA-OD2 3.35Å; W1829-D1850 PolarHBondContact N-OD2 3.27Å; E1830-D1850 PolarHBondContact N-OD1 2.84Å; E1830-D1850 PolarHBondContact N-OD2 3.36Å; N1831-D1850 VanDerWaalsContact CB-OD1 3.3Å; N1831-D1850 WeakPolarHBondContact CB-OD1 3.17Å; N1831-D1850 PolarHBondContact N-OD1 3.43Å; N1831-D1850 VanDerWaalsContact ND2-CG 3.34Å; N1831-D1850 PolarHBondContact ND2-OD1 3.24Å; D1850-S1852 PolarHBondContact O-N 3.48Å; D1850-S1852 VanDerWaalsContact O-N 3.14Å; D1850-R1853 PolarHBondContact O-N 2.94Å
1851	H	94.1	Very high	90.9	Very high	110 Å²	110	40.3 Å²	40.3	51%	0.509	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-65.5	-16.1	-176.3	76	-87.9	0	0	0	114.1	F1827 Y1849 K2062	F1827-H1851 AromaticContact CD1-CE1 3.32Å; F1827-H1851 WeakPolarHBondContact CD1-CE1 3.42Å; F1827-H1851 AromaticContact CD1-ND1 3.59Å; F1827-H1851 AromaticContact CE1-CE1 3.74Å; F1827-H1851 AromaticContact CG-CE1 3.94Å; Y1849-H1851 VanDerWaalsContact C-N 3.34Å; Y1849-H1851 AromaticContact CD2-CE1 3.85Å; Y1849-H1851 PolarHBondContact O-N 3.37Å; H1851-K2062 PolarHBondContact CE1-O 3.38Å; H1851-K2062 PolarHBondContact NE2-O 3.47Å
1852	S	95.7	Very high	90.3	Very high	8 Å²	8	43.8 Å²	43.8	6%	0.056	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-129	1	-176.2	60	0	0	0	0	112.6	Y1849 D1850 N1871 Y1872 Q2063	Y1849-S1852 PolarHBondContact O-N 3.02Å; Y1849-S1852 PolarHBondContact O-OG 3.26Å; D1850-S1852 PolarHBondContact O-N 3.48Å; D1850-S1852 VanDerWaalsContact O-N 3.14Å; S1852-N1871 CarbonylContact O-C 3.54Å; S1852-N1871 VanDerWaalsContact O-CA 3.22Å; S1852-N1871 WeakPolarHBondContact O-CA 3.07Å; S1852-N1871 PolarHBondContact OG-ND2 2.98Å; S1852-Y1872 WeakPolarHBondContact O-CD2 3.49Å; S1852-Y1872 PolarHBondContact O-N 3.2Å; S1852-Q2063 PolarHBondContact OG-O 2.98Å
1853	R	97.1	Very high	89.8	Confident	26 Å²	26	48.2 Å²	48.2	10%	0.098	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	147.5	-176.7	76.7	-178	176.8	95.7	-12.2	110.8	N1831 A1848 Y1849 D1850 V1855 D1866 A1870	N1831-R1853 VanDerWaalsContact CG-CZ 3.46Å; N1831-R1853 VanDerWaalsContact CG-NE 3.27Å; N1831-R1853 PolarHBondContact ND2-NE 2.94Å; N1831-R1853 PolarHBondContact OD1-NH2 3.28Å; A1848-R1853 HydrophobicContact CB-CB 4.04Å; Y1849-R1853 WeakPolarHBondContact O-CB 3.32Å; Y1849-R1853 PolarHBondContact O-N 3.1Å; D1850-R1853 PolarHBondContact O-N 2.94Å; R1853-V1855 HydrophobicContact CG-CG2 4.02Å; R1853-V1855 PolarHBondContact O-N 3.4Å; R1853-D1866 IonicContact CZ-OD2 3.06Å; R1853-D1866 PolarHBondContact NH1-O 3.23Å; R1853-D1866 VanDerWaalsContact NH1-O 3.11Å; R1853-D1866 IonicContact NH1-OD2 3.18Å; R1853-D1866 PolarHBondContact NH1-OD2 3.32Å; R1853-D1866 IonicContact NH2-OD2 2.69Å; R1853-D1866 PolarHBondContact NH2-OD2 3.01Å; R1853-A1870 CarbonylContact C-O 3.28Å; R1853-A1870 VanDerWaalsContact CA-O 3.26Å; R1853-A1870 WeakPolarHBondContact CA-O 3.4Å
1854	V	97.4	Very high	89.5	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	115.9	166.7	-171.7	0	0	0	0	107.9	L1856 I1868 A1870 Y1872 I1883 M1899 Q1903	V1854-L1856 HydrophobicContact CG1-CD2 4.31Å; V1854-I1868 HydrophobicContact CB-CG2 4.33Å; V1854-A1870 HydrophobicContact CB-CB 3.96Å; V1854-A1870 HydrophobicContact CG2-CB 3.66Å; V1854-A1870 PolarHBondContact N-O 3.47Å; V1854-Y1872 HydrophobicContact CB-CE2 4.32Å; V1854-Y1872 HydrophobicContact CG1-CE1 4.49Å; V1854-Y1872 HydrophobicContact CG1-CE2 4.44Å; V1854-Y1872 HydrophobicContact CG2-CD1 4.24Å; V1854-Y1872 HydrophobicContact CG2-CD2 4.19Å; V1854-Y1872 HydrophobicContact CG2-CE1 4.12Å; V1854-Y1872 HydrophobicContact CG2-CE2 4.07Å; V1854-Y1872 HydrophobicContact CG2-CG 4.29Å; V1854-I1883 HydrophobicContact CG2-CB 4.42Å; V1854-I1883 HydrophobicContact CG2-CD1 3.98Å; V1854-I1883 HydrophobicContact CG2-CG1 3.85Å; V1854-I1883 HydrophobicContact CG2-CG2 3.72Å; V1854-M1899 HydrophobicContact CB-CG 4.5Å; V1854-M1899 HydrophobicContact CB-SD 4.14Å; V1854-M1899 HydrophobicContact CG1-CG 3.75Å; V1854-M1899 HydrophobicContact CG1-SD 4.02Å; V1854-M1899 HydrophobicContact CG2-SD 4.16Å; V1854-Q1903 HydrophobicContact CG1-CG 3.82Å
1855	V	95.6	Very high	89.7	Confident	75 Å²	75	47.5 Å²	47.5	46%	0.455	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	125.8	174.8	-171.1	0	0	0	0	107.7	R1853 D1866	R1853-V1855 HydrophobicContact CG-CG2 4.02Å; R1853-V1855 PolarHBondContact O-N 3.4Å; V1855-D1866 WeakPolarHBondContact CA-O 3.43Å; V1855-D1866 HydrophobicContact CG1-CB 4.26Å
1856	L	94.3	Very high	90	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.021	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-91.1	159.6	172.9	-52.9	-177.1	0	0	0	110.5	V1854 S1858 D1866 I1868 D1895 M1899 E1902	V1854-L1856 HydrophobicContact CG1-CD2 4.31Å; L1856-S1858 PolarHBondContact O-N 3.06Å; L1856-D1866 PolarHBondContact N-O 3.12Å; L1856-D1866 WeakPolarHBondContact O-CA 3.45Å; L1856-I1868 HydrophobicContact CD1-CB 4.12Å; L1856-I1868 HydrophobicContact CD1-CG2 3.99Å; L1856-I1868 HydrophobicContact CD2-CG2 4.02Å; L1856-I1868 HydrophobicContact CG-CG2 3.96Å; L1856-D1895 HydrophobicContact CD1-CB 3.69Å; L1856-D1895 WeakPolarHBondContact CD1-O 3.16Å; L1856-M1899 HydrophobicContact CD2-CB 3.72Å; L1856-M1899 HydrophobicContact CD2-CG 3.97Å; L1856-E1902 WeakPolarHBondContact CA-OE2 3.4Å; L1856-E1902 WeakPolarHBondContact CB-OE2 3.46Å
1857	Q	88.3	Confident	90.2	Very high	140 Å²	140	48.7 Å²	48.7	65%	0.654	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-61.9	130.6	171.6	-63.4	-175.9	-3.3	0	0	109.5	I1859 R1898 E1902	Q1857-I1859 PolarHBondContact O-N 3.25Å; Q1857-R1898 PolarHBondContact O-NH1 2.91Å; Q1857-E1902 WeakPolarHBondContact CB-OE1 3.45Å; Q1857-E1902 HydrophobicContact CG-CG 4.33Å; Q1857-E1902 PolarHBondContact N-OE1 3.31Å; Q1857-E1902 PolarHBondContact N-OE2 3.03Å
1858	S	86.5	Confident	90.4	Very high	89 Å²	89	48.5 Å²	48.5	62%	0.622	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-66.3	124.8	176.2	-52.7	0	0	0	0	109.8	L1856	L1856-S1858 PolarHBondContact O-N 3.06Å
1859	I	83.9	Confident	90.5	Very high	61 Å²	61	48.5 Å²	48.5	31%	0.313	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-81.1	124.5	170.6	-59.7	173.9	0	0	0	107.5	Q1857 C1861 V1862 S1865	Q1857-I1859 PolarHBondContact O-N 3.25Å; I1859-C1861 PolarHBondContact O-N 3.22Å; I1859-V1862 HydrophobicContact CB-CB 4.19Å; I1859-V1862 HydrophobicContact CB-CG2 4.29Å; I1859-V1862 HydrophobicContact CG2-CB 4.3Å; I1859-V1862 HydrophobicContact CG2-CG2 3.85Å; I1859-V1862 PolarHBondContact O-N 2.84Å; I1859-S1865 PolarHBondContact N-OG 3.2Å; I1859-S1865 PolarHBondContact O-OG 2.69Å
1860	D	78.6	Confident	90.6	Very high	131 Å²	131	47.8 Å²	47.8	70%	0.701	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	134.3	178.5	-73.8	-37	0	0	0	111.9	V1862	D1860-V1862 PolarHBondContact O-N 2.95Å; D1860-V1862 VanDerWaalsContact O-N 3.16Å
1861	C	77	Confident	90.8	Very high	136 Å²	136	46.6 Å²	46.6	92%	0.919	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	12.1	-177.7	-55	0	0	0	0	116.4	I1859 P1863	I1859-C1861 PolarHBondContact O-N 3.22Å; C1861-P1863 WeakPolarHBondContact O-CD 3.24Å
1862	V	81.8	Confident	91	Very high	74 Å²	74	43.3 Å²	43.3	45%	0.448	25%	0.25	S	C	.	.			trans	-116.8	91.5	173.9	-173.1	0	0	0	0	110.5	I1859 D1860 S1865	I1859-V1862 HydrophobicContact CB-CB 4.19Å; I1859-V1862 HydrophobicContact CB-CG2 4.29Å; I1859-V1862 HydrophobicContact CG2-CB 4.3Å; I1859-V1862 HydrophobicContact CG2-CG2 3.85Å; I1859-V1862 PolarHBondContact O-N 2.84Å; D1860-V1862 PolarHBondContact O-N 2.95Å; D1860-V1862 VanDerWaalsContact O-N 3.16Å; V1862-S1865 WeakPolarHBondContact O-CB 3.4Å; V1862-S1865 PolarHBondContact O-N 2.72Å; V1862-S1865 PolarHBondContact O-OG 2.9Å
1863	P	81.3	Confident	91.1	Very high	92 Å²	92	43 Å²	43	60%	0.597	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	138.8	173.6	-25.2	35.5	0	0	0	111.9	M1836 C1861 S1865	M1836-P1863 HydrophobicContact CE-CB 3.91Å; M1836-P1863 HydrophobicContact SD-CB 3.33Å; M1836-P1863 WeakPolarHBondContact SD-CB 3.36Å; C1861-P1863 WeakPolarHBondContact O-CD 3.24Å; P1863-S1865 PolarHBondContact O-N 3.4Å
1864	G	85.9	Confident	91.1	Very high	5 Å²	5	44.1 Å²	44.1	5%	0.052	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	2.4	-178.4	0	0	0	0	0	115.4	M1836 N1837 K1840 D1866 Y1867	M1836-G1864 PolarHBondContact SD-N 2.89Å; N1837-G1864 WeakPolarHBondContact OD1-CA 3.37Å; N1837-G1864 PolarHBondContact OD1-O 2.83Å; N1837-G1864 VanDerWaalsContact OD1-O 3.04Å; K1840-G1864 PolarHBondContact NZ-O 2.68Å; G1864-D1866 WeakPolarHBondContact CA-OD1 3.18Å; G1864-D1866 PolarHBondContact O-N 2.85Å; G1864-Y1867 PolarHBondContact O-N 3.19Å
1865	S	90.6	Very high	90.8	Very high	3 Å²	3	44.6 Å²	44.6	2%	0.021	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-12.3	172.3	55.4	0	0	0	0	113.6	I1859 V1862 P1863 Y1867 R1898	I1859-S1865 PolarHBondContact N-OG 3.2Å; I1859-S1865 PolarHBondContact O-OG 2.69Å; V1862-S1865 WeakPolarHBondContact O-CB 3.4Å; V1862-S1865 PolarHBondContact O-N 2.72Å; V1862-S1865 PolarHBondContact O-OG 2.9Å; P1863-S1865 PolarHBondContact O-N 3.4Å; S1865-Y1867 VanDerWaalsContact C-N 3.29Å; S1865-R1898 PolarHBondContact O-NH2 2.7Å
1866	D	93.4	Very high	90.6	Very high	24 Å²	24	42.2 Å²	42.2	13%	0.128	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-6.6	173.9	73.2	-66.9	0	0	0	113.8	R1853 V1855 L1856 G1864	R1853-D1866 IonicContact CZ-OD2 3.06Å; R1853-D1866 PolarHBondContact NH1-O 3.23Å; R1853-D1866 VanDerWaalsContact NH1-O 3.11Å; R1853-D1866 IonicContact NH1-OD2 3.18Å; R1853-D1866 PolarHBondContact NH1-OD2 3.32Å; R1853-D1866 IonicContact NH2-OD2 2.69Å; R1853-D1866 PolarHBondContact NH2-OD2 3.01Å; V1855-D1866 WeakPolarHBondContact CA-O 3.43Å; V1855-D1866 HydrophobicContact CG1-CB 4.26Å; L1856-D1866 PolarHBondContact N-O 3.12Å; L1856-D1866 WeakPolarHBondContact O-CA 3.45Å; G1864-D1866 WeakPolarHBondContact CA-OD1 3.18Å; G1864-D1866 PolarHBondContact O-N 2.85Å
1867	Y	96.3	Very high	90.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	139	-172.5	179.6	-85.7	0	0	0	113.8	N1831 S1832 N1837 K1840 N1841 A1848 G1864 S1865 N1869	N1831-Y1867 HydrophobicContact CB-CD2 3.99Å; N1831-Y1867 HydrophobicContact CB-CE2 4.42Å; N1831-Y1867 WeakPolarHBondContact O-CD2 3.41Å; S1832-Y1867 VanDerWaalsContact CA-CE2 3.49Å; S1832-Y1867 WeakPolarHBondContact CA-OH 3.35Å; S1832-Y1867 VanDerWaalsContact CB-OH 3.28Å; S1832-Y1867 WeakPolarHBondContact CB-OH 3.37Å; S1832-Y1867 WeakPolarHBondContact OG-CE2 3.46Å; S1832-Y1867 PolarHBondContact OG-OH 3Å; N1837-Y1867 HydrophobicContact CB-CD1 3.64Å; N1837-Y1867 HydrophobicContact CB-CD2 4.29Å; N1837-Y1867 HydrophobicContact CB-CE1 4.08Å; N1837-Y1867 HydrophobicContact CB-CG 3.75Å; N1837-Y1867 WeakPolarHBondContact ND2-CB 3.39Å; N1837-Y1867 WeakPolarHBondContact OD1-CB 3.39Å; K1840-Y1867 HydrophobicContact CB-CD1 3.73Å; K1840-Y1867 HydrophobicContact CB-CE1 3.74Å; K1840-Y1867 HydrophobicContact CD-CD1 3.9Å; K1840-Y1867 VanDerWaalsContact CD-O 3.25Å; K1840-Y1867 WeakPolarHBondContact CD-O 3.34Å; K1840-Y1867 HydrophobicContact CG-CD1 4.39Å; K1840-Y1867 PolarHBondContact NZ-O 2.84Å; N1841-Y1867 PolarHBondContact ND2-OH 2.97Å; N1841-Y1867 PolarHBondContact OD1-OH 2.68Å; A1848-Y1867 HydrophobicContact CB-CE2 4.22Å; G1864-Y1867 PolarHBondContact O-N 3.19Å; S1865-Y1867 VanDerWaalsContact C-N 3.29Å; Y1867-N1869 HydrophobicContact CE1-CB 4.14Å; Y1867-N1869 WeakPolarHBondContact OH-CB 3.34Å; Y1867-N1869 PolarHBondContact OH-ND2 3.11Å; Y1867-N1869 VanDerWaalsContact OH-ND2 3.08Å
1868	I	96.6	Very high	90.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	150	157.5	179.4	164.1	0	0	0	107.3	V1854 L1856 A1870 D1895 F1896 M1899	V1854-I1868 HydrophobicContact CB-CG2 4.33Å; L1856-I1868 HydrophobicContact CD1-CB 4.12Å; L1856-I1868 HydrophobicContact CD1-CG2 3.99Å; L1856-I1868 HydrophobicContact CD2-CG2 4.02Å; L1856-I1868 HydrophobicContact CG-CG2 3.96Å; I1868-A1870 HydrophobicContact CG1-CB 4.46Å; I1868-A1870 HydrophobicContact CG2-CB 3.97Å; I1868-A1870 PolarHBondContact O-N 2.92Å; I1868-D1895 HydrophobicContact CB-CB 4.36Å; I1868-D1895 HydrophobicContact CD1-CB 4.4Å; I1868-F1896 HydrophobicContact CD1-CB 3.95Å; I1868-F1896 HydrophobicContact CD1-CD2 4.31Å; I1868-M1899 HydrophobicContact CD1-CB 4.36Å; I1868-M1899 HydrophobicContact CD1-CE 4.38Å; I1868-M1899 HydrophobicContact CD1-SD 4.11Å; I1868-M1899 HydrophobicContact CG2-CG 4.38Å; I1868-M1899 HydrophobicContact CG2-SD 3.85Å
1869	N	97	Very high	90.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	79.2	174.4	-166.3	-57.4	0	0	0	111.1	D156 S157 K1840 N1841 V1846 A1848 Y1867 T1885 Q1886 R2064	D156-N1869 HydrophobicContact CB-CB 3.51Å; D156-N1869 VanDerWaalsContact CB-ND2 3.35Å; D156-N1869 WeakPolarHBondContact CB-ND2 3.42Å; D156-N1869 WeakPolarHBondContact CB-OD1 3.34Å; D156-N1869 WeakPolarHBondContact OD2-CB 3.29Å; S157-N1869 PolarHBondContact N-ND2 2.81Å; S157-N1869 VanDerWaalsContact N-ND2 3.11Å; K1840-N1869 WeakPolarHBondContact O-CB 3.46Å; N1841-N1869 WeakPolarHBondContact OD1-CB 3.14Å; N1841-N1869 PolarHBondContact OD1-ND2 2.85Å; V1846-N1869 PolarHBondContact O-ND2 2.87Å; V1846-N1869 PolarHBondContact O-OD1 2.96Å; A1848-N1869 PolarHBondContact N-ND2 3.05Å; Y1867-N1869 HydrophobicContact CE1-CB 4.14Å; Y1867-N1869 WeakPolarHBondContact OH-CB 3.34Å; Y1867-N1869 PolarHBondContact OH-ND2 3.11Å; Y1867-N1869 VanDerWaalsContact OH-ND2 3.08Å; N1869-T1885 PolarHBondContact O-OG1 3.11Å; N1869-Q1886 PolarHBondContact O-OE1 2.76Å; N1869-R2064 VanDerWaalsContact OD1-CZ 3.24Å; N1869-R2064 PolarHBondContact OD1-NH1 3.44Å; N1869-R2064 PolarHBondContact OD1-NH2 3.47Å
1870	A	97.9	Very high	90.8	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	142.4	178.3	0	0	0	0	0	108.8	R1853 V1854 I1868 I1883 A1884 T1885 M1899	R1853-A1870 CarbonylContact C-O 3.28Å; R1853-A1870 VanDerWaalsContact CA-O 3.26Å; R1853-A1870 WeakPolarHBondContact CA-O 3.4Å; V1854-A1870 HydrophobicContact CB-CB 3.96Å; V1854-A1870 HydrophobicContact CG2-CB 3.66Å; V1854-A1870 PolarHBondContact N-O 3.47Å; I1868-A1870 HydrophobicContact CG1-CB 4.46Å; I1868-A1870 HydrophobicContact CG2-CB 3.97Å; I1868-A1870 PolarHBondContact O-N 2.92Å; A1870-I1883 HydrophobicContact CB-CG2 3.73Å; A1870-A1884 WeakPolarHBondContact CA-O 3.19Å; A1870-T1885 WeakPolarHBondContact CB-OG1 3.24Å; A1870-M1899 HydrophobicContact CB-SD 3.57Å; A1870-M1899 VanDerWaalsContact CB-SD 3.57Å
1871	N	98.4	Very high	91.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	142.6	167.3	-59.7	96.9	0	0	0	109.9	A1848 Y1849 S1852 I1873 I1883 A1884 Q2063 R2064	A1848-N1871 WeakPolarHBondContact CA-ND2 3.46Å; A1848-N1871 WeakPolarHBondContact CA-OD1 3.26Å; Y1849-N1871 PolarHBondContact N-ND2 2.99Å; Y1849-N1871 PolarHBondContact O-ND2 3.48Å; Y1849-N1871 VanDerWaalsContact O-ND2 3.16Å; S1852-N1871 CarbonylContact O-C 3.54Å; S1852-N1871 VanDerWaalsContact O-CA 3.22Å; S1852-N1871 WeakPolarHBondContact O-CA 3.07Å; S1852-N1871 PolarHBondContact OG-ND2 2.98Å; N1871-I1873 HydrophobicContact CB-CD1 4.46Å; N1871-I1883 CarbonylContact O-C 3.53Å; N1871-I1883 VanDerWaalsContact O-CA 3.29Å; N1871-I1883 WeakPolarHBondContact O-CA 3.38Å; N1871-A1884 PolarHBondContact N-O 3.06Å; N1871-A1884 PolarHBondContact O-N 3.41Å; N1871-Q2063 WeakPolarHBondContact CB-O 3.43Å; N1871-Q2063 VanDerWaalsContact CG-O 3.27Å; N1871-Q2063 PolarHBondContact ND2-O 3.45Å; N1871-R2064 HydrophobicContact CB-CB 4.08Å; N1871-R2064 WeakPolarHBondContact OD1-CB 3.06Å; N1871-R2064 WeakPolarHBondContact OD1-CD 3.36Å; N1871-R2064 VanDerWaalsContact OD1-CG 3.23Å; N1871-R2064 WeakPolarHBondContact OD1-CG 3.34Å; N1871-R2064 PolarHBondContact OD1-NH1 2.78Å
1872	Y	98	Very high	92.5	Very high	42 Å²	42	37.5 Å²	37.5	17%	0.165	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	139.5	157.2	-58.4	-76.5	0	0	0	109.5	S1852 V1854 N1880 Y1882 I1883 Q1903	S1852-Y1872 WeakPolarHBondContact O-CD2 3.49Å; S1852-Y1872 PolarHBondContact O-N 3.2Å; V1854-Y1872 HydrophobicContact CB-CE2 4.32Å; V1854-Y1872 HydrophobicContact CG1-CE1 4.49Å; V1854-Y1872 HydrophobicContact CG1-CE2 4.44Å; V1854-Y1872 HydrophobicContact CG2-CD1 4.24Å; V1854-Y1872 HydrophobicContact CG2-CD2 4.19Å; V1854-Y1872 HydrophobicContact CG2-CE1 4.12Å; V1854-Y1872 HydrophobicContact CG2-CE2 4.07Å; V1854-Y1872 HydrophobicContact CG2-CG 4.29Å; Y1872-N1880 VanDerWaalsContact CB-OD1 3.26Å; Y1872-N1880 WeakPolarHBondContact CB-OD1 3.2Å; Y1872-N1880 HydrophobicContact CD1-CB 3.82Å; Y1872-N1880 HydrophobicContact CG-CB 4.08Å; Y1872-Y1882 WeakPolarHBondContact CA-O 3.4Å; Y1872-I1883 HydrophobicContact CD1-CD1 4.24Å; Y1872-I1883 HydrophobicContact CD1-CG1 3.75Å; Y1872-I1883 HydrophobicContact CE1-CD1 4.04Å; Y1872-I1883 HydrophobicContact CE1-CG1 4.07Å; Y1872-Q1903 PolarHBondContact OH-NE2 3.32Å; Y1872-Q1903 VanDerWaalsContact OH-NE2 3.16Å; Y1872-Q1903 PolarHBondContact OH-OE1 3.16Å
1873	I	97.7	Very high	93.3	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	133.3	176	-61.9	-62.6	0	0	0	108.4	N1871 N1880 A1881 Y1882 A1884 I2036 L2060 Q2063 R2064 M2067	N1871-I1873 HydrophobicContact CB-CD1 4.46Å; I1873-N1880 CarbonylContact O-C 3.48Å; I1873-A1881 PolarHBondContact O-N 3.12Å; I1873-Y1882 HydrophobicContact CB-CD2 4.46Å; I1873-Y1882 HydrophobicContact CG2-CD2 4.24Å; I1873-Y1882 PolarHBondContact N-O 2.77Å; I1873-Y1882 PolarHBondContact O-N 2.7Å; I1873-A1884 HydrophobicContact CD1-CB 4.12Å; I1873-A1884 HydrophobicContact CG1-CB 3.44Å; I1873-A1884 VanDerWaalsContact CG1-CB 3.44Å; I1873-I2036 HydrophobicContact CB-CD1 4.49Å; I1873-I2036 HydrophobicContact CG1-CD1 4.44Å; I1873-I2036 HydrophobicContact CG2-CD1 4.37Å; I1873-I2036 HydrophobicContact CG2-CG2 3.93Å; I1873-L2060 HydrophobicContact CG2-CD2 3.6Å; I1873-Q2063 HydrophobicContact CD1-CB 3.63Å; I1873-R2064 HydrophobicContact CD1-CB 3.96Å; I1873-M2067 HydrophobicContact CD1-CE 4.05Å; I1873-M2067 HydrophobicContact CG1-CE 4.16Å
1874	D	95.6	Very high	94.1	Very high	50 Å²	50	29.6 Å²	29.6	27%	0.267	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	136.3	178.6	-72.9	0.9	0	0	0	110.8	M1879 N1880 I2040 Q2063	D1874-M1879 WeakPolarHBondContact OD1-CA 3.45Å; D1874-N1880 PolarHBondContact OD1-N 3.21Å; D1874-I2040 WeakPolarHBondContact O-CD1 3.5Å; D1874-Q2063 PolarHBondContact OD1-NE2 2.67Å
1875	G	92.3	Very high	94.7	Very high	10 Å²	10	29.4 Å²	29.4	10%	0.103	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	174.9	166.7	0	0	0	0	0	111.9	R1877 R1878	G1875-R1877 PolarHBondContact O-N 3.17Å; G1875-R1878 WeakPolarHBondContact CA-O 3.32Å; G1875-R1878 PolarHBondContact N-O 3.46Å; G1875-R1878 PolarHBondContact O-N 2.69Å; G1875-R1878 VanDerWaalsContact O-N 3.12Å
1876	Y	90.3	Very high	95	Very high	26 Å²	26	29.2 Å²	29.2	10%	0.102	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	110.1	179.6	178.7	-99.9	0	0	0	110.8	R1878 E2043 R2044 Y2047 E2048	Y1876-R1878 PolarHBondContact O-N 2.65Å; Y1876-E2043 HydrophobicContact CD1-CB 4.01Å; Y1876-E2043 HydrophobicContact CD1-CG 3.76Å; Y1876-E2043 HydrophobicContact CG-CB 4.09Å; Y1876-E2043 HydrophobicContact CG-CG 4.24Å; Y1876-R2044 HydrophobicContact CD2-CB 3.64Å; Y1876-R2044 HydrophobicContact CD2-CG 3.97Å; Y1876-R2044 HydrophobicContact CE2-CB 3.59Å; Y1876-R2044 HydrophobicContact CE2-CG 3.44Å; Y1876-R2044 VanDerWaalsContact CE2-CG 3.44Å; Y1876-R2044 HydrophobicContact CG-CB 4.21Å; Y1876-Y2047 HydrophobicContact CD1-CD2 4.07Å; Y1876-Y2047 AromaticContact CE1-CD2 3.49Å; Y1876-Y2047 HydrophobicContact CE1-CD2 3.49Å; Y1876-Y2047 VanDerWaalsContact CE1-CD2 3.49Å; Y1876-Y2047 HydrophobicContact CE1-CE2 4.29Å; Y1876-Y2047 HydrophobicContact CE1-CG 4.03Å; Y1876-E2048 VanDerWaalsContact OH-CG 3.25Å; Y1876-E2048 WeakPolarHBondContact OH-CG 3.02Å; Y1876-E2048 PolarHBondContact OH-OE1 2.8Å
1877	R	86.7	Confident	95.1	Very high	181 Å²	181	28.1 Å²	28.1	68%	0.683	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.8	23.6	-176	-53	-179	179.9	-164.6	-0.4	114.3	G1875 E2048	G1875-R1877 PolarHBondContact O-N 3.17Å; R1877-E2048 IonicContact CZ-OE1 3.53Å; R1877-E2048 IonicContact NE-OE1 3.32Å; R1877-E2048 IonicContact NH2-OE1 3.95Å; R1877-E2048 PolarHBondContact NH2-OE1 3.22Å
1878	R	88.6	Confident	95.1	Very high	60 Å²	60	28.1 Å²	28.1	23%	0.226	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	103.1	178	-179.8	-178.7	168	-145	-8.9	109.1	G1875 Y1876 A1881 Q2018 A2019	G1875-R1878 WeakPolarHBondContact CA-O 3.32Å; G1875-R1878 PolarHBondContact N-O 3.46Å; G1875-R1878 PolarHBondContact O-N 2.69Å; G1875-R1878 VanDerWaalsContact O-N 3.12Å; Y1876-R1878 PolarHBondContact O-N 2.65Å; R1878-A1881 HydrophobicContact CB-CB 4.11Å; R1878-A1881 HydrophobicContact CG-CB 3.8Å; R1878-A1881 WeakPolarHBondContact O-CB 3.1Å; R1878-Q2018 PolarHBondContact NH2-O 2.89Å; R1878-A2019 VanDerWaalsContact NH2-C 3.32Å; R1878-A2019 PolarHBondContact NH2-O 2.86Å
1879	M	90.8	Very high	94.9	Very high	147 Å²	147	28.1 Å²	28.1	72%	0.724	13%	0.127	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-60.7	148	174.7	-64.9	-179	71.1	0	0	110.5	D1874 A1881	D1874-M1879 WeakPolarHBondContact OD1-CA 3.45Å; M1879-A1881 PolarHBondContact O-N 3.4Å; M1879-A1881 VanDerWaalsContact O-N 3.07Å
1880	N	92.8	Very high	94.5	Very high	69 Å²	69	30.1 Å²	30.1	37%	0.369	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	51.7	31.4	178.2	-56.9	-13.4	0	0	0	114.2	Y1872 I1873 D1874 Y1882	Y1872-N1880 VanDerWaalsContact CB-OD1 3.26Å; Y1872-N1880 WeakPolarHBondContact CB-OD1 3.2Å; Y1872-N1880 HydrophobicContact CD1-CB 3.82Å; Y1872-N1880 HydrophobicContact CG-CB 4.08Å; I1873-N1880 CarbonylContact O-C 3.48Å; D1874-N1880 PolarHBondContact OD1-N 3.21Å; N1880-Y1882 PolarHBondContact O-N 3.3Å
1881	A	93.5	Very high	94	Very high	2 Å²	2	31.7 Å²	31.7	2%	0.017	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	-28	-176.8	0	0	0	0	0	113.5	I1873 R1878 M1879 P2020 I2021	I1873-A1881 PolarHBondContact O-N 3.12Å; R1878-A1881 HydrophobicContact CB-CB 4.11Å; R1878-A1881 HydrophobicContact CG-CB 3.8Å; R1878-A1881 WeakPolarHBondContact O-CB 3.1Å; M1879-A1881 PolarHBondContact O-N 3.4Å; M1879-A1881 VanDerWaalsContact O-N 3.07Å; A1881-P2020 WeakPolarHBondContact O-CA 3.47Å; A1881-I2021 PolarHBondContact O-N 3.24Å
1882	Y	97.6	Very high	93.7	Very high	3 Å²	3	31.7 Å²	31.7	1%	0.012	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	163	175.8	-38.2	-96.1	0	0	0	110.3	Y1872 I1873 N1880 I2021 V2023 I2036 D2039 I2040	Y1872-Y1882 WeakPolarHBondContact CA-O 3.4Å; I1873-Y1882 HydrophobicContact CB-CD2 4.46Å; I1873-Y1882 HydrophobicContact CG2-CD2 4.24Å; I1873-Y1882 PolarHBondContact N-O 2.77Å; I1873-Y1882 PolarHBondContact O-N 2.7Å; N1880-Y1882 PolarHBondContact O-N 3.3Å; Y1882-I2021 CarbonylContact C-O 3.55Å; Y1882-I2021 WeakPolarHBondContact CA-O 3.11Å; Y1882-I2021 WeakPolarHBondContact CB-O 3.4Å; Y1882-I2021 HydrophobicContact CD1-CB 3.99Å; Y1882-I2021 HydrophobicContact CD1-CD1 4.16Å; Y1882-I2021 HydrophobicContact CE1-CD1 4.05Å; Y1882-V2023 HydrophobicContact CD1-CG2 4.04Å; Y1882-I2036 HydrophobicContact CD1-CG1 4.14Å; Y1882-I2036 HydrophobicContact CD2-CD1 4.49Å; Y1882-I2036 HydrophobicContact CD2-CG1 4.38Å; Y1882-I2036 HydrophobicContact CD2-CG2 3.81Å; Y1882-I2036 HydrophobicContact CE2-CG2 3.79Å; Y1882-I2036 HydrophobicContact CG-CD1 4.13Å; Y1882-I2036 HydrophobicContact CG-CG1 4.07Å; Y1882-I2036 HydrophobicContact CG-CG2 4.35Å; Y1882-D2039 HydrophobicContact CE1-CB 4.36Å; Y1882-D2039 WeakPolarHBondContact CE1-OD2 3.26Å; Y1882-D2039 PolarHBondContact OH-OD2 2.85Å; Y1882-I2040 HydrophobicContact CE2-CD1 3.95Å; Y1882-I2040 HydrophobicContact CE2-CG1 3.71Å
1883	I	98.2	Very high	93.5	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	110.7	162.2	-73	166	0	0	0	107.1	V1854 A1870 N1871 Y1872 T1885 M1899 Q1903 V1905 P2020 I2021 V2022 V2023	V1854-I1883 HydrophobicContact CG2-CB 4.42Å; V1854-I1883 HydrophobicContact CG2-CD1 3.98Å; V1854-I1883 HydrophobicContact CG2-CG1 3.85Å; V1854-I1883 HydrophobicContact CG2-CG2 3.72Å; A1870-I1883 HydrophobicContact CB-CG2 3.73Å; N1871-I1883 CarbonylContact O-C 3.53Å; N1871-I1883 VanDerWaalsContact O-CA 3.29Å; N1871-I1883 WeakPolarHBondContact O-CA 3.38Å; Y1872-I1883 HydrophobicContact CD1-CD1 4.24Å; Y1872-I1883 HydrophobicContact CD1-CG1 3.75Å; Y1872-I1883 HydrophobicContact CE1-CD1 4.04Å; Y1872-I1883 HydrophobicContact CE1-CG1 4.07Å; I1883-T1885 PolarHBondContact O-N 2.97Å; I1883-M1899 HydrophobicContact CD1-SD 4.48Å; I1883-M1899 HydrophobicContact CG2-CE 3.94Å; I1883-M1899 HydrophobicContact CG2-SD 3.78Å; I1883-Q1903 HydrophobicContact CD1-CB 4.03Å; I1883-Q1903 HydrophobicContact CD1-CG 3.95Å; I1883-V1905 HydrophobicContact CD1-CG2 4.36Å; I1883-P2020 HydrophobicContact CD1-CB 3.87Å; I1883-P2020 HydrophobicContact CD1-CG 3.6Å; I1883-P2020 HydrophobicContact CG1-CB 3.88Å; I1883-P2020 HydrophobicContact CG1-CG 4.16Å; I1883-I2021 PolarHBondContact N-O 2.74Å; I1883-V2022 HydrophobicContact CB-CG2 3.89Å; I1883-V2022 HydrophobicContact CD1-CG2 4.15Å; I1883-V2022 HydrophobicContact CG2-CG2 4.16Å; I1883-V2022 CarbonylContact O-C 3.59Å; I1883-V2022 WeakPolarHBondContact O-CA 3.34Å; I1883-V2023 PolarHBondContact O-N 3.5Å
1884	A	98.3	Very high	93.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	109.4	170.4	0	0	0	0	0	108.9	A1870 N1871 I1873 V2023 T2032 I2036 M2067	A1870-A1884 WeakPolarHBondContact CA-O 3.19Å; N1871-A1884 PolarHBondContact N-O 3.06Å; N1871-A1884 PolarHBondContact O-N 3.41Å; I1873-A1884 HydrophobicContact CD1-CB 4.12Å; I1873-A1884 HydrophobicContact CG1-CB 3.44Å; I1873-A1884 VanDerWaalsContact CG1-CB 3.44Å; A1884-V2023 WeakPolarHBondContact CA-O 3.38Å; A1884-T2032 HydrophobicContact CB-CG2 3.89Å; A1884-I2036 HydrophobicContact CB-CD1 4.2Å; A1884-M2067 HydrophobicContact CB-CE 4.06Å; A1884-M2067 HydrophobicContact CB-SD 4.3Å
1885	T	98.2	Very high	93.2	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	178.8	-179.6	-170.5	0	0	0	0	110.1	N1869 A1870 I1883 F1896 M1899 V2022 V2023 H2024 G2028	N1869-T1885 PolarHBondContact O-OG1 3.11Å; A1870-T1885 WeakPolarHBondContact CB-OG1 3.24Å; I1883-T1885 PolarHBondContact O-N 2.97Å; T1885-F1896 HydrophobicContact CG2-CD2 4.42Å; T1885-F1896 HydrophobicContact CG2-CE2 3.94Å; T1885-M1899 HydrophobicContact CG2-CE 4.04Å; T1885-V2022 HydrophobicContact CG2-CG1 3.61Å; T1885-V2023 PolarHBondContact N-O 2.62Å; T1885-V2023 VanDerWaalsContact N-O 3.12Å; T1885-H2024 HydrophobicContact CG2-CB 4.01Å; T1885-H2024 WeakPolarHBondContact O-CA 3.3Å; T1885-H2024 WeakPolarHBondContact O-CB 3.36Å; T1885-G2028 WeakPolarHBondContact O-CA 3.31Å
1886	Q	96.5	Very high	93.4	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-80.6	173.4	178.2	81.7	-118.1	53.8	0	0	115	D156 K1840 N1869 P1888 T1892 H2024	D156-Q1886 HydrophobicContact CB-CB 4.23Å; D156-Q1886 WeakPolarHBondContact OD1-CB 3.3Å; D156-Q1886 WeakPolarHBondContact OD1-CG 3.35Å; D156-Q1886 PolarHBondContact OD2-NE2 2.9Å; D156-Q1886 PolarHBondContact OD2-OE1 2.91Å; K1840-Q1886 PolarHBondContact O-NE2 3.03Å; N1869-Q1886 PolarHBondContact O-OE1 2.76Å; Q1886-P1888 VanDerWaalsContact O-CD 3.32Å; Q1886-P1888 WeakPolarHBondContact O-CD 3.37Å; Q1886-T1892 PolarHBondContact NE2-OG1 2.94Å; Q1886-H2024 VanDerWaalsContact C-CB 3.4Å; Q1886-H2024 WeakPolarHBondContact O-CB 3.35Å; Q1886-H2024 VanDerWaalsContact O-CG 3.31Å; Q1886-H2024 PolarHBondContact O-ND1 2.83Å
1887	G	95.4	Very high	93.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.138	C	C	.	.	P	Polyproline II helix	trans	-73.2	120.2	148.7	0	0	0	0	0	109.6	R1842 C1922 H2024 C2025 S2026	R1842-G1887 WeakPolarHBondContact CD-O 3.49Å; R1842-G1887 PolarHBondContact NE-O 2.69Å; R1842-G1887 PolarHBondContact NH2-O 2.78Å; G1887-C1922 WeakPolarHBondContact CA-SG 3.15Å; G1887-H2024 VanDerWaalsContact CA-ND1 3.32Å; G1887-H2024 WeakPolarHBondContact CA-ND1 3.28Å; G1887-H2024 PolarHBondContact N-ND1 3.01Å; G1887-C2025 PolarHBondContact N-O 2.84Å; G1887-S2026 PolarHBondContact N-O 3.23Å; G1887-S2026 VanDerWaalsContact N-O 3.07Å
1888	P	95.7	Very high	93.9	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.108	C	C	.	.	P	Polyproline II helix	trans	-51.6	163.2	175.5	-31.3	35.7	0	0	0	114.9	I233 R1842 Q1886 T1892 F1896 D1923 Y1925	I233-P1888 HydrophobicContact CD1-CB 4.4Å; I233-P1888 WeakPolarHBondContact CD1-O 3.32Å; R1842-P1888 PolarHBondContact NH2-O 3.31Å; Q1886-P1888 VanDerWaalsContact O-CD 3.32Å; Q1886-P1888 WeakPolarHBondContact O-CD 3.37Å; P1888-T1892 WeakPolarHBondContact CA-OG1 3.31Å; P1888-F1896 HydrophobicContact CB-CB 4.33Å; P1888-F1896 HydrophobicContact CG-CB 3.52Å; P1888-F1896 HydrophobicContact CG-CD1 4.07Å; P1888-F1896 HydrophobicContact CG-CD2 3.31Å; P1888-F1896 HydrophobicContact CG-CE2 3.98Å; P1888-F1896 HydrophobicContact CG-CG 3.35Å; P1888-D1923 WeakPolarHBondContact O-CB 3.32Å; P1888-Y1925 HydrophobicContact CB-CD1 4.34Å; P1888-Y1925 VanDerWaalsContact CD-CD1 3.43Å; P1888-Y1925 HydrophobicContact CG-CD1 3.73Å; P1888-Y1925 HydrophobicContact CG-CG 3.91Å
1889	T	92.9	Very high	94.2	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.097	C	C	.	.			trans	-123.7	-175.8	152.6	84.5	0	0	0	0	110.6	Q153 R231 R1842 E1891 T1892 F1893 D1923	Q153-T1889 HydrophobicContact CB-CG2 3.34Å; Q153-T1889 WeakPolarHBondContact CB-OG1 3.25Å; Q153-T1889 HydrophobicContact CG-CG2 4.03Å; Q153-T1889 WeakPolarHBondContact CG-OG1 3.36Å; Q153-T1889 PolarHBondContact NE2-OG1 3.1Å; R231-T1889 WeakPolarHBondContact O-CG2 3.45Å; R1842-T1889 HydrophobicContact CG-CG2 3.83Å; T1889-E1891 PolarHBondContact O-N 3.22Å; T1889-E1891 PolarHBondContact OG1-OE2 2.84Å; T1889-T1892 PolarHBondContact N-OG1 2.82Å; T1889-T1892 PolarHBondContact O-N 2.83Å; T1889-T1892 VanDerWaalsContact O-N 3.11Å; T1889-T1892 PolarHBondContact O-OG1 2.95Å; T1889-F1893 PolarHBondContact O-N 2.59Å; T1889-F1893 VanDerWaalsContact O-N 3.15Å; T1889-D1923 HydrophobicContact CG2-CB 4.03Å; T1889-D1923 WeakPolarHBondContact CG2-OD2 3.32Å
1890	P	88.8	Confident	94.4	Very high	43 Å²	43	11.4 Å²	11.4	28%	0.279	6%	0.063	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-16.5	-165.3	-24.1	31.9	0	0	0	117	R231 R232 I233 F1893	R231-P1890 HydrophobicContact CB-CG 4.37Å; R232-P1890 WeakPolarHBondContact O-CD 3.21Å; R232-P1890 WeakPolarHBondContact O-CG 3.44Å; I233-P1890 HydrophobicContact CG1-CG 3.87Å; P1890-F1893 WeakPolarHBondContact O-CB 3.12Å
1891	E	86.6	Confident	94.4	Very high	32 Å²	32	9.5 Å²	9.5	15%	0.15	5%	0.051	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-41.2	-176	-51.2	64.6	-133.4	0	0	109.8	I151 Q153 R231 T1889	I151-E1891 HydrophobicContact CB-CG 4.16Å; I151-E1891 HydrophobicContact CG2-CG 3.97Å; Q153-E1891 PolarHBondContact NE2-OE2 3.44Å; R231-E1891 WeakPolarHBondContact CB-OE1 2.33Å; R231-E1891 WeakPolarHBondContact CD-OE1 3.41Å; R231-E1891 WeakPolarHBondContact CG-OE1 3.36Å; R231-E1891 IonicContact CZ-OE1 2.7Å; R231-E1891 VanDerWaalsContact CZ-OE1 3.32Å; R231-E1891 IonicContact NE-OE1 3.05Å; R231-E1891 PolarHBondContact NE-OE1 2.82Å; R231-E1891 IonicContact NH1-OE1 2.7Å; R231-E1891 PolarHBondContact NH1-OE1 2.73Å; T1889-E1891 PolarHBondContact O-N 3.22Å; T1889-E1891 PolarHBondContact OG1-OE2 2.84Å
1892	T	93.8	Very high	94.3	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-0.9	179.1	49.2	0	0	0	0	113.4	Q153 K1840 Q1886 P1888 T1889 S1894 D1895 F1896	Q153-T1892 PolarHBondContact NE2-OG1 3.02Å; Q153-T1892 PolarHBondContact OE1-OG1 3.35Å; K1840-T1892 HydrophobicContact CB-CG2 3.42Å; K1840-T1892 VanDerWaalsContact CB-CG2 3.42Å; K1840-T1892 HydrophobicContact CG-CG2 3.86Å; Q1886-T1892 PolarHBondContact NE2-OG1 2.94Å; P1888-T1892 WeakPolarHBondContact CA-OG1 3.31Å; T1889-T1892 PolarHBondContact N-OG1 2.82Å; T1889-T1892 PolarHBondContact O-N 2.83Å; T1889-T1892 VanDerWaalsContact O-N 3.11Å; T1889-T1892 PolarHBondContact O-OG1 2.95Å; T1892-S1894 VanDerWaalsContact C-N 3.35Å; T1892-S1894 PolarHBondContact O-N 2.75Å; T1892-D1895 PolarHBondContact O-N 2.79Å; T1892-F1896 VanDerWaalsContact O-CB 3.22Å; T1892-F1896 WeakPolarHBondContact O-CB 3.48Å; T1892-F1896 PolarHBondContact O-N 3.29Å
1893	F	94	Very high	94.2	Very high	31 Å²	31	12.9 Å²	12.9	14%	0.136	7%	0.066	C	C	.	.	H	α-helix	trans	-34.2	-62.4	161.7	-101	12.7	0	0	0	114.7	I233 T1889 P1890 W1897 Q1924 Y1925 F1934	I233-F1893 HydrophobicContact CB-CE1 4.09Å; I233-F1893 HydrophobicContact CB-CZ 4.31Å; I233-F1893 HydrophobicContact CD1-CD1 3.55Å; I233-F1893 HydrophobicContact CD1-CE1 3.17Å; I233-F1893 HydrophobicContact CD1-CZ 4.2Å; I233-F1893 HydrophobicContact CG1-CD1 4Å; I233-F1893 HydrophobicContact CG1-CE1 3.51Å; I233-F1893 HydrophobicContact CG1-CZ 4.12Å; I233-F1893 HydrophobicContact CG2-CD1 4.49Å; I233-F1893 HydrophobicContact CG2-CE1 3.33Å; I233-F1893 HydrophobicContact CG2-CE2 4.25Å; I233-F1893 HydrophobicContact CG2-CZ 3.19Å; T1889-F1893 PolarHBondContact O-N 2.59Å; T1889-F1893 VanDerWaalsContact O-N 3.15Å; P1890-F1893 WeakPolarHBondContact O-CB 3.12Å; F1893-W1897 PolarHBondContact O-N 2.79Å; F1893-Q1924 WeakPolarHBondContact CE1-O 3.39Å; F1893-Y1925 VanDerWaalsContact CE1-CA 3.49Å; F1893-F1934 HydrophobicContact CB-CD1 4.2Å; F1893-F1934 HydrophobicContact CD1-CE1 4.42Å; F1893-F1934 HydrophobicContact CD2-CD1 4.1Å; F1893-F1934 AromaticContact CD2-CE1 3.84Å; F1893-F1934 HydrophobicContact CD2-CE1 3.84Å; F1893-F1934 HydrophobicContact CE1-CE1 4.28Å; F1893-F1934 HydrophobicContact CE2-CD1 4.45Å; F1893-F1934 AromaticContact CE2-CE1 3.75Å; F1893-F1934 HydrophobicContact CE2-CE1 3.75Å; F1893-F1934 HydrophobicContact CG-CD1 4.22Å; F1893-F1934 HydrophobicContact CG-CE1 4.11Å; F1893-F1934 AromaticContact CZ-CE1 3.92Å; F1893-F1934 HydrophobicContact CZ-CE1 3.92Å
1894	S	91.4	Very high	93.9	Very high	36 Å²	36	21.4 Å²	21.4	25%	0.252	10%	0.098	S	C	.	.	H	α-helix	trans	-65.1	-44.6	-176.8	-72.5	0	0	0	0	110.9	T1892 R1898 A1935	T1892-S1894 VanDerWaalsContact C-N 3.35Å; T1892-S1894 PolarHBondContact O-N 2.75Å; S1894-R1898 WeakPolarHBondContact O-CB 3.24Å; S1894-R1898 PolarHBondContact O-N 2.59Å; S1894-A1935 WeakPolarHBondContact OG-CA 3.45Å; S1894-A1935 PolarHBondContact OG-N 2.79Å; S1894-A1935 VanDerWaalsContact OG-N 3.09Å
1895	D	94	Very high	93.6	Very high	11 Å²	11	21.5 Å²	21.5	6%	0.059	10%	0.099	C	C	.	.	H	α-helix	trans	-71.5	-32.2	-176.4	-64.5	-29.9	0	0	0	112.2	K1840 L1856 I1868 T1892 R1898 M1899	K1840-D1895 WeakPolarHBondContact CD-OD2 3.17Å; K1840-D1895 WeakPolarHBondContact CE-OD2 3.29Å; K1840-D1895 IonicContact NZ-OD1 3.18Å; K1840-D1895 IonicContact NZ-OD2 3.38Å; K1840-D1895 PolarHBondContact NZ-OD2 2.7Å; L1856-D1895 HydrophobicContact CD1-CB 3.69Å; L1856-D1895 WeakPolarHBondContact CD1-O 3.16Å; I1868-D1895 HydrophobicContact CB-CB 4.36Å; I1868-D1895 HydrophobicContact CD1-CB 4.4Å; T1892-D1895 PolarHBondContact O-N 2.79Å; D1895-R1898 IonicContact OD1-CZ 2.73Å; D1895-R1898 IonicContact OD1-NE 3.44Å; D1895-R1898 IonicContact OD1-NH2 2.79Å; D1895-R1898 PolarHBondContact OD1-NH2 2.83Å; D1895-M1899 VanDerWaalsContact O-CB 3.3Å; D1895-M1899 WeakPolarHBondContact O-CB 3.47Å; D1895-M1899 PolarHBondContact O-N 3.29Å
1896	F	96.6	Very high	93.3	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-71	-52.6	177.8	179.5	-85.9	0	0	0	111.3	I1868 T1885 P1888 T1892 R1898 M1899 I1900 I1908 Y1925 V2022	I1868-F1896 HydrophobicContact CD1-CB 3.95Å; I1868-F1896 HydrophobicContact CD1-CD2 4.31Å; T1885-F1896 HydrophobicContact CG2-CD2 4.42Å; T1885-F1896 HydrophobicContact CG2-CE2 3.94Å; P1888-F1896 HydrophobicContact CB-CB 4.33Å; P1888-F1896 HydrophobicContact CG-CB 3.52Å; P1888-F1896 HydrophobicContact CG-CD1 4.07Å; P1888-F1896 HydrophobicContact CG-CD2 3.31Å; P1888-F1896 HydrophobicContact CG-CE2 3.98Å; P1888-F1896 HydrophobicContact CG-CG 3.35Å; T1892-F1896 VanDerWaalsContact O-CB 3.22Å; T1892-F1896 WeakPolarHBondContact O-CB 3.48Å; T1892-F1896 PolarHBondContact O-N 3.29Å; F1896-R1898 PolarHBondContact O-N 2.8Å; F1896-M1899 HydrophobicContact CD2-CE 4.1Å; F1896-M1899 HydrophobicContact CE2-CE 4.18Å; F1896-M1899 CarbonylContact O-C 3.52Å; F1896-M1899 WeakPolarHBondContact O-CA 3.45Å; F1896-M1899 VanDerWaalsContact O-CB 3.23Å; F1896-M1899 WeakPolarHBondContact O-CB 3.38Å; F1896-M1899 PolarHBondContact O-N 3.09Å; F1896-I1900 HydrophobicContact CD1-CD1 4.39Å; F1896-I1900 HydrophobicContact CD1-CG1 4.03Å; F1896-I1900 HydrophobicContact CE1-CD1 3.77Å; F1896-I1900 HydrophobicContact CE1-CG1 3.68Å; F1896-I1900 HydrophobicContact CE2-CD1 4.46Å; F1896-I1900 HydrophobicContact CZ-CD1 3.84Å; F1896-I1900 HydrophobicContact CZ-CG1 4.28Å; F1896-I1900 WeakPolarHBondContact O-CG1 3.28Å; F1896-I1900 PolarHBondContact O-N 2.97Å; F1896-I1908 HydrophobicContact CE1-CD1 4.07Å; F1896-I1908 HydrophobicContact CZ-CD1 4.25Å; F1896-I1908 HydrophobicContact CZ-CG2 4.07Å; F1896-Y1925 AromaticContact CD1-CD2 3.57Å; F1896-Y1925 HydrophobicContact CD1-CD2 3.57Å; F1896-Y1925 HydrophobicContact CD1-CE2 4.11Å; F1896-Y1925 AromaticContact CD1-CG 3.9Å; F1896-Y1925 HydrophobicContact CD1-CG 3.9Å; F1896-Y1925 HydrophobicContact CE1-CD1 4.48Å; F1896-Y1925 AromaticContact CE1-CD2 3.16Å; F1896-Y1925 HydrophobicContact CE1-CD2 3.16Å; F1896-Y1925 AromaticContact CE1-CE2 3.21Å; F1896-Y1925 HydrophobicContact CE1-CE2 3.21Å; F1896-Y1925 AromaticContact CE1-CG 3.82Å; F1896-Y1925 HydrophobicContact CE1-CG 3.82Å; F1896-Y1925 AromaticContact CE1-CZ 3.89Å; F1896-Y1925 AromaticContact CZ-CD2 3.87Å; F1896-Y1925 HydrophobicContact CZ-CD2 3.87Å; F1896-Y1925 HydrophobicContact CZ-CE1 4.29Å; F1896-Y1925 AromaticContact CZ-CE2 3.53Å; F1896-Y1925 HydrophobicContact CZ-CE2 3.53Å; F1896-Y1925 HydrophobicContact CZ-CG 4.35Å; F1896-Y1925 AromaticContact CZ-CZ 3.72Å; F1896-V2022 HydrophobicContact CE2-CG1 3.91Å; F1896-V2022 HydrophobicContact CZ-CG1 4.04Å
1897	W	94.8	Very high	93.3	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-64.7	-31.1	177.2	-80.1	116.2	0	0	0	112.6	F1893 I1900 W1901 I1908 Y1925 W1926 F1934 L1939 V1941 F1957 L1959	F1893-W1897 PolarHBondContact O-N 2.79Å; W1897-I1900 HydrophobicContact CD2-CG1 4.49Å; W1897-I1900 HydrophobicContact CE3-CB 3.86Å; W1897-I1900 HydrophobicContact CE3-CG1 3.69Å; W1897-I1900 HydrophobicContact CE3-CG2 4.08Å; W1897-I1900 HydrophobicContact CZ3-CB 4.21Å; W1897-I1900 HydrophobicContact CZ3-CG1 3.92Å; W1897-I1900 HydrophobicContact CZ3-CG2 3.97Å; W1897-I1900 WeakPolarHBondContact O-CB 3.23Å; W1897-I1900 PolarHBondContact O-N 3.01Å; W1897-W1901 PolarHBondContact O-N 3.19Å; W1897-I1908 HydrophobicContact CH2-CD1 3.81Å; W1897-I1908 HydrophobicContact CZ3-CD1 3.9Å; W1897-Y1925 AromaticContact CE2-CD2 3.94Å; W1897-Y1925 HydrophobicContact CH2-CD2 4.5Å; W1897-Y1925 AromaticContact CZ2-CD2 3.7Å; W1897-Y1925 HydrophobicContact CZ2-CD2 3.7Å; W1897-Y1925 HydrophobicContact CZ2-CE2 4.16Å; W1897-Y1925 PolarHBondContact NE1-O 2.65Å; W1897-W1926 HydrophobicContact CZ2-CB 3.83Å; W1897-F1934 HydrophobicContact CB-CB 4.08Å; W1897-F1934 HydrophobicContact CB-CG 4.41Å; W1897-F1934 AromaticContact CD1-CD1 3.54Å; W1897-F1934 AromaticContact CD1-CD2 3.68Å; W1897-F1934 AromaticContact CD1-CE1 3.87Å; W1897-F1934 AromaticContact CD1-CG 3.44Å; W1897-F1934 VanDerWaalsContact CD1-CG 3.44Å; W1897-F1934 HydrophobicContact CG-CB 4.35Å; W1897-F1934 HydrophobicContact CG-CD2 4.31Å; W1897-F1934 HydrophobicContact CG-CG 4.15Å; W1897-F1934 AromaticContact NE1-CE2 3.94Å; W1897-F1934 AromaticContact NE1-CZ 3.94Å; W1897-L1939 HydrophobicContact CB-CD1 4.3Å; W1897-L1939 WeakPolarHBondContact O-CD1 3.38Å; W1897-V1941 HydrophobicContact CB-CG2 4.34Å; W1897-V1941 HydrophobicContact CD2-CG1 4.39Å; W1897-V1941 HydrophobicContact CD2-CG2 3.5Å; W1897-V1941 HydrophobicContact CE3-CG1 4.48Å; W1897-V1941 HydrophobicContact CE3-CG2 3.87Å; W1897-V1941 HydrophobicContact CG-CG2 3.71Å; W1897-V1941 HydrophobicContact CH2-CG1 3.92Å; W1897-V1941 HydrophobicContact CZ2-CG1 3.8Å; W1897-V1941 HydrophobicContact CZ2-CG2 4.38Å; W1897-V1941 HydrophobicContact CZ3-CG1 4.26Å; W1897-V1941 HydrophobicContact CZ3-CG2 4.44Å; W1897-F1957 AromaticContact CH2-CD2 3.9Å; W1897-F1957 HydrophobicContact CH2-CD2 3.9Å; W1897-F1957 HydrophobicContact CH2-CE2 4.35Å; W1897-F1957 HydrophobicContact CH2-CG 4.3Å; W1897-L1959 HydrophobicContact CE3-CD1 4.26Å; W1897-L1959 HydrophobicContact CE3-CD2 3.8Å; W1897-L1959 HydrophobicContact CE3-CG 4.22Å; W1897-L1959 HydrophobicContact CH2-CD1 4.5Å; W1897-L1959 HydrophobicContact CZ3-CD1 3.79Å; W1897-L1959 HydrophobicContact CZ3-CD2 3.95Å; W1897-L1959 HydrophobicContact CZ3-CG 4.23Å
1898	R	92.9	Very high	93.4	Very high	11 Å²	11	24.1 Å²	24.1	4%	0.042	12%	0.117	C	C	.	.	H	α-helix	trans	-69.2	-35.2	171.6	-172.1	161.5	63.8	90	-2.1	112.8	Q1857 S1865 S1894 D1895 F1896 W1901 E1902 A1935 L1939	Q1857-R1898 PolarHBondContact O-NH1 2.91Å; S1865-R1898 PolarHBondContact O-NH2 2.7Å; S1894-R1898 WeakPolarHBondContact O-CB 3.24Å; S1894-R1898 PolarHBondContact O-N 2.59Å; D1895-R1898 IonicContact OD1-CZ 2.73Å; D1895-R1898 IonicContact OD1-NE 3.44Å; D1895-R1898 IonicContact OD1-NH2 2.79Å; D1895-R1898 PolarHBondContact OD1-NH2 2.83Å; F1896-R1898 PolarHBondContact O-N 2.8Å; R1898-W1901 PolarHBondContact O-N 2.8Å; R1898-E1902 WeakPolarHBondContact CD-OE1 3.43Å; R1898-E1902 HydrophobicContact CG-CG 4.1Å; R1898-E1902 WeakPolarHBondContact CG-OE1 3.36Å; R1898-E1902 IonicContact CZ-OE1 2.73Å; R1898-E1902 IonicContact NH1-OE1 3.73Å; R1898-E1902 PolarHBondContact NH1-OE1 2.86Å; R1898-E1902 VanDerWaalsContact O-CB 3.31Å; R1898-E1902 WeakPolarHBondContact O-CB 3.47Å; R1898-E1902 VanDerWaalsContact O-CG 3.29Å; R1898-E1902 WeakPolarHBondContact O-CG 3.26Å; R1898-E1902 PolarHBondContact O-N 2.86Å; R1898-A1935 HydrophobicContact CB-CB 4.46Å; R1898-L1939 VanDerWaalsContact CA-CD1 3.48Å; R1898-L1939 HydrophobicContact CB-CD1 3.98Å
1899	M	95.9	Very high	93.5	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.7	-47.2	166.3	-168	-173.9	64.7	0	0	111.6	V1854 L1856 I1868 A1870 I1883 T1885 D1895 F1896 W1901 Q1903 V2022	V1854-M1899 HydrophobicContact CB-CG 4.5Å; V1854-M1899 HydrophobicContact CB-SD 4.14Å; V1854-M1899 HydrophobicContact CG1-CG 3.75Å; V1854-M1899 HydrophobicContact CG1-SD 4.02Å; V1854-M1899 HydrophobicContact CG2-SD 4.16Å; L1856-M1899 HydrophobicContact CD2-CB 3.72Å; L1856-M1899 HydrophobicContact CD2-CG 3.97Å; I1868-M1899 HydrophobicContact CD1-CB 4.36Å; I1868-M1899 HydrophobicContact CD1-CE 4.38Å; I1868-M1899 HydrophobicContact CD1-SD 4.11Å; I1868-M1899 HydrophobicContact CG2-CG 4.38Å; I1868-M1899 HydrophobicContact CG2-SD 3.85Å; A1870-M1899 HydrophobicContact CB-SD 3.57Å; A1870-M1899 VanDerWaalsContact CB-SD 3.57Å; I1883-M1899 HydrophobicContact CD1-SD 4.48Å; I1883-M1899 HydrophobicContact CG2-CE 3.94Å; I1883-M1899 HydrophobicContact CG2-SD 3.78Å; T1885-M1899 HydrophobicContact CG2-CE 4.04Å; D1895-M1899 VanDerWaalsContact O-CB 3.3Å; D1895-M1899 WeakPolarHBondContact O-CB 3.47Å; D1895-M1899 PolarHBondContact O-N 3.29Å; F1896-M1899 HydrophobicContact CD2-CE 4.1Å; F1896-M1899 HydrophobicContact CE2-CE 4.18Å; F1896-M1899 CarbonylContact O-C 3.52Å; F1896-M1899 WeakPolarHBondContact O-CA 3.45Å; F1896-M1899 VanDerWaalsContact O-CB 3.23Å; F1896-M1899 WeakPolarHBondContact O-CB 3.38Å; F1896-M1899 PolarHBondContact O-N 3.09Å; M1899-W1901 VanDerWaalsContact C-N 3.25Å; M1899-W1901 PolarHBondContact O-N 3.01Å; M1899-Q1903 HydrophobicContact CG-CG 3.97Å; M1899-Q1903 WeakPolarHBondContact O-CB 3.43Å; M1899-Q1903 VanDerWaalsContact O-CG 3.23Å; M1899-Q1903 WeakPolarHBondContact O-CG 3.4Å; M1899-Q1903 PolarHBondContact O-N 3.1Å; M1899-V2022 HydrophobicContact CE-CG1 4.08Å; M1899-V2022 HydrophobicContact CE-CG2 3.72Å
1900	I	95.4	Very high	93.7	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.01	12%	0.117	C	C	.	.	H	α-helix	trans	-56.5	-43.6	176.6	-56.6	-45.8	0	0	0	110.4	F1896 W1897 R1904 V1905 I1908 L1959 V1971 V2022	F1896-I1900 HydrophobicContact CD1-CD1 4.39Å; F1896-I1900 HydrophobicContact CD1-CG1 4.03Å; F1896-I1900 HydrophobicContact CE1-CD1 3.77Å; F1896-I1900 HydrophobicContact CE1-CG1 3.68Å; F1896-I1900 HydrophobicContact CE2-CD1 4.46Å; F1896-I1900 HydrophobicContact CZ-CD1 3.84Å; F1896-I1900 HydrophobicContact CZ-CG1 4.28Å; F1896-I1900 WeakPolarHBondContact O-CG1 3.28Å; F1896-I1900 PolarHBondContact O-N 2.97Å; W1897-I1900 HydrophobicContact CD2-CG1 4.49Å; W1897-I1900 HydrophobicContact CE3-CB 3.86Å; W1897-I1900 HydrophobicContact CE3-CG1 3.69Å; W1897-I1900 HydrophobicContact CE3-CG2 4.08Å; W1897-I1900 HydrophobicContact CZ3-CB 4.21Å; W1897-I1900 HydrophobicContact CZ3-CG1 3.92Å; W1897-I1900 HydrophobicContact CZ3-CG2 3.97Å; W1897-I1900 WeakPolarHBondContact O-CB 3.23Å; W1897-I1900 PolarHBondContact O-N 3.01Å; I1900-R1904 PolarHBondContact O-N 3.14Å; I1900-V1905 HydrophobicContact CB-CB 4.48Å; I1900-V1905 HydrophobicContact CD1-CB 4.19Å; I1900-V1905 HydrophobicContact CD1-CG1 4.05Å; I1900-V1905 HydrophobicContact CG2-CB 3.98Å; I1900-V1905 HydrophobicContact CG2-CG1 4.38Å; I1900-V1905 WeakPolarHBondContact CG2-O 3.26Å; I1900-V1905 PolarHBondContact O-N 3.34Å; I1900-I1908 HydrophobicContact CD1-CD1 3.83Å; I1900-I1908 HydrophobicContact CD1-CG1 3.85Å; I1900-I1908 HydrophobicContact CG1-CD1 3.95Å; I1900-I1908 HydrophobicContact CG1-CG1 4.48Å; I1900-L1959 HydrophobicContact CB-CD2 4.27Å; I1900-L1959 HydrophobicContact CG2-CD2 3.65Å; I1900-V1971 HydrophobicContact CG2-CG1 3.99Å; I1900-V1971 HydrophobicContact CG2-CG2 3.93Å; I1900-V2022 HydrophobicContact CD1-CB 4.18Å; I1900-V2022 HydrophobicContact CD1-CG1 4.3Å; I1900-V2022 HydrophobicContact CD1-CG2 3.74Å
1901	W	92.2	Very high	94.1	Very high	28 Å²	28	22.1 Å²	22.1	11%	0.106	10%	0.104	C	C	.	.	H	α-helix	trans	-69.8	-57	178.7	-174.7	-94.2	0	0	0	113.1	W1897 R1898 M1899 Q1903 R1904 L1939 L1959 A1961 I1964 E1967 R1969	W1897-W1901 PolarHBondContact O-N 3.19Å; R1898-W1901 PolarHBondContact O-N 2.8Å; M1899-W1901 VanDerWaalsContact C-N 3.25Å; M1899-W1901 PolarHBondContact O-N 3.01Å; W1901-Q1903 VanDerWaalsContact C-N 3.26Å; W1901-Q1903 PolarHBondContact O-N 3.45Å; W1901-R1904 PolarHBondContact O-N 3.18Å; W1901-L1939 HydrophobicContact CB-CD1 3.82Å; W1901-L1939 HydrophobicContact CB-CD2 3.81Å; W1901-L1939 HydrophobicContact CD2-CD2 3.62Å; W1901-L1939 HydrophobicContact CE3-CD2 3.85Å; W1901-L1939 HydrophobicContact CG-CD1 4.41Å; W1901-L1939 HydrophobicContact CG-CD2 3.58Å; W1901-L1959 HydrophobicContact CE3-CB 4.01Å; W1901-L1959 HydrophobicContact CE3-CD2 4.43Å; W1901-L1959 HydrophobicContact CZ3-CB 4.08Å; W1901-A1961 HydrophobicContact CD2-CB 4.21Å; W1901-A1961 HydrophobicContact CH2-CB 3.8Å; W1901-A1961 HydrophobicContact CZ2-CB 3.39Å; W1901-A1961 HydrophobicContact CZ3-CB 4.35Å; W1901-I1964 HydrophobicContact CZ2-CD1 4.32Å; W1901-E1967 HydrophobicContact CH2-CB 4.08Å; W1901-E1967 HydrophobicContact CH2-CG 3.89Å; W1901-E1967 WeakPolarHBondContact CH2-O 3.32Å; W1901-E1967 HydrophobicContact CZ2-CG 4.38Å; W1901-E1967 VanDerWaalsContact CZ2-OE2 3.3Å; W1901-E1967 WeakPolarHBondContact CZ2-OE2 3.35Å; W1901-R1969 HydrophobicContact CH2-CG 4.32Å; W1901-R1969 HydrophobicContact CZ3-CB 4.4Å; W1901-R1969 HydrophobicContact CZ3-CG 3.95Å; W1901-R1969 PolarHBondContact O-NH1 3.48Å
1902	E	92.3	Very high	94.4	Very high	41 Å²	41	20.6 Å²	20.6	19%	0.192	10%	0.097	C	C	.	.	H	α-helix	trans	-61.7	-36.3	-175.9	-68.7	173.4	-168.9	0	0	111.5	L1856 Q1857 R1898 R1904	L1856-E1902 WeakPolarHBondContact CA-OE2 3.4Å; L1856-E1902 WeakPolarHBondContact CB-OE2 3.46Å; Q1857-E1902 WeakPolarHBondContact CB-OE1 3.45Å; Q1857-E1902 HydrophobicContact CG-CG 4.33Å; Q1857-E1902 PolarHBondContact N-OE1 3.31Å; Q1857-E1902 PolarHBondContact N-OE2 3.03Å; R1898-E1902 WeakPolarHBondContact CD-OE1 3.43Å; R1898-E1902 HydrophobicContact CG-CG 4.1Å; R1898-E1902 WeakPolarHBondContact CG-OE1 3.36Å; R1898-E1902 IonicContact CZ-OE1 2.73Å; R1898-E1902 IonicContact NH1-OE1 3.73Å; R1898-E1902 PolarHBondContact NH1-OE1 2.86Å; R1898-E1902 VanDerWaalsContact O-CB 3.31Å; R1898-E1902 WeakPolarHBondContact O-CB 3.47Å; R1898-E1902 VanDerWaalsContact O-CG 3.29Å; R1898-E1902 WeakPolarHBondContact O-CG 3.26Å; R1898-E1902 PolarHBondContact O-N 2.86Å; E1902-R1904 VanDerWaalsContact C-N 3.34Å
1903	Q	93.7	Very high	94.3	Very high	36 Å²	36	24.5 Å²	24.5	17%	0.168	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	5.9	178.4	-52.8	-60.3	-42.9	0	0	114	V1854 Y1872 I1883 M1899 W1901 V1905 P2020	V1854-Q1903 HydrophobicContact CG1-CG 3.82Å; Y1872-Q1903 PolarHBondContact OH-NE2 3.32Å; Y1872-Q1903 VanDerWaalsContact OH-NE2 3.16Å; Y1872-Q1903 PolarHBondContact OH-OE1 3.16Å; I1883-Q1903 HydrophobicContact CD1-CB 4.03Å; I1883-Q1903 HydrophobicContact CD1-CG 3.95Å; M1899-Q1903 HydrophobicContact CG-CG 3.97Å; M1899-Q1903 WeakPolarHBondContact O-CB 3.43Å; M1899-Q1903 VanDerWaalsContact O-CG 3.23Å; M1899-Q1903 WeakPolarHBondContact O-CG 3.4Å; M1899-Q1903 PolarHBondContact O-N 3.1Å; W1901-Q1903 VanDerWaalsContact C-N 3.26Å; W1901-Q1903 PolarHBondContact O-N 3.45Å; Q1903-V1905 HydrophobicContact CB-CG2 3.83Å; Q1903-V1905 PolarHBondContact O-N 3.47Å; Q1903-V1905 VanDerWaalsContact O-N 3.12Å; Q1903-P2020 HydrophobicContact CB-CG 4.18Å
1904	R	92.4	Very high	94.2	Very high	178 Å²	178	24.5 Å²	24.5	67%	0.672	11%	0.113	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.8	28.6	179	-58.9	179.9	171	178.2	-3.5	114.8	I1900 W1901 E1902 S1906 A2019	I1900-R1904 PolarHBondContact O-N 3.14Å; W1901-R1904 PolarHBondContact O-N 3.18Å; E1902-R1904 VanDerWaalsContact C-N 3.34Å; R1904-S1906 PolarHBondContact O-N 3.33Å; R1904-A2019 HydrophobicContact CB-CB 4.25Å; R1904-A2019 WeakPolarHBondContact O-CB 3.38Å
1905	V	92.9	Very high	93.8	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.018	12%	0.119	C	C	.	.			trans	-66.9	118.4	-172.5	171.8	0	0	0	0	110.5	I1883 I1900 Q1903 I1907 I1908 V1971 P2020 V2022	I1883-V1905 HydrophobicContact CD1-CG2 4.36Å; I1900-V1905 HydrophobicContact CB-CB 4.48Å; I1900-V1905 HydrophobicContact CD1-CB 4.19Å; I1900-V1905 HydrophobicContact CD1-CG1 4.05Å; I1900-V1905 HydrophobicContact CG2-CB 3.98Å; I1900-V1905 HydrophobicContact CG2-CG1 4.38Å; I1900-V1905 WeakPolarHBondContact CG2-O 3.26Å; I1900-V1905 PolarHBondContact O-N 3.34Å; Q1903-V1905 HydrophobicContact CB-CG2 3.83Å; Q1903-V1905 PolarHBondContact O-N 3.47Å; Q1903-V1905 VanDerWaalsContact O-N 3.12Å; V1905-I1907 WeakPolarHBondContact CG1-O 3.41Å; V1905-I1908 HydrophobicContact CG1-CG1 4.28Å; V1905-V1971 VanDerWaalsContact O-CG2 3.29Å; V1905-V1971 WeakPolarHBondContact O-CG2 3.32Å; V1905-P2020 HydrophobicContact CG2-CG 4.03Å; V1905-V2022 HydrophobicContact CB-CG2 4.24Å; V1905-V2022 HydrophobicContact CG1-CB 4.06Å; V1905-V2022 HydrophobicContact CG1-CG2 3.71Å; V1905-V2022 HydrophobicContact CG2-CG2 3.64Å
1906	S	91.8	Very high	93.1	Very high	54 Å²	54	26.2 Å²	26.2	38%	0.378	12%	0.117	S	C	.	.			trans	-96	-9.4	173.6	58.9	0	0	0	0	113.8	R1904 V1971 K1972	R1904-S1906 PolarHBondContact O-N 3.33Å; S1906-V1971 CarbonylContact O-C 3.56Å; S1906-V1971 WeakPolarHBondContact O-CA 3.44Å; S1906-K1972 PolarHBondContact O-N 3.03Å
1907	I	96.1	Very high	92	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	126.1	-179.9	-56.9	-172.1	0	0	0	111.5	V1905 V1909 K1972 F1974 V1998 T2001 L2002 I2021 V2022	V1905-I1907 WeakPolarHBondContact CG1-O 3.41Å; I1907-V1909 HydrophobicContact CG2-CG2 4Å; I1907-K1972 CarbonylContact C-O 3.57Å; I1907-K1972 WeakPolarHBondContact CA-O 3.2Å; I1907-F1974 HydrophobicContact CG2-CD2 3.79Å; I1907-F1974 HydrophobicContact CG2-CE2 3.85Å; I1907-V1998 HydrophobicContact CG2-CG1 4.1Å; I1907-T2001 HydrophobicContact CD1-CG2 3.7Å; I1907-T2001 HydrophobicContact CG1-CG2 4.08Å; I1907-L2002 HydrophobicContact CD1-CD2 3.52Å; I1907-L2002 HydrophobicContact CD1-CG 3.74Å; I1907-L2002 HydrophobicContact CG1-CD2 4.44Å; I1907-I2021 HydrophobicContact CB-CG2 4.19Å; I1907-I2021 HydrophobicContact CG2-CG2 3.83Å; I1907-V2022 PolarHBondContact O-N 3.42Å
1908	I	97.6	Very high	90.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	142.2	170.6	-54.1	168.7	0	0	0	108.7	F1896 W1897 I1900 V1905 Y1925 V1971 K1972 H1973 F1974 V2022	F1896-I1908 HydrophobicContact CE1-CD1 4.07Å; F1896-I1908 HydrophobicContact CZ-CD1 4.25Å; F1896-I1908 HydrophobicContact CZ-CG2 4.07Å; W1897-I1908 HydrophobicContact CH2-CD1 3.81Å; W1897-I1908 HydrophobicContact CZ3-CD1 3.9Å; I1900-I1908 HydrophobicContact CD1-CD1 3.83Å; I1900-I1908 HydrophobicContact CD1-CG1 3.85Å; I1900-I1908 HydrophobicContact CG1-CD1 3.95Å; I1900-I1908 HydrophobicContact CG1-CG1 4.48Å; V1905-I1908 HydrophobicContact CG1-CG1 4.28Å; I1908-Y1925 HydrophobicContact CD1-CE2 4.24Å; I1908-Y1925 HydrophobicContact CG2-CE2 4.37Å; I1908-Y1925 WeakPolarHBondContact CG2-OH 3.45Å; I1908-V1971 HydrophobicContact CD1-CG1 3.64Å; I1908-V1971 HydrophobicContact CG1-CG1 3.82Å; I1908-K1972 PolarHBondContact N-O 3.17Å; I1908-H1973 HydrophobicContact CB-CB 4.29Å; I1908-H1973 CarbonylContact O-C 3.5Å; I1908-H1973 WeakPolarHBondContact O-CA 3.2Å; I1908-F1974 PolarHBondContact O-N 2.94Å; I1908-V2022 CarbonylContact C-O 3.57Å; I1908-V2022 WeakPolarHBondContact CA-O 3.43Å; I1908-V2022 HydrophobicContact CG1-CB 4.43Å; I1908-V2022 HydrophobicContact CG2-CB 4.5Å; I1908-V2022 HydrophobicContact CG2-CG1 4.16Å
1909	V	97.9	Very high	90.3	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	109.2	-177.5	-175.9	0	0	0	0	109.8	I1907 M1911 F1974 F1994 V1998 I2021 V2022 V2023 H2024 F2035	I1907-V1909 HydrophobicContact CG2-CG2 4Å; V1909-M1911 HydrophobicContact CG1-CG 4.22Å; V1909-M1911 HydrophobicContact CG1-SD 4.1Å; V1909-F1974 CarbonylContact C-O 3.48Å; V1909-F1974 VanDerWaalsContact CA-O 3.27Å; V1909-F1974 WeakPolarHBondContact CA-O 3.35Å; V1909-F1994 HydrophobicContact CG1-CE1 3.62Å; V1909-F1994 HydrophobicContact CG1-CZ 3.73Å; V1909-V1998 HydrophobicContact CG2-CG1 4.25Å; V1909-V1998 HydrophobicContact CG2-CG2 4.17Å; V1909-I2021 HydrophobicContact CG2-CG2 3.68Å; V1909-V2022 PolarHBondContact N-O 2.92Å; V1909-V2023 HydrophobicContact CB-CB 4.32Å; V1909-V2023 HydrophobicContact CB-CG1 4.07Å; V1909-V2023 HydrophobicContact CB-CG2 4.12Å; V1909-V2023 HydrophobicContact CG1-CG1 4.12Å; V1909-V2023 HydrophobicContact CG2-CG2 4.36Å; V1909-V2023 CarbonylContact O-C 3.51Å; V1909-V2023 WeakPolarHBondContact O-CA 3.31Å; V1909-H2024 PolarHBondContact O-CD2 2.86Å; V1909-H2024 PolarHBondContact O-N 3.49Å; V1909-F2035 HydrophobicContact CB-CZ 4.46Å; V1909-F2035 HydrophobicContact CG1-CD1 4.38Å; V1909-F2035 HydrophobicContact CG1-CD2 4Å; V1909-F2035 HydrophobicContact CG1-CE1 4.13Å; V1909-F2035 HydrophobicContact CG1-CE2 3.7Å; V1909-F2035 HydrophobicContact CG1-CG 4.34Å; V1909-F2035 HydrophobicContact CG1-CZ 3.79Å; V1909-F2035 HydrophobicContact CG2-CE1 4.36Å; V1909-F2035 HydrophobicContact CG2-CZ 4.07Å
1910	M	97.8	Very high	89.8	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	95.3	-177.6	175.6	176.1	-172.1	0	0	111.3	T1912 L1914 C1922 W1926 F1974 Q1975 F1976 H2024	M1910-T1912 HydrophobicContact CE-CG2 3.74Å; M1910-T1912 WeakPolarHBondContact CE-O 3.49Å; M1910-T1912 HydrophobicContact CG-CG2 4.02Å; M1910-T1912 PolarHBondContact O-N 3.1Å; M1910-L1914 HydrophobicContact CE-CD2 4.15Å; M1910-C1922 HydrophobicContact CE-CB 3.51Å; M1910-C1922 VanDerWaalsContact CE-SG 3.53Å; M1910-W1926 HydrophobicContact CE-CH2 3.8Å; M1910-W1926 HydrophobicContact CE-CZ3 4.16Å; M1910-W1926 HydrophobicContact SD-CH2 3.38Å; M1910-W1926 WeakPolarHBondContact SD-CH2 3.05Å; M1910-W1926 HydrophobicContact SD-CZ2 4.33Å; M1910-W1926 HydrophobicContact SD-CZ3 3.64Å; M1910-F1974 PolarHBondContact N-O 2.76Å; M1910-Q1975 HydrophobicContact CB-CB 3.91Å; M1910-Q1975 HydrophobicContact CB-CG 4.11Å; M1910-Q1975 HydrophobicContact CG-CB 4.15Å; M1910-Q1975 HydrophobicContact CG-CG 3.8Å; M1910-Q1975 CarbonylContact O-C 3.47Å; M1910-Q1975 WeakPolarHBondContact O-CA 3.36Å; M1910-Q1975 HydrophobicContact SD-CB 4.12Å; M1910-Q1975 HydrophobicContact SD-CG 3.71Å; M1910-Q1975 PolarHBondContact SD-NE2 3.47Å; M1910-F1976 PolarHBondContact O-N 3Å; M1910-H2024 WeakPolarHBondContact CB-NE2 3.23Å; M1910-H2024 WeakPolarHBondContact CG-CE1 3.43Å
1911	M	96.6	Very high	89.6	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	21%	0.214	C	C	.	.			trans	-80.4	43.2	-178.2	-67.7	-57.8	-57	0	0	113.7	V1909 F1976 W1979 L1991 F1994 V2023 H2024 C2025 R2031 F2035	V1909-M1911 HydrophobicContact CG1-CG 4.22Å; V1909-M1911 HydrophobicContact CG1-SD 4.1Å; M1911-F1976 HydrophobicContact CE-CB 3.92Å; M1911-F1976 HydrophobicContact CE-CD1 3.79Å; M1911-F1976 HydrophobicContact CE-CG 4.02Å; M1911-F1976 HydrophobicContact SD-CB 3.74Å; M1911-F1976 HydrophobicContact SD-CG 4.41Å; M1911-W1979 HydrophobicContact CE-CE3 3.62Å; M1911-W1979 HydrophobicContact CE-CZ3 3.67Å; M1911-L1991 HydrophobicContact CE-CD1 3.55Å; M1911-L1991 HydrophobicContact SD-CD1 4.21Å; M1911-F1994 HydrophobicContact SD-CD1 4.33Å; M1911-F1994 HydrophobicContact SD-CE1 3.52Å; M1911-F1994 VanDerWaalsContact SD-CE1 3.52Å; M1911-F1994 HydrophobicContact SD-CZ 4.13Å; M1911-V2023 HydrophobicContact CG-CG1 4.3Å; M1911-H2024 WeakPolarHBondContact CB-O 3Å; M1911-H2024 PolarHBondContact N-O 2.74Å; M1911-C2025 HydrophobicContact CB-CB 3.98Å; M1911-R2031 HydrophobicContact CB-CB 3.84Å; M1911-R2031 WeakPolarHBondContact O-CD 3.06Å; M1911-F2035 HydrophobicContact CE-CB 4.31Å; M1911-F2035 HydrophobicContact CG-CB 3.94Å; M1911-F2035 HydrophobicContact CG-CD2 4.45Å; M1911-F2035 HydrophobicContact CG-CG 4.32Å; M1911-F2035 HydrophobicContact SD-CB 4Å; M1911-F2035 HydrophobicContact SD-CD2 3.67Å; M1911-F2035 HydrophobicContact SD-CG 4.1Å
1912	T	93.2	Very high	89.6	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	-164.2	159.1	-177.4	-170.9	0	0	0	0	113.3	M1910 E1916 K1921 C1922 Q1975 F1976 C2025 R2031	M1910-T1912 HydrophobicContact CE-CG2 3.74Å; M1910-T1912 WeakPolarHBondContact CE-O 3.49Å; M1910-T1912 HydrophobicContact CG-CG2 4.02Å; M1910-T1912 PolarHBondContact O-N 3.1Å; T1912-E1916 PolarHBondContact OG1-OE1 3.36Å; T1912-K1921 WeakPolarHBondContact OG1-CB 3.29Å; T1912-C1922 HydrophobicContact CG2-CB 3.46Å; T1912-C1922 VanDerWaalsContact CG2-CB 3.46Å; T1912-Q1975 WeakPolarHBondContact O-CG 3.18Å; T1912-Q1975 PolarHBondContact O-NE2 2.71Å; T1912-F1976 PolarHBondContact N-O 3.28Å; T1912-C2025 VanDerWaalsContact CG2-C 3.46Å; T1912-C2025 HydrophobicContact CG2-CB 4.45Å; T1912-R2031 PolarHBondContact OG1-NH1 3.39Å; T1912-R2031 VanDerWaalsContact OG1-NH1 3.14Å
1913	R	91.7	Very high	89.6	Confident	82 Å²	82	44.4 Å²	44.4	31%	0.309	20%	0.201	S	C	.	.			trans	-76.6	168.3	158.1	-62.7	-174.9	-170.5	158.3	10.2	110.4	E1916 T1977	R1913-E1916 HydrophobicContact CB-CG 4.07Å; R1913-E1916 PolarHBondContact N-OE1 3.19Å; R1913-T1977 VanDerWaalsContact CZ-O 3.32Å; R1913-T1977 PolarHBondContact NE-O 3.46Å; R1913-T1977 PolarHBondContact NH2-O 3Å
1914	L	90.8	Very high	89.7	Confident	32 Å²	32	42.8 Å²	42.8	17%	0.168	19%	0.193	C	C	.	.	S	Bend	trans	-62.7	-55.9	169.1	-64.8	169.9	0	0	0	109.8	F235 M1910 V1920 K1921 C1922 Q1924 W1926	F235-L1914 HydrophobicContact CE1-CD1 3.8Å; F235-L1914 HydrophobicContact CE1-CD2 4.3Å; F235-L1914 HydrophobicContact CZ-CD1 4.01Å; F235-L1914 HydrophobicContact CZ-CD2 4.41Å; M1910-L1914 HydrophobicContact CE-CD2 4.15Å; L1914-V1920 CarbonylContact O-C 3.56Å; L1914-V1920 WeakPolarHBondContact O-CA 3.36Å; L1914-K1921 PolarHBondContact O-N 2.73Å; L1914-C1922 CarbonylContact C-O 3.52Å; L1914-C1922 WeakPolarHBondContact CA-O 3.5Å; L1914-C1922 VanDerWaalsContact CD2-O 3.3Å; L1914-C1922 WeakPolarHBondContact CD2-O 3.35Å; L1914-C1922 PolarHBondContact O-N 3.22Å; L1914-C1922 VanDerWaalsContact O-N 3.15Å; L1914-Q1924 HydrophobicContact CD2-CB 4.13Å; L1914-W1926 HydrophobicContact CD2-CH2 3.85Å
1915	E	84.4	Confident	89.7	Confident	78 Å²	78	34.3 Å²	34.3	36%	0.364	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	140.4	-175.7	-172	156.2	-113.9	0	0	112	R232 V1920	R232-E1915 IonicContact CZ-OE1 3.49Å; R232-E1915 IonicContact NH1-OE1 3.64Å; R232-E1915 PolarHBondContact NH1-OE1 2.82Å; E1915-V1920 HydrophobicContact CB-CG2 3.84Å; E1915-V1920 HydrophobicContact CG-CG2 4.13Å
1916	E	78.2	Confident	89.7	Confident	5 Å²	5	34.1 Å²	34.1	2%	0.023	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	124.5	-177	-69.1	177	-167.9	0	0	107.5	T1912 R1913 S1918 R1919 K1921 D1981 R2031	T1912-E1916 PolarHBondContact OG1-OE1 3.36Å; R1913-E1916 HydrophobicContact CB-CG 4.07Å; R1913-E1916 PolarHBondContact N-OE1 3.19Å; E1916-S1918 PolarHBondContact O-N 2.95Å; E1916-R1919 PolarHBondContact N-O 3.33Å; E1916-R1919 PolarHBondContact O-N 2.83Å; E1916-K1921 HydrophobicContact CB-CD 4.46Å; E1916-K1921 HydrophobicContact CB-CG 3.85Å; E1916-K1921 HydrophobicContact CG-CG 3.86Å; E1916-K1921 VanDerWaalsContact OE2-CE 3.23Å; E1916-K1921 WeakPolarHBondContact OE2-CE 3.15Å; E1916-K1921 IonicContact OE2-NZ 2.65Å; E1916-D1981 VanDerWaalsContact C-OD2 3.31Å; E1916-D1981 WeakPolarHBondContact CA-OD2 3.24Å; E1916-D1981 HydrophobicContact CB-CB 4.01Å; E1916-R2031 IonicContact OE1-CZ 2.72Å; E1916-R2031 IonicContact OE1-NH1 3.78Å; E1916-R2031 PolarHBondContact OE1-NH1 3.37Å; E1916-R2031 IonicContact OE1-NH2 3.6Å; E1916-R2031 PolarHBondContact OE1-NH2 3.12Å; E1916-R2031 IonicContact OE2-CZ 3.47Å; E1916-R2031 IonicContact OE2-NH1 3.82Å; E1916-R2031 PolarHBondContact OE2-NH1 2.77Å; E1916-R2031 IonicContact OE2-NH2 3.41Å; E1916-R2031 PolarHBondContact OE2-NH2 3.39Å
1917	R	73.3	Confident	89.4	Confident	174 Å²	174	31.6 Å²	31.6	66%	0.657	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	44.1	44.7	-170.1	-77.6	156.9	-175.4	-146.9	-6.1	114	R1919 D1981 H1982	R1917-R1919 PolarHBondContact O-N 2.79Å; R1917-R1919 VanDerWaalsContact O-N 3.11Å; R1917-D1981 HydrophobicContact CG-CB 4.31Å; R1917-D1981 WeakPolarHBondContact CG-OD2 3.32Å; R1917-D1981 PolarHBondContact N-OD2 2.83Å; R1917-H1982 VanDerWaalsContact CZ-CD2 3.47Å; R1917-H1982 PolarHBondContact NH1-CD2 3.48Å; R1917-H1982 PolarHBondContact NH1-NE2 2.92Å
1918	S	73	Confident	88.6	Confident	100 Å²	100	31.5 Å²	31.5	70%	0.699	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	19.6	-177.5	-54.3	0	0	0	0	115.1	E1916	E1916-S1918 PolarHBondContact O-N 2.95Å
1919	R	79.6	Confident	87.5	Confident	134 Å²	134	32 Å²	32	51%	0.506	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	123.3	166	-62.8	-175.1	178.8	-163.2	-0.5	108	E1916 R1917 K1921	E1916-R1919 PolarHBondContact N-O 3.33Å; E1916-R1919 PolarHBondContact O-N 2.83Å; R1917-R1919 PolarHBondContact O-N 2.79Å; R1917-R1919 VanDerWaalsContact O-N 3.11Å; R1919-K1921 PolarHBondContact O-N 2.8Å
1920	V	86.1	Confident	86.2	Confident	4 Å²	4	33.8 Å²	33.8	2%	0.024	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	134.9	171.4	158.7	0	0	0	0	110.5	R232 L1914 E1915 C1922 D1923	R232-V1920 HydrophobicContact CG-CB 4.46Å; R232-V1920 HydrophobicContact CG-CG1 4.47Å; L1914-V1920 CarbonylContact O-C 3.56Å; L1914-V1920 WeakPolarHBondContact O-CA 3.36Å; E1915-V1920 HydrophobicContact CB-CG2 3.84Å; E1915-V1920 HydrophobicContact CG-CG2 4.13Å; V1920-C1922 WeakPolarHBondContact CG1-O 3.36Å; V1920-D1923 HydrophobicContact CG1-CB 4.5Å; V1920-D1923 WeakPolarHBondContact CG1-OD1 3.5Å; V1920-D1923 WeakPolarHBondContact CG1-OD2 3.2Å
1921	K	90.1	Very high	85.6	Confident	48 Å²	48	37.4 Å²	37.4	21%	0.209	19%	0.186	C	C	.	.	S	Bend	trans	-102.5	-45.6	176	-60.9	-65.4	-173.2	155.1	0	109.6	R1842 T1912 L1914 E1916 R1919 S2026	R1842-K1921 PolarHBondContact NE-O 2.88Å; R1842-K1921 PolarHBondContact NH1-O 2.99Å; T1912-K1921 WeakPolarHBondContact OG1-CB 3.29Å; L1914-K1921 PolarHBondContact O-N 2.73Å; E1916-K1921 HydrophobicContact CB-CD 4.46Å; E1916-K1921 HydrophobicContact CB-CG 3.85Å; E1916-K1921 HydrophobicContact CG-CG 3.86Å; E1916-K1921 VanDerWaalsContact OE2-CE 3.23Å; E1916-K1921 WeakPolarHBondContact OE2-CE 3.15Å; E1916-K1921 IonicContact OE2-NZ 2.65Å; R1919-K1921 PolarHBondContact O-N 2.8Å; K1921-S2026 WeakPolarHBondContact O-CA 3.49Å; K1921-S2026 WeakPolarHBondContact O-CB 3.46Å; K1921-S2026 PolarHBondContact O-OG 3Å
1922	C	92.4	Very high	85.2	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.199	C	C	.	.			trans	-135.8	143.7	175.3	-175.5	0	0	0	0	110.8	G1887 M1910 T1912 L1914 V1920 H2024	G1887-C1922 WeakPolarHBondContact CA-SG 3.15Å; M1910-C1922 HydrophobicContact CE-CB 3.51Å; M1910-C1922 VanDerWaalsContact CE-SG 3.53Å; T1912-C1922 HydrophobicContact CG2-CB 3.46Å; T1912-C1922 VanDerWaalsContact CG2-CB 3.46Å; L1914-C1922 CarbonylContact C-O 3.52Å; L1914-C1922 WeakPolarHBondContact CA-O 3.5Å; L1914-C1922 VanDerWaalsContact CD2-O 3.3Å; L1914-C1922 WeakPolarHBondContact CD2-O 3.35Å; L1914-C1922 PolarHBondContact O-N 3.22Å; L1914-C1922 VanDerWaalsContact O-N 3.15Å; V1920-C1922 WeakPolarHBondContact CG1-O 3.36Å; C1922-H2024 PolarHBondContact SG-CE1 2.85Å
1923	D	92.9	Very high	84.7	Confident	4 Å²	4	43.8 Å²	43.8	2%	0.021	22%	0.224	C	C	.	.			trans	-110.5	156.7	178.4	-69.4	-87	0	0	0	107.8	R232 I233 R1842 P1888 T1889 V1920 Y1925	R232-D1923 WeakPolarHBondContact CA-OD1 3.43Å; R232-D1923 WeakPolarHBondContact CB-OD1 3.31Å; R232-D1923 WeakPolarHBondContact CG-OD1 3.15Å; I233-D1923 HydrophobicContact CB-CB 3.62Å; I233-D1923 HydrophobicContact CD1-CB 3.39Å; I233-D1923 HydrophobicContact CG1-CB 3.51Å; I233-D1923 PolarHBondContact N-OD1 3.45Å; R1842-D1923 IonicContact CZ-OD2 2.59Å; R1842-D1923 IonicContact NH1-OD2 3.63Å; R1842-D1923 PolarHBondContact NH1-OD2 3.31Å; R1842-D1923 VanDerWaalsContact NH2-CB 3.29Å; R1842-D1923 IonicContact NH2-OD2 3.1Å; R1842-D1923 PolarHBondContact NH2-OD2 3.24Å; P1888-D1923 WeakPolarHBondContact O-CB 3.32Å; T1889-D1923 HydrophobicContact CG2-CB 4.03Å; T1889-D1923 WeakPolarHBondContact CG2-OD2 3.32Å; V1920-D1923 HydrophobicContact CG1-CB 4.5Å; V1920-D1923 WeakPolarHBondContact CG1-OD1 3.5Å; V1920-D1923 WeakPolarHBondContact CG1-OD2 3.2Å; D1923-Y1925 PolarHBondContact O-N 3.29Å
1924	Q	94.2	Very high	84.4	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.005	21%	0.21	C	C	.	.			trans	-93.9	86.3	-156.2	-178.6	-179.8	-119.4	0	0	114.5	I233 F235 P236 G261 F263 F1893 L1914 W1926 S1928	I233-Q1924 HydrophobicContact CG2-CB 4.16Å; I233-Q1924 VanDerWaalsContact CG2-O 3.23Å; I233-Q1924 WeakPolarHBondContact CG2-O 3.39Å; F235-Q1924 HydrophobicContact CB-CB 4.25Å; F235-Q1924 HydrophobicContact CB-CG 3.54Å; F235-Q1924 HydrophobicContact CD1-CB 2.68Å; F235-Q1924 HydrophobicContact CD1-CG 2.3Å; F235-Q1924 HydrophobicContact CD2-CB 3.85Å; F235-Q1924 HydrophobicContact CD2-CG 2.32Å; F235-Q1924 HydrophobicContact CE1-CB 2.68Å; F235-Q1924 HydrophobicContact CE1-CG 2.31Å; F235-Q1924 HydrophobicContact CE2-CB 3.84Å; F235-Q1924 HydrophobicContact CE2-CG 2.31Å; F235-Q1924 HydrophobicContact CG-CB 3.31Å; F235-Q1924 HydrophobicContact CG-CG 2.31Å; F235-Q1924 HydrophobicContact CZ-CB 3.3Å; F235-Q1924 HydrophobicContact CZ-CG 2.3Å; F235-Q1924 PolarHBondContact O-NE2 2.88Å; P236-Q1924 PolarHBondContact O-NE2 2.82Å; P236-Q1924 PolarHBondContact O-OE1 2.7Å; G261-Q1924 PolarHBondContact O-OE1 3.41Å; F263-Q1924 VanDerWaalsContact N-CD 3.27Å; F1893-Q1924 WeakPolarHBondContact CE1-O 3.39Å; L1914-Q1924 HydrophobicContact CD2-CB 4.13Å; Q1924-W1926 VanDerWaalsContact C-N 3.34Å; Q1924-W1926 HydrophobicContact CB-CZ3 4.4Å; Q1924-W1926 HydrophobicContact CG-CD2 4.05Å; Q1924-W1926 HydrophobicContact CG-CE3 4.23Å; Q1924-W1926 HydrophobicContact CG-CH2 4.31Å; Q1924-W1926 HydrophobicContact CG-CZ2 4.18Å; Q1924-W1926 HydrophobicContact CG-CZ3 4.36Å; Q1924-W1926 PolarHBondContact O-N 3.12Å; Q1924-S1928 PolarHBondContact OE1-OG 3.05Å
1925	Y	93.5	Very high	83.6	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.203	C	C	.	.			trans	-64	-33.4	175.9	52.8	-84.7	0	0	0	114.6	P1888 F1893 F1896 W1897 I1908 D1923 F1934 H1973 H2024	P1888-Y1925 HydrophobicContact CB-CD1 4.34Å; P1888-Y1925 VanDerWaalsContact CD-CD1 3.43Å; P1888-Y1925 HydrophobicContact CG-CD1 3.73Å; P1888-Y1925 HydrophobicContact CG-CG 3.91Å; F1893-Y1925 VanDerWaalsContact CE1-CA 3.49Å; F1896-Y1925 AromaticContact CD1-CD2 3.57Å; F1896-Y1925 HydrophobicContact CD1-CD2 3.57Å; F1896-Y1925 HydrophobicContact CD1-CE2 4.11Å; F1896-Y1925 AromaticContact CD1-CG 3.9Å; F1896-Y1925 HydrophobicContact CD1-CG 3.9Å; F1896-Y1925 HydrophobicContact CE1-CD1 4.48Å; F1896-Y1925 AromaticContact CE1-CD2 3.16Å; F1896-Y1925 HydrophobicContact CE1-CD2 3.16Å; F1896-Y1925 AromaticContact CE1-CE2 3.21Å; F1896-Y1925 HydrophobicContact CE1-CE2 3.21Å; F1896-Y1925 AromaticContact CE1-CG 3.82Å; F1896-Y1925 HydrophobicContact CE1-CG 3.82Å; F1896-Y1925 AromaticContact CE1-CZ 3.89Å; F1896-Y1925 AromaticContact CZ-CD2 3.87Å; F1896-Y1925 HydrophobicContact CZ-CD2 3.87Å; F1896-Y1925 HydrophobicContact CZ-CE1 4.29Å; F1896-Y1925 AromaticContact CZ-CE2 3.53Å; F1896-Y1925 HydrophobicContact CZ-CE2 3.53Å; F1896-Y1925 HydrophobicContact CZ-CG 4.35Å; F1896-Y1925 AromaticContact CZ-CZ 3.72Å; W1897-Y1925 AromaticContact CE2-CD2 3.94Å; W1897-Y1925 HydrophobicContact CH2-CD2 4.5Å; W1897-Y1925 AromaticContact CZ2-CD2 3.7Å; W1897-Y1925 HydrophobicContact CZ2-CD2 3.7Å; W1897-Y1925 HydrophobicContact CZ2-CE2 4.16Å; W1897-Y1925 PolarHBondContact NE1-O 2.65Å; I1908-Y1925 HydrophobicContact CD1-CE2 4.24Å; I1908-Y1925 HydrophobicContact CG2-CE2 4.37Å; I1908-Y1925 WeakPolarHBondContact CG2-OH 3.45Å; D1923-Y1925 PolarHBondContact O-N 3.29Å; Y1925-F1934 VanDerWaalsContact O-CE1 3.23Å; Y1925-F1934 WeakPolarHBondContact O-CE1 3.42Å; Y1925-F1934 WeakPolarHBondContact O-CZ 3.27Å; Y1925-H1973 AromaticContact CE2-CD2 3.67Å; Y1925-H1973 AromaticContact CE2-NE2 3.87Å; Y1925-H1973 AromaticContact CZ-CD2 3.66Å; Y1925-H1973 AromaticContact CZ-NE2 3.46Å; Y1925-H1973 PolarHBondContact OH-CD2 3.05Å; Y1925-H1973 PolarHBondContact OH-NE2 3.13Å; Y1925-H2024 AromaticContact CE1-CE1 3.66Å; Y1925-H2024 AromaticContact CE1-NE2 3.43Å; Y1925-H2024 WeakPolarHBondContact CE1-NE2 3.42Å; Y1925-H2024 AromaticContact CZ-NE2 3.5Å; Y1925-H2024 PolarHBondContact OH-CD2 3.5Å; Y1925-H2024 PolarHBondContact OH-NE2 3.31Å
1926	W	93.1	Very high	82.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.226	C	C	.	.	S	Bend	trans	-68.1	145.9	178.8	58.6	114.6	0	0	0	110	F235 W1897 M1910 L1914 Q1924 R1955 F1957 H1973	F235-W1926 WeakPolarHBondContact CB-O 3.26Å; F235-W1926 HydrophobicContact CD2-CD2 4.47Å; F235-W1926 HydrophobicContact CD2-CG 4.23Å; F235-W1926 WeakPolarHBondContact CD2-O 3.37Å; F235-W1926 AromaticContact CE2-CD1 3.42Å; F235-W1926 VanDerWaalsContact CE2-CD1 3.42Å; F235-W1926 AromaticContact CE2-CD2 3.72Å; F235-W1926 HydrophobicContact CE2-CD2 3.72Å; F235-W1926 AromaticContact CE2-CE2 3.18Å; F235-W1926 AromaticContact CE2-CG 3.86Å; F235-W1926 HydrophobicContact CE2-CG 3.86Å; F235-W1926 HydrophobicContact CE2-CH2 4.45Å; F235-W1926 AromaticContact CE2-CZ2 3.59Å; F235-W1926 HydrophobicContact CE2-CZ2 3.59Å; F235-W1926 AromaticContact CE2-NE1 3.07Å; F235-W1926 WeakPolarHBondContact CG-O 3.29Å; F235-W1926 AromaticContact CZ-CE2 3.77Å; F235-W1926 HydrophobicContact CZ-CH2 4.1Å; F235-W1926 AromaticContact CZ-CZ2 3.5Å; F235-W1926 HydrophobicContact CZ-CZ2 3.5Å; F235-W1926 VanDerWaalsContact CZ-CZ2 3.5Å; W1897-W1926 HydrophobicContact CZ2-CB 3.83Å; M1910-W1926 HydrophobicContact CE-CH2 3.8Å; M1910-W1926 HydrophobicContact CE-CZ3 4.16Å; M1910-W1926 HydrophobicContact SD-CH2 3.38Å; M1910-W1926 WeakPolarHBondContact SD-CH2 3.05Å; M1910-W1926 HydrophobicContact SD-CZ2 4.33Å; M1910-W1926 HydrophobicContact SD-CZ3 3.64Å; L1914-W1926 HydrophobicContact CD2-CH2 3.85Å; Q1924-W1926 VanDerWaalsContact C-N 3.34Å; Q1924-W1926 HydrophobicContact CB-CZ3 4.4Å; Q1924-W1926 HydrophobicContact CG-CD2 4.05Å; Q1924-W1926 HydrophobicContact CG-CE3 4.23Å; Q1924-W1926 HydrophobicContact CG-CH2 4.31Å; Q1924-W1926 HydrophobicContact CG-CZ2 4.18Å; Q1924-W1926 HydrophobicContact CG-CZ3 4.36Å; Q1924-W1926 PolarHBondContact O-N 3.12Å; W1926-R1955 VanDerWaalsContact CE2-NH1 3.33Å; W1926-F1957 HydrophobicContact CB-CE1 3.8Å; W1926-F1957 HydrophobicContact CB-CE2 3.91Å; W1926-F1957 HydrophobicContact CB-CZ 3.39Å; W1926-F1957 AromaticContact CD1-CE1 3.87Å; W1926-F1957 AromaticContact CD1-CZ 3.34Å; W1926-F1957 HydrophobicContact CG-CE1 4.22Å; W1926-F1957 HydrophobicContact CG-CE2 4.3Å; W1926-F1957 AromaticContact CG-CZ 3.59Å; W1926-F1957 HydrophobicContact CG-CZ 3.59Å; W1926-H1973 AromaticContact CD2-NE2 3.63Å; W1926-H1973 AromaticContact CE2-NE2 3.95Å; W1926-H1973 AromaticContact CE3-NE2 3.38Å; W1926-H1973 AromaticContact CZ3-NE2 3.59Å
1927	P	85.8	Confident	82.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.234	C	C	.	.			trans	-65.6	160.6	151.8	29.1	-27.7	0	0	0	107.2	P236 E1932 F1934 V1941 F1957	P236-P1927 HydrophobicContact CG-CB 4.27Å; P1927-E1932 WeakPolarHBondContact CA-OE2 3.21Å; P1927-E1932 HydrophobicContact CB-CB 3.57Å; P1927-E1932 WeakPolarHBondContact CB-OE2 3.09Å; P1927-E1932 HydrophobicContact CG-CB 4.27Å; P1927-F1934 HydrophobicContact CG-CE2 4.24Å; P1927-V1941 HydrophobicContact CG-CB 3.71Å; P1927-V1941 HydrophobicContact CG-CG1 3.52Å; P1927-V1941 WeakPolarHBondContact CG-O 3.28Å; P1927-F1957 WeakPolarHBondContact O-CE1 3.38Å
1928	S	78.7	Confident	82.5	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.224	C	C	.	.			trans	-132.8	-0.4	159.7	73.8	0	0	0	0	115.2	F235 P236 P237 T238 G261 Q1924 P1943	F235-S1928 VanDerWaalsContact CD2-OG 3.26Å; F235-S1928 WeakPolarHBondContact CD2-OG 3.38Å; F235-S1928 WeakPolarHBondContact CE2-OG 3.11Å; P236-S1928 VanDerWaalsContact C-C 3.43Å; P236-S1928 CarbonylContact O-C 3.59Å; P236-S1928 WeakPolarHBondContact O-CA 3.34Å; P236-S1928 WeakPolarHBondContact O-CB 3.46Å; P236-S1928 PolarHBondContact O-N 3.38Å; P236-S1928 PolarHBondContact O-OG 2.88Å; P237-S1928 CarbonylContact C-O 3.55Å; P237-S1928 WeakPolarHBondContact CA-OG 3.39Å; P237-S1928 VanDerWaalsContact N-C 3.28Å; T238-S1928 WeakPolarHBondContact CA-O 3.31Å; T238-S1928 WeakPolarHBondContact CB-O 3.36Å; T238-S1928 PolarHBondContact N-O 3.3Å; T238-S1928 PolarHBondContact N-OG 2.74Å; T238-S1928 WeakPolarHBondContact OG1-CA 3.39Å; T238-S1928 WeakPolarHBondContact OG1-CB 3.33Å; T238-S1928 PolarHBondContact OG1-O 2.84Å; G261-S1928 PolarHBondContact O-OG 2.89Å; Q1924-S1928 PolarHBondContact OE1-OG 3.05Å; S1928-P1943 WeakPolarHBondContact O-CG 3Å
1929	R	74	Confident	83.2	Confident	10 Å²	10	32.8 Å²	32.8	4%	0.038	19%	0.193	C	C	.	.	S	Bend	trans	-140.1	147.4	156	-66	-177.9	-172.3	114.8	21.2	115.6	P236 P237 A317 G322 L323 V324	P236-R1929 VanDerWaalsContact C-N 3.26Å; P236-R1929 HydrophobicContact CB-CB 3.94Å; P236-R1929 VanDerWaalsContact CB-N 3.33Å; P236-R1929 WeakPolarHBondContact CB-O 3.27Å; P236-R1929 WeakPolarHBondContact CG-O 3.46Å; P237-R1929 VanDerWaalsContact C-CG 3.45Å; P237-R1929 VanDerWaalsContact CD-CG 3.48Å; P237-R1929 WeakPolarHBondContact O-CD 3.4Å; P237-R1929 WeakPolarHBondContact O-CG 3.25Å; P237-R1929 PolarHBondContact O-NE 3.43Å; P237-R1929 PolarHBondContact O-NH2 3.32Å; A317-R1929 PolarHBondContact O-NE 2.99Å; A317-R1929 PolarHBondContact O-NH1 3.13Å; A317-R1929 PolarHBondContact O-NH2 3.01Å; G322-R1929 PolarHBondContact O-NH1 2.97Å; L323-R1929 VanDerWaalsContact N-CD 3.32Å; V324-R1929 HydrophobicContact CB-CG 3.75Å; V324-R1929 HydrophobicContact CG1-CG 3.87Å
1930	G	72.1	Confident	83.7	Confident	38 Å²	38	29.6 Å²	29.6	39%	0.392	19%	0.186	S	C	.	.	S	Bend	trans	63.1	170.7	-166.1	0	0	0	0	0	110.1	P1943	G1930-P1943 WeakPolarHBondContact O-CD 3.44Å
1931	P	84	Confident	83.9	Confident	76 Å²	76	29.4 Å²	29.4	49%	0.494	18%	0.184	S	C	.	.			trans	-66.8	138.6	157.1	31.7	-32.3	0	0	0	109.9	L1940 V1941 K1942	P1931-L1940 HydrophobicContact CB-CD1 3.79Å; P1931-L1940 HydrophobicContact CB-CD2 3.8Å; P1931-L1940 HydrophobicContact CB-CG 3.65Å; P1931-L1940 HydrophobicContact CG-CD2 4.44Å; P1931-V1941 CarbonylContact C-O 3.54Å; P1931-V1941 VanDerWaalsContact CA-O 3.24Å; P1931-V1941 WeakPolarHBondContact CA-O 3.39Å; P1931-K1942 HydrophobicContact CB-CB 4.22Å
1932	E	87.9	Confident	83.8	Confident	57 Å²	57	32.3 Å²	32.3	27%	0.266	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	149.5	169.4	-167.8	171.5	-166	0	0	109.2	P236 P1927 F1934 V1941	P236-E1932 WeakPolarHBondContact CD-OE2 3.2Å; P1927-E1932 WeakPolarHBondContact CA-OE2 3.21Å; P1927-E1932 HydrophobicContact CB-CB 3.57Å; P1927-E1932 WeakPolarHBondContact CB-OE2 3.09Å; P1927-E1932 HydrophobicContact CG-CB 4.27Å; E1932-F1934 HydrophobicContact CB-CE2 3.82Å; E1932-F1934 HydrophobicContact CB-CZ 4.25Å; E1932-F1934 HydrophobicContact CG-CE2 4.01Å; E1932-F1934 HydrophobicContact CG-CZ 4.05Å; E1932-V1941 PolarHBondContact N-O 2.64Å; E1932-V1941 PolarHBondContact O-N 2.84Å
1933	S	84.1	Confident	83.8	Confident	76 Å²	76	33.2 Å²	33.2	53%	0.531	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	116.6	-169	61.9	0	0	0	0	111.8	L1939	S1933-L1939 CarbonylContact C-O 3.56Å; S1933-L1939 WeakPolarHBondContact CA-O 3.3Å
1934	F	85.2	Confident	83.4	Confident	5 Å²	5	36.1 Å²	36.1	2%	0.022	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	171.2	178.8	-60.6	-91.6	0	0	0	110.4	F1893 W1897 Y1925 P1927 E1932 S1936 G1937 L1938 L1939 V1941	F1893-F1934 HydrophobicContact CB-CD1 4.2Å; F1893-F1934 HydrophobicContact CD1-CE1 4.42Å; F1893-F1934 HydrophobicContact CD2-CD1 4.1Å; F1893-F1934 AromaticContact CD2-CE1 3.84Å; F1893-F1934 HydrophobicContact CD2-CE1 3.84Å; F1893-F1934 HydrophobicContact CE1-CE1 4.28Å; F1893-F1934 HydrophobicContact CE2-CD1 4.45Å; F1893-F1934 AromaticContact CE2-CE1 3.75Å; F1893-F1934 HydrophobicContact CE2-CE1 3.75Å; F1893-F1934 HydrophobicContact CG-CD1 4.22Å; F1893-F1934 HydrophobicContact CG-CE1 4.11Å; F1893-F1934 AromaticContact CZ-CE1 3.92Å; F1893-F1934 HydrophobicContact CZ-CE1 3.92Å; W1897-F1934 HydrophobicContact CB-CB 4.08Å; W1897-F1934 HydrophobicContact CB-CG 4.41Å; W1897-F1934 AromaticContact CD1-CD1 3.54Å; W1897-F1934 AromaticContact CD1-CD2 3.68Å; W1897-F1934 AromaticContact CD1-CE1 3.87Å; W1897-F1934 AromaticContact CD1-CG 3.44Å; W1897-F1934 VanDerWaalsContact CD1-CG 3.44Å; W1897-F1934 HydrophobicContact CG-CB 4.35Å; W1897-F1934 HydrophobicContact CG-CD2 4.31Å; W1897-F1934 HydrophobicContact CG-CG 4.15Å; W1897-F1934 AromaticContact NE1-CE2 3.94Å; W1897-F1934 AromaticContact NE1-CZ 3.94Å; Y1925-F1934 VanDerWaalsContact O-CE1 3.23Å; Y1925-F1934 WeakPolarHBondContact O-CE1 3.42Å; Y1925-F1934 WeakPolarHBondContact O-CZ 3.27Å; P1927-F1934 HydrophobicContact CG-CE2 4.24Å; E1932-F1934 HydrophobicContact CB-CE2 3.82Å; E1932-F1934 HydrophobicContact CB-CZ 4.25Å; E1932-F1934 HydrophobicContact CG-CE2 4.01Å; E1932-F1934 HydrophobicContact CG-CZ 4.05Å; F1934-S1936 PolarHBondContact O-N 3.29Å; F1934-G1937 PolarHBondContact O-N 2.94Å; F1934-G1937 VanDerWaalsContact O-N 3.1Å; F1934-L1938 PolarHBondContact O-N 2.59Å; F1934-L1939 PolarHBondContact N-O 3.29Å; F1934-L1939 PolarHBondContact O-N 3.13Å; F1934-L1939 VanDerWaalsContact O-N 3.16Å; F1934-V1941 HydrophobicContact CD2-CB 4.04Å; F1934-V1941 HydrophobicContact CD2-CG2 3.57Å; F1934-V1941 HydrophobicContact CE2-CB 3.98Å; F1934-V1941 HydrophobicContact CE2-CG2 3.95Å
1935	A	73.9	Confident	83	Confident	2 Å²	2	37.5 Å²	37.5	2%	0.017	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	52.1	53	-178.3	0	0	0	0	0	112.5	S1894 R1898 G1937 L1938 L1939	S1894-A1935 WeakPolarHBondContact OG-CA 3.45Å; S1894-A1935 PolarHBondContact OG-N 2.79Å; S1894-A1935 VanDerWaalsContact OG-N 3.09Å; R1898-A1935 HydrophobicContact CB-CB 4.46Å; A1935-G1937 PolarHBondContact O-N 2.68Å; A1935-G1937 VanDerWaalsContact O-N 3.07Å; A1935-L1938 HydrophobicContact CB-CB 4.08Å; A1935-L1938 VanDerWaalsContact O-CB 3.22Å; A1935-L1938 WeakPolarHBondContact O-CB 3.46Å; A1935-L1938 WeakPolarHBondContact O-CG 3.36Å; A1935-L1938 PolarHBondContact O-N 3.44Å; A1935-L1939 HydrophobicContact CB-CD1 4.4Å
1936	S	66.9	Low	82.6	Confident	121 Å²	121	37.5 Å²	37.5	85%	0.846	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	55.6	25.7	-179	-55.7	0	0	0	0	114.7	F1934	F1934-S1936 PolarHBondContact O-N 3.29Å
1937	G	66.6	Low	82.1	Confident	19 Å²	19	39 Å²	39	20%	0.196	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	88.8	13.9	-176.4	0	0	0	0	0	114.8	F1934 A1935 R1962	F1934-G1937 PolarHBondContact O-N 2.94Å; F1934-G1937 VanDerWaalsContact O-N 3.1Å; A1935-G1937 PolarHBondContact O-N 2.68Å; A1935-G1937 VanDerWaalsContact O-N 3.07Å; G1937-R1962 WeakPolarHBondContact O-CB 3.49Å; G1937-R1962 WeakPolarHBondContact O-CD 3.46Å
1938	L	79.7	Confident	82	Confident	85 Å²	85	39.2 Å²	39.2	45%	0.445	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-28.3	170.9	-66.9	171.3	0	0	0	112.7	F1934 A1935 A1961 R1962	F1934-L1938 PolarHBondContact O-N 2.59Å; A1935-L1938 HydrophobicContact CB-CB 4.08Å; A1935-L1938 VanDerWaalsContact O-CB 3.22Å; A1935-L1938 WeakPolarHBondContact O-CB 3.46Å; A1935-L1938 WeakPolarHBondContact O-CG 3.36Å; A1935-L1938 PolarHBondContact O-N 3.44Å; L1938-A1961 CarbonylContact O-C 3.5Å; L1938-A1961 WeakPolarHBondContact O-CA 3.43Å; L1938-R1962 PolarHBondContact O-N 3.4Å
1939	L	87.5	Confident	82.2	Confident	8 Å²	8	39.6 Å²	39.6	4%	0.042	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	127.2	-178.3	-69	170.9	0	0	0	111.2	W1897 R1898 W1901 S1933 F1934 A1935 A1961	W1897-L1939 HydrophobicContact CB-CD1 4.3Å; W1897-L1939 WeakPolarHBondContact O-CD1 3.38Å; R1898-L1939 VanDerWaalsContact CA-CD1 3.48Å; R1898-L1939 HydrophobicContact CB-CD1 3.98Å; W1901-L1939 HydrophobicContact CB-CD1 3.82Å; W1901-L1939 HydrophobicContact CB-CD2 3.81Å; W1901-L1939 HydrophobicContact CD2-CD2 3.62Å; W1901-L1939 HydrophobicContact CE3-CD2 3.85Å; W1901-L1939 HydrophobicContact CG-CD1 4.41Å; W1901-L1939 HydrophobicContact CG-CD2 3.58Å; S1933-L1939 CarbonylContact C-O 3.56Å; S1933-L1939 WeakPolarHBondContact CA-O 3.3Å; F1934-L1939 PolarHBondContact N-O 3.29Å; F1934-L1939 PolarHBondContact O-N 3.13Å; F1934-L1939 VanDerWaalsContact O-N 3.16Å; A1935-L1939 HydrophobicContact CB-CD1 4.4Å; L1939-A1961 HydrophobicContact CD2-CB 3.89Å
1940	L	88.5	Confident	82.6	Confident	67 Å²	67	39.3 Å²	39.3	35%	0.351	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	112.1	174.6	-163.4	73.6	0	0	0	108.4	P1931 L1959 T1960	P1931-L1940 HydrophobicContact CB-CD1 3.79Å; P1931-L1940 HydrophobicContact CB-CD2 3.8Å; P1931-L1940 HydrophobicContact CB-CG 3.65Å; P1931-L1940 HydrophobicContact CG-CD2 4.44Å; L1940-L1959 WeakPolarHBondContact O-CA 3.2Å; L1940-T1960 PolarHBondContact N-O 2.73Å; L1940-T1960 PolarHBondContact O-N 2.77Å
1941	V	91.7	Very high	83.3	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.2	176.3	-174.7	0	0	0	0	107.2	W1897 P1927 P1931 E1932 F1934 F1957 L1959	W1897-V1941 HydrophobicContact CB-CG2 4.34Å; W1897-V1941 HydrophobicContact CD2-CG1 4.39Å; W1897-V1941 HydrophobicContact CD2-CG2 3.5Å; W1897-V1941 HydrophobicContact CE3-CG1 4.48Å; W1897-V1941 HydrophobicContact CE3-CG2 3.87Å; W1897-V1941 HydrophobicContact CG-CG2 3.71Å; W1897-V1941 HydrophobicContact CH2-CG1 3.92Å; W1897-V1941 HydrophobicContact CZ2-CG1 3.8Å; W1897-V1941 HydrophobicContact CZ2-CG2 4.38Å; W1897-V1941 HydrophobicContact CZ3-CG1 4.26Å; W1897-V1941 HydrophobicContact CZ3-CG2 4.44Å; P1927-V1941 HydrophobicContact CG-CB 3.71Å; P1927-V1941 HydrophobicContact CG-CG1 3.52Å; P1927-V1941 WeakPolarHBondContact CG-O 3.28Å; P1931-V1941 CarbonylContact C-O 3.54Å; P1931-V1941 VanDerWaalsContact CA-O 3.24Å; P1931-V1941 WeakPolarHBondContact CA-O 3.39Å; E1932-V1941 PolarHBondContact N-O 2.64Å; E1932-V1941 PolarHBondContact O-N 2.84Å; F1934-V1941 HydrophobicContact CD2-CB 4.04Å; F1934-V1941 HydrophobicContact CD2-CG2 3.57Å; F1934-V1941 HydrophobicContact CE2-CB 3.98Å; F1934-V1941 HydrophobicContact CE2-CG2 3.95Å; V1941-F1957 HydrophobicContact CG1-CB 4.01Å; V1941-F1957 HydrophobicContact CG1-CD1 4.07Å; V1941-F1957 HydrophobicContact CG1-CG 4.11Å; V1941-L1959 HydrophobicContact CG1-CD1 4.08Å; V1941-L1959 HydrophobicContact CG2-CG 4.28Å
1942	K	88.1	Confident	83.5	Confident	109 Å²	109	35.3 Å²	35.3	47%	0.474	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	122.3	-178.3	180	-173.2	172.7	-173	0	109.8	P1931 F1957 H1958	P1931-K1942 HydrophobicContact CB-CB 4.22Å; K1942-F1957 CarbonylContact O-C 3.51Å; K1942-F1957 VanDerWaalsContact O-CA 3.24Å; K1942-F1957 WeakPolarHBondContact O-CA 3.32Å; K1942-H1958 HydrophobicContact CB-CB 4.44Å; K1942-H1958 PolarHBondContact N-O 2.95Å; K1942-H1958 PolarHBondContact O-N 3.35Å
1943	P	90.7	Very high	83.6	Confident	19 Å²	19	32.7 Å²	32.7	12%	0.123	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	140.3	171.1	30.3	-31.4	0	0	0	111.3	T238 S1928 G1930 F1957	T238-P1943 HydrophobicContact CG2-CB 3.96Å; T238-P1943 WeakPolarHBondContact OG1-CB 3.3Å; S1928-P1943 WeakPolarHBondContact O-CG 3Å; G1930-P1943 WeakPolarHBondContact O-CD 3.44Å; P1943-F1957 HydrophobicContact CB-CD1 4.09Å; P1943-F1957 HydrophobicContact CB-CE1 4.09Å
1944	V	86.4	Confident	83.9	Confident	65 Å²	65	29.4 Å²	29.4	39%	0.394	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	-48.5	-175.9	-178.8	0	0	0	0	110.7	T1956 H1958	V1944-T1956 HydrophobicContact CB-CG2 4.31Å; V1944-T1956 WeakPolarHBondContact CB-O 3.2Å; V1944-T1956 PolarHBondContact N-O 2.88Å; V1944-H1958 HydrophobicContact CG2-CB 4.01Å
1945	D	84.3	Confident	84.3	Confident	30 Å²	30	29.4 Å²	29.4	16%	0.16	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	164.8	-172.3	177.9	45.4	0	0	0	109.6	R326 T1956	R326-D1945 IonicContact CZ-OD1 2.77Å; R326-D1945 IonicContact NH1-OD1 3Å; R326-D1945 PolarHBondContact NH1-OD1 2.93Å; R326-D1945 IonicContact NH2-OD1 3.83Å; D1945-T1956 PolarHBondContact N-O 3.2Å; D1945-T1956 PolarHBondContact O-N 2.7Å
1946	T	86.3	Confident	85.1	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	160.5	158.7	-61.3	0	0	0	0	110.6	T238 I239 N240 E241 E1948 T1953 I1954 R1955	T238-T1946 WeakPolarHBondContact CG2-OG1 3.44Å; I239-T1946 VanDerWaalsContact O-CB 3.32Å; I239-T1946 WeakPolarHBondContact O-CB 3.25Å; I239-T1946 PolarHBondContact O-N 3.46Å; I239-T1946 VanDerWaalsContact O-N 3.14Å; N240-T1946 VanDerWaalsContact C-C 3.45Å; N240-T1946 CarbonylContact C-O 3.52Å; N240-T1946 VanDerWaalsContact C-O 3.24Å; N240-T1946 HydrophobicContact CB-CG2 3.37Å; N240-T1946 CarbonylContact O-C 3.59Å; N240-T1946 VanDerWaalsContact O-CB 3.29Å; N240-T1946 WeakPolarHBondContact O-CB 3Å; N240-T1946 WeakPolarHBondContact O-CG2 3.26Å; N240-T1946 PolarHBondContact OD1-OG1 3.14Å; E241-T1946 WeakPolarHBondContact CA-O 3.45Å; E241-T1946 PolarHBondContact N-O 3.36Å; T1946-E1948 HydrophobicContact CG2-CG 4.49Å; T1946-T1953 HydrophobicContact CG2-CG2 3.21Å; T1946-I1954 CarbonylContact C-O 3.58Å; T1946-I1954 WeakPolarHBondContact CA-O 3.47Å; T1946-I1954 WeakPolarHBondContact CG2-O 3.5Å; T1946-R1955 HydrophobicContact CG2-CB 3.96Å; T1946-R1955 HydrophobicContact CG2-CG 3.54Å; T1946-R1955 WeakPolarHBondContact OG1-CA 3.3Å; T1946-R1955 VanDerWaalsContact OG1-CB 3.24Å; T1946-R1955 WeakPolarHBondContact OG1-CB 3.34Å
1947	I	83	Confident	86.4	Confident	32 Å²	32	24 Å²	24	16%	0.164	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	86.4	175.6	-55.9	-178.8	0	0	0	110.9	N240 E241 L1949 T1953 I1954	N240-I1947 CarbonylContact O-C 3.54Å; N240-I1947 VanDerWaalsContact O-CA 3.25Å; N240-I1947 WeakPolarHBondContact O-CA 3.21Å; N240-I1947 PolarHBondContact O-N 2.71Å; E241-I1947 VanDerWaalsContact OE1-CA 3.24Å; E241-I1947 WeakPolarHBondContact OE1-CA 3.43Å; E241-I1947 WeakPolarHBondContact OE1-CG2 3.39Å; I1947-L1949 HydrophobicContact CG2-CD1 4.2Å; I1947-L1949 HydrophobicContact CG2-CD2 4.3Å; I1947-L1949 HydrophobicContact CG2-CG 4.16Å; I1947-T1953 CarbonylContact O-C 3.52Å; I1947-T1953 VanDerWaalsContact O-CA 3.3Å; I1947-T1953 WeakPolarHBondContact O-CA 3.37Å; I1947-I1954 HydrophobicContact CB-CB 4.1Å; I1947-I1954 HydrophobicContact CB-CD1 4.23Å; I1947-I1954 HydrophobicContact CB-CG1 4.33Å; I1947-I1954 HydrophobicContact CG2-CD1 4.27Å; I1947-I1954 PolarHBondContact N-O 3.44Å; I1947-I1954 PolarHBondContact O-N 3.31Å
1948	E	81.7	Confident	87.7	Confident	5 Å²	5	25.9 Å²	25.9	2%	0.023	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	129.2	167.2	-0.1	-169.4	110.3	0	0	115.8	N240 E241 R259 H298 T1946 Y1952 T1953 R1955	N240-E1948 HydrophobicContact CB-CG 3.24Å; N240-E1948 WeakPolarHBondContact CB-OE1 3.35Å; N240-E1948 PolarHBondContact ND2-OE1 3.24Å; N240-E1948 VanDerWaalsContact O-CG 3.32Å; N240-E1948 WeakPolarHBondContact O-CG 3.43Å; N240-E1948 PolarHBondContact O-N 2.91Å; E241-E1948 HydrophobicContact CG-CG 4.47Å; E241-E1948 WeakPolarHBondContact CG-O 3.2Å; E241-E1948 VanDerWaalsContact OE1-C 3.28Å; E241-E1948 PolarHBondContact OE1-N 2.89Å; E241-E1948 VanDerWaalsContact OE1-N 3.08Å; R259-E1948 HydrophobicContact CB-CG 3.72Å; R259-E1948 WeakPolarHBondContact CB-OE2 3.44Å; R259-E1948 WeakPolarHBondContact CD-O 3.32Å; R259-E1948 HydrophobicContact CG-CG 4.36Å; R259-E1948 VanDerWaalsContact NH1-C 3.29Å; R259-E1948 PolarHBondContact NH1-O 3.3Å; H298-E1948 VanDerWaalsContact CE1-CD 3.49Å; H298-E1948 IonicContact CE1-OE1 3.98Å; H298-E1948 PolarHBondContact CE1-OE1 3.08Å; H298-E1948 VanDerWaalsContact CE1-OE1 3.26Å; H298-E1948 IonicContact CE1-OE2 3.82Å; H298-E1948 PolarHBondContact CE1-OE2 2.98Å; H298-E1948 IonicContact ND1-OE1 2.7Å; H298-E1948 IonicContact ND1-OE2 3.76Å; H298-E1948 PolarHBondContact ND1-OE2 3.4Å; H298-E1948 VanDerWaalsContact ND1-OE2 3.17Å; H298-E1948 IonicContact NE2-OE2 2.7Å; T1946-E1948 HydrophobicContact CG2-CG 4.49Å; E1948-Y1952 CarbonylContact C-O 3.59Å; E1948-Y1952 WeakPolarHBondContact CA-O 3.47Å; E1948-T1953 HydrophobicContact CB-CG2 3.78Å; E1948-T1953 WeakPolarHBondContact CB-OG1 3.29Å; E1948-T1953 HydrophobicContact CG-CG2 3.53Å; E1948-T1953 WeakPolarHBondContact OE1-CG2 3.36Å; E1948-R1955 IonicContact OE1-NH2 2.65Å; E1948-R1955 PolarHBondContact OE1-NH2 2.94Å
1949	L	84.5	Confident	88.2	Confident	7 Å²	7	21.9 Å²	21.9	4%	0.037	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	175.9	-175.9	-57.4	177.5	0	0	0	109.7	E241 I1947 Y1951 Y1952 Y2179 R2180	E241-L1949 WeakPolarHBondContact OE1-CD2 3.39Å; I1947-L1949 HydrophobicContact CG2-CD1 4.2Å; I1947-L1949 HydrophobicContact CG2-CD2 4.3Å; I1947-L1949 HydrophobicContact CG2-CG 4.16Å; L1949-Y1951 PolarHBondContact O-N 2.95Å; L1949-Y1952 HydrophobicContact CD1-CD2 4.29Å; L1949-Y1952 HydrophobicContact CD1-CE2 3.57Å; L1949-Y1952 HydrophobicContact CG-CE2 4.49Å; L1949-Y1952 PolarHBondContact N-O 2.81Å; L1949-Y1952 PolarHBondContact O-N 3.49Å; L1949-Y2179 WeakPolarHBondContact CB-O 3.26Å; L1949-Y2179 HydrophobicContact CD1-CE1 4.3Å; L1949-Y2179 HydrophobicContact CD1-CE2 3.81Å; L1949-Y2179 WeakPolarHBondContact CD1-OH 3.31Å; L1949-Y2179 HydrophobicContact CD2-CD1 3.77Å; L1949-Y2179 HydrophobicContact CD2-CE1 3.24Å; L1949-Y2179 HydrophobicContact CD2-CE2 4.09Å; L1949-Y2179 HydrophobicContact CD2-CG 4.38Å; L1949-Y2179 VanDerWaalsContact CD2-CZ 3.4Å; L1949-Y2179 HydrophobicContact CG-CE1 4.39Å; L1949-R2180 CarbonylContact C-O 3.58Å; L1949-R2180 HydrophobicContact CD2-CG 4.1Å
1950	A	82.1	Confident	88.3	Confident	5 Å²	5	23.5 Å²	23.5	4%	0.041	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-22.1	-169.1	0	0	0	0	0	115.3	S2178 Y2179 R2180 R2182	A1950-S2178 WeakPolarHBondContact CB-O 3.31Å; A1950-Y2179 PolarHBondContact N-O 2.8Å; A1950-R2180 WeakPolarHBondContact CA-O 3.39Å; A1950-R2180 PolarHBondContact N-O 2.79Å; A1950-R2182 HydrophobicContact CB-CG 4.34Å; A1950-R2182 VanDerWaalsContact O-CD 3.28Å; A1950-R2182 WeakPolarHBondContact O-CD 3.21Å; A1950-R2182 VanDerWaalsContact O-CG 3.25Å; A1950-R2182 WeakPolarHBondContact O-CG 3.45Å
1951	Y	86.7	Confident	88	Confident	19 Å²	19	20.7 Å²	20.7	8%	0.075	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.5	-3.4	-178.1	-51.6	-81.5	0	0	0	114.8	L1949 F1976 T1977 G1978 Y1987 P1990 D2177 M2349	L1949-Y1951 PolarHBondContact O-N 2.95Å; Y1951-F1976 WeakPolarHBondContact O-CD2 3.32Å; Y1951-T1977 PolarHBondContact O-N 2.92Å; Y1951-T1977 PolarHBondContact O-OG1 3.07Å; Y1951-G1978 PolarHBondContact O-N 3.15Å; Y1951-Y1987 PolarHBondContact OH-OH 3.37Å; Y1951-P1990 HydrophobicContact CD1-CB 3.98Å; Y1951-P1990 HydrophobicContact CD1-CG 3.97Å; Y1951-P1990 HydrophobicContact CD2-CB 3.8Å; Y1951-P1990 HydrophobicContact CD2-CG 3.94Å; Y1951-P1990 HydrophobicContact CE1-CG 4.03Å; Y1951-P1990 HydrophobicContact CE2-CB 4.38Å; Y1951-P1990 HydrophobicContact CE2-CG 4.01Å; Y1951-P1990 HydrophobicContact CG-CB 3.58Å; Y1951-P1990 HydrophobicContact CG-CG 3.93Å; Y1951-D2177 PolarHBondContact OH-OD2 3.5Å; Y1951-M2349 HydrophobicContact CE2-CE 4.45Å; Y1951-M2349 HydrophobicContact CE2-SD 3.86Å
1952	Y	88.7	Confident	87.1	Confident	11 Å²	11	29.6 Å²	29.6	4%	0.043	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	166.6	-178.7	59.3	-96.5	0	0	0	115	E1948 L1949 I1954 Q1975 T1977 F1994 R1997	E1948-Y1952 CarbonylContact C-O 3.59Å; E1948-Y1952 WeakPolarHBondContact CA-O 3.47Å; L1949-Y1952 HydrophobicContact CD1-CD2 4.29Å; L1949-Y1952 HydrophobicContact CD1-CE2 3.57Å; L1949-Y1952 HydrophobicContact CG-CE2 4.49Å; L1949-Y1952 PolarHBondContact N-O 2.81Å; L1949-Y1952 PolarHBondContact O-N 3.49Å; Y1952-I1954 HydrophobicContact CD2-CG1 4.1Å; Y1952-I1954 HydrophobicContact CE2-CD1 4.14Å; Y1952-I1954 HydrophobicContact CE2-CG1 4.16Å; Y1952-Q1975 CarbonylContact C-O 3.57Å; Y1952-Q1975 WeakPolarHBondContact CA-O 3.47Å; Y1952-Q1975 WeakPolarHBondContact CB-O 3.44Å; Y1952-T1977 PolarHBondContact N-OG1 3.29Å; Y1952-F1994 HydrophobicContact CD1-CB 3.93Å; Y1952-F1994 AromaticContact CD1-CD2 3.96Å; Y1952-F1994 HydrophobicContact CD1-CD2 3.96Å; Y1952-F1994 HydrophobicContact CD1-CG 4.44Å; Y1952-F1994 AromaticContact CD2-CD2 3.86Å; Y1952-F1994 HydrophobicContact CD2-CD2 3.86Å; Y1952-F1994 HydrophobicContact CE1-CB 4.19Å; Y1952-F1994 HydrophobicContact CG-CB 4.35Å; Y1952-F1994 AromaticContact CG-CD2 3.5Å; Y1952-F1994 HydrophobicContact CG-CD2 3.5Å; Y1952-F1994 VanDerWaalsContact CG-CD2 3.5Å; Y1952-F1994 HydrophobicContact CG-CE2 4.26Å; Y1952-F1994 HydrophobicContact CG-CG 4.39Å; Y1952-R1997 HydrophobicContact CE2-CG 4.33Å
1953	T	88.8	Confident	86.2	Confident	2 Å²	2	27.7 Å²	27.7	1%	0.012	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	125.1	-176.8	-47.8	0	0	0	0	112.6	N240 T1946 I1947 E1948 R1955 F1974 Q1975	N240-T1953 HydrophobicContact CB-CG2 4.49Å; T1946-T1953 HydrophobicContact CG2-CG2 3.21Å; I1947-T1953 CarbonylContact O-C 3.52Å; I1947-T1953 VanDerWaalsContact O-CA 3.3Å; I1947-T1953 WeakPolarHBondContact O-CA 3.37Å; E1948-T1953 HydrophobicContact CB-CG2 3.78Å; E1948-T1953 WeakPolarHBondContact CB-OG1 3.29Å; E1948-T1953 HydrophobicContact CG-CG2 3.53Å; E1948-T1953 WeakPolarHBondContact OE1-CG2 3.36Å; T1953-R1955 HydrophobicContact CG2-CG 4.19Å; T1953-R1955 VanDerWaalsContact CG2-NH2 3.26Å; T1953-F1974 CarbonylContact O-C 3.55Å; T1953-F1974 WeakPolarHBondContact O-CA 3.38Å; T1953-Q1975 PolarHBondContact N-O 2.65Å; T1953-Q1975 PolarHBondContact O-N 3.36Å
1954	I	90.7	Very high	85.4	Confident	7 Å²	7	30.6 Å²	30.6	4%	0.036	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	97.9	-179.2	-40.5	168.5	0	0	0	110.8	T1946 I1947 Y1952 H1973 F1974 R1997	T1946-I1954 CarbonylContact C-O 3.58Å; T1946-I1954 WeakPolarHBondContact CA-O 3.47Å; T1946-I1954 WeakPolarHBondContact CG2-O 3.5Å; I1947-I1954 HydrophobicContact CB-CB 4.1Å; I1947-I1954 HydrophobicContact CB-CD1 4.23Å; I1947-I1954 HydrophobicContact CB-CG1 4.33Å; I1947-I1954 HydrophobicContact CG2-CD1 4.27Å; I1947-I1954 PolarHBondContact N-O 3.44Å; I1947-I1954 PolarHBondContact O-N 3.31Å; Y1952-I1954 HydrophobicContact CD2-CG1 4.1Å; Y1952-I1954 HydrophobicContact CE2-CD1 4.14Å; Y1952-I1954 HydrophobicContact CE2-CG1 4.16Å; I1954-H1973 CarbonylContact C-O 3.56Å; I1954-H1973 WeakPolarHBondContact CA-O 3.44Å; I1954-F1974 HydrophobicContact CB-CD1 4.15Å; I1954-F1974 HydrophobicContact CB-CE1 4.14Å; I1954-F1974 HydrophobicContact CD1-CD1 4.26Å; I1954-F1974 HydrophobicContact CD1-CE1 3.92Å; I1954-F1974 HydrophobicContact CG1-CD1 3.73Å; I1954-F1974 HydrophobicContact CG1-CE1 3.83Å; I1954-F1974 HydrophobicContact CG2-CD1 3.63Å; I1954-F1974 HydrophobicContact CG2-CD2 4.32Å; I1954-F1974 HydrophobicContact CG2-CE1 3.3Å; I1954-F1974 HydrophobicContact CG2-CE2 4.05Å; I1954-F1974 HydrophobicContact CG2-CG 4.12Å; I1954-F1974 HydrophobicContact CG2-CZ 3.51Å; I1954-R1997 HydrophobicContact CD1-CG 3.61Å
1955	R	93.3	Very high	84.3	Confident	4 Å²	4	35.1 Å²	35.1	2%	0.015	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	155	178	-32.2	-150.4	155.2	76.4	9.5	110.9	N240 W1926 T1946 E1948 T1953 F1957 K1972 H1973 Q1975	N240-R1955 PolarHBondContact ND2-NE 2.75Å; N240-R1955 PolarHBondContact ND2-NH2 2.77Å; W1926-R1955 VanDerWaalsContact CE2-NH1 3.33Å; T1946-R1955 HydrophobicContact CG2-CB 3.96Å; T1946-R1955 HydrophobicContact CG2-CG 3.54Å; T1946-R1955 WeakPolarHBondContact OG1-CA 3.3Å; T1946-R1955 VanDerWaalsContact OG1-CB 3.24Å; T1946-R1955 WeakPolarHBondContact OG1-CB 3.34Å; E1948-R1955 IonicContact OE1-NH2 2.65Å; E1948-R1955 PolarHBondContact OE1-NH2 2.94Å; T1953-R1955 HydrophobicContact CG2-CG 4.19Å; T1953-R1955 VanDerWaalsContact CG2-NH2 3.26Å; R1955-F1957 HydrophobicContact CB-CE1 4.41Å; R1955-F1957 HydrophobicContact CB-CE2 3.72Å; R1955-F1957 HydrophobicContact CB-CZ 3.56Å; R1955-F1957 HydrophobicContact CG-CZ 4.22Å; R1955-K1972 CarbonylContact O-C 3.57Å; R1955-K1972 WeakPolarHBondContact O-CA 3.2Å; R1955-H1973 HydrophobicContact CB-CB 4.02Å; R1955-H1973 HydrophobicContact CG-CB 4.3Å; R1955-H1973 PolarHBondContact N-O 3.33Å; R1955-H1973 PolarHBondContact NH1-CE1 3.29Å; R1955-H1973 PolarHBondContact O-N 3.04Å; R1955-Q1975 VanDerWaalsContact CZ-OE1 3.31Å
1956	T	92.1	Very high	83.5	Confident	9 Å²	9	41.9 Å²	41.9	6%	0.055	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	125.8	172.3	-53	0	0	0	0	109.1	V1944 D1945 E1970 K1972	V1944-T1956 HydrophobicContact CB-CG2 4.31Å; V1944-T1956 WeakPolarHBondContact CB-O 3.2Å; V1944-T1956 PolarHBondContact N-O 2.88Å; D1945-T1956 PolarHBondContact N-O 3.2Å; D1945-T1956 PolarHBondContact O-N 2.7Å; T1956-E1970 HydrophobicContact CG2-CG 3.54Å; T1956-K1972 HydrophobicContact CG2-CG 4.3Å
1957	F	94.2	Very high	83.2	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	145.4	176.7	-53.4	-74.1	0	0	0	110.7	W1897 W1926 P1927 V1941 K1942 P1943 R1955 L1959 E1970 V1971 H1973	W1897-F1957 AromaticContact CH2-CD2 3.9Å; W1897-F1957 HydrophobicContact CH2-CD2 3.9Å; W1897-F1957 HydrophobicContact CH2-CE2 4.35Å; W1897-F1957 HydrophobicContact CH2-CG 4.3Å; W1926-F1957 HydrophobicContact CB-CE1 3.8Å; W1926-F1957 HydrophobicContact CB-CE2 3.91Å; W1926-F1957 HydrophobicContact CB-CZ 3.39Å; W1926-F1957 AromaticContact CD1-CE1 3.87Å; W1926-F1957 AromaticContact CD1-CZ 3.34Å; W1926-F1957 HydrophobicContact CG-CE1 4.22Å; W1926-F1957 HydrophobicContact CG-CE2 4.3Å; W1926-F1957 AromaticContact CG-CZ 3.59Å; W1926-F1957 HydrophobicContact CG-CZ 3.59Å; P1927-F1957 WeakPolarHBondContact O-CE1 3.38Å; V1941-F1957 HydrophobicContact CG1-CB 4.01Å; V1941-F1957 HydrophobicContact CG1-CD1 4.07Å; V1941-F1957 HydrophobicContact CG1-CG 4.11Å; K1942-F1957 CarbonylContact O-C 3.51Å; K1942-F1957 VanDerWaalsContact O-CA 3.24Å; K1942-F1957 WeakPolarHBondContact O-CA 3.32Å; P1943-F1957 HydrophobicContact CB-CD1 4.09Å; P1943-F1957 HydrophobicContact CB-CE1 4.09Å; R1955-F1957 HydrophobicContact CB-CE1 4.41Å; R1955-F1957 HydrophobicContact CB-CE2 3.72Å; R1955-F1957 HydrophobicContact CB-CZ 3.56Å; R1955-F1957 HydrophobicContact CG-CZ 4.22Å; F1957-L1959 HydrophobicContact CB-CD1 3.85Å; F1957-E1970 CarbonylContact O-C 3.07Å; F1957-E1970 WeakPolarHBondContact O-CA 3.5Å; F1957-V1971 PolarHBondContact N-O 3.03Å; F1957-V1971 PolarHBondContact O-N 3.46Å; F1957-H1973 HydrophobicContact CD2-CB 4.25Å; F1957-H1973 HydrophobicContact CE2-CB 3.6Å
1958	H	92.4	Very high	83.3	Confident	59 Å²	59	46.7 Å²	46.7	27%	0.273	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	128.8	160.3	-78.8	-169.5	0	0	0	108.8	K1942 V1944 C1968 R1969	K1942-H1958 HydrophobicContact CB-CB 4.44Å; K1942-H1958 PolarHBondContact N-O 2.95Å; K1942-H1958 PolarHBondContact O-N 3.35Å; V1944-H1958 HydrophobicContact CG2-CB 4.01Å; H1958-C1968 PolarHBondContact ND1-SG 3.35Å; H1958-R1969 CarbonylContact C-O 3.39Å; H1958-R1969 WeakPolarHBondContact CA-O 3.25Å
1959	L	91.3	Very high	83.7	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	132.3	172.8	-78.6	56.8	0	0	0	108.3	W1897 I1900 W1901 L1940 V1941 F1957 C1968 R1969 V1971	W1897-L1959 HydrophobicContact CE3-CD1 4.26Å; W1897-L1959 HydrophobicContact CE3-CD2 3.8Å; W1897-L1959 HydrophobicContact CE3-CG 4.22Å; W1897-L1959 HydrophobicContact CH2-CD1 4.5Å; W1897-L1959 HydrophobicContact CZ3-CD1 3.79Å; W1897-L1959 HydrophobicContact CZ3-CD2 3.95Å; W1897-L1959 HydrophobicContact CZ3-CG 4.23Å; I1900-L1959 HydrophobicContact CB-CD2 4.27Å; I1900-L1959 HydrophobicContact CG2-CD2 3.65Å; W1901-L1959 HydrophobicContact CE3-CB 4.01Å; W1901-L1959 HydrophobicContact CE3-CD2 4.43Å; W1901-L1959 HydrophobicContact CZ3-CB 4.08Å; L1940-L1959 WeakPolarHBondContact O-CA 3.2Å; V1941-L1959 HydrophobicContact CG1-CD1 4.08Å; V1941-L1959 HydrophobicContact CG2-CG 4.28Å; F1957-L1959 HydrophobicContact CB-CD1 3.85Å; L1959-C1968 WeakPolarHBondContact O-CA 3.47Å; L1959-R1969 PolarHBondContact N-O 2.83Å; L1959-R1969 PolarHBondContact O-N 3.32Å; L1959-V1971 HydrophobicContact CD1-CB 4.07Å; L1959-V1971 HydrophobicContact CD1-CG2 3.68Å; L1959-V1971 HydrophobicContact CD2-CG2 3.87Å; L1959-V1971 HydrophobicContact CG-CG2 4.32Å
1960	T	88.6	Confident	84	Confident	42 Å²	42	52.7 Å²	52.7	26%	0.258	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	143.2	164.3	55.3	0	0	0	0	110	L1940 C1968	L1940-T1960 PolarHBondContact N-O 2.73Å; L1940-T1960 PolarHBondContact O-N 2.77Å; T1960-C1968 HydrophobicContact CG2-CB 3.84Å
1961	A	82.2	Confident	84.5	Confident	8 Å²	8	52.5 Å²	52.5	7%	0.066	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	137.1	174.4	0	0	0	0	0	111.1	W1901 L1938 L1939 G1963 I1964	W1901-A1961 HydrophobicContact CD2-CB 4.21Å; W1901-A1961 HydrophobicContact CH2-CB 3.8Å; W1901-A1961 HydrophobicContact CZ2-CB 3.39Å; W1901-A1961 HydrophobicContact CZ3-CB 4.35Å; L1938-A1961 CarbonylContact O-C 3.5Å; L1938-A1961 WeakPolarHBondContact O-CA 3.43Å; L1939-A1961 HydrophobicContact CD2-CB 3.89Å; A1961-G1963 PolarHBondContact O-N 2.83Å; A1961-I1964 HydrophobicContact CB-CB 4.22Å; A1961-I1964 HydrophobicContact CB-CD1 4.24Å; A1961-I1964 HydrophobicContact CB-CG1 4.27Å; A1961-I1964 CarbonylContact O-C 3.44Å; A1961-I1964 PolarHBondContact O-N 3.45Å
1962	R	72.6	Confident	84.8	Confident	186 Å²	186	54.2 Å²	54.2	70%	0.702	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	117.7	178.3	-174.9	176.1	178.2	-169.2	-0.2	109.7	G1937 L1938	G1937-R1962 WeakPolarHBondContact O-CB 3.49Å; G1937-R1962 WeakPolarHBondContact O-CD 3.46Å; L1938-R1962 PolarHBondContact O-N 3.4Å
1963	G	69.1	Low	85.2	Confident	69 Å²	69	53.7 Å²	53.7	71%	0.711	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.2	-1.8	-171.5	0	0	0	0	0	114.6	A1961	A1961-G1963 PolarHBondContact O-N 2.83Å
1964	I	75.5	Confident	85.5	Confident	80 Å²	80	53.6 Å²	53.6	41%	0.41	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	56.5	170.3	-40.1	178.5	0	0	0	108.1	W1901 A1961 D1966 E1967	W1901-I1964 HydrophobicContact CZ2-CD1 4.32Å; A1961-I1964 HydrophobicContact CB-CB 4.22Å; A1961-I1964 HydrophobicContact CB-CD1 4.24Å; A1961-I1964 HydrophobicContact CB-CG1 4.27Å; A1961-I1964 CarbonylContact O-C 3.44Å; A1961-I1964 PolarHBondContact O-N 3.45Å; I1964-D1966 PolarHBondContact O-N 3.26Å; I1964-E1967 HydrophobicContact CG2-CB 3.61Å; I1964-E1967 PolarHBondContact O-N 3.2Å
1965	E	61.7	Low	85.8	Confident	161 Å²	161	53.7 Å²	53.7	75%	0.752	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	-21.2	-170.3	-61.5	-172.6	178.6	0	0	113.3	E1967	E1965-E1967 VanDerWaalsContact C-N 3.32Å
1966	D	68.7	Low	85.9	Confident	172 Å²	172	53.6 Å²	53.6	92%	0.92	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	-18.4	172.2	-61.1	-52.5	0	0	0	113.5	I1964	I1964-D1966 PolarHBondContact O-N 3.26Å
1967	E	80.5	Confident	85.8	Confident	65 Å²	65	54.4 Å²	54.4	30%	0.304	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	100.1	-179.6	-165.9	176.4	-162	0	0	111.7	W1901 I1964 E1965 R1969	W1901-E1967 HydrophobicContact CH2-CB 4.08Å; W1901-E1967 HydrophobicContact CH2-CG 3.89Å; W1901-E1967 WeakPolarHBondContact CH2-O 3.32Å; W1901-E1967 HydrophobicContact CZ2-CG 4.38Å; W1901-E1967 VanDerWaalsContact CZ2-OE2 3.3Å; W1901-E1967 WeakPolarHBondContact CZ2-OE2 3.35Å; I1964-E1967 HydrophobicContact CG2-CB 3.61Å; I1964-E1967 PolarHBondContact O-N 3.2Å; E1965-E1967 VanDerWaalsContact C-N 3.32Å; E1967-R1969 VanDerWaalsContact CD-NE 3.27Å; E1967-R1969 HydrophobicContact CG-CG 4.16Å; E1967-R1969 IonicContact OE1-CZ 3.47Å; E1967-R1969 IonicContact OE1-NE 2.72Å; E1967-R1969 PolarHBondContact OE1-NE 2.89Å; E1967-R1969 IonicContact OE1-NH2 3.33Å; E1967-R1969 PolarHBondContact OE1-NH2 2.84Å; E1967-R1969 IonicContact OE2-CZ 3.63Å; E1967-R1969 IonicContact OE2-NE 3.64Å; E1967-R1969 IonicContact OE2-NH2 2.72Å; E1967-R1969 PolarHBondContact OE2-NH2 2.81Å
1968	C	84.1	Confident	85.4	Confident	67 Å²	67	55.3 Å²	55.3	45%	0.453	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	121	170.8	-179.4	0	0	0	0	110.2	H1958 L1959 T1960	H1958-C1968 PolarHBondContact ND1-SG 3.35Å; L1959-C1968 WeakPolarHBondContact O-CA 3.47Å; T1960-C1968 HydrophobicContact CG2-CB 3.84Å
1969	R	89.5	Confident	85.3	Confident	41 Å²	41	52.6 Å²	52.6	16%	0.155	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	129.4	-178.9	-59.9	-171.3	-171.1	146.9	7.9	112	W1901 H1958 L1959 E1967	W1901-R1969 HydrophobicContact CH2-CG 4.32Å; W1901-R1969 HydrophobicContact CZ3-CB 4.4Å; W1901-R1969 HydrophobicContact CZ3-CG 3.95Å; W1901-R1969 PolarHBondContact O-NH1 3.48Å; H1958-R1969 CarbonylContact C-O 3.39Å; H1958-R1969 WeakPolarHBondContact CA-O 3.25Å; L1959-R1969 PolarHBondContact N-O 2.83Å; L1959-R1969 PolarHBondContact O-N 3.32Å; E1967-R1969 VanDerWaalsContact CD-NE 3.27Å; E1967-R1969 HydrophobicContact CG-CG 4.16Å; E1967-R1969 IonicContact OE1-CZ 3.47Å; E1967-R1969 IonicContact OE1-NE 2.72Å; E1967-R1969 PolarHBondContact OE1-NE 2.89Å; E1967-R1969 IonicContact OE1-NH2 3.33Å; E1967-R1969 PolarHBondContact OE1-NH2 2.84Å; E1967-R1969 IonicContact OE2-CZ 3.63Å; E1967-R1969 IonicContact OE2-NE 3.64Å; E1967-R1969 IonicContact OE2-NH2 2.72Å; E1967-R1969 PolarHBondContact OE2-NH2 2.81Å
1970	E	90.6	Very high	84.7	Confident	97 Å²	97	54.5 Å²	54.5	45%	0.453	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	131.9	171.3	-169.5	-176.4	102.1	0	0	110.5	T1956 F1957 K1972	T1956-E1970 HydrophobicContact CG2-CG 3.54Å; F1957-E1970 CarbonylContact O-C 3.07Å; F1957-E1970 WeakPolarHBondContact O-CA 3.5Å; E1970-K1972 WeakPolarHBondContact OE1-CE 3.42Å; E1970-K1972 IonicContact OE1-NZ 2.72Å; E1970-K1972 PolarHBondContact OE1-NZ 3.35Å
1971	V	93.1	Very high	83.4	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.006	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	118.5	178.6	-175.8	0	0	0	0	109.6	I1900 V1905 S1906 I1908 F1957 L1959	I1900-V1971 HydrophobicContact CG2-CG1 3.99Å; I1900-V1971 HydrophobicContact CG2-CG2 3.93Å; V1905-V1971 VanDerWaalsContact O-CG2 3.29Å; V1905-V1971 WeakPolarHBondContact O-CG2 3.32Å; S1906-V1971 CarbonylContact O-C 3.56Å; S1906-V1971 WeakPolarHBondContact O-CA 3.44Å; I1908-V1971 HydrophobicContact CD1-CG1 3.64Å; I1908-V1971 HydrophobicContact CG1-CG1 3.82Å; F1957-V1971 PolarHBondContact N-O 3.03Å; F1957-V1971 PolarHBondContact O-N 3.46Å; L1959-V1971 HydrophobicContact CD1-CB 4.07Å; L1959-V1971 HydrophobicContact CD1-CG2 3.68Å; L1959-V1971 HydrophobicContact CD2-CG2 3.87Å; L1959-V1971 HydrophobicContact CG-CG2 4.32Å
1972	K	93.9	Very high	82.6	Confident	56 Å²	56	60.1 Å²	60.1	24%	0.243	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	138.7	177	-60.5	-164	-166.5	-179.2	0	111.7	S1906 I1907 I1908 R1955 T1956 E1970 F1974 T2001	S1906-K1972 PolarHBondContact O-N 3.03Å; I1907-K1972 CarbonylContact C-O 3.57Å; I1907-K1972 WeakPolarHBondContact CA-O 3.2Å; I1908-K1972 PolarHBondContact N-O 3.17Å; R1955-K1972 CarbonylContact O-C 3.57Å; R1955-K1972 WeakPolarHBondContact O-CA 3.2Å; T1956-K1972 HydrophobicContact CG2-CG 4.3Å; E1970-K1972 WeakPolarHBondContact OE1-CE 3.42Å; E1970-K1972 IonicContact OE1-NZ 2.72Å; E1970-K1972 PolarHBondContact OE1-NZ 3.35Å; K1972-F1974 HydrophobicContact CB-CD2 4.33Å; K1972-F1974 HydrophobicContact CB-CE2 3.53Å; K1972-F1974 HydrophobicContact CB-CZ 4.09Å; K1972-T2001 HydrophobicContact CD-CG2 3.85Å; K1972-T2001 HydrophobicContact CG-CG2 4.43Å
1973	H	96.1	Very high	83	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	103.6	-170.9	167.4	-55.8	0	0	0	110.1	I1908 Y1925 W1926 I1954 R1955 F1957	I1908-H1973 HydrophobicContact CB-CB 4.29Å; I1908-H1973 CarbonylContact O-C 3.5Å; I1908-H1973 WeakPolarHBondContact O-CA 3.2Å; Y1925-H1973 AromaticContact CE2-CD2 3.67Å; Y1925-H1973 AromaticContact CE2-NE2 3.87Å; Y1925-H1973 AromaticContact CZ-CD2 3.66Å; Y1925-H1973 AromaticContact CZ-NE2 3.46Å; Y1925-H1973 PolarHBondContact OH-CD2 3.05Å; Y1925-H1973 PolarHBondContact OH-NE2 3.13Å; W1926-H1973 AromaticContact CD2-NE2 3.63Å; W1926-H1973 AromaticContact CE2-NE2 3.95Å; W1926-H1973 AromaticContact CE3-NE2 3.38Å; W1926-H1973 AromaticContact CZ3-NE2 3.59Å; I1954-H1973 CarbonylContact C-O 3.56Å; I1954-H1973 WeakPolarHBondContact CA-O 3.44Å; R1955-H1973 HydrophobicContact CB-CB 4.02Å; R1955-H1973 HydrophobicContact CG-CB 4.3Å; R1955-H1973 PolarHBondContact N-O 3.33Å; R1955-H1973 PolarHBondContact NH1-CE1 3.29Å; R1955-H1973 PolarHBondContact O-N 3.04Å; F1957-H1973 HydrophobicContact CD2-CB 4.25Å; F1957-H1973 HydrophobicContact CE2-CB 3.6Å
1974	F	96.2	Very high	84	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	105.5	-175.8	-63.2	-101	0	0	0	109.6	I1907 I1908 V1909 M1910 T1953 I1954 K1972 F1994 R1997 V1998 T2001	I1907-F1974 HydrophobicContact CG2-CD2 3.79Å; I1907-F1974 HydrophobicContact CG2-CE2 3.85Å; I1908-F1974 PolarHBondContact O-N 2.94Å; V1909-F1974 CarbonylContact C-O 3.48Å; V1909-F1974 VanDerWaalsContact CA-O 3.27Å; V1909-F1974 WeakPolarHBondContact CA-O 3.35Å; M1910-F1974 PolarHBondContact N-O 2.76Å; T1953-F1974 CarbonylContact O-C 3.55Å; T1953-F1974 WeakPolarHBondContact O-CA 3.38Å; I1954-F1974 HydrophobicContact CB-CD1 4.15Å; I1954-F1974 HydrophobicContact CB-CE1 4.14Å; I1954-F1974 HydrophobicContact CD1-CD1 4.26Å; I1954-F1974 HydrophobicContact CD1-CE1 3.92Å; I1954-F1974 HydrophobicContact CG1-CD1 3.73Å; I1954-F1974 HydrophobicContact CG1-CE1 3.83Å; I1954-F1974 HydrophobicContact CG2-CD1 3.63Å; I1954-F1974 HydrophobicContact CG2-CD2 4.32Å; I1954-F1974 HydrophobicContact CG2-CE1 3.3Å; I1954-F1974 HydrophobicContact CG2-CE2 4.05Å; I1954-F1974 HydrophobicContact CG2-CG 4.12Å; I1954-F1974 HydrophobicContact CG2-CZ 3.51Å; K1972-F1974 HydrophobicContact CB-CD2 4.33Å; K1972-F1974 HydrophobicContact CB-CE2 3.53Å; K1972-F1974 HydrophobicContact CB-CZ 4.09Å; F1974-F1994 HydrophobicContact CB-CE2 3.58Å; F1974-F1994 HydrophobicContact CB-CZ 3.7Å; F1974-F1994 VanDerWaalsContact O-CZ 3.29Å; F1974-F1994 WeakPolarHBondContact O-CZ 3.29Å; F1974-R1997 HydrophobicContact CE1-CG 4.17Å; F1974-V1998 HydrophobicContact CB-CG2 3.78Å; F1974-V1998 HydrophobicContact CD1-CG2 3.62Å; F1974-V1998 HydrophobicContact CD2-CG2 3.98Å; F1974-V1998 HydrophobicContact CE1-CG2 4.2Å; F1974-V1998 HydrophobicContact CG-CG2 3.53Å; F1974-T2001 HydrophobicContact CZ-CG2 4.41Å; F1974-T2001 WeakPolarHBondContact CZ-OG1 3.37Å
1975	Q	96.7	Very high	84.4	Confident	9 Å²	9	48.1 Å²	48.1	4%	0.042	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	117.9	176.4	175.6	176.4	17.1	0	0	111.4	M1910 T1912 Y1952 T1953 R1955 T1977	M1910-Q1975 HydrophobicContact CB-CB 3.91Å; M1910-Q1975 HydrophobicContact CB-CG 4.11Å; M1910-Q1975 HydrophobicContact CG-CB 4.15Å; M1910-Q1975 HydrophobicContact CG-CG 3.8Å; M1910-Q1975 CarbonylContact O-C 3.47Å; M1910-Q1975 WeakPolarHBondContact O-CA 3.36Å; M1910-Q1975 HydrophobicContact SD-CB 4.12Å; M1910-Q1975 HydrophobicContact SD-CG 3.71Å; M1910-Q1975 PolarHBondContact SD-NE2 3.47Å; T1912-Q1975 WeakPolarHBondContact O-CG 3.18Å; T1912-Q1975 PolarHBondContact O-NE2 2.71Å; Y1952-Q1975 CarbonylContact C-O 3.57Å; Y1952-Q1975 WeakPolarHBondContact CA-O 3.47Å; Y1952-Q1975 WeakPolarHBondContact CB-O 3.44Å; T1953-Q1975 PolarHBondContact N-O 2.65Å; T1953-Q1975 PolarHBondContact O-N 3.36Å; R1955-Q1975 VanDerWaalsContact CZ-OE1 3.31Å; Q1975-T1977 HydrophobicContact CG-CG2 3.97Å; Q1975-T1977 PolarHBondContact O-N 2.96Å
1976	F	95.3	Very high	85.2	Confident	1 Å²	1	46.1 Å²	46.1	0%	0.004	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	111.6	172.4	-170.1	-107.1	0	0	0	110.6	M1910 M1911 T1912 Y1951 W1979 P1985 P1990 L1991 F1994	M1910-F1976 PolarHBondContact O-N 3Å; M1911-F1976 HydrophobicContact CE-CB 3.92Å; M1911-F1976 HydrophobicContact CE-CD1 3.79Å; M1911-F1976 HydrophobicContact CE-CG 4.02Å; M1911-F1976 HydrophobicContact SD-CB 3.74Å; M1911-F1976 HydrophobicContact SD-CG 4.41Å; T1912-F1976 PolarHBondContact N-O 3.28Å; Y1951-F1976 WeakPolarHBondContact O-CD2 3.32Å; F1976-W1979 HydrophobicContact CD1-CB 3.96Å; F1976-W1979 HydrophobicContact CD1-CE3 4.08Å; F1976-W1979 HydrophobicContact CE1-CB 3.93Å; F1976-W1979 HydrophobicContact CE1-CE3 4.02Å; F1976-W1979 VanDerWaalsContact CE1-N 3.34Å; F1976-P1985 HydrophobicContact CE1-CG 4.1Å; F1976-P1985 HydrophobicContact CZ-CG 4.44Å; F1976-P1990 HydrophobicContact CE2-CB 4.03Å; F1976-P1990 HydrophobicContact CZ-CB 4.16Å; F1976-L1991 HydrophobicContact CD1-CD1 4.45Å; F1976-L1991 HydrophobicContact CD2-CD1 4.21Å; F1976-L1991 HydrophobicContact CE2-CB 4.23Å; F1976-L1991 HydrophobicContact CE2-CD1 4.28Å; F1976-L1991 HydrophobicContact CG-CD1 4.31Å; F1976-L1991 HydrophobicContact CZ-CB 4.07Å; F1976-L1991 HydrophobicContact CZ-CD1 4.42Å; F1976-F1994 HydrophobicContact CB-CD1 4.34Å; F1976-F1994 HydrophobicContact CB-CD2 4.39Å; F1976-F1994 HydrophobicContact CB-CE1 3.97Å; F1976-F1994 HydrophobicContact CB-CE2 3.98Å; F1976-F1994 HydrophobicContact CB-CZ 3.74Å; F1976-F1994 HydrophobicContact CD2-CB 4.04Å; F1976-F1994 HydrophobicContact CD2-CD1 4.22Å; F1976-F1994 HydrophobicContact CD2-CD2 4.15Å; F1976-F1994 AromaticContact CD2-CG 3.91Å; F1976-F1994 HydrophobicContact CD2-CG 3.91Å; F1976-F1994 HydrophobicContact CE2-CB 4.42Å
1977	T	90.5	Very high	85.8	Confident	27 Å²	27	39.3 Å²	39.3	17%	0.166	21%	0.21	C	C	.	.			trans	-97.9	-9.6	-179	61.9	0	0	0	0	112.9	R1913 Y1951 Y1952 Q1975 W1979	R1913-T1977 VanDerWaalsContact CZ-O 3.32Å; R1913-T1977 PolarHBondContact NE-O 3.46Å; R1913-T1977 PolarHBondContact NH2-O 3Å; Y1951-T1977 PolarHBondContact O-N 2.92Å; Y1951-T1977 PolarHBondContact O-OG1 3.07Å; Y1952-T1977 PolarHBondContact N-OG1 3.29Å; Q1975-T1977 HydrophobicContact CG-CG2 3.97Å; Q1975-T1977 PolarHBondContact O-N 2.96Å; T1977-W1979 VanDerWaalsContact C-N 3.35Å; T1977-W1979 PolarHBondContact O-N 3Å
1978	G	85.5	Confident	86.2	Confident	18 Å²	18	37 Å²	37	19%	0.186	20%	0.201	C	C	.	.			trans	-77.1	-6.1	-178.7	0	0	0	0	0	116.3	Y1951	Y1951-G1978 PolarHBondContact O-N 3.15Å
1979	W	89.2	Confident	86.3	Confident	3 Å²	3	34 Å²	34	1%	0.011	18%	0.18	C	C	.	.	S	Bend	trans	-79	131.8	178.7	-150.8	-60.9	0	0	0	111.2	M1911 F1976 T1977 G1983 V1984 P1985 L1991 R2031 A2034 Q2073 F2076	M1911-W1979 HydrophobicContact CE-CE3 3.62Å; M1911-W1979 HydrophobicContact CE-CZ3 3.67Å; F1976-W1979 HydrophobicContact CD1-CB 3.96Å; F1976-W1979 HydrophobicContact CD1-CE3 4.08Å; F1976-W1979 HydrophobicContact CE1-CB 3.93Å; F1976-W1979 HydrophobicContact CE1-CE3 4.02Å; F1976-W1979 VanDerWaalsContact CE1-N 3.34Å; T1977-W1979 VanDerWaalsContact C-N 3.35Å; T1977-W1979 PolarHBondContact O-N 3Å; W1979-G1983 PolarHBondContact NE1-O 3.27Å; W1979-V1984 HydrophobicContact CZ2-CB 4.47Å; W1979-V1984 HydrophobicContact CZ2-CG1 3.97Å; W1979-P1985 HydrophobicContact CD2-CG 4.05Å; W1979-P1985 HydrophobicContact CE3-CG 4.17Å; W1979-P1985 HydrophobicContact CG-CG 4.27Å; W1979-L1991 HydrophobicContact CZ3-CD2 4.02Å; W1979-R2031 HydrophobicContact CD2-CB 4.31Å; W1979-R2031 HydrophobicContact CD2-CG 3.76Å; W1979-R2031 HydrophobicContact CE3-CB 4.16Å; W1979-R2031 HydrophobicContact CE3-CG 4.13Å; W1979-R2031 HydrophobicContact CG-CG 4.24Å; W1979-R2031 VanDerWaalsContact CG-NE 3.28Å; W1979-R2031 HydrophobicContact CH2-CB 4.25Å; W1979-R2031 HydrophobicContact CH2-CG 4.26Å; W1979-R2031 HydrophobicContact CZ2-CB 4.37Å; W1979-R2031 HydrophobicContact CZ2-CG 3.88Å; W1979-R2031 HydrophobicContact CZ3-CB 4.13Å; W1979-R2031 HydrophobicContact CZ3-CG 4.36Å; W1979-A2034 HydrophobicContact CH2-CB 3.74Å; W1979-A2034 HydrophobicContact CZ3-CB 4.44Å; W1979-Q2073 HydrophobicContact CZ2-CG 4.19Å; W1979-F2076 HydrophobicContact CH2-CD1 4.15Å; W1979-F2076 HydrophobicContact CH2-CE1 4.07Å; W1979-F2076 HydrophobicContact CZ3-CE1 4.27Å
1980	P	79.3	Confident	86.1	Confident	42 Å²	42	32.2 Å²	32.2	27%	0.273	17%	0.174	S	C	.	.			trans	-75.3	154.7	177.3	29.3	-35.5	0	0	0	113.9	H1982 V1984 R2031	P1980-H1982 WeakPolarHBondContact CG-O 3.5Å; P1980-H1982 PolarHBondContact O-N 3.29Å; P1980-V1984 VanDerWaalsContact CG-O 3.27Å; P1980-V1984 WeakPolarHBondContact CG-O 3.21Å; P1980-R2031 PolarHBondContact O-NH2 3.26Å
1981	D	62	Low	86.1	Confident	38 Å²	38	27.7 Å²	27.7	20%	0.203	15%	0.153	C	C	.	.	S	Bend	trans	-56.1	-25.6	-178.6	-54.8	32.9	0	0	0	113.9	E1916 R1917	E1916-D1981 VanDerWaalsContact C-OD2 3.31Å; E1916-D1981 WeakPolarHBondContact CA-OD2 3.24Å; E1916-D1981 HydrophobicContact CB-CB 4.01Å; R1917-D1981 HydrophobicContact CG-CB 4.31Å; R1917-D1981 WeakPolarHBondContact CG-OD2 3.32Å; R1917-D1981 PolarHBondContact N-OD2 2.83Å
1982	H	64.7	Low	85.9	Confident	130 Å²	130	27.9 Å²	27.9	60%	0.602	15%	0.154	S	C	*	.	S	Bend	trans	-139.6	147.3	171.9	-68	-113.2	0	0	0	109.3	R1917 P1980	R1917-H1982 VanDerWaalsContact CZ-CD2 3.47Å; R1917-H1982 PolarHBondContact NH1-CD2 3.48Å; R1917-H1982 PolarHBondContact NH1-NE2 2.92Å; P1980-H1982 WeakPolarHBondContact CG-O 3.5Å; P1980-H1982 PolarHBondContact O-N 3.29Å
1983	G	81.3	Confident	85.4	Confident	32 Å²	32	26 Å²	26	33%	0.33	15%	0.147	S	C	.	.	S	Bend	trans	76.1	-147.4	-178.5	0	0	0	0	0	113.7	W1979	W1979-G1983 PolarHBondContact NE1-O 3.27Å
1984	V	89.1	Confident	85.1	Confident	38 Å²	38	26 Å²	26	23%	0.23	15%	0.147	C	C	.	.			trans	-127.8	161.9	-174.8	-67.3	0	0	0	0	110.9	W1979 P1980 E1986 D2072 Q2073 F2076	W1979-V1984 HydrophobicContact CZ2-CB 4.47Å; W1979-V1984 HydrophobicContact CZ2-CG1 3.97Å; P1980-V1984 VanDerWaalsContact CG-O 3.27Å; P1980-V1984 WeakPolarHBondContact CG-O 3.21Å; V1984-E1986 PolarHBondContact O-N 3.02Å; V1984-D2072 HydrophobicContact CG1-CB 3.8Å; V1984-D2072 HydrophobicContact CG2-CB 4.41Å; V1984-Q2073 HydrophobicContact CG1-CG 4.13Å; V1984-F2076 HydrophobicContact CB-CB 3.98Å; V1984-F2076 HydrophobicContact CB-CD1 4.5Å; V1984-F2076 HydrophobicContact CB-CD2 3.92Å; V1984-F2076 HydrophobicContact CB-CG 3.89Å; V1984-F2076 HydrophobicContact CG1-CB 3.84Å; V1984-F2076 HydrophobicContact CG1-CG 4.12Å; V1984-F2076 HydrophobicContact CG2-CB 4.1Å; V1984-F2076 HydrophobicContact CG2-CD2 4.06Å; V1984-F2076 HydrophobicContact CG2-CG 4.28Å
1985	P	85.4	Confident	84.9	Confident	12 Å²	12	26 Å²	26	8%	0.078	15%	0.147	C	C	.	.			trans	-53.8	135.5	171.4	-23.8	33.7	0	0	0	111.5	F1976 W1979 Y1987 F2076	F1976-P1985 HydrophobicContact CE1-CG 4.1Å; F1976-P1985 HydrophobicContact CZ-CG 4.44Å; W1979-P1985 HydrophobicContact CD2-CG 4.05Å; W1979-P1985 HydrophobicContact CE3-CG 4.17Å; W1979-P1985 HydrophobicContact CG-CG 4.27Å; P1985-Y1987 PolarHBondContact O-N 3.04Å; P1985-F2076 HydrophobicContact CB-CE2 3.87Å; P1985-F2076 HydrophobicContact CB-CZ 3.87Å; P1985-F2076 HydrophobicContact CG-CE1 4.29Å; P1985-F2076 HydrophobicContact CG-CE2 4.06Å; P1985-F2076 HydrophobicContact CG-CZ 3.65Å; P1985-F2076 WeakPolarHBondContact O-CE2 3.23Å
1986	E	77.3	Confident	84.4	Confident	119 Å²	119	27.4 Å²	27.4	56%	0.556	15%	0.151	S	C	*	.	S	Bend	trans	-60.2	-20.8	-176.9	-172.5	174.3	-179.8	0	0	113	V1984 S2154	V1984-E1986 PolarHBondContact O-N 3.02Å; E1986-S2154 VanDerWaalsContact OE1-CB 3.22Å; E1986-S2154 WeakPolarHBondContact OE1-CB 3.24Å; E1986-S2154 PolarHBondContact OE1-OG 2.94Å
1987	Y	81.3	Confident	83.9	Confident	30 Å²	30	29.5 Å²	29.5	12%	0.118	16%	0.159	C	C	.	.	S	Bend	trans	-149.7	146	173	45	-84.3	0	0	0	109.9	Y1951 P1985 I1989 P1990 M2349 T2352	Y1951-Y1987 PolarHBondContact OH-OH 3.37Å; P1985-Y1987 PolarHBondContact O-N 3.04Å; Y1987-I1989 HydrophobicContact CD2-CB 4.47Å; Y1987-I1989 PolarHBondContact O-N 3.2Å; Y1987-P1990 HydrophobicContact CD2-CG 4.08Å; Y1987-P1990 HydrophobicContact CE2-CG 3.65Å; Y1987-M2349 HydrophobicContact CE2-CG 4.12Å; Y1987-M2349 HydrophobicContact CE2-SD 4.49Å; Y1987-T2352 HydrophobicContact CD1-CG2 4.2Å; Y1987-T2352 HydrophobicContact CD2-CG2 4.18Å; Y1987-T2352 HydrophobicContact CG-CG2 3.87Å
1988	P	88.5	Confident	83.9	Confident	17 Å²	17	28.2 Å²	28.2	11%	0.11	15%	0.151	C	C	.	.	S	Bend	trans	-79.9	-15.6	-170.6	30.1	-35.8	0	0	0	115.1	L1991 L1992 F2076 A2080 E2083	P1988-L1991 PolarHBondContact O-N 2.95Å; P1988-L1992 HydrophobicContact CB-CD1 4.15Å; P1988-L1992 HydrophobicContact CB-CG 4.5Å; P1988-L1992 HydrophobicContact CG-CD1 4.4Å; P1988-L1992 PolarHBondContact O-N 2.96Å; P1988-L1992 VanDerWaalsContact O-N 3.13Å; P1988-F2076 HydrophobicContact CB-CE2 3.93Å; P1988-F2076 HydrophobicContact CB-CZ 4.06Å; P1988-A2080 HydrophobicContact CB-CB 3.64Å; P1988-A2080 HydrophobicContact CG-CB 4.47Å; P1988-E2083 HydrophobicContact CG-CB 3.82Å; P1988-E2083 HydrophobicContact CG-CG 4.03Å
1989	I	86.2	Confident	84	Confident	2 Å²	2	28.9 Å²	28.9	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-51.5	-47.2	-170.4	-61.1	166.3	0	0	0	113.6	Y1987 L1991 L1992 L1993 E2083 Q2345 R2348 M2349	Y1987-I1989 HydrophobicContact CD2-CB 4.47Å; Y1987-I1989 PolarHBondContact O-N 3.2Å; I1989-L1991 VanDerWaalsContact C-N 3.28Å; I1989-L1991 PolarHBondContact O-N 3.29Å; I1989-L1992 PolarHBondContact O-N 2.87Å; I1989-L1992 VanDerWaalsContact O-N 3.14Å; I1989-L1993 HydrophobicContact CG2-CD1 4.04Å; I1989-L1993 HydrophobicContact CG2-CG 4.31Å; I1989-L1993 WeakPolarHBondContact O-CG 3.3Å; I1989-L1993 PolarHBondContact O-N 2.99Å; I1989-E2083 HydrophobicContact CG1-CG 4.06Å; I1989-Q2345 VanDerWaalsContact CG2-OE1 3.22Å; I1989-R2348 HydrophobicContact CD1-CB 4.22Å; I1989-R2348 HydrophobicContact CD1-CG 3.88Å; I1989-M2349 HydrophobicContact CD1-CB 4.49Å; I1989-M2349 HydrophobicContact CG2-CB 4.24Å; I1989-M2349 HydrophobicContact CG2-SD 4.21Å
1990	P	85.5	Confident	83.6	Confident	5 Å²	5	31.4 Å²	31.4	3%	0.032	17%	0.169	C	C	.	.	H	α-helix	trans	-58.2	-35.6	177.1	-27.7	35.9	0	0	0	114.5	Y1951 F1976 Y1987 F1994 M2349	Y1951-P1990 HydrophobicContact CD1-CB 3.98Å; Y1951-P1990 HydrophobicContact CD1-CG 3.97Å; Y1951-P1990 HydrophobicContact CD2-CB 3.8Å; Y1951-P1990 HydrophobicContact CD2-CG 3.94Å; Y1951-P1990 HydrophobicContact CE1-CG 4.03Å; Y1951-P1990 HydrophobicContact CE2-CB 4.38Å; Y1951-P1990 HydrophobicContact CE2-CG 4.01Å; Y1951-P1990 HydrophobicContact CG-CB 3.58Å; Y1951-P1990 HydrophobicContact CG-CG 3.93Å; F1976-P1990 HydrophobicContact CE2-CB 4.03Å; F1976-P1990 HydrophobicContact CZ-CB 4.16Å; Y1987-P1990 HydrophobicContact CD2-CG 4.08Å; Y1987-P1990 HydrophobicContact CE2-CG 3.65Å; P1990-F1994 WeakPolarHBondContact O-CB 3.38Å; P1990-F1994 PolarHBondContact O-N 2.94Å; P1990-F1994 VanDerWaalsContact O-N 3.1Å; P1990-M2349 HydrophobicContact CG-SD 4.09Å
1991	L	91.2	Very high	83.7	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-73.9	-36.5	177.9	-177.2	59.6	0	0	0	111.5	M1911 F1976 W1979 P1988 I1989 F1994 I1995 F2035 I2038 F2076	M1911-L1991 HydrophobicContact CE-CD1 3.55Å; M1911-L1991 HydrophobicContact SD-CD1 4.21Å; F1976-L1991 HydrophobicContact CD1-CD1 4.45Å; F1976-L1991 HydrophobicContact CD2-CD1 4.21Å; F1976-L1991 HydrophobicContact CE2-CB 4.23Å; F1976-L1991 HydrophobicContact CE2-CD1 4.28Å; F1976-L1991 HydrophobicContact CG-CD1 4.31Å; F1976-L1991 HydrophobicContact CZ-CB 4.07Å; F1976-L1991 HydrophobicContact CZ-CD1 4.42Å; W1979-L1991 HydrophobicContact CZ3-CD2 4.02Å; P1988-L1991 PolarHBondContact O-N 2.95Å; I1989-L1991 VanDerWaalsContact C-N 3.28Å; I1989-L1991 PolarHBondContact O-N 3.29Å; L1991-F1994 HydrophobicContact CD1-CD1 3.83Å; L1991-F1994 HydrophobicContact CD1-CE1 4.48Å; L1991-F1994 WeakPolarHBondContact O-CB 3.48Å; L1991-F1994 PolarHBondContact O-N 2.94Å; L1991-I1995 HydrophobicContact CD1-CD1 4.3Å; L1991-I1995 HydrophobicContact CD1-CG1 4.4Å; L1991-I1995 HydrophobicContact CD2-CD1 4.48Å; L1991-I1995 HydrophobicContact CG-CD1 3.92Å; L1991-I1995 HydrophobicContact CG-CG1 4.46Å; L1991-I1995 WeakPolarHBondContact O-CB 3.42Å; L1991-I1995 VanDerWaalsContact O-CG1 3.31Å; L1991-I1995 WeakPolarHBondContact O-CG1 3.4Å; L1991-I1995 PolarHBondContact O-N 3.09Å; L1991-F2035 HydrophobicContact CD1-CD2 4.34Å; L1991-I2038 HydrophobicContact CD2-CD1 3.83Å; L1991-F2076 HydrophobicContact CD2-CE1 3.62Å; L1991-F2076 HydrophobicContact CD2-CZ 4.18Å
1992	L	89.8	Confident	84.4	Confident	6 Å²	6	31.5 Å²	31.5	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-66.7	-40.5	177.6	-65.4	169.6	0	0	0	111.6	P1988 I1989 I1995 R1996 I2038 L2042 A2080 E2083 V2084	P1988-L1992 HydrophobicContact CB-CD1 4.15Å; P1988-L1992 HydrophobicContact CB-CG 4.5Å; P1988-L1992 HydrophobicContact CG-CD1 4.4Å; P1988-L1992 PolarHBondContact O-N 2.96Å; P1988-L1992 VanDerWaalsContact O-N 3.13Å; I1989-L1992 PolarHBondContact O-N 2.87Å; I1989-L1992 VanDerWaalsContact O-N 3.14Å; L1992-I1995 PolarHBondContact O-N 2.9Å; L1992-R1996 WeakPolarHBondContact O-CG 3.13Å; L1992-R1996 PolarHBondContact O-N 3.17Å; L1992-I2038 HydrophobicContact CD2-CG2 4.02Å; L1992-L2042 HydrophobicContact CD2-CD1 4.31Å; L1992-A2080 HydrophobicContact CD2-CB 4.18Å; L1992-E2083 HydrophobicContact CD1-CB 3.93Å; L1992-E2083 HydrophobicContact CD1-CG 3.45Å; L1992-E2083 VanDerWaalsContact CD1-CG 3.45Å; L1992-V2084 HydrophobicContact CD1-CG2 3.65Å; L1992-V2084 HydrophobicContact CD2-CG2 3.56Å; L1992-V2084 HydrophobicContact CG-CG2 4.1Å
1993	L	83.4	Confident	84.1	Confident	17 Å²	17	29.9 Å²	29.9	9%	0.089	17%	0.169	C	C	.	.	H	α-helix	trans	-63.6	-44.2	172.4	-66.9	175.2	0	0	0	111.6	I1989 I1995 R1996 R1997 M2349	I1989-L1993 HydrophobicContact CG2-CD1 4.04Å; I1989-L1993 HydrophobicContact CG2-CG 4.31Å; I1989-L1993 WeakPolarHBondContact O-CG 3.3Å; I1989-L1993 PolarHBondContact O-N 2.99Å; L1993-I1995 PolarHBondContact O-N 2.83Å; L1993-R1996 PolarHBondContact O-N 3.17Å; L1993-R1997 WeakPolarHBondContact O-CB 3.39Å; L1993-R1997 PolarHBondContact O-N 3.11Å; L1993-M2349 HydrophobicContact CD1-CE 4.34Å
1994	F	90	Very high	82.4	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-58.5	-45.8	174.1	174.5	-100.2	0	0	0	112.6	V1909 M1911 Y1952 F1974 F1976 P1990 L1991 R1997 V1998 F2035	V1909-F1994 HydrophobicContact CG1-CE1 3.62Å; V1909-F1994 HydrophobicContact CG1-CZ 3.73Å; M1911-F1994 HydrophobicContact SD-CD1 4.33Å; M1911-F1994 HydrophobicContact SD-CE1 3.52Å; M1911-F1994 VanDerWaalsContact SD-CE1 3.52Å; M1911-F1994 HydrophobicContact SD-CZ 4.13Å; Y1952-F1994 HydrophobicContact CD1-CB 3.93Å; Y1952-F1994 AromaticContact CD1-CD2 3.96Å; Y1952-F1994 HydrophobicContact CD1-CD2 3.96Å; Y1952-F1994 HydrophobicContact CD1-CG 4.44Å; Y1952-F1994 AromaticContact CD2-CD2 3.86Å; Y1952-F1994 HydrophobicContact CD2-CD2 3.86Å; Y1952-F1994 HydrophobicContact CE1-CB 4.19Å; Y1952-F1994 HydrophobicContact CG-CB 4.35Å; Y1952-F1994 AromaticContact CG-CD2 3.5Å; Y1952-F1994 HydrophobicContact CG-CD2 3.5Å; Y1952-F1994 VanDerWaalsContact CG-CD2 3.5Å; Y1952-F1994 HydrophobicContact CG-CE2 4.26Å; Y1952-F1994 HydrophobicContact CG-CG 4.39Å; F1974-F1994 HydrophobicContact CB-CE2 3.58Å; F1974-F1994 HydrophobicContact CB-CZ 3.7Å; F1974-F1994 VanDerWaalsContact O-CZ 3.29Å; F1974-F1994 WeakPolarHBondContact O-CZ 3.29Å; F1976-F1994 HydrophobicContact CB-CD1 4.34Å; F1976-F1994 HydrophobicContact CB-CD2 4.39Å; F1976-F1994 HydrophobicContact CB-CE1 3.97Å; F1976-F1994 HydrophobicContact CB-CE2 3.98Å; F1976-F1994 HydrophobicContact CB-CZ 3.74Å; F1976-F1994 HydrophobicContact CD2-CB 4.04Å; F1976-F1994 HydrophobicContact CD2-CD1 4.22Å; F1976-F1994 HydrophobicContact CD2-CD2 4.15Å; F1976-F1994 AromaticContact CD2-CG 3.91Å; F1976-F1994 HydrophobicContact CD2-CG 3.91Å; F1976-F1994 HydrophobicContact CE2-CB 4.42Å; P1990-F1994 WeakPolarHBondContact O-CB 3.38Å; P1990-F1994 PolarHBondContact O-N 2.94Å; P1990-F1994 VanDerWaalsContact O-N 3.1Å; L1991-F1994 HydrophobicContact CD1-CD1 3.83Å; L1991-F1994 HydrophobicContact CD1-CE1 4.48Å; L1991-F1994 WeakPolarHBondContact O-CB 3.48Å; L1991-F1994 PolarHBondContact O-N 2.94Å; F1994-R1997 PolarHBondContact O-N 2.69Å; F1994-V1998 HydrophobicContact CE1-CG2 4.47Å; F1994-V1998 WeakPolarHBondContact O-CG2 3.34Å; F1994-V1998 PolarHBondContact O-N 2.91Å; F1994-F2035 HydrophobicContact CD1-CD2 4.14Å; F1994-F2035 AromaticContact CD1-CE2 3.81Å; F1994-F2035 HydrophobicContact CD1-CE2 3.81Å; F1994-F2035 AromaticContact CE1-CD2 3.85Å; F1994-F2035 HydrophobicContact CE1-CD2 3.85Å; F1994-F2035 AromaticContact CE1-CE2 3.57Å; F1994-F2035 HydrophobicContact CE1-CE2 3.57Å
1995	I	91.7	Very high	79.8	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.1	-44.6	175.7	-74.7	166.5	0	0	0	111.5	L1991 L1992 L1993 R1997 V1998 R1999 F2035 I2038 D2039 L2042	L1991-I1995 HydrophobicContact CD1-CD1 4.3Å; L1991-I1995 HydrophobicContact CD1-CG1 4.4Å; L1991-I1995 HydrophobicContact CD2-CD1 4.48Å; L1991-I1995 HydrophobicContact CG-CD1 3.92Å; L1991-I1995 HydrophobicContact CG-CG1 4.46Å; L1991-I1995 WeakPolarHBondContact O-CB 3.42Å; L1991-I1995 VanDerWaalsContact O-CG1 3.31Å; L1991-I1995 WeakPolarHBondContact O-CG1 3.4Å; L1991-I1995 PolarHBondContact O-N 3.09Å; L1992-I1995 PolarHBondContact O-N 2.9Å; L1993-I1995 PolarHBondContact O-N 2.83Å; I1995-R1997 VanDerWaalsContact C-N 3.31Å; I1995-R1997 PolarHBondContact O-N 2.92Å; I1995-V1998 PolarHBondContact O-N 2.93Å; I1995-R1999 WeakPolarHBondContact O-CG 3.29Å; I1995-R1999 PolarHBondContact O-N 3.2Å; I1995-F2035 HydrophobicContact CB-CE2 4.48Å; I1995-F2035 HydrophobicContact CD1-CD2 4.18Å; I1995-F2035 HydrophobicContact CD1-CE2 4.36Å; I1995-F2035 HydrophobicContact CG1-CD2 3.7Å; I1995-F2035 HydrophobicContact CG1-CE2 3.43Å; I1995-F2035 VanDerWaalsContact CG1-CE2 3.43Å; I1995-F2035 HydrophobicContact CG1-CZ 4.2Å; I1995-I2038 HydrophobicContact CD1-CB 3.99Å; I1995-I2038 HydrophobicContact CD1-CG2 3.59Å; I1995-D2039 WeakPolarHBondContact CG2-OD1 3.45Å; I1995-L2042 HydrophobicContact CG2-CD1 3.72Å
1996	R	85.9	Confident	77.2	Confident	37 Å²	37	44.9 Å²	44.9	14%	0.14	25%	0.25	C	S	.	.	H	α-helix	trans	-57.5	-43.9	173.8	-73.6	177.1	-176.7	177.9	1	111.4	L1992 L1993 R1999 A2000 G2088 E2091 D2342	L1992-R1996 WeakPolarHBondContact O-CG 3.13Å; L1992-R1996 PolarHBondContact O-N 3.17Å; L1993-R1996 PolarHBondContact O-N 3.17Å; R1996-R1999 PolarHBondContact O-N 2.81Å; R1996-A2000 WeakPolarHBondContact O-CB 3.44Å; R1996-A2000 PolarHBondContact O-N 3.03Å; R1996-G2088 PolarHBondContact NH2-O 2.89Å; R1996-E2091 IonicContact NH1-OE2 3.39Å; R1996-D2342 IonicContact CZ-OD2 3.52Å; R1996-D2342 IonicContact NH1-OD2 3.71Å; R1996-D2342 PolarHBondContact NH1-OD2 2.65Å
1997	R	84.6	Confident	74.9	Confident	46 Å²	46	46.3 Å²	46.3	17%	0.174	26%	0.262	C	S	.	.	H	α-helix	trans	-67.6	-35.2	-179.8	-168.4	59.9	171.6	176.9	-3.8	113.1	Y1952 I1954 F1974 L1993 F1994 I1995 T2001 E2338	Y1952-R1997 HydrophobicContact CE2-CG 4.33Å; I1954-R1997 HydrophobicContact CD1-CG 3.61Å; F1974-R1997 HydrophobicContact CE1-CG 4.17Å; L1993-R1997 WeakPolarHBondContact O-CB 3.39Å; L1993-R1997 PolarHBondContact O-N 3.11Å; F1994-R1997 PolarHBondContact O-N 2.69Å; I1995-R1997 VanDerWaalsContact C-N 3.31Å; I1995-R1997 PolarHBondContact O-N 2.92Å; R1997-T2001 PolarHBondContact O-OG1 2.72Å; R1997-E2338 WeakPolarHBondContact CD-OE1 3.46Å; R1997-E2338 IonicContact CZ-OE1 3.23Å; R1997-E2338 VanDerWaalsContact CZ-OE1 3.24Å; R1997-E2338 IonicContact NE-OE1 3.52Å; R1997-E2338 PolarHBondContact NE-OE1 2.88Å; R1997-E2338 IonicContact NH1-OE1 2.8Å; R1997-E2338 IonicContact NH2-OE1 3.82Å
1998	V	90.7	Very high	72.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.2	-52.1	167.8	170.2	0	0	0	0	110.4	I1907 V1909 F1974 F1994 I1995 A2000 T2001 F2035	I1907-V1998 HydrophobicContact CG2-CG1 4.1Å; V1909-V1998 HydrophobicContact CG2-CG1 4.25Å; V1909-V1998 HydrophobicContact CG2-CG2 4.17Å; F1974-V1998 HydrophobicContact CB-CG2 3.78Å; F1974-V1998 HydrophobicContact CD1-CG2 3.62Å; F1974-V1998 HydrophobicContact CD2-CG2 3.98Å; F1974-V1998 HydrophobicContact CE1-CG2 4.2Å; F1974-V1998 HydrophobicContact CG-CG2 3.53Å; F1994-V1998 HydrophobicContact CE1-CG2 4.47Å; F1994-V1998 WeakPolarHBondContact O-CG2 3.34Å; F1994-V1998 PolarHBondContact O-N 2.91Å; I1995-V1998 PolarHBondContact O-N 2.93Å; V1998-A2000 VanDerWaalsContact C-N 3.3Å; V1998-A2000 PolarHBondContact O-N 2.8Å; V1998-T2001 WeakPolarHBondContact O-CB 3.12Å; V1998-T2001 PolarHBondContact O-N 3.19Å; V1998-F2035 HydrophobicContact CB-CZ 4.49Å; V1998-F2035 HydrophobicContact CG1-CZ 4.24Å; V1998-F2035 HydrophobicContact CG2-CE2 4.47Å; V1998-F2035 HydrophobicContact CG2-CZ 4.34Å
1999	R	86.8	Confident	69.4	Low	32 Å²	32	59.2 Å²	59.2	12%	0.121	33%	0.329	C	S	.	.	H	α-helix	trans	-60.5	-35.9	-179.5	-74.5	-179.3	169	-100.4	-53.2	113.3	I1995 R1996 T2001 L2002 D2039 E2043	I1995-R1999 WeakPolarHBondContact O-CG 3.29Å; I1995-R1999 PolarHBondContact O-N 3.2Å; R1996-R1999 PolarHBondContact O-N 2.81Å; R1999-T2001 PolarHBondContact O-N 2.85Å; R1999-T2001 VanDerWaalsContact O-N 3.17Å; R1999-L2002 WeakPolarHBondContact O-CB 3.41Å; R1999-L2002 PolarHBondContact O-N 2.84Å; R1999-D2039 IonicContact CZ-OD1 2.72Å; R1999-D2039 IonicContact CZ-OD2 2.73Å; R1999-D2039 VanDerWaalsContact NE-CG 3.31Å; R1999-D2039 IonicContact NE-OD1 3.46Å; R1999-D2039 PolarHBondContact NE-OD1 2.85Å; R1999-D2039 IonicContact NE-OD2 2.72Å; R1999-D2039 PolarHBondContact NE-OD2 3.27Å; R1999-D2039 VanDerWaalsContact NH2-CG 3.27Å; R1999-D2039 PolarHBondContact NH2-O 2.9Å; R1999-D2039 IonicContact NH2-OD1 3.6Å; R1999-D2039 PolarHBondContact NH2-OD1 2.89Å; R1999-D2039 IonicContact NH2-OD2 3.23Å; R1999-D2039 PolarHBondContact NH2-OD2 2.88Å; R1999-E2043 IonicContact CZ-OE1 3.38Å; R1999-E2043 IonicContact CZ-OE2 3.18Å; R1999-E2043 VanDerWaalsContact NH1-CD 3.28Å; R1999-E2043 IonicContact NH1-OE1 2.72Å; R1999-E2043 PolarHBondContact NH1-OE1 2.86Å; R1999-E2043 IonicContact NH1-OE2 3.18Å; R1999-E2043 VanDerWaalsContact NH2-CD 3.28Å; R1999-E2043 IonicContact NH2-OE1 3.66Å; R1999-E2043 PolarHBondContact NH2-OE1 2.86Å; R1999-E2043 IonicContact NH2-OE2 3.71Å; R1999-E2043 PolarHBondContact NH2-OE2 3.3Å
2000	A	81.2	Confident	66.6	Low	55 Å²	55	67.5 Å²	67.5	46%	0.455	37%	0.365	S	S	.	.	H	α-helix	trans	-64.6	-13.9	176	0	0	0	0	0	114.2	R1996 V1998 T2003	R1996-A2000 WeakPolarHBondContact O-CB 3.44Å; R1996-A2000 PolarHBondContact O-N 3.03Å; V1998-A2000 VanDerWaalsContact C-N 3.3Å; V1998-A2000 PolarHBondContact O-N 2.8Å; A2000-T2003 PolarHBondContact O-OG1 3.31Å
2001	T	82	Confident	63.8	Low	49 Å²	49	75.9 Å²	75.9	30%	0.301	40%	0.404	S	S	.	.	H	α-helix	trans	-88.6	-17.9	174.2	-59	0	0	0	0	112.4	I1907 K1972 F1974 R1997 V1998 R1999	I1907-T2001 HydrophobicContact CD1-CG2 3.7Å; I1907-T2001 HydrophobicContact CG1-CG2 4.08Å; K1972-T2001 HydrophobicContact CD-CG2 3.85Å; K1972-T2001 HydrophobicContact CG-CG2 4.43Å; F1974-T2001 HydrophobicContact CZ-CG2 4.41Å; F1974-T2001 WeakPolarHBondContact CZ-OG1 3.37Å; R1997-T2001 PolarHBondContact O-OG1 2.72Å; V1998-T2001 WeakPolarHBondContact O-CB 3.12Å; V1998-T2001 PolarHBondContact O-N 3.19Å; R1999-T2001 PolarHBondContact O-N 2.85Å; R1999-T2001 VanDerWaalsContact O-N 3.17Å
2002	L	75.8	Confident	60.8	Low	33 Å²	33	80.9 Å²	80.9	17%	0.173	44%	0.439	C	S	.	.	H	α-helix	trans	-83.2	-20.5	-179.4	-66.5	167.8	0	0	0	113.8	I1907 R1999 P2004 Q2018 I2021	I1907-L2002 HydrophobicContact CD1-CD2 3.52Å; I1907-L2002 HydrophobicContact CD1-CG 3.74Å; I1907-L2002 HydrophobicContact CG1-CD2 4.44Å; R1999-L2002 WeakPolarHBondContact O-CB 3.41Å; R1999-L2002 PolarHBondContact O-N 2.84Å; L2002-P2004 WeakPolarHBondContact O-CD 3.35Å; L2002-Q2018 PolarHBondContact O-NE2 2.93Å; L2002-I2021 HydrophobicContact CD1-CD1 3.69Å; L2002-I2021 HydrophobicContact CD2-CD1 4.17Å; L2002-I2021 HydrophobicContact CD2-CG1 4.19Å; L2002-I2021 HydrophobicContact CG-CD1 4.46Å
2003	T	59.3	Low	57.7	Low	97 Å²	97	88.4 Å²	88.4	60%	0.595	48%	0.479	S	S	*	.	S	Bend	trans	-71.8	120.8	-179.9	42.3	0	0	0	0	110.5	A2000	A2000-T2003 PolarHBondContact O-OG1 3.31Å
2004	P	44.9	Very low	55.1	Low	109 Å²	109	95.5 Å²	95.5	71%	0.708	51%	0.512	S	S	*	.			trans	-59.4	139.4	177.5	-23.6	34.1	0	0	0	111.7	L2002 T2006	L2002-P2004 WeakPolarHBondContact O-CD 3.35Å; P2004-T2006 PolarHBondContact O-N 2.92Å
2005	N	34.8	Very low	52.2	Low	154 Å²	154	103.2 Å²	103.2	82%	0.824	55%	0.553	S	S	*	*			trans	-66.7	97.1	170.1	-95.6	-23.6	0	0	0	109.6	N2007	N2005-N2007 PolarHBondContact O-N 3.07Å
2006	T	29.4	Very low	49.8	Very low	133 Å²	133	109.5 Å²	109.5	82%	0.816	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	64.6	175.8	55	0	0	0	0	111.5	P2004	P2004-T2006 PolarHBondContact O-N 2.92Å
2007	N	30.5	Very low	48.4	Very low	150 Å²	150	116.3 Å²	116.3	80%	0.802	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.3	-14.9	169.8	-93.1	-21.6	0	0	0	113	N2005 M2009	N2005-N2007 PolarHBondContact O-N 3.07Å; N2007-M2009 PolarHBondContact O-N 3.31Å
2008	N	29.6	Very low	47.8	Very low	167 Å²	167	118.6 Å²	118.6	89%	0.893	64%	0.637	S	S	*	*			trans	-90.4	92.6	167.6	-80.5	1.5	0	0	0	110.1
2009	M	24.9	Very low	47.5	Very low	151 Å²	151	119.8 Å²	119.8	74%	0.744	65%	0.647	S	S	*	*			trans	-86.5	145.3	173.9	-161.9	159.6	70.7	0	0	110.3	N2007	N2007-M2009 PolarHBondContact O-N 3.31Å
2010	F	27.5	Very low	47.9	Very low	175 Å²	175	119 Å²	119	77%	0.768	65%	0.646	S	S	*	*			trans	70.4	102.3	179.2	-49.5	-79.1	0	0	0	117.7
2011	Q	27	Very low	48.6	Very low	181 Å²	181	116.5 Å²	116.5	85%	0.846	63%	0.625	S	S	*	*				174.1	157.6	94.4	-88.9	-173.9	12.8	0	0	113.3
2012	S	26.7	Very low	49.3	Very low	107 Å²	107	114.2 Å²	114.2	75%	0.748	61%	0.611	S	S	*	*			trans	55	125.6	163.9	51.2	0	0	0	0	120.8	H2014	S2012-H2014 PolarHBondContact O-N 2.7Å
2013	N	25.3	Very low	50.4	Low	163 Å²	163	112.6 Å²	112.6	87%	0.872	60%	0.602	S	S	*	*			trans	-57.6	115.8	171.6	-61.4	-22.8	0	0	0	113.1
2014	H	28.6	Very low	52.2	Low	167 Å²	167	108 Å²	108	77%	0.773	57%	0.574	S	S	*	*			trans	-142.7	142.1	146.6	-91.2	-80.4	0	0	0	108.8	S2012 V2016	S2012-H2014 PolarHBondContact O-N 2.7Å; H2014-V2016 VanDerWaalsContact C-N 3.29Å; H2014-V2016 PolarHBondContact O-N 2.75Å
2015	N	29.9	Very low	54.5	Low	162 Å²	162	103.1 Å²	103.1	87%	0.866	54%	0.542	S	S	*	.			trans	-70.2	90.9	165.7	-75.2	-7.7	0	0	0	107.7	E2017	N2015-E2017 VanDerWaalsContact C-N 3.3Å; N2015-E2017 PolarHBondContact O-N 3.44Å
2016	V	40.5	Very low	57.3	Low	131 Å²	131	96.2 Å²	96.2	79%	0.794	51%	0.506	S	S	*	.			trans	-74.6	89.3	173.2	-176.5	0	0	0	0	107.7	H2014 Q2018	H2014-V2016 VanDerWaalsContact C-N 3.29Å; H2014-V2016 PolarHBondContact O-N 2.75Å; V2016-Q2018 PolarHBondContact O-N 2.79Å
2017	E	57.4	Low	60.3	Low	180 Å²	180	90.1 Å²	90.1	84%	0.841	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-56.5	122.4	171.2	-67.4	-172.5	141.6	0	0	109.2	N2015 A2019	N2015-E2017 VanDerWaalsContact C-N 3.3Å; N2015-E2017 PolarHBondContact O-N 3.44Å; E2017-A2019 PolarHBondContact O-N 3.32Å
2018	Q	70.9	Confident	63.3	Low	95 Å²	95	83 Å²	83	44%	0.444	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-67.8	127.3	-177.4	-168	176.2	41.9	0	0	109	R1878 L2002 V2016	R1878-Q2018 PolarHBondContact NH2-O 2.89Å; L2002-Q2018 PolarHBondContact O-NE2 2.93Å; V2016-Q2018 PolarHBondContact O-N 2.79Å
2019	A	85	Confident	66.4	Low	24 Å²	24	75 Å²	75	20%	0.198	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-63.5	148.5	-177.1	0	0	0	0	0	112.7	R1878 R1904 E2017	R1878-A2019 VanDerWaalsContact NH2-C 3.32Å; R1878-A2019 PolarHBondContact NH2-O 2.86Å; R1904-A2019 HydrophobicContact CB-CB 4.25Å; R1904-A2019 WeakPolarHBondContact O-CB 3.38Å; E2017-A2019 PolarHBondContact O-N 3.32Å
2020	P	94	Very high	69.7	Low	16 Å²	16	67.9 Å²	67.9	10%	0.104	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-60.9	150.5	178.5	21.4	-31.3	0	0	0	112.9	A1881 I1883 Q1903 V1905	A1881-P2020 WeakPolarHBondContact O-CA 3.47Å; I1883-P2020 HydrophobicContact CD1-CB 3.87Å; I1883-P2020 HydrophobicContact CD1-CG 3.6Å; I1883-P2020 HydrophobicContact CG1-CB 3.88Å; I1883-P2020 HydrophobicContact CG1-CG 4.16Å; Q1903-P2020 HydrophobicContact CB-CG 4.18Å; V1905-P2020 HydrophobicContact CG2-CG 4.03Å
2021	I	96.1	Very high	72.9	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.015	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	118.5	169.4	-56.1	168.8	0	0	0	108.2	A1881 Y1882 I1883 I1907 V1909 L2002 V2023	A1881-I2021 PolarHBondContact O-N 3.24Å; Y1882-I2021 CarbonylContact C-O 3.55Å; Y1882-I2021 WeakPolarHBondContact CA-O 3.11Å; Y1882-I2021 WeakPolarHBondContact CB-O 3.4Å; Y1882-I2021 HydrophobicContact CD1-CB 3.99Å; Y1882-I2021 HydrophobicContact CD1-CD1 4.16Å; Y1882-I2021 HydrophobicContact CE1-CD1 4.05Å; I1883-I2021 PolarHBondContact N-O 2.74Å; I1907-I2021 HydrophobicContact CB-CG2 4.19Å; I1907-I2021 HydrophobicContact CG2-CG2 3.83Å; V1909-I2021 HydrophobicContact CG2-CG2 3.68Å; L2002-I2021 HydrophobicContact CD1-CD1 3.69Å; L2002-I2021 HydrophobicContact CD2-CD1 4.17Å; L2002-I2021 HydrophobicContact CD2-CG1 4.19Å; L2002-I2021 HydrophobicContact CG-CD1 4.46Å; I2021-V2023 HydrophobicContact CG2-CG2 3.97Å; I2021-V2023 PolarHBondContact O-N 3.34Å
2022	V	98	Very high	76.3	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	123.9	174	167.9	0	0	0	0	109	I1883 T1885 F1896 M1899 I1900 V1905 I1907 I1908 V1909	I1883-V2022 HydrophobicContact CB-CG2 3.89Å; I1883-V2022 HydrophobicContact CD1-CG2 4.15Å; I1883-V2022 HydrophobicContact CG2-CG2 4.16Å; I1883-V2022 CarbonylContact O-C 3.59Å; I1883-V2022 WeakPolarHBondContact O-CA 3.34Å; T1885-V2022 HydrophobicContact CG2-CG1 3.61Å; F1896-V2022 HydrophobicContact CE2-CG1 3.91Å; F1896-V2022 HydrophobicContact CZ-CG1 4.04Å; M1899-V2022 HydrophobicContact CE-CG1 4.08Å; M1899-V2022 HydrophobicContact CE-CG2 3.72Å; I1900-V2022 HydrophobicContact CD1-CB 4.18Å; I1900-V2022 HydrophobicContact CD1-CG1 4.3Å; I1900-V2022 HydrophobicContact CD1-CG2 3.74Å; V1905-V2022 HydrophobicContact CB-CG2 4.24Å; V1905-V2022 HydrophobicContact CG1-CB 4.06Å; V1905-V2022 HydrophobicContact CG1-CG2 3.71Å; V1905-V2022 HydrophobicContact CG2-CG2 3.64Å; I1907-V2022 PolarHBondContact O-N 3.42Å; I1908-V2022 CarbonylContact C-O 3.57Å; I1908-V2022 WeakPolarHBondContact CA-O 3.43Å; I1908-V2022 HydrophobicContact CG1-CB 4.43Å; I1908-V2022 HydrophobicContact CG2-CB 4.5Å; I1908-V2022 HydrophobicContact CG2-CG1 4.16Å; V1909-V2022 PolarHBondContact N-O 2.92Å
2023	V	98.2	Very high	79.6	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	127.7	178.3	-169.3	0	0	0	0	109.2	Y1882 I1883 A1884 T1885 V1909 M1911 I2021 T2032 F2035 I2036	Y1882-V2023 HydrophobicContact CD1-CG2 4.04Å; I1883-V2023 PolarHBondContact O-N 3.5Å; A1884-V2023 WeakPolarHBondContact CA-O 3.38Å; T1885-V2023 PolarHBondContact N-O 2.62Å; T1885-V2023 VanDerWaalsContact N-O 3.12Å; V1909-V2023 HydrophobicContact CB-CB 4.32Å; V1909-V2023 HydrophobicContact CB-CG1 4.07Å; V1909-V2023 HydrophobicContact CB-CG2 4.12Å; V1909-V2023 HydrophobicContact CG1-CG1 4.12Å; V1909-V2023 HydrophobicContact CG2-CG2 4.36Å; V1909-V2023 CarbonylContact O-C 3.51Å; V1909-V2023 WeakPolarHBondContact O-CA 3.31Å; M1911-V2023 HydrophobicContact CG-CG1 4.3Å; I2021-V2023 HydrophobicContact CG2-CG2 3.97Å; I2021-V2023 PolarHBondContact O-N 3.34Å; V2023-T2032 HydrophobicContact CB-CG2 4.03Å; V2023-T2032 HydrophobicContact CG1-CG2 3.8Å; V2023-T2032 WeakPolarHBondContact O-CG2 3.34Å; V2023-F2035 HydrophobicContact CB-CD1 4.48Å; V2023-F2035 HydrophobicContact CG1-CB 4.33Å; V2023-F2035 HydrophobicContact CG1-CD1 3.65Å; V2023-F2035 HydrophobicContact CG1-CE1 4.28Å; V2023-F2035 HydrophobicContact CG1-CG 4.14Å; V2023-F2035 HydrophobicContact CG2-CD1 3.95Å; V2023-F2035 HydrophobicContact CG2-CE1 3.89Å; V2023-I2036 HydrophobicContact CB-CD1 4.1Å; V2023-I2036 HydrophobicContact CB-CG1 4.27Å; V2023-I2036 HydrophobicContact CG1-CD1 4.5Å; V2023-I2036 HydrophobicContact CG1-CG1 4.32Å; V2023-I2036 HydrophobicContact CG2-CD1 4.2Å; V2023-I2036 HydrophobicContact CG2-CG1 4.06Å
2024	H	97.9	Very high	83	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	171.3	179.1	79.8	95.5	0	0	0	112.8	T1885 Q1886 G1887 V1909 M1910 M1911 C1922 Y1925 T2032	T1885-H2024 HydrophobicContact CG2-CB 4.01Å; T1885-H2024 WeakPolarHBondContact O-CA 3.3Å; T1885-H2024 WeakPolarHBondContact O-CB 3.36Å; Q1886-H2024 VanDerWaalsContact C-CB 3.4Å; Q1886-H2024 WeakPolarHBondContact O-CB 3.35Å; Q1886-H2024 VanDerWaalsContact O-CG 3.31Å; Q1886-H2024 PolarHBondContact O-ND1 2.83Å; G1887-H2024 VanDerWaalsContact CA-ND1 3.32Å; G1887-H2024 WeakPolarHBondContact CA-ND1 3.28Å; G1887-H2024 PolarHBondContact N-ND1 3.01Å; V1909-H2024 PolarHBondContact O-CD2 2.86Å; V1909-H2024 PolarHBondContact O-N 3.49Å; M1910-H2024 WeakPolarHBondContact CB-NE2 3.23Å; M1910-H2024 WeakPolarHBondContact CG-CE1 3.43Å; M1911-H2024 WeakPolarHBondContact CB-O 3Å; M1911-H2024 PolarHBondContact N-O 2.74Å; C1922-H2024 PolarHBondContact SG-CE1 2.85Å; Y1925-H2024 AromaticContact CE1-CE1 3.66Å; Y1925-H2024 AromaticContact CE1-NE2 3.43Å; Y1925-H2024 WeakPolarHBondContact CE1-NE2 3.42Å; Y1925-H2024 AromaticContact CZ-NE2 3.5Å; Y1925-H2024 PolarHBondContact OH-CD2 3.5Å; Y1925-H2024 PolarHBondContact OH-NE2 3.31Å; H2024-T2032 VanDerWaalsContact CA-OG1 3.3Å; H2024-T2032 WeakPolarHBondContact CA-OG1 3.46Å; H2024-T2032 PolarHBondContact O-OG1 2.87Å
2025	C	93.2	Very high	86.3	Confident	6 Å²	6	31.4 Å²	31.4	4%	0.041	17%	0.168	C	C	.	.	S	Bend	trans	-140.2	-121.6	167.3	51.4	0	0	0	0	107.9	G1887 M1911 T1912 G2028 R2031 T2032	G1887-C2025 PolarHBondContact N-O 2.84Å; M1911-C2025 HydrophobicContact CB-CB 3.98Å; T1912-C2025 VanDerWaalsContact CG2-C 3.46Å; T1912-C2025 HydrophobicContact CG2-CB 4.45Å; C2025-G2028 PolarHBondContact SG-N 2.91Å; C2025-R2031 HydrophobicContact CB-CB 4.04Å; C2025-T2032 PolarHBondContact N-OG1 2.91Å; C2025-T2032 PolarHBondContact SG-OG1 2.72Å
2026	S	92.9	Very high	89.6	Confident	10 Å²	10	23.7 Å²	23.7	7%	0.07	13%	0.126	C	C	.	.	S	Bend	trans	-75.7	-64.4	157.7	-179.7	0	0	0	0	109.4	V154 R1842 Y1843 G1887 K1921	V154-S2026 PolarHBondContact O-OG 3.41Å; R1842-S2026 WeakPolarHBondContact CD-O 3.43Å; Y1843-S2026 PolarHBondContact OH-OG 2.95Å; G1887-S2026 PolarHBondContact N-O 3.23Å; G1887-S2026 VanDerWaalsContact N-O 3.07Å; K1921-S2026 WeakPolarHBondContact O-CA 3.49Å; K1921-S2026 WeakPolarHBondContact O-CB 3.46Å; K1921-S2026 PolarHBondContact O-OG 3Å
2027	A	91.2	Very high	92.3	Very high	4 Å²	4	17.4 Å²	17.4	3%	0.033	9%	0.088	C	C	.	.	S	Bend	trans	-89.3	-21.4	-172.1	0	0	0	0	0	116.4	G155 Y1843 V1846 V2029 R2064	G155-A2027 WeakPolarHBondContact O-CA 3.49Å; G155-A2027 WeakPolarHBondContact O-CB 3.42Å; Y1843-A2027 HydrophobicContact CD2-CB 4.24Å; Y1843-A2027 HydrophobicContact CE2-CB 4.07Å; V1846-A2027 HydrophobicContact CB-CB 4.41Å; V1846-A2027 HydrophobicContact CG1-CB 4.32Å; V1846-A2027 WeakPolarHBondContact CG1-O 3.34Å; V1846-A2027 HydrophobicContact CG2-CB 3.99Å; A2027-V2029 HydrophobicContact CB-CG2 3.96Å; A2027-R2064 PolarHBondContact O-NH2 2.73Å
2028	G	94	Very high	94.2	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.048	C	C	.	.	S	Bend	trans	81.6	17	-172.9	0	0	0	0	0	115.5	T1885 C2025 T2032 R2064	T1885-G2028 WeakPolarHBondContact O-CA 3.31Å; C2025-G2028 PolarHBondContact SG-N 2.91Å; G2028-T2032 WeakPolarHBondContact CA-OG1 3.32Å; G2028-T2032 WeakPolarHBondContact O-CB 3.44Å; G2028-T2032 VanDerWaalsContact O-CG2 3.23Å; G2028-T2032 WeakPolarHBondContact O-CG2 3.47Å; G2028-R2064 PolarHBondContact O-NE 3.12Å
2029	V	95.4	Very high	95.4	Very high	0 Å²	0	4.4 Å²	4.4	0%	0	3%	0.028	C	C	.	.	S	Bend	trans	-133.4	-45.9	-176.1	-63.5	0	0	0	0	115.9	V1846 A2027 G2033 R2064 N2065 F2066 M2067 V2068	V1846-V2029 HydrophobicContact CB-CG2 4.43Å; V1846-V2029 HydrophobicContact CG1-CB 4.2Å; V1846-V2029 HydrophobicContact CG1-CG1 3.28Å; V1846-V2029 HydrophobicContact CG1-CG2 3.86Å; V1846-V2029 HydrophobicContact CG2-CG2 3.64Å; A2027-V2029 HydrophobicContact CB-CG2 3.96Å; V2029-G2033 VanDerWaalsContact O-CA 3.27Å; V2029-G2033 WeakPolarHBondContact O-CA 3.24Å; V2029-G2033 PolarHBondContact O-N 2.88Å; V2029-R2064 HydrophobicContact CG1-CG 3.8Å; V2029-N2065 WeakPolarHBondContact CG1-O 3.42Å; V2029-F2066 HydrophobicContact CB-CB 4.37Å; V2029-F2066 HydrophobicContact CG2-CB 4.03Å; V2029-M2067 HydrophobicContact CB-SD 4.12Å; V2029-M2067 HydrophobicContact CG1-SD 3.92Å; V2029-V2068 PolarHBondContact O-N 2.9Å
2030	G	93.1	Very high	95.9	Very high	1 Å²	1	3.7 Å²	3.7	1%	0.01	2%	0.021	C	C	.	.	H	α-helix	trans	-69.4	-84.9	-179.6	0	0	0	0	0	112.8	T2032 G2033 A2034 Q2073	G2030-T2032 PolarHBondContact O-N 2.83Å; G2030-G2033 PolarHBondContact O-N 2.77Å; G2030-G2033 VanDerWaalsContact O-N 3.13Å; G2030-A2034 PolarHBondContact O-N 3.32Å; G2030-Q2073 PolarHBondContact O-OE1 3.11Å
2031	R	96.3	Very high	95.9	Very high	27 Å²	27	3.1 Å²	3.1	10%	0.102	2%	0.016	C	C	.	.	H	α-helix	trans	-60.4	-30.4	177.6	-54.3	-178.4	177.2	153.4	-3.3	112.8	M1911 T1912 E1916 W1979 P1980 C2025 F2035	M1911-R2031 HydrophobicContact CB-CB 3.84Å; M1911-R2031 WeakPolarHBondContact O-CD 3.06Å; T1912-R2031 PolarHBondContact OG1-NH1 3.39Å; T1912-R2031 VanDerWaalsContact OG1-NH1 3.14Å; E1916-R2031 IonicContact OE1-CZ 2.72Å; E1916-R2031 IonicContact OE1-NH1 3.78Å; E1916-R2031 PolarHBondContact OE1-NH1 3.37Å; E1916-R2031 IonicContact OE1-NH2 3.6Å; E1916-R2031 PolarHBondContact OE1-NH2 3.12Å; E1916-R2031 IonicContact OE2-CZ 3.47Å; E1916-R2031 IonicContact OE2-NH1 3.82Å; E1916-R2031 PolarHBondContact OE2-NH1 2.77Å; E1916-R2031 IonicContact OE2-NH2 3.41Å; E1916-R2031 PolarHBondContact OE2-NH2 3.39Å; W1979-R2031 HydrophobicContact CD2-CB 4.31Å; W1979-R2031 HydrophobicContact CD2-CG 3.76Å; W1979-R2031 HydrophobicContact CE3-CB 4.16Å; W1979-R2031 HydrophobicContact CE3-CG 4.13Å; W1979-R2031 HydrophobicContact CG-CG 4.24Å; W1979-R2031 VanDerWaalsContact CG-NE 3.28Å; W1979-R2031 HydrophobicContact CH2-CB 4.25Å; W1979-R2031 HydrophobicContact CH2-CG 4.26Å; W1979-R2031 HydrophobicContact CZ2-CB 4.37Å; W1979-R2031 HydrophobicContact CZ2-CG 3.88Å; W1979-R2031 HydrophobicContact CZ3-CB 4.13Å; W1979-R2031 HydrophobicContact CZ3-CG 4.36Å; P1980-R2031 PolarHBondContact O-NH2 3.26Å; C2025-R2031 HydrophobicContact CB-CB 4.04Å; R2031-F2035 PolarHBondContact O-N 3.18Å
2032	T	97.3	Very high	95.7	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-64.1	-49.7	172.3	-64.1	0	0	0	0	112.2	A1884 V2023 H2024 C2025 G2028 G2030 A2034 F2035 I2036	A1884-T2032 HydrophobicContact CB-CG2 3.89Å; V2023-T2032 HydrophobicContact CB-CG2 4.03Å; V2023-T2032 HydrophobicContact CG1-CG2 3.8Å; V2023-T2032 WeakPolarHBondContact O-CG2 3.34Å; H2024-T2032 VanDerWaalsContact CA-OG1 3.3Å; H2024-T2032 WeakPolarHBondContact CA-OG1 3.46Å; H2024-T2032 PolarHBondContact O-OG1 2.87Å; C2025-T2032 PolarHBondContact N-OG1 2.91Å; C2025-T2032 PolarHBondContact SG-OG1 2.72Å; G2028-T2032 WeakPolarHBondContact CA-OG1 3.32Å; G2028-T2032 WeakPolarHBondContact O-CB 3.44Å; G2028-T2032 VanDerWaalsContact O-CG2 3.23Å; G2028-T2032 WeakPolarHBondContact O-CG2 3.47Å; G2030-T2032 PolarHBondContact O-N 2.83Å; T2032-A2034 VanDerWaalsContact C-N 3.32Å; T2032-A2034 PolarHBondContact O-N 3.08Å; T2032-F2035 PolarHBondContact O-N 3.01Å; T2032-I2036 HydrophobicContact CG2-CD1 3.94Å; T2032-I2036 WeakPolarHBondContact O-CG1 3.18Å; T2032-I2036 PolarHBondContact O-N 3.34Å
2033	G	96.6	Very high	95.3	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-62.3	-41.2	175.8	0	0	0	0	0	111.4	V2029 G2030 F2035 I2036 V2037	V2029-G2033 VanDerWaalsContact O-CA 3.27Å; V2029-G2033 WeakPolarHBondContact O-CA 3.24Å; V2029-G2033 PolarHBondContact O-N 2.88Å; G2030-G2033 PolarHBondContact O-N 2.77Å; G2030-G2033 VanDerWaalsContact O-N 3.13Å; G2033-F2035 PolarHBondContact O-N 3.34Å; G2033-I2036 PolarHBondContact O-N 3Å; G2033-V2037 WeakPolarHBondContact O-CB 3.37Å; G2033-V2037 WeakPolarHBondContact O-CG2 3.35Å; G2033-V2037 PolarHBondContact O-N 2.7Å
2034	A	97.1	Very high	95.1	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-60.7	-43.9	175.5	0	0	0	0	0	113	W1979 G2030 T2032 I2038 I2077	W1979-A2034 HydrophobicContact CH2-CB 3.74Å; W1979-A2034 HydrophobicContact CZ3-CB 4.44Å; G2030-A2034 PolarHBondContact O-N 3.32Å; T2032-A2034 VanDerWaalsContact C-N 3.32Å; T2032-A2034 PolarHBondContact O-N 3.08Å; A2034-I2038 WeakPolarHBondContact O-CD1 3.5Å; A2034-I2038 VanDerWaalsContact O-CG1 3.22Å; A2034-I2038 WeakPolarHBondContact O-CG1 3.49Å; A2034-I2038 PolarHBondContact O-N 3.47Å; A2034-I2077 HydrophobicContact CB-CD1 4.27Å; A2034-I2077 HydrophobicContact CB-CG1 4.2Å
2035	F	97.9	Very high	94.7	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-58.5	-53	172.1	175.3	-85.1	0	0	0	111.3	V1909 M1911 L1991 F1994 I1995 V1998 V2023 R2031 T2032 G2033 V2037 I2038 D2039	V1909-F2035 HydrophobicContact CB-CZ 4.46Å; V1909-F2035 HydrophobicContact CG1-CD1 4.38Å; V1909-F2035 HydrophobicContact CG1-CD2 4Å; V1909-F2035 HydrophobicContact CG1-CE1 4.13Å; V1909-F2035 HydrophobicContact CG1-CE2 3.7Å; V1909-F2035 HydrophobicContact CG1-CG 4.34Å; V1909-F2035 HydrophobicContact CG1-CZ 3.79Å; V1909-F2035 HydrophobicContact CG2-CE1 4.36Å; V1909-F2035 HydrophobicContact CG2-CZ 4.07Å; M1911-F2035 HydrophobicContact CE-CB 4.31Å; M1911-F2035 HydrophobicContact CG-CB 3.94Å; M1911-F2035 HydrophobicContact CG-CD2 4.45Å; M1911-F2035 HydrophobicContact CG-CG 4.32Å; M1911-F2035 HydrophobicContact SD-CB 4Å; M1911-F2035 HydrophobicContact SD-CD2 3.67Å; M1911-F2035 HydrophobicContact SD-CG 4.1Å; L1991-F2035 HydrophobicContact CD1-CD2 4.34Å; F1994-F2035 HydrophobicContact CD1-CD2 4.14Å; F1994-F2035 AromaticContact CD1-CE2 3.81Å; F1994-F2035 HydrophobicContact CD1-CE2 3.81Å; F1994-F2035 AromaticContact CE1-CD2 3.85Å; F1994-F2035 HydrophobicContact CE1-CD2 3.85Å; F1994-F2035 AromaticContact CE1-CE2 3.57Å; F1994-F2035 HydrophobicContact CE1-CE2 3.57Å; I1995-F2035 HydrophobicContact CB-CE2 4.48Å; I1995-F2035 HydrophobicContact CD1-CD2 4.18Å; I1995-F2035 HydrophobicContact CD1-CE2 4.36Å; I1995-F2035 HydrophobicContact CG1-CD2 3.7Å; I1995-F2035 HydrophobicContact CG1-CE2 3.43Å; I1995-F2035 VanDerWaalsContact CG1-CE2 3.43Å; I1995-F2035 HydrophobicContact CG1-CZ 4.2Å; V1998-F2035 HydrophobicContact CB-CZ 4.49Å; V1998-F2035 HydrophobicContact CG1-CZ 4.24Å; V1998-F2035 HydrophobicContact CG2-CE2 4.47Å; V1998-F2035 HydrophobicContact CG2-CZ 4.34Å; V2023-F2035 HydrophobicContact CB-CD1 4.48Å; V2023-F2035 HydrophobicContact CG1-CB 4.33Å; V2023-F2035 HydrophobicContact CG1-CD1 3.65Å; V2023-F2035 HydrophobicContact CG1-CE1 4.28Å; V2023-F2035 HydrophobicContact CG1-CG 4.14Å; V2023-F2035 HydrophobicContact CG2-CD1 3.95Å; V2023-F2035 HydrophobicContact CG2-CE1 3.89Å; R2031-F2035 PolarHBondContact O-N 3.18Å; T2032-F2035 PolarHBondContact O-N 3.01Å; G2033-F2035 PolarHBondContact O-N 3.34Å; F2035-V2037 PolarHBondContact O-N 2.94Å; F2035-I2038 PolarHBondContact O-N 3.43Å; F2035-D2039 HydrophobicContact CE1-CB 4.48Å; F2035-D2039 WeakPolarHBondContact O-CB 3.43Å; F2035-D2039 PolarHBondContact O-N 2.77Å
2036	I	97.9	Very high	94.3	Very high	0 Å²	0	14 Å²	14	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-63.2	-45.1	-175.2	-70	173.5	0	0	0	111.6	I1873 Y1882 A1884 V2023 T2032 G2033 I2038 D2039 I2040 L2060 M2067	I1873-I2036 HydrophobicContact CB-CD1 4.49Å; I1873-I2036 HydrophobicContact CG1-CD1 4.44Å; I1873-I2036 HydrophobicContact CG2-CD1 4.37Å; I1873-I2036 HydrophobicContact CG2-CG2 3.93Å; Y1882-I2036 HydrophobicContact CD1-CG1 4.14Å; Y1882-I2036 HydrophobicContact CD2-CD1 4.49Å; Y1882-I2036 HydrophobicContact CD2-CG1 4.38Å; Y1882-I2036 HydrophobicContact CD2-CG2 3.81Å; Y1882-I2036 HydrophobicContact CE2-CG2 3.79Å; Y1882-I2036 HydrophobicContact CG-CD1 4.13Å; Y1882-I2036 HydrophobicContact CG-CG1 4.07Å; Y1882-I2036 HydrophobicContact CG-CG2 4.35Å; A1884-I2036 HydrophobicContact CB-CD1 4.2Å; V2023-I2036 HydrophobicContact CB-CD1 4.1Å; V2023-I2036 HydrophobicContact CB-CG1 4.27Å; V2023-I2036 HydrophobicContact CG1-CD1 4.5Å; V2023-I2036 HydrophobicContact CG1-CG1 4.32Å; V2023-I2036 HydrophobicContact CG2-CD1 4.2Å; V2023-I2036 HydrophobicContact CG2-CG1 4.06Å; T2032-I2036 HydrophobicContact CG2-CD1 3.94Å; T2032-I2036 WeakPolarHBondContact O-CG1 3.18Å; T2032-I2036 PolarHBondContact O-N 3.34Å; G2033-I2036 PolarHBondContact O-N 3Å; I2036-I2038 PolarHBondContact O-N 3.5Å; I2036-D2039 PolarHBondContact O-N 3.35Å; I2036-I2040 HydrophobicContact CG2-CD1 3.48Å; I2036-I2040 VanDerWaalsContact CG2-CD1 3.48Å; I2036-I2040 HydrophobicContact CG2-CG1 4.09Å; I2036-I2040 WeakPolarHBondContact O-CB 3.29Å; I2036-I2040 WeakPolarHBondContact O-CG1 3.42Å; I2036-I2040 PolarHBondContact O-N 2.77Å; I2036-L2060 HydrophobicContact CB-CD1 4.33Å; I2036-L2060 HydrophobicContact CG2-CD1 3.77Å; I2036-M2067 HydrophobicContact CD1-CE 4.08Å
2037	V	97.9	Very high	94.1	Very high	0 Å²	0	21 Å²	21	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-63	-42.7	179.8	177.2	0	0	0	0	111.1	G2033 F2035 D2039 M2041 I2053 C2056 V2057 L2060 V2068 I2077	G2033-V2037 WeakPolarHBondContact O-CB 3.37Å; G2033-V2037 WeakPolarHBondContact O-CG2 3.35Å; G2033-V2037 PolarHBondContact O-N 2.7Å; F2035-V2037 PolarHBondContact O-N 2.94Å; V2037-D2039 VanDerWaalsContact C-N 3.35Å; V2037-M2041 HydrophobicContact CG1-CG 4.3Å; V2037-M2041 WeakPolarHBondContact O-CB 3.3Å; V2037-M2041 WeakPolarHBondContact O-CG 3.46Å; V2037-M2041 PolarHBondContact O-N 3Å; V2037-I2053 HydrophobicContact CG1-CG2 4.25Å; V2037-C2056 HydrophobicContact CG1-CB 4.31Å; V2037-V2057 HydrophobicContact CG1-CG2 4.29Å; V2037-V2057 HydrophobicContact CG2-CG2 3.78Å; V2037-L2060 HydrophobicContact CG2-CD1 3.49Å; V2037-L2060 VanDerWaalsContact CG2-CD1 3.49Å; V2037-L2060 HydrophobicContact CG2-CG 4.33Å; V2037-V2068 HydrophobicContact CG2-CG2 3.97Å; V2037-I2077 HydrophobicContact CB-CD1 4.1Å; V2037-I2077 HydrophobicContact CB-CG2 4.41Å; V2037-I2077 HydrophobicContact CG1-CD1 4.19Å; V2037-I2077 HydrophobicContact CG1-CG2 3.69Å; V2037-I2077 HydrophobicContact CG2-CD1 4.48Å
2038	I	96.9	Very high	93.9	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-62.3	-45.2	175.2	-64.2	165.1	0	0	0	109.6	L1991 L1992 I1995 A2034 F2035 I2036 M2041 L2042 F2076 I2077 A2080 L2081	L1991-I2038 HydrophobicContact CD2-CD1 3.83Å; L1992-I2038 HydrophobicContact CD2-CG2 4.02Å; I1995-I2038 HydrophobicContact CD1-CB 3.99Å; I1995-I2038 HydrophobicContact CD1-CG2 3.59Å; A2034-I2038 WeakPolarHBondContact O-CD1 3.5Å; A2034-I2038 VanDerWaalsContact O-CG1 3.22Å; A2034-I2038 WeakPolarHBondContact O-CG1 3.49Å; A2034-I2038 PolarHBondContact O-N 3.47Å; F2035-I2038 PolarHBondContact O-N 3.43Å; I2036-I2038 PolarHBondContact O-N 3.5Å; I2038-M2041 PolarHBondContact O-N 3.24Å; I2038-L2042 HydrophobicContact CG2-CD1 3.72Å; I2038-L2042 HydrophobicContact CG2-CG 4.12Å; I2038-L2042 WeakPolarHBondContact O-CB 3.4Å; I2038-L2042 WeakPolarHBondContact O-CG 3.35Å; I2038-L2042 PolarHBondContact O-N 2.93Å; I2038-F2076 HydrophobicContact CD1-CE1 4.48Å; I2038-I2077 HydrophobicContact CD1-CG1 4.26Å; I2038-I2077 HydrophobicContact CG1-CB 4.27Å; I2038-I2077 HydrophobicContact CG1-CG1 4.03Å; I2038-I2077 HydrophobicContact CG1-CG2 4.06Å; I2038-A2080 HydrophobicContact CD1-CB 3.7Å; I2038-A2080 HydrophobicContact CG1-CB 4.2Å; I2038-L2081 HydrophobicContact CG2-CD2 4.4Å
2039	D	95.6	Very high	93.6	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-61.1	-47.1	-179.4	-154.3	62	0	0	0	112.7	Y1882 I1995 R1999 F2035 I2036 V2037 L2042 E2043	Y1882-D2039 HydrophobicContact CE1-CB 4.36Å; Y1882-D2039 WeakPolarHBondContact CE1-OD2 3.26Å; Y1882-D2039 PolarHBondContact OH-OD2 2.85Å; I1995-D2039 WeakPolarHBondContact CG2-OD1 3.45Å; R1999-D2039 IonicContact CZ-OD1 2.72Å; R1999-D2039 IonicContact CZ-OD2 2.73Å; R1999-D2039 VanDerWaalsContact NE-CG 3.31Å; R1999-D2039 IonicContact NE-OD1 3.46Å; R1999-D2039 PolarHBondContact NE-OD1 2.85Å; R1999-D2039 IonicContact NE-OD2 2.72Å; R1999-D2039 PolarHBondContact NE-OD2 3.27Å; R1999-D2039 VanDerWaalsContact NH2-CG 3.27Å; R1999-D2039 PolarHBondContact NH2-O 2.9Å; R1999-D2039 IonicContact NH2-OD1 3.6Å; R1999-D2039 PolarHBondContact NH2-OD1 2.89Å; R1999-D2039 IonicContact NH2-OD2 3.23Å; R1999-D2039 PolarHBondContact NH2-OD2 2.88Å; F2035-D2039 HydrophobicContact CE1-CB 4.48Å; F2035-D2039 WeakPolarHBondContact O-CB 3.43Å; F2035-D2039 PolarHBondContact O-N 2.77Å; I2036-D2039 PolarHBondContact O-N 3.35Å; V2037-D2039 VanDerWaalsContact C-N 3.35Å; D2039-L2042 PolarHBondContact O-N 3.4Å; D2039-E2043 PolarHBondContact O-N 3Å
2040	I	96.2	Very high	93.4	Very high	10 Å²	10	31.3 Å²	31.3	5%	0.051	14%	0.138	C	C	.	.	H	α-helix	trans	-60.5	-44.3	174.5	-67.2	174.1	0	0	0	111.2	D1874 Y1882 I2036 E2043 R2044 L2060	D1874-I2040 WeakPolarHBondContact O-CD1 3.5Å; Y1882-I2040 HydrophobicContact CE2-CD1 3.95Å; Y1882-I2040 HydrophobicContact CE2-CG1 3.71Å; I2036-I2040 HydrophobicContact CG2-CD1 3.48Å; I2036-I2040 VanDerWaalsContact CG2-CD1 3.48Å; I2036-I2040 HydrophobicContact CG2-CG1 4.09Å; I2036-I2040 WeakPolarHBondContact O-CB 3.29Å; I2036-I2040 WeakPolarHBondContact O-CG1 3.42Å; I2036-I2040 PolarHBondContact O-N 2.77Å; I2040-E2043 VanDerWaalsContact O-CB 3.28Å; I2040-E2043 WeakPolarHBondContact O-CB 3.45Å; I2040-E2043 PolarHBondContact O-N 2.99Å; I2040-R2044 PolarHBondContact O-N 2.76Å; I2040-L2060 HydrophobicContact CD1-CD2 4.05Å
2041	M	94.9	Very high	93.3	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.015	14%	0.137	C	C	.	.	H	α-helix	trans	-69.8	-37	178.9	-70.3	-63.7	101.9	0	0	112	V2037 I2038 E2043 R2044 L2045 V2051 D2052 I2053 C2056 L2081	V2037-M2041 HydrophobicContact CG1-CG 4.3Å; V2037-M2041 WeakPolarHBondContact O-CB 3.3Å; V2037-M2041 WeakPolarHBondContact O-CG 3.46Å; V2037-M2041 PolarHBondContact O-N 3Å; I2038-M2041 PolarHBondContact O-N 3.24Å; M2041-E2043 PolarHBondContact O-N 3Å; M2041-R2044 HydrophobicContact CE-CB 4.29Å; M2041-R2044 PolarHBondContact O-N 3.3Å; M2041-L2045 VanDerWaalsContact O-CB 3.28Å; M2041-L2045 WeakPolarHBondContact O-CB 3.24Å; M2041-L2045 WeakPolarHBondContact O-CG 3.18Å; M2041-L2045 PolarHBondContact O-N 2.95Å; M2041-V2051 HydrophobicContact SD-CG1 4.11Å; M2041-D2052 HydrophobicContact SD-CB 4.39Å; M2041-D2052 PolarHBondContact SD-N 2.93Å; M2041-I2053 HydrophobicContact CG-CG1 4.29Å; M2041-C2056 HydrophobicContact CE-CB 3.89Å; M2041-L2081 HydrophobicContact CB-CD1 3.51Å; M2041-L2081 HydrophobicContact CB-CD2 3.56Å; M2041-L2081 HydrophobicContact CB-CG 4.2Å; M2041-L2081 HydrophobicContact CG-CD1 3.76Å
2042	L	91.8	Very high	93.1	Very high	23 Å²	23	31 Å²	31	12%	0.12	14%	0.138	C	C	.	.	H	α-helix	trans	-64.6	-23.9	171.1	-70	172.7	0	0	0	112.9	L1992 I1995 I2038 D2039 L2045 K2046 L2081 V2084	L1992-L2042 HydrophobicContact CD2-CD1 4.31Å; I1995-L2042 HydrophobicContact CG2-CD1 3.72Å; I2038-L2042 HydrophobicContact CG2-CD1 3.72Å; I2038-L2042 HydrophobicContact CG2-CG 4.12Å; I2038-L2042 WeakPolarHBondContact O-CB 3.4Å; I2038-L2042 WeakPolarHBondContact O-CG 3.35Å; I2038-L2042 PolarHBondContact O-N 2.93Å; D2039-L2042 PolarHBondContact O-N 3.4Å; L2042-L2045 HydrophobicContact CD2-CD1 4.21Å; L2042-K2046 WeakPolarHBondContact O-CG 3.06Å; L2042-L2081 HydrophobicContact CD2-CD2 4.07Å; L2042-L2081 HydrophobicContact CG-CD2 4.09Å; L2042-V2084 HydrophobicContact CD2-CB 3.98Å; L2042-V2084 HydrophobicContact CD2-CG1 3.69Å; L2042-V2084 HydrophobicContact CD2-CG2 3.85Å
2043	E	90.1	Very high	93	Very high	43 Å²	43	31.1 Å²	31.1	20%	0.201	14%	0.138	C	C	.	.	H	α-helix	trans	-75.2	-51.8	167.7	-151	105.6	-93.4	0	0	111.2	Y1876 R1999 D2039 I2040 M2041 L2045 K2046 Y2047	Y1876-E2043 HydrophobicContact CD1-CB 4.01Å; Y1876-E2043 HydrophobicContact CD1-CG 3.76Å; Y1876-E2043 HydrophobicContact CG-CB 4.09Å; Y1876-E2043 HydrophobicContact CG-CG 4.24Å; R1999-E2043 IonicContact CZ-OE1 3.38Å; R1999-E2043 IonicContact CZ-OE2 3.18Å; R1999-E2043 VanDerWaalsContact NH1-CD 3.28Å; R1999-E2043 IonicContact NH1-OE1 2.72Å; R1999-E2043 PolarHBondContact NH1-OE1 2.86Å; R1999-E2043 IonicContact NH1-OE2 3.18Å; R1999-E2043 VanDerWaalsContact NH2-CD 3.28Å; R1999-E2043 IonicContact NH2-OE1 3.66Å; R1999-E2043 PolarHBondContact NH2-OE1 2.86Å; R1999-E2043 IonicContact NH2-OE2 3.71Å; R1999-E2043 PolarHBondContact NH2-OE2 3.3Å; D2039-E2043 PolarHBondContact O-N 3Å; I2040-E2043 VanDerWaalsContact O-CB 3.28Å; I2040-E2043 WeakPolarHBondContact O-CB 3.45Å; I2040-E2043 PolarHBondContact O-N 2.99Å; M2041-E2043 PolarHBondContact O-N 3Å; E2043-L2045 VanDerWaalsContact C-N 3.25Å; E2043-L2045 PolarHBondContact O-N 3.01Å; E2043-K2046 VanDerWaalsContact O-CB 3.31Å; E2043-K2046 WeakPolarHBondContact O-CB 2.89Å; E2043-K2046 PolarHBondContact O-N 2.9Å; E2043-K2046 IonicContact OE1-NZ 2.94Å; E2043-K2046 PolarHBondContact OE1-NZ 3.32Å; E2043-Y2047 HydrophobicContact CG-CE2 4.26Å; E2043-Y2047 VanDerWaalsContact O-CD2 3.32Å; E2043-Y2047 WeakPolarHBondContact O-CD2 3.35Å
2044	R	93.1	Very high	92.9	Very high	38 Å²	38	32.3 Å²	32.3	14%	0.143	14%	0.143	C	C	.	.	H	α-helix	trans	-54.9	-41.3	178.2	-171.3	166.2	-162	169	1.3	112.2	Y1876 I2040 M2041 K2046 Y2047 E2048 T2050 D2052	Y1876-R2044 HydrophobicContact CD2-CB 3.64Å; Y1876-R2044 HydrophobicContact CD2-CG 3.97Å; Y1876-R2044 HydrophobicContact CE2-CB 3.59Å; Y1876-R2044 HydrophobicContact CE2-CG 3.44Å; Y1876-R2044 VanDerWaalsContact CE2-CG 3.44Å; Y1876-R2044 HydrophobicContact CG-CB 4.21Å; I2040-R2044 PolarHBondContact O-N 2.76Å; M2041-R2044 HydrophobicContact CE-CB 4.29Å; M2041-R2044 PolarHBondContact O-N 3.3Å; R2044-K2046 PolarHBondContact O-N 2.88Å; R2044-Y2047 PolarHBondContact O-N 3.05Å; R2044-Y2047 VanDerWaalsContact O-N 3.09Å; R2044-E2048 HydrophobicContact CG-CB 4.16Å; R2044-E2048 IonicContact CZ-OE2 3.73Å; R2044-E2048 IonicContact NE-OE2 2.61Å; R2044-E2048 PolarHBondContact NE-OE2 3.24Å; R2044-E2048 IonicContact NH2-OE2 2.67Å; R2044-E2048 PolarHBondContact NH2-OE2 2.81Å; R2044-E2048 PolarHBondContact O-N 3.16Å; R2044-T2050 PolarHBondContact NE-OG1 3.09Å; R2044-D2052 IonicContact CZ-OD2 2.93Å; R2044-D2052 IonicContact NH1-OD2 3Å; R2044-D2052 PolarHBondContact NH1-OD2 2.72Å
2045	L	88.9	Confident	92.7	Very high	21 Å²	21	33.5 Å²	33.5	11%	0.11	16%	0.155	C	C	.	.	H	α-helix	trans	-58.8	-26.5	175.1	-78	172.8	0	0	0	114.1	V1796 M2041 L2042 E2043 K2049 V2051 L2081 I2085	V1796-L2045 HydrophobicContact CG2-CD2 3.13Å; M2041-L2045 VanDerWaalsContact O-CB 3.28Å; M2041-L2045 WeakPolarHBondContact O-CB 3.24Å; M2041-L2045 WeakPolarHBondContact O-CG 3.18Å; M2041-L2045 PolarHBondContact O-N 2.95Å; L2042-L2045 HydrophobicContact CD2-CD1 4.21Å; E2043-L2045 VanDerWaalsContact C-N 3.25Å; E2043-L2045 PolarHBondContact O-N 3.01Å; L2045-K2049 WeakPolarHBondContact O-CD 3.1Å; L2045-K2049 PolarHBondContact O-NZ 2.86Å; L2045-V2051 HydrophobicContact CD1-CG2 4.35Å; L2045-V2051 HydrophobicContact CD2-CG2 3.57Å; L2045-V2051 HydrophobicContact CG-CG2 4.05Å; L2045-L2081 HydrophobicContact CD1-CD2 3.88Å; L2045-I2085 HydrophobicContact CD1-CD1 4.49Å; L2045-I2085 HydrophobicContact CD1-CG1 4.49Å; L2045-I2085 HydrophobicContact CD2-CD1 4.13Å; L2045-I2085 HydrophobicContact CD2-CG1 4.35Å
2046	K	85.2	Confident	92.5	Very high	112 Å²	112	34.1 Å²	34.1	49%	0.487	16%	0.159	S	C	.	.	H	α-helix	trans	-70.1	-44.5	174.1	-64.6	166.8	-172.5	173	0	110.8	L2042 E2043 R2044 K2049	L2042-K2046 WeakPolarHBondContact O-CG 3.06Å; E2043-K2046 VanDerWaalsContact O-CB 3.31Å; E2043-K2046 WeakPolarHBondContact O-CB 2.89Å; E2043-K2046 PolarHBondContact O-N 2.9Å; E2043-K2046 IonicContact OE1-NZ 2.94Å; E2043-K2046 PolarHBondContact OE1-NZ 3.32Å; R2044-K2046 PolarHBondContact O-N 2.88Å; K2046-K2049 PolarHBondContact O-NZ 2.9Å
2047	Y	87.9	Confident	92.4	Very high	159 Å²	159	34.1 Å²	34.1	62%	0.624	16%	0.159	S	C	*	.	H	α-helix	trans	-97.9	-42.9	-167.7	-62	-81.2	0	0	0	115.5	Y1876 E2043 R2044	Y1876-Y2047 HydrophobicContact CD1-CD2 4.07Å; Y1876-Y2047 AromaticContact CE1-CD2 3.49Å; Y1876-Y2047 HydrophobicContact CE1-CD2 3.49Å; Y1876-Y2047 VanDerWaalsContact CE1-CD2 3.49Å; Y1876-Y2047 HydrophobicContact CE1-CE2 4.29Å; Y1876-Y2047 HydrophobicContact CE1-CG 4.03Å; E2043-Y2047 HydrophobicContact CG-CE2 4.26Å; E2043-Y2047 VanDerWaalsContact O-CD2 3.32Å; E2043-Y2047 WeakPolarHBondContact O-CD2 3.35Å; R2044-Y2047 PolarHBondContact O-N 3.05Å; R2044-Y2047 VanDerWaalsContact O-N 3.09Å
2048	E	88.7	Confident	92.1	Very high	68 Å²	68	35.9 Å²	35.9	32%	0.318	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-16.7	-170.1	-84.5	176.4	-156.6	0	0	114.9	Y1876 R1877 R2044 T2050	Y1876-E2048 VanDerWaalsContact OH-CG 3.25Å; Y1876-E2048 WeakPolarHBondContact OH-CG 3.02Å; Y1876-E2048 PolarHBondContact OH-OE1 2.8Å; R1877-E2048 IonicContact CZ-OE1 3.53Å; R1877-E2048 IonicContact NE-OE1 3.32Å; R1877-E2048 IonicContact NH2-OE1 3.95Å; R1877-E2048 PolarHBondContact NH2-OE1 3.22Å; R2044-E2048 HydrophobicContact CG-CB 4.16Å; R2044-E2048 IonicContact CZ-OE2 3.73Å; R2044-E2048 IonicContact NE-OE2 2.61Å; R2044-E2048 PolarHBondContact NE-OE2 3.24Å; R2044-E2048 IonicContact NH2-OE2 2.67Å; R2044-E2048 PolarHBondContact NH2-OE2 2.81Å; R2044-E2048 PolarHBondContact O-N 3.16Å; E2048-T2050 PolarHBondContact O-N 2.84Å; E2048-T2050 PolarHBondContact OE2-OG1 2.96Å
2049	K	87.6	Confident	91.9	Very high	126 Å²	126	38.3 Å²	38.3	55%	0.548	19%	0.187	S	C	.	.	S	Bend	trans	55.8	30.5	-173.7	-48	-60.9	163.3	-158.8	0	113.8	V1796 L2045 K2046	V1796-K2049 WeakPolarHBondContact CB-O 3.45Å; V1796-K2049 WeakPolarHBondContact CG2-O 3.02Å; V1796-K2049 PolarHBondContact N-O 2.36Å; L2045-K2049 WeakPolarHBondContact O-CD 3.1Å; L2045-K2049 PolarHBondContact O-NZ 2.86Å; K2046-K2049 PolarHBondContact O-NZ 2.9Å
2050	T	91.1	Very high	91.9	Very high	26 Å²	26	38.4 Å²	38.4	16%	0.16	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	160.9	172.5	56.9	0	0	0	0	111	P1793 I1794 R2044 E2048	P1793-T2050 HydrophobicContact CB-CG2 4.38Å; I1794-T2050 CarbonylContact O-C 3.48Å; I1794-T2050 VanDerWaalsContact O-CA 3.24Å; I1794-T2050 WeakPolarHBondContact O-CA 3.28Å; R2044-T2050 PolarHBondContact NE-OG1 3.09Å; E2048-T2050 PolarHBondContact O-N 2.84Å; E2048-T2050 PolarHBondContact OE2-OG1 2.96Å
2051	V	90.2	Very high	91.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	135.6	177.1	175.3	0	0	0	0	108.2	I1794 V1796 L1799 M2041 L2045 I2053 L2081 I2085	I1794-V2051 WeakPolarHBondContact CA-O 3.33Å; I1794-V2051 WeakPolarHBondContact CB-O 3.47Å; I1794-V2051 PolarHBondContact N-O 2.78Å; I1794-V2051 PolarHBondContact O-N 2.78Å; V1796-V2051 HydrophobicContact CG2-CG2 4.4Å; L1799-V2051 HydrophobicContact CD1-CB 4.46Å; L1799-V2051 HydrophobicContact CD1-CG1 4.27Å; L1799-V2051 HydrophobicContact CD2-CG2 4.39Å; M2041-V2051 HydrophobicContact SD-CG1 4.11Å; L2045-V2051 HydrophobicContact CD1-CG2 4.35Å; L2045-V2051 HydrophobicContact CD2-CG2 3.57Å; L2045-V2051 HydrophobicContact CG-CG2 4.05Å; V2051-I2053 HydrophobicContact CG1-CD1 3.55Å; V2051-I2053 HydrophobicContact CG1-CG1 3.65Å; V2051-L2081 HydrophobicContact CG1-CD1 4.06Å; V2051-I2085 HydrophobicContact CG2-CD1 4.28Å
2052	D	93.1	Very high	91.8	Very high	22 Å²	22	42.1 Å²	42.1	12%	0.118	20%	0.202	C	C	.	.			trans	-146.4	71	-169.7	-178	5.1	0	0	0	108.8	P1793 M2041 R2044 G2055 C2056	P1793-D2052 HydrophobicContact CB-CB 4.16Å; P1793-D2052 HydrophobicContact CG-CB 4.32Å; M2041-D2052 HydrophobicContact SD-CB 4.39Å; M2041-D2052 PolarHBondContact SD-N 2.93Å; R2044-D2052 IonicContact CZ-OD2 2.93Å; R2044-D2052 IonicContact NH1-OD2 3Å; R2044-D2052 PolarHBondContact NH1-OD2 2.72Å; D2052-G2055 WeakPolarHBondContact OD1-CA 3.01Å; D2052-G2055 PolarHBondContact OD1-N 2.93Å; D2052-C2056 WeakPolarHBondContact O-CB 3.4Å; D2052-C2056 PolarHBondContact O-N 3.22Å
2053	I	95	Very high	91.9	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-74.1	-42.3	-171.9	-65.1	154.6	0	0	0	109.7	V2037 M2041 V2051 C2056 V2057 Y2074 I2077 H2078 L2081	V2037-I2053 HydrophobicContact CG1-CG2 4.25Å; M2041-I2053 HydrophobicContact CG-CG1 4.29Å; V2051-I2053 HydrophobicContact CG1-CD1 3.55Å; V2051-I2053 HydrophobicContact CG1-CG1 3.65Å; I2053-C2056 PolarHBondContact O-N 2.73Å; I2053-V2057 HydrophobicContact CG2-CG2 4.38Å; I2053-V2057 WeakPolarHBondContact O-CB 3.35Å; I2053-V2057 VanDerWaalsContact O-CG2 3.27Å; I2053-V2057 WeakPolarHBondContact O-CG2 3.06Å; I2053-V2057 PolarHBondContact O-N 3.45Å; I2053-Y2074 HydrophobicContact CG2-CD2 4.17Å; I2053-Y2074 HydrophobicContact CG2-CE2 3.64Å; I2053-I2077 HydrophobicContact CD1-CG2 4.09Å; I2053-I2077 HydrophobicContact CG1-CG2 3.94Å; I2053-I2077 HydrophobicContact CG2-CB 4.48Å; I2053-I2077 HydrophobicContact CG2-CG2 3.75Å; I2053-H2078 HydrophobicContact CD1-CB 4.4Å; I2053-H2078 VanDerWaalsContact CD1-CD2 3.41Å; I2053-H2078 WeakPolarHBondContact CD1-CD2 3.39Å; I2053-H2078 WeakPolarHBondContact CD1-NE2 3.38Å; I2053-L2081 HydrophobicContact CD1-CD1 3.71Å; I2053-L2081 HydrophobicContact CG1-CD1 3.85Å
2054	Y	94.2	Very high	92.2	Very high	26 Å²	26	40.2 Å²	40.2	10%	0.102	19%	0.193	C	C	.	.	H	α-helix	trans	-58.4	-53.7	173.5	-179.5	-89.5	0	0	0	112.2	H1791 E1817 S1820 I1821 C2056 V2057 K2058 Y2074	H1791-Y2054 HydrophobicContact CB-CD1 3.29Å; H1791-Y2054 HydrophobicContact CB-CD2 4.47Å; H1791-Y2054 HydrophobicContact CB-CE1 3.76Å; H1791-Y2054 HydrophobicContact CB-CG 3.7Å; H1791-Y2054 AromaticContact CD2-CD1 3.99Å; H1791-Y2054 AromaticContact CD2-CE1 3.61Å; H1791-Y2054 AromaticContact CD2-CE2 4Å; H1791-Y2054 AromaticContact CD2-CZ 3.61Å; H1791-Y2054 AromaticContact CG-CD1 3.55Å; H1791-Y2054 AromaticContact CG-CD2 3.97Å; H1791-Y2054 AromaticContact CG-CE1 3.69Å; H1791-Y2054 AromaticContact CG-CG 3.7Å; H1791-Y2054 AromaticContact CG-CZ 3.96Å; H1791-Y2054 AromaticContact ND1-CD2 3.81Å; H1791-Y2054 AromaticContact ND1-CG 3.86Å; H1791-Y2054 AromaticContact NE2-CZ 3.97Å; E1817-Y2054 HydrophobicContact CG-CD2 3.64Å; E1817-Y2054 HydrophobicContact CG-CE2 4.28Å; E1817-Y2054 HydrophobicContact CG-CG 4.49Å; S1820-Y2054 PolarHBondContact O-OH 3.18Å; S1820-Y2054 VanDerWaalsContact O-OH 3.13Å; S1820-Y2054 WeakPolarHBondContact OG-CE2 3.46Å; I1821-Y2054 HydrophobicContact CB-CE2 4.45Å; I1821-Y2054 HydrophobicContact CD1-CD2 4.34Å; I1821-Y2054 HydrophobicContact CG1-CD2 3.81Å; I1821-Y2054 HydrophobicContact CG1-CE2 3.66Å; Y2054-C2056 VanDerWaalsContact C-N 3.32Å; Y2054-C2056 PolarHBondContact O-N 2.93Å; Y2054-V2057 PolarHBondContact O-N 2.86Å; Y2054-K2058 HydrophobicContact CE1-CD 3.81Å; Y2054-K2058 VanDerWaalsContact O-CB 3.27Å; Y2054-K2058 WeakPolarHBondContact O-CB 3.02Å; Y2054-K2058 PolarHBondContact O-N 2.81Å; Y2054-Y2074 WeakPolarHBondContact CA-OH 3.13Å; Y2054-Y2074 WeakPolarHBondContact CB-OH 3.46Å; Y2054-Y2074 PolarHBondContact N-OH 3.35Å
2055	G	91.6	Very high	92.1	Very high	25 Å²	25	38.8 Å²	38.8	26%	0.258	19%	0.188	S	C	.	.	H	α-helix	trans	-63.4	-38.4	-179.4	0	0	0	0	0	112.3	D2052 A2059	D2052-G2055 WeakPolarHBondContact OD1-CA 3.01Å; D2052-G2055 PolarHBondContact OD1-N 2.93Å; G2055-A2059 WeakPolarHBondContact O-CB 3.07Å; G2055-A2059 PolarHBondContact O-N 2.79Å
2056	C	94.6	Very high	92.3	Very high	12 Å²	12	40.1 Å²	40.1	8%	0.081	19%	0.193	C	C	.	.	H	α-helix	trans	-61.7	-54.9	173.1	-173	0	0	0	0	111.8	V2037 M2041 D2052 I2053 Y2054 K2058 A2059 L2060	V2037-C2056 HydrophobicContact CG1-CB 4.31Å; M2041-C2056 HydrophobicContact CE-CB 3.89Å; D2052-C2056 WeakPolarHBondContact O-CB 3.4Å; D2052-C2056 PolarHBondContact O-N 3.22Å; I2053-C2056 PolarHBondContact O-N 2.73Å; Y2054-C2056 VanDerWaalsContact C-N 3.32Å; Y2054-C2056 PolarHBondContact O-N 2.93Å; C2056-K2058 VanDerWaalsContact C-N 3.31Å; C2056-K2058 PolarHBondContact O-N 2.72Å; C2056-A2059 WeakPolarHBondContact O-CB 3.2Å; C2056-A2059 PolarHBondContact O-N 3.45Å; C2056-A2059 VanDerWaalsContact O-N 3.07Å; C2056-L2060 WeakPolarHBondContact O-CG 3.11Å; C2056-L2060 PolarHBondContact O-N 3.26Å
2057	V	95.8	Very high	92.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.2	-39	-179.8	178.7	0	0	0	0	111.3	I1821 V2037 I2053 Y2054 A2059 L2060 R2061 V2068 Y2074	I1821-V2057 HydrophobicContact CD1-CB 4.23Å; I1821-V2057 HydrophobicContact CD1-CG1 3.87Å; I1821-V2057 HydrophobicContact CG2-CG1 4.16Å; V2037-V2057 HydrophobicContact CG1-CG2 4.29Å; V2037-V2057 HydrophobicContact CG2-CG2 3.78Å; I2053-V2057 HydrophobicContact CG2-CG2 4.38Å; I2053-V2057 WeakPolarHBondContact O-CB 3.35Å; I2053-V2057 VanDerWaalsContact O-CG2 3.27Å; I2053-V2057 WeakPolarHBondContact O-CG2 3.06Å; I2053-V2057 PolarHBondContact O-N 3.45Å; Y2054-V2057 PolarHBondContact O-N 2.86Å; V2057-A2059 VanDerWaalsContact C-N 3.32Å; V2057-A2059 PolarHBondContact O-N 2.81Å; V2057-L2060 PolarHBondContact O-N 3.32Å; V2057-R2061 HydrophobicContact CG1-CG 4.35Å; V2057-R2061 WeakPolarHBondContact O-CB 3.47Å; V2057-R2061 WeakPolarHBondContact O-CG 3.33Å; V2057-R2061 PolarHBondContact O-N 3.3Å; V2057-V2068 HydrophobicContact CG1-CB 4.12Å; V2057-V2068 HydrophobicContact CG1-CG2 4.26Å; V2057-V2068 HydrophobicContact CG2-CB 4.33Å; V2057-V2068 HydrophobicContact CG2-CG2 3.76Å; V2057-Y2074 HydrophobicContact CB-CE2 4.45Å; V2057-Y2074 HydrophobicContact CG2-CD2 4.25Å; V2057-Y2074 HydrophobicContact CG2-CE2 4.06Å
2058	K	92.3	Very high	93.1	Very high	38 Å²	38	27.2 Å²	27.2	17%	0.165	14%	0.14	C	C	.	.	H	α-helix	trans	-63.1	-36	174.6	-169.7	163.5	-179.3	167.1	0	112.2	I1821 E1822 E1824 Y2054 C2056 K2062	I1821-K2058 HydrophobicContact CG2-CB 3.92Å; I1821-K2058 HydrophobicContact CG2-CG 4.38Å; E1822-K2058 WeakPolarHBondContact O-CE 3.31Å; E1824-K2058 WeakPolarHBondContact OE1-CE 3.34Å; E1824-K2058 IonicContact OE1-NZ 2.82Å; E1824-K2058 PolarHBondContact OE1-NZ 2.94Å; Y2054-K2058 HydrophobicContact CE1-CD 3.81Å; Y2054-K2058 VanDerWaalsContact O-CB 3.27Å; Y2054-K2058 WeakPolarHBondContact O-CB 3.02Å; Y2054-K2058 PolarHBondContact O-N 2.81Å; C2056-K2058 VanDerWaalsContact C-N 3.31Å; C2056-K2058 PolarHBondContact O-N 2.72Å; K2058-K2062 WeakPolarHBondContact O-CG 2.79Å
2059	A	92.4	Very high	93.3	Very high	50 Å²	50	27 Å²	27	41%	0.413	14%	0.139	S	C	.	.	H	α-helix	trans	-69.9	-46.6	171.8	0	0	0	0	0	112	G2055 C2056 V2057 R2061 K2062	G2055-A2059 WeakPolarHBondContact O-CB 3.07Å; G2055-A2059 PolarHBondContact O-N 2.79Å; C2056-A2059 WeakPolarHBondContact O-CB 3.2Å; C2056-A2059 PolarHBondContact O-N 3.45Å; C2056-A2059 VanDerWaalsContact O-N 3.07Å; V2057-A2059 VanDerWaalsContact C-N 3.32Å; V2057-A2059 PolarHBondContact O-N 2.81Å; A2059-R2061 VanDerWaalsContact C-N 3.29Å; A2059-R2061 PolarHBondContact O-N 3.37Å; A2059-K2062 VanDerWaalsContact O-CB 3.32Å; A2059-K2062 WeakPolarHBondContact O-CB 3.17Å; A2059-K2062 PolarHBondContact O-N 3.24Å
2060	L	95.1	Very high	93.4	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.016	13%	0.128	C	C	.	.	H	α-helix	trans	-59.9	-39.9	179.2	-59.7	-155.7	0	0	0	111.9	I1873 I2036 V2037 I2040 C2056 V2057 K2062 Q2063 R2064 M2067	I1873-L2060 HydrophobicContact CG2-CD2 3.6Å; I2036-L2060 HydrophobicContact CB-CD1 4.33Å; I2036-L2060 HydrophobicContact CG2-CD1 3.77Å; V2037-L2060 HydrophobicContact CG2-CD1 3.49Å; V2037-L2060 VanDerWaalsContact CG2-CD1 3.49Å; V2037-L2060 HydrophobicContact CG2-CG 4.33Å; I2040-L2060 HydrophobicContact CD1-CD2 4.05Å; C2056-L2060 WeakPolarHBondContact O-CG 3.11Å; C2056-L2060 PolarHBondContact O-N 3.26Å; V2057-L2060 PolarHBondContact O-N 3.32Å; L2060-K2062 PolarHBondContact O-N 2.88Å; L2060-Q2063 PolarHBondContact O-N 2.88Å; L2060-R2064 PolarHBondContact O-N 2.73Å; L2060-M2067 HydrophobicContact CB-CB 3.7Å; L2060-M2067 HydrophobicContact CB-CE 4.32Å; L2060-M2067 HydrophobicContact CB-CG 4Å; L2060-M2067 HydrophobicContact CD1-CE 3.82Å
2061	R	95	Very high	93.5	Very high	29 Å²	29	24.9 Å²	24.9	11%	0.109	13%	0.133	C	C	.	.	H	α-helix	trans	-64.9	-16.1	176.5	-75.9	-174.8	178.8	-172.5	-0.9	114.2	Y1818 I1821 T1823 Y1849 V2057 A2059 R2064 M2067 V2068	Y1818-R2061 VanDerWaalsContact CE2-NH2 3.29Å; Y1818-R2061 VanDerWaalsContact CZ-NH2 3.34Å; Y1818-R2061 PolarHBondContact OH-NH2 3.14Å; I1821-R2061 PolarHBondContact O-NH1 3.16Å; I1821-R2061 VanDerWaalsContact O-NH1 3.11Å; T1823-R2061 HydrophobicContact CG2-CB 3.82Å; T1823-R2061 VanDerWaalsContact CG2-O 3.31Å; T1823-R2061 WeakPolarHBondContact CG2-O 3.23Å; Y1849-R2061 WeakPolarHBondContact CE2-O 3.33Å; Y1849-R2061 PolarHBondContact OH-O 2.86Å; V2057-R2061 HydrophobicContact CG1-CG 4.35Å; V2057-R2061 WeakPolarHBondContact O-CB 3.47Å; V2057-R2061 WeakPolarHBondContact O-CG 3.33Å; V2057-R2061 PolarHBondContact O-N 3.3Å; A2059-R2061 VanDerWaalsContact C-N 3.29Å; A2059-R2061 PolarHBondContact O-N 3.37Å; R2061-R2064 CarbonylContact C-O 3.14Å; R2061-R2064 VanDerWaalsContact CA-O 3.29Å; R2061-R2064 WeakPolarHBondContact CA-O 3.3Å; R2061-M2067 HydrophobicContact CG-CB 4.16Å; R2061-M2067 PolarHBondContact NE-O 3.46Å; R2061-V2068 PolarHBondContact NH2-O 2.93Å
2062	K	93	Very high	93.6	Very high	63 Å²	63	28.8 Å²	28.8	27%	0.274	15%	0.154	S	C	.	.	H	α-helix	trans	-78	-34.6	168.5	-61.9	-176.2	177.9	-160.8	0	112.3	Q1825 F1827 Y1849 H1851 K2058 A2059 L2060	Q1825-K2062 VanDerWaalsContact OE1-CE 3.3Å; F1827-K2062 HydrophobicContact CE1-CB 4.32Å; F1827-K2062 HydrophobicContact CE2-CB 4.21Å; F1827-K2062 HydrophobicContact CE2-CG 4.41Å; F1827-K2062 HydrophobicContact CZ-CB 3.58Å; F1827-K2062 HydrophobicContact CZ-CG 3.83Å; Y1849-K2062 WeakPolarHBondContact CD2-O 3.1Å; Y1849-K2062 VanDerWaalsContact CE2-O 3.26Å; Y1849-K2062 WeakPolarHBondContact CE2-O 2.72Å; H1851-K2062 PolarHBondContact CE1-O 3.38Å; H1851-K2062 PolarHBondContact NE2-O 3.47Å; K2058-K2062 WeakPolarHBondContact O-CG 2.79Å; A2059-K2062 VanDerWaalsContact O-CB 3.32Å; A2059-K2062 WeakPolarHBondContact O-CB 3.17Å; A2059-K2062 PolarHBondContact O-N 3.24Å; L2060-K2062 PolarHBondContact O-N 2.88Å
2063	Q	94.8	Very high	93.7	Very high	26 Å²	26	28.5 Å²	28.5	12%	0.121	15%	0.152	C	C	.	.	H	α-helix	trans	-87.5	-28	-177.2	-64.8	-176.4	-69.9	0	0	113.5	Y1849 S1852 N1871 I1873 D1874 L2060	Y1849-Q2063 WeakPolarHBondContact CD2-O 3.42Å; S1852-Q2063 PolarHBondContact OG-O 2.98Å; N1871-Q2063 WeakPolarHBondContact CB-O 3.43Å; N1871-Q2063 VanDerWaalsContact CG-O 3.27Å; N1871-Q2063 PolarHBondContact ND2-O 3.45Å; I1873-Q2063 HydrophobicContact CD1-CB 3.63Å; D1874-Q2063 PolarHBondContact OD1-NE2 2.67Å; L2060-Q2063 PolarHBondContact O-N 2.88Å
2064	R	95.7	Very high	93.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.151	C	C	.	.	S	Bend	trans	-149.8	145.1	172.2	-175.5	170.8	179.3	79.2	-3.5	109.6	N1869 N1871 I1873 A2027 G2028 V2029 L2060 R2061 M2067	N1869-R2064 VanDerWaalsContact OD1-CZ 3.24Å; N1869-R2064 PolarHBondContact OD1-NH1 3.44Å; N1869-R2064 PolarHBondContact OD1-NH2 3.47Å; N1871-R2064 HydrophobicContact CB-CB 4.08Å; N1871-R2064 WeakPolarHBondContact OD1-CB 3.06Å; N1871-R2064 WeakPolarHBondContact OD1-CD 3.36Å; N1871-R2064 VanDerWaalsContact OD1-CG 3.23Å; N1871-R2064 WeakPolarHBondContact OD1-CG 3.34Å; N1871-R2064 PolarHBondContact OD1-NH1 2.78Å; I1873-R2064 HydrophobicContact CD1-CB 3.96Å; A2027-R2064 PolarHBondContact O-NH2 2.73Å; G2028-R2064 PolarHBondContact O-NE 3.12Å; V2029-R2064 HydrophobicContact CG1-CG 3.8Å; L2060-R2064 PolarHBondContact O-N 2.73Å; R2061-R2064 CarbonylContact C-O 3.14Å; R2061-R2064 VanDerWaalsContact CA-O 3.29Å; R2061-R2064 WeakPolarHBondContact CA-O 3.3Å; R2064-M2067 HydrophobicContact CB-CG 3.94Å; R2064-M2067 HydrophobicContact CB-SD 4.1Å; R2064-M2067 HydrophobicContact CG-CG 4.48Å; R2064-M2067 HydrophobicContact CG-SD 4.25Å; R2064-M2067 WeakPolarHBondContact O-CG 3.44Å
2065	N	91.6	Very high	93.7	Very high	7 Å²	7	28.7 Å²	28.7	4%	0.037	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	160.8	-180	74	-4.2	0	0	0	112.2	V1846 I1847 Y1849 V2029 M2067	V1846-N2065 WeakPolarHBondContact CA-OD1 3.45Å; I1847-N2065 HydrophobicContact CD1-CB 3.7Å; I1847-N2065 WeakPolarHBondContact CD1-ND2 3.43Å; I1847-N2065 WeakPolarHBondContact CG1-ND2 3.32Å; I1847-N2065 PolarHBondContact N-ND2 2.76Å; I1847-N2065 VanDerWaalsContact N-ND2 3.15Å; I1847-N2065 PolarHBondContact N-OD1 2.93Å; Y1849-N2065 HydrophobicContact CE1-CB 4.31Å; V2029-N2065 WeakPolarHBondContact CG1-O 3.42Å; N2065-M2067 PolarHBondContact O-N 2.95Å
2066	F	93.1	Very high	93.9	Very high	49 Å²	49	27.9 Å²	27.9	22%	0.215	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	19.6	172.6	-50.7	-56.8	0	0	0	118.8	E200 V2029 V2068 Q2069	E200-F2066 HydrophobicContact CB-CE2 4.35Å; E200-F2066 HydrophobicContact CG-CE2 3.68Å; E200-F2066 HydrophobicContact CG-CZ 3.93Å; E200-F2066 WeakPolarHBondContact OE1-CZ 3.29Å; E200-F2066 WeakPolarHBondContact OE2-CZ 3.33Å; V2029-F2066 HydrophobicContact CB-CB 4.37Å; V2029-F2066 HydrophobicContact CG2-CB 4.03Å; F2066-V2068 CarbonylContact O-C 3.58Å; F2066-V2068 VanDerWaalsContact O-C 3.31Å; F2066-V2068 PolarHBondContact O-N 2.94Å; F2066-V2068 VanDerWaalsContact O-N 3.16Å; F2066-Q2069 HydrophobicContact CB-CG 4.42Å; F2066-Q2069 PolarHBondContact O-N 2.87Å
2067	M	96.3	Very high	94	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	-55	122.1	172.2	-66.3	-65.6	-79	0	0	109.1	I1873 A1884 V2029 I2036 L2060 R2061 R2064 N2065	I1873-M2067 HydrophobicContact CD1-CE 4.05Å; I1873-M2067 HydrophobicContact CG1-CE 4.16Å; A1884-M2067 HydrophobicContact CB-CE 4.06Å; A1884-M2067 HydrophobicContact CB-SD 4.3Å; V2029-M2067 HydrophobicContact CB-SD 4.12Å; V2029-M2067 HydrophobicContact CG1-SD 3.92Å; I2036-M2067 HydrophobicContact CD1-CE 4.08Å; L2060-M2067 HydrophobicContact CB-CB 3.7Å; L2060-M2067 HydrophobicContact CB-CE 4.32Å; L2060-M2067 HydrophobicContact CB-CG 4Å; L2060-M2067 HydrophobicContact CD1-CE 3.82Å; R2061-M2067 HydrophobicContact CG-CB 4.16Å; R2061-M2067 PolarHBondContact NE-O 3.46Å; R2064-M2067 HydrophobicContact CB-CG 3.94Å; R2064-M2067 HydrophobicContact CB-SD 4.1Å; R2064-M2067 HydrophobicContact CG-CG 4.48Å; R2064-M2067 HydrophobicContact CG-SD 4.25Å; R2064-M2067 WeakPolarHBondContact O-CG 3.44Å; N2065-M2067 PolarHBondContact O-N 2.95Å
2068	V	94.9	Very high	93.9	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	58.1	98.7	-160.2	-170	0	0	0	0	110.6	Y1818 V2029 V2037 V2057 R2061 F2066 Q2073 Y2074 I2077	Y1818-V2068 HydrophobicContact CE2-CG1 4.33Å; Y1818-V2068 PolarHBondContact OH-O 2.96Å; Y1818-V2068 VanDerWaalsContact OH-O 3.08Å; V2029-V2068 PolarHBondContact O-N 2.9Å; V2037-V2068 HydrophobicContact CG2-CG2 3.97Å; V2057-V2068 HydrophobicContact CG1-CB 4.12Å; V2057-V2068 HydrophobicContact CG1-CG2 4.26Å; V2057-V2068 HydrophobicContact CG2-CB 4.33Å; V2057-V2068 HydrophobicContact CG2-CG2 3.76Å; R2061-V2068 PolarHBondContact NH2-O 2.93Å; F2066-V2068 CarbonylContact O-C 3.58Å; F2066-V2068 VanDerWaalsContact O-C 3.31Å; F2066-V2068 PolarHBondContact O-N 2.94Å; F2066-V2068 VanDerWaalsContact O-N 3.16Å; V2068-Q2073 HydrophobicContact CG1-CB 3.75Å; V2068-Y2074 HydrophobicContact CG1-CD2 4.39Å; V2068-I2077 HydrophobicContact CB-CD1 4.42Å; V2068-I2077 HydrophobicContact CG1-CD1 3.9Å; V2068-I2077 HydrophobicContact CG2-CD1 3.56Å
2069	Q	90.8	Very high	93.8	Very high	65 Å²	65	27.7 Å²	27.7	30%	0.304	15%	0.147	S	C	.	.			trans	-95.3	-16.9	-163.5	-168.8	179.8	12.6	0	0	113.9	T201 Y1818 F2066	T201-Q2069 PolarHBondContact OG1-NE2 3.31Å; Y1818-Q2069 PolarHBondContact OH-O 2.97Å; F2066-Q2069 HydrophobicContact CB-CG 4.42Å; F2066-Q2069 PolarHBondContact O-N 2.87Å
2070	T	91.5	Very high	93.9	Very high	51 Å²	51	25.3 Å²	25.3	31%	0.313	13%	0.128	S	C	.	.	S	Bend	trans	-135.3	155.7	176.9	67.8	0	0	0	0	112.1	Y1818 D2072 Q2073 Y2074	Y1818-T2070 PolarHBondContact OH-N 3.2Å; T2070-D2072 VanDerWaalsContact C-N 3.32Å; T2070-D2072 PolarHBondContact O-N 3.07Å; T2070-Q2073 WeakPolarHBondContact O-CB 3.41Å; T2070-Q2073 PolarHBondContact O-N 3.37Å; T2070-Q2073 WeakPolarHBondContact OG1-CG 3.46Å; T2070-Q2073 PolarHBondContact OG1-N 3.27Å; T2070-Q2073 PolarHBondContact OG1-NE2 3.39Å; T2070-Y2074 PolarHBondContact O-N 2.73Å
2071	E	92.1	Very high	93.8	Very high	55 Å²	55	25.2 Å²	25.2	26%	0.257	13%	0.127	S	C	.	.	H	α-helix	trans	-57.2	-43	173.4	-172.9	-178.2	170.6	0	0	111.7	S1815 Y1818 Q2073 Y2074 I2075	S1815-E2071 VanDerWaalsContact CA-OE1 3.27Å; S1815-E2071 WeakPolarHBondContact CA-OE1 3.24Å; S1815-E2071 WeakPolarHBondContact CB-OE1 3.43Å; S1815-E2071 PolarHBondContact N-OE1 2.94Å; S1815-E2071 VanDerWaalsContact N-OE1 3.13Å; S1815-E2071 PolarHBondContact OG-OE1 3.05Å; S1815-E2071 PolarHBondContact OG-OE2 3.06Å; Y1818-E2071 HydrophobicContact CD1-CB 4.05Å; Y1818-E2071 HydrophobicContact CE1-CB 4.47Å; Y1818-E2071 HydrophobicContact CG-CB 4.36Å; E2071-Q2073 PolarHBondContact O-N 2.97Å; E2071-Q2073 VanDerWaalsContact O-N 3.13Å; E2071-Y2074 CarbonylContact O-C 3.58Å; E2071-Y2074 WeakPolarHBondContact O-CA 3.37Å; E2071-Y2074 VanDerWaalsContact O-CB 3.31Å; E2071-Y2074 WeakPolarHBondContact O-CB 3.28Å; E2071-Y2074 PolarHBondContact O-N 3.29Å; E2071-I2075 HydrophobicContact CG-CD1 3.92Å; E2071-I2075 HydrophobicContact CG-CG1 4.32Å; E2071-I2075 WeakPolarHBondContact O-CG1 3.43Å; E2071-I2075 PolarHBondContact O-N 3.44Å
2072	D	92.3	Very high	93.5	Very high	82 Å²	82	26 Å²	26	44%	0.439	13%	0.133	S	C	.	.	H	α-helix	trans	-49.5	-41.9	172.9	-61.8	-20.1	0	0	0	112.2	V1984 T2070 F2076	V1984-D2072 HydrophobicContact CG1-CB 3.8Å; V1984-D2072 HydrophobicContact CG2-CB 4.41Å; T2070-D2072 VanDerWaalsContact C-N 3.32Å; T2070-D2072 PolarHBondContact O-N 3.07Å; D2072-F2076 WeakPolarHBondContact O-CB 3.41Å; D2072-F2076 PolarHBondContact O-N 2.87Å
2073	Q	95.7	Very high	93.3	Very high	16 Å²	16	23.8 Å²	23.8	8%	0.075	12%	0.124	C	C	.	.	H	α-helix	trans	-69.1	-36.8	179.3	-66.4	162.1	28.6	0	0	111	W1979 V1984 G2030 V2068 T2070 E2071 F2076 I2077	W1979-Q2073 HydrophobicContact CZ2-CG 4.19Å; V1984-Q2073 HydrophobicContact CG1-CG 4.13Å; G2030-Q2073 PolarHBondContact O-OE1 3.11Å; V2068-Q2073 HydrophobicContact CG1-CB 3.75Å; T2070-Q2073 WeakPolarHBondContact O-CB 3.41Å; T2070-Q2073 PolarHBondContact O-N 3.37Å; T2070-Q2073 WeakPolarHBondContact OG1-CG 3.46Å; T2070-Q2073 PolarHBondContact OG1-N 3.27Å; T2070-Q2073 PolarHBondContact OG1-NE2 3.39Å; E2071-Q2073 PolarHBondContact O-N 2.97Å; E2071-Q2073 VanDerWaalsContact O-N 3.13Å; Q2073-F2076 PolarHBondContact O-N 3.47Å; Q2073-I2077 WeakPolarHBondContact O-CD1 3.4Å; Q2073-I2077 WeakPolarHBondContact O-CG1 3.48Å; Q2073-I2077 PolarHBondContact O-N 3.01Å
2074	Y	96.3	Very high	93	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-66.2	-44.7	176	-164.8	-104	0	0	0	112.1	F1814 E1817 Y1818 I1821 I2053 Y2054 V2057 V2068 T2070 E2071 F2076 I2077 H2078	F1814-Y2074 HydrophobicContact CD1-CD1 4.04Å; F1814-Y2074 HydrophobicContact CD1-CE1 4.2Å; E1817-Y2074 HydrophobicContact CG-CE1 4.2Å; E1817-Y2074 WeakPolarHBondContact OE1-CE1 3.18Å; E1817-Y2074 PolarHBondContact OE1-OH 2.97Å; Y1818-Y2074 HydrophobicContact CD2-CD1 4.4Å; Y1818-Y2074 AromaticContact CD2-CD2 3.98Å; Y1818-Y2074 HydrophobicContact CD2-CD2 3.98Å; Y1818-Y2074 AromaticContact CD2-CG 3.78Å; Y1818-Y2074 HydrophobicContact CD2-CG 3.78Å; I1821-Y2074 HydrophobicContact CD1-CD2 4.16Å; I1821-Y2074 HydrophobicContact CD1-CE2 3.65Å; I2053-Y2074 HydrophobicContact CG2-CD2 4.17Å; I2053-Y2074 HydrophobicContact CG2-CE2 3.64Å; Y2054-Y2074 WeakPolarHBondContact CA-OH 3.13Å; Y2054-Y2074 WeakPolarHBondContact CB-OH 3.46Å; Y2054-Y2074 PolarHBondContact N-OH 3.35Å; V2057-Y2074 HydrophobicContact CB-CE2 4.45Å; V2057-Y2074 HydrophobicContact CG2-CD2 4.25Å; V2057-Y2074 HydrophobicContact CG2-CE2 4.06Å; V2068-Y2074 HydrophobicContact CG1-CD2 4.39Å; T2070-Y2074 PolarHBondContact O-N 2.73Å; E2071-Y2074 CarbonylContact O-C 3.58Å; E2071-Y2074 WeakPolarHBondContact O-CA 3.37Å; E2071-Y2074 VanDerWaalsContact O-CB 3.31Å; E2071-Y2074 WeakPolarHBondContact O-CB 3.28Å; E2071-Y2074 PolarHBondContact O-N 3.29Å; Y2074-F2076 VanDerWaalsContact C-N 3.35Å; Y2074-I2077 PolarHBondContact O-N 3.47Å; Y2074-H2078 AromaticContact CD1-CE1 3.95Å; Y2074-H2078 AromaticContact CE1-CE1 3.48Å; Y2074-H2078 VanDerWaalsContact CE1-CE1 3.48Å; Y2074-H2078 WeakPolarHBondContact CE1-CE1 3.01Å; Y2074-H2078 AromaticContact CZ-CE1 3.73Å; Y2074-H2078 PolarHBondContact O-N 2.8Å; Y2074-H2078 PolarHBondContact O-ND1 3.39Å
2075	I	93.3	Very high	92.5	Very high	32 Å²	32	26 Å²	26	16%	0.164	14%	0.137	C	C	.	.	H	α-helix	trans	-65.4	-38.3	174.2	-62	173.3	0	0	0	110.9	N1811 F1814 E2071 H2078 S2079	N1811-I2075 HydrophobicContact CB-CD1 3.97Å; F1814-I2075 HydrophobicContact CB-CD1 4.08Å; F1814-I2075 HydrophobicContact CB-CG1 3.92Å; F1814-I2075 HydrophobicContact CD1-CG1 4Å; F1814-I2075 HydrophobicContact CD2-CD1 4.1Å; F1814-I2075 HydrophobicContact CD2-CG1 3.74Å; F1814-I2075 HydrophobicContact CD2-CG2 4.49Å; F1814-I2075 HydrophobicContact CE1-CG1 4.44Å; F1814-I2075 HydrophobicContact CE2-CG1 4.19Å; F1814-I2075 HydrophobicContact CE2-CG2 4.23Å; F1814-I2075 HydrophobicContact CG-CD1 4.18Å; F1814-I2075 HydrophobicContact CG-CG1 3.64Å; E2071-I2075 HydrophobicContact CG-CD1 3.92Å; E2071-I2075 HydrophobicContact CG-CG1 4.32Å; E2071-I2075 WeakPolarHBondContact O-CG1 3.43Å; E2071-I2075 PolarHBondContact O-N 3.44Å; I2075-H2078 WeakPolarHBondContact O-CB 3.46Å; I2075-H2078 PolarHBondContact O-N 2.99Å; I2075-S2079 PolarHBondContact O-N 2.84Å; I2075-S2079 PolarHBondContact O-OG 3.25Å
2076	F	94.6	Very high	92.2	Very high	7 Å²	7	28.9 Å²	28.9	3%	0.031	15%	0.153	C	C	.	.	H	α-helix	trans	-68.1	-35.8	178	179.9	-103	0	0	0	113	W1979 V1984 P1985 P1988 L1991 I2038 D2072 Q2073 Y2074 S2079 A2080	W1979-F2076 HydrophobicContact CH2-CD1 4.15Å; W1979-F2076 HydrophobicContact CH2-CE1 4.07Å; W1979-F2076 HydrophobicContact CZ3-CE1 4.27Å; V1984-F2076 HydrophobicContact CB-CB 3.98Å; V1984-F2076 HydrophobicContact CB-CD1 4.5Å; V1984-F2076 HydrophobicContact CB-CD2 3.92Å; V1984-F2076 HydrophobicContact CB-CG 3.89Å; V1984-F2076 HydrophobicContact CG1-CB 3.84Å; V1984-F2076 HydrophobicContact CG1-CG 4.12Å; V1984-F2076 HydrophobicContact CG2-CB 4.1Å; V1984-F2076 HydrophobicContact CG2-CD2 4.06Å; V1984-F2076 HydrophobicContact CG2-CG 4.28Å; P1985-F2076 HydrophobicContact CB-CE2 3.87Å; P1985-F2076 HydrophobicContact CB-CZ 3.87Å; P1985-F2076 HydrophobicContact CG-CE1 4.29Å; P1985-F2076 HydrophobicContact CG-CE2 4.06Å; P1985-F2076 HydrophobicContact CG-CZ 3.65Å; P1985-F2076 WeakPolarHBondContact O-CE2 3.23Å; P1988-F2076 HydrophobicContact CB-CE2 3.93Å; P1988-F2076 HydrophobicContact CB-CZ 4.06Å; L1991-F2076 HydrophobicContact CD2-CE1 3.62Å; L1991-F2076 HydrophobicContact CD2-CZ 4.18Å; I2038-F2076 HydrophobicContact CD1-CE1 4.48Å; D2072-F2076 WeakPolarHBondContact O-CB 3.41Å; D2072-F2076 PolarHBondContact O-N 2.87Å; Q2073-F2076 PolarHBondContact O-N 3.47Å; Y2074-F2076 VanDerWaalsContact C-N 3.35Å; F2076-S2079 PolarHBondContact O-N 3.42Å; F2076-A2080 WeakPolarHBondContact O-CB 3.48Å; F2076-A2080 PolarHBondContact O-N 3.31Å
2077	I	96.6	Very high	91.5	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-59.9	-46.7	172.1	-69.2	157.6	0	0	0	110.7	A2034 V2037 I2038 I2053 V2068 Q2073 Y2074 S2079 A2080 L2081	A2034-I2077 HydrophobicContact CB-CD1 4.27Å; A2034-I2077 HydrophobicContact CB-CG1 4.2Å; V2037-I2077 HydrophobicContact CB-CD1 4.1Å; V2037-I2077 HydrophobicContact CB-CG2 4.41Å; V2037-I2077 HydrophobicContact CG1-CD1 4.19Å; V2037-I2077 HydrophobicContact CG1-CG2 3.69Å; V2037-I2077 HydrophobicContact CG2-CD1 4.48Å; I2038-I2077 HydrophobicContact CD1-CG1 4.26Å; I2038-I2077 HydrophobicContact CG1-CB 4.27Å; I2038-I2077 HydrophobicContact CG1-CG1 4.03Å; I2038-I2077 HydrophobicContact CG1-CG2 4.06Å; I2053-I2077 HydrophobicContact CD1-CG2 4.09Å; I2053-I2077 HydrophobicContact CG1-CG2 3.94Å; I2053-I2077 HydrophobicContact CG2-CB 4.48Å; I2053-I2077 HydrophobicContact CG2-CG2 3.75Å; V2068-I2077 HydrophobicContact CB-CD1 4.42Å; V2068-I2077 HydrophobicContact CG1-CD1 3.9Å; V2068-I2077 HydrophobicContact CG2-CD1 3.56Å; Q2073-I2077 WeakPolarHBondContact O-CD1 3.4Å; Q2073-I2077 WeakPolarHBondContact O-CG1 3.48Å; Q2073-I2077 PolarHBondContact O-N 3.01Å; Y2074-I2077 PolarHBondContact O-N 3.47Å; I2077-S2079 VanDerWaalsContact C-N 3.33Å; I2077-S2079 PolarHBondContact O-N 3.5Å; I2077-A2080 PolarHBondContact O-N 3.33Å; I2077-L2081 HydrophobicContact CG2-CD1 3.86Å; I2077-L2081 WeakPolarHBondContact O-CG 3.29Å; I2077-L2081 PolarHBondContact O-N 3.35Å; I2077-L2081 VanDerWaalsContact O-N 3.07Å
2078	H	94.2	Very high	90.7	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-58.9	-45.8	175	-75.8	82.2	0	0	0	111.6	V1803 F1814 I2053 Y2074 I2075 A2080 L2081 L2082	V1803-H2078 HydrophobicContact CG2-CB 3.99Å; F1814-H2078 HydrophobicContact CE1-CB 4.17Å; F1814-H2078 AromaticContact CE1-CD2 3.85Å; F1814-H2078 AromaticContact CE1-CE1 3.77Å; F1814-H2078 AromaticContact CE1-CG 3.6Å; F1814-H2078 AromaticContact CE1-ND1 3.55Å; F1814-H2078 AromaticContact CE1-NE2 3.97Å; F1814-H2078 HydrophobicContact CZ-CB 4.05Å; F1814-H2078 AromaticContact CZ-CG 3.94Å; I2053-H2078 HydrophobicContact CD1-CB 4.4Å; I2053-H2078 VanDerWaalsContact CD1-CD2 3.41Å; I2053-H2078 WeakPolarHBondContact CD1-CD2 3.39Å; I2053-H2078 WeakPolarHBondContact CD1-NE2 3.38Å; Y2074-H2078 AromaticContact CD1-CE1 3.95Å; Y2074-H2078 AromaticContact CE1-CE1 3.48Å; Y2074-H2078 VanDerWaalsContact CE1-CE1 3.48Å; Y2074-H2078 WeakPolarHBondContact CE1-CE1 3.01Å; Y2074-H2078 AromaticContact CZ-CE1 3.73Å; Y2074-H2078 PolarHBondContact O-N 2.8Å; Y2074-H2078 PolarHBondContact O-ND1 3.39Å; I2075-H2078 WeakPolarHBondContact O-CB 3.46Å; I2075-H2078 PolarHBondContact O-N 2.99Å; H2078-A2080 PolarHBondContact O-N 2.86Å; H2078-L2081 PolarHBondContact O-N 3.48Å; H2078-L2082 WeakPolarHBondContact O-CB 3.42Å; H2078-L2082 PolarHBondContact O-N 3Å
2079	S	91.6	Very high	90	Very high	46 Å²	46	34 Å²	34	32%	0.322	19%	0.19	S	C	.	.	H	α-helix	trans	-61.9	-40	178.4	-56	0	0	0	0	112.6	I2075 F2076 I2077 E2083	I2075-S2079 PolarHBondContact O-N 2.84Å; I2075-S2079 PolarHBondContact O-OG 3.25Å; F2076-S2079 PolarHBondContact O-N 3.42Å; I2077-S2079 VanDerWaalsContact C-N 3.33Å; I2077-S2079 PolarHBondContact O-N 3.5Å; S2079-E2083 WeakPolarHBondContact O-CB 3.27Å; S2079-E2083 PolarHBondContact O-N 3.48Å
2080	A	92.5	Very high	89.8	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-69.2	-36.7	178.5	0	0	0	0	0	112.9	P1988 L1992 I2038 F2076 I2077 H2078 V2084	P1988-A2080 HydrophobicContact CB-CB 3.64Å; P1988-A2080 HydrophobicContact CG-CB 4.47Å; L1992-A2080 HydrophobicContact CD2-CB 4.18Å; I2038-A2080 HydrophobicContact CD1-CB 3.7Å; I2038-A2080 HydrophobicContact CG1-CB 4.2Å; F2076-A2080 WeakPolarHBondContact O-CB 3.48Å; F2076-A2080 PolarHBondContact O-N 3.31Å; I2077-A2080 PolarHBondContact O-N 3.33Å; H2078-A2080 PolarHBondContact O-N 2.86Å; A2080-V2084 PolarHBondContact O-N 3.17Å
2081	L	93.6	Very high	89.5	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-76.7	-36	177.9	-68.1	163.3	0	0	0	111.7	L1799 I2038 M2041 L2042 L2045 V2051 I2053 I2077 H2078 V2084 I2085	L1799-L2081 HydrophobicContact CD2-CB 4.32Å; I2038-L2081 HydrophobicContact CG2-CD2 4.4Å; M2041-L2081 HydrophobicContact CB-CD1 3.51Å; M2041-L2081 HydrophobicContact CB-CD2 3.56Å; M2041-L2081 HydrophobicContact CB-CG 4.2Å; M2041-L2081 HydrophobicContact CG-CD1 3.76Å; L2042-L2081 HydrophobicContact CD2-CD2 4.07Å; L2042-L2081 HydrophobicContact CG-CD2 4.09Å; L2045-L2081 HydrophobicContact CD1-CD2 3.88Å; V2051-L2081 HydrophobicContact CG1-CD1 4.06Å; I2053-L2081 HydrophobicContact CD1-CD1 3.71Å; I2053-L2081 HydrophobicContact CG1-CD1 3.85Å; I2077-L2081 HydrophobicContact CG2-CD1 3.86Å; I2077-L2081 WeakPolarHBondContact O-CG 3.29Å; I2077-L2081 PolarHBondContact O-N 3.35Å; I2077-L2081 VanDerWaalsContact O-N 3.07Å; H2078-L2081 PolarHBondContact O-N 3.48Å; L2081-V2084 PolarHBondContact O-N 3.37Å; L2081-I2085 WeakPolarHBondContact O-CD1 3.38Å; L2081-I2085 WeakPolarHBondContact O-CG1 3.47Å; L2081-I2085 PolarHBondContact O-N 2.84Å
2082	L	90.3	Very high	89.3	Confident	47 Å²	47	28.4 Å²	28.4	25%	0.246	16%	0.161	C	C	.	.	H	α-helix	trans	-61.2	-42.8	170.8	-176.8	61.3	0	0	0	111.9	L1799 P1800 V1803 H2078 V2084 I2085 D2086	L1799-L2082 HydrophobicContact CD2-CB 4.47Å; P1800-L2082 HydrophobicContact CB-CD1 4.03Å; P1800-L2082 HydrophobicContact CG-CD1 3.78Å; V1803-L2082 HydrophobicContact CB-CD2 4.41Å; V1803-L2082 HydrophobicContact CG1-CD2 4.23Å; H2078-L2082 WeakPolarHBondContact O-CB 3.42Å; H2078-L2082 PolarHBondContact O-N 3Å; L2082-V2084 PolarHBondContact O-N 3.02Å; L2082-I2085 PolarHBondContact O-N 2.83Å; L2082-D2086 PolarHBondContact O-N 2.74Å
2083	E	88.2	Confident	89	Confident	15 Å²	15	26.4 Å²	26.4	7%	0.07	15%	0.153	C	C	.	.	H	α-helix	trans	-57.2	-44.8	174.1	170.1	61.4	-146	0	0	112.3	P1988 I1989 L1992 S2079 A2087 Q2345 R2348	P1988-E2083 HydrophobicContact CG-CB 3.82Å; P1988-E2083 HydrophobicContact CG-CG 4.03Å; I1989-E2083 HydrophobicContact CG1-CG 4.06Å; L1992-E2083 HydrophobicContact CD1-CB 3.93Å; L1992-E2083 HydrophobicContact CD1-CG 3.45Å; L1992-E2083 VanDerWaalsContact CD1-CG 3.45Å; S2079-E2083 WeakPolarHBondContact O-CB 3.27Å; S2079-E2083 PolarHBondContact O-N 3.48Å; E2083-A2087 WeakPolarHBondContact O-CB 3.41Å; E2083-A2087 PolarHBondContact O-N 3.38Å; E2083-Q2345 PolarHBondContact OE1-NE2 2.97Å; E2083-Q2345 PolarHBondContact OE1-OE1 2.95Å; E2083-R2348 VanDerWaalsContact CD-NE 3.25Å; E2083-R2348 VanDerWaalsContact OE1-CD 3.32Å; E2083-R2348 WeakPolarHBondContact OE1-CD 3.42Å; E2083-R2348 IonicContact OE1-CZ 3.26Å; E2083-R2348 IonicContact OE1-NE 3.3Å; E2083-R2348 PolarHBondContact OE1-NE 2.83Å; E2083-R2348 IonicContact OE1-NH2 3.89Å; E2083-R2348 IonicContact OE2-CZ 2.99Å; E2083-R2348 VanDerWaalsContact OE2-CZ 3.23Å; E2083-R2348 IonicContact OE2-NE 3.17Å; E2083-R2348 PolarHBondContact OE2-NE 3.36Å; E2083-R2348 IonicContact OE2-NH2 3.44Å; E2083-R2348 PolarHBondContact OE2-NH2 3.37Å
2084	V	87.6	Confident	88.5	Confident	28 Å²	28	25.8 Å²	25.8	17%	0.17	15%	0.15	C	C	.	.	H	α-helix	trans	-70	-31.8	177.6	175.3	0	0	0	0	112.7	L1992 L2042 A2080 L2081 L2082 G2088	L1992-V2084 HydrophobicContact CD1-CG2 3.65Å; L1992-V2084 HydrophobicContact CD2-CG2 3.56Å; L1992-V2084 HydrophobicContact CG-CG2 4.1Å; L2042-V2084 HydrophobicContact CD2-CB 3.98Å; L2042-V2084 HydrophobicContact CD2-CG1 3.69Å; L2042-V2084 HydrophobicContact CD2-CG2 3.85Å; A2080-V2084 PolarHBondContact O-N 3.17Å; L2081-V2084 PolarHBondContact O-N 3.37Å; L2082-V2084 PolarHBondContact O-N 3.02Å; V2084-G2088 VanDerWaalsContact O-CA 3.24Å; V2084-G2088 WeakPolarHBondContact O-CA 3.41Å; V2084-G2088 PolarHBondContact O-N 3.37Å
2085	I	86.8	Confident	87.9	Confident	45 Å²	45	33.9 Å²	33.9	23%	0.231	18%	0.181	C	C	.	.	H	α-helix	trans	-71.8	-41.7	177.4	-74	160.8	0	0	0	111.2	V1796 L1799 L2045 V2051 L2081 L2082	V1796-I2085 HydrophobicContact CB-CD1 4.5Å; V1796-I2085 HydrophobicContact CG1-CD1 4.06Å; V1796-I2085 HydrophobicContact CG1-CG1 3.99Å; V1796-I2085 HydrophobicContact CG1-CG2 3.77Å; V1796-I2085 HydrophobicContact CG2-CD1 4.1Å; L1799-I2085 HydrophobicContact CB-CD1 4.41Å; L1799-I2085 HydrophobicContact CD2-CD1 3.47Å; L1799-I2085 VanDerWaalsContact CD2-CD1 3.47Å; L2045-I2085 HydrophobicContact CD1-CD1 4.49Å; L2045-I2085 HydrophobicContact CD1-CG1 4.49Å; L2045-I2085 HydrophobicContact CD2-CD1 4.13Å; L2045-I2085 HydrophobicContact CD2-CG1 4.35Å; V2051-I2085 HydrophobicContact CG2-CD1 4.28Å; L2081-I2085 WeakPolarHBondContact O-CD1 3.38Å; L2081-I2085 WeakPolarHBondContact O-CG1 3.47Å; L2081-I2085 PolarHBondContact O-N 2.84Å; L2082-I2085 PolarHBondContact O-N 2.83Å
2086	D	83.2	Confident	87.7	Confident	68 Å²	68	36 Å²	36	36%	0.364	19%	0.192	S	C	.	.	H	α-helix	trans	-70.9	-47.8	176.7	175.9	49.1	0	0	0	112.3	L2082 K2121 R2348	L2082-D2086 PolarHBondContact O-N 2.74Å; D2086-K2121 PolarHBondContact O-NZ 2.79Å; D2086-R2348 IonicContact OD2-CZ 3.54Å; D2086-R2348 IonicContact OD2-NH1 3.69Å; D2086-R2348 PolarHBondContact OD2-NH1 2.91Å; D2086-R2348 IonicContact OD2-NH2 3.33Å; D2086-R2348 PolarHBondContact OD2-NH2 2.97Å
2087	A	80.1	Confident	87.5	Confident	8 Å²	8	35.7 Å²	35.7	7%	0.066	19%	0.191	C	C	.	.	H	α-helix	trans	-72.5	-39.8	179.8	0	0	0	0	0	113.2	E2083 F2344	E2083-A2087 WeakPolarHBondContact O-CB 3.41Å; E2083-A2087 PolarHBondContact O-N 3.38Å; A2087-F2344 HydrophobicContact CB-CD1 4.24Å; A2087-F2344 HydrophobicContact CB-CE1 3.59Å; A2087-F2344 HydrophobicContact CB-CZ 4.48Å
2088	G	78.4	Confident	87.1	Confident	28 Å²	28	38 Å²	38	29%	0.289	21%	0.208	S	C	.	.			trans	75.4	-155.5	-168.2	0	0	0	0	0	113.2	R1996 V2084	R1996-G2088 PolarHBondContact NH2-O 2.89Å; V2084-G2088 VanDerWaalsContact O-CA 3.24Å; V2084-G2088 WeakPolarHBondContact O-CA 3.41Å; V2084-G2088 PolarHBondContact O-N 3.37Å
2089	N	79.9	Confident	86.9	Confident	121 Å²	121	41.1 Å²	41.1	65%	0.647	23%	0.233	S	C	*	.			trans	-104.6	102.1	173.4	-175.5	55.6	0	0	0	111.2
2090	T	86.8	Confident	86.9	Confident	7 Å²	7	40.6 Å²	40.6	4%	0.043	23%	0.226	C	C	.	.			trans	-103.7	5.9	-179.1	49.6	0	0	0	0	113.1	D2342 F2344	T2090-D2342 VanDerWaalsContact CB-OD1 3.29Å; T2090-D2342 WeakPolarHBondContact CB-OD1 3.48Å; T2090-D2342 VanDerWaalsContact OG1-CG 3.22Å; T2090-D2342 PolarHBondContact OG1-OD1 2.94Å; T2090-D2342 PolarHBondContact OG1-OD2 3.26Å; T2090-D2342 VanDerWaalsContact OG1-OD2 3.12Å; T2090-F2344 HydrophobicContact CG2-CB 3.7Å; T2090-F2344 HydrophobicContact CG2-CD1 3.9Å; T2090-F2344 HydrophobicContact CG2-CG 3.8Å
2091	E	85.7	Confident	86.8	Confident	36 Å²	36	40.8 Å²	40.8	17%	0.168	23%	0.227	C	C	.	.			trans	-87.1	129	179	-169.1	168.1	95.6	0	0	111.6	R1996 R2334 I2340 D2342	R1996-E2091 IonicContact NH1-OE2 3.39Å; E2091-R2334 IonicContact OE2-CZ 3.2Å; E2091-R2334 IonicContact OE2-NH1 2.75Å; E2091-R2334 PolarHBondContact OE2-NH1 3.36Å; E2091-R2334 IonicContact OE2-NH2 3.78Å; E2091-R2334 PolarHBondContact OE2-NH2 3.31Å; E2091-I2340 HydrophobicContact CG-CB 4.31Å; E2091-I2340 HydrophobicContact CG-CD1 4.21Å; E2091-I2340 HydrophobicContact CG-CG1 4.4Å; E2091-D2342 HydrophobicContact CB-CB 4.25Å; E2091-D2342 HydrophobicContact CG-CB 4.42Å
2092	V	88.3	Confident	86.6	Confident	9 Å²	9	47.5 Å²	47.5	6%	0.055	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	122.1	-169	-173.6	0	0	0	0	109.7	A2094 N2096 H2100 I2340 V2341	V2092-A2094 PolarHBondContact O-N 2.81Å; V2092-N2096 HydrophobicContact CG1-CB 4.14Å; V2092-H2100 HydrophobicContact CG1-CB 3.73Å; V2092-H2100 HydrophobicContact CG2-CB 4.19Å; V2092-I2340 CarbonylContact O-C 3.03Å; V2092-I2340 WeakPolarHBondContact O-CA 3.22Å; V2092-V2341 PolarHBondContact N-O 3.17Å; V2092-V2341 PolarHBondContact O-N 2.93Å
2093	P	86	Confident	86.6	Confident	41 Å²	41	52 Å²	52	27%	0.266	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	137.4	169.4	-23.6	34.2	0	0	0	111.1	R2095 N2096 L2097	P2093-R2095 VanDerWaalsContact C-N 3.31Å; P2093-R2095 HydrophobicContact CB-CG 4.22Å; P2093-R2095 PolarHBondContact O-N 3.39Å; P2093-N2096 WeakPolarHBondContact O-CA 3.49Å; P2093-N2096 WeakPolarHBondContact O-CB 3.29Å; P2093-N2096 PolarHBondContact O-N 2.86Å; P2093-L2097 PolarHBondContact O-N 2.79Å
2094	A	84.5	Confident	86.7	Confident	2 Å²	2	51.8 Å²	51.8	2%	0.017	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-54.1	-44.6	-172.2	0	0	0	0	0	112.7	V2092 N2096 L2097 M2335 G2339 L2375 Y2381	V2092-A2094 PolarHBondContact O-N 2.81Å; A2094-N2096 PolarHBondContact O-N 2.79Å; A2094-N2096 VanDerWaalsContact O-N 3.08Å; A2094-L2097 WeakPolarHBondContact O-CB 3.35Å; A2094-L2097 PolarHBondContact O-N 3Å; A2094-M2335 HydrophobicContact CB-CG 4.08Å; A2094-M2335 HydrophobicContact CB-SD 4.17Å; A2094-G2339 WeakPolarHBondContact CB-O 3.24Å; A2094-G2339 PolarHBondContact N-O 3.07Å; A2094-L2375 HydrophobicContact CB-CD1 3.87Å; A2094-L2375 HydrophobicContact CB-CD2 4.33Å; A2094-L2375 WeakPolarHBondContact O-CD2 3.38Å; A2094-Y2381 HydrophobicContact CB-CD1 4.44Å
2095	R	84.1	Confident	86.8	Confident	170 Å²	170	55.4 Å²	55.4	64%	0.642	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-52	-30	172.3	59.6	170.5	-173.7	-90.7	0.3	114.8	P2093	P2093-R2095 VanDerWaalsContact C-N 3.31Å; P2093-R2095 HydrophobicContact CB-CG 4.22Å; P2093-R2095 PolarHBondContact O-N 3.39Å
2096	N	89.6	Confident	86.8	Confident	77 Å²	77	59 Å²	59	41%	0.412	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-92.1	-6.1	179.7	-68.1	3.6	0	0	0	113	V2092 P2093 A2094 S2098 A2099 H2100	V2092-N2096 HydrophobicContact CG1-CB 4.14Å; P2093-N2096 WeakPolarHBondContact O-CA 3.49Å; P2093-N2096 WeakPolarHBondContact O-CB 3.29Å; P2093-N2096 PolarHBondContact O-N 2.86Å; A2094-N2096 PolarHBondContact O-N 2.79Å; A2094-N2096 VanDerWaalsContact O-N 3.08Å; N2096-S2098 VanDerWaalsContact C-N 3.33Å; N2096-S2098 PolarHBondContact O-N 3.17Å; N2096-A2099 PolarHBondContact O-N 3.02Å; N2096-A2099 VanDerWaalsContact O-N 3.07Å; N2096-H2100 PolarHBondContact O-N 3.23Å
2097	L	90.1	Very high	86.8	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-57.7	-42.5	-173.5	-177.7	65.6	0	0	0	112.5	P2093 A2094 A2099 H2100 I2101 V2341 Y2368 V2371 L2372 L2375	P2093-L2097 PolarHBondContact O-N 2.79Å; A2094-L2097 WeakPolarHBondContact O-CB 3.35Å; A2094-L2097 PolarHBondContact O-N 3Å; L2097-A2099 VanDerWaalsContact C-N 3.33Å; L2097-A2099 PolarHBondContact O-N 2.84Å; L2097-H2100 PolarHBondContact O-N 3.48Å; L2097-I2101 HydrophobicContact CD1-CD1 3.94Å; L2097-I2101 HydrophobicContact CD1-CG1 4.19Å; L2097-I2101 HydrophobicContact CD2-CD1 4.36Å; L2097-I2101 HydrophobicContact CG-CD1 3.77Å; L2097-I2101 HydrophobicContact CG-CG1 4.39Å; L2097-I2101 WeakPolarHBondContact O-CG1 3.26Å; L2097-I2101 PolarHBondContact O-N 3.02Å; L2097-V2341 HydrophobicContact CD1-CB 4.26Å; L2097-V2341 HydrophobicContact CD1-CG1 3.97Å; L2097-V2341 HydrophobicContact CD1-CG2 4.49Å; L2097-V2341 HydrophobicContact CD2-CG2 4.36Å; L2097-Y2368 HydrophobicContact CD1-CD1 4.27Å; L2097-V2371 HydrophobicContact CD2-CB 4.33Å; L2097-V2371 HydrophobicContact CD2-CG1 3.74Å; L2097-L2372 HydrophobicContact CD2-CB 4.22Å; L2097-L2372 HydrophobicContact CD2-CD1 4.32Å; L2097-L2372 HydrophobicContact CG-CD1 4.43Å; L2097-L2375 HydrophobicContact CB-CD2 4.14Å; L2097-L2375 HydrophobicContact CD2-CD2 4.05Å
2098	S	87.8	Confident	86.6	Confident	50 Å²	50	61.8 Å²	61.8	35%	0.35	31%	0.314	S	S	.	.	H	α-helix	trans	-60.4	-41.6	176.7	-173.1	0	0	0	0	112.1	N2096 K2102	N2096-S2098 VanDerWaalsContact C-N 3.33Å; N2096-S2098 PolarHBondContact O-N 3.17Å; S2098-K2102 WeakPolarHBondContact O-CB 3.46Å; S2098-K2102 VanDerWaalsContact O-CG 3.23Å; S2098-K2102 WeakPolarHBondContact O-CG 3.15Å; S2098-K2102 PolarHBondContact O-N 3Å
2099	A	89.7	Confident	86.5	Confident	65 Å²	65	64.8 Å²	64.8	54%	0.537	34%	0.336	S	S	.	.	H	α-helix	trans	-70.3	-37.3	177.5	0	0	0	0	0	112.2	N2096 L2097 K2103	N2096-A2099 PolarHBondContact O-N 3.02Å; N2096-A2099 VanDerWaalsContact O-N 3.07Å; L2097-A2099 VanDerWaalsContact C-N 3.33Å; L2097-A2099 PolarHBondContact O-N 2.84Å; A2099-K2103 PolarHBondContact O-N 3.37Å
2100	H	91.2	Very high	86.2	Confident	36 Å²	36	62.9 Å²	62.9	17%	0.167	33%	0.328	C	S	.	.	H	α-helix	trans	-67.5	-45.5	175.3	172.9	88.5	0	0	0	112.3	V2092 N2096 L2097 K2102 K2103 L2104 Y2368	V2092-H2100 HydrophobicContact CG1-CB 3.73Å; V2092-H2100 HydrophobicContact CG2-CB 4.19Å; N2096-H2100 PolarHBondContact O-N 3.23Å; L2097-H2100 PolarHBondContact O-N 3.48Å; H2100-K2102 VanDerWaalsContact C-N 3.32Å; H2100-K2102 PolarHBondContact O-N 3.39Å; H2100-K2103 CarbonylContact O-C 3.51Å; H2100-K2103 WeakPolarHBondContact O-CA 3.27Å; H2100-K2103 WeakPolarHBondContact O-CB 3.25Å; H2100-K2103 PolarHBondContact O-N 2.85Å; H2100-K2103 VanDerWaalsContact O-N 3.09Å; H2100-L2104 VanDerWaalsContact NE2-CD1 3.31Å; H2100-L2104 WeakPolarHBondContact NE2-CD1 3.27Å; H2100-L2104 PolarHBondContact O-N 2.72Å; H2100-Y2368 AromaticContact CD2-CE1 3.78Å; H2100-Y2368 AromaticContact NE2-CE1 3.66Å
2101	I	91.8	Very high	85.5	Confident	4 Å²	4	64.9 Å²	64.9	2%	0.021	35%	0.351	C	S	.	.	H	α-helix	trans	-61.5	-41	175.5	-69.4	168.6	0	0	0	110.8	L2097 K2103 L2104 R2105 Y2368 L2372	L2097-I2101 HydrophobicContact CD1-CD1 3.94Å; L2097-I2101 HydrophobicContact CD1-CG1 4.19Å; L2097-I2101 HydrophobicContact CD2-CD1 4.36Å; L2097-I2101 HydrophobicContact CG-CD1 3.77Å; L2097-I2101 HydrophobicContact CG-CG1 4.39Å; L2097-I2101 WeakPolarHBondContact O-CG1 3.26Å; L2097-I2101 PolarHBondContact O-N 3.02Å; I2101-K2103 VanDerWaalsContact C-N 3.35Å; I2101-K2103 PolarHBondContact O-N 2.83Å; I2101-L2104 PolarHBondContact O-N 3.07Å; I2101-R2105 WeakPolarHBondContact O-CG 3.42Å; I2101-R2105 PolarHBondContact O-N 2.68Å; I2101-R2105 VanDerWaalsContact O-N 3.08Å; I2101-Y2368 HydrophobicContact CD1-CD1 3.96Å; I2101-Y2368 HydrophobicContact CG1-CD1 3.6Å; I2101-Y2368 HydrophobicContact CG1-CE1 4.41Å; I2101-Y2368 HydrophobicContact CG1-CG 4.32Å; I2101-L2372 HydrophobicContact CD1-CB 3.85Å; I2101-L2372 HydrophobicContact CD1-CD1 4.49Å; I2101-L2372 HydrophobicContact CD1-CD2 3.98Å; I2101-L2372 HydrophobicContact CD1-CG 4.33Å
2102	K	89.2	Confident	85.1	Confident	141 Å²	141	63.6 Å²	63.6	61%	0.613	35%	0.347	S	S	*	.	H	α-helix	trans	-57.7	-47.1	171.7	-75.1	169.5	-176	178.1	0	111.2	S2098 H2100 R2105 M2106	S2098-K2102 WeakPolarHBondContact O-CB 3.46Å; S2098-K2102 VanDerWaalsContact O-CG 3.23Å; S2098-K2102 WeakPolarHBondContact O-CG 3.15Å; S2098-K2102 PolarHBondContact O-N 3Å; H2100-K2102 VanDerWaalsContact C-N 3.32Å; H2100-K2102 PolarHBondContact O-N 3.39Å; K2102-R2105 PolarHBondContact O-N 3.21Å; K2102-M2106 WeakPolarHBondContact O-CG 3.31Å; K2102-M2106 PolarHBondContact O-N 2.9Å; K2102-M2106 VanDerWaalsContact O-N 3.16Å
2103	K	89.7	Confident	85	Confident	141 Å²	141	64 Å²	64	61%	0.613	35%	0.35	S	S	*	.	H	α-helix	trans	-61.8	-42.4	177	-175.4	179.1	177.9	179.6	0	112.9	A2099 H2100 I2101 R2105 M2106	A2099-K2103 PolarHBondContact O-N 3.37Å; H2100-K2103 CarbonylContact O-C 3.51Å; H2100-K2103 WeakPolarHBondContact O-CA 3.27Å; H2100-K2103 WeakPolarHBondContact O-CB 3.25Å; H2100-K2103 PolarHBondContact O-N 2.85Å; H2100-K2103 VanDerWaalsContact O-N 3.09Å; I2101-K2103 VanDerWaalsContact C-N 3.35Å; I2101-K2103 PolarHBondContact O-N 2.83Å; K2103-R2105 PolarHBondContact O-N 2.7Å; K2103-M2106 WeakPolarHBondContact O-CB 3.03Å; K2103-M2106 PolarHBondContact O-N 3.39Å
2104	L	90.6	Very high	84.9	Confident	11 Å²	11	62.4 Å²	62.4	6%	0.058	34%	0.341	C	S	.	.	H	α-helix	trans	-66.6	-24.3	177.1	-69	-171.9	0	0	0	113	H2100 I2101 G2114 M2115 Y2368	H2100-L2104 VanDerWaalsContact NE2-CD1 3.31Å; H2100-L2104 WeakPolarHBondContact NE2-CD1 3.27Å; H2100-L2104 PolarHBondContact O-N 2.72Å; I2101-L2104 PolarHBondContact O-N 3.07Å; L2104-G2114 WeakPolarHBondContact O-CA 3.32Å; L2104-G2114 PolarHBondContact O-N 3.31Å; L2104-M2115 HydrophobicContact CB-CB 4.32Å; L2104-M2115 HydrophobicContact CD1-CE 3.58Å; L2104-M2115 PolarHBondContact O-N 3.48Å; L2104-Y2368 HydrophobicContact CD1-CE1 4.14Å
2105	R	90	Very high	85.2	Confident	103 Å²	103	62.3 Å²	62.3	39%	0.389	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-6.9	174.9	-70.6	179.9	-178.3	167.8	8.6	114.5	I2101 K2102 K2103 L2107 N2369	I2101-R2105 WeakPolarHBondContact O-CG 3.42Å; I2101-R2105 PolarHBondContact O-N 2.68Å; I2101-R2105 VanDerWaalsContact O-N 3.08Å; K2102-R2105 PolarHBondContact O-N 3.21Å; K2103-R2105 PolarHBondContact O-N 2.7Å; R2105-L2107 PolarHBondContact O-N 3.01Å; R2105-N2369 PolarHBondContact NH2-OD1 2.98Å
2106	M	85.4	Confident	85.4	Confident	121 Å²	121	56.9 Å²	56.9	60%	0.596	32%	0.322	S	S	*	.	S	Bend	trans	-69	129	169.5	-68.4	176.4	69.3	0	0	108.5	K2102 K2103	K2102-M2106 WeakPolarHBondContact O-CG 3.31Å; K2102-M2106 PolarHBondContact O-N 2.9Å; K2102-M2106 VanDerWaalsContact O-N 3.16Å; K2103-M2106 WeakPolarHBondContact O-CB 3.03Å; K2103-M2106 PolarHBondContact O-N 3.39Å
2107	L	83.2	Confident	85.3	Confident	113 Å²	113	56 Å²	56	59%	0.592	32%	0.317	S	S	*	.	B	Isolated β-bridge	trans	-75.6	148.3	174.9	-58.1	-178.5	0	0	0	110.6	M1754 R2105 G2112	M1754-L2107 VanDerWaalsContact CE-O 3.26Å; M1754-L2107 WeakPolarHBondContact CE-O 3.48Å; R2105-L2107 PolarHBondContact O-N 3.01Å; L2107-G2112 CarbonylContact C-O 3.52Å; L2107-G2112 VanDerWaalsContact CA-O 3.25Å; L2107-G2112 WeakPolarHBondContact CA-O 3.38Å
2108	D	76.6	Confident	85.3	Confident	21 Å²	21	57 Å²	57	11%	0.112	32%	0.322	C	S	.	.			trans	-87.4	174.5	174.6	64	43.9	0	0	0	113.3	M1754 Y1755 T2110 G2111 G2112	M1754-D2108 HydrophobicContact CB-CB 4.01Å; M1754-D2108 HydrophobicContact CG-CB 3.47Å; M1754-D2108 VanDerWaalsContact CG-CB 3.47Å; M1754-D2108 HydrophobicContact SD-CB 4.15Å; Y1755-D2108 HydrophobicContact CD1-CB 4.28Å; Y1755-D2108 VanDerWaalsContact CD1-OD2 3.25Å; Y1755-D2108 WeakPolarHBondContact CD1-OD2 3.3Å; Y1755-D2108 HydrophobicContact CG-CB 4.41Å; D2108-T2110 PolarHBondContact O-N 3.36Å; D2108-T2110 VanDerWaalsContact O-N 3.09Å; D2108-T2110 VanDerWaalsContact OD1-CA 3.22Å; D2108-T2110 WeakPolarHBondContact OD1-CA 3.3Å; D2108-T2110 WeakPolarHBondContact OD1-CB 3.26Å; D2108-T2110 PolarHBondContact OD1-N 2.82Å; D2108-T2110 PolarHBondContact OD1-OG1 2.71Å; D2108-G2111 PolarHBondContact O-N 2.73Å; D2108-G2111 PolarHBondContact OD1-N 3.3Å; D2108-G2112 VanDerWaalsContact CG-O 3.22Å; D2108-G2112 PolarHBondContact N-O 2.82Å; D2108-G2112 PolarHBondContact OD1-N 2.84Å; D2108-G2112 WeakPolarHBondContact OD2-CA 3.49Å
2109	A	76.1	Confident	85.5	Confident	91 Å²	91	55.8 Å²	55.8	75%	0.752	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-10	178	0	0	0	0	0	114.1	M1754	M1754-A2109 HydrophobicContact SD-CB 4.21Å; M1754-A2109 PolarHBondContact SD-N 2.81Å; M1754-A2109 VanDerWaalsContact SD-N 3.42Å
2110	T	75	Confident	85.5	Confident	81 Å²	81	56.9 Å²	56.9	50%	0.497	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	3.2	175.1	48.3	0	0	0	0	113.2	D1756 D2108	D1756-T2110 HydrophobicContact CB-CG2 3.67Å; D1756-T2110 WeakPolarHBondContact CB-OG1 3.35Å; D1756-T2110 PolarHBondContact OD2-OG1 2.83Å; D2108-T2110 PolarHBondContact O-N 3.36Å; D2108-T2110 VanDerWaalsContact O-N 3.09Å; D2108-T2110 VanDerWaalsContact OD1-CA 3.22Å; D2108-T2110 WeakPolarHBondContact OD1-CA 3.3Å; D2108-T2110 WeakPolarHBondContact OD1-CB 3.26Å; D2108-T2110 PolarHBondContact OD1-N 2.82Å; D2108-T2110 PolarHBondContact OD1-OG1 2.71Å
2111	G	70.5	Confident	85.4	Confident	50 Å²	50	58.2 Å²	58.2	52%	0.515	31%	0.309	S	S	.	.	S	Bend	trans	85.2	-0.3	178.2	0	0	0	0	0	115.7	D2108	D2108-G2111 PolarHBondContact O-N 2.73Å; D2108-G2111 PolarHBondContact OD1-N 3.3Å
2112	G	76.8	Confident	85.3	Confident	9 Å²	9	58 Å²	58	9%	0.093	31%	0.308	C	S	.	.			trans	-75.1	161.9	173.3	0	0	0	0	0	111.9	L2107 D2108 E2116	L2107-G2112 CarbonylContact C-O 3.52Å; L2107-G2112 VanDerWaalsContact CA-O 3.25Å; L2107-G2112 WeakPolarHBondContact CA-O 3.38Å; D2108-G2112 VanDerWaalsContact CG-O 3.22Å; D2108-G2112 PolarHBondContact N-O 2.82Å; D2108-G2112 PolarHBondContact OD1-N 2.84Å; D2108-G2112 WeakPolarHBondContact OD2-CA 3.49Å; G2112-E2116 VanDerWaalsContact CA-OE2 3.29Å; G2112-E2116 WeakPolarHBondContact CA-OE2 3.22Å
2113	S	87.1	Confident	85.3	Confident	17 Å²	17	53.2 Å²	53.2	12%	0.119	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-110.6	156.8	172.4	82	0	0	0	0	111.7	M2115 E2116 L2117	S2113-M2115 PolarHBondContact O-N 2.8Å; S2113-M2115 WeakPolarHBondContact OG-CB 3.39Å; S2113-M2115 PolarHBondContact OG-N 2.69Å; S2113-E2116 WeakPolarHBondContact O-CB 3.26Å; S2113-E2116 PolarHBondContact O-N 2.7Å; S2113-E2116 VanDerWaalsContact O-N 3.16Å; S2113-E2116 WeakPolarHBondContact OG-CB 3.37Å; S2113-E2116 PolarHBondContact OG-N 3.42Å; S2113-L2117 PolarHBondContact O-N 2.75Å
2114	G	83.9	Confident	85	Confident	7 Å²	7	53.3 Å²	53.3	7%	0.072	30%	0.297	C	S	.	.	H	α-helix	trans	-59.9	-34.4	171.1	0	0	0	0	0	112.4	L2104 E2118	L2104-G2114 WeakPolarHBondContact O-CA 3.32Å; L2104-G2114 PolarHBondContact O-N 3.31Å; G2114-E2118 PolarHBondContact O-N 3.2Å; G2114-E2118 VanDerWaalsContact O-N 3.08Å
2115	M	90.3	Very high	84.7	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-61.8	-44.3	173.9	-166.9	102.2	-85.9	0	0	111.4	L2104 S2113 F2119 Y2364 Q2365 Y2368	L2104-M2115 HydrophobicContact CB-CB 4.32Å; L2104-M2115 HydrophobicContact CD1-CE 3.58Å; L2104-M2115 PolarHBondContact O-N 3.48Å; S2113-M2115 PolarHBondContact O-N 2.8Å; S2113-M2115 WeakPolarHBondContact OG-CB 3.39Å; S2113-M2115 PolarHBondContact OG-N 2.69Å; M2115-F2119 WeakPolarHBondContact O-CB 3.1Å; M2115-F2119 PolarHBondContact O-N 3.03Å; M2115-Y2364 HydrophobicContact CE-CD1 3.65Å; M2115-Y2364 HydrophobicContact CE-CE1 3.44Å; M2115-Y2364 VanDerWaalsContact CE-CE1 3.44Å; M2115-Y2364 HydrophobicContact CG-CD1 4.26Å; M2115-Q2365 HydrophobicContact CG-CB 4.43Å; M2115-Q2365 HydrophobicContact SD-CB 4.11Å; M2115-Q2365 HydrophobicContact SD-CG 4.26Å; M2115-Y2368 HydrophobicContact CE-CD1 4.48Å; M2115-Y2368 HydrophobicContact CE-CD2 3.27Å; M2115-Y2368 HydrophobicContact CE-CE1 4.47Å; M2115-Y2368 HydrophobicContact CE-CE2 3.29Å; M2115-Y2368 HydrophobicContact CE-CG 3.9Å; M2115-Y2368 HydrophobicContact SD-CD2 4.33Å
2116	E	88.7	Confident	84.2	Confident	55 Å²	55	58 Å²	58	26%	0.257	32%	0.315	S	S	.	.	H	α-helix	trans	-67.4	-42.8	179.4	-168.6	-162.7	-175.5	0	0	111.1	G2112 S2113 F2119 K2120 E2361	G2112-E2116 VanDerWaalsContact CA-OE2 3.29Å; G2112-E2116 WeakPolarHBondContact CA-OE2 3.22Å; S2113-E2116 WeakPolarHBondContact O-CB 3.26Å; S2113-E2116 PolarHBondContact O-N 2.7Å; S2113-E2116 VanDerWaalsContact O-N 3.16Å; S2113-E2116 WeakPolarHBondContact OG-CB 3.37Å; S2113-E2116 PolarHBondContact OG-N 3.42Å; E2116-F2119 PolarHBondContact O-N 2.92Å; E2116-K2120 HydrophobicContact CG-CD 4.14Å; E2116-K2120 WeakPolarHBondContact O-CB 3.39Å; E2116-K2120 VanDerWaalsContact O-CG 3.26Å; E2116-K2120 WeakPolarHBondContact O-CG 3.38Å; E2116-K2120 PolarHBondContact O-N 3.13Å; E2116-K2120 WeakPolarHBondContact OE1-CE 3.26Å; E2116-K2120 IonicContact OE1-NZ 3.4Å; E2116-K2120 PolarHBondContact OE1-NZ 3.48Å; E2116-K2120 IonicContact OE2-NZ 3.88Å; E2116-K2120 PolarHBondContact OE2-NZ 3.09Å; E2116-E2361 VanDerWaalsContact CA-OE1 3.27Å; E2116-E2361 WeakPolarHBondContact CA-OE1 3.47Å; E2116-E2361 WeakPolarHBondContact CB-OE1 3.45Å; E2116-E2361 WeakPolarHBondContact CG-OE2 3.48Å; E2116-E2361 PolarHBondContact N-OE1 2.75Å
2117	L	86.9	Confident	83.8	Confident	58 Å²	58	53 Å²	53	30%	0.304	29%	0.29	S	S	.	.	H	α-helix	trans	-66.3	-42.1	177.9	-170.6	73	0	0	0	112	Y1755 S2113 F2119 K2120 K2121	Y1755-L2117 HydrophobicContact CD1-CB 4.4Å; Y1755-L2117 HydrophobicContact CD1-CD2 3.9Å; Y1755-L2117 HydrophobicContact CD2-CD2 4.45Å; Y1755-L2117 HydrophobicContact CE1-CB 3.62Å; Y1755-L2117 HydrophobicContact CE1-CD2 3.38Å; Y1755-L2117 HydrophobicContact CE1-CG 4.07Å; Y1755-L2117 HydrophobicContact CE2-CD2 3.97Å; Y1755-L2117 HydrophobicContact CG-CD2 4.43Å; Y1755-L2117 VanDerWaalsContact CZ-CD2 3.42Å; S2113-L2117 PolarHBondContact O-N 2.75Å; L2117-F2119 VanDerWaalsContact C-N 3.32Å; L2117-F2119 PolarHBondContact O-N 3.06Å; L2117-K2120 PolarHBondContact O-N 3.49Å; L2117-K2121 PolarHBondContact O-N 2.93Å
2118	E	90.4	Very high	83.1	Confident	23 Å²	23	52 Å²	52	11%	0.107	29%	0.291	C	S	.	.	H	α-helix	trans	-58.8	-44.7	172.5	-79.2	-173	-179.9	0	0	111.2	G2114 K2121 L2122 F2344 Y2364 Y2368	G2114-E2118 PolarHBondContact O-N 3.2Å; G2114-E2118 VanDerWaalsContact O-N 3.08Å; E2118-K2121 PolarHBondContact O-N 2.93Å; E2118-L2122 PolarHBondContact O-N 2.84Å; E2118-L2122 VanDerWaalsContact O-N 3.09Å; E2118-F2344 HydrophobicContact CB-CD2 4.08Å; E2118-F2344 HydrophobicContact CB-CE2 4.43Å; E2118-F2344 HydrophobicContact CG-CD2 4.24Å; E2118-F2344 WeakPolarHBondContact O-CE2 3.47Å; E2118-Y2364 HydrophobicContact CB-CE1 3.75Å; E2118-Y2364 PolarHBondContact OE2-OH 2.72Å; E2118-Y2368 PolarHBondContact OE2-OH 2.78Å
2119	F	93.2	Very high	82.8	Confident	24 Å²	24	59.3 Å²	59.3	11%	0.105	32%	0.324	C	S	.	.	H	α-helix	trans	-67	-39.3	177	-171.5	-103.5	0	0	0	112.8	M2115 E2116 L2117 K2121 L2122 A2123 T2360 E2361 Y2364	M2115-F2119 WeakPolarHBondContact O-CB 3.1Å; M2115-F2119 PolarHBondContact O-N 3.03Å; E2116-F2119 PolarHBondContact O-N 2.92Å; L2117-F2119 VanDerWaalsContact C-N 3.32Å; L2117-F2119 PolarHBondContact O-N 3.06Å; F2119-K2121 VanDerWaalsContact C-N 3.34Å; F2119-K2121 PolarHBondContact O-N 3.46Å; F2119-L2122 PolarHBondContact O-N 3.05Å; F2119-A2123 WeakPolarHBondContact O-CB 3.34Å; F2119-A2123 PolarHBondContact O-N 2.76Å; F2119-T2360 WeakPolarHBondContact CE2-O 3.37Å; F2119-E2361 HydrophobicContact CB-CB 4.5Å; F2119-E2361 HydrophobicContact CB-CG 4.25Å; F2119-E2361 HydrophobicContact CD1-CB 3.81Å; F2119-E2361 HydrophobicContact CD1-CG 4.44Å; F2119-E2361 HydrophobicContact CE1-CB 4.29Å; F2119-E2361 HydrophobicContact CG-CB 4.08Å; F2119-E2361 HydrophobicContact CG-CG 4.35Å; F2119-Y2364 HydrophobicContact CB-CD1 3.98Å; F2119-Y2364 HydrophobicContact CD2-CD1 4.3Å; F2119-Y2364 AromaticContact CD2-CG 3.98Å; F2119-Y2364 HydrophobicContact CD2-CG 3.98Å
2120	K	89.8	Confident	82.9	Confident	87 Å²	87	56.6 Å²	56.6	38%	0.378	30%	0.301	S	S	.	.	H	α-helix	trans	-56.7	-44.9	173	-78.6	166.3	177.4	163.9	0	111.2	E2116 L2117 A2123 Q2124	E2116-K2120 HydrophobicContact CG-CD 4.14Å; E2116-K2120 WeakPolarHBondContact O-CB 3.39Å; E2116-K2120 VanDerWaalsContact O-CG 3.26Å; E2116-K2120 WeakPolarHBondContact O-CG 3.38Å; E2116-K2120 PolarHBondContact O-N 3.13Å; E2116-K2120 WeakPolarHBondContact OE1-CE 3.26Å; E2116-K2120 IonicContact OE1-NZ 3.4Å; E2116-K2120 PolarHBondContact OE1-NZ 3.48Å; E2116-K2120 IonicContact OE2-NZ 3.88Å; E2116-K2120 PolarHBondContact OE2-NZ 3.09Å; L2117-K2120 PolarHBondContact O-N 3.49Å; K2120-A2123 PolarHBondContact O-N 3.3Å; K2120-Q2124 VanDerWaalsContact O-CG 3.3Å; K2120-Q2124 WeakPolarHBondContact O-CG 3.18Å; K2120-Q2124 PolarHBondContact O-N 2.88Å
2121	K	87.3	Confident	83.4	Confident	65 Å²	65	59.3 Å²	59.3	28%	0.283	31%	0.306	S	S	.	.	H	α-helix	trans	-60.2	-46.9	173.7	-76	-172.5	174.5	-167	0	112.2	D2086 L2117 E2118 F2119 A2123 Q2124 F2125 F2344	D2086-K2121 PolarHBondContact O-NZ 2.79Å; L2117-K2121 PolarHBondContact O-N 2.93Å; E2118-K2121 PolarHBondContact O-N 2.93Å; F2119-K2121 VanDerWaalsContact C-N 3.34Å; F2119-K2121 PolarHBondContact O-N 3.46Å; K2121-A2123 VanDerWaalsContact C-N 3.3Å; K2121-A2123 PolarHBondContact O-N 3.01Å; K2121-Q2124 PolarHBondContact O-N 2.84Å; K2121-F2125 PolarHBondContact O-N 3.39Å; K2121-F2344 HydrophobicContact CB-CE2 3.91Å; K2121-F2344 HydrophobicContact CB-CZ 4.05Å; K2121-F2344 HydrophobicContact CD-CE2 4.49Å; K2121-F2344 HydrophobicContact CD-CZ 4.37Å
2122	L	91.2	Very high	84.4	Confident	0 Å²	0	60 Å²	60	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61	-38.7	175.6	-68.2	172	0	0	0	111.9	E2118 F2119 Q2124 F2125 F2344 I2347 R2348 R2351 Y2364	E2118-L2122 PolarHBondContact O-N 2.84Å; E2118-L2122 VanDerWaalsContact O-N 3.09Å; F2119-L2122 PolarHBondContact O-N 3.05Å; L2122-Q2124 VanDerWaalsContact C-N 3.34Å; L2122-F2125 WeakPolarHBondContact O-CB 3.37Å; L2122-F2125 PolarHBondContact O-N 3.04Å; L2122-F2344 HydrophobicContact CD1-CD2 4.03Å; L2122-F2344 HydrophobicContact CD1-CE2 4.4Å; L2122-F2344 HydrophobicContact CD2-CD2 3.96Å; L2122-F2344 HydrophobicContact CD2-CE1 4.45Å; L2122-F2344 HydrophobicContact CD2-CE2 3.86Å; L2122-F2344 HydrophobicContact CD2-CG 4.32Å; L2122-F2344 HydrophobicContact CD2-CZ 4.12Å; L2122-F2344 HydrophobicContact CG-CD2 3.8Å; L2122-F2344 HydrophobicContact CG-CE2 3.69Å; L2122-F2344 HydrophobicContact CG-CZ 4.38Å; L2122-I2347 HydrophobicContact CD1-CB 4.29Å; L2122-I2347 HydrophobicContact CD1-CG2 3.97Å; L2122-I2347 HydrophobicContact CD2-CG2 4.41Å; L2122-R2348 HydrophobicContact CD2-CB 3.87Å; L2122-R2348 HydrophobicContact CD2-CG 4.4Å; L2122-R2351 VanDerWaalsContact C-NH1 3.31Å; L2122-R2351 PolarHBondContact O-NH1 2.84Å; L2122-Y2364 HydrophobicContact CD1-CD2 3.97Å; L2122-Y2364 HydrophobicContact CD1-CE2 3.48Å; L2122-Y2364 VanDerWaalsContact CD1-CE2 3.48Å
2123	A	87.9	Confident	85	Confident	40 Å²	40	63 Å²	63	33%	0.331	31%	0.31	S	S	.	.	H	α-helix	trans	-67.6	-30.2	177.1	0	0	0	0	0	113.5	F2119 K2120 K2121 R2126	F2119-A2123 WeakPolarHBondContact O-CB 3.34Å; F2119-A2123 PolarHBondContact O-N 2.76Å; K2120-A2123 PolarHBondContact O-N 3.3Å; K2121-A2123 VanDerWaalsContact C-N 3.3Å; K2121-A2123 PolarHBondContact O-N 3.01Å; A2123-R2126 PolarHBondContact O-NH1 2.79Å; A2123-R2126 PolarHBondContact O-NH2 2.78Å
2124	Q	84.9	Confident	85.2	Confident	142 Å²	142	62.6 Å²	62.6	66%	0.664	31%	0.308	S	S	*	.	H	α-helix	trans	-79.9	-29.2	175.5	-71.1	168	1.3	0	0	112.9	K2120 K2121 L2122 R2126	K2120-Q2124 VanDerWaalsContact O-CG 3.3Å; K2120-Q2124 WeakPolarHBondContact O-CG 3.18Å; K2120-Q2124 PolarHBondContact O-N 2.88Å; K2121-Q2124 PolarHBondContact O-N 2.84Å; L2122-Q2124 VanDerWaalsContact C-N 3.34Å; Q2124-R2126 PolarHBondContact O-N 3.1Å; Q2124-R2126 PolarHBondContact O-NH1 2.67Å
2125	F	83.7	Confident	85.6	Confident	35 Å²	35	62.4 Å²	62.4	15%	0.154	31%	0.305	C	S	.	.			trans	-51.9	133.7	-179.9	-178.9	-97.7	0	0	0	113.9	K2121 L2122 R2348 R2351 T2352	K2121-F2125 PolarHBondContact O-N 3.39Å; L2122-F2125 WeakPolarHBondContact O-CB 3.37Å; L2122-F2125 PolarHBondContact O-N 3.04Å; F2125-R2348 HydrophobicContact CD2-CG 4.15Å; F2125-R2348 HydrophobicContact CE2-CG 4.13Å; F2125-R2348 HydrophobicContact CG-CG 4.42Å; F2125-R2348 HydrophobicContact CZ-CG 4.39Å; F2125-R2351 HydrophobicContact CD1-CB 4Å; F2125-R2351 HydrophobicContact CE1-CB 4.16Å; F2125-T2352 HydrophobicContact CE1-CG2 4.15Å; F2125-T2352 HydrophobicContact CZ-CG2 3.9Å
2126	R	78.5	Confident	85.6	Confident	178 Å²	178	67.7 Å²	67.7	67%	0.672	33%	0.33	S	S	*	.			trans	-135.8	135.6	173.6	-60.6	-65.9	176.6	-90.8	-3.8	108.8	A2123 Q2124 P2128	A2123-R2126 PolarHBondContact O-NH1 2.79Å; A2123-R2126 PolarHBondContact O-NH2 2.78Å; Q2124-R2126 PolarHBondContact O-N 3.1Å; Q2124-R2126 PolarHBondContact O-NH1 2.67Å; R2126-P2128 WeakPolarHBondContact O-CD 3.13Å
2127	L	77.5	Confident	85.5	Confident	16 Å²	16	66.1 Å²	66.1	8%	0.084	32%	0.322	C	S	.	.			trans	-69.7	121.5	175.1	-179.4	69.2	0	0	0	110.2	A2130 Y2152 T2352	L2127-A2130 HydrophobicContact CB-CB 4.23Å; L2127-A2130 HydrophobicContact CD2-CB 4.26Å; L2127-A2130 HydrophobicContact CG-CB 4.4Å; L2127-A2130 WeakPolarHBondContact O-CB 3.18Å; L2127-Y2152 HydrophobicContact CB-CE1 4.32Å; L2127-Y2152 HydrophobicContact CD2-CD1 4.25Å; L2127-Y2152 HydrophobicContact CD2-CD2 4.04Å; L2127-Y2152 HydrophobicContact CD2-CE1 4.09Å; L2127-Y2152 HydrophobicContact CD2-CE2 3.89Å; L2127-Y2152 HydrophobicContact CD2-CG 4.22Å; L2127-T2352 HydrophobicContact CD1-CG2 4.11Å
2128	P	68.1	Low	85.4	Confident	93 Å²	93	64.3 Å²	64.3	60%	0.604	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	144.7	174.6	-24.3	35.6	0	0	0	111.7	R2126 A2130	R2126-P2128 WeakPolarHBondContact O-CD 3.13Å; P2128-A2130 PolarHBondContact O-N 3.47Å
2129	H	70.5	Confident	85.3	Confident	173 Å²	173	63.7 Å²	63.7	80%	0.801	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	15.3	177.3	-50.8	105.5	0	0	0	116.6	K2131	H2129-K2131 PolarHBondContact O-N 2.76Å
2130	A	78.8	Confident	85.4	Confident	34 Å²	34	62.6 Å²	62.6	28%	0.281	31%	0.311	S	S	.	.			trans	-53.2	130.8	178.8	0	0	0	0	0	113	L2127 P2128 Y2132 Y2152	L2127-A2130 HydrophobicContact CB-CB 4.23Å; L2127-A2130 HydrophobicContact CD2-CB 4.26Å; L2127-A2130 HydrophobicContact CG-CB 4.4Å; L2127-A2130 WeakPolarHBondContact O-CB 3.18Å; P2128-A2130 PolarHBondContact O-N 3.47Å; A2130-Y2132 HydrophobicContact CB-CE2 4.33Å; A2130-Y2152 HydrophobicContact CB-CD1 3.93Å; A2130-Y2152 HydrophobicContact CB-CE1 3.83Å
2131	K	85.8	Confident	85.4	Confident	139 Å²	139	64 Å²	64	60%	0.604	32%	0.317	S	S	*	.			trans	-117.7	144.3	-178.9	-71.8	154.4	-170	164.7	0	110.1	H2129 Y2152 E2153	H2129-K2131 PolarHBondContact O-N 2.76Å; K2131-Y2152 CarbonylContact O-C 3.54Å; K2131-Y2152 WeakPolarHBondContact O-CA 3.4Å; K2131-E2153 HydrophobicContact CB-CB 3.93Å; K2131-E2153 PolarHBondContact O-N 3.37Å
2132	Y	90.8	Very high	85.7	Confident	64 Å²	64	64.2 Å²	64.2	25%	0.251	32%	0.322	S	S	.	.			trans	-133	31.9	-178.5	-53	-81.5	0	0	0	111	A2130 S2134 A2135 Q2136 L2150 P2151 Y2152 P2355	A2130-Y2132 HydrophobicContact CB-CE2 4.33Å; Y2132-S2134 PolarHBondContact O-N 2.7Å; Y2132-A2135 WeakPolarHBondContact O-CB 3.32Å; Y2132-A2135 PolarHBondContact O-N 3.42Å; Y2132-A2135 VanDerWaalsContact O-N 3.07Å; Y2132-Q2136 WeakPolarHBondContact O-CG 3.44Å; Y2132-Q2136 PolarHBondContact O-N 2.77Å; Y2132-L2150 HydrophobicContact CD1-CB 3.66Å; Y2132-L2150 HydrophobicContact CE1-CB 4.22Å; Y2132-L2150 HydrophobicContact CG-CB 4.31Å; Y2132-P2151 WeakPolarHBondContact CD1-O 3.47Å; Y2132-Y2152 HydrophobicContact CD1-CD1 4.38Å; Y2132-Y2152 AromaticContact CE1-CD1 3.56Å; Y2132-Y2152 HydrophobicContact CE1-CD1 3.56Å; Y2132-Y2152 AromaticContact CE1-CE1 3.93Å; Y2132-Y2152 HydrophobicContact CE1-CE1 3.93Å; Y2132-Y2152 AromaticContact CZ-CD1 3.9Å; Y2132-Y2152 AromaticContact CZ-CE1 3.91Å; Y2132-Y2152 WeakPolarHBondContact OH-CE1 3.36Å; Y2132-P2355 HydrophobicContact CE1-CG 4.46Å
2133	T	88.7	Confident	85.9	Confident	71 Å²	71	65.3 Å²	65.3	44%	0.436	33%	0.327	S	S	.	.	H	α-helix	trans	-58.8	-51.6	-162.5	13.9	0	0	0	0	113.2	A2135 Q2136 Q2137 E2153	T2133-A2135 VanDerWaalsContact C-N 3.31Å; T2133-A2135 PolarHBondContact O-N 3.05Å; T2133-Q2136 PolarHBondContact O-N 3.22Å; T2133-Q2137 PolarHBondContact O-N 2.96Å; T2133-E2153 WeakPolarHBondContact CA-OE2 3.2Å; T2133-E2153 VanDerWaalsContact CB-OE2 3.31Å; T2133-E2153 WeakPolarHBondContact CB-OE2 3.26Å; T2133-E2153 PolarHBondContact N-OE2 3.43Å; T2133-E2153 VanDerWaalsContact OG1-CD 3.25Å; T2133-E2153 WeakPolarHBondContact OG1-CG 3.36Å; T2133-E2153 PolarHBondContact OG1-OE2 2.7Å
2134	S	91.8	Very high	86.3	Confident	10 Å²	10	63.9 Å²	63.9	7%	0.07	31%	0.313	C	S	.	.	H	α-helix	trans	-68	-29.2	175.4	-69.6	0	0	0	0	113.2	Y2132 Q2137 N2140 E2153 R2156	Y2132-S2134 PolarHBondContact O-N 2.7Å; S2134-Q2137 PolarHBondContact O-OE1 3.39Å; S2134-N2140 WeakPolarHBondContact O-CB 3.45Å; S2134-N2140 PolarHBondContact O-ND2 3.18Å; S2134-E2153 PolarHBondContact N-OE2 3.04Å; S2134-E2153 PolarHBondContact OG-OE1 2.97Å; S2134-R2156 PolarHBondContact OG-NH2 2.9Å
2135	A	92.2	Very high	86.7	Confident	2 Å²	2	59.2 Å²	59.2	2%	0.017	29%	0.29	C	S	.	.	H	α-helix	trans	-73.5	-26.5	179.7	0	0	0	0	0	113.8	Y2132 T2133 N2144 L2150 P2151 Y2170	Y2132-A2135 WeakPolarHBondContact O-CB 3.32Å; Y2132-A2135 PolarHBondContact O-N 3.42Å; Y2132-A2135 VanDerWaalsContact O-N 3.07Å; T2133-A2135 VanDerWaalsContact C-N 3.31Å; T2133-A2135 PolarHBondContact O-N 3.05Å; A2135-N2144 PolarHBondContact O-ND2 3.09Å; A2135-L2150 HydrophobicContact CB-CB 3.99Å; A2135-L2150 HydrophobicContact CB-CD1 4.25Å; A2135-L2150 HydrophobicContact CB-CD2 4.31Å; A2135-L2150 HydrophobicContact CB-CG 4.41Å; A2135-P2151 HydrophobicContact CB-CG 4.17Å; A2135-Y2170 HydrophobicContact CB-CE2 3.71Å; A2135-Y2170 VanDerWaalsContact CB-OH 3.28Å; A2135-Y2170 WeakPolarHBondContact CB-OH 3.28Å
2136	Q	90.1	Very high	87.1	Confident	112 Å²	112	60.8 Å²	60.8	52%	0.523	30%	0.299	S	S	.	.	H	α-helix	trans	-91.4	-10	-178.5	-70.2	178.5	-15.7	0	0	113.7	Y2132 T2133 K2141 L2150	Y2132-Q2136 WeakPolarHBondContact O-CG 3.44Å; Y2132-Q2136 PolarHBondContact O-N 2.77Å; T2133-Q2136 PolarHBondContact O-N 3.22Å; Q2136-K2141 WeakPolarHBondContact O-CE 2.97Å; Q2136-L2150 HydrophobicContact CG-CD1 4.06Å
2137	Q	88	Confident	87.6	Confident	22 Å²	22	58.1 Å²	58.1	10%	0.103	30%	0.298	C	S	.	.	S	Bend	trans	-54.4	143.9	173.2	-83.8	169.8	-24.9	0	0	112.6	D604 S607 T2133 S2134 C2139 N2140 K2141	D604-Q2137 VanDerWaalsContact CG-CD 3.49Å; D604-Q2137 VanDerWaalsContact OD1-CB 3.23Å; D604-Q2137 WeakPolarHBondContact OD1-CB 3Å; D604-Q2137 VanDerWaalsContact OD1-CD 3.23Å; D604-Q2137 WeakPolarHBondContact OD1-CG 3.27Å; S607-Q2137 PolarHBondContact OG-NE2 3.01Å; S607-Q2137 VanDerWaalsContact OG-NE2 3.14Å; T2133-Q2137 PolarHBondContact O-N 2.96Å; S2134-Q2137 PolarHBondContact O-OE1 3.39Å; Q2137-C2139 VanDerWaalsContact C-N 3.31Å; Q2137-C2139 PolarHBondContact O-N 3.14Å; Q2137-N2140 HydrophobicContact CB-CB 4.31Å; Q2137-N2140 PolarHBondContact O-N 3.3Å; Q2137-N2140 PolarHBondContact OE1-ND2 2.67Å; Q2137-K2141 PolarHBondContact O-N 3.12Å; Q2137-K2141 VanDerWaalsContact O-N 3.15Å
2138	G	84.2	Confident	87.9	Confident	21 Å²	21	63.4 Å²	63.4	22%	0.216	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-29.2	-171.3	0	0	0	0	0	114.4	V603	V603-G2138 VanDerWaalsContact CG1-N 3.29Å
2139	C	88.5	Confident	89.1	Confident	10 Å²	10	59.7 Å²	59.7	7%	0.068	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-33.8	171	60.4	0	0	0	0	112.6	S600 D604 Q2137 N2142 E2166 G2167	S600-C2139 VanDerWaalsContact O-CB 3.31Å; S600-C2139 WeakPolarHBondContact O-CB 3.38Å; D604-C2139 VanDerWaalsContact CG-SG 3.59Å; D604-C2139 PolarHBondContact OD1-SG 2.82Å; D604-C2139 PolarHBondContact OD2-SG 3.2Å; Q2137-C2139 VanDerWaalsContact C-N 3.31Å; Q2137-C2139 PolarHBondContact O-N 3.14Å; C2139-N2142 PolarHBondContact O-OD1 2.82Å; C2139-N2142 VanDerWaalsContact O-OD1 3.11Å; C2139-E2166 HydrophobicContact CB-CB 4.3Å; C2139-G2167 WeakPolarHBondContact SG-CA 3.26Å
2140	N	95.2	Very high	90.2	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-17.1	-167.8	-68.7	-25.5	0	0	0	113.8	S2134 Q2137 N2142 K2143 N2144 G2167 Y2170	S2134-N2140 WeakPolarHBondContact O-CB 3.45Å; S2134-N2140 PolarHBondContact O-ND2 3.18Å; Q2137-N2140 HydrophobicContact CB-CB 4.31Å; Q2137-N2140 PolarHBondContact O-N 3.3Å; Q2137-N2140 PolarHBondContact OE1-ND2 2.67Å; N2140-N2142 PolarHBondContact O-N 3.41Å; N2140-N2142 VanDerWaalsContact O-N 3.09Å; N2140-K2143 WeakPolarHBondContact O-CB 3.12Å; N2140-K2143 PolarHBondContact O-N 3.47Å; N2140-N2144 PolarHBondContact O-ND2 3.2Å; N2140-G2167 VanDerWaalsContact OD1-CA 3.23Å; N2140-G2167 WeakPolarHBondContact OD1-CA 3.31Å; N2140-G2167 PolarHBondContact OD1-O 2.92Å; N2140-Y2170 HydrophobicContact CB-CD1 3.58Å; N2140-Y2170 HydrophobicContact CB-CE1 3.93Å; N2140-Y2170 HydrophobicContact CB-CG 4.1Å; N2140-Y2170 VanDerWaalsContact CG-CD1 3.47Å; N2140-Y2170 VanDerWaalsContact ND2-CB 3.34Å; N2140-Y2170 WeakPolarHBondContact ND2-CB 3.43Å
2141	K	90.7	Very high	91	Very high	116 Å²	116	50.8 Å²	50.8	50%	0.504	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-52.7	-32.7	176.3	-74.3	-179.9	-175.6	-178	0	113.6	Q2136 Q2137	Q2136-K2141 WeakPolarHBondContact O-CE 2.97Å; Q2137-K2141 PolarHBondContact O-N 3.12Å; Q2137-K2141 VanDerWaalsContact O-N 3.15Å
2142	N	92.2	Very high	91.3	Very high	70 Å²	70	44.6 Å²	44.6	37%	0.374	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-85	-5	179.7	71.7	15.6	0	0	0	114.4	C2139 N2140	C2139-N2142 PolarHBondContact O-OD1 2.82Å; C2139-N2142 VanDerWaalsContact O-OD1 3.11Å; N2140-N2142 PolarHBondContact O-N 3.41Å; N2140-N2142 VanDerWaalsContact O-N 3.09Å
2143	K	96.1	Very high	91.4	Very high	24 Å²	24	43.9 Å²	43.9	10%	0.104	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-92.6	-1.1	174.7	-60.5	-174.1	173.1	-163.5	0	112.8	N2140 G2167 Y2170 Q2189 T2195 D2198	N2140-K2143 WeakPolarHBondContact O-CB 3.12Å; N2140-K2143 PolarHBondContact O-N 3.47Å; K2143-G2167 PolarHBondContact NZ-O 3.32Å; K2143-Y2170 HydrophobicContact CB-CD1 4.37Å; K2143-Y2170 HydrophobicContact CB-CE1 4.25Å; K2143-Y2170 HydrophobicContact CD-CD1 4.02Å; K2143-Y2170 PolarHBondContact NZ-O 3.33Å; K2143-Q2189 PolarHBondContact O-NE2 2.82Å; K2143-T2195 HydrophobicContact CB-CG2 3.84Å; K2143-T2195 HydrophobicContact CG-CG2 4.14Å; K2143-D2198 VanDerWaalsContact CE-OD2 3.28Å; K2143-D2198 WeakPolarHBondContact CE-OD2 3.4Å; K2143-D2198 IonicContact NZ-OD1 2.69Å; K2143-D2198 IonicContact NZ-OD2 3.68Å; K2143-D2198 PolarHBondContact NZ-OD2 2.8Å
2144	N	96.1	Very high	91.3	Very high	10 Å²	10	43.9 Å²	43.9	5%	0.053	23%	0.229	C	C	.	.			trans	-104.1	125.6	-179.6	-60.9	-46.7	0	0	0	110.2	A2135 N2140 L2147 L2150 Y2170 N2172	A2135-N2144 PolarHBondContact O-ND2 3.09Å; N2140-N2144 PolarHBondContact O-ND2 3.2Å; N2144-L2147 HydrophobicContact CB-CD2 4.32Å; N2144-L2150 HydrophobicContact CB-CD2 4.2Å; N2144-Y2170 PolarHBondContact OD1-OH 3.5Å; N2144-N2172 PolarHBondContact OD1-ND2 2.94Å
2145	R	94	Very high	91.3	Very high	44 Å²	44	44.5 Å²	44.5	17%	0.166	23%	0.233	C	C	.	.	S	Bend	trans	-69.2	-36.2	175.8	-170.8	-179.7	-66.9	-82.5	-6.8	111.4	A2190 P2191 M2192 E2223 C2224 S2316	R2145-A2190 PolarHBondContact NE-O 3.22Å; R2145-A2190 PolarHBondContact NH2-O 3.14Å; R2145-P2191 PolarHBondContact NH2-O 3.46Å; R2145-M2192 HydrophobicContact CB-CG 4.35Å; R2145-M2192 HydrophobicContact CB-SD 3.93Å; R2145-M2192 PolarHBondContact N-SD 2.85Å; R2145-E2223 IonicContact CZ-OE1 2.67Å; R2145-E2223 VanDerWaalsContact CZ-OE1 3.32Å; R2145-E2223 PolarHBondContact NH1-O 2.72Å; R2145-E2223 IonicContact NH1-OE1 3.11Å; R2145-E2223 PolarHBondContact NH1-OE1 3.25Å; R2145-E2223 IonicContact NH2-OE1 3.89Å; R2145-E2223 PolarHBondContact NH2-OE1 3.14Å; R2145-C2224 PolarHBondContact NE-O 3.49Å; R2145-C2224 PolarHBondContact NH2-O 3.45Å; R2145-S2316 VanDerWaalsContact CD-O 3.27Å; R2145-S2316 WeakPolarHBondContact CD-O 3.4Å; R2145-S2316 PolarHBondContact NE-O 2.84Å
2146	L	90.5	Very high	91.5	Very high	68 Å²	68	46.1 Å²	46.1	36%	0.356	24%	0.238	S	C	.	.			trans	-129.3	127.7	174.6	-66.6	-175.2	0	0	0	110.6	N2148 I2149 A2317	L2146-N2148 VanDerWaalsContact C-N 3.28Å; L2146-N2148 PolarHBondContact O-N 2.99Å; L2146-I2149 HydrophobicContact CB-CB 4.15Å; L2146-I2149 HydrophobicContact CB-CG1 4.16Å; L2146-I2149 HydrophobicContact CD1-CG1 4Å; L2146-I2149 PolarHBondContact O-N 3.4Å; L2146-A2317 HydrophobicContact CD1-CB 3.65Å; L2146-A2317 HydrophobicContact CG-CB 4.41Å
2147	L	88.7	Confident	91.9	Very high	121 Å²	121	40.8 Å²	40.8	63%	0.634	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-12.5	-177.3	-65.8	176	0	0	0	114.2	N2144 L2150	N2144-L2147 HydrophobicContact CB-CD2 4.32Å; L2147-L2150 WeakPolarHBondContact O-CG 3.22Å
2148	N	85.8	Confident	92.1	Very high	128 Å²	128	43 Å²	43	68%	0.684	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-6.3	173.5	63.4	-29.2	0	0	0	113.6	L2146	L2146-N2148 VanDerWaalsContact C-N 3.28Å; L2146-N2148 PolarHBondContact O-N 2.99Å
2149	I	91.8	Very high	92.6	Very high	15 Å²	15	42.4 Å²	42.4	8%	0.077	22%	0.221	C	C	.	.			trans	-114.7	84.4	175.6	-56.1	-60	0	0	0	108.3	L2146 N2172 A2317 V2319	L2146-I2149 HydrophobicContact CB-CB 4.15Å; L2146-I2149 HydrophobicContact CB-CG1 4.16Å; L2146-I2149 HydrophobicContact CD1-CG1 4Å; L2146-I2149 PolarHBondContact O-N 3.4Å; I2149-N2172 PolarHBondContact O-ND2 3.23Å; I2149-A2317 HydrophobicContact CG1-CB 4.45Å; I2149-V2319 HydrophobicContact CD1-CG2 4.19Å; I2149-V2319 HydrophobicContact CG1-CG2 4.43Å; I2149-V2319 HydrophobicContact CG2-CG1 3.51Å; I2149-V2319 HydrophobicContact CG2-CG2 4.25Å
2150	L	94.1	Very high	92.7	Very high	18 Å²	18	46.9 Å²	46.9	9%	0.094	24%	0.241	C	C	.	.			trans	-110.8	146.2	-178.3	-56.1	-176.7	0	0	0	110.4	Y2132 A2135 Q2136 N2144 L2147 P2355	Y2132-L2150 HydrophobicContact CD1-CB 3.66Å; Y2132-L2150 HydrophobicContact CE1-CB 4.22Å; Y2132-L2150 HydrophobicContact CG-CB 4.31Å; A2135-L2150 HydrophobicContact CB-CB 3.99Å; A2135-L2150 HydrophobicContact CB-CD1 4.25Å; A2135-L2150 HydrophobicContact CB-CD2 4.31Å; A2135-L2150 HydrophobicContact CB-CG 4.41Å; Q2136-L2150 HydrophobicContact CG-CD1 4.06Å; N2144-L2150 HydrophobicContact CB-CD2 4.2Å; L2147-L2150 WeakPolarHBondContact O-CG 3.22Å; L2150-P2355 WeakPolarHBondContact O-CD 3.39Å; L2150-P2355 VanDerWaalsContact O-CG 3.23Å; L2150-P2355 WeakPolarHBondContact O-CG 3.38Å
2151	P	95.5	Very high	92.4	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.013	27%	0.268	C	S	.	.			trans	-70.8	136.6	176.7	30.9	-36	0	0	0	111.1	Y2132 A2135 R2156 Y2170 N2174	Y2132-P2151 WeakPolarHBondContact CD1-O 3.47Å; A2135-P2151 HydrophobicContact CB-CG 4.17Å; P2151-R2156 HydrophobicContact CB-CB 4.19Å; P2151-Y2170 WeakPolarHBondContact CD-OH 3.34Å; P2151-Y2170 HydrophobicContact CG-CE2 3.69Å; P2151-Y2170 WeakPolarHBondContact CG-OH 3.37Å; P2151-N2174 VanDerWaalsContact CA-OD1 3.24Å; P2151-N2174 WeakPolarHBondContact CA-OD1 3.37Å; P2151-N2174 WeakPolarHBondContact CB-ND2 3.38Å; P2151-N2174 WeakPolarHBondContact CB-OD1 3.46Å
2152	Y	93.1	Very high	92.3	Very high	9 Å²	9	47.6 Å²	47.6	4%	0.035	26%	0.255	C	S	.	.			trans	-63	140.3	166.8	-57.4	-51.6	0	0	0	110.6	L2127 A2130 K2131 Y2132 S2154 T2155 R2156 N2174 R2351 T2352 P2355	L2127-Y2152 HydrophobicContact CB-CE1 4.32Å; L2127-Y2152 HydrophobicContact CD2-CD1 4.25Å; L2127-Y2152 HydrophobicContact CD2-CD2 4.04Å; L2127-Y2152 HydrophobicContact CD2-CE1 4.09Å; L2127-Y2152 HydrophobicContact CD2-CE2 3.89Å; L2127-Y2152 HydrophobicContact CD2-CG 4.22Å; A2130-Y2152 HydrophobicContact CB-CD1 3.93Å; A2130-Y2152 HydrophobicContact CB-CE1 3.83Å; K2131-Y2152 CarbonylContact O-C 3.54Å; K2131-Y2152 WeakPolarHBondContact O-CA 3.4Å; Y2132-Y2152 HydrophobicContact CD1-CD1 4.38Å; Y2132-Y2152 AromaticContact CE1-CD1 3.56Å; Y2132-Y2152 HydrophobicContact CE1-CD1 3.56Å; Y2132-Y2152 AromaticContact CE1-CE1 3.93Å; Y2132-Y2152 HydrophobicContact CE1-CE1 3.93Å; Y2132-Y2152 AromaticContact CZ-CD1 3.9Å; Y2132-Y2152 AromaticContact CZ-CE1 3.91Å; Y2132-Y2152 WeakPolarHBondContact OH-CE1 3.36Å; Y2152-S2154 VanDerWaalsContact C-N 3.34Å; Y2152-S2154 PolarHBondContact O-N 2.8Å; Y2152-T2155 PolarHBondContact O-N 3.23Å; Y2152-R2156 WeakPolarHBondContact O-CB 3.47Å; Y2152-R2156 PolarHBondContact O-N 3.38Å; Y2152-N2174 PolarHBondContact N-ND2 2.99Å; Y2152-N2174 PolarHBondContact O-ND2 2.96Å; Y2152-R2351 WeakPolarHBondContact CE2-O 3.47Å; Y2152-R2351 PolarHBondContact OH-O 3.14Å; Y2152-T2352 WeakPolarHBondContact CD2-O 3.1Å; Y2152-T2352 VanDerWaalsContact CE2-O 3.26Å; Y2152-T2352 WeakPolarHBondContact CE2-O 3.35Å; Y2152-P2355 HydrophobicContact CE1-CB 4.17Å; Y2152-P2355 HydrophobicContact CE1-CG 4.23Å
2153	E	92.5	Very high	91.9	Very high	49 Å²	49	54.7 Å²	54.7	23%	0.229	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-34.7	-178	-165.2	72.5	-131.1	0	0	113	K2131 T2133 S2134 T2155 R2156	K2131-E2153 HydrophobicContact CB-CB 3.93Å; K2131-E2153 PolarHBondContact O-N 3.37Å; T2133-E2153 WeakPolarHBondContact CA-OE2 3.2Å; T2133-E2153 VanDerWaalsContact CB-OE2 3.31Å; T2133-E2153 WeakPolarHBondContact CB-OE2 3.26Å; T2133-E2153 PolarHBondContact N-OE2 3.43Å; T2133-E2153 VanDerWaalsContact OG1-CD 3.25Å; T2133-E2153 WeakPolarHBondContact OG1-CG 3.36Å; T2133-E2153 PolarHBondContact OG1-OE2 2.7Å; S2134-E2153 PolarHBondContact N-OE2 3.04Å; S2134-E2153 PolarHBondContact OG-OE1 2.97Å; E2153-T2155 VanDerWaalsContact C-N 3.31Å; E2153-T2155 PolarHBondContact O-N 3.05Å; E2153-R2156 IonicContact OE1-CZ 3.36Å; E2153-R2156 IonicContact OE1-NE 3.28Å; E2153-R2156 PolarHBondContact OE1-NE 3.22Å; E2153-R2156 IonicContact OE1-NH2 2.83Å; E2153-R2156 PolarHBondContact OE1-NH2 3.28Å
2154	S	86.5	Confident	91	Very high	71 Å²	71	57.6 Å²	57.6	50%	0.497	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-24.3	-178.7	42.6	0	0	0	0	113.9	E1986 Y2152	E1986-S2154 VanDerWaalsContact OE1-CB 3.22Å; E1986-S2154 WeakPolarHBondContact OE1-CB 3.24Å; E1986-S2154 PolarHBondContact OE1-OG 2.94Å; Y2152-S2154 VanDerWaalsContact C-N 3.34Å; Y2152-S2154 PolarHBondContact O-N 2.8Å
2155	T	92.1	Very high	90.5	Very high	22 Å²	22	61 Å²	61	14%	0.135	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	0.7	-178.5	60.7	0	0	0	0	113.9	Y2152 E2153 N2174 F2175 Q2353	Y2152-T2155 PolarHBondContact O-N 3.23Å; E2153-T2155 VanDerWaalsContact C-N 3.31Å; E2153-T2155 PolarHBondContact O-N 3.05Å; T2155-N2174 CarbonylContact O-C 3.56Å; T2155-N2174 VanDerWaalsContact O-CA 3.3Å; T2155-N2174 WeakPolarHBondContact O-CA 3.45Å; T2155-N2174 PolarHBondContact OG1-ND2 3.26Å; T2155-F2175 PolarHBondContact O-N 2.87Å; T2155-Q2353 HydrophobicContact CG2-CB 4.41Å; T2155-Q2353 HydrophobicContact CG2-CG 4.47Å; T2155-Q2353 PolarHBondContact OG1-O 2.82Å
2156	R	95.7	Very high	90	Very high	37 Å²	37	61 Å²	61	14%	0.14	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	157.8	-177.8	76.7	166.5	174.8	110.2	-14.1	112.1	S2134 P2151 Y2152 E2153 P2158 D2169 A2173	S2134-R2156 PolarHBondContact OG-NH2 2.9Å; P2151-R2156 HydrophobicContact CB-CB 4.19Å; Y2152-R2156 WeakPolarHBondContact O-CB 3.47Å; Y2152-R2156 PolarHBondContact O-N 3.38Å; E2153-R2156 IonicContact OE1-CZ 3.36Å; E2153-R2156 IonicContact OE1-NE 3.28Å; E2153-R2156 PolarHBondContact OE1-NE 3.22Å; E2153-R2156 IonicContact OE1-NH2 2.83Å; E2153-R2156 PolarHBondContact OE1-NH2 3.28Å; R2156-P2158 VanDerWaalsContact O-CD 3.3Å; R2156-P2158 WeakPolarHBondContact O-CD 3.33Å; R2156-D2169 IonicContact CZ-OD2 3.32Å; R2156-D2169 PolarHBondContact NH1-O 2.76Å; R2156-D2169 IonicContact NH1-OD2 3.03Å; R2156-D2169 PolarHBondContact NH1-OD2 2.77Å; R2156-D2169 IonicContact NH2-OD2 3.29Å; R2156-D2169 PolarHBondContact NH2-OD2 2.77Å; R2156-A2173 WeakPolarHBondContact CA-O 3.2Å
2157	V	97.4	Very high	89.8	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	116.9	166	171.9	0	0	0	0	109.8	L2159 I2171 A2173 F2175 I2186 M2202 L2206	V2157-L2159 HydrophobicContact CG1-CD2 3.96Å; V2157-I2171 HydrophobicContact CB-CG2 4.18Å; V2157-I2171 HydrophobicContact CG1-CG2 4.04Å; V2157-A2173 HydrophobicContact CB-CB 4.07Å; V2157-A2173 HydrophobicContact CG2-CB 3.89Å; V2157-A2173 PolarHBondContact N-O 3.34Å; V2157-F2175 HydrophobicContact CB-CE2 4.48Å; V2157-F2175 HydrophobicContact CG2-CD2 4.07Å; V2157-F2175 HydrophobicContact CG2-CE1 4.46Å; V2157-F2175 HydrophobicContact CG2-CE2 3.96Å; V2157-F2175 HydrophobicContact CG2-CG 4.37Å; V2157-F2175 HydrophobicContact CG2-CZ 4.17Å; V2157-I2186 HydrophobicContact CG2-CG1 4.27Å; V2157-I2186 HydrophobicContact CG2-CG2 3.91Å; V2157-M2202 HydrophobicContact CB-SD 4.42Å; V2157-M2202 HydrophobicContact CG1-CG 3.79Å; V2157-M2202 HydrophobicContact CG1-SD 3.94Å; V2157-M2202 HydrophobicContact CG2-SD 4.44Å; V2157-L2206 HydrophobicContact CG1-CD1 3.6Å; V2157-L2206 HydrophobicContact CG2-CD1 4.28Å
2158	P	93.3	Very high	89.9	Confident	69 Å²	69	52.3 Å²	52.3	45%	0.448	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	138.9	165.8	35	-31.1	0	0	0	110.5	R2156 D2169	R2156-P2158 VanDerWaalsContact O-CD 3.3Å; R2156-P2158 WeakPolarHBondContact O-CD 3.33Å; P2158-D2169 WeakPolarHBondContact CA-O 3.37Å
2159	L	94.9	Very high	90.3	Very high	7 Å²	7	47.9 Å²	47.9	4%	0.037	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-102.1	157.9	169.9	-50.6	-177.3	0	0	0	110.2	V2157 P2161 D2169 I2171 D2198 M2202	V2157-L2159 HydrophobicContact CG1-CD2 3.96Å; L2159-P2161 WeakPolarHBondContact O-CD 3.3Å; L2159-D2169 PolarHBondContact N-O 2.74Å; L2159-D2169 WeakPolarHBondContact O-CA 3.4Å; L2159-D2169 WeakPolarHBondContact O-CB 3.39Å; L2159-I2171 HydrophobicContact CD1-CB 4.15Å; L2159-I2171 HydrophobicContact CD1-CG2 4.08Å; L2159-I2171 HydrophobicContact CD2-CG2 4.06Å; L2159-I2171 HydrophobicContact CG-CG2 4.05Å; L2159-D2198 HydrophobicContact CD1-CB 4.04Å; L2159-M2202 HydrophobicContact CD2-CB 3.6Å; L2159-M2202 HydrophobicContact CD2-CG 3.94Å
2160	Q	90.1	Very high	90.6	Very high	104 Å²	104	47.2 Å²	47.2	49%	0.486	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-63.6	121.5	174.5	-73.7	-70.7	-5.4	0	0	110.8	I2162 R2201 E2205	Q2160-I2162 PolarHBondContact O-N 3.07Å; Q2160-R2201 PolarHBondContact O-NH1 3.21Å; Q2160-E2205 PolarHBondContact N-OE2 2.65Å
2161	P	89.4	Confident	90.7	Very high	85 Å²	85	46.5 Å²	46.5	55%	0.552	26%	0.261	S	S	*	.	P	Polyproline II helix	trans	-66.9	128.1	-171.8	25	-33.6	0	0	0	112.1	L2159 R2163 D2169	L2159-P2161 WeakPolarHBondContact O-CD 3.3Å; P2161-R2163 PolarHBondContact O-N 3.5Å; P2161-D2169 HydrophobicContact CB-CB 4.48Å
2162	I	87.4	Confident	90.8	Very high	46 Å²	46	46.5 Å²	46.5	24%	0.236	26%	0.26	C	S	.	.			trans	-75.9	112.6	176.2	-57.6	164.7	0	0	0	107.7	Q2160 G2164 V2165 S2168	Q2160-I2162 PolarHBondContact O-N 3.07Å; I2162-G2164 PolarHBondContact O-N 3.43Å; I2162-V2165 HydrophobicContact CB-CB 4.27Å; I2162-V2165 HydrophobicContact CB-CG2 4.27Å; I2162-V2165 HydrophobicContact CG2-CB 4.44Å; I2162-V2165 HydrophobicContact CG2-CG2 3.89Å; I2162-V2165 PolarHBondContact O-N 3.49Å; I2162-S2168 PolarHBondContact N-OG 2.84Å; I2162-S2168 PolarHBondContact O-OG 3.05Å
2163	R	84.2	Confident	91	Very high	220 Å²	220	46 Å²	46	83%	0.83	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	112.5	-179.2	-68.9	-173	-71.8	-160.8	-4.5	111.3	P2161	P2161-R2163 PolarHBondContact O-N 3.5Å
2164	G	78.6	Confident	91.3	Very high	85 Å²	85	43.7 Å²	43.7	88%	0.876	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	103	-0.4	179.4	0	0	0	0	0	116	I2162	I2162-G2164 PolarHBondContact O-N 3.43Å
2165	V	85	Confident	91.8	Very high	82 Å²	82	41.3 Å²	41.3	50%	0.497	23%	0.228	S	C	.	.			trans	-120	111.1	-177	-174.6	0	0	0	0	110.8	I2162 S2168	I2162-V2165 HydrophobicContact CB-CB 4.27Å; I2162-V2165 HydrophobicContact CB-CG2 4.27Å; I2162-V2165 HydrophobicContact CG2-CB 4.44Å; I2162-V2165 HydrophobicContact CG2-CG2 3.89Å; I2162-V2165 PolarHBondContact O-N 3.49Å; V2165-S2168 VanDerWaalsContact O-CB 3.32Å; V2165-S2168 WeakPolarHBondContact O-CB 3.38Å; V2165-S2168 PolarHBondContact O-N 3.05Å; V2165-S2168 PolarHBondContact O-OG 3.33Å
2166	E	82.5	Confident	91.9	Very high	43 Å²	43	40.2 Å²	40.2	20%	0.201	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	145.2	167.7	-90	-159.7	171.2	0	0	110.5	S601 A602 V603 D604 Q605 C2139 S2168	S601-E2166 VanDerWaalsContact CA-OE2 3.24Å; S601-E2166 WeakPolarHBondContact CA-OE2 3.5Å; A602-E2166 PolarHBondContact N-OE2 3.04Å; V603-E2166 PolarHBondContact N-OE2 2.9Å; V603-E2166 VanDerWaalsContact N-OE2 3.07Å; D604-E2166 VanDerWaalsContact CB-CD 3.44Å; D604-E2166 HydrophobicContact CB-CG 3.85Å; D604-E2166 WeakPolarHBondContact CB-OE1 3.42Å; D604-E2166 PolarHBondContact N-OE1 2.86Å; D604-E2166 VanDerWaalsContact N-OE1 3.1Å; D604-E2166 PolarHBondContact N-OE2 2.86Å; D604-E2166 VanDerWaalsContact OD2-CB 3.23Å; D604-E2166 WeakPolarHBondContact OD2-CB 3.3Å; D604-E2166 WeakPolarHBondContact OD2-CG 3.37Å; Q605-E2166 WeakPolarHBondContact CG-OE1 3.36Å; Q605-E2166 PolarHBondContact N-OE1 3.42Å; C2139-E2166 HydrophobicContact CB-CB 4.3Å; E2166-S2168 PolarHBondContact O-N 2.77Å; E2166-S2168 VanDerWaalsContact O-N 3.12Å
2167	G	87.2	Confident	91.7	Very high	2 Å²	2	38.8 Å²	38.8	2%	0.021	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	11.1	-178.5	0	0	0	0	0	117.1	D604 C2139 N2140 K2143 D2169 Y2170	D604-G2167 PolarHBondContact OD2-N 2.84Å; C2139-G2167 WeakPolarHBondContact SG-CA 3.26Å; N2140-G2167 VanDerWaalsContact OD1-CA 3.23Å; N2140-G2167 WeakPolarHBondContact OD1-CA 3.31Å; N2140-G2167 PolarHBondContact OD1-O 2.92Å; K2143-G2167 PolarHBondContact NZ-O 3.32Å; G2167-D2169 VanDerWaalsContact C-N 3.26Å; G2167-D2169 PolarHBondContact O-N 3.39Å; G2167-Y2170 PolarHBondContact O-N 3.16Å
2168	S	91.4	Very high	91.3	Very high	4 Å²	4	39 Å²	39	3%	0.028	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-8.4	-177.8	59.7	0	0	0	0	114.7	I2162 V2165 E2166 R2201	I2162-S2168 PolarHBondContact N-OG 2.84Å; I2162-S2168 PolarHBondContact O-OG 3.05Å; V2165-S2168 VanDerWaalsContact O-CB 3.32Å; V2165-S2168 WeakPolarHBondContact O-CB 3.38Å; V2165-S2168 PolarHBondContact O-N 3.05Å; V2165-S2168 PolarHBondContact O-OG 3.33Å; E2166-S2168 PolarHBondContact O-N 2.77Å; E2166-S2168 VanDerWaalsContact O-N 3.12Å; S2168-R2201 VanDerWaalsContact O-CZ 3.29Å; S2168-R2201 PolarHBondContact O-NH1 3.17Å; S2168-R2201 PolarHBondContact O-NH2 2.8Å
2169	D	93.5	Very high	90.9	Very high	36 Å²	36	36.6 Å²	36.6	19%	0.193	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-5.2	169.6	75.6	-55	0	0	0	113.3	R2156 P2158 L2159 P2161 G2167	R2156-D2169 IonicContact CZ-OD2 3.32Å; R2156-D2169 PolarHBondContact NH1-O 2.76Å; R2156-D2169 IonicContact NH1-OD2 3.03Å; R2156-D2169 PolarHBondContact NH1-OD2 2.77Å; R2156-D2169 IonicContact NH2-OD2 3.29Å; R2156-D2169 PolarHBondContact NH2-OD2 2.77Å; P2158-D2169 WeakPolarHBondContact CA-O 3.37Å; L2159-D2169 PolarHBondContact N-O 2.74Å; L2159-D2169 WeakPolarHBondContact O-CA 3.4Å; L2159-D2169 WeakPolarHBondContact O-CB 3.39Å; P2161-D2169 HydrophobicContact CB-CB 4.48Å; G2167-D2169 VanDerWaalsContact C-N 3.26Å; G2167-D2169 PolarHBondContact O-N 3.39Å
2170	Y	97.5	Very high	90.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	134.2	-170.2	178.8	-93.6	0	0	0	114.4	A2135 N2140 K2143 N2144 P2151 G2167	A2135-Y2170 HydrophobicContact CB-CE2 3.71Å; A2135-Y2170 VanDerWaalsContact CB-OH 3.28Å; A2135-Y2170 WeakPolarHBondContact CB-OH 3.28Å; N2140-Y2170 HydrophobicContact CB-CD1 3.58Å; N2140-Y2170 HydrophobicContact CB-CE1 3.93Å; N2140-Y2170 HydrophobicContact CB-CG 4.1Å; N2140-Y2170 VanDerWaalsContact CG-CD1 3.47Å; N2140-Y2170 VanDerWaalsContact ND2-CB 3.34Å; N2140-Y2170 WeakPolarHBondContact ND2-CB 3.43Å; K2143-Y2170 HydrophobicContact CB-CD1 4.37Å; K2143-Y2170 HydrophobicContact CB-CE1 4.25Å; K2143-Y2170 HydrophobicContact CD-CD1 4.02Å; K2143-Y2170 PolarHBondContact NZ-O 3.33Å; N2144-Y2170 PolarHBondContact OD1-OH 3.5Å; P2151-Y2170 WeakPolarHBondContact CD-OH 3.34Å; P2151-Y2170 HydrophobicContact CG-CE2 3.69Å; P2151-Y2170 WeakPolarHBondContact CG-OH 3.37Å; G2167-Y2170 PolarHBondContact O-N 3.16Å
2171	I	97.4	Very high	90	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.021	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	149.7	163.7	-174.7	163	0	0	0	109	V2157 L2159 A2173 D2198 F2199 M2202	V2157-I2171 HydrophobicContact CB-CG2 4.18Å; V2157-I2171 HydrophobicContact CG1-CG2 4.04Å; L2159-I2171 HydrophobicContact CD1-CB 4.15Å; L2159-I2171 HydrophobicContact CD1-CG2 4.08Å; L2159-I2171 HydrophobicContact CD2-CG2 4.06Å; L2159-I2171 HydrophobicContact CG-CG2 4.05Å; I2171-A2173 VanDerWaalsContact C-N 3.25Å; I2171-A2173 HydrophobicContact CG2-CB 4.17Å; I2171-A2173 PolarHBondContact O-N 2.88Å; I2171-D2198 HydrophobicContact CD1-CB 4.19Å; I2171-F2199 HydrophobicContact CD1-CB 4.32Å; I2171-M2202 HydrophobicContact CD1-CB 4.37Å; I2171-M2202 HydrophobicContact CD1-CE 4.5Å; I2171-M2202 HydrophobicContact CD1-SD 4Å; I2171-M2202 HydrophobicContact CG2-SD 3.89Å
2172	N	97.5	Very high	89.8	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	75	177.7	-170.5	-39.6	0	0	0	111.2	N2144 I2149 T2188 Q2189 R2354	N2144-N2172 PolarHBondContact OD1-ND2 2.94Å; I2149-N2172 PolarHBondContact O-ND2 3.23Å; N2172-T2188 PolarHBondContact O-OG1 3.47Å; N2172-Q2189 HydrophobicContact CB-CG 4.08Å; N2172-Q2189 PolarHBondContact O-N 2.72Å; N2172-R2354 PolarHBondContact OD1-NH1 2.8Å; N2172-R2354 PolarHBondContact OD1-NH2 2.87Å
2173	A	97.9	Very high	90	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	147.8	179.6	0	0	0	0	0	111.5	R2156 V2157 I2171 I2186 A2187 M2202	R2156-A2173 WeakPolarHBondContact CA-O 3.2Å; V2157-A2173 HydrophobicContact CB-CB 4.07Å; V2157-A2173 HydrophobicContact CG2-CB 3.89Å; V2157-A2173 PolarHBondContact N-O 3.34Å; I2171-A2173 VanDerWaalsContact C-N 3.25Å; I2171-A2173 HydrophobicContact CG2-CB 4.17Å; I2171-A2173 PolarHBondContact O-N 2.88Å; A2173-I2186 HydrophobicContact CB-CG2 3.75Å; A2173-A2187 WeakPolarHBondContact CA-O 3.25Å; A2173-M2202 HydrophobicContact CB-SD 3.85Å
2174	N	97.9	Very high	90.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	142.3	172.8	-63.5	92.9	0	0	0	110.2	P2151 Y2152 T2155 I2186 A2187 R2354	P2151-N2174 VanDerWaalsContact CA-OD1 3.24Å; P2151-N2174 WeakPolarHBondContact CA-OD1 3.37Å; P2151-N2174 WeakPolarHBondContact CB-ND2 3.38Å; P2151-N2174 WeakPolarHBondContact CB-OD1 3.46Å; Y2152-N2174 PolarHBondContact N-ND2 2.99Å; Y2152-N2174 PolarHBondContact O-ND2 2.96Å; T2155-N2174 CarbonylContact O-C 3.56Å; T2155-N2174 VanDerWaalsContact O-CA 3.3Å; T2155-N2174 WeakPolarHBondContact O-CA 3.45Å; T2155-N2174 PolarHBondContact OG1-ND2 3.26Å; N2174-I2186 CarbonylContact O-C 3.43Å; N2174-I2186 WeakPolarHBondContact O-CA 3.45Å; N2174-A2187 PolarHBondContact N-O 3.02Å; N2174-A2187 PolarHBondContact O-N 3.08Å; N2174-R2354 HydrophobicContact CB-CB 4.16Å; N2174-R2354 HydrophobicContact CB-CG 4.45Å; N2174-R2354 WeakPolarHBondContact OD1-CD 3.2Å; N2174-R2354 WeakPolarHBondContact OD1-CG 3.12Å; N2174-R2354 PolarHBondContact OD1-NH1 3.37Å
2175	F	97.1	Very high	91.3	Very high	20 Å²	20	24.8 Å²	24.8	9%	0.088	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	143.3	159.1	-68.8	-74.1	0	0	0	109.9	T2155 V2157 K2183 Y2185 I2186 L2206	T2155-F2175 PolarHBondContact O-N 2.87Å; V2157-F2175 HydrophobicContact CB-CE2 4.48Å; V2157-F2175 HydrophobicContact CG2-CD2 4.07Å; V2157-F2175 HydrophobicContact CG2-CE1 4.46Å; V2157-F2175 HydrophobicContact CG2-CE2 3.96Å; V2157-F2175 HydrophobicContact CG2-CG 4.37Å; V2157-F2175 HydrophobicContact CG2-CZ 4.17Å; F2175-K2183 HydrophobicContact CB-CB 4.17Å; F2175-K2183 HydrophobicContact CB-CD 4.27Å; F2175-K2183 HydrophobicContact CB-CG 3.91Å; F2175-K2183 HydrophobicContact CD1-CB 3.69Å; F2175-K2183 HydrophobicContact CD1-CD 3.87Å; F2175-K2183 HydrophobicContact CD1-CG 4.01Å; F2175-K2183 HydrophobicContact CD2-CD 4.07Å; F2175-K2183 HydrophobicContact CE1-CB 4.34Å; F2175-K2183 HydrophobicContact CE1-CD 4.14Å; F2175-K2183 HydrophobicContact CE2-CD 4.33Å; F2175-K2183 HydrophobicContact CG-CB 4.12Å; F2175-K2183 HydrophobicContact CG-CD 3.81Å; F2175-K2183 HydrophobicContact CG-CG 3.95Å; F2175-K2183 HydrophobicContact CZ-CD 4.36Å; F2175-Y2185 WeakPolarHBondContact CA-O 3.34Å; F2175-I2186 HydrophobicContact CD1-CG1 4.07Å; F2175-I2186 HydrophobicContact CE1-CG1 4.15Å; F2175-L2206 HydrophobicContact CE1-CD1 3.84Å; F2175-L2206 HydrophobicContact CZ-CD1 3.63Å; F2175-L2206 HydrophobicContact CZ-CD2 3.97Å; F2175-L2206 HydrophobicContact CZ-CG 4.46Å
2176	V	95.1	Very high	91.9	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	130.7	173.7	-176.5	0	0	0	0	109.3	K2183 A2184 Y2185 A2187 L2326 L2350	V2176-K2183 CarbonylContact O-C 3.58Å; V2176-A2184 PolarHBondContact O-N 3.43Å; V2176-A2184 VanDerWaalsContact O-N 3.12Å; V2176-Y2185 PolarHBondContact N-O 2.99Å; V2176-Y2185 PolarHBondContact O-N 2.88Å; V2176-A2187 HydrophobicContact CG2-CB 3.76Å; V2176-L2326 HydrophobicContact CB-CD1 4.48Å; V2176-L2326 HydrophobicContact CG1-CD1 4.28Å; V2176-L2326 HydrophobicContact CG1-CD2 4.33Å; V2176-L2326 HydrophobicContact CG2-CD1 4.38Å; V2176-L2350 HydrophobicContact CG1-CD2 3.47Å; V2176-L2350 VanDerWaalsContact CG1-CD2 3.47Å
2177	D	91.3	Very high	92.7	Very high	6 Å²	6	18.8 Å²	18.8	3%	0.032	9%	0.085	C	C	.	.			trans	-75.9	143.6	176.3	-64.5	-0.2	0	0	0	109.8	Y1951 D2181 R2182 K2183	Y1951-D2177 PolarHBondContact OH-OD2 3.5Å; D2177-D2181 CarbonylContact C-O 3.58Å; D2177-D2181 WeakPolarHBondContact CA-O 3.33Å; D2177-R2182 WeakPolarHBondContact OD1-CA 3.14Å; D2177-R2182 IonicContact OD2-CZ 2.68Å; D2177-R2182 IonicContact OD2-NE 3.57Å; D2177-R2182 PolarHBondContact OD2-NE 2.82Å; D2177-R2182 IonicContact OD2-NH2 3.08Å; D2177-R2182 PolarHBondContact OD2-NH2 2.78Å; D2177-R2182 VanDerWaalsContact OD2-NH2 3.1Å; D2177-K2183 PolarHBondContact OD1-N 3.28Å
2178	S	88.9	Confident	93.2	Very high	6 Å²	6	18.8 Å²	18.8	4%	0.042	8%	0.084	C	C	.	.			trans	-88.5	-167.9	172.3	77	0	0	0	0	111.4	A1950 R2180 D2181 Y2185	A1950-S2178 WeakPolarHBondContact CB-O 3.31Å; S2178-R2180 PolarHBondContact OG-N 3.12Å; S2178-R2180 VanDerWaalsContact OG-N 3.11Å; S2178-D2181 PolarHBondContact N-O 3.39Å; S2178-D2181 PolarHBondContact OG-N 2.83Å; S2178-Y2185 VanDerWaalsContact CB-CE2 3.4Å
2179	Y	83.8	Confident	93.5	Very high	17 Å²	17	18.8 Å²	18.8	7%	0.067	8%	0.084	C	C	.	.	S	Bend	trans	-64.3	-34.1	168.3	177.3	-115.7	0	0	0	111.1	L1949 A1950 E2333 R2334 H2337 E2338	L1949-Y2179 WeakPolarHBondContact CB-O 3.26Å; L1949-Y2179 HydrophobicContact CD1-CE1 4.3Å; L1949-Y2179 HydrophobicContact CD1-CE2 3.81Å; L1949-Y2179 WeakPolarHBondContact CD1-OH 3.31Å; L1949-Y2179 HydrophobicContact CD2-CD1 3.77Å; L1949-Y2179 HydrophobicContact CD2-CE1 3.24Å; L1949-Y2179 HydrophobicContact CD2-CE2 4.09Å; L1949-Y2179 HydrophobicContact CD2-CG 4.38Å; L1949-Y2179 VanDerWaalsContact CD2-CZ 3.4Å; L1949-Y2179 HydrophobicContact CG-CE1 4.39Å; A1950-Y2179 PolarHBondContact N-O 2.8Å; Y2179-E2333 HydrophobicContact CD1-CB 4.17Å; Y2179-E2333 HydrophobicContact CD1-CG 3.73Å; Y2179-E2333 HydrophobicContact CE1-CG 4.47Å; Y2179-R2334 HydrophobicContact CD2-CB 3.77Å; Y2179-R2334 HydrophobicContact CD2-CG 4.11Å; Y2179-R2334 HydrophobicContact CE2-CB 3.66Å; Y2179-R2334 HydrophobicContact CE2-CG 3.56Å; Y2179-R2334 HydrophobicContact CG-CB 4.33Å; Y2179-H2337 HydrophobicContact CE1-CB 4.21Å; Y2179-H2337 AromaticContact CE1-ND1 3.95Å; Y2179-E2338 WeakPolarHBondContact OH-CG 3.28Å
2180	R	82.9	Confident	93.6	Very high	5 Å²	5	17.1 Å²	17.1	2%	0.019	8%	0.075	C	C	.	.	S	Bend	trans	-104.7	-47.7	-177.2	-71.1	-178.5	157	131.3	-7.5	115	E241 T257 R259 L1949 A1950 S2178 E2333 H2337	E241-R2180 IonicContact OE2-CZ 2.65Å; E241-R2180 IonicContact OE2-NE 3.37Å; E241-R2180 PolarHBondContact OE2-NE 3.09Å; E241-R2180 IonicContact OE2-NH2 2.74Å; E241-R2180 PolarHBondContact OE2-NH2 3.16Å; T257-R2180 WeakPolarHBondContact OG1-CD 3.22Å; T257-R2180 PolarHBondContact OG1-NH1 2.75Å; R259-R2180 VanDerWaalsContact CZ-O 3.23Å; R259-R2180 PolarHBondContact NH1-O 2.96Å; R259-R2180 PolarHBondContact NH2-O 2.83Å; L1949-R2180 CarbonylContact C-O 3.58Å; L1949-R2180 HydrophobicContact CD2-CG 4.1Å; A1950-R2180 WeakPolarHBondContact CA-O 3.39Å; A1950-R2180 PolarHBondContact N-O 2.79Å; S2178-R2180 PolarHBondContact OG-N 3.12Å; S2178-R2180 VanDerWaalsContact OG-N 3.11Å; R2180-E2333 WeakPolarHBondContact CD-OE1 2.92Å; R2180-E2333 IonicContact CZ-OE1 3.11Å; R2180-E2333 IonicContact NE-OE1 3.3Å; R2180-E2333 IonicContact NH1-OE1 2.75Å; R2180-E2333 PolarHBondContact NH1-OE1 2.67Å; R2180-H2337 VanDerWaalsContact CZ-CE1 3.49Å; R2180-H2337 PolarHBondContact NH1-CE1 2.78Å; R2180-H2337 PolarHBondContact NH1-NE2 2.98Å; R2180-H2337 PolarHBondContact NH2-CD2 3.27Å; R2180-H2337 PolarHBondContact NH2-CE1 3.01Å; R2180-H2337 VanDerWaalsContact NH2-CE1 3.3Å; R2180-H2337 PolarHBondContact NH2-NE2 3.35Å
2181	D	83.2	Confident	93.6	Very high	36 Å²	36	17.2 Å²	17.2	19%	0.193	8%	0.075	C	C	.	.			trans	-109.6	138	-163.5	-36.5	-40.8	0	0	0	110.7	R259 D2177 S2178 A2184	R259-D2181 IonicContact CZ-OD1 3.59Å; R259-D2181 IonicContact NH2-OD1 2.71Å; R259-D2181 PolarHBondContact NH2-OD1 2.88Å; D2177-D2181 CarbonylContact C-O 3.58Å; D2177-D2181 WeakPolarHBondContact CA-O 3.33Å; S2178-D2181 PolarHBondContact N-O 3.39Å; S2178-D2181 PolarHBondContact OG-N 2.83Å; D2181-A2184 HydrophobicContact CB-CB 3.95Å
2182	R	86.8	Confident	93.5	Very high	133 Å²	133	18.9 Å²	18.9	50%	0.502	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	138.5	169.6	-58.4	-158.1	67.7	-138.4	-8.5	109.8	A1950 D2177 A2184	A1950-R2182 HydrophobicContact CB-CG 4.34Å; A1950-R2182 VanDerWaalsContact O-CD 3.28Å; A1950-R2182 WeakPolarHBondContact O-CD 3.21Å; A1950-R2182 VanDerWaalsContact O-CG 3.25Å; A1950-R2182 WeakPolarHBondContact O-CG 3.45Å; D2177-R2182 WeakPolarHBondContact OD1-CA 3.14Å; D2177-R2182 IonicContact OD2-CZ 2.68Å; D2177-R2182 IonicContact OD2-NE 3.57Å; D2177-R2182 PolarHBondContact OD2-NE 2.82Å; D2177-R2182 IonicContact OD2-NH2 3.08Å; D2177-R2182 PolarHBondContact OD2-NH2 2.78Å; D2177-R2182 VanDerWaalsContact OD2-NH2 3.1Å; R2182-A2184 PolarHBondContact O-N 3.24Å
2183	K	91.4	Very high	93.3	Very high	113 Å²	113	21.7 Å²	21.7	49%	0.491	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	30	-174.1	-53.6	-170.1	173.1	-167.5	0	114.1	F2175 V2176 D2177 Y2185 P2310	F2175-K2183 HydrophobicContact CB-CB 4.17Å; F2175-K2183 HydrophobicContact CB-CD 4.27Å; F2175-K2183 HydrophobicContact CB-CG 3.91Å; F2175-K2183 HydrophobicContact CD1-CB 3.69Å; F2175-K2183 HydrophobicContact CD1-CD 3.87Å; F2175-K2183 HydrophobicContact CD1-CG 4.01Å; F2175-K2183 HydrophobicContact CD2-CD 4.07Å; F2175-K2183 HydrophobicContact CE1-CB 4.34Å; F2175-K2183 HydrophobicContact CE1-CD 4.14Å; F2175-K2183 HydrophobicContact CE2-CD 4.33Å; F2175-K2183 HydrophobicContact CG-CB 4.12Å; F2175-K2183 HydrophobicContact CG-CD 3.81Å; F2175-K2183 HydrophobicContact CG-CG 3.95Å; F2175-K2183 HydrophobicContact CZ-CD 4.36Å; V2176-K2183 CarbonylContact O-C 3.58Å; D2177-K2183 PolarHBondContact OD1-N 3.28Å; K2183-Y2185 PolarHBondContact O-N 3.34Å; K2183-Y2185 VanDerWaalsContact O-N 3.16Å; K2183-P2310 WeakPolarHBondContact O-CB 3.5Å
2184	A	91.6	Very high	93.1	Very high	8 Å²	8	28.8 Å²	28.8	7%	0.066	14%	0.138	C	C	.	.			trans	-57	-28.1	-179.4	0	0	0	0	0	114.5	V2176 D2181 R2182 P2310 I2311	V2176-A2184 PolarHBondContact O-N 3.43Å; V2176-A2184 VanDerWaalsContact O-N 3.12Å; D2181-A2184 HydrophobicContact CB-CB 3.95Å; R2182-A2184 PolarHBondContact O-N 3.24Å; A2184-P2310 VanDerWaalsContact O-CA 3.25Å; A2184-P2310 WeakPolarHBondContact O-CA 3.43Å; A2184-I2311 PolarHBondContact O-N 3.36Å; A2184-I2311 VanDerWaalsContact O-N 3.12Å
2185	Y	97.3	Very high	93	Very high	4 Å²	4	29 Å²	29	2%	0.016	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	159.6	-175.7	-45.2	-86.8	0	0	0	111.5	F2175 V2176 S2178 K2183 H2299 I2311 I2313 F2325 L2326 S2329	F2175-Y2185 WeakPolarHBondContact CA-O 3.34Å; V2176-Y2185 PolarHBondContact N-O 2.99Å; V2176-Y2185 PolarHBondContact O-N 2.88Å; S2178-Y2185 VanDerWaalsContact CB-CE2 3.4Å; K2183-Y2185 PolarHBondContact O-N 3.34Å; K2183-Y2185 VanDerWaalsContact O-N 3.16Å; Y2185-H2299 AromaticContact CE1-CE1 3.9Å; Y2185-H2299 PolarHBondContact OH-CE1 3.47Å; Y2185-H2299 VanDerWaalsContact OH-CE1 3.24Å; Y2185-I2311 CarbonylContact C-O 3.35Å; Y2185-I2311 VanDerWaalsContact CA-O 3.32Å; Y2185-I2311 WeakPolarHBondContact CA-O 3.11Å; Y2185-I2311 HydrophobicContact CD1-CB 4.07Å; Y2185-I2311 HydrophobicContact CD1-CD1 4.22Å; Y2185-I2311 HydrophobicContact CD1-CG1 4.4Å; Y2185-I2311 HydrophobicContact CE1-CD1 4.04Å; Y2185-I2313 HydrophobicContact CD1-CD1 3.56Å; Y2185-I2313 HydrophobicContact CE1-CD1 4.26Å; Y2185-I2313 HydrophobicContact CG-CD1 4.07Å; Y2185-F2325 HydrophobicContact CE1-CE1 4.34Å; Y2185-L2326 HydrophobicContact CD1-CD2 3.7Å; Y2185-L2326 HydrophobicContact CD2-CD2 3.14Å; Y2185-L2326 HydrophobicContact CE1-CD2 3.98Å; Y2185-L2326 HydrophobicContact CE2-CD2 3.43Å; Y2185-L2326 VanDerWaalsContact CE2-CD2 3.43Å; Y2185-L2326 HydrophobicContact CG-CD2 3.28Å; Y2185-S2329 WeakPolarHBondContact OH-CB 3.32Å
2186	I	98.1	Very high	93	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	113.2	163.5	-64.5	159.4	0	0	0	107.5	V2157 A2173 N2174 F2175 M2202 L2206 P2310 I2311 T2312 I2313	V2157-I2186 HydrophobicContact CG2-CG1 4.27Å; V2157-I2186 HydrophobicContact CG2-CG2 3.91Å; A2173-I2186 HydrophobicContact CB-CG2 3.75Å; N2174-I2186 CarbonylContact O-C 3.43Å; N2174-I2186 WeakPolarHBondContact O-CA 3.45Å; F2175-I2186 HydrophobicContact CD1-CG1 4.07Å; F2175-I2186 HydrophobicContact CE1-CG1 4.15Å; I2186-M2202 HydrophobicContact CG2-CE 3.97Å; I2186-M2202 HydrophobicContact CG2-SD 3.92Å; I2186-L2206 HydrophobicContact CD1-CB 4.3Å; I2186-L2206 HydrophobicContact CD1-CD1 3.53Å; I2186-L2206 HydrophobicContact CG1-CD1 4.39Å; I2186-P2310 HydrophobicContact CD1-CB 4.09Å; I2186-P2310 HydrophobicContact CD1-CG 3.52Å; I2186-P2310 HydrophobicContact CG1-CB 4.01Å; I2186-P2310 HydrophobicContact CG1-CG 3.96Å; I2186-I2311 PolarHBondContact N-O 3.1Å; I2186-T2312 CarbonylContact O-C 3.35Å; I2186-I2313 PolarHBondContact O-N 2.92Å
2187	A	98.1	Very high	93	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	106.7	171.2	0	0	0	0	0	109.1	A2173 N2174 V2176 T2322 L2326 M2357	A2173-A2187 WeakPolarHBondContact CA-O 3.25Å; N2174-A2187 PolarHBondContact N-O 3.02Å; N2174-A2187 PolarHBondContact O-N 3.08Å; V2176-A2187 HydrophobicContact CG2-CB 3.76Å; A2187-T2322 HydrophobicContact CB-CG2 3.81Å; A2187-L2326 HydrophobicContact CB-CD1 4.21Å; A2187-M2357 HydrophobicContact CB-CE 4.28Å
2188	T	98.3	Very high	93.3	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.012	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	153.8	-177.7	-177.5	0	0	0	0	111.7	N2172 F2199 M2202 T2312 I2313 H2314 G2318	N2172-T2188 PolarHBondContact O-OG1 3.47Å; T2188-F2199 HydrophobicContact CG2-CE2 4.23Å; T2188-M2202 HydrophobicContact CG2-CE 4.3Å; T2188-T2312 HydrophobicContact CG2-CG2 3.58Å; T2188-I2313 PolarHBondContact N-O 3.48Å; T2188-H2314 HydrophobicContact CG2-CB 3.83Å; T2188-H2314 VanDerWaalsContact O-CA 3.29Å; T2188-H2314 WeakPolarHBondContact O-CA 3.2Å; T2188-H2314 WeakPolarHBondContact O-CB 3.46Å; T2188-G2318 WeakPolarHBondContact O-CA 3.22Å
2189	Q	97.1	Very high	93.7	Very high	4 Å²	4	32.9 Å²	32.9	2%	0.019	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	155.4	161.5	75.1	-178.2	21.9	0	0	110.5	K2143 N2172	K2143-Q2189 PolarHBondContact O-NE2 2.82Å; N2172-Q2189 HydrophobicContact CB-CG 4.08Å; N2172-Q2189 PolarHBondContact O-N 2.72Å
2190	A	96.7	Very high	94.3	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.154	C	C	.	.	P	Polyproline II helix	trans	-64.9	130.7	170	0	0	0	0	0	111	R2145 T2215 C2224 C2225 H2314 C2315 S2316	R2145-A2190 PolarHBondContact NE-O 3.22Å; R2145-A2190 PolarHBondContact NH2-O 3.14Å; A2190-T2215 HydrophobicContact CB-CG2 4.38Å; A2190-C2224 WeakPolarHBondContact CB-O 3.35Å; A2190-C2225 HydrophobicContact CB-CB 3.79Å; A2190-H2314 WeakPolarHBondContact CA-ND1 3.29Å; A2190-H2314 WeakPolarHBondContact CB-ND1 3.49Å; A2190-C2315 WeakPolarHBondContact CB-O 3.49Å; A2190-C2315 PolarHBondContact N-O 2.63Å; A2190-S2316 PolarHBondContact N-O 3Å
2191	P	97	Very high	94.9	Very high	2 Å²	2	32 Å²	32	1%	0.013	15%	0.154	C	C	.	.	P	Polyproline II helix	trans	-51	141.3	-174.9	-31.8	38.1	0	0	0	114	R2145 F2199 Y2226 Y2228	R2145-P2191 PolarHBondContact NH2-O 3.46Å; P2191-F2199 HydrophobicContact CB-CB 4.48Å; P2191-F2199 HydrophobicContact CB-CG 4.49Å; P2191-F2199 HydrophobicContact CG-CB 4.05Å; P2191-F2199 HydrophobicContact CG-CD1 4.03Å; P2191-F2199 HydrophobicContact CG-CD2 3.53Å; P2191-F2199 HydrophobicContact CG-CE1 4.38Å; P2191-F2199 HydrophobicContact CG-CE2 3.9Å; P2191-F2199 HydrophobicContact CG-CG 3.59Å; P2191-F2199 HydrophobicContact CG-CZ 4.32Å; P2191-Y2226 VanDerWaalsContact O-CB 3.23Å; P2191-Y2226 WeakPolarHBondContact O-CB 3.27Å; P2191-Y2226 PolarHBondContact O-N 2.95Å; P2191-Y2228 HydrophobicContact CB-CD1 3.98Å; P2191-Y2228 HydrophobicContact CB-CG 4.26Å; P2191-Y2228 HydrophobicContact CG-CD1 3.6Å; P2191-Y2228 HydrophobicContact CG-CE1 4.13Å; P2191-Y2228 HydrophobicContact CG-CG 3.95Å
2192	M	95.8	Very high	95.6	Very high	39 Å²	39	30.3 Å²	30.3	19%	0.192	15%	0.145	C	C	.	.	P	Polyproline II helix	trans	-102.5	159.7	170.7	-58.5	166.7	72.9	0	0	108.3	R2145 K2194 T2195 V2196	R2145-M2192 HydrophobicContact CB-CG 4.35Å; R2145-M2192 HydrophobicContact CB-SD 3.93Å; R2145-M2192 PolarHBondContact N-SD 2.85Å; M2192-K2194 PolarHBondContact O-N 3.19Å; M2192-T2195 HydrophobicContact CB-CG2 4.47Å; M2192-T2195 PolarHBondContact N-OG1 3.18Å; M2192-T2195 PolarHBondContact O-N 3.49Å; M2192-T2195 PolarHBondContact O-OG1 3.23Å; M2192-V2196 WeakPolarHBondContact O-CG2 3.42Å; M2192-V2196 PolarHBondContact O-N 2.86Å
2193	A	93.6	Very high	96.1	Very high	61 Å²	61	24 Å²	24	50%	0.504	12%	0.121	S	C	.	.	G	3₁₀ helix	trans	-49	-33.6	176.1	0	0	0	0	0	113.9	Y2226	A2193-Y2226 HydrophobicContact CB-CD2 3.69Å; A2193-Y2226 HydrophobicContact CB-CE2 3.65Å; A2193-Y2226 HydrophobicContact CB-CG 4.17Å
2194	K	92.5	Very high	96.3	Very high	149 Å²	149	19.4 Å²	19.4	65%	0.648	10%	0.101	S	C	*	.	G	3₁₀ helix	trans	-81.5	-7.4	179.3	-62.6	-179.5	-178.4	176.1	0	115	M2192	M2192-K2194 PolarHBondContact O-N 3.19Å
2195	T	96.8	Very high	96.4	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.018	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	-126.3	11.1	-174.5	72.9	0	0	0	0	113.1	K2143 M2192 D2198 F2199	K2143-T2195 HydrophobicContact CB-CG2 3.84Å; K2143-T2195 HydrophobicContact CG-CG2 4.14Å; M2192-T2195 HydrophobicContact CB-CG2 4.47Å; M2192-T2195 PolarHBondContact N-OG1 3.18Å; M2192-T2195 PolarHBondContact O-N 3.49Å; M2192-T2195 PolarHBondContact O-OG1 3.23Å; T2195-D2198 PolarHBondContact O-N 3.31Å; T2195-F2199 WeakPolarHBondContact O-CB 3.48Å; T2195-F2199 PolarHBondContact O-N 3.48Å
2196	V	96.6	Very high	96.2	Very high	6 Å²	6	23.8 Å²	23.8	4%	0.036	12%	0.121	C	C	.	.	H	α-helix	trans	-64.7	-42.5	178.8	179	0	0	0	0	111.2	M2192 F2199 W2200 Y2226 Y2237	M2192-V2196 WeakPolarHBondContact O-CG2 3.42Å; M2192-V2196 PolarHBondContact O-N 2.86Å; V2196-F2199 PolarHBondContact O-N 2.88Å; V2196-W2200 VanDerWaalsContact O-CD1 3.27Å; V2196-W2200 PolarHBondContact O-N 3.27Å; V2196-Y2226 HydrophobicContact CG2-CD1 3.55Å; V2196-Y2226 HydrophobicContact CG2-CE1 3.87Å; V2196-Y2237 HydrophobicContact CB-CD1 4.49Å; V2196-Y2237 HydrophobicContact CG1-CD1 3.46Å; V2196-Y2237 VanDerWaalsContact CG1-CD1 3.46Å; V2196-Y2237 HydrophobicContact CG1-CD2 4.5Å; V2196-Y2237 HydrophobicContact CG1-CE1 3.59Å; V2196-Y2237 HydrophobicContact CG1-CG 3.94Å
2197	E	95	Very high	96	Very high	93 Å²	93	26.6 Å²	26.6	44%	0.435	14%	0.136	S	C	.	.	H	α-helix	trans	-66.5	-42.2	177	-55.9	-160.2	136.6	0	0	111.8	F2199 W2200 R2201 Q2238	E2197-F2199 VanDerWaalsContact C-N 3.29Å; E2197-F2199 PolarHBondContact O-N 3.42Å; E2197-W2200 PolarHBondContact O-N 2.94Å; E2197-R2201 VanDerWaalsContact O-CB 3.22Å; E2197-R2201 WeakPolarHBondContact O-CB 3.46Å; E2197-R2201 PolarHBondContact O-N 3.07Å; E2197-Q2238 HydrophobicContact CB-CB 4.19Å; E2197-Q2238 HydrophobicContact CG-CB 4.32Å; E2197-Q2238 WeakPolarHBondContact OE1-CA 3.23Å; E2197-Q2238 PolarHBondContact OE1-N 2.7Å
2198	D	96.8	Very high	95.8	Very high	14 Å²	14	26.6 Å²	26.6	8%	0.075	14%	0.136	C	C	.	.	H	α-helix	trans	-61.2	-37.1	174	-71.3	-17.6	0	0	0	111.9	K2143 L2159 I2171 T2195 R2201 M2202	K2143-D2198 VanDerWaalsContact CE-OD2 3.28Å; K2143-D2198 WeakPolarHBondContact CE-OD2 3.4Å; K2143-D2198 IonicContact NZ-OD1 2.69Å; K2143-D2198 IonicContact NZ-OD2 3.68Å; K2143-D2198 PolarHBondContact NZ-OD2 2.8Å; L2159-D2198 HydrophobicContact CD1-CB 4.04Å; I2171-D2198 HydrophobicContact CD1-CB 4.19Å; T2195-D2198 PolarHBondContact O-N 3.31Å; D2198-R2201 IonicContact OD1-CZ 2.94Å; D2198-R2201 IonicContact OD1-NE 2.79Å; D2198-R2201 IonicContact OD1-NH2 3.34Å; D2198-R2201 PolarHBondContact OD1-NH2 2.92Å; D2198-M2202 WeakPolarHBondContact O-CB 3.47Å; D2198-M2202 PolarHBondContact O-N 3.11Å
2199	F	98	Very high	95.6	Very high	1 Å²	1	27 Å²	27	0%	0.004	14%	0.139	C	C	.	.	H	α-helix	trans	-66.9	-51.7	177.1	-179.9	-95.9	0	0	0	112.1	I2171 T2188 P2191 T2195 V2196 E2197 R2201 M2202 I2203 V2211 Y2228 T2312	I2171-F2199 HydrophobicContact CD1-CB 4.32Å; T2188-F2199 HydrophobicContact CG2-CE2 4.23Å; P2191-F2199 HydrophobicContact CB-CB 4.48Å; P2191-F2199 HydrophobicContact CB-CG 4.49Å; P2191-F2199 HydrophobicContact CG-CB 4.05Å; P2191-F2199 HydrophobicContact CG-CD1 4.03Å; P2191-F2199 HydrophobicContact CG-CD2 3.53Å; P2191-F2199 HydrophobicContact CG-CE1 4.38Å; P2191-F2199 HydrophobicContact CG-CE2 3.9Å; P2191-F2199 HydrophobicContact CG-CG 3.59Å; P2191-F2199 HydrophobicContact CG-CZ 4.32Å; T2195-F2199 WeakPolarHBondContact O-CB 3.48Å; T2195-F2199 PolarHBondContact O-N 3.48Å; V2196-F2199 PolarHBondContact O-N 2.88Å; E2197-F2199 VanDerWaalsContact C-N 3.29Å; E2197-F2199 PolarHBondContact O-N 3.42Å; F2199-R2201 PolarHBondContact O-N 3.28Å; F2199-M2202 HydrophobicContact CD2-CE 4Å; F2199-M2202 HydrophobicContact CE2-CE 4.1Å; F2199-M2202 WeakPolarHBondContact O-CB 3.39Å; F2199-M2202 PolarHBondContact O-N 3.08Å; F2199-I2203 HydrophobicContact CD1-CG1 4.19Å; F2199-I2203 HydrophobicContact CE1-CD1 4.34Å; F2199-I2203 HydrophobicContact CE1-CG1 3.87Å; F2199-I2203 HydrophobicContact CE2-CG1 4.49Å; F2199-I2203 HydrophobicContact CZ-CD1 4.06Å; F2199-I2203 HydrophobicContact CZ-CG1 4.04Å; F2199-I2203 WeakPolarHBondContact O-CB 3.34Å; F2199-I2203 VanDerWaalsContact O-CG1 3.25Å; F2199-I2203 WeakPolarHBondContact O-CG1 3.36Å; F2199-I2203 PolarHBondContact O-N 2.92Å; F2199-V2211 HydrophobicContact CE1-CG2 4.45Å; F2199-V2211 HydrophobicContact CZ-CG1 3.94Å; F2199-V2211 HydrophobicContact CZ-CG2 4.04Å; F2199-Y2228 AromaticContact CD1-CD2 3.91Å; F2199-Y2228 HydrophobicContact CD1-CD2 3.91Å; F2199-Y2228 HydrophobicContact CD1-CE2 4.34Å; F2199-Y2228 HydrophobicContact CD1-CG 4.35Å; F2199-Y2228 AromaticContact CE1-CD2 3.54Å; F2199-Y2228 HydrophobicContact CE1-CD2 3.54Å; F2199-Y2228 AromaticContact CE1-CE2 3.52Å; F2199-Y2228 HydrophobicContact CE1-CE2 3.52Å; F2199-Y2228 HydrophobicContact CE1-CG 4.28Å; F2199-Y2228 HydrophobicContact CZ-CD2 4.4Å; F2199-Y2228 HydrophobicContact CZ-CE2 4.03Å; F2199-T2312 HydrophobicContact CE2-CG2 3.76Å; F2199-T2312 HydrophobicContact CZ-CG2 4.16Å
2200	W	97.2	Very high	95.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.6	-30.8	177.7	-73.2	109.3	0	0	0	112.9	V2196 E2197 I2203 W2204 Y2228 W2229 Y2237 Y2240 V2242 L2260 L2271	V2196-W2200 VanDerWaalsContact O-CD1 3.27Å; V2196-W2200 PolarHBondContact O-N 3.27Å; E2197-W2200 PolarHBondContact O-N 2.94Å; W2200-I2203 HydrophobicContact CE3-CG2 4.22Å; W2200-W2204 PolarHBondContact O-N 3Å; W2200-Y2228 AromaticContact CZ2-CD2 3.91Å; W2200-Y2228 HydrophobicContact CZ2-CD2 3.91Å; W2200-Y2228 HydrophobicContact CZ2-CE2 4.47Å; W2200-Y2228 WeakPolarHBondContact CZ2-O 3.27Å; W2200-Y2228 PolarHBondContact NE1-O 3.44Å; W2200-W2229 HydrophobicContact CZ2-CB 4.29Å; W2200-Y2237 AromaticContact CD1-CD2 3.3Å; W2200-Y2237 AromaticContact CD1-CE2 3.9Å; W2200-Y2237 AromaticContact CD1-CG 3.65Å; W2200-Y2237 HydrophobicContact CG-CD2 4.04Å; W2200-Y2237 AromaticContact NE1-CD2 3.37Å; W2200-Y2237 AromaticContact NE1-CE2 3.46Å; W2200-Y2240 HydrophobicContact CB-CD2 4.31Å; W2200-V2242 HydrophobicContact CD2-CG2 3.78Å; W2200-V2242 HydrophobicContact CE3-CG2 3.94Å; W2200-V2242 HydrophobicContact CG-CG2 4.39Å; W2200-V2242 HydrophobicContact CH2-CG1 3.74Å; W2200-V2242 HydrophobicContact CH2-CG2 3.94Å; W2200-V2242 HydrophobicContact CZ2-CB 4.48Å; W2200-V2242 HydrophobicContact CZ2-CG1 3.94Å; W2200-V2242 HydrophobicContact CZ2-CG2 3.78Å; W2200-V2242 HydrophobicContact CZ3-CG1 4.33Å; W2200-V2242 HydrophobicContact CZ3-CG2 4.01Å; W2200-L2260 HydrophobicContact CD2-CD1 4.4Å; W2200-L2260 HydrophobicContact CE3-CD1 3.58Å; W2200-L2260 HydrophobicContact CE3-CD2 4.07Å; W2200-L2260 HydrophobicContact CE3-CG 4.45Å; W2200-L2260 HydrophobicContact CZ3-CD1 3.96Å; W2200-L2260 HydrophobicContact CZ3-CD2 4.29Å; W2200-L2271 HydrophobicContact CH2-CD2 4.29Å; W2200-L2271 HydrophobicContact CZ3-CD1 4.03Å; W2200-L2271 HydrophobicContact CZ3-CD2 4.21Å
2201	R	95.3	Very high	95.6	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.015	14%	0.139	C	C	.	.	H	α-helix	trans	-65	-47.8	171.5	-174.5	158.1	55.3	103.7	2	112.3	Q2160 S2168 E2197 D2198 F2199 I2203 W2204 E2205 Y2240	Q2160-R2201 PolarHBondContact O-NH1 3.21Å; S2168-R2201 VanDerWaalsContact O-CZ 3.29Å; S2168-R2201 PolarHBondContact O-NH1 3.17Å; S2168-R2201 PolarHBondContact O-NH2 2.8Å; E2197-R2201 VanDerWaalsContact O-CB 3.22Å; E2197-R2201 WeakPolarHBondContact O-CB 3.46Å; E2197-R2201 PolarHBondContact O-N 3.07Å; D2198-R2201 IonicContact OD1-CZ 2.94Å; D2198-R2201 IonicContact OD1-NE 2.79Å; D2198-R2201 IonicContact OD1-NH2 3.34Å; D2198-R2201 PolarHBondContact OD1-NH2 2.92Å; F2199-R2201 PolarHBondContact O-N 3.28Å; R2201-I2203 VanDerWaalsContact C-N 3.33Å; R2201-I2203 PolarHBondContact O-N 2.92Å; R2201-W2204 PolarHBondContact O-N 3.05Å; R2201-E2205 WeakPolarHBondContact CD-OE1 3.24Å; R2201-E2205 HydrophobicContact CG-CG 4.26Å; R2201-E2205 WeakPolarHBondContact CG-OE1 3.12Å; R2201-E2205 WeakPolarHBondContact O-CB 3.25Å; R2201-E2205 WeakPolarHBondContact O-CG 3.32Å; R2201-E2205 PolarHBondContact O-N 3.47Å; R2201-Y2240 HydrophobicContact CB-CE2 3.74Å; R2201-Y2240 HydrophobicContact CG-CE2 4.09Å
2202	M	97.6	Very high	95.7	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-54	-48.8	173.1	-175.5	-177.6	75.1	0	0	112.2	V2157 L2159 I2171 A2173 I2186 T2188 D2198 F2199 W2204 L2206 T2312	V2157-M2202 HydrophobicContact CB-SD 4.42Å; V2157-M2202 HydrophobicContact CG1-CG 3.79Å; V2157-M2202 HydrophobicContact CG1-SD 3.94Å; V2157-M2202 HydrophobicContact CG2-SD 4.44Å; L2159-M2202 HydrophobicContact CD2-CB 3.6Å; L2159-M2202 HydrophobicContact CD2-CG 3.94Å; I2171-M2202 HydrophobicContact CD1-CB 4.37Å; I2171-M2202 HydrophobicContact CD1-CE 4.5Å; I2171-M2202 HydrophobicContact CD1-SD 4Å; I2171-M2202 HydrophobicContact CG2-SD 3.89Å; A2173-M2202 HydrophobicContact CB-SD 3.85Å; I2186-M2202 HydrophobicContact CG2-CE 3.97Å; I2186-M2202 HydrophobicContact CG2-SD 3.92Å; T2188-M2202 HydrophobicContact CG2-CE 4.3Å; D2198-M2202 WeakPolarHBondContact O-CB 3.47Å; D2198-M2202 PolarHBondContact O-N 3.11Å; F2199-M2202 HydrophobicContact CD2-CE 4Å; F2199-M2202 HydrophobicContact CE2-CE 4.1Å; F2199-M2202 WeakPolarHBondContact O-CB 3.39Å; F2199-M2202 PolarHBondContact O-N 3.08Å; M2202-W2204 VanDerWaalsContact C-N 3.34Å; M2202-W2204 PolarHBondContact O-N 3.03Å; M2202-L2206 HydrophobicContact CG-CD1 4.03Å; M2202-L2206 WeakPolarHBondContact O-CB 3.36Å; M2202-L2206 PolarHBondContact O-N 3.35Å; M2202-L2206 VanDerWaalsContact O-N 3.08Å; M2202-T2312 HydrophobicContact CE-CG2 3.66Å
2203	I	97.1	Very high	95.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-57.2	-46.3	178.9	-73	-62.8	0	0	0	111.4	F2199 W2200 R2201 N2207 S2208 V2211 L2260 L2271 T2312	F2199-I2203 HydrophobicContact CD1-CG1 4.19Å; F2199-I2203 HydrophobicContact CE1-CD1 4.34Å; F2199-I2203 HydrophobicContact CE1-CG1 3.87Å; F2199-I2203 HydrophobicContact CE2-CG1 4.49Å; F2199-I2203 HydrophobicContact CZ-CD1 4.06Å; F2199-I2203 HydrophobicContact CZ-CG1 4.04Å; F2199-I2203 WeakPolarHBondContact O-CB 3.34Å; F2199-I2203 VanDerWaalsContact O-CG1 3.25Å; F2199-I2203 WeakPolarHBondContact O-CG1 3.36Å; F2199-I2203 PolarHBondContact O-N 2.92Å; W2200-I2203 HydrophobicContact CE3-CG2 4.22Å; R2201-I2203 VanDerWaalsContact C-N 3.33Å; R2201-I2203 PolarHBondContact O-N 2.92Å; I2203-N2207 PolarHBondContact O-N 3.2Å; I2203-S2208 PolarHBondContact O-N 2.93Å; I2203-V2211 HydrophobicContact CD1-CG2 3.59Å; I2203-V2211 HydrophobicContact CG1-CG2 4.46Å; I2203-L2260 HydrophobicContact CG2-CD2 3.66Å; I2203-L2271 HydrophobicContact CG2-CD1 3.19Å; I2203-T2312 HydrophobicContact CD1-CG2 4.06Å; I2203-T2312 WeakPolarHBondContact CD1-OG1 3.37Å
2204	W	95	Very high	95.9	Very high	17 Å²	17	22.2 Å²	22.2	6%	0.064	11%	0.105	C	C	.	.	H	α-helix	trans	-70.4	-48.9	179.9	-175	-98	0	0	0	113.3	W2200 R2201 M2202 L2206 N2207 Y2240 L2260 D2262 Q2267 R2269	W2200-W2204 PolarHBondContact O-N 3Å; R2201-W2204 PolarHBondContact O-N 3.05Å; M2202-W2204 VanDerWaalsContact C-N 3.34Å; M2202-W2204 PolarHBondContact O-N 3.03Å; W2204-L2206 VanDerWaalsContact C-N 3.29Å; W2204-L2206 PolarHBondContact O-N 2.75Å; W2204-N2207 PolarHBondContact O-N 2.63Å; W2204-Y2240 HydrophobicContact CB-CD1 4.04Å; W2204-Y2240 HydrophobicContact CB-CE1 3.54Å; W2204-Y2240 AromaticContact CD1-CE1 3.5Å; W2204-Y2240 HydrophobicContact CD2-CD1 4.23Å; W2204-Y2240 AromaticContact CD2-CE1 3.91Å; W2204-Y2240 HydrophobicContact CD2-CE1 3.91Å; W2204-Y2240 AromaticContact CG-CD1 4Å; W2204-Y2240 HydrophobicContact CG-CD1 4Å; W2204-Y2240 AromaticContact CG-CE1 3.34Å; W2204-Y2240 HydrophobicContact CG-CE1 3.34Å; W2204-L2260 HydrophobicContact CE3-CD2 3.78Å; W2204-L2260 HydrophobicContact CE3-CG 3.84Å; W2204-L2260 HydrophobicContact CZ3-CD2 4.47Å; W2204-L2260 HydrophobicContact CZ3-CG 4.18Å; W2204-D2262 HydrophobicContact CD2-CB 4.46Å; W2204-D2262 HydrophobicContact CH2-CB 4Å; W2204-D2262 HydrophobicContact CZ2-CB 3.5Å; W2204-D2262 VanDerWaalsContact CZ2-CB 3.5Å; W2204-D2262 PolarHBondContact NE1-OD2 2.98Å; W2204-Q2267 HydrophobicContact CH2-CB 3.82Å; W2204-Q2267 WeakPolarHBondContact CH2-O 3.44Å; W2204-Q2267 HydrophobicContact CZ2-CB 3.89Å; W2204-R2269 HydrophobicContact CH2-CG 4.09Å; W2204-R2269 HydrophobicContact CZ3-CB 4.23Å; W2204-R2269 HydrophobicContact CZ3-CG 3.73Å; W2204-R2269 PolarHBondContact O-NH1 3.07Å
2205	E	94	Very high	96	Very high	60 Å²	60	15.2 Å²	15.2	28%	0.28	8%	0.075	S	C	.	.	H	α-helix	trans	-66.4	-30.5	-174.9	-71.9	176.5	-172.9	0	0	112.4	Q2160 R2201	Q2160-E2205 PolarHBondContact N-OE2 2.65Å; R2201-E2205 WeakPolarHBondContact CD-OE1 3.24Å; R2201-E2205 HydrophobicContact CG-CG 4.26Å; R2201-E2205 WeakPolarHBondContact CG-OE1 3.12Å; R2201-E2205 WeakPolarHBondContact O-CB 3.25Å; R2201-E2205 WeakPolarHBondContact O-CG 3.32Å; R2201-E2205 PolarHBondContact O-N 3.47Å
2206	L	93.9	Very high	95.8	Very high	44 Å²	44	17 Å²	17	23%	0.23	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	6	178.5	-58.1	-177.8	0	0	0	114.4	V2157 F2175 I2186 M2202 W2204 S2208 P2310	V2157-L2206 HydrophobicContact CG1-CD1 3.6Å; V2157-L2206 HydrophobicContact CG2-CD1 4.28Å; F2175-L2206 HydrophobicContact CE1-CD1 3.84Å; F2175-L2206 HydrophobicContact CZ-CD1 3.63Å; F2175-L2206 HydrophobicContact CZ-CD2 3.97Å; F2175-L2206 HydrophobicContact CZ-CG 4.46Å; I2186-L2206 HydrophobicContact CD1-CB 4.3Å; I2186-L2206 HydrophobicContact CD1-CD1 3.53Å; I2186-L2206 HydrophobicContact CG1-CD1 4.39Å; M2202-L2206 HydrophobicContact CG-CD1 4.03Å; M2202-L2206 WeakPolarHBondContact O-CB 3.36Å; M2202-L2206 PolarHBondContact O-N 3.35Å; M2202-L2206 VanDerWaalsContact O-N 3.08Å; W2204-L2206 VanDerWaalsContact C-N 3.29Å; W2204-L2206 PolarHBondContact O-N 2.75Å; L2206-S2208 PolarHBondContact O-N 2.91Å; L2206-P2310 HydrophobicContact CB-CG 4.41Å; L2206-P2310 VanDerWaalsContact O-CD 3.24Å; L2206-P2310 WeakPolarHBondContact O-CD 3.4Å
2207	N	93.5	Very high	95.6	Very high	59 Å²	59	19.2 Å²	19.2	32%	0.316	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	33.9	-177	-162.9	35.3	0	0	0	113.9	I2203 W2204 N2209 R2269	I2203-N2207 PolarHBondContact O-N 3.2Å; W2204-N2207 PolarHBondContact O-N 2.63Å; N2207-N2209 VanDerWaalsContact C-N 3.3Å; N2207-N2209 PolarHBondContact O-N 3.33Å; N2207-N2209 PolarHBondContact OD1-ND2 2.91Å; N2207-R2269 PolarHBondContact OD1-NH1 3.43Å; N2207-R2269 VanDerWaalsContact OD1-NH1 3.15Å
2208	S	94.3	Very high	95.4	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.097	C	C	.	.			trans	-82.9	73.3	-176.5	-169.9	0	0	0	0	110.8	I2203 L2206 I2210 P2310 T2312	I2203-S2208 PolarHBondContact O-N 2.93Å; L2206-S2208 PolarHBondContact O-N 2.91Å; S2208-I2210 PolarHBondContact O-N 2.81Å; S2208-I2210 VanDerWaalsContact O-N 3.11Å; S2208-P2310 WeakPolarHBondContact CA-O 3.33Å; S2208-P2310 WeakPolarHBondContact CB-O 3.5Å; S2208-P2310 PolarHBondContact OG-O 3.11Å; S2208-T2312 WeakPolarHBondContact OG-CB 3.22Å; S2208-T2312 PolarHBondContact OG-N 2.63Å; S2208-T2312 PolarHBondContact OG-OG1 2.92Å
2209	N	93.4	Very high	94.9	Very high	12 Å²	12	18.3 Å²	18.3	6%	0.064	9%	0.094	C	C	.	.			trans	-76.4	7.3	-175	-55	-41.7	0	0	0	113.7	N2207 L2271 R2272 Q2307	N2207-N2209 VanDerWaalsContact C-N 3.3Å; N2207-N2209 PolarHBondContact O-N 3.33Å; N2207-N2209 PolarHBondContact OD1-ND2 2.91Å; N2209-L2271 CarbonylContact O-C 3.59Å; N2209-L2271 WeakPolarHBondContact O-CA 3.41Å; N2209-R2272 PolarHBondContact O-N 2.7Å; N2209-Q2307 VanDerWaalsContact CB-OE1 3.29Å; N2209-Q2307 PolarHBondContact ND2-OE1 3.03Å
2210	I	96.8	Very high	94.2	Very high	5 Å²	5	20.3 Å²	20.3	3%	0.026	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	129.3	169	-56.3	-164.2	0	0	0	111.1	S2208 V2212 R2272 F2274 T2301 K2302 I2311 T2312	S2208-I2210 PolarHBondContact O-N 2.81Å; S2208-I2210 VanDerWaalsContact O-N 3.11Å; I2210-V2212 HydrophobicContact CG2-CG2 4.46Å; I2210-R2272 CarbonylContact C-O 3.51Å; I2210-R2272 VanDerWaalsContact CA-O 3.29Å; I2210-R2272 WeakPolarHBondContact CA-O 3.44Å; I2210-R2272 HydrophobicContact CG1-CB 4.39Å; I2210-F2274 HydrophobicContact CD1-CE2 4.47Å; I2210-F2274 HydrophobicContact CG2-CD2 3.81Å; I2210-F2274 HydrophobicContact CG2-CE2 4.03Å; I2210-T2301 HydrophobicContact CD1-CG2 3.66Å; I2210-K2302 HydrophobicContact CD1-CB 3.27Å; I2210-K2302 HydrophobicContact CD1-CG 4.33Å; I2210-K2302 HydrophobicContact CG1-CB 4.32Å; I2210-I2311 HydrophobicContact CB-CG2 4.37Å; I2210-I2311 HydrophobicContact CG2-CG2 4.02Å; I2210-T2312 PolarHBondContact O-N 3Å
2211	V	97.7	Very high	93.3	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	138	173.6	-179.9	0	0	0	0	109.2	F2199 I2203 Y2228 L2271 R2272 Q2273 F2274 T2312	F2199-V2211 HydrophobicContact CE1-CG2 4.45Å; F2199-V2211 HydrophobicContact CZ-CG1 3.94Å; F2199-V2211 HydrophobicContact CZ-CG2 4.04Å; I2203-V2211 HydrophobicContact CD1-CG2 3.59Å; I2203-V2211 HydrophobicContact CG1-CG2 4.46Å; V2211-Y2228 WeakPolarHBondContact CG1-OH 3.44Å; V2211-L2271 HydrophobicContact CG2-CD1 4.18Å; V2211-L2271 HydrophobicContact CG2-CD2 4.11Å; V2211-R2272 PolarHBondContact N-O 3.18Å; V2211-Q2273 HydrophobicContact CB-CB 4.41Å; V2211-Q2273 HydrophobicContact CB-CG 4.37Å; V2211-Q2273 HydrophobicContact CG1-CG 4.33Å; V2211-Q2273 CarbonylContact O-C 3.54Å; V2211-Q2273 WeakPolarHBondContact O-CA 3.43Å; V2211-F2274 PolarHBondContact O-N 3.38Å; V2211-T2312 CarbonylContact C-O 3.6Å; V2211-T2312 VanDerWaalsContact CA-O 3.31Å; V2211-T2312 WeakPolarHBondContact CA-O 3.49Å
2212	V	98.1	Very high	92.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	118.7	176.5	176.1	0	0	0	0	107.8	I2210 L2214 F2274 F2294 V2298 I2311 T2312 I2313 H2314 F2325	I2210-V2212 HydrophobicContact CG2-CG2 4.46Å; V2212-L2214 HydrophobicContact CG1-CD2 3.63Å; V2212-L2214 HydrophobicContact CG1-CG 3.94Å; V2212-F2274 CarbonylContact C-O 3.58Å; V2212-F2274 WeakPolarHBondContact CA-O 3.42Å; V2212-F2294 HydrophobicContact CG1-CE1 3.8Å; V2212-F2294 HydrophobicContact CG1-CZ 3.92Å; V2212-V2298 HydrophobicContact CG2-CB 4.42Å; V2212-V2298 HydrophobicContact CG2-CG1 3.46Å; V2212-V2298 VanDerWaalsContact CG2-CG1 3.46Å; V2212-V2298 HydrophobicContact CG2-CG2 4.03Å; V2212-I2311 HydrophobicContact CB-CG2 4.44Å; V2212-I2311 HydrophobicContact CG2-CG2 3.44Å; V2212-I2311 VanDerWaalsContact CG2-CG2 3.44Å; V2212-T2312 PolarHBondContact N-O 2.82Å; V2212-I2313 HydrophobicContact CB-CB 4.27Å; V2212-I2313 HydrophobicContact CB-CG1 3.99Å; V2212-I2313 HydrophobicContact CB-CG2 4.14Å; V2212-I2313 HydrophobicContact CG1-CG1 4.45Å; V2212-I2313 HydrophobicContact CG1-CG2 3.98Å; V2212-I2313 HydrophobicContact CG2-CG1 4.29Å; V2212-I2313 CarbonylContact O-C 3.57Å; V2212-I2313 WeakPolarHBondContact O-CA 3.42Å; V2212-H2314 PolarHBondContact O-CD2 2.86Å; V2212-H2314 PolarHBondContact O-N 3.31Å; V2212-F2325 HydrophobicContact CG1-CD2 4.2Å; V2212-F2325 HydrophobicContact CG1-CE2 4.05Å
2213	M	97.9	Very high	92.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	110.3	-178.7	175.8	161.4	166.2	0	0	108.5	T2215 L2217 C2225 Y2228 W2229 F2274 Q2275 F2276 H2314	M2213-T2215 HydrophobicContact CE-CG2 4.38Å; M2213-T2215 WeakPolarHBondContact CE-O 3.38Å; M2213-T2215 HydrophobicContact CG-CG2 4.28Å; M2213-T2215 VanDerWaalsContact CG-O 3.31Å; M2213-T2215 WeakPolarHBondContact CG-O 3.46Å; M2213-L2217 HydrophobicContact CE-CD2 4.1Å; M2213-L2217 HydrophobicContact CE-CG 4.44Å; M2213-C2225 HydrophobicContact CE-CB 3.74Å; M2213-Y2228 HydrophobicContact SD-CE1 4Å; M2213-W2229 HydrophobicContact CE-CH2 3.74Å; M2213-W2229 HydrophobicContact CE-CZ3 4.02Å; M2213-W2229 HydrophobicContact SD-CH2 3.72Å; M2213-W2229 HydrophobicContact SD-CZ3 3.63Å; M2213-F2274 PolarHBondContact N-O 3.39Å; M2213-Q2275 HydrophobicContact CB-CB 4.24Å; M2213-Q2275 HydrophobicContact CB-CG 4.46Å; M2213-Q2275 HydrophobicContact CG-CB 4.43Å; M2213-Q2275 HydrophobicContact CG-CG 4.15Å; M2213-Q2275 CarbonylContact O-C 3.52Å; M2213-Q2275 VanDerWaalsContact O-CA 3.27Å; M2213-Q2275 WeakPolarHBondContact O-CA 3.33Å; M2213-F2276 PolarHBondContact O-N 2.87Å; M2213-H2314 VanDerWaalsContact CG-CE1 3.42Å; M2213-H2314 WeakPolarHBondContact CG-CE1 3.35Å
2214	L	97.2	Very high	92.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.166	C	C	.	.			trans	-102.3	32.7	-175.3	-55	174.8	0	0	0	111.2	V2212 F2276 F2291 F2294 I2313 H2314 C2315 R2321 F2325	V2212-L2214 HydrophobicContact CG1-CD2 3.63Å; V2212-L2214 HydrophobicContact CG1-CG 3.94Å; L2214-F2276 HydrophobicContact CD2-CB 4.05Å; L2214-F2291 HydrophobicContact CD2-CE2 4.13Å; L2214-F2291 HydrophobicContact CD2-CZ 4.5Å; L2214-F2294 HydrophobicContact CD2-CD1 4.45Å; L2214-F2294 HydrophobicContact CD2-CE1 3.65Å; L2214-F2294 HydrophobicContact CD2-CZ 4.28Å; L2214-I2313 HydrophobicContact CD1-CG2 3.68Å; L2214-I2313 HydrophobicContact CG-CG2 4.27Å; L2214-H2314 PolarHBondContact N-O 2.62Å; L2214-C2315 HydrophobicContact CB-CB 4.14Å; L2214-R2321 HydrophobicContact CB-CB 3.92Å; L2214-R2321 HydrophobicContact CD1-CB 4.13Å; L2214-R2321 WeakPolarHBondContact CD1-O 3.3Å; L2214-R2321 WeakPolarHBondContact O-CD 3.15Å; L2214-R2321 PolarHBondContact O-NH1 2.76Å; L2214-F2325 HydrophobicContact CD1-CB 3.79Å; L2214-F2325 HydrophobicContact CD1-CD2 4.46Å; L2214-F2325 HydrophobicContact CD1-CG 4.38Å; L2214-F2325 HydrophobicContact CD2-CD2 4.23Å
2215	T	94.2	Very high	92.1	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.006	16%	0.163	C	C	.	.	S	Bend	trans	-157.9	150.2	-173.9	-168.2	0	0	0	0	108.9	A2190 M2213 E2219 C2224 C2225	A2190-T2215 HydrophobicContact CB-CG2 4.38Å; M2213-T2215 HydrophobicContact CE-CG2 4.38Å; M2213-T2215 WeakPolarHBondContact CE-O 3.38Å; M2213-T2215 HydrophobicContact CG-CG2 4.28Å; M2213-T2215 VanDerWaalsContact CG-O 3.31Å; M2213-T2215 WeakPolarHBondContact CG-O 3.46Å; T2215-E2219 VanDerWaalsContact CA-OE1 3.22Å; T2215-E2219 WeakPolarHBondContact CA-OE1 3.25Å; T2215-E2219 WeakPolarHBondContact CB-OE1 3.02Å; T2215-E2219 PolarHBondContact OG1-OE1 3.18Å; T2215-C2224 HydrophobicContact CG2-CB 4.49Å; T2215-C2224 VanDerWaalsContact OG1-CB 3.26Å; T2215-C2224 WeakPolarHBondContact OG1-CB 3.38Å; T2215-C2225 HydrophobicContact CG2-CB 4.04Å
2216	N	92.1	Very high	92.2	Very high	42 Å²	42	33 Å²	33	23%	0.225	17%	0.166	C	C	.	.			trans	-81.8	166.1	169.2	-67.8	-47.6	0	0	0	110	N2218 E2219 Q2275	N2216-N2218 PolarHBondContact O-N 3.45Å; N2216-E2219 HydrophobicContact CB-CG 4.09Å; N2216-E2219 PolarHBondContact N-OE1 3.22Å; N2216-Q2275 PolarHBondContact OD1-NE2 3.27Å
2217	L	92.8	Very high	92.2	Very high	52 Å²	52	33.8 Å²	33.8	27%	0.272	17%	0.173	S	C	.	.	S	Bend	trans	-57.2	-43.2	178.4	-69.4	172.7	0	0	0	111.1	M2213 C2224 C2225 P2227 W2229	M2213-L2217 HydrophobicContact CE-CD2 4.1Å; M2213-L2217 HydrophobicContact CE-CG 4.44Å; L2217-C2224 PolarHBondContact O-N 2.91Å; L2217-C2225 WeakPolarHBondContact CA-O 3.47Å; L2217-C2225 HydrophobicContact CD2-CB 4.3Å; L2217-C2225 VanDerWaalsContact CD2-O 3.26Å; L2217-C2225 WeakPolarHBondContact CD2-O 3.44Å; L2217-C2225 PolarHBondContact O-N 2.7Å; L2217-P2227 HydrophobicContact CD1-CB 4.25Å; L2217-P2227 HydrophobicContact CD2-CB 3.95Å; L2217-W2229 HydrophobicContact CD1-CH2 4.49Å; L2217-W2229 HydrophobicContact CD2-CH2 3.64Å; L2217-W2229 HydrophobicContact CD2-CZ3 3.92Å; L2217-W2229 HydrophobicContact CG-CH2 4.17Å
2218	N	90.2	Very high	92.2	Very high	87 Å²	87	31 Å²	31	47%	0.465	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	140.4	174.2	-63.2	80.5	0	0	0	110.2	N2216 R2222	N2216-N2218 PolarHBondContact O-N 3.45Å; N2218-R2222 CarbonylContact C-O 3.48Å; N2218-R2222 WeakPolarHBondContact CA-O 3.48Å
2219	E	87	Confident	92.3	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	115.8	172.5	-63.6	-171.9	-148	0	0	110.4	G379 E380 T2215 N2216 G2221 R2222 E2281 R2321	G379-E2219 WeakPolarHBondContact CA-O 3.49Å; G379-E2219 PolarHBondContact N-O 2.96Å; E380-E2219 HydrophobicContact CG-CB 4.37Å; E380-E2219 WeakPolarHBondContact CG-OE2 3.49Å; T2215-E2219 VanDerWaalsContact CA-OE1 3.22Å; T2215-E2219 WeakPolarHBondContact CA-OE1 3.25Å; T2215-E2219 WeakPolarHBondContact CB-OE1 3.02Å; T2215-E2219 PolarHBondContact OG1-OE1 3.18Å; N2216-E2219 HydrophobicContact CB-CG 4.09Å; N2216-E2219 PolarHBondContact N-OE1 3.22Å; E2219-G2221 PolarHBondContact O-N 3.06Å; E2219-R2222 PolarHBondContact N-O 2.77Å; E2219-R2222 PolarHBondContact O-N 3.39Å; E2219-E2281 VanDerWaalsContact CA-OE1 3.24Å; E2219-E2281 WeakPolarHBondContact CA-OE1 3.34Å; E2219-E2281 HydrophobicContact CB-CB 4.3Å; E2219-E2281 HydrophobicContact CB-CG 4.09Å; E2219-E2281 HydrophobicContact CG-CG 4.27Å; E2219-R2321 IonicContact OE1-CZ 2.68Å; E2219-R2321 IonicContact OE1-NH1 3.91Å; E2219-R2321 PolarHBondContact OE1-NH1 2.8Å; E2219-R2321 IonicContact OE1-NH2 3.62Å; E2219-R2321 IonicContact OE2-CZ 3.43Å; E2219-R2321 IonicContact OE2-NH1 3.2Å; E2219-R2321 PolarHBondContact OE2-NH1 2.8Å; E2219-R2321 IonicContact OE2-NH2 3.02Å; E2219-R2321 PolarHBondContact OE2-NH2 3.19Å
2220	R	84	Confident	92.1	Very high	44 Å²	44	31.8 Å²	31.8	17%	0.166	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	44.8	21.7	-155.7	-70.9	175.4	-84.6	165.5	-16	114.1	D375 G377 L378 G379 L381 E2281 H2282	D375-R2220 VanDerWaalsContact O-CD 3.22Å; D375-R2220 WeakPolarHBondContact O-CD 3.26Å; G377-R2220 CarbonylContact C-O 3.57Å; G377-R2220 VanDerWaalsContact CA-O 3.26Å; G377-R2220 WeakPolarHBondContact CA-O 3.4Å; G377-R2220 PolarHBondContact N-O 2.98Å; L378-R2220 PolarHBondContact N-O 3.28Å; G379-R2220 PolarHBondContact O-NH2 2.98Å; L381-R2220 PolarHBondContact O-NH2 2.91Å; R2220-E2281 HydrophobicContact CG-CB 4.49Å; R2220-E2281 VanDerWaalsContact CG-OE2 3.25Å; R2220-E2281 WeakPolarHBondContact CG-OE2 3.31Å; R2220-E2281 PolarHBondContact N-OE1 3.02Å; R2220-E2281 PolarHBondContact NH2-O 2.84Å; R2220-H2282 WeakPolarHBondContact CD-NE2 3.41Å; R2220-H2282 PolarHBondContact NE-NE2 3.11Å; R2220-H2282 PolarHBondContact NH1-CE1 3.32Å; R2220-H2282 PolarHBondContact NH1-NE2 3.44Å; R2220-H2282 PolarHBondContact NH2-CE1 2.63Å; R2220-H2282 PolarHBondContact NH2-ND1 3.49Å; R2220-H2282 PolarHBondContact NH2-NE2 2.83Å
2221	G	77	Confident	91.5	Very high	46 Å²	46	36.3 Å²	36.3	47%	0.474	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.1	1.3	-177.3	0	0	0	0	0	116.5	E2219	E2219-G2221 PolarHBondContact O-N 3.06Å
2222	R	85.9	Confident	90.8	Very high	128 Å²	128	44 Å²	44	48%	0.483	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	132.9	158	-89.8	-177.2	-168.7	129	19.8	107.4	L378 N2218 E2219 C2224	L378-R2222 HydrophobicContact CB-CG 3.72Å; L378-R2222 HydrophobicContact CD2-CB 4.28Å; L378-R2222 HydrophobicContact CD2-CG 3.49Å; L378-R2222 VanDerWaalsContact CD2-CG 3.49Å; L378-R2222 HydrophobicContact CG-CG 4.21Å; L378-R2222 PolarHBondContact O-NH1 3.19Å; L378-R2222 PolarHBondContact O-NH2 3.21Å; L378-R2222 VanDerWaalsContact O-NH2 3.11Å; N2218-R2222 CarbonylContact C-O 3.48Å; N2218-R2222 WeakPolarHBondContact CA-O 3.48Å; E2219-R2222 PolarHBondContact N-O 2.77Å; E2219-R2222 PolarHBondContact O-N 3.39Å; R2222-C2224 PolarHBondContact O-N 3.2Å
2223	E	89.2	Confident	90	Very high	84 Å²	84	52.6 Å²	52.6	39%	0.393	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	105.9	165	-170.4	-146.3	92.4	0	0	107.8	R2145	R2145-E2223 IonicContact CZ-OE1 2.67Å; R2145-E2223 VanDerWaalsContact CZ-OE1 3.32Å; R2145-E2223 PolarHBondContact NH1-O 2.72Å; R2145-E2223 IonicContact NH1-OE1 3.11Å; R2145-E2223 PolarHBondContact NH1-OE1 3.25Å; R2145-E2223 IonicContact NH2-OE1 3.89Å; R2145-E2223 PolarHBondContact NH2-OE1 3.14Å
2224	C	90.7	Very high	89.7	Confident	2 Å²	2	56 Å²	56	1%	0.014	28%	0.281	C	S	.	.	S	Bend	trans	-88.9	-31.6	172.7	-70.5	0	0	0	0	110.3	R2145 A2190 T2215 L2217 R2222 S2316	R2145-C2224 PolarHBondContact NE-O 3.49Å; R2145-C2224 PolarHBondContact NH2-O 3.45Å; A2190-C2224 WeakPolarHBondContact CB-O 3.35Å; T2215-C2224 HydrophobicContact CG2-CB 4.49Å; T2215-C2224 VanDerWaalsContact OG1-CB 3.26Å; T2215-C2224 WeakPolarHBondContact OG1-CB 3.38Å; L2217-C2224 PolarHBondContact O-N 2.91Å; R2222-C2224 PolarHBondContact O-N 3.2Å; C2224-S2316 WeakPolarHBondContact O-CA 3.35Å
2225	C	95.1	Very high	89.4	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.293	C	S	.	.	S	Bend	trans	-144.5	131.1	177.2	-174.5	0	0	0	0	110.7	A2190 M2213 T2215 L2217	A2190-C2225 HydrophobicContact CB-CB 3.79Å; M2213-C2225 HydrophobicContact CE-CB 3.74Å; T2215-C2225 HydrophobicContact CG2-CB 4.04Å; L2217-C2225 WeakPolarHBondContact CA-O 3.47Å; L2217-C2225 HydrophobicContact CD2-CB 4.3Å; L2217-C2225 VanDerWaalsContact CD2-O 3.26Å; L2217-C2225 WeakPolarHBondContact CD2-O 3.44Å; L2217-C2225 PolarHBondContact O-N 2.7Å
2226	Y	95.1	Very high	89.3	Confident	88 Å²	88	64.9 Å²	64.9	35%	0.345	32%	0.32	S	S	.	.			trans	-74.7	140.8	168.2	-176	-90.1	0	0	0	109.5	P2191 A2193 V2196 Y2228	P2191-Y2226 VanDerWaalsContact O-CB 3.23Å; P2191-Y2226 WeakPolarHBondContact O-CB 3.27Å; P2191-Y2226 PolarHBondContact O-N 2.95Å; A2193-Y2226 HydrophobicContact CB-CD2 3.69Å; A2193-Y2226 HydrophobicContact CB-CE2 3.65Å; A2193-Y2226 HydrophobicContact CB-CG 4.17Å; V2196-Y2226 HydrophobicContact CG2-CD1 3.55Å; V2196-Y2226 HydrophobicContact CG2-CE1 3.87Å; Y2226-Y2228 VanDerWaalsContact C-N 3.34Å; Y2226-Y2228 WeakPolarHBondContact O-CD1 3.5Å; Y2226-Y2228 PolarHBondContact O-N 2.67Å
2227	P	93.5	Very high	89.3	Confident	59 Å²	59	64.8 Å²	64.8	38%	0.383	32%	0.317	S	S	.	.			trans	-67.8	89.6	177.3	28	-34.9	0	0	0	111.1	L2217 W2229	L2217-P2227 HydrophobicContact CD1-CB 4.25Å; L2217-P2227 HydrophobicContact CD2-CB 3.95Å; P2227-W2229 PolarHBondContact O-N 3.37Å
2228	Y	95.1	Very high	89.1	Confident	2 Å²	2	64 Å²	64	1%	0.008	31%	0.312	C	S	.	.			trans	-78.2	-3.7	-178.9	58.6	-91.1	0	0	0	113.6	P2191 F2199 W2200 V2211 M2213 Y2226 Y2237 Q2273 H2314	P2191-Y2228 HydrophobicContact CB-CD1 3.98Å; P2191-Y2228 HydrophobicContact CB-CG 4.26Å; P2191-Y2228 HydrophobicContact CG-CD1 3.6Å; P2191-Y2228 HydrophobicContact CG-CE1 4.13Å; P2191-Y2228 HydrophobicContact CG-CG 3.95Å; F2199-Y2228 AromaticContact CD1-CD2 3.91Å; F2199-Y2228 HydrophobicContact CD1-CD2 3.91Å; F2199-Y2228 HydrophobicContact CD1-CE2 4.34Å; F2199-Y2228 HydrophobicContact CD1-CG 4.35Å; F2199-Y2228 AromaticContact CE1-CD2 3.54Å; F2199-Y2228 HydrophobicContact CE1-CD2 3.54Å; F2199-Y2228 AromaticContact CE1-CE2 3.52Å; F2199-Y2228 HydrophobicContact CE1-CE2 3.52Å; F2199-Y2228 HydrophobicContact CE1-CG 4.28Å; F2199-Y2228 HydrophobicContact CZ-CD2 4.4Å; F2199-Y2228 HydrophobicContact CZ-CE2 4.03Å; W2200-Y2228 AromaticContact CZ2-CD2 3.91Å; W2200-Y2228 HydrophobicContact CZ2-CD2 3.91Å; W2200-Y2228 HydrophobicContact CZ2-CE2 4.47Å; W2200-Y2228 WeakPolarHBondContact CZ2-O 3.27Å; W2200-Y2228 PolarHBondContact NE1-O 3.44Å; V2211-Y2228 WeakPolarHBondContact CG1-OH 3.44Å; M2213-Y2228 HydrophobicContact SD-CE1 4Å; Y2226-Y2228 VanDerWaalsContact C-N 3.34Å; Y2226-Y2228 WeakPolarHBondContact O-CD1 3.5Å; Y2226-Y2228 PolarHBondContact O-N 2.67Å; Y2228-Y2237 WeakPolarHBondContact O-CE2 3.48Å; Y2228-Y2237 PolarHBondContact O-OH 2.75Å; Y2228-Q2273 PolarHBondContact OH-NE2 3.4Å; Y2228-H2314 AromaticContact CE1-CE1 3.67Å; Y2228-H2314 AromaticContact CE1-NE2 3.69Å; Y2228-H2314 AromaticContact CZ-NE2 3.6Å; Y2228-H2314 PolarHBondContact OH-NE2 2.87Å
2229	W	94.8	Very high	89.1	Confident	19 Å²	19	64 Å²	64	7%	0.072	31%	0.306	C	S	.	.	S	Bend	trans	-120.3	150.1	-176.7	69.5	95	0	0	0	112.2	W2200 M2213 L2217 P2227 F2258	W2200-W2229 HydrophobicContact CZ2-CB 4.29Å; M2213-W2229 HydrophobicContact CE-CH2 3.74Å; M2213-W2229 HydrophobicContact CE-CZ3 4.02Å; M2213-W2229 HydrophobicContact SD-CH2 3.72Å; M2213-W2229 HydrophobicContact SD-CZ3 3.63Å; L2217-W2229 HydrophobicContact CD1-CH2 4.49Å; L2217-W2229 HydrophobicContact CD2-CH2 3.64Å; L2217-W2229 HydrophobicContact CD2-CZ3 3.92Å; L2217-W2229 HydrophobicContact CG-CH2 4.17Å; P2227-W2229 PolarHBondContact O-N 3.37Å; W2229-F2258 HydrophobicContact CB-CE1 3.84Å; W2229-F2258 HydrophobicContact CB-CE2 4.31Å; W2229-F2258 HydrophobicContact CB-CZ 3.55Å; W2229-F2258 AromaticContact CD1-CE1 3.97Å; W2229-F2258 AromaticContact CD1-CZ 3.56Å; W2229-F2258 HydrophobicContact CG-CE1 4.25Å; W2229-F2258 AromaticContact CG-CZ 3.71Å; W2229-F2258 HydrophobicContact CG-CZ 3.71Å
2230	P	89.3	Confident	89.5	Confident	8 Å²	8	64 Å²	64	5%	0.052	31%	0.306	C	S	.	.			trans	-76.3	145.8	169.7	28.3	-30.1	0	0	0	112.2	R2233 V2242 P2244 F2258	P2230-R2233 WeakPolarHBondContact CB-O 3.49Å; P2230-V2242 HydrophobicContact CG-CB 4Å; P2230-V2242 HydrophobicContact CG-CG1 3.78Å; P2230-V2242 WeakPolarHBondContact CG-O 3.45Å; P2230-P2244 HydrophobicContact CB-CG 4.48Å; P2230-P2244 HydrophobicContact CG-CG 4.45Å; P2230-F2258 HydrophobicContact CG-CE1 4.49Å
2231	T	84.9	Confident	90	Very high	101 Å²	101	63.5 Å²	63.5	62%	0.62	31%	0.308	S	S	*	.	S	Bend	trans	-93.9	-56.8	171	46.9	0	0	0	0	111.8
2232	E	81.8	Confident	90.9	Very high	160 Å²	160	61.3 Å²	61.3	75%	0.748	29%	0.285	S	S	*	.	S	Bend	trans	-101.1	-32	-169.5	-63.1	173.3	171.3	0	0	114.7
2233	R	83.1	Confident	91.2	Very high	181 Å²	181	56.6 Å²	56.6	68%	0.683	27%	0.27	S	S	*	.	S	Bend	trans	-142.9	142.6	-165.9	62.3	177.7	178.5	-107.4	2.2	112.7	P2230 S2235	P2230-R2233 WeakPolarHBondContact CB-O 3.49Å; R2233-S2235 PolarHBondContact O-N 3.06Å; R2233-S2235 PolarHBondContact O-OG 3.08Å
2234	S	90.3	Very high	91.4	Very high	72 Å²	72	54.6 Å²	54.6	50%	0.503	26%	0.264	S	S	.	.			trans	-46.1	125.9	176.4	-56.5	0	0	0	0	111.9	V2242 D2243	S2234-V2242 VanDerWaalsContact CA-O 3.3Å; S2234-V2242 WeakPolarHBondContact CA-O 3.35Å; S2234-D2243 WeakPolarHBondContact CB-OD1 3.46Å; S2234-D2243 PolarHBondContact OG-OD1 3.34Å
2235	S	90.5	Very high	91.4	Very high	34 Å²	34	59.1 Å²	59.1	24%	0.238	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	141	-179.9	-70.5	0	0	0	0	110.4	R2233 V2242	R2233-S2235 PolarHBondContact O-N 3.06Å; R2233-S2235 PolarHBondContact O-OG 3.08Å; S2235-V2242 PolarHBondContact N-O 3.32Å; S2235-V2242 PolarHBondContact O-N 2.94Å
2236	R	93.2	Very high	91.1	Very high	154 Å²	154	62 Å²	62	58%	0.581	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.7	124.3	-175.3	-178.3	176.6	169.6	161.2	0.6	110.8	Q2238 Y2240 V2241	R2236-Q2238 PolarHBondContact NE-O 2.8Å; R2236-Q2238 PolarHBondContact NH2-O 3.34Å; R2236-Q2238 VanDerWaalsContact NH2-O 3.07Å; R2236-Y2240 CarbonylContact C-O 3.59Å; R2236-Y2240 WeakPolarHBondContact CA-O 3.39Å; R2236-V2241 HydrophobicContact CB-CG2 4.28Å; R2236-V2241 HydrophobicContact CG-CG2 4.13Å
2237	Y	91.4	Very high	90.9	Very high	39 Å²	39	61.9 Å²	61.9	15%	0.153	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	108.1	175.2	-50.7	-72.5	0	0	0	107.4	V2196 W2200 Y2228 Y2239 Y2240 V2242	V2196-Y2237 HydrophobicContact CB-CD1 4.49Å; V2196-Y2237 HydrophobicContact CG1-CD1 3.46Å; V2196-Y2237 VanDerWaalsContact CG1-CD1 3.46Å; V2196-Y2237 HydrophobicContact CG1-CD2 4.5Å; V2196-Y2237 HydrophobicContact CG1-CE1 3.59Å; V2196-Y2237 HydrophobicContact CG1-CG 3.94Å; W2200-Y2237 AromaticContact CD1-CD2 3.3Å; W2200-Y2237 AromaticContact CD1-CE2 3.9Å; W2200-Y2237 AromaticContact CD1-CG 3.65Å; W2200-Y2237 HydrophobicContact CG-CD2 4.04Å; W2200-Y2237 AromaticContact NE1-CD2 3.37Å; W2200-Y2237 AromaticContact NE1-CE2 3.46Å; Y2228-Y2237 WeakPolarHBondContact O-CE2 3.48Å; Y2228-Y2237 PolarHBondContact O-OH 2.75Å; Y2237-Y2239 PolarHBondContact O-N 3.03Å; Y2237-Y2240 PolarHBondContact N-O 2.83Å; Y2237-Y2240 PolarHBondContact O-N 3.37Å; Y2237-V2242 HydrophobicContact CD2-CG2 3.7Å; Y2237-V2242 HydrophobicContact CE2-CB 4.24Å; Y2237-V2242 HydrophobicContact CE2-CG2 3.76Å
2238	Q	89.7	Confident	90.7	Very high	36 Å²	36	64.3 Å²	64.3	17%	0.168	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	-98.5	-171.4	-163.8	-170.4	44.9	0	0	114.2	E2197 R2236	E2197-Q2238 HydrophobicContact CB-CB 4.19Å; E2197-Q2238 HydrophobicContact CG-CB 4.32Å; E2197-Q2238 WeakPolarHBondContact OE1-CA 3.23Å; E2197-Q2238 PolarHBondContact OE1-N 2.7Å; R2236-Q2238 PolarHBondContact NE-O 2.8Å; R2236-Q2238 PolarHBondContact NH2-O 3.34Å; R2236-Q2238 VanDerWaalsContact NH2-O 3.07Å
2239	Y	89.4	Confident	90.5	Very high	86 Å²	86	69.6 Å²	69.6	34%	0.337	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-15.6	177.2	-57.4	-64.4	0	0	0	112.9	Y2237 A2263 R2264	Y2237-Y2239 PolarHBondContact O-N 3.03Å; Y2239-A2263 WeakPolarHBondContact O-CB 3.49Å; Y2239-A2263 PolarHBondContact O-N 2.97Å; Y2239-R2264 HydrophobicContact CD1-CG 3.61Å; Y2239-R2264 HydrophobicContact CE1-CG 4.28Å; Y2239-R2264 HydrophobicContact CG-CG 3.92Å
2240	Y	94.8	Very high	90.2	Very high	0 Å²	0	72.6 Å²	72.6	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	117.4	-166.4	-53	-70.3	0	0	0	110.6	W2200 R2201 W2204 R2236 Y2237 T2261 D2262 R2264	W2200-Y2240 HydrophobicContact CB-CD2 4.31Å; R2201-Y2240 HydrophobicContact CB-CE2 3.74Å; R2201-Y2240 HydrophobicContact CG-CE2 4.09Å; W2204-Y2240 HydrophobicContact CB-CD1 4.04Å; W2204-Y2240 HydrophobicContact CB-CE1 3.54Å; W2204-Y2240 AromaticContact CD1-CE1 3.5Å; W2204-Y2240 HydrophobicContact CD2-CD1 4.23Å; W2204-Y2240 AromaticContact CD2-CE1 3.91Å; W2204-Y2240 HydrophobicContact CD2-CE1 3.91Å; W2204-Y2240 AromaticContact CG-CD1 4Å; W2204-Y2240 HydrophobicContact CG-CD1 4Å; W2204-Y2240 AromaticContact CG-CE1 3.34Å; W2204-Y2240 HydrophobicContact CG-CE1 3.34Å; R2236-Y2240 CarbonylContact C-O 3.59Å; R2236-Y2240 WeakPolarHBondContact CA-O 3.39Å; Y2237-Y2240 PolarHBondContact N-O 2.83Å; Y2237-Y2240 PolarHBondContact O-N 3.37Å; Y2240-T2261 WeakPolarHBondContact CA-O 3.22Å; Y2240-D2262 HydrophobicContact CD1-CB 4.37Å; Y2240-D2262 HydrophobicContact CE1-CB 4.32Å; Y2240-R2264 PolarHBondContact OH-NH2 3.19Å; Y2240-R2264 VanDerWaalsContact OH-NH2 3.13Å
2241	V	94.8	Very high	89.9	Confident	34 Å²	34	77.6 Å²	77.6	21%	0.206	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	122.6	170.7	-176.6	0	0	0	0	107.8	R2236 T2261 A2263	R2236-V2241 HydrophobicContact CB-CG2 4.28Å; R2236-V2241 HydrophobicContact CG-CG2 4.13Å; V2241-T2261 PolarHBondContact N-O 3.22Å; V2241-T2261 PolarHBondContact O-N 3.37Å; V2241-A2263 HydrophobicContact CG2-CB 4.36Å
2242	V	96.2	Very high	90.1	Very high	0 Å²	0	74.7 Å²	74.7	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	110.1	176	-173.2	0	0	0	0	106.9	W2200 P2230 S2234 S2235 Y2237 F2258 L2260	W2200-V2242 HydrophobicContact CD2-CG2 3.78Å; W2200-V2242 HydrophobicContact CE3-CG2 3.94Å; W2200-V2242 HydrophobicContact CG-CG2 4.39Å; W2200-V2242 HydrophobicContact CH2-CG1 3.74Å; W2200-V2242 HydrophobicContact CH2-CG2 3.94Å; W2200-V2242 HydrophobicContact CZ2-CB 4.48Å; W2200-V2242 HydrophobicContact CZ2-CG1 3.94Å; W2200-V2242 HydrophobicContact CZ2-CG2 3.78Å; W2200-V2242 HydrophobicContact CZ3-CG1 4.33Å; W2200-V2242 HydrophobicContact CZ3-CG2 4.01Å; P2230-V2242 HydrophobicContact CG-CB 4Å; P2230-V2242 HydrophobicContact CG-CG1 3.78Å; P2230-V2242 WeakPolarHBondContact CG-O 3.45Å; S2234-V2242 VanDerWaalsContact CA-O 3.3Å; S2234-V2242 WeakPolarHBondContact CA-O 3.35Å; S2235-V2242 PolarHBondContact N-O 3.32Å; S2235-V2242 PolarHBondContact O-N 2.94Å; Y2237-V2242 HydrophobicContact CD2-CG2 3.7Å; Y2237-V2242 HydrophobicContact CE2-CB 4.24Å; Y2237-V2242 HydrophobicContact CE2-CG2 3.76Å; V2242-F2258 HydrophobicContact CG1-CB 3.88Å; V2242-F2258 HydrophobicContact CG1-CD1 3.6Å; V2242-F2258 HydrophobicContact CG1-CE1 4.41Å; V2242-F2258 HydrophobicContact CG1-CG 3.88Å; V2242-L2260 HydrophobicContact CG2-CD1 3.87Å
2243	D	93	Very high	90.6	Very high	30 Å²	30	67.6 Å²	67.6	16%	0.16	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	123.6	170.7	-50.9	-48	0	0	0	108.4	S2234 F2258 K2259	S2234-D2243 WeakPolarHBondContact CB-OD1 3.46Å; S2234-D2243 PolarHBondContact OG-OD1 3.34Å; D2243-F2258 CarbonylContact O-C 3.53Å; D2243-F2258 VanDerWaalsContact O-CA 3.28Å; D2243-F2258 WeakPolarHBondContact O-CA 3.44Å; D2243-K2259 HydrophobicContact CB-CB 4.16Å; D2243-K2259 PolarHBondContact N-O 2.86Å; D2243-K2259 PolarHBondContact O-N 3.41Å; D2243-K2259 IonicContact OD2-NZ 3.44Å; D2243-K2259 PolarHBondContact OD2-NZ 2.79Å
2244	P	93	Very high	91.1	Very high	41 Å²	41	59.3 Å²	59.3	27%	0.266	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	131.5	169	28.9	-30.9	0	0	0	109.5	P2230 F2258	P2230-P2244 HydrophobicContact CB-CG 4.48Å; P2230-P2244 HydrophobicContact CG-CG 4.45Å; P2244-F2258 HydrophobicContact CB-CD1 4.38Å; P2244-F2258 HydrophobicContact CB-CE1 4.4Å
2245	M	90.1	Very high	91.4	Very high	97 Å²	97	57 Å²	57	48%	0.478	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	-57.6	179.2	-64.6	-179.9	62.7	0	0	112	E2257 K2259 T2270	M2245-E2257 HydrophobicContact CB-CB 4.19Å; M2245-E2257 WeakPolarHBondContact CB-O 3.44Å; M2245-E2257 PolarHBondContact N-O 2.97Å; M2245-K2259 HydrophobicContact CG-CB 3.97Å; M2245-K2259 HydrophobicContact SD-CB 3.63Å; M2245-T2270 HydrophobicContact SD-CG2 4.39Å
2246	V	88.6	Confident	91.6	Very high	60 Å²	60	56.5 Å²	56.5	36%	0.364	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	146	-176.4	-163.6	0	0	0	0	109.9	Y2248 R2256 E2257	V2246-Y2248 HydrophobicContact CB-CD2 4.42Å; V2246-Y2248 HydrophobicContact CB-CE2 3.83Å; V2246-Y2248 HydrophobicContact CG1-CD1 4.36Å; V2246-Y2248 HydrophobicContact CG1-CD2 4.01Å; V2246-Y2248 HydrophobicContact CG1-CE1 3.91Å; V2246-Y2248 HydrophobicContact CG1-CE2 3.53Å; V2246-Y2248 HydrophobicContact CG1-CG 4.41Å; V2246-Y2248 VanDerWaalsContact CG1-CZ 3.48Å; V2246-R2256 WeakPolarHBondContact O-CA 3.15Å; V2246-E2257 HydrophobicContact CB-CB 4.49Å; V2246-E2257 PolarHBondContact N-O 2.95Å; V2246-E2257 PolarHBondContact O-N 3.4Å
2247	E	91.9	Very high	91.7	Very high	87 Å²	87	50.3 Å²	50.3	41%	0.407	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	120.7	169	178.9	158.4	163.3	0	0	109.6	T2254 R2256	E2247-T2254 HydrophobicContact CG-CG2 3.61Å; E2247-T2254 WeakPolarHBondContact OE1-CG2 3.36Å; E2247-R2256 HydrophobicContact CB-CG 4.35Å; E2247-R2256 HydrophobicContact CG-CG 3.97Å; E2247-R2256 IonicContact OE1-CZ 3.42Å; E2247-R2256 IonicContact OE1-NE 2.78Å; E2247-R2256 PolarHBondContact OE1-NE 2.97Å; E2247-R2256 IonicContact OE1-NH2 3.35Å; E2247-R2256 PolarHBondContact OE1-NH2 3.16Å; E2247-R2256 VanDerWaalsContact OE2-CD 3.32Å; E2247-R2256 WeakPolarHBondContact OE2-CD 3.34Å; E2247-R2256 IonicContact OE2-CZ 2.93Å; E2247-R2256 IonicContact OE2-NE 2.65Å; E2247-R2256 PolarHBondContact OE2-NE 3.34Å; E2247-R2256 IonicContact OE2-NH2 3.55Å
2248	Y	89.8	Confident	91.9	Very high	110 Å²	110	48.6 Å²	48.6	43%	0.431	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	117.7	177.4	-59	-83.4	0	0	0	109	V2246 T2254 L2255 E2257	V2246-Y2248 HydrophobicContact CB-CD2 4.42Å; V2246-Y2248 HydrophobicContact CB-CE2 3.83Å; V2246-Y2248 HydrophobicContact CG1-CD1 4.36Å; V2246-Y2248 HydrophobicContact CG1-CD2 4.01Å; V2246-Y2248 HydrophobicContact CG1-CE1 3.91Å; V2246-Y2248 HydrophobicContact CG1-CE2 3.53Å; V2246-Y2248 HydrophobicContact CG1-CG 4.41Å; V2246-Y2248 VanDerWaalsContact CG1-CZ 3.48Å; Y2248-T2254 CarbonylContact O-C 3.58Å; Y2248-T2254 WeakPolarHBondContact O-CA 3.28Å; Y2248-L2255 HydrophobicContact CD2-CD2 4.26Å; Y2248-L2255 HydrophobicContact CD2-CG 4.2Å; Y2248-L2255 PolarHBondContact N-O 3.29Å; Y2248-L2255 PolarHBondContact O-N 2.98Å; Y2248-E2257 HydrophobicContact CE2-CG 4.28Å
2249	N	89	Confident	92.1	Very high	112 Å²	112	50.8 Å²	50.8	60%	0.599	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	106.4	173	-72.6	-65.6	0	0	0	109.1	T2254	N2249-T2254 WeakPolarHBondContact OD1-CB 3.41Å; N2249-T2254 WeakPolarHBondContact OD1-CG2 3.17Å; N2249-T2254 PolarHBondContact OD1-OG1 2.67Å
2250	M	90.1	Very high	92.4	Very high	83 Å²	83	46.7 Å²	46.7	41%	0.409	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	162	172.8	-55.3	-65.3	-71.2	0	0	108.6	N2252 Y2253	M2250-N2252 PolarHBondContact O-N 3.35Å; M2250-N2252 VanDerWaalsContact O-N 3.08Å; M2250-Y2253 CarbonylContact C-O 2.95Å; M2250-Y2253 WeakPolarHBondContact CA-O 3.34Å; M2250-Y2253 HydrophobicContact CB-CD1 3.95Å; M2250-Y2253 HydrophobicContact CB-CD2 4.14Å; M2250-Y2253 HydrophobicContact CB-CE1 3.73Å; M2250-Y2253 HydrophobicContact CB-CE2 3.92Å; M2250-Y2253 HydrophobicContact CB-CG 4.15Å; M2250-Y2253 VanDerWaalsContact CB-O 3.26Å; M2250-Y2253 WeakPolarHBondContact CB-O 3.28Å; M2250-Y2253 HydrophobicContact CG-CD2 4.2Å; M2250-Y2253 HydrophobicContact CG-CE1 4.14Å; M2250-Y2253 HydrophobicContact CG-CE2 3.61Å; M2250-Y2253 PolarHBondContact N-O 2.95Å; M2250-Y2253 PolarHBondContact O-N 3.48Å
2251	P	81.8	Confident	92.4	Very high	113 Å²	113	47.7 Å²	47.7	73%	0.734	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-38.5	-169.6	-30.5	37.4	0	0	0	114.9
2252	N	89.1	Confident	92.3	Very high	40 Å²	40	46.3 Å²	46.3	21%	0.214	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.6	2.6	-172.7	-42.6	-16.4	0	0	0	113.2	M2250 F2276 T2277 D2278 A2290	M2250-N2252 PolarHBondContact O-N 3.35Å; M2250-N2252 VanDerWaalsContact O-N 3.08Å; N2252-F2276 HydrophobicContact CB-CE2 4.06Å; N2252-F2276 WeakPolarHBondContact O-CD2 3.31Å; N2252-T2277 PolarHBondContact O-N 3.13Å; N2252-T2277 VanDerWaalsContact O-N 3.11Å; N2252-T2277 PolarHBondContact O-OG1 2.98Å; N2252-T2277 VanDerWaalsContact O-OG1 3.06Å; N2252-D2278 VanDerWaalsContact CA-CG 3.47Å; N2252-D2278 WeakPolarHBondContact CA-OD1 3.07Å; N2252-D2278 WeakPolarHBondContact CA-OD2 3.16Å; N2252-D2278 HydrophobicContact CB-CB 4.22Å; N2252-D2278 WeakPolarHBondContact CB-OD2 3.24Å; N2252-D2278 PolarHBondContact OD1-OD2 2.79Å; N2252-A2290 WeakPolarHBondContact ND2-CA 3.4Å; N2252-A2290 VanDerWaalsContact ND2-CB 3.29Å; N2252-A2290 WeakPolarHBondContact ND2-CB 3.47Å
2253	Y	93.2	Very high	92	Very high	11 Å²	11	48.7 Å²	48.7	4%	0.043	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	149.5	-177.2	67.8	-87.6	0	0	0	113.6	M2250 L2255 F2274 Q2275 T2277 F2294 Q2297	M2250-Y2253 CarbonylContact C-O 2.95Å; M2250-Y2253 WeakPolarHBondContact CA-O 3.34Å; M2250-Y2253 HydrophobicContact CB-CD1 3.95Å; M2250-Y2253 HydrophobicContact CB-CD2 4.14Å; M2250-Y2253 HydrophobicContact CB-CE1 3.73Å; M2250-Y2253 HydrophobicContact CB-CE2 3.92Å; M2250-Y2253 HydrophobicContact CB-CG 4.15Å; M2250-Y2253 VanDerWaalsContact CB-O 3.26Å; M2250-Y2253 WeakPolarHBondContact CB-O 3.28Å; M2250-Y2253 HydrophobicContact CG-CD2 4.2Å; M2250-Y2253 HydrophobicContact CG-CE1 4.14Å; M2250-Y2253 HydrophobicContact CG-CE2 3.61Å; M2250-Y2253 PolarHBondContact N-O 2.95Å; M2250-Y2253 PolarHBondContact O-N 3.48Å; Y2253-L2255 HydrophobicContact CD2-CB 4.46Å; Y2253-L2255 HydrophobicContact CE2-CB 4.21Å; Y2253-F2274 AromaticContact CD2-CD1 3.9Å; Y2253-F2274 HydrophobicContact CD2-CD1 3.9Å; Y2253-F2274 AromaticContact CE2-CD1 3.73Å; Y2253-F2274 HydrophobicContact CE2-CD1 3.73Å; Y2253-F2274 AromaticContact CE2-CE1 3.88Å; Y2253-F2274 HydrophobicContact CE2-CE1 3.88Å; Y2253-Q2275 CarbonylContact C-O 2.77Å; Y2253-Q2275 WeakPolarHBondContact CA-O 3.26Å; Y2253-Q2275 VanDerWaalsContact CB-O 3.22Å; Y2253-Q2275 WeakPolarHBondContact CB-O 3.31Å; Y2253-T2277 PolarHBondContact N-OG1 3.35Å; Y2253-F2294 AromaticContact CD1-CD2 3.77Å; Y2253-F2294 HydrophobicContact CD1-CD2 3.77Å; Y2253-F2294 HydrophobicContact CD1-CE2 4.45Å; Y2253-F2294 HydrophobicContact CD2-CD2 4.3Å; Y2253-F2294 HydrophobicContact CD2-CE2 4.23Å; Y2253-F2294 HydrophobicContact CE1-CD2 4.47Å; Y2253-F2294 AromaticContact CG-CD2 3.67Å; Y2253-F2294 HydrophobicContact CG-CD2 3.67Å; Y2253-F2294 AromaticContact CG-CE2 3.89Å; Y2253-F2294 HydrophobicContact CG-CE2 3.89Å; Y2253-Q2297 HydrophobicContact CE1-CB 4.39Å; Y2253-Q2297 HydrophobicContact CE1-CG 4.01Å; Y2253-Q2297 WeakPolarHBondContact OH-CG 3.4Å
2254	T	93.8	Very high	91.8	Very high	7 Å²	7	53.5 Å²	53.5	4%	0.043	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	134.2	165.9	-49.9	0	0	0	0	110.7	E2247 Y2248 N2249 R2256 F2274 Q2275	E2247-T2254 HydrophobicContact CG-CG2 3.61Å; E2247-T2254 WeakPolarHBondContact OE1-CG2 3.36Å; Y2248-T2254 CarbonylContact O-C 3.58Å; Y2248-T2254 WeakPolarHBondContact O-CA 3.28Å; N2249-T2254 WeakPolarHBondContact OD1-CB 3.41Å; N2249-T2254 WeakPolarHBondContact OD1-CG2 3.17Å; N2249-T2254 PolarHBondContact OD1-OG1 2.67Å; T2254-R2256 HydrophobicContact CG2-CG 3.99Å; T2254-F2274 CarbonylContact O-C 3.08Å; T2254-F2274 WeakPolarHBondContact O-CA 3.31Å; T2254-Q2275 PolarHBondContact N-O 3.14Å; T2254-Q2275 PolarHBondContact O-N 2.76Å
2255	L	95.6	Very high	91.5	Very high	24 Å²	24	55.4 Å²	55.4	13%	0.126	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	117.6	167.7	166.5	58.3	0	0	0	109.7	Y2248 Y2253 R2272 Q2273 F2274	Y2248-L2255 HydrophobicContact CD2-CD2 4.26Å; Y2248-L2255 HydrophobicContact CD2-CG 4.2Å; Y2248-L2255 PolarHBondContact N-O 3.29Å; Y2248-L2255 PolarHBondContact O-N 2.98Å; Y2253-L2255 HydrophobicContact CD2-CB 4.46Å; Y2253-L2255 HydrophobicContact CE2-CB 4.21Å; L2255-R2272 HydrophobicContact CD1-CB 3.88Å; L2255-R2272 HydrophobicContact CD1-CG 4.28Å; L2255-Q2273 CarbonylContact C-O 3.37Å; L2255-Q2273 VanDerWaalsContact CA-O 3.3Å; L2255-Q2273 WeakPolarHBondContact CA-O 3.22Å; L2255-F2274 HydrophobicContact CB-CE1 4.4Å; L2255-F2274 HydrophobicContact CD1-CD1 4.32Å; L2255-F2274 HydrophobicContact CD1-CD2 4.04Å; L2255-F2274 HydrophobicContact CD1-CE1 3.99Å; L2255-F2274 HydrophobicContact CD1-CE2 3.69Å; L2255-F2274 HydrophobicContact CD1-CG 4.32Å; L2255-F2274 HydrophobicContact CD1-CZ 3.64Å; L2255-F2274 HydrophobicContact CD2-CE1 4.12Å; L2255-F2274 HydrophobicContact CD2-CZ 4.04Å; L2255-F2274 HydrophobicContact CG-CE1 4.4Å; L2255-F2274 HydrophobicContact CG-CZ 4.37Å
2256	R	96	Very high	91.1	Very high	22 Å²	22	53.4 Å²	53.4	8%	0.083	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	130.6	173.5	-55.2	-173.1	177	79.5	14.6	111.1	V2246 E2247 T2254 F2258 R2272 Q2273	V2246-R2256 WeakPolarHBondContact O-CA 3.15Å; E2247-R2256 HydrophobicContact CB-CG 4.35Å; E2247-R2256 HydrophobicContact CG-CG 3.97Å; E2247-R2256 IonicContact OE1-CZ 3.42Å; E2247-R2256 IonicContact OE1-NE 2.78Å; E2247-R2256 PolarHBondContact OE1-NE 2.97Å; E2247-R2256 IonicContact OE1-NH2 3.35Å; E2247-R2256 PolarHBondContact OE1-NH2 3.16Å; E2247-R2256 VanDerWaalsContact OE2-CD 3.32Å; E2247-R2256 WeakPolarHBondContact OE2-CD 3.34Å; E2247-R2256 IonicContact OE2-CZ 2.93Å; E2247-R2256 IonicContact OE2-NE 2.65Å; E2247-R2256 PolarHBondContact OE2-NE 3.34Å; E2247-R2256 IonicContact OE2-NH2 3.55Å; T2254-R2256 HydrophobicContact CG2-CG 3.99Å; R2256-F2258 HydrophobicContact CB-CD2 4.4Å; R2256-F2258 HydrophobicContact CB-CE1 4.5Å; R2256-F2258 HydrophobicContact CB-CE2 3.52Å; R2256-F2258 HydrophobicContact CB-CZ 3.57Å; R2256-F2258 HydrophobicContact CG-CZ 4.33Å; R2256-R2272 CarbonylContact O-C 3.42Å; R2256-R2272 WeakPolarHBondContact O-CA 3.25Å; R2256-Q2273 HydrophobicContact CB-CB 4.32Å; R2256-Q2273 VanDerWaalsContact CD-OE1 3.28Å; R2256-Q2273 PolarHBondContact N-O 2.7Å; R2256-Q2273 PolarHBondContact O-N 3Å
2257	E	94.4	Very high	91.3	Very high	25 Å²	25	55.5 Å²	55.5	12%	0.117	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	132.1	169.6	-57.2	-147.7	165.7	0	0	110.6	M2245 V2246 Y2248 L2271 R2272	M2245-E2257 HydrophobicContact CB-CB 4.19Å; M2245-E2257 WeakPolarHBondContact CB-O 3.44Å; M2245-E2257 PolarHBondContact N-O 2.97Å; V2246-E2257 HydrophobicContact CB-CB 4.49Å; V2246-E2257 PolarHBondContact N-O 2.95Å; V2246-E2257 PolarHBondContact O-N 3.4Å; Y2248-E2257 HydrophobicContact CE2-CG 4.28Å; E2257-L2271 WeakPolarHBondContact CA-O 3.46Å; E2257-R2272 HydrophobicContact CG-CG 4.27Å; E2257-R2272 IonicContact OE1-CZ 3.48Å; E2257-R2272 IonicContact OE1-NE 2.73Å; E2257-R2272 PolarHBondContact OE1-NE 3.04Å; E2257-R2272 IonicContact OE1-NH2 3.17Å; E2257-R2272 PolarHBondContact OE1-NH2 3.03Å; E2257-R2272 IonicContact OE2-CZ 3.58Å; E2257-R2272 IonicContact OE2-NE 2.82Å; E2257-R2272 IonicContact OE2-NH2 3.71Å; E2257-R2272 PolarHBondContact OE2-NH2 2.72Å
2258	F	95.1	Very high	91.1	Very high	3 Å²	3	53.8 Å²	53.8	1%	0.013	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	145.4	176	-56	-81.6	0	0	0	110.6	W2229 P2230 V2242 D2243 P2244 R2256 T2270 L2271 Q2273	W2229-F2258 HydrophobicContact CB-CE1 3.84Å; W2229-F2258 HydrophobicContact CB-CE2 4.31Å; W2229-F2258 HydrophobicContact CB-CZ 3.55Å; W2229-F2258 AromaticContact CD1-CE1 3.97Å; W2229-F2258 AromaticContact CD1-CZ 3.56Å; W2229-F2258 HydrophobicContact CG-CE1 4.25Å; W2229-F2258 AromaticContact CG-CZ 3.71Å; W2229-F2258 HydrophobicContact CG-CZ 3.71Å; P2230-F2258 HydrophobicContact CG-CE1 4.49Å; V2242-F2258 HydrophobicContact CG1-CB 3.88Å; V2242-F2258 HydrophobicContact CG1-CD1 3.6Å; V2242-F2258 HydrophobicContact CG1-CE1 4.41Å; V2242-F2258 HydrophobicContact CG1-CG 3.88Å; D2243-F2258 CarbonylContact O-C 3.53Å; D2243-F2258 VanDerWaalsContact O-CA 3.28Å; D2243-F2258 WeakPolarHBondContact O-CA 3.44Å; P2244-F2258 HydrophobicContact CB-CD1 4.38Å; P2244-F2258 HydrophobicContact CB-CE1 4.4Å; R2256-F2258 HydrophobicContact CB-CD2 4.4Å; R2256-F2258 HydrophobicContact CB-CE1 4.5Å; R2256-F2258 HydrophobicContact CB-CE2 3.52Å; R2256-F2258 HydrophobicContact CB-CZ 3.57Å; R2256-F2258 HydrophobicContact CG-CZ 4.33Å; F2258-T2270 CarbonylContact O-C 3.53Å; F2258-T2270 WeakPolarHBondContact O-CA 3.26Å; F2258-L2271 HydrophobicContact CD2-CD2 3.82Å; F2258-L2271 PolarHBondContact N-O 2.83Å; F2258-L2271 PolarHBondContact O-N 2.86Å; F2258-Q2273 HydrophobicContact CE2-CB 3.88Å
2259	K	94.3	Very high	91.3	Very high	82 Å²	82	51.5 Å²	51.5	36%	0.357	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	105.7	162.4	165.7	175.2	163.1	-82.8	0	108	D2243 M2245 T2261 A2268	D2243-K2259 HydrophobicContact CB-CB 4.16Å; D2243-K2259 PolarHBondContact N-O 2.86Å; D2243-K2259 PolarHBondContact O-N 3.41Å; D2243-K2259 IonicContact OD2-NZ 3.44Å; D2243-K2259 PolarHBondContact OD2-NZ 2.79Å; M2245-K2259 HydrophobicContact CG-CB 3.97Å; M2245-K2259 HydrophobicContact SD-CB 3.63Å; K2259-T2261 WeakPolarHBondContact CE-OG1 3.25Å; K2259-T2261 PolarHBondContact NZ-OG1 3.35Å; K2259-T2261 VanDerWaalsContact NZ-OG1 3.14Å; K2259-A2268 HydrophobicContact CD-CB 4.45Å; K2259-A2268 HydrophobicContact CG-CB 4.13Å
2260	L	95.3	Very high	91.4	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	116.6	175.6	-178.6	62.8	0	0	0	108.6	W2200 I2203 W2204 V2242 A2268 R2269 L2271	W2200-L2260 HydrophobicContact CD2-CD1 4.4Å; W2200-L2260 HydrophobicContact CE3-CD1 3.58Å; W2200-L2260 HydrophobicContact CE3-CD2 4.07Å; W2200-L2260 HydrophobicContact CE3-CG 4.45Å; W2200-L2260 HydrophobicContact CZ3-CD1 3.96Å; W2200-L2260 HydrophobicContact CZ3-CD2 4.29Å; I2203-L2260 HydrophobicContact CG2-CD2 3.66Å; W2204-L2260 HydrophobicContact CE3-CD2 3.78Å; W2204-L2260 HydrophobicContact CE3-CG 3.84Å; W2204-L2260 HydrophobicContact CZ3-CD2 4.47Å; W2204-L2260 HydrophobicContact CZ3-CG 4.18Å; V2242-L2260 HydrophobicContact CG2-CD1 3.87Å; L2260-A2268 CarbonylContact O-C 3.56Å; L2260-A2268 WeakPolarHBondContact O-CA 3.01Å; L2260-R2269 PolarHBondContact N-O 3.36Å; L2260-R2269 PolarHBondContact O-N 2.91Å; L2260-L2271 HydrophobicContact CD2-CD1 4.42Å
2261	T	94.9	Very high	91.6	Very high	21 Å²	21	44.9 Å²	44.9	13%	0.129	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	128	-176.4	-48.8	0	0	0	0	110.7	Y2240 V2241 K2259 Q2267 A2268	Y2240-T2261 WeakPolarHBondContact CA-O 3.22Å; V2241-T2261 PolarHBondContact N-O 3.22Å; V2241-T2261 PolarHBondContact O-N 3.37Å; K2259-T2261 WeakPolarHBondContact CE-OG1 3.25Å; K2259-T2261 PolarHBondContact NZ-OG1 3.35Å; K2259-T2261 VanDerWaalsContact NZ-OG1 3.14Å; T2261-Q2267 CarbonylContact C-O 3.58Å; T2261-Q2267 VanDerWaalsContact CA-O 3.31Å; T2261-Q2267 WeakPolarHBondContact CA-O 3.34Å; T2261-Q2267 WeakPolarHBondContact CG2-O 3.29Å; T2261-A2268 HydrophobicContact CG2-CB 4.24Å
2262	D	94.1	Very high	92.2	Very high	4 Å²	4	40.6 Å²	40.6	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	113.7	172.2	-171.1	-25.4	0	0	0	110	W2204 Y2240 R2264 D2265 G2266 Q2267	W2204-D2262 HydrophobicContact CD2-CB 4.46Å; W2204-D2262 HydrophobicContact CH2-CB 4Å; W2204-D2262 HydrophobicContact CZ2-CB 3.5Å; W2204-D2262 VanDerWaalsContact CZ2-CB 3.5Å; W2204-D2262 PolarHBondContact NE1-OD2 2.98Å; Y2240-D2262 HydrophobicContact CD1-CB 4.37Å; Y2240-D2262 HydrophobicContact CE1-CB 4.32Å; D2262-R2264 PolarHBondContact O-N 3.42Å; D2262-R2264 VanDerWaalsContact O-N 3.08Å; D2262-R2264 WeakPolarHBondContact OD1-CB 3.26Å; D2262-R2264 VanDerWaalsContact OD1-CG 3.27Å; D2262-R2264 WeakPolarHBondContact OD1-CG 3.41Å; D2262-R2264 IonicContact OD1-CZ 2.69Å; D2262-R2264 PolarHBondContact OD1-N 3.11Å; D2262-R2264 IonicContact OD1-NE 3.19Å; D2262-R2264 PolarHBondContact OD1-NE 2.93Å; D2262-R2264 IonicContact OD1-NH2 3.18Å; D2262-R2264 IonicContact OD2-CZ 3.72Å; D2262-R2264 VanDerWaalsContact OD2-CZ 3.3Å; D2262-R2264 IonicContact OD2-NE 2.84Å; D2262-R2264 PolarHBondContact OD2-NE 3.39Å; D2262-R2264 VanDerWaalsContact OD2-NE 3.11Å; D2262-R2264 IonicContact OD2-NH2 3.81Å; D2262-R2264 PolarHBondContact OD2-NH2 2.81Å; D2262-D2265 PolarHBondContact O-N 3.06Å; D2262-G2266 WeakPolarHBondContact O-CA 3.26Å; D2262-G2266 PolarHBondContact O-N 3.49Å; D2262-Q2267 PolarHBondContact N-O 3.09Å
2263	A	89.3	Confident	92.6	Very high	51 Å²	51	38.7 Å²	38.7	42%	0.421	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	0	-177.9	0	0	0	0	0	114.1	Y2239 V2241	Y2239-A2263 WeakPolarHBondContact O-CB 3.49Å; Y2239-A2263 PolarHBondContact O-N 2.97Å; V2241-A2263 HydrophobicContact CG2-CB 4.36Å
2264	R	88	Confident	92.9	Very high	130 Å²	130	38.2 Å²	38.2	49%	0.491	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-35.1	176.5	-60.5	174.4	-69.2	-172.1	6	113	Y2239 Y2240 D2262	Y2239-R2264 HydrophobicContact CD1-CG 3.61Å; Y2239-R2264 HydrophobicContact CE1-CG 4.28Å; Y2239-R2264 HydrophobicContact CG-CG 3.92Å; Y2240-R2264 PolarHBondContact OH-NH2 3.19Å; Y2240-R2264 VanDerWaalsContact OH-NH2 3.13Å; D2262-R2264 PolarHBondContact O-N 3.42Å; D2262-R2264 VanDerWaalsContact O-N 3.08Å; D2262-R2264 WeakPolarHBondContact OD1-CB 3.26Å; D2262-R2264 VanDerWaalsContact OD1-CG 3.27Å; D2262-R2264 WeakPolarHBondContact OD1-CG 3.41Å; D2262-R2264 IonicContact OD1-CZ 2.69Å; D2262-R2264 PolarHBondContact OD1-N 3.11Å; D2262-R2264 IonicContact OD1-NE 3.19Å; D2262-R2264 PolarHBondContact OD1-NE 2.93Å; D2262-R2264 IonicContact OD1-NH2 3.18Å; D2262-R2264 IonicContact OD2-CZ 3.72Å; D2262-R2264 VanDerWaalsContact OD2-CZ 3.3Å; D2262-R2264 IonicContact OD2-NE 2.84Å; D2262-R2264 PolarHBondContact OD2-NE 3.39Å; D2262-R2264 VanDerWaalsContact OD2-NE 3.11Å; D2262-R2264 IonicContact OD2-NH2 3.81Å; D2262-R2264 PolarHBondContact OD2-NH2 2.81Å
2265	D	87.6	Confident	93	Very high	82 Å²	82	38.7 Å²	38.7	44%	0.439	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-130	-9	-177.4	71.3	0.5	0	0	0	114.5	D2262 Q2267	D2262-D2265 PolarHBondContact O-N 3.06Å; D2265-Q2267 VanDerWaalsContact C-N 3.31Å; D2265-Q2267 WeakPolarHBondContact OD1-CB 3.48Å; D2265-Q2267 PolarHBondContact OD1-N 3.31Å; D2265-Q2267 PolarHBondContact OD2-NE2 3.31Å
2266	G	82.2	Confident	93	Very high	55 Å²	55	37.6 Å²	37.6	57%	0.567	21%	0.205	S	C	*	.			trans	80	5.5	178.9	0	0	0	0	0	114.6	D2262	D2262-G2266 WeakPolarHBondContact O-CA 3.26Å; D2262-G2266 PolarHBondContact O-N 3.49Å
2267	Q	91.1	Very high	92.8	Very high	103 Å²	103	38.6 Å²	38.6	48%	0.481	21%	0.213	S	C	.	.			trans	-63.9	143.4	172.6	-71.2	-171.2	60.5	0	0	110.5	W2204 T2261 D2262 D2265	W2204-Q2267 HydrophobicContact CH2-CB 3.82Å; W2204-Q2267 WeakPolarHBondContact CH2-O 3.44Å; W2204-Q2267 HydrophobicContact CZ2-CB 3.89Å; T2261-Q2267 CarbonylContact C-O 3.58Å; T2261-Q2267 VanDerWaalsContact CA-O 3.31Å; T2261-Q2267 WeakPolarHBondContact CA-O 3.34Å; T2261-Q2267 WeakPolarHBondContact CG2-O 3.29Å; D2262-Q2267 PolarHBondContact N-O 3.09Å; D2265-Q2267 VanDerWaalsContact C-N 3.31Å; D2265-Q2267 WeakPolarHBondContact OD1-CB 3.48Å; D2265-Q2267 PolarHBondContact OD1-N 3.31Å; D2265-Q2267 PolarHBondContact OD2-NE2 3.31Å
2268	A	89	Confident	92.5	Very high	51 Å²	51	40.5 Å²	40.5	42%	0.421	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	147.6	177.5	0	0	0	0	0	112	K2259 L2260 T2261	K2259-A2268 HydrophobicContact CD-CB 4.45Å; K2259-A2268 HydrophobicContact CG-CB 4.13Å; L2260-A2268 CarbonylContact O-C 3.56Å; L2260-A2268 WeakPolarHBondContact O-CA 3.01Å; T2261-A2268 HydrophobicContact CG2-CB 4.24Å
2269	R	92.5	Very high	92.3	Very high	62 Å²	62	40.6 Å²	40.6	23%	0.234	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	145.8	176.9	-58	-178.5	-162	156.3	11.7	109.9	W2204 N2207 L2260	W2204-R2269 HydrophobicContact CH2-CG 4.09Å; W2204-R2269 HydrophobicContact CZ3-CB 4.23Å; W2204-R2269 HydrophobicContact CZ3-CG 3.73Å; W2204-R2269 PolarHBondContact O-NH1 3.07Å; N2207-R2269 PolarHBondContact OD1-NH1 3.43Å; N2207-R2269 VanDerWaalsContact OD1-NH1 3.15Å; L2260-R2269 PolarHBondContact N-O 3.36Å; L2260-R2269 PolarHBondContact O-N 2.91Å
2270	T	91.6	Very high	91.8	Very high	56 Å²	56	37.3 Å²	37.3	34%	0.344	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	123.2	169.1	-56.7	0	0	0	0	109.2	M2245 F2258	M2245-T2270 HydrophobicContact SD-CG2 4.39Å; F2258-T2270 CarbonylContact O-C 3.53Å; F2258-T2270 WeakPolarHBondContact O-CA 3.26Å
2271	L	95	Very high	90.8	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	141.5	176.1	178.5	143.6	0	0	0	110.6	W2200 I2203 N2209 V2211 E2257 F2258 L2260	W2200-L2271 HydrophobicContact CH2-CD2 4.29Å; W2200-L2271 HydrophobicContact CZ3-CD1 4.03Å; W2200-L2271 HydrophobicContact CZ3-CD2 4.21Å; I2203-L2271 HydrophobicContact CG2-CD1 3.19Å; N2209-L2271 CarbonylContact O-C 3.59Å; N2209-L2271 WeakPolarHBondContact O-CA 3.41Å; V2211-L2271 HydrophobicContact CG2-CD1 4.18Å; V2211-L2271 HydrophobicContact CG2-CD2 4.11Å; E2257-L2271 WeakPolarHBondContact CA-O 3.46Å; F2258-L2271 HydrophobicContact CD2-CD2 3.82Å; F2258-L2271 PolarHBondContact N-O 2.83Å; F2258-L2271 PolarHBondContact O-N 2.86Å; L2260-L2271 HydrophobicContact CD2-CD1 4.42Å
2272	R	95.2	Very high	89.8	Confident	23 Å²	23	39.1 Å²	39.1	9%	0.087	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	120.5	-179.8	-67.4	-177.2	170.2	82.4	16	111.3	N2209 I2210 V2211 L2255 R2256 E2257 F2274 F2305	N2209-R2272 PolarHBondContact O-N 2.7Å; I2210-R2272 CarbonylContact C-O 3.51Å; I2210-R2272 VanDerWaalsContact CA-O 3.29Å; I2210-R2272 WeakPolarHBondContact CA-O 3.44Å; I2210-R2272 HydrophobicContact CG1-CB 4.39Å; V2211-R2272 PolarHBondContact N-O 3.18Å; L2255-R2272 HydrophobicContact CD1-CB 3.88Å; L2255-R2272 HydrophobicContact CD1-CG 4.28Å; R2256-R2272 CarbonylContact O-C 3.42Å; R2256-R2272 WeakPolarHBondContact O-CA 3.25Å; E2257-R2272 HydrophobicContact CG-CG 4.27Å; E2257-R2272 IonicContact OE1-CZ 3.48Å; E2257-R2272 IonicContact OE1-NE 2.73Å; E2257-R2272 PolarHBondContact OE1-NE 3.04Å; E2257-R2272 IonicContact OE1-NH2 3.17Å; E2257-R2272 PolarHBondContact OE1-NH2 3.03Å; E2257-R2272 IonicContact OE2-CZ 3.58Å; E2257-R2272 IonicContact OE2-NE 2.82Å; E2257-R2272 IonicContact OE2-NH2 3.71Å; E2257-R2272 PolarHBondContact OE2-NH2 2.72Å; R2272-F2274 HydrophobicContact CB-CD2 4.48Å; R2272-F2274 HydrophobicContact CB-CE2 3.92Å; R2272-F2305 VanDerWaalsContact NE-CE2 3.32Å; R2272-F2305 VanDerWaalsContact NH1-CG 3.34Å
2273	Q	97.5	Very high	89.4	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	120.8	173.2	-178.6	-150.2	61.4	0	0	109.6	V2211 Y2228 L2255 R2256 F2258	V2211-Q2273 HydrophobicContact CB-CB 4.41Å; V2211-Q2273 HydrophobicContact CB-CG 4.37Å; V2211-Q2273 HydrophobicContact CG1-CG 4.33Å; V2211-Q2273 CarbonylContact O-C 3.54Å; V2211-Q2273 WeakPolarHBondContact O-CA 3.43Å; Y2228-Q2273 PolarHBondContact OH-NE2 3.4Å; L2255-Q2273 CarbonylContact C-O 3.37Å; L2255-Q2273 VanDerWaalsContact CA-O 3.3Å; L2255-Q2273 WeakPolarHBondContact CA-O 3.22Å; R2256-Q2273 HydrophobicContact CB-CB 4.32Å; R2256-Q2273 VanDerWaalsContact CD-OE1 3.28Å; R2256-Q2273 PolarHBondContact N-O 2.7Å; R2256-Q2273 PolarHBondContact O-N 3Å; F2258-Q2273 HydrophobicContact CE2-CB 3.88Å
2274	F	97.6	Very high	89.5	Confident	1 Å²	1	38.3 Å²	38.3	0%	0.004	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	104.2	172.5	-72.1	-97.9	0	0	0	109.6	I2210 V2211 V2212 M2213 Y2253 T2254 L2255 R2272 F2294 V2298 T2301	I2210-F2274 HydrophobicContact CD1-CE2 4.47Å; I2210-F2274 HydrophobicContact CG2-CD2 3.81Å; I2210-F2274 HydrophobicContact CG2-CE2 4.03Å; V2211-F2274 PolarHBondContact O-N 3.38Å; V2212-F2274 CarbonylContact C-O 3.58Å; V2212-F2274 WeakPolarHBondContact CA-O 3.42Å; M2213-F2274 PolarHBondContact N-O 3.39Å; Y2253-F2274 AromaticContact CD2-CD1 3.9Å; Y2253-F2274 HydrophobicContact CD2-CD1 3.9Å; Y2253-F2274 AromaticContact CE2-CD1 3.73Å; Y2253-F2274 HydrophobicContact CE2-CD1 3.73Å; Y2253-F2274 AromaticContact CE2-CE1 3.88Å; Y2253-F2274 HydrophobicContact CE2-CE1 3.88Å; T2254-F2274 CarbonylContact O-C 3.08Å; T2254-F2274 WeakPolarHBondContact O-CA 3.31Å; L2255-F2274 HydrophobicContact CB-CE1 4.4Å; L2255-F2274 HydrophobicContact CD1-CD1 4.32Å; L2255-F2274 HydrophobicContact CD1-CD2 4.04Å; L2255-F2274 HydrophobicContact CD1-CE1 3.99Å; L2255-F2274 HydrophobicContact CD1-CE2 3.69Å; L2255-F2274 HydrophobicContact CD1-CG 4.32Å; L2255-F2274 HydrophobicContact CD1-CZ 3.64Å; L2255-F2274 HydrophobicContact CD2-CE1 4.12Å; L2255-F2274 HydrophobicContact CD2-CZ 4.04Å; L2255-F2274 HydrophobicContact CG-CE1 4.4Å; L2255-F2274 HydrophobicContact CG-CZ 4.37Å; R2272-F2274 HydrophobicContact CB-CD2 4.48Å; R2272-F2274 HydrophobicContact CB-CE2 3.92Å; F2274-F2294 HydrophobicContact CB-CE2 3.8Å; F2274-F2294 HydrophobicContact CB-CZ 3.8Å; F2274-F2294 HydrophobicContact CD1-CE2 4.34Å; F2274-V2298 HydrophobicContact CB-CG2 3.79Å; F2274-V2298 HydrophobicContact CD1-CG2 3.83Å; F2274-V2298 HydrophobicContact CD2-CG2 4.24Å; F2274-V2298 HydrophobicContact CG-CG2 3.7Å; F2274-T2301 HydrophobicContact CE2-CG2 3.99Å; F2274-T2301 HydrophobicContact CZ-CG2 3.85Å; F2274-T2301 VanDerWaalsContact CZ-OG1 3.24Å; F2274-T2301 WeakPolarHBondContact CZ-OG1 3.16Å
2275	Q	97.2	Very high	89.5	Confident	17 Å²	17	32.5 Å²	32.5	8%	0.079	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	105.8	172.1	177.8	-177.7	-10.9	0	0	109.8	M2213 N2216 Y2253 T2254 T2277	M2213-Q2275 HydrophobicContact CB-CB 4.24Å; M2213-Q2275 HydrophobicContact CB-CG 4.46Å; M2213-Q2275 HydrophobicContact CG-CB 4.43Å; M2213-Q2275 HydrophobicContact CG-CG 4.15Å; M2213-Q2275 CarbonylContact O-C 3.52Å; M2213-Q2275 VanDerWaalsContact O-CA 3.27Å; M2213-Q2275 WeakPolarHBondContact O-CA 3.33Å; N2216-Q2275 PolarHBondContact OD1-NE2 3.27Å; Y2253-Q2275 CarbonylContact C-O 2.77Å; Y2253-Q2275 WeakPolarHBondContact CA-O 3.26Å; Y2253-Q2275 VanDerWaalsContact CB-O 3.22Å; Y2253-Q2275 WeakPolarHBondContact CB-O 3.31Å; T2254-Q2275 PolarHBondContact N-O 3.14Å; T2254-Q2275 PolarHBondContact O-N 2.76Å; Q2275-T2277 PolarHBondContact O-N 3.47Å
2276	F	95.9	Very high	89	Confident	1 Å²	1	30.6 Å²	30.6	0%	0.004	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	115.8	170.6	-172.7	-107.6	0	0	0	109.2	M2213 L2214 N2252 D2278 W2279 P2285 F2291 F2294	M2213-F2276 PolarHBondContact O-N 2.87Å; L2214-F2276 HydrophobicContact CD2-CB 4.05Å; N2252-F2276 HydrophobicContact CB-CE2 4.06Å; N2252-F2276 WeakPolarHBondContact O-CD2 3.31Å; F2276-D2278 VanDerWaalsContact CE1-C 3.43Å; F2276-D2278 HydrophobicContact CE1-CB 3.99Å; F2276-D2278 HydrophobicContact CE2-CB 4.19Å; F2276-D2278 HydrophobicContact CZ-CB 3.7Å; F2276-W2279 HydrophobicContact CD1-CB 3.98Å; F2276-W2279 HydrophobicContact CD1-CE3 4.41Å; F2276-W2279 HydrophobicContact CE1-CB 4.05Å; F2276-W2279 HydrophobicContact CE1-CE3 4.39Å; F2276-W2279 VanDerWaalsContact CE1-N 3.31Å; F2276-P2285 HydrophobicContact CE1-CG 4.11Å; F2276-F2291 HydrophobicContact CD1-CD2 4.02Å; F2276-F2291 HydrophobicContact CD1-CE2 4.19Å; F2276-F2291 HydrophobicContact CD2-CD2 4.34Å; F2276-F2291 AromaticContact CE1-CD2 3.71Å; F2276-F2291 HydrophobicContact CE1-CD2 3.71Å; F2276-F2291 HydrophobicContact CE1-CE2 4.3Å; F2276-F2291 HydrophobicContact CE2-CD2 4.06Å; F2276-F2291 HydrophobicContact CG-CD2 4.32Å; F2276-F2291 HydrophobicContact CG-CE2 4.46Å; F2276-F2291 HydrophobicContact CZ-CB 4.29Å; F2276-F2291 AromaticContact CZ-CD2 3.73Å; F2276-F2291 HydrophobicContact CZ-CD2 3.73Å; F2276-F2294 HydrophobicContact CB-CD1 4.14Å; F2276-F2294 HydrophobicContact CB-CD2 4.11Å; F2276-F2294 HydrophobicContact CB-CE1 3.88Å; F2276-F2294 HydrophobicContact CB-CE2 3.81Å; F2276-F2294 HydrophobicContact CB-CG 4.25Å; F2276-F2294 HydrophobicContact CB-CZ 3.69Å; F2276-F2294 HydrophobicContact CD2-CB 3.69Å; F2276-F2294 AromaticContact CD2-CD1 3.96Å; F2276-F2294 HydrophobicContact CD2-CD1 3.96Å; F2276-F2294 AromaticContact CD2-CD2 3.63Å; F2276-F2294 HydrophobicContact CD2-CD2 3.63Å; F2276-F2294 HydrophobicContact CD2-CE2 4.22Å; F2276-F2294 AromaticContact CD2-CG 3.47Å; F2276-F2294 HydrophobicContact CD2-CG 3.47Å; F2276-F2294 VanDerWaalsContact CD2-CG 3.47Å; F2276-F2294 HydrophobicContact CE2-CB 3.88Å; F2276-F2294 HydrophobicContact CE2-CG 4.17Å; F2276-F2294 HydrophobicContact CG-CD1 4.24Å; F2276-F2294 HydrophobicContact CG-CD2 4.31Å; F2276-F2294 HydrophobicContact CG-CE1 4.46Å; F2276-F2294 HydrophobicContact CG-CE2 4.5Å; F2276-F2294 HydrophobicContact CG-CG 4.16Å
2277	T	91.5	Very high	88.9	Confident	42 Å²	42	30.3 Å²	30.3	26%	0.258	17%	0.167	S	C	.	.			trans	-86.4	-27	-174.9	45.3	0	0	0	0	112.5	N2252 Y2253 Q2275 W2279	N2252-T2277 PolarHBondContact O-N 3.13Å; N2252-T2277 VanDerWaalsContact O-N 3.11Å; N2252-T2277 PolarHBondContact O-OG1 2.98Å; N2252-T2277 VanDerWaalsContact O-OG1 3.06Å; Y2253-T2277 PolarHBondContact N-OG1 3.35Å; Q2275-T2277 PolarHBondContact O-N 3.47Å; T2277-W2279 VanDerWaalsContact C-N 3.28Å; T2277-W2279 PolarHBondContact O-N 2.84Å
2278	D	88	Confident	88.9	Confident	66 Å²	66	25.7 Å²	25.7	35%	0.353	15%	0.146	S	C	.	.			trans	-91.1	15.2	-163.2	-71.2	28.9	0	0	0	113.7	N2252 F2276 P2280	N2252-D2278 VanDerWaalsContact CA-CG 3.47Å; N2252-D2278 WeakPolarHBondContact CA-OD1 3.07Å; N2252-D2278 WeakPolarHBondContact CA-OD2 3.16Å; N2252-D2278 HydrophobicContact CB-CB 4.22Å; N2252-D2278 WeakPolarHBondContact CB-OD2 3.24Å; N2252-D2278 PolarHBondContact OD1-OD2 2.79Å; F2276-D2278 VanDerWaalsContact CE1-C 3.43Å; F2276-D2278 HydrophobicContact CE1-CB 3.99Å; F2276-D2278 HydrophobicContact CE2-CB 4.19Å; F2276-D2278 HydrophobicContact CZ-CB 3.7Å; D2278-P2280 WeakPolarHBondContact O-CD 3.26Å
2279	W	89.9	Confident	88.8	Confident	4 Å²	4	25.9 Å²	25.9	2%	0.015	14%	0.138	C	C	.	.	S	Bend	trans	-81.5	116.6	166.4	-153.6	-55.9	0	0	0	109	F2276 T2277 G2283 V2284 P2285 F2291 R2321 V2324 Q2363	F2276-W2279 HydrophobicContact CD1-CB 3.98Å; F2276-W2279 HydrophobicContact CD1-CE3 4.41Å; F2276-W2279 HydrophobicContact CE1-CB 4.05Å; F2276-W2279 HydrophobicContact CE1-CE3 4.39Å; F2276-W2279 VanDerWaalsContact CE1-N 3.31Å; T2277-W2279 VanDerWaalsContact C-N 3.28Å; T2277-W2279 PolarHBondContact O-N 2.84Å; W2279-G2283 PolarHBondContact NE1-O 2.86Å; W2279-V2284 HydrophobicContact CZ2-CG1 4.16Å; W2279-P2285 HydrophobicContact CD2-CG 3.99Å; W2279-P2285 HydrophobicContact CE3-CG 4.1Å; W2279-P2285 HydrophobicContact CG-CG 4.3Å; W2279-F2291 HydrophobicContact CE3-CD2 4.36Å; W2279-F2291 AromaticContact CE3-CE2 3.93Å; W2279-F2291 HydrophobicContact CE3-CE2 3.93Å; W2279-F2291 HydrophobicContact CE3-CZ 4.43Å; W2279-F2291 HydrophobicContact CZ3-CD2 4.26Å; W2279-F2291 HydrophobicContact CZ3-CE1 4.37Å; W2279-F2291 AromaticContact CZ3-CE2 3.7Å; W2279-F2291 HydrophobicContact CZ3-CE2 3.7Å; W2279-F2291 AromaticContact CZ3-CZ 3.76Å; W2279-F2291 HydrophobicContact CZ3-CZ 3.76Å; W2279-R2321 VanDerWaalsContact CD1-CZ 3.4Å; W2279-R2321 HydrophobicContact CD2-CB 4.23Å; W2279-R2321 VanDerWaalsContact CD2-CD 3.46Å; W2279-R2321 HydrophobicContact CD2-CG 3.69Å; W2279-R2321 HydrophobicContact CE3-CB 3.97Å; W2279-R2321 HydrophobicContact CE3-CG 3.97Å; W2279-R2321 HydrophobicContact CG-CG 4.27Å; W2279-R2321 HydrophobicContact CH2-CB 3.99Å; W2279-R2321 HydrophobicContact CH2-CG 4.01Å; W2279-R2321 HydrophobicContact CZ2-CB 4.25Å; W2279-R2321 HydrophobicContact CZ2-CG 3.73Å; W2279-R2321 HydrophobicContact CZ3-CB 3.85Å; W2279-R2321 HydrophobicContact CZ3-CG 4.12Å; W2279-V2324 HydrophobicContact CH2-CB 3.75Å; W2279-V2324 HydrophobicContact CH2-CG1 3.77Å; W2279-V2324 HydrophobicContact CH2-CG2 3.93Å; W2279-V2324 HydrophobicContact CZ3-CB 4.35Å; W2279-V2324 HydrophobicContact CZ3-CG1 4.26Å; W2279-Q2363 HydrophobicContact CZ2-CG 4.3Å
2280	P	83.7	Confident	88.5	Confident	13 Å²	13	23.6 Å²	23.6	8%	0.084	13%	0.133	C	C	.	.			trans	-65.1	149.2	-179.4	26.5	-34.9	0	0	0	112.1	D2278 H2282 V2284 R2321	D2278-P2280 WeakPolarHBondContact O-CD 3.26Å; P2280-H2282 WeakPolarHBondContact CB-O 3.13Å; P2280-H2282 VanDerWaalsContact CG-O 3.26Å; P2280-H2282 WeakPolarHBondContact CG-O 3.24Å; P2280-H2282 PolarHBondContact O-N 2.77Å; P2280-V2284 VanDerWaalsContact CG-O 3.28Å; P2280-V2284 WeakPolarHBondContact CG-O 3.34Å; P2280-R2321 PolarHBondContact O-NH2 3.23Å
2281	E	75.9	Confident	88.6	Confident	59 Å²	59	20.9 Å²	20.9	28%	0.276	12%	0.116	S	C	.	.	S	Bend	trans	-66.2	17.8	173.8	-47.5	-178.2	122.5	0	0	113.8	E380 L381 E2219 R2220	E380-E2281 CarbonylContact C-O 3.52Å; E380-E2281 WeakPolarHBondContact CA-O 3.38Å; E380-E2281 PolarHBondContact N-O 2.7Å; L381-E2281 PolarHBondContact N-O 3.18Å; E2219-E2281 VanDerWaalsContact CA-OE1 3.24Å; E2219-E2281 WeakPolarHBondContact CA-OE1 3.34Å; E2219-E2281 HydrophobicContact CB-CB 4.3Å; E2219-E2281 HydrophobicContact CB-CG 4.09Å; E2219-E2281 HydrophobicContact CG-CG 4.27Å; R2220-E2281 HydrophobicContact CG-CB 4.49Å; R2220-E2281 VanDerWaalsContact CG-OE2 3.25Å; R2220-E2281 WeakPolarHBondContact CG-OE2 3.31Å; R2220-E2281 PolarHBondContact N-OE1 3.02Å; R2220-E2281 PolarHBondContact NH2-O 2.84Å
2282	H	73.7	Confident	88.4	Confident	1 Å²	1	21.6 Å²	21.6	1%	0.005	12%	0.12	C	C	.	.	S	Bend	trans	-167.9	98.5	-157.8	-84.9	-83.5	0	0	0	106.6	I373 L381 S382 R383 R2220 P2280	I373-H2282 PolarHBondContact O-NE2 2.85Å; L381-H2282 PolarHBondContact O-CE1 3.27Å; L381-H2282 VanDerWaalsContact O-CE1 3.23Å; L381-H2282 PolarHBondContact O-ND1 2.82Å; S382-H2282 VanDerWaalsContact C-CB 3.48Å; S382-H2282 VanDerWaalsContact C-ND1 3.28Å; S382-H2282 PolarHBondContact O-ND1 3.17Å; R383-H2282 HydrophobicContact CB-CB 3.8Å; R383-H2282 WeakPolarHBondContact CB-O 3.49Å; R383-H2282 PolarHBondContact N-O 3.32Å; R2220-H2282 WeakPolarHBondContact CD-NE2 3.41Å; R2220-H2282 PolarHBondContact NE-NE2 3.11Å; R2220-H2282 PolarHBondContact NH1-CE1 3.32Å; R2220-H2282 PolarHBondContact NH1-NE2 3.44Å; R2220-H2282 PolarHBondContact NH2-CE1 2.63Å; R2220-H2282 PolarHBondContact NH2-ND1 3.49Å; R2220-H2282 PolarHBondContact NH2-NE2 2.83Å; P2280-H2282 WeakPolarHBondContact CB-O 3.13Å; P2280-H2282 VanDerWaalsContact CG-O 3.26Å; P2280-H2282 WeakPolarHBondContact CG-O 3.24Å; P2280-H2282 PolarHBondContact O-N 2.77Å
2283	G	84.4	Confident	88	Confident	9 Å²	9	21.8 Å²	21.8	9%	0.093	12%	0.123	C	C	.	.	S	Bend	trans	80.7	-130.8	172.8	0	0	0	0	0	116	W2279	W2279-G2283 PolarHBondContact NE1-O 2.86Å
2284	V	91.7	Very high	87.9	Confident	28 Å²	28	21.8 Å²	21.8	17%	0.17	12%	0.123	C	C	.	.	S	Bend	trans	-131.3	159.1	-172.7	-65.3	0	0	0	0	111.6	W2279 P2280 D2362 Q2363 F2366	W2279-V2284 HydrophobicContact CZ2-CG1 4.16Å; P2280-V2284 VanDerWaalsContact CG-O 3.28Å; P2280-V2284 WeakPolarHBondContact CG-O 3.34Å; V2284-D2362 HydrophobicContact CG1-CB 3.87Å; V2284-D2362 HydrophobicContact CG2-CB 4.37Å; V2284-Q2363 HydrophobicContact CG1-CB 4.48Å; V2284-Q2363 HydrophobicContact CG1-CG 3.79Å; V2284-F2366 HydrophobicContact CB-CB 4.14Å; V2284-F2366 HydrophobicContact CB-CD2 4.03Å; V2284-F2366 HydrophobicContact CB-CG 4.15Å; V2284-F2366 HydrophobicContact CG1-CB 4.08Å; V2284-F2366 HydrophobicContact CG1-CG 4.44Å; V2284-F2366 HydrophobicContact CG2-CB 4.2Å; V2284-F2366 HydrophobicContact CG2-CD2 4.14Å; V2284-F2366 HydrophobicContact CG2-CG 4.46Å
2285	P	89.3	Confident	87.6	Confident	9 Å²	9	22 Å²	22	6%	0.058	12%	0.124	C	C	.	.			trans	-58.3	139.8	176.1	-22.4	33.9	0	0	0	112	F2276 W2279 F2366	F2276-P2285 HydrophobicContact CE1-CG 4.11Å; W2279-P2285 HydrophobicContact CD2-CG 3.99Å; W2279-P2285 HydrophobicContact CE3-CG 4.1Å; W2279-P2285 HydrophobicContact CG-CG 4.3Å; P2285-F2366 HydrophobicContact CB-CE2 3.95Å; P2285-F2366 HydrophobicContact CB-CZ 4.15Å; P2285-F2366 HydrophobicContact CG-CE2 4.18Å; P2285-F2366 HydrophobicContact CG-CZ 4.03Å; P2285-F2366 VanDerWaalsContact O-CE2 3.28Å; P2285-F2366 WeakPolarHBondContact O-CE2 3.32Å
2286	E	76.9	Confident	87.2	Confident	41 Å²	41	22 Å²	22	19%	0.192	13%	0.127	C	C	.	.	S	Bend	trans	-77.6	-22.6	-178.6	-66.8	-167.2	-125.4	0	0	113.4	S370 R383 Q385 H432	S370-E2286 WeakPolarHBondContact CB-OE2 3.36Å; R383-E2286 VanDerWaalsContact CD-OE1 3.31Å; R383-E2286 WeakPolarHBondContact CD-OE1 3.47Å; R383-E2286 IonicContact CZ-OE1 2.8Å; R383-E2286 IonicContact NE-OE1 2.61Å; R383-E2286 IonicContact NH1-OE1 2.8Å; R383-E2286 PolarHBondContact NH1-OE1 3.42Å; Q385-E2286 HydrophobicContact CG-CG 4.35Å; Q385-E2286 VanDerWaalsContact NE2-CG 3.32Å; Q385-E2286 PolarHBondContact NE2-OE2 2.79Å; H432-E2286 IonicContact CE1-OE2 2.67Å; H432-E2286 PolarHBondContact CE1-OE2 3.44Å
2287	S	80.2	Confident	87.1	Confident	49 Å²	49	22.7 Å²	22.7	34%	0.343	13%	0.131	S	C	.	.			trans	-107.9	126.6	169.9	168.9	0	0	0	0	108.8	E2289 A2290	S2287-E2289 VanDerWaalsContact C-N 3.35Å; S2287-E2289 WeakPolarHBondContact OG-CB 3.46Å; S2287-E2289 PolarHBondContact OG-N 3.2Å; S2287-A2290 PolarHBondContact OG-N 3.5Å
2288	C	89.5	Confident	87.2	Confident	6 Å²	6	20.7 Å²	20.7	4%	0.041	12%	0.119	C	C	.	.	H	α-helix	trans	-73.4	-35.1	167.2	-42.2	0	0	0	0	109.9	A2290 F2291 I2292 F2366 A2370 E2373	C2288-A2290 PolarHBondContact O-N 3.35Å; C2288-F2291 CarbonylContact O-C 3.51Å; C2288-F2291 WeakPolarHBondContact O-CA 3.47Å; C2288-F2291 PolarHBondContact O-N 3.26Å; C2288-I2292 HydrophobicContact CB-CD1 3.72Å; C2288-I2292 HydrophobicContact CB-CG1 4.38Å; C2288-I2292 VanDerWaalsContact O-CG1 3.27Å; C2288-I2292 WeakPolarHBondContact O-CG1 3.37Å; C2288-I2292 PolarHBondContact O-N 3.23Å; C2288-F2366 HydrophobicContact CB-CE2 4.32Å; C2288-F2366 HydrophobicContact CB-CZ 4.42Å; C2288-A2370 HydrophobicContact CB-CB 3.68Å; C2288-E2373 HydrophobicContact CB-CB 4.36Å; C2288-E2373 WeakPolarHBondContact CB-OE2 3.3Å; C2288-E2373 PolarHBondContact SG-OE2 3.08Å
2289	E	86.8	Confident	87.3	Confident	55 Å²	55	18.6 Å²	18.6	26%	0.257	11%	0.107	S	C	.	.	H	α-helix	trans	-51.6	-42.9	-177.7	-169.5	178	-164.6	0	0	112.4	K252 L335 S2287 F2291 I2292 D2293 E2373	K252-E2289 PolarHBondContact NZ-O 2.75Å; K252-E2289 IonicContact NZ-OE1 3.83Å; L335-E2289 WeakPolarHBondContact CD1-OE2 3.28Å; S2287-E2289 VanDerWaalsContact C-N 3.35Å; S2287-E2289 WeakPolarHBondContact OG-CB 3.46Å; S2287-E2289 PolarHBondContact OG-N 3.2Å; E2289-F2291 VanDerWaalsContact C-N 3.32Å; E2289-F2291 PolarHBondContact O-N 3.28Å; E2289-I2292 PolarHBondContact O-N 3.37Å; E2289-D2293 WeakPolarHBondContact O-CB 3.34Å; E2289-D2293 PolarHBondContact O-N 2.75Å; E2289-E2373 WeakPolarHBondContact CA-OE1 3.45Å; E2289-E2373 WeakPolarHBondContact CB-OE1 3.44Å; E2289-E2373 PolarHBondContact N-OE1 3.16Å
2290	A	88.1	Confident	87.2	Confident	14 Å²	14	18.5 Å²	18.5	12%	0.116	11%	0.106	C	C	.	.	H	α-helix	trans	-58.2	-42.3	176	0	0	0	0	0	112.5	N2252 S2287 C2288 F2294	N2252-A2290 WeakPolarHBondContact ND2-CA 3.4Å; N2252-A2290 VanDerWaalsContact ND2-CB 3.29Å; N2252-A2290 WeakPolarHBondContact ND2-CB 3.47Å; S2287-A2290 PolarHBondContact OG-N 3.5Å; C2288-A2290 PolarHBondContact O-N 3.35Å; A2290-F2294 WeakPolarHBondContact O-CB 3.35Å; A2290-F2294 PolarHBondContact O-N 3.07Å
2291	F	93.1	Very high	87.5	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-81.5	-32.4	179.6	-163.1	-106.4	0	0	0	112.8	L2214 F2276 W2279 C2288 E2289 D2293 F2294 L2295 V2324 F2325 L2328 F2366	L2214-F2291 HydrophobicContact CD2-CE2 4.13Å; L2214-F2291 HydrophobicContact CD2-CZ 4.5Å; F2276-F2291 HydrophobicContact CD1-CD2 4.02Å; F2276-F2291 HydrophobicContact CD1-CE2 4.19Å; F2276-F2291 HydrophobicContact CD2-CD2 4.34Å; F2276-F2291 AromaticContact CE1-CD2 3.71Å; F2276-F2291 HydrophobicContact CE1-CD2 3.71Å; F2276-F2291 HydrophobicContact CE1-CE2 4.3Å; F2276-F2291 HydrophobicContact CE2-CD2 4.06Å; F2276-F2291 HydrophobicContact CG-CD2 4.32Å; F2276-F2291 HydrophobicContact CG-CE2 4.46Å; F2276-F2291 HydrophobicContact CZ-CB 4.29Å; F2276-F2291 AromaticContact CZ-CD2 3.73Å; F2276-F2291 HydrophobicContact CZ-CD2 3.73Å; W2279-F2291 HydrophobicContact CE3-CD2 4.36Å; W2279-F2291 AromaticContact CE3-CE2 3.93Å; W2279-F2291 HydrophobicContact CE3-CE2 3.93Å; W2279-F2291 HydrophobicContact CE3-CZ 4.43Å; W2279-F2291 HydrophobicContact CZ3-CD2 4.26Å; W2279-F2291 HydrophobicContact CZ3-CE1 4.37Å; W2279-F2291 AromaticContact CZ3-CE2 3.7Å; W2279-F2291 HydrophobicContact CZ3-CE2 3.7Å; W2279-F2291 AromaticContact CZ3-CZ 3.76Å; W2279-F2291 HydrophobicContact CZ3-CZ 3.76Å; C2288-F2291 CarbonylContact O-C 3.51Å; C2288-F2291 WeakPolarHBondContact O-CA 3.47Å; C2288-F2291 PolarHBondContact O-N 3.26Å; E2289-F2291 VanDerWaalsContact C-N 3.32Å; E2289-F2291 PolarHBondContact O-N 3.28Å; F2291-D2293 VanDerWaalsContact C-N 3.35Å; F2291-F2294 HydrophobicContact CD2-CD1 4.4Å; F2291-F2294 HydrophobicContact CE2-CD1 4.16Å; F2291-F2294 PolarHBondContact O-N 3.12Å; F2291-L2295 HydrophobicContact CD1-CD1 3.59Å; F2291-L2295 HydrophobicContact CD1-CG 4.12Å; F2291-L2295 HydrophobicContact CE1-CD1 3.68Å; F2291-L2295 HydrophobicContact CE1-CD2 4.44Å; F2291-L2295 HydrophobicContact CE1-CG 3.97Å; F2291-L2295 VanDerWaalsContact O-CB 3.3Å; F2291-L2295 WeakPolarHBondContact O-CB 3.36Å; F2291-L2295 WeakPolarHBondContact O-CD1 3.4Å; F2291-L2295 VanDerWaalsContact O-CG 3.27Å; F2291-L2295 WeakPolarHBondContact O-CG 3.36Å; F2291-L2295 PolarHBondContact O-N 3.48Å; F2291-V2324 HydrophobicContact CE1-CG1 3.92Å; F2291-F2325 HydrophobicContact CE1-CB 4.47Å; F2291-F2325 HydrophobicContact CZ-CB 3.97Å; F2291-F2325 AromaticContact CZ-CD2 3.97Å; F2291-F2325 HydrophobicContact CZ-CD2 3.97Å; F2291-F2325 HydrophobicContact CZ-CG 4.44Å; F2291-L2328 HydrophobicContact CD1-CD1 3.87Å; F2291-L2328 HydrophobicContact CE1-CD1 4.04Å; F2291-F2366 HydrophobicContact CB-CE1 4.42Å; F2291-F2366 HydrophobicContact CB-CZ 3.92Å; F2291-F2366 AromaticContact CD1-CE1 3.9Å; F2291-F2366 HydrophobicContact CD1-CE1 3.9Å; F2291-F2366 HydrophobicContact CD1-CZ 4.27Å; F2291-F2366 HydrophobicContact CG-CE1 4.31Å; F2291-F2366 HydrophobicContact CG-CZ 4.26Å
2292	I	90.9	Very high	88.1	Confident	16 Å²	16	16.1 Å²	16.1	8%	0.082	10%	0.095	C	C	.	.	H	α-helix	trans	-67.2	-37.4	172.3	-64.9	161.4	0	0	0	110.1	C2288 E2289 G2296 A2370 E2373 Y2374	C2288-I2292 HydrophobicContact CB-CD1 3.72Å; C2288-I2292 HydrophobicContact CB-CG1 4.38Å; C2288-I2292 VanDerWaalsContact O-CG1 3.27Å; C2288-I2292 WeakPolarHBondContact O-CG1 3.37Å; C2288-I2292 PolarHBondContact O-N 3.23Å; E2289-I2292 PolarHBondContact O-N 3.37Å; I2292-G2296 PolarHBondContact O-N 3.34Å; I2292-A2370 HydrophobicContact CD1-CB 4.1Å; I2292-A2370 VanDerWaalsContact CD1-O 3.32Å; I2292-A2370 WeakPolarHBondContact CD1-O 3.47Å; I2292-A2370 HydrophobicContact CG1-CB 4.2Å; I2292-E2373 HydrophobicContact CD1-CB 4.27Å; I2292-Y2374 HydrophobicContact CG2-CD2 3.83Å; I2292-Y2374 HydrophobicContact CG2-CE2 4.37Å; I2292-Y2374 HydrophobicContact CG2-CG 4.49Å
2293	D	87.3	Confident	88.6	Confident	27 Å²	27	16.3 Å²	16.3	14%	0.144	10%	0.096	C	C	.	.	H	α-helix	trans	-62.1	-55.6	167.6	-176.2	52.3	0	0	0	110.4	K252 E2289 F2291 L2295 G2296 Q2297	K252-D2293 HydrophobicContact CD-CB 4.06Å; K252-D2293 HydrophobicContact CG-CB 4.47Å; K252-D2293 VanDerWaalsContact CG-OD1 3.26Å; K252-D2293 WeakPolarHBondContact CG-OD1 3.43Å; E2289-D2293 WeakPolarHBondContact O-CB 3.34Å; E2289-D2293 PolarHBondContact O-N 2.75Å; F2291-D2293 VanDerWaalsContact C-N 3.35Å; D2293-L2295 VanDerWaalsContact C-N 3.32Å; D2293-L2295 PolarHBondContact O-N 2.86Å; D2293-G2296 CarbonylContact O-C 3.54Å; D2293-G2296 WeakPolarHBondContact O-CA 3.24Å; D2293-G2296 PolarHBondContact O-N 2.75Å; D2293-Q2297 WeakPolarHBondContact O-CG 3.5Å; D2293-Q2297 PolarHBondContact O-N 2.87Å; D2293-Q2297 PolarHBondContact OD1-NE2 2.81Å; D2293-Q2297 WeakPolarHBondContact OD2-CG 3.14Å; D2293-Q2297 PolarHBondContact OD2-NE2 2.82Å
2294	F	93.9	Very high	88.5	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-53.5	-45.9	-179.1	179.7	-100.4	0	0	0	113.4	V2212 L2214 Y2253 F2274 F2276 A2290 F2291 G2296 Q2297 V2298 F2325	V2212-F2294 HydrophobicContact CG1-CE1 3.8Å; V2212-F2294 HydrophobicContact CG1-CZ 3.92Å; L2214-F2294 HydrophobicContact CD2-CD1 4.45Å; L2214-F2294 HydrophobicContact CD2-CE1 3.65Å; L2214-F2294 HydrophobicContact CD2-CZ 4.28Å; Y2253-F2294 AromaticContact CD1-CD2 3.77Å; Y2253-F2294 HydrophobicContact CD1-CD2 3.77Å; Y2253-F2294 HydrophobicContact CD1-CE2 4.45Å; Y2253-F2294 HydrophobicContact CD2-CD2 4.3Å; Y2253-F2294 HydrophobicContact CD2-CE2 4.23Å; Y2253-F2294 HydrophobicContact CE1-CD2 4.47Å; Y2253-F2294 AromaticContact CG-CD2 3.67Å; Y2253-F2294 HydrophobicContact CG-CD2 3.67Å; Y2253-F2294 AromaticContact CG-CE2 3.89Å; Y2253-F2294 HydrophobicContact CG-CE2 3.89Å; F2274-F2294 HydrophobicContact CB-CE2 3.8Å; F2274-F2294 HydrophobicContact CB-CZ 3.8Å; F2274-F2294 HydrophobicContact CD1-CE2 4.34Å; F2276-F2294 HydrophobicContact CB-CD1 4.14Å; F2276-F2294 HydrophobicContact CB-CD2 4.11Å; F2276-F2294 HydrophobicContact CB-CE1 3.88Å; F2276-F2294 HydrophobicContact CB-CE2 3.81Å; F2276-F2294 HydrophobicContact CB-CG 4.25Å; F2276-F2294 HydrophobicContact CB-CZ 3.69Å; F2276-F2294 HydrophobicContact CD2-CB 3.69Å; F2276-F2294 AromaticContact CD2-CD1 3.96Å; F2276-F2294 HydrophobicContact CD2-CD1 3.96Å; F2276-F2294 AromaticContact CD2-CD2 3.63Å; F2276-F2294 HydrophobicContact CD2-CD2 3.63Å; F2276-F2294 HydrophobicContact CD2-CE2 4.22Å; F2276-F2294 AromaticContact CD2-CG 3.47Å; F2276-F2294 HydrophobicContact CD2-CG 3.47Å; F2276-F2294 VanDerWaalsContact CD2-CG 3.47Å; F2276-F2294 HydrophobicContact CE2-CB 3.88Å; F2276-F2294 HydrophobicContact CE2-CG 4.17Å; F2276-F2294 HydrophobicContact CG-CD1 4.24Å; F2276-F2294 HydrophobicContact CG-CD2 4.31Å; F2276-F2294 HydrophobicContact CG-CE1 4.46Å; F2276-F2294 HydrophobicContact CG-CE2 4.5Å; F2276-F2294 HydrophobicContact CG-CG 4.16Å; A2290-F2294 WeakPolarHBondContact O-CB 3.35Å; A2290-F2294 PolarHBondContact O-N 3.07Å; F2291-F2294 HydrophobicContact CD2-CD1 4.4Å; F2291-F2294 HydrophobicContact CE2-CD1 4.16Å; F2291-F2294 PolarHBondContact O-N 3.12Å; F2294-G2296 VanDerWaalsContact C-N 3.33Å; F2294-G2296 PolarHBondContact O-N 2.67Å; F2294-Q2297 PolarHBondContact O-N 2.85Å; F2294-V2298 HydrophobicContact CD1-CG2 4.21Å; F2294-V2298 HydrophobicContact CD2-CG2 4.31Å; F2294-V2298 HydrophobicContact CE1-CG2 3.74Å; F2294-V2298 HydrophobicContact CE2-CG2 3.89Å; F2294-V2298 HydrophobicContact CG-CG2 4.48Å; F2294-V2298 HydrophobicContact CZ-CG2 3.57Å; F2294-V2298 WeakPolarHBondContact O-CB 3.45Å; F2294-V2298 WeakPolarHBondContact O-CG2 3.5Å; F2294-V2298 PolarHBondContact O-N 3.48Å; F2294-F2325 HydrophobicContact CD1-CD2 4.29Å; F2294-F2325 HydrophobicContact CD1-CE2 4.01Å; F2294-F2325 HydrophobicContact CE1-CD2 4.06Å; F2294-F2325 AromaticContact CE1-CE2 3.76Å; F2294-F2325 HydrophobicContact CE1-CE2 3.76Å
2295	L	92.9	Very high	88.1	Confident	6 Å²	6	22.1 Å²	22.1	3%	0.031	12%	0.117	C	C	.	.	H	α-helix	trans	-53	-51.5	169.7	-81.5	161.2	0	0	0	110.8	F2291 D2293 H2299 F2325 L2328 S2329 L2332	F2291-L2295 HydrophobicContact CD1-CD1 3.59Å; F2291-L2295 HydrophobicContact CD1-CG 4.12Å; F2291-L2295 HydrophobicContact CE1-CD1 3.68Å; F2291-L2295 HydrophobicContact CE1-CD2 4.44Å; F2291-L2295 HydrophobicContact CE1-CG 3.97Å; F2291-L2295 VanDerWaalsContact O-CB 3.3Å; F2291-L2295 WeakPolarHBondContact O-CB 3.36Å; F2291-L2295 WeakPolarHBondContact O-CD1 3.4Å; F2291-L2295 VanDerWaalsContact O-CG 3.27Å; F2291-L2295 WeakPolarHBondContact O-CG 3.36Å; F2291-L2295 PolarHBondContact O-N 3.48Å; D2293-L2295 VanDerWaalsContact C-N 3.32Å; D2293-L2295 PolarHBondContact O-N 2.86Å; L2295-H2299 VanDerWaalsContact O-CB 3.29Å; L2295-H2299 WeakPolarHBondContact O-CB 3.13Å; L2295-H2299 PolarHBondContact O-CD2 3.19Å; L2295-H2299 VanDerWaalsContact O-CD2 3.23Å; L2295-H2299 PolarHBondContact O-N 2.76Å; L2295-F2325 HydrophobicContact CD2-CD1 4.02Å; L2295-F2325 HydrophobicContact CD2-CD2 3.56Å; L2295-F2325 HydrophobicContact CD2-CE1 4.01Å; L2295-F2325 HydrophobicContact CD2-CE2 3.56Å; L2295-F2325 HydrophobicContact CD2-CG 3.79Å; L2295-F2325 HydrophobicContact CD2-CZ 3.77Å; L2295-F2325 WeakPolarHBondContact CD2-O 3.4Å; L2295-F2325 HydrophobicContact CG-CD2 4.24Å; L2295-F2325 HydrophobicContact CG-CE2 4.2Å; L2295-L2328 HydrophobicContact CD1-CB 3.56Å; L2295-L2328 HydrophobicContact CD1-CD1 3.94Å; L2295-L2328 HydrophobicContact CD1-CG 4.4Å; L2295-S2329 VanDerWaalsContact CD2-OG 3.32Å; L2295-S2329 WeakPolarHBondContact CD2-OG 3.38Å; L2295-L2332 HydrophobicContact CD1-CD1 4.16Å
2296	G	88.5	Confident	87.2	Confident	15 Å²	15	23.7 Å²	23.7	16%	0.155	14%	0.135	C	C	.	.	H	α-helix	trans	-48.1	-63.9	169.7	0	0	0	0	0	111.9	I2292 D2293 F2294 V2298 H2299 K2300	I2292-G2296 PolarHBondContact O-N 3.34Å; D2293-G2296 CarbonylContact O-C 3.54Å; D2293-G2296 WeakPolarHBondContact O-CA 3.24Å; D2293-G2296 PolarHBondContact O-N 2.75Å; F2294-G2296 VanDerWaalsContact C-N 3.33Å; F2294-G2296 PolarHBondContact O-N 2.67Å; G2296-V2298 PolarHBondContact O-N 3.4Å; G2296-H2299 CarbonylContact O-C 3.4Å; G2296-H2299 PolarHBondContact O-N 3.07Å; G2296-K2300 WeakPolarHBondContact O-CA 3.37Å; G2296-K2300 WeakPolarHBondContact O-CB 3.38Å; G2296-K2300 PolarHBondContact O-N 2.81Å
2297	Q	92.1	Very high	87.3	Confident	17 Å²	17	23.4 Å²	23.4	8%	0.079	13%	0.134	C	C	.	.	H	α-helix	trans	-55.8	-45.7	-175.9	-57	-63.1	-16	0	0	113.5	G251 Y2253 D2293 F2294 T2301	G251-Q2297 PolarHBondContact O-NE2 3Å; Y2253-Q2297 HydrophobicContact CE1-CB 4.39Å; Y2253-Q2297 HydrophobicContact CE1-CG 4.01Å; Y2253-Q2297 WeakPolarHBondContact OH-CG 3.4Å; D2293-Q2297 WeakPolarHBondContact O-CG 3.5Å; D2293-Q2297 PolarHBondContact O-N 2.87Å; D2293-Q2297 PolarHBondContact OD1-NE2 2.81Å; D2293-Q2297 WeakPolarHBondContact OD2-CG 3.14Å; D2293-Q2297 PolarHBondContact OD2-NE2 2.82Å; F2294-Q2297 PolarHBondContact O-N 2.85Å; Q2297-T2301 WeakPolarHBondContact O-CB 3.28Å; Q2297-T2301 PolarHBondContact O-N 2.89Å; Q2297-T2301 PolarHBondContact O-OG1 2.98Å
2298	V	94.1	Very high	87.1	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62	-47.6	176.9	168	0	0	0	0	110.7	V2212 F2274 F2294 G2296 I2311 F2325	V2212-V2298 HydrophobicContact CG2-CB 4.42Å; V2212-V2298 HydrophobicContact CG2-CG1 3.46Å; V2212-V2298 VanDerWaalsContact CG2-CG1 3.46Å; V2212-V2298 HydrophobicContact CG2-CG2 4.03Å; F2274-V2298 HydrophobicContact CB-CG2 3.79Å; F2274-V2298 HydrophobicContact CD1-CG2 3.83Å; F2274-V2298 HydrophobicContact CD2-CG2 4.24Å; F2274-V2298 HydrophobicContact CG-CG2 3.7Å; F2294-V2298 HydrophobicContact CD1-CG2 4.21Å; F2294-V2298 HydrophobicContact CD2-CG2 4.31Å; F2294-V2298 HydrophobicContact CE1-CG2 3.74Å; F2294-V2298 HydrophobicContact CE2-CG2 3.89Å; F2294-V2298 HydrophobicContact CG-CG2 4.48Å; F2294-V2298 HydrophobicContact CZ-CG2 3.57Å; F2294-V2298 WeakPolarHBondContact O-CB 3.45Å; F2294-V2298 WeakPolarHBondContact O-CG2 3.5Å; F2294-V2298 PolarHBondContact O-N 3.48Å; G2296-V2298 PolarHBondContact O-N 3.4Å; V2298-I2311 HydrophobicContact CG1-CD1 4.15Å; V2298-I2311 HydrophobicContact CG1-CG2 4.25Å; V2298-F2325 HydrophobicContact CB-CE2 4.27Å; V2298-F2325 HydrophobicContact CB-CZ 4.05Å; V2298-F2325 HydrophobicContact CG1-CE2 4.24Å; V2298-F2325 HydrophobicContact CG1-CZ 3.65Å; V2298-F2325 HydrophobicContact CG2-CE2 4.31Å
2299	H	91	Very high	87	Confident	22 Å²	22	26.8 Å²	26.8	10%	0.102	15%	0.15	C	C	.	.	H	α-helix	trans	-62.3	-65.8	176.3	-88.3	-68.3	0	0	0	109.8	N255 R303 Y2185 L2295 G2296 T2301 K2302 S2329	N255-H2299 PolarHBondContact ND2-ND1 2.74Å; N255-H2299 WeakPolarHBondContact OD1-CB 3.14Å; R303-H2299 WeakPolarHBondContact CD-O 3.35Å; R303-H2299 WeakPolarHBondContact CG-O 3Å; R303-H2299 PolarHBondContact NE-O 3.17Å; Y2185-H2299 AromaticContact CE1-CE1 3.9Å; Y2185-H2299 PolarHBondContact OH-CE1 3.47Å; Y2185-H2299 VanDerWaalsContact OH-CE1 3.24Å; L2295-H2299 VanDerWaalsContact O-CB 3.29Å; L2295-H2299 WeakPolarHBondContact O-CB 3.13Å; L2295-H2299 PolarHBondContact O-CD2 3.19Å; L2295-H2299 VanDerWaalsContact O-CD2 3.23Å; L2295-H2299 PolarHBondContact O-N 2.76Å; G2296-H2299 CarbonylContact O-C 3.4Å; G2296-H2299 PolarHBondContact O-N 3.07Å; H2299-T2301 PolarHBondContact O-N 2.86Å; H2299-K2302 PolarHBondContact O-N 2.84Å; H2299-S2329 WeakPolarHBondContact NE2-CB 3.45Å; H2299-S2329 PolarHBondContact NE2-OG 2.86Å
2300	K	88	Confident	87.3	Confident	1 Å²	1	24.9 Å²	24.9	0%	0.004	14%	0.142	C	C	.	.	H	α-helix	trans	-32.2	-39.3	172.3	-176.9	-154.9	-147.4	-169.9	0	115.4	G251 K252 R303 L304 T305 D306 G2296	G251-K2300 PolarHBondContact O-NZ 2.82Å; K252-K2300 VanDerWaalsContact C-CE 3.48Å; K252-K2300 WeakPolarHBondContact O-CE 3.3Å; K252-K2300 PolarHBondContact O-NZ 3.4Å; R303-K2300 CarbonylContact C-O 3.57Å; R303-K2300 VanDerWaalsContact CB-O 3.27Å; R303-K2300 WeakPolarHBondContact CB-O 3.4Å; R303-K2300 VanDerWaalsContact CG-CA 3.42Å; R303-K2300 WeakPolarHBondContact CG-O 3.31Å; L304-K2300 WeakPolarHBondContact O-CE 3.5Å; L304-K2300 WeakPolarHBondContact O-CG 3.38Å; T305-K2300 HydrophobicContact CG2-CD 4.08Å; T305-K2300 HydrophobicContact CG2-CG 3.89Å; D306-K2300 VanDerWaalsContact N-NZ 3.16Å; D306-K2300 IonicContact OD1-NZ 3.82Å; G2296-K2300 WeakPolarHBondContact O-CA 3.37Å; G2296-K2300 WeakPolarHBondContact O-CB 3.38Å; G2296-K2300 PolarHBondContact O-N 2.81Å
2301	T	89.5	Confident	87.7	Confident	10 Å²	10	24.2 Å²	24.2	6%	0.061	14%	0.137	C	C	.	.	H	α-helix	trans	-65.8	-37.8	176.1	-64	0	0	0	0	112.5	I2210 F2274 Q2297 H2299 E2303 Q2304 F2305	I2210-T2301 HydrophobicContact CD1-CG2 3.66Å; F2274-T2301 HydrophobicContact CE2-CG2 3.99Å; F2274-T2301 HydrophobicContact CZ-CG2 3.85Å; F2274-T2301 VanDerWaalsContact CZ-OG1 3.24Å; F2274-T2301 WeakPolarHBondContact CZ-OG1 3.16Å; Q2297-T2301 WeakPolarHBondContact O-CB 3.28Å; Q2297-T2301 PolarHBondContact O-N 2.89Å; Q2297-T2301 PolarHBondContact O-OG1 2.98Å; H2299-T2301 PolarHBondContact O-N 2.86Å; T2301-E2303 PolarHBondContact O-N 2.82Å; T2301-Q2304 PolarHBondContact O-N 3.42Å; T2301-F2305 HydrophobicContact CG2-CD2 3.65Å; T2301-F2305 HydrophobicContact CG2-CE2 3.86Å; T2301-F2305 VanDerWaalsContact O-CD2 3.31Å; T2301-F2305 WeakPolarHBondContact O-CD2 3.35Å; T2301-F2305 PolarHBondContact O-N 3.37Å
2302	K	89	Confident	88	Confident	12 Å²	12	24.2 Å²	24.2	5%	0.052	14%	0.137	C	C	.	.	H	α-helix	trans	-86.4	-1.1	-156.3	97.9	102.9	-167.7	164.4	0	116.4	R303 I2210 H2299 Q2307 G2309 I2311	R303-K2302 PolarHBondContact NH1-O 3.1Å; I2210-K2302 HydrophobicContact CD1-CB 3.27Å; I2210-K2302 HydrophobicContact CD1-CG 4.33Å; I2210-K2302 HydrophobicContact CG1-CB 4.32Å; H2299-K2302 PolarHBondContact O-N 2.84Å; K2302-Q2307 HydrophobicContact CB-CB 4.19Å; K2302-Q2307 HydrophobicContact CD-CB 4.14Å; K2302-Q2307 WeakPolarHBondContact CD-O 3.34Å; K2302-Q2307 PolarHBondContact NZ-O 3.09Å; K2302-Q2307 WeakPolarHBondContact O-CA 3.32Å; K2302-Q2307 WeakPolarHBondContact O-CB 3.49Å; K2302-Q2307 PolarHBondContact O-N 3.42Å; K2302-G2309 PolarHBondContact NZ-O 2.89Å; K2302-I2311 HydrophobicContact CD-CD1 4.13Å; K2302-I2311 HydrophobicContact CD-CG1 3.76Å; K2302-I2311 HydrophobicContact CG-CD1 3.84Å; K2302-I2311 HydrophobicContact CG-CG1 3.96Å
2303	E	84.4	Confident	88.3	Confident	6 Å²	6	23.4 Å²	23.4	3%	0.028	13%	0.133	C	C	.	.	H	α-helix	trans	-123	-8.8	158.7	-32.8	109.2	-164.5	0	0	113.1	T301 L302 R303 T2301 F2305 G2306	T301-E2303 VanDerWaalsContact CB-OE1 3.23Å; T301-E2303 WeakPolarHBondContact CB-OE1 3.25Å; T301-E2303 VanDerWaalsContact CG2-CD 3.48Å; T301-E2303 HydrophobicContact CG2-CG 4.22Å; T301-E2303 WeakPolarHBondContact CG2-OE1 3.37Å; T301-E2303 WeakPolarHBondContact O-CB 3.5Å; T301-E2303 WeakPolarHBondContact O-CG 3.23Å; L302-E2303 VanDerWaalsContact CA-OE2 3.26Å; L302-E2303 WeakPolarHBondContact CA-OE2 3.15Å; L302-E2303 VanDerWaalsContact N-CD 3.33Å; L302-E2303 PolarHBondContact N-OE2 2.87Å; L302-E2303 VanDerWaalsContact O-OE2 3.14Å; R303-E2303 WeakPolarHBondContact CA-OE2 3.38Å; R303-E2303 VanDerWaalsContact CB-CA 3.41Å; R303-E2303 HydrophobicContact CB-CB 3.42Å; R303-E2303 VanDerWaalsContact CB-CB 3.42Å; R303-E2303 HydrophobicContact CB-CG 3.82Å; R303-E2303 WeakPolarHBondContact CB-OE2 3.48Å; R303-E2303 WeakPolarHBondContact CD-OE1 3.31Å; R303-E2303 WeakPolarHBondContact CD-OE2 3.36Å; R303-E2303 HydrophobicContact CG-CB 4.36Å; R303-E2303 HydrophobicContact CG-CG 4.29Å; R303-E2303 VanDerWaalsContact CG-OE2 3.29Å; R303-E2303 WeakPolarHBondContact CG-OE2 3.47Å; R303-E2303 IonicContact CZ-OE1 3.9Å; R303-E2303 PolarHBondContact N-OE2 2.85Å; R303-E2303 IonicContact NE-OE1 3.78Å; R303-E2303 PolarHBondContact NE-OE1 2.76Å; R303-E2303 VanDerWaalsContact NE-OE1 3.1Å; R303-E2303 IonicContact NE-OE2 3.31Å; R303-E2303 VanDerWaalsContact NH1-CG 3.32Å; R303-E2303 IonicContact NH1-OE1 2.66Å; R303-E2303 IonicContact NH2-OE1 2.73Å; R303-E2303 PolarHBondContact NH2-OE1 2.86Å; T2301-E2303 PolarHBondContact O-N 2.82Å; E2303-F2305 PolarHBondContact O-N 2.77Å; E2303-G2306 VanDerWaalsContact C-N 3.29Å; E2303-G2306 PolarHBondContact O-N 2.93Å
2304	Q	81.9	Confident	88.8	Confident	84 Å²	84	22.1 Å²	22.1	39%	0.393	13%	0.126	S	C	.	.	H	α-helix	trans	-58	-34.1	160.9	-171.8	-127.7	-7	0	0	109.4	R303 T305 T2301	R303-Q2304 WeakPolarHBondContact O-CA 3.33Å; R303-Q2304 VanDerWaalsContact O-CB 3.26Å; R303-Q2304 WeakPolarHBondContact O-CB 3.04Å; R303-Q2304 PolarHBondContact O-N 2.86Å; R303-Q2304 VanDerWaalsContact O-N 3.09Å; T305-Q2304 HydrophobicContact CG2-CB 3.8Å; T305-Q2304 HydrophobicContact CG2-CG 3.84Å; T305-Q2304 VanDerWaalsContact OG1-CG 3.25Å; T305-Q2304 WeakPolarHBondContact OG1-CG 3.37Å; T305-Q2304 PolarHBondContact OG1-NE2 2.56Å; T305-Q2304 VanDerWaalsContact OG1-NE2 3.08Å; T305-Q2304 PolarHBondContact OG1-OE1 3.35Å; T2301-Q2304 PolarHBondContact O-N 3.42Å
2305	F	82.2	Confident	88.9	Confident	75 Å²	75	22.3 Å²	22.3	33%	0.329	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	15.1	170.5	-60.5	-62.6	0	0	0	114.6	R2272 T2301 E2303 Q2307	R2272-F2305 VanDerWaalsContact NE-CE2 3.32Å; R2272-F2305 VanDerWaalsContact NH1-CG 3.34Å; T2301-F2305 HydrophobicContact CG2-CD2 3.65Å; T2301-F2305 HydrophobicContact CG2-CE2 3.86Å; T2301-F2305 VanDerWaalsContact O-CD2 3.31Å; T2301-F2305 WeakPolarHBondContact O-CD2 3.35Å; T2301-F2305 PolarHBondContact O-N 3.37Å; E2303-F2305 PolarHBondContact O-N 2.77Å; F2305-Q2307 HydrophobicContact CB-CG 4.1Å; F2305-Q2307 PolarHBondContact O-N 3.02Å; F2305-Q2307 PolarHBondContact O-NE2 3.02Å
2306	G	72	Confident	88.9	Confident	41 Å²	41	22.9 Å²	22.9	42%	0.423	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	45.3	175.3	0	0	0	0	0	116.2	E2303 D2308	E2303-G2306 VanDerWaalsContact C-N 3.29Å; E2303-G2306 PolarHBondContact O-N 2.93Å; G2306-D2308 PolarHBondContact O-N 2.73Å
2307	Q	77.9	Confident	89	Confident	36 Å²	36	22.5 Å²	22.5	17%	0.168	13%	0.127	C	C	.	.			trans	-91.9	94.9	-174.4	-56	-62.5	-41.2	0	0	111.9	N2209 K2302 F2305 G2309	N2209-Q2307 VanDerWaalsContact CB-OE1 3.29Å; N2209-Q2307 PolarHBondContact ND2-OE1 3.03Å; K2302-Q2307 HydrophobicContact CB-CB 4.19Å; K2302-Q2307 HydrophobicContact CD-CB 4.14Å; K2302-Q2307 WeakPolarHBondContact CD-O 3.34Å; K2302-Q2307 PolarHBondContact NZ-O 3.09Å; K2302-Q2307 WeakPolarHBondContact O-CA 3.32Å; K2302-Q2307 WeakPolarHBondContact O-CB 3.49Å; K2302-Q2307 PolarHBondContact O-N 3.42Å; F2305-Q2307 HydrophobicContact CB-CG 4.1Å; F2305-Q2307 PolarHBondContact O-N 3.02Å; F2305-Q2307 PolarHBondContact O-NE2 3.02Å; Q2307-G2309 PolarHBondContact O-N 2.89Å
2308	D	77	Confident	89.2	Confident	115 Å²	115	21.7 Å²	21.7	62%	0.615	12%	0.123	S	C	*	.			trans	-64.5	-29.8	173.3	-50.7	-42.1	0	0	0	112	Q296 G2306	Q296-D2308 PolarHBondContact NE2-OD1 2.81Å; Q296-D2308 PolarHBondContact NE2-OD2 1.86Å; G2306-D2308 PolarHBondContact O-N 2.73Å
2309	G	85.6	Confident	89.2	Confident	10 Å²	10	21.7 Å²	21.7	10%	0.103	12%	0.123	C	C	.	.	S	Bend	trans	-63.5	160.4	-178	0	0	0	0	0	114.7	K2302 Q2307	K2302-G2309 PolarHBondContact NZ-O 2.89Å; Q2307-G2309 PolarHBondContact O-N 2.89Å
2310	P	94.4	Very high	89.3	Confident	15 Å²	15	20.7 Å²	20.7	10%	0.097	12%	0.119	C	C	.	.	P	Polyproline II helix	trans	-69.6	152.8	-179.1	29.9	-34.4	0	0	0	111.8	K2183 A2184 I2186 L2206 S2208	K2183-P2310 WeakPolarHBondContact O-CB 3.5Å; A2184-P2310 VanDerWaalsContact O-CA 3.25Å; A2184-P2310 WeakPolarHBondContact O-CA 3.43Å; I2186-P2310 HydrophobicContact CD1-CB 4.09Å; I2186-P2310 HydrophobicContact CD1-CG 3.52Å; I2186-P2310 HydrophobicContact CG1-CB 4.01Å; I2186-P2310 HydrophobicContact CG1-CG 3.96Å; L2206-P2310 HydrophobicContact CB-CG 4.41Å; L2206-P2310 VanDerWaalsContact O-CD 3.24Å; L2206-P2310 WeakPolarHBondContact O-CD 3.4Å; S2208-P2310 WeakPolarHBondContact CA-O 3.33Å; S2208-P2310 WeakPolarHBondContact CB-O 3.5Å; S2208-P2310 PolarHBondContact OG-O 3.11Å
2311	I	97	Very high	89.7	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	122	168.5	-48	175.2	0	0	0	108.6	A2184 Y2185 I2186 I2210 V2212 V2298 K2302 I2313	A2184-I2311 PolarHBondContact O-N 3.36Å; A2184-I2311 VanDerWaalsContact O-N 3.12Å; Y2185-I2311 CarbonylContact C-O 3.35Å; Y2185-I2311 VanDerWaalsContact CA-O 3.32Å; Y2185-I2311 WeakPolarHBondContact CA-O 3.11Å; Y2185-I2311 HydrophobicContact CD1-CB 4.07Å; Y2185-I2311 HydrophobicContact CD1-CD1 4.22Å; Y2185-I2311 HydrophobicContact CD1-CG1 4.4Å; Y2185-I2311 HydrophobicContact CE1-CD1 4.04Å; I2186-I2311 PolarHBondContact N-O 3.1Å; I2210-I2311 HydrophobicContact CB-CG2 4.37Å; I2210-I2311 HydrophobicContact CG2-CG2 4.02Å; V2212-I2311 HydrophobicContact CB-CG2 4.44Å; V2212-I2311 HydrophobicContact CG2-CG2 3.44Å; V2212-I2311 VanDerWaalsContact CG2-CG2 3.44Å; V2298-I2311 HydrophobicContact CG1-CD1 4.15Å; V2298-I2311 HydrophobicContact CG1-CG2 4.25Å; K2302-I2311 HydrophobicContact CD-CD1 4.13Å; K2302-I2311 HydrophobicContact CD-CG1 3.76Å; K2302-I2311 HydrophobicContact CG-CD1 3.84Å; K2302-I2311 HydrophobicContact CG-CG1 3.96Å; I2311-I2313 HydrophobicContact CG2-CG1 4.08Å; I2311-I2313 PolarHBondContact O-N 2.77Å
2312	T	98.2	Very high	90.1	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	108.9	175.1	-69.4	0	0	0	0	110.2	I2186 T2188 F2199 M2202 I2203 S2208 I2210 V2211 V2212	I2186-T2312 CarbonylContact O-C 3.35Å; T2188-T2312 HydrophobicContact CG2-CG2 3.58Å; F2199-T2312 HydrophobicContact CE2-CG2 3.76Å; F2199-T2312 HydrophobicContact CZ-CG2 4.16Å; M2202-T2312 HydrophobicContact CE-CG2 3.66Å; I2203-T2312 HydrophobicContact CD1-CG2 4.06Å; I2203-T2312 WeakPolarHBondContact CD1-OG1 3.37Å; S2208-T2312 WeakPolarHBondContact OG-CB 3.22Å; S2208-T2312 PolarHBondContact OG-N 2.63Å; S2208-T2312 PolarHBondContact OG-OG1 2.92Å; I2210-T2312 PolarHBondContact O-N 3Å; V2211-T2312 CarbonylContact C-O 3.6Å; V2211-T2312 VanDerWaalsContact CA-O 3.31Å; V2211-T2312 WeakPolarHBondContact CA-O 3.49Å; V2212-T2312 PolarHBondContact N-O 2.82Å
2313	I	98.2	Very high	90.5	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	130.6	-178.2	-51.9	156.8	0	0	0	110.2	Y2185 I2186 T2188 V2212 L2214 I2311 T2322 F2325 L2326	Y2185-I2313 HydrophobicContact CD1-CD1 3.56Å; Y2185-I2313 HydrophobicContact CE1-CD1 4.26Å; Y2185-I2313 HydrophobicContact CG-CD1 4.07Å; I2186-I2313 PolarHBondContact O-N 2.92Å; T2188-I2313 PolarHBondContact N-O 3.48Å; V2212-I2313 HydrophobicContact CB-CB 4.27Å; V2212-I2313 HydrophobicContact CB-CG1 3.99Å; V2212-I2313 HydrophobicContact CB-CG2 4.14Å; V2212-I2313 HydrophobicContact CG1-CG1 4.45Å; V2212-I2313 HydrophobicContact CG1-CG2 3.98Å; V2212-I2313 HydrophobicContact CG2-CG1 4.29Å; V2212-I2313 CarbonylContact O-C 3.57Å; V2212-I2313 WeakPolarHBondContact O-CA 3.42Å; L2214-I2313 HydrophobicContact CD1-CG2 3.68Å; L2214-I2313 HydrophobicContact CG-CG2 4.27Å; I2311-I2313 HydrophobicContact CG2-CG1 4.08Å; I2311-I2313 PolarHBondContact O-N 2.77Å; I2313-T2322 HydrophobicContact CB-CG2 4.1Å; I2313-T2322 HydrophobicContact CG2-CG2 3.78Å; I2313-F2325 HydrophobicContact CD1-CD1 3.41Å; I2313-F2325 VanDerWaalsContact CD1-CD1 3.41Å; I2313-F2325 HydrophobicContact CD1-CE1 3.64Å; I2313-F2325 HydrophobicContact CD1-CG 4.35Å; I2313-F2325 HydrophobicContact CG1-CD1 4.18Å; I2313-F2325 HydrophobicContact CG1-CE1 4.25Å; I2313-F2325 HydrophobicContact CG2-CG 4.46Å; I2313-L2326 HydrophobicContact CD1-CD1 4.3Å; I2313-L2326 HydrophobicContact CD1-CD2 3.69Å; I2313-L2326 HydrophobicContact CD1-CG 3.87Å
2314	H	98.2	Very high	91.1	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	150.9	172.8	67	98.1	0	0	0	113.9	T2188 A2190 V2212 M2213 L2214 Y2228	T2188-H2314 HydrophobicContact CG2-CB 3.83Å; T2188-H2314 VanDerWaalsContact O-CA 3.29Å; T2188-H2314 WeakPolarHBondContact O-CA 3.2Å; T2188-H2314 WeakPolarHBondContact O-CB 3.46Å; A2190-H2314 WeakPolarHBondContact CA-ND1 3.29Å; A2190-H2314 WeakPolarHBondContact CB-ND1 3.49Å; V2212-H2314 PolarHBondContact O-CD2 2.86Å; V2212-H2314 PolarHBondContact O-N 3.31Å; M2213-H2314 VanDerWaalsContact CG-CE1 3.42Å; M2213-H2314 WeakPolarHBondContact CG-CE1 3.35Å; L2214-H2314 PolarHBondContact N-O 2.62Å; Y2228-H2314 AromaticContact CE1-CE1 3.67Å; Y2228-H2314 AromaticContact CE1-NE2 3.69Å; Y2228-H2314 AromaticContact CZ-NE2 3.6Å; Y2228-H2314 PolarHBondContact OH-NE2 2.87Å
2315	C	94.2	Very high	91.9	Very high	4 Å²	4	15.5 Å²	15.5	3%	0.027	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	-175.3	151.8	72	0	0	0	0	106.6	A2190 L2214 A2317 G2318 R2321 T2322	A2190-C2315 WeakPolarHBondContact CB-O 3.49Å; A2190-C2315 PolarHBondContact N-O 2.63Å; L2214-C2315 HydrophobicContact CB-CB 4.14Å; C2315-A2317 PolarHBondContact O-N 2.91Å; C2315-A2317 VanDerWaalsContact O-N 3.14Å; C2315-G2318 PolarHBondContact O-N 2.67Å; C2315-G2318 PolarHBondContact SG-N 2.8Å; C2315-G2318 VanDerWaalsContact SG-N 3.45Å; C2315-R2321 HydrophobicContact CB-CB 4Å; C2315-R2321 HydrophobicContact CB-CG 4.41Å; C2315-T2322 PolarHBondContact N-OG1 2.95Å
2316	S	93.6	Very high	92.6	Very high	17 Å²	17	12 Å²	12	12%	0.119	8%	0.078	C	C	.	.	S	Bend	trans	-31.2	-65	176.5	-177.6	0	0	0	0	113.9	E380 R2145 A2190 C2224	E380-S2316 WeakPolarHBondContact OE2-CB 3.43Å; R2145-S2316 VanDerWaalsContact CD-O 3.27Å; R2145-S2316 WeakPolarHBondContact CD-O 3.4Å; R2145-S2316 PolarHBondContact NE-O 2.84Å; A2190-S2316 PolarHBondContact N-O 3Å; C2224-S2316 WeakPolarHBondContact O-CA 3.35Å
2317	A	91.8	Very high	93.7	Very high	7 Å²	7	10 Å²	10	6%	0.058	6%	0.058	C	C	.	.	S	Bend	trans	-96.4	-8.5	177.1	0	0	0	0	0	115.3	L2146 I2149 C2315 V2319 R2354	L2146-A2317 HydrophobicContact CD1-CB 3.65Å; L2146-A2317 HydrophobicContact CG-CB 4.41Å; I2149-A2317 HydrophobicContact CG1-CB 4.45Å; C2315-A2317 PolarHBondContact O-N 2.91Å; C2315-A2317 VanDerWaalsContact O-N 3.14Å; A2317-V2319 HydrophobicContact CB-CG2 4Å; A2317-R2354 PolarHBondContact O-NH2 3.34Å
2318	G	94.5	Very high	94.6	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.05	C	C	.	.	S	Bend	trans	68.9	32.4	-177.9	0	0	0	0	0	115.2	T2188 C2315 T2322 R2354	T2188-G2318 WeakPolarHBondContact O-CA 3.22Å; C2315-G2318 PolarHBondContact O-N 2.67Å; C2315-G2318 PolarHBondContact SG-N 2.8Å; C2315-G2318 VanDerWaalsContact SG-N 3.45Å; G2318-T2322 WeakPolarHBondContact CA-OG1 3.23Å; G2318-R2354 PolarHBondContact O-NE 2.9Å
2319	V	95.1	Very high	95.4	Very high	0 Å²	0	3.2 Å²	3.2	0%	0	2%	0.024	C	C	.	.	S	Bend	trans	-137.1	-46.6	-176.5	-65.1	0	0	0	0	115.5	I2149 A2317 G2323 R2354 P2355 M2357 V2358	I2149-V2319 HydrophobicContact CD1-CG2 4.19Å; I2149-V2319 HydrophobicContact CG1-CG2 4.43Å; I2149-V2319 HydrophobicContact CG2-CG1 3.51Å; I2149-V2319 HydrophobicContact CG2-CG2 4.25Å; A2317-V2319 HydrophobicContact CB-CG2 4Å; V2319-G2323 VanDerWaalsContact O-CA 3.29Å; V2319-G2323 WeakPolarHBondContact O-CA 3.3Å; V2319-G2323 PolarHBondContact O-N 3.47Å; V2319-R2354 HydrophobicContact CG1-CG 4.13Å; V2319-P2355 VanDerWaalsContact CG1-O 3.23Å; V2319-P2355 WeakPolarHBondContact CG1-O 3.4Å; V2319-M2357 HydrophobicContact CB-SD 4.22Å; V2319-M2357 HydrophobicContact CG1-SD 4.15Å; V2319-M2357 WeakPolarHBondContact O-CA 3.47Å; V2319-V2358 PolarHBondContact O-N 3.45Å; V2319-V2358 VanDerWaalsContact O-N 3.12Å
2320	G	93.8	Very high	95.7	Very high	2 Å²	2	3.1 Å²	3.1	2%	0.021	2%	0.021	C	C	.	.	H	α-helix	trans	-68.9	-79.7	-178.5	0	0	0	0	0	112.4	T2322 G2323 V2324 Q2363	G2320-T2322 VanDerWaalsContact C-N 3.31Å; G2320-T2322 PolarHBondContact O-N 2.76Å; G2320-G2323 WeakPolarHBondContact O-CA 3.45Å; G2320-G2323 PolarHBondContact O-N 2.81Å; G2320-V2324 PolarHBondContact O-N 3.27Å; G2320-Q2363 VanDerWaalsContact CA-OE1 3.22Å
2321	R	96.5	Very high	95.6	Very high	4 Å²	4	2.4 Å²	2.4	2%	0.015	2%	0.016	C	C	.	.	H	α-helix	trans	-59.4	-40.5	177.8	-52.4	-177.2	173.3	161.8	-0.2	112.4	E380 L2214 E2219 W2279 P2280 C2315 G2323 V2324 F2325	E380-R2321 IonicContact OE1-CZ 3.34Å; E380-R2321 IonicContact OE1-NE 2.76Å; E380-R2321 IonicContact OE1-NH1 2.67Å; E380-R2321 IonicContact OE1-NH2 3.63Å; L2214-R2321 HydrophobicContact CB-CB 3.92Å; L2214-R2321 HydrophobicContact CD1-CB 4.13Å; L2214-R2321 WeakPolarHBondContact CD1-O 3.3Å; L2214-R2321 WeakPolarHBondContact O-CD 3.15Å; L2214-R2321 PolarHBondContact O-NH1 2.76Å; E2219-R2321 IonicContact OE1-CZ 2.68Å; E2219-R2321 IonicContact OE1-NH1 3.91Å; E2219-R2321 PolarHBondContact OE1-NH1 2.8Å; E2219-R2321 IonicContact OE1-NH2 3.62Å; E2219-R2321 IonicContact OE2-CZ 3.43Å; E2219-R2321 IonicContact OE2-NH1 3.2Å; E2219-R2321 PolarHBondContact OE2-NH1 2.8Å; E2219-R2321 IonicContact OE2-NH2 3.02Å; E2219-R2321 PolarHBondContact OE2-NH2 3.19Å; W2279-R2321 VanDerWaalsContact CD1-CZ 3.4Å; W2279-R2321 HydrophobicContact CD2-CB 4.23Å; W2279-R2321 VanDerWaalsContact CD2-CD 3.46Å; W2279-R2321 HydrophobicContact CD2-CG 3.69Å; W2279-R2321 HydrophobicContact CE3-CB 3.97Å; W2279-R2321 HydrophobicContact CE3-CG 3.97Å; W2279-R2321 HydrophobicContact CG-CG 4.27Å; W2279-R2321 HydrophobicContact CH2-CB 3.99Å; W2279-R2321 HydrophobicContact CH2-CG 4.01Å; W2279-R2321 HydrophobicContact CZ2-CB 4.25Å; W2279-R2321 HydrophobicContact CZ2-CG 3.73Å; W2279-R2321 HydrophobicContact CZ3-CB 3.85Å; W2279-R2321 HydrophobicContact CZ3-CG 4.12Å; P2280-R2321 PolarHBondContact O-NH2 3.23Å; C2315-R2321 HydrophobicContact CB-CB 4Å; C2315-R2321 HydrophobicContact CB-CG 4.41Å; R2321-G2323 VanDerWaalsContact C-N 3.29Å; R2321-G2323 PolarHBondContact O-N 2.86Å; R2321-V2324 PolarHBondContact O-N 2.89Å; R2321-V2324 VanDerWaalsContact O-N 3.14Å; R2321-F2325 PolarHBondContact O-N 2.89Å
2322	T	97.7	Very high	95.3	Very high	0 Å²	0	3.1 Å²	3.1	0%	0	2%	0.02	C	C	.	.	H	α-helix	trans	-56.6	-41.4	171.5	-57.1	0	0	0	0	112	A2187 I2313 C2315 G2318 G2320 L2326 M2357	A2187-T2322 HydrophobicContact CB-CG2 3.81Å; I2313-T2322 HydrophobicContact CB-CG2 4.1Å; I2313-T2322 HydrophobicContact CG2-CG2 3.78Å; C2315-T2322 PolarHBondContact N-OG1 2.95Å; G2318-T2322 WeakPolarHBondContact CA-OG1 3.23Å; G2320-T2322 VanDerWaalsContact C-N 3.31Å; G2320-T2322 PolarHBondContact O-N 2.76Å; T2322-L2326 HydrophobicContact CG2-CD1 3.97Å; T2322-L2326 WeakPolarHBondContact O-CB 3.19Å; T2322-L2326 WeakPolarHBondContact O-CD1 3.45Å; T2322-L2326 WeakPolarHBondContact O-CG 3.37Å; T2322-L2326 PolarHBondContact O-N 3.5Å; T2322-L2326 VanDerWaalsContact O-N 3.11Å; T2322-M2357 HydrophobicContact CG2-CE 4.37Å
2323	G	96.5	Very high	94.7	Very high	0 Å²	0	4.2 Å²	4.2	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-65.9	-39	174.5	0	0	0	0	0	113.1	V2319 G2320 R2321 L2326 A2327 V2358	V2319-G2323 VanDerWaalsContact O-CA 3.29Å; V2319-G2323 WeakPolarHBondContact O-CA 3.3Å; V2319-G2323 PolarHBondContact O-N 3.47Å; G2320-G2323 WeakPolarHBondContact O-CA 3.45Å; G2320-G2323 PolarHBondContact O-N 2.81Å; R2321-G2323 VanDerWaalsContact C-N 3.29Å; R2321-G2323 PolarHBondContact O-N 2.86Å; G2323-L2326 PolarHBondContact O-N 2.64Å; G2323-A2327 WeakPolarHBondContact O-CB 3.47Å; G2323-A2327 PolarHBondContact O-N 3.29Å; G2323-V2358 WeakPolarHBondContact O-CG2 3.36Å
2324	V	97.5	Very high	94.1	Very high	0 Å²	0	4.6 Å²	4.6	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-65.6	-43.9	176.1	172.9	0	0	0	0	111.4	W2279 F2291 G2320 R2321 L2326 A2327 L2328 V2358 Q2363 F2366	W2279-V2324 HydrophobicContact CH2-CB 3.75Å; W2279-V2324 HydrophobicContact CH2-CG1 3.77Å; W2279-V2324 HydrophobicContact CH2-CG2 3.93Å; W2279-V2324 HydrophobicContact CZ3-CB 4.35Å; W2279-V2324 HydrophobicContact CZ3-CG1 4.26Å; F2291-V2324 HydrophobicContact CE1-CG1 3.92Å; G2320-V2324 PolarHBondContact O-N 3.27Å; R2321-V2324 PolarHBondContact O-N 2.89Å; R2321-V2324 VanDerWaalsContact O-N 3.14Å; V2324-L2326 VanDerWaalsContact C-N 3.29Å; V2324-L2326 PolarHBondContact O-N 2.99Å; V2324-A2327 PolarHBondContact O-N 2.87Å; V2324-L2328 HydrophobicContact CG1-CD1 3.9Å; V2324-L2328 HydrophobicContact CG1-CG 4.48Å; V2324-L2328 WeakPolarHBondContact O-CB 3.38Å; V2324-L2328 WeakPolarHBondContact O-CG 3.21Å; V2324-L2328 PolarHBondContact O-N 2.81Å; V2324-V2358 HydrophobicContact CG2-CG1 4.36Å; V2324-V2358 HydrophobicContact CG2-CG2 4.18Å; V2324-Q2363 HydrophobicContact CG2-CB 3.62Å; V2324-Q2363 HydrophobicContact CG2-CG 4Å; V2324-F2366 HydrophobicContact CG1-CD1 3.68Å; V2324-F2366 HydrophobicContact CG1-CE1 3.81Å
2325	F	97.5	Very high	93.5	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-56	-45.9	174.2	-174.7	-78.1	0	0	0	111.3	Y2185 V2212 L2214 F2291 F2294 L2295 V2298 I2313 R2321 S2329	Y2185-F2325 HydrophobicContact CE1-CE1 4.34Å; V2212-F2325 HydrophobicContact CG1-CD2 4.2Å; V2212-F2325 HydrophobicContact CG1-CE2 4.05Å; L2214-F2325 HydrophobicContact CD1-CB 3.79Å; L2214-F2325 HydrophobicContact CD1-CD2 4.46Å; L2214-F2325 HydrophobicContact CD1-CG 4.38Å; L2214-F2325 HydrophobicContact CD2-CD2 4.23Å; F2291-F2325 HydrophobicContact CE1-CB 4.47Å; F2291-F2325 HydrophobicContact CZ-CB 3.97Å; F2291-F2325 AromaticContact CZ-CD2 3.97Å; F2291-F2325 HydrophobicContact CZ-CD2 3.97Å; F2291-F2325 HydrophobicContact CZ-CG 4.44Å; F2294-F2325 HydrophobicContact CD1-CD2 4.29Å; F2294-F2325 HydrophobicContact CD1-CE2 4.01Å; F2294-F2325 HydrophobicContact CE1-CD2 4.06Å; F2294-F2325 AromaticContact CE1-CE2 3.76Å; F2294-F2325 HydrophobicContact CE1-CE2 3.76Å; L2295-F2325 HydrophobicContact CD2-CD1 4.02Å; L2295-F2325 HydrophobicContact CD2-CD2 3.56Å; L2295-F2325 HydrophobicContact CD2-CE1 4.01Å; L2295-F2325 HydrophobicContact CD2-CE2 3.56Å; L2295-F2325 HydrophobicContact CD2-CG 3.79Å; L2295-F2325 HydrophobicContact CD2-CZ 3.77Å; L2295-F2325 WeakPolarHBondContact CD2-O 3.4Å; L2295-F2325 HydrophobicContact CG-CD2 4.24Å; L2295-F2325 HydrophobicContact CG-CE2 4.2Å; V2298-F2325 HydrophobicContact CB-CE2 4.27Å; V2298-F2325 HydrophobicContact CB-CZ 4.05Å; V2298-F2325 HydrophobicContact CG1-CE2 4.24Å; V2298-F2325 HydrophobicContact CG1-CZ 3.65Å; V2298-F2325 HydrophobicContact CG2-CE2 4.31Å; I2313-F2325 HydrophobicContact CD1-CD1 3.41Å; I2313-F2325 VanDerWaalsContact CD1-CD1 3.41Å; I2313-F2325 HydrophobicContact CD1-CE1 3.64Å; I2313-F2325 HydrophobicContact CD1-CG 4.35Å; I2313-F2325 HydrophobicContact CG1-CD1 4.18Å; I2313-F2325 HydrophobicContact CG1-CE1 4.25Å; I2313-F2325 HydrophobicContact CG2-CG 4.46Å; R2321-F2325 PolarHBondContact O-N 2.89Å; F2325-S2329 WeakPolarHBondContact CE1-OG 3.3Å; F2325-S2329 VanDerWaalsContact O-CB 3.31Å; F2325-S2329 WeakPolarHBondContact O-CB 3.46Å; F2325-S2329 PolarHBondContact O-N 3.04Å; F2325-S2329 PolarHBondContact O-OG 2.7Å
2326	L	97	Very high	92.8	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-72.5	-43.3	-178.1	-74.4	163.9	0	0	0	112.7	V2176 Y2185 A2187 I2313 T2322 G2323 V2324 L2328 S2329 I2330 L2350 M2357	V2176-L2326 HydrophobicContact CB-CD1 4.48Å; V2176-L2326 HydrophobicContact CG1-CD1 4.28Å; V2176-L2326 HydrophobicContact CG1-CD2 4.33Å; V2176-L2326 HydrophobicContact CG2-CD1 4.38Å; Y2185-L2326 HydrophobicContact CD1-CD2 3.7Å; Y2185-L2326 HydrophobicContact CD2-CD2 3.14Å; Y2185-L2326 HydrophobicContact CE1-CD2 3.98Å; Y2185-L2326 HydrophobicContact CE2-CD2 3.43Å; Y2185-L2326 VanDerWaalsContact CE2-CD2 3.43Å; Y2185-L2326 HydrophobicContact CG-CD2 3.28Å; A2187-L2326 HydrophobicContact CB-CD1 4.21Å; I2313-L2326 HydrophobicContact CD1-CD1 4.3Å; I2313-L2326 HydrophobicContact CD1-CD2 3.69Å; I2313-L2326 HydrophobicContact CD1-CG 3.87Å; T2322-L2326 HydrophobicContact CG2-CD1 3.97Å; T2322-L2326 WeakPolarHBondContact O-CB 3.19Å; T2322-L2326 WeakPolarHBondContact O-CD1 3.45Å; T2322-L2326 WeakPolarHBondContact O-CG 3.37Å; T2322-L2326 PolarHBondContact O-N 3.5Å; T2322-L2326 VanDerWaalsContact O-N 3.11Å; G2323-L2326 PolarHBondContact O-N 2.64Å; V2324-L2326 VanDerWaalsContact C-N 3.29Å; V2324-L2326 PolarHBondContact O-N 2.99Å; L2326-L2328 VanDerWaalsContact C-N 3.35Å; L2326-L2328 PolarHBondContact O-N 3.07Å; L2326-S2329 PolarHBondContact O-N 2.97Å; L2326-I2330 VanDerWaalsContact O-CG1 3.29Å; L2326-I2330 WeakPolarHBondContact O-CG1 3.35Å; L2326-I2330 PolarHBondContact O-N 3.02Å; L2326-L2350 HydrophobicContact CB-CD1 3.95Å; L2326-L2350 HydrophobicContact CB-CD2 3.94Å; L2326-M2357 HydrophobicContact CD1-CE 3.39Å
2327	A	96.5	Very high	91.7	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-60.8	-44.8	177.2	0	0	0	0	0	111	G2323 V2324 I2330 V2331 M2343 I2347 L2350 V2358	G2323-A2327 WeakPolarHBondContact O-CB 3.47Å; G2323-A2327 PolarHBondContact O-N 3.29Å; V2324-A2327 PolarHBondContact O-N 2.87Å; A2327-I2330 PolarHBondContact O-N 2.88Å; A2327-V2331 WeakPolarHBondContact O-CB 3.3Å; A2327-V2331 WeakPolarHBondContact O-CG2 3.38Å; A2327-V2331 PolarHBondContact O-N 2.98Å; A2327-M2343 HydrophobicContact CB-SD 4.27Å; A2327-I2347 HydrophobicContact CB-CD1 4.11Å; A2327-I2347 HydrophobicContact CB-CG1 3.75Å; A2327-L2350 HydrophobicContact CB-CD1 3.92Å; A2327-V2358 HydrophobicContact CB-CG2 4.19Å
2328	L	96.4	Very high	90.8	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-70	-41.6	176	-71.2	176.1	0	0	0	112.4	F2291 L2295 V2324 L2326 I2330 V2331 L2332 M2343 F2366 C2367 A2370 V2371	F2291-L2328 HydrophobicContact CD1-CD1 3.87Å; F2291-L2328 HydrophobicContact CE1-CD1 4.04Å; L2295-L2328 HydrophobicContact CD1-CB 3.56Å; L2295-L2328 HydrophobicContact CD1-CD1 3.94Å; L2295-L2328 HydrophobicContact CD1-CG 4.4Å; V2324-L2328 HydrophobicContact CG1-CD1 3.9Å; V2324-L2328 HydrophobicContact CG1-CG 4.48Å; V2324-L2328 WeakPolarHBondContact O-CB 3.38Å; V2324-L2328 WeakPolarHBondContact O-CG 3.21Å; V2324-L2328 PolarHBondContact O-N 2.81Å; L2326-L2328 VanDerWaalsContact C-N 3.35Å; L2326-L2328 PolarHBondContact O-N 3.07Å; L2328-I2330 PolarHBondContact O-N 3.36Å; L2328-V2331 PolarHBondContact O-N 3.13Å; L2328-L2332 HydrophobicContact CB-CD1 3.98Å; L2328-L2332 HydrophobicContact CB-CG 4.36Å; L2328-L2332 HydrophobicContact CD2-CD1 4.42Å; L2328-L2332 HydrophobicContact CD2-CD2 4.44Å; L2328-L2332 HydrophobicContact CD2-CG 4.34Å; L2328-L2332 WeakPolarHBondContact O-CB 3.41Å; L2328-L2332 WeakPolarHBondContact O-CD1 3.32Å; L2328-L2332 WeakPolarHBondContact O-CG 3.19Å; L2328-L2332 PolarHBondContact O-N 2.93Å; L2328-M2343 HydrophobicContact CD2-CE 4.49Å; L2328-F2366 HydrophobicContact CD1-CD1 4.42Å; L2328-F2366 HydrophobicContact CD1-CE1 4.01Å; L2328-C2367 HydrophobicContact CD2-CB 4.27Å; L2328-C2367 WeakPolarHBondContact CD2-O 3.49Å; L2328-A2370 HydrophobicContact CD1-CB 3.66Å; L2328-A2370 HydrophobicContact CD2-CB 3.74Å; L2328-A2370 HydrophobicContact CG-CB 4.38Å; L2328-V2371 HydrophobicContact CD2-CG2 3.72Å
2329	S	93.7	Very high	89.9	Confident	9 Å²	9	9.3 Å²	9.3	6%	0.063	5%	0.047	C	C	.	.	H	α-helix	trans	-53.6	-44.1	173.5	-63.7	0	0	0	0	111.9	Y2185 L2295 H2299 F2325 L2326 E2333	Y2185-S2329 WeakPolarHBondContact OH-CB 3.32Å; L2295-S2329 VanDerWaalsContact CD2-OG 3.32Å; L2295-S2329 WeakPolarHBondContact CD2-OG 3.38Å; H2299-S2329 WeakPolarHBondContact NE2-CB 3.45Å; H2299-S2329 PolarHBondContact NE2-OG 2.86Å; F2325-S2329 WeakPolarHBondContact CE1-OG 3.3Å; F2325-S2329 VanDerWaalsContact O-CB 3.31Å; F2325-S2329 WeakPolarHBondContact O-CB 3.46Å; F2325-S2329 PolarHBondContact O-N 3.04Å; F2325-S2329 PolarHBondContact O-OG 2.7Å; L2326-S2329 PolarHBondContact O-N 2.97Å; S2329-E2333 VanDerWaalsContact O-CB 3.26Å; S2329-E2333 WeakPolarHBondContact O-CB 3.49Å; S2329-E2333 PolarHBondContact O-N 2.84Å
2330	I	92.1	Very high	89.4	Confident	7 Å²	7	10.5 Å²	10.5	4%	0.036	5%	0.053	C	C	.	.	H	α-helix	trans	-74.8	-47.7	-178.8	-64.7	167.8	0	0	0	111.8	L2326 A2327 L2328 E2333 R2334 T2346 L2350	L2326-I2330 VanDerWaalsContact O-CG1 3.29Å; L2326-I2330 WeakPolarHBondContact O-CG1 3.35Å; L2326-I2330 PolarHBondContact O-N 3.02Å; A2327-I2330 PolarHBondContact O-N 2.88Å; L2328-I2330 PolarHBondContact O-N 3.36Å; I2330-E2333 PolarHBondContact O-N 3.14Å; I2330-R2334 VanDerWaalsContact O-CB 3.31Å; I2330-R2334 WeakPolarHBondContact O-CB 3.49Å; I2330-R2334 PolarHBondContact O-N 2.96Å; I2330-T2346 HydrophobicContact CB-CG2 3.8Å; I2330-T2346 HydrophobicContact CD1-CG2 4.29Å; I2330-T2346 HydrophobicContact CG2-CG2 3.54Å; I2330-L2350 HydrophobicContact CD1-CD2 3.9Å; I2330-L2350 HydrophobicContact CD1-CG 4.4Å
2331	V	92.5	Very high	89.2	Confident	1 Å²	1	10.5 Å²	10.5	1%	0.006	5%	0.053	C	C	.	.	H	α-helix	trans	-72.2	-39.4	-176	176.9	0	0	0	0	112.4	A2327 L2328 E2333 R2334 M2335 V2341 M2343 T2346 V2371	A2327-V2331 WeakPolarHBondContact O-CB 3.3Å; A2327-V2331 WeakPolarHBondContact O-CG2 3.38Å; A2327-V2331 PolarHBondContact O-N 2.98Å; L2328-V2331 PolarHBondContact O-N 3.13Å; V2331-E2333 VanDerWaalsContact C-N 3.3Å; V2331-E2333 PolarHBondContact O-N 2.88Å; V2331-R2334 PolarHBondContact O-N 2.89Å; V2331-M2335 VanDerWaalsContact O-CB 3.3Å; V2331-M2335 WeakPolarHBondContact O-CB 3.22Å; V2331-M2335 PolarHBondContact O-N 3.34Å; V2331-V2341 HydrophobicContact CG1-CB 4.48Å; V2331-V2341 HydrophobicContact CG1-CG1 3.86Å; V2331-V2341 HydrophobicContact CG1-CG2 4.34Å; V2331-M2343 HydrophobicContact CB-CE 4.01Å; V2331-M2343 HydrophobicContact CG1-CE 3.94Å; V2331-M2343 HydrophobicContact CG2-CE 3.8Å; V2331-M2343 HydrophobicContact CG2-SD 3.91Å; V2331-T2346 HydrophobicContact CG2-CG2 3.85Å; V2331-T2346 WeakPolarHBondContact CG2-OG1 3.34Å; V2331-V2371 HydrophobicContact CB-CG2 4.22Å; V2331-V2371 HydrophobicContact CG1-CG1 4.06Å; V2331-V2371 HydrophobicContact CG1-CG2 3.61Å
2332	L	90.7	Very high	88.9	Confident	15 Å²	15	10.3 Å²	10.3	8%	0.079	5%	0.052	C	C	.	.	H	α-helix	trans	-66.9	-36	177.7	-57.2	172.3	0	0	0	110.5	L2295 L2328 R2336 V2371 Y2374	L2295-L2332 HydrophobicContact CD1-CD1 4.16Å; L2328-L2332 HydrophobicContact CB-CD1 3.98Å; L2328-L2332 HydrophobicContact CB-CG 4.36Å; L2328-L2332 HydrophobicContact CD2-CD1 4.42Å; L2328-L2332 HydrophobicContact CD2-CD2 4.44Å; L2328-L2332 HydrophobicContact CD2-CG 4.34Å; L2328-L2332 WeakPolarHBondContact O-CB 3.41Å; L2328-L2332 WeakPolarHBondContact O-CD1 3.32Å; L2328-L2332 WeakPolarHBondContact O-CG 3.19Å; L2328-L2332 PolarHBondContact O-N 2.93Å; L2332-R2336 WeakPolarHBondContact O-CD 3.33Å; L2332-R2336 VanDerWaalsContact O-CG 3.24Å; L2332-R2336 WeakPolarHBondContact O-CG 3.4Å; L2332-R2336 PolarHBondContact O-N 3.11Å; L2332-V2371 HydrophobicContact CD2-CB 4.25Å; L2332-V2371 HydrophobicContact CD2-CG2 3.77Å; L2332-Y2374 HydrophobicContact CB-CD1 3.99Å; L2332-Y2374 HydrophobicContact CB-CE1 4.01Å; L2332-Y2374 HydrophobicContact CD2-CD1 3.43Å; L2332-Y2374 VanDerWaalsContact CD2-CD1 3.43Å; L2332-Y2374 HydrophobicContact CD2-CE1 4.31Å; L2332-Y2374 HydrophobicContact CD2-CG 3.78Å; L2332-Y2374 HydrophobicContact CG-CD1 4.17Å
2333	E	85.2	Confident	88.7	Confident	23 Å²	23	10.3 Å²	10.3	11%	0.107	5%	0.052	C	C	.	.	H	α-helix	trans	-69.5	-44.6	172.6	-164	173.1	-146.9	0	0	112	Y2179 R2180 S2329 I2330 V2331 M2335 R2336 H2337	Y2179-E2333 HydrophobicContact CD1-CB 4.17Å; Y2179-E2333 HydrophobicContact CD1-CG 3.73Å; Y2179-E2333 HydrophobicContact CE1-CG 4.47Å; R2180-E2333 WeakPolarHBondContact CD-OE1 2.92Å; R2180-E2333 IonicContact CZ-OE1 3.11Å; R2180-E2333 IonicContact NE-OE1 3.3Å; R2180-E2333 IonicContact NH1-OE1 2.75Å; R2180-E2333 PolarHBondContact NH1-OE1 2.67Å; S2329-E2333 VanDerWaalsContact O-CB 3.26Å; S2329-E2333 WeakPolarHBondContact O-CB 3.49Å; S2329-E2333 PolarHBondContact O-N 2.84Å; I2330-E2333 PolarHBondContact O-N 3.14Å; V2331-E2333 VanDerWaalsContact C-N 3.3Å; V2331-E2333 PolarHBondContact O-N 2.88Å; E2333-M2335 PolarHBondContact O-N 3.16Å; E2333-R2336 PolarHBondContact O-N 3.41Å; E2333-H2337 PolarHBondContact O-N 3.04Å; E2333-H2337 PolarHBondContact O-ND1 3.06Å
2334	R	85.1	Confident	88.5	Confident	8 Å²	8	10.4 Å²	10.4	3%	0.03	5%	0.052	C	C	.	.	H	α-helix	trans	-60.1	-45.8	175.9	-174.9	171.7	-171.8	-145.5	-8.6	112.2	E2091 Y2179 I2330 V2331 R2336 H2337 E2338 I2340	E2091-R2334 IonicContact OE2-CZ 3.2Å; E2091-R2334 IonicContact OE2-NH1 2.75Å; E2091-R2334 PolarHBondContact OE2-NH1 3.36Å; E2091-R2334 IonicContact OE2-NH2 3.78Å; E2091-R2334 PolarHBondContact OE2-NH2 3.31Å; Y2179-R2334 HydrophobicContact CD2-CB 3.77Å; Y2179-R2334 HydrophobicContact CD2-CG 4.11Å; Y2179-R2334 HydrophobicContact CE2-CB 3.66Å; Y2179-R2334 HydrophobicContact CE2-CG 3.56Å; Y2179-R2334 HydrophobicContact CG-CB 4.33Å; I2330-R2334 VanDerWaalsContact O-CB 3.31Å; I2330-R2334 WeakPolarHBondContact O-CB 3.49Å; I2330-R2334 PolarHBondContact O-N 2.96Å; V2331-R2334 PolarHBondContact O-N 2.89Å; R2334-R2336 VanDerWaalsContact C-N 3.28Å; R2334-R2336 PolarHBondContact O-N 2.64Å; R2334-H2337 PolarHBondContact O-N 2.89Å; R2334-H2337 VanDerWaalsContact O-N 3.17Å; R2334-E2338 HydrophobicContact CG-CB 4.45Å; R2334-E2338 HydrophobicContact CG-CG 4.26Å; R2334-E2338 IonicContact CZ-OE2 3.74Å; R2334-E2338 VanDerWaalsContact CZ-OE2 3.32Å; R2334-E2338 IonicContact NE-OE2 2.72Å; R2334-E2338 PolarHBondContact NE-OE2 2.92Å; R2334-E2338 IonicContact NH2-OE2 2.77Å; R2334-E2338 PolarHBondContact NH2-OE2 2.78Å; R2334-E2338 WeakPolarHBondContact O-CB 3.28Å; R2334-E2338 PolarHBondContact O-N 2.96Å; R2334-I2340 VanDerWaalsContact NH2-CD1 3.35Å
2335	M	86	Confident	88.1	Confident	4 Å²	4	10.6 Å²	10.6	2%	0.02	5%	0.054	C	C	.	.	H	α-helix	trans	-60.9	-36.9	-179.3	-170.7	177.6	74.4	0	0	112.1	A2094 V2331 E2333 H2337 G2339 I2340 V2341 V2371 Y2374 L2375	A2094-M2335 HydrophobicContact CB-CG 4.08Å; A2094-M2335 HydrophobicContact CB-SD 4.17Å; V2331-M2335 VanDerWaalsContact O-CB 3.3Å; V2331-M2335 WeakPolarHBondContact O-CB 3.22Å; V2331-M2335 PolarHBondContact O-N 3.34Å; E2333-M2335 PolarHBondContact O-N 3.16Å; M2335-H2337 PolarHBondContact O-N 2.86Å; M2335-G2339 WeakPolarHBondContact O-CA 3.37Å; M2335-G2339 PolarHBondContact O-N 2.82Å; M2335-I2340 WeakPolarHBondContact CA-O 3.37Å; M2335-V2341 HydrophobicContact CB-CG2 4.16Å; M2335-V2341 HydrophobicContact CG-CG2 3.86Å; M2335-V2341 HydrophobicContact SD-CG2 3.61Å; M2335-V2371 HydrophobicContact CE-CG1 4.21Å; M2335-V2371 HydrophobicContact SD-CG1 3.59Å; M2335-V2371 VanDerWaalsContact SD-CG1 3.59Å; M2335-Y2374 HydrophobicContact CE-CD1 3.78Å; M2335-L2375 HydrophobicContact CE-CB 3.89Å; M2335-L2375 HydrophobicContact CE-CD1 4.08Å; M2335-L2375 HydrophobicContact SD-CB 4.22Å; M2335-L2375 HydrophobicContact SD-CD1 4.04Å
2336	R	79.2	Confident	87.8	Confident	52 Å²	52	10.9 Å²	10.9	20%	0.196	6%	0.055	C	C	.	.	H	α-helix	trans	-64.7	-35.5	176.6	-72.8	164.4	62.8	138.7	-5.3	113.8	T254 L2332 E2333 R2334 Y2374 F2378 Y2381	T254-R2336 PolarHBondContact OG1-NH1 3.02Å; T254-R2336 PolarHBondContact OG1-NH2 2.8Å; L2332-R2336 WeakPolarHBondContact O-CD 3.33Å; L2332-R2336 VanDerWaalsContact O-CG 3.24Å; L2332-R2336 WeakPolarHBondContact O-CG 3.4Å; L2332-R2336 PolarHBondContact O-N 3.11Å; E2333-R2336 PolarHBondContact O-N 3.41Å; R2334-R2336 VanDerWaalsContact C-N 3.28Å; R2334-R2336 PolarHBondContact O-N 2.64Å; R2336-Y2374 WeakPolarHBondContact CD-OH 3.27Å; R2336-Y2374 HydrophobicContact CG-CE1 4.06Å; R2336-Y2374 PolarHBondContact NH1-OH 3.16Å; R2336-F2378 HydrophobicContact CG-CZ 4.19Å; R2336-Y2381 PolarHBondContact O-OH 3.08Å
2337	H	70.6	Confident	87.7	Confident	37 Å²	37	10.9 Å²	10.9	17%	0.171	6%	0.055	C	C	.	.	H	α-helix	trans	-100.8	-22.1	-173.4	-58.2	98	0	0	0	113.9	Y2179 R2180 E2333 R2334 M2335	Y2179-H2337 HydrophobicContact CE1-CB 4.21Å; Y2179-H2337 AromaticContact CE1-ND1 3.95Å; R2180-H2337 VanDerWaalsContact CZ-CE1 3.49Å; R2180-H2337 PolarHBondContact NH1-CE1 2.78Å; R2180-H2337 PolarHBondContact NH1-NE2 2.98Å; R2180-H2337 PolarHBondContact NH2-CD2 3.27Å; R2180-H2337 PolarHBondContact NH2-CE1 3.01Å; R2180-H2337 VanDerWaalsContact NH2-CE1 3.3Å; R2180-H2337 PolarHBondContact NH2-NE2 3.35Å; E2333-H2337 PolarHBondContact O-N 3.04Å; E2333-H2337 PolarHBondContact O-ND1 3.06Å; R2334-H2337 PolarHBondContact O-N 2.89Å; R2334-H2337 VanDerWaalsContact O-N 3.17Å; M2335-H2337 PolarHBondContact O-N 2.86Å
2338	E	72.9	Confident	87.4	Confident	18 Å²	18	11.2 Å²	11.2	8%	0.084	6%	0.057	C	C	.	.	H	α-helix	trans	-117.6	-15	-177.6	-55.8	-157.8	131.6	0	0	114.3	R1997 Y2179 R2334 I2340	R1997-E2338 WeakPolarHBondContact CD-OE1 3.46Å; R1997-E2338 IonicContact CZ-OE1 3.23Å; R1997-E2338 VanDerWaalsContact CZ-OE1 3.24Å; R1997-E2338 IonicContact NE-OE1 3.52Å; R1997-E2338 PolarHBondContact NE-OE1 2.88Å; R1997-E2338 IonicContact NH1-OE1 2.8Å; R1997-E2338 IonicContact NH2-OE1 3.82Å; Y2179-E2338 WeakPolarHBondContact OH-CG 3.28Å; R2334-E2338 HydrophobicContact CG-CB 4.45Å; R2334-E2338 HydrophobicContact CG-CG 4.26Å; R2334-E2338 IonicContact CZ-OE2 3.74Å; R2334-E2338 VanDerWaalsContact CZ-OE2 3.32Å; R2334-E2338 IonicContact NE-OE2 2.72Å; R2334-E2338 PolarHBondContact NE-OE2 2.92Å; R2334-E2338 IonicContact NH2-OE2 2.77Å; R2334-E2338 PolarHBondContact NH2-OE2 2.78Å; R2334-E2338 WeakPolarHBondContact O-CB 3.28Å; R2334-E2338 PolarHBondContact O-N 2.96Å; E2338-I2340 HydrophobicContact CB-CD1 3.85Å; E2338-I2340 HydrophobicContact CB-CG1 3.7Å; E2338-I2340 PolarHBondContact O-N 2.82Å; E2338-I2340 WeakPolarHBondContact OE2-CD1 3.35Å
2339	G	76.3	Confident	87	Confident	16 Å²	16	12 Å²	12	17%	0.165	6%	0.06	C	C	.	.	S	Bend	trans	68.1	18.7	-176.3	0	0	0	0	0	114.2	A2094 M2335	A2094-G2339 WeakPolarHBondContact CB-O 3.24Å; A2094-G2339 PolarHBondContact N-O 3.07Å; M2335-G2339 WeakPolarHBondContact O-CA 3.37Å; M2335-G2339 PolarHBondContact O-N 2.82Å
2340	I	84.5	Confident	87	Confident	24 Å²	24	11.7 Å²	11.7	12%	0.123	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	156.6	-175.8	68.5	-163.6	0	0	0	111.7	E2091 V2092 R2334 M2335 E2338	E2091-I2340 HydrophobicContact CG-CB 4.31Å; E2091-I2340 HydrophobicContact CG-CD1 4.21Å; E2091-I2340 HydrophobicContact CG-CG1 4.4Å; V2092-I2340 CarbonylContact O-C 3.03Å; V2092-I2340 WeakPolarHBondContact O-CA 3.22Å; R2334-I2340 VanDerWaalsContact NH2-CD1 3.35Å; M2335-I2340 WeakPolarHBondContact CA-O 3.37Å; E2338-I2340 HydrophobicContact CB-CD1 3.85Å; E2338-I2340 HydrophobicContact CB-CG1 3.7Å; E2338-I2340 PolarHBondContact O-N 2.82Å; E2338-I2340 WeakPolarHBondContact OE2-CD1 3.35Å
2341	V	89	Confident	87.1	Confident	2 Å²	2	12.1 Å²	12.1	1%	0.012	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	129.1	-176.3	173.2	0	0	0	0	108.7	V2092 L2097 V2331 M2335 V2371	V2092-V2341 PolarHBondContact N-O 3.17Å; V2092-V2341 PolarHBondContact O-N 2.93Å; L2097-V2341 HydrophobicContact CD1-CB 4.26Å; L2097-V2341 HydrophobicContact CD1-CG1 3.97Å; L2097-V2341 HydrophobicContact CD1-CG2 4.49Å; L2097-V2341 HydrophobicContact CD2-CG2 4.36Å; V2331-V2341 HydrophobicContact CG1-CB 4.48Å; V2331-V2341 HydrophobicContact CG1-CG1 3.86Å; V2331-V2341 HydrophobicContact CG1-CG2 4.34Å; M2335-V2341 HydrophobicContact CB-CG2 4.16Å; M2335-V2341 HydrophobicContact CG-CG2 3.86Å; M2335-V2341 HydrophobicContact SD-CG2 3.61Å; V2341-V2371 HydrophobicContact CG1-CG1 4.19Å; V2341-V2371 HydrophobicContact CG2-CG1 3.69Å
2342	D	89.5	Confident	86.9	Confident	1 Å²	1	12.1 Å²	12.1	1%	0.005	6%	0.059	C	C	.	.			trans	-139.7	85.3	170.5	-168.1	-24.4	0	0	0	108.2	R1996 T2090 E2091 Q2345 T2346	R1996-D2342 IonicContact CZ-OD2 3.52Å; R1996-D2342 IonicContact NH1-OD2 3.71Å; R1996-D2342 PolarHBondContact NH1-OD2 2.65Å; T2090-D2342 VanDerWaalsContact CB-OD1 3.29Å; T2090-D2342 WeakPolarHBondContact CB-OD1 3.48Å; T2090-D2342 VanDerWaalsContact OG1-CG 3.22Å; T2090-D2342 PolarHBondContact OG1-OD1 2.94Å; T2090-D2342 PolarHBondContact OG1-OD2 3.26Å; T2090-D2342 VanDerWaalsContact OG1-OD2 3.12Å; E2091-D2342 HydrophobicContact CB-CB 4.25Å; E2091-D2342 HydrophobicContact CG-CB 4.42Å; D2342-Q2345 WeakPolarHBondContact OD1-CB 3.5Å; D2342-Q2345 PolarHBondContact OD1-N 2.84Å; D2342-Q2345 WeakPolarHBondContact OD2-CG 3.28Å; D2342-T2346 WeakPolarHBondContact O-CB 3.47Å; D2342-T2346 PolarHBondContact O-N 3.25Å; D2342-T2346 PolarHBondContact O-OG1 3.44Å
2343	M	94	Very high	87	Confident	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-70	-42.1	-175.3	-171.7	59	67.3	0	0	111.3	A2327 L2328 V2331 T2346 I2347 Y2364 C2367 Y2368 V2371	A2327-M2343 HydrophobicContact CB-SD 4.27Å; L2328-M2343 HydrophobicContact CD2-CE 4.49Å; V2331-M2343 HydrophobicContact CB-CE 4.01Å; V2331-M2343 HydrophobicContact CG1-CE 3.94Å; V2331-M2343 HydrophobicContact CG2-CE 3.8Å; V2331-M2343 HydrophobicContact CG2-SD 3.91Å; M2343-T2346 PolarHBondContact O-N 2.99Å; M2343-I2347 HydrophobicContact CG-CD1 3.87Å; M2343-I2347 PolarHBondContact O-N 3.43Å; M2343-I2347 HydrophobicContact SD-CD1 3.79Å; M2343-I2347 HydrophobicContact SD-CG1 4.34Å; M2343-Y2364 HydrophobicContact CG-CD2 4.33Å; M2343-Y2364 HydrophobicContact CG-CE2 3.88Å; M2343-C2367 HydrophobicContact CE-CB 3.64Å; M2343-C2367 HydrophobicContact CG-CB 4.26Å; M2343-C2367 HydrophobicContact SD-CB 3.59Å; M2343-C2367 VanDerWaalsContact SD-CB 3.59Å; M2343-Y2368 HydrophobicContact CB-CD2 4.1Å; M2343-Y2368 HydrophobicContact CB-CE1 4.23Å; M2343-Y2368 HydrophobicContact CB-CE2 3.42Å; M2343-Y2368 VanDerWaalsContact CB-CE2 3.42Å; M2343-Y2368 HydrophobicContact CG-CD2 3.84Å; M2343-Y2368 HydrophobicContact CG-CE2 3.5Å; M2343-Y2368 VanDerWaalsContact CG-CE2 3.5Å; M2343-V2371 HydrophobicContact CE-CG2 3.58Å
2344	F	92.7	Very high	87.4	Confident	1 Å²	1	10.6 Å²	10.6	0%	0.004	5%	0.051	C	C	.	.	H	α-helix	trans	-56.6	-54.8	178.2	-176.5	-88	0	0	0	111.5	A2087 T2090 E2118 K2121 L2122 T2346 I2347 R2348	A2087-F2344 HydrophobicContact CB-CD1 4.24Å; A2087-F2344 HydrophobicContact CB-CE1 3.59Å; A2087-F2344 HydrophobicContact CB-CZ 4.48Å; T2090-F2344 HydrophobicContact CG2-CB 3.7Å; T2090-F2344 HydrophobicContact CG2-CD1 3.9Å; T2090-F2344 HydrophobicContact CG2-CG 3.8Å; E2118-F2344 HydrophobicContact CB-CD2 4.08Å; E2118-F2344 HydrophobicContact CB-CE2 4.43Å; E2118-F2344 HydrophobicContact CG-CD2 4.24Å; E2118-F2344 WeakPolarHBondContact O-CE2 3.47Å; K2121-F2344 HydrophobicContact CB-CE2 3.91Å; K2121-F2344 HydrophobicContact CB-CZ 4.05Å; K2121-F2344 HydrophobicContact CD-CE2 4.49Å; K2121-F2344 HydrophobicContact CD-CZ 4.37Å; L2122-F2344 HydrophobicContact CD1-CD2 4.03Å; L2122-F2344 HydrophobicContact CD1-CE2 4.4Å; L2122-F2344 HydrophobicContact CD2-CD2 3.96Å; L2122-F2344 HydrophobicContact CD2-CE1 4.45Å; L2122-F2344 HydrophobicContact CD2-CE2 3.86Å; L2122-F2344 HydrophobicContact CD2-CG 4.32Å; L2122-F2344 HydrophobicContact CD2-CZ 4.12Å; L2122-F2344 HydrophobicContact CG-CD2 3.8Å; L2122-F2344 HydrophobicContact CG-CE2 3.69Å; L2122-F2344 HydrophobicContact CG-CZ 4.38Å; F2344-T2346 VanDerWaalsContact C-N 3.31Å; F2344-T2346 PolarHBondContact O-N 2.93Å; F2344-I2347 PolarHBondContact O-N 2.92Å; F2344-R2348 VanDerWaalsContact O-CB 3.3Å; F2344-R2348 WeakPolarHBondContact O-CB 3.36Å; F2344-R2348 PolarHBondContact O-N 2.99Å
2345	Q	88.4	Confident	87.7	Confident	5 Å²	5	11 Å²	11	2%	0.023	6%	0.056	C	C	.	.	H	α-helix	trans	-67.4	-32.5	-179.8	-76.9	-66.7	-9.8	0	0	112.6	I1989 E2083 D2342 R2348 M2349	I1989-Q2345 VanDerWaalsContact CG2-OE1 3.22Å; E2083-Q2345 PolarHBondContact OE1-NE2 2.97Å; E2083-Q2345 PolarHBondContact OE1-OE1 2.95Å; D2342-Q2345 WeakPolarHBondContact OD1-CB 3.5Å; D2342-Q2345 PolarHBondContact OD1-N 2.84Å; D2342-Q2345 WeakPolarHBondContact OD2-CG 3.28Å; Q2345-R2348 PolarHBondContact O-N 3.13Å; Q2345-M2349 VanDerWaalsContact O-CB 3.26Å; Q2345-M2349 WeakPolarHBondContact O-CB 3.31Å; Q2345-M2349 PolarHBondContact O-N 2.87Å
2346	T	91.3	Very high	88	Confident	5 Å²	5	12 Å²	12	3%	0.031	7%	0.066	C	C	.	.	H	α-helix	trans	-62.3	-46.7	174.5	-58.3	0	0	0	0	111.3	I2330 V2331 D2342 M2343 F2344 M2349 L2350	I2330-T2346 HydrophobicContact CB-CG2 3.8Å; I2330-T2346 HydrophobicContact CD1-CG2 4.29Å; I2330-T2346 HydrophobicContact CG2-CG2 3.54Å; V2331-T2346 HydrophobicContact CG2-CG2 3.85Å; V2331-T2346 WeakPolarHBondContact CG2-OG1 3.34Å; D2342-T2346 WeakPolarHBondContact O-CB 3.47Å; D2342-T2346 PolarHBondContact O-N 3.25Å; D2342-T2346 PolarHBondContact O-OG1 3.44Å; M2343-T2346 PolarHBondContact O-N 2.99Å; F2344-T2346 VanDerWaalsContact C-N 3.31Å; F2344-T2346 PolarHBondContact O-N 2.93Å; T2346-M2349 PolarHBondContact O-N 2.97Å; T2346-L2350 WeakPolarHBondContact O-CG 3.46Å; T2346-L2350 PolarHBondContact O-N 2.79Å
2347	I	94.7	Very high	88.8	Confident	0 Å²	0	9.5 Å²	9.5	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-73.1	-34	179.9	-68.9	167.7	0	0	0	111.6	L2122 A2327 M2343 F2344 L2350 R2351 V2358 Y2364	L2122-I2347 HydrophobicContact CD1-CB 4.29Å; L2122-I2347 HydrophobicContact CD1-CG2 3.97Å; L2122-I2347 HydrophobicContact CD2-CG2 4.41Å; A2327-I2347 HydrophobicContact CB-CD1 4.11Å; A2327-I2347 HydrophobicContact CB-CG1 3.75Å; M2343-I2347 HydrophobicContact CG-CD1 3.87Å; M2343-I2347 PolarHBondContact O-N 3.43Å; M2343-I2347 HydrophobicContact SD-CD1 3.79Å; M2343-I2347 HydrophobicContact SD-CG1 4.34Å; F2344-I2347 PolarHBondContact O-N 2.92Å; I2347-L2350 PolarHBondContact O-N 3.09Å; I2347-R2351 WeakPolarHBondContact O-CG 3.24Å; I2347-R2351 PolarHBondContact O-N 2.87Å; I2347-V2358 HydrophobicContact CD1-CB 4.08Å; I2347-V2358 HydrophobicContact CD1-CG1 4.08Å; I2347-V2358 HydrophobicContact CD1-CG2 3.74Å; I2347-V2358 HydrophobicContact CG1-CB 4.44Å; I2347-V2358 HydrophobicContact CG1-CG2 3.89Å; I2347-V2358 HydrophobicContact CG2-CB 4.02Å; I2347-V2358 HydrophobicContact CG2-CG2 4.26Å; I2347-Y2364 HydrophobicContact CD1-CD2 3.57Å; I2347-Y2364 HydrophobicContact CD1-CE2 3.83Å
2348	R	90.6	Very high	90	Very high	8 Å²	8	7.8 Å²	7.8	3%	0.03	5%	0.049	C	C	.	.	H	α-helix	trans	-61.5	-42.6	171.5	-162.8	170.1	170.8	119.4	-8.1	111.4	I1989 E2083 D2086 L2122 F2125 F2344 Q2345 R2351 T2352	I1989-R2348 HydrophobicContact CD1-CB 4.22Å; I1989-R2348 HydrophobicContact CD1-CG 3.88Å; E2083-R2348 VanDerWaalsContact CD-NE 3.25Å; E2083-R2348 VanDerWaalsContact OE1-CD 3.32Å; E2083-R2348 WeakPolarHBondContact OE1-CD 3.42Å; E2083-R2348 IonicContact OE1-CZ 3.26Å; E2083-R2348 IonicContact OE1-NE 3.3Å; E2083-R2348 PolarHBondContact OE1-NE 2.83Å; E2083-R2348 IonicContact OE1-NH2 3.89Å; E2083-R2348 IonicContact OE2-CZ 2.99Å; E2083-R2348 VanDerWaalsContact OE2-CZ 3.23Å; E2083-R2348 IonicContact OE2-NE 3.17Å; E2083-R2348 PolarHBondContact OE2-NE 3.36Å; E2083-R2348 IonicContact OE2-NH2 3.44Å; E2083-R2348 PolarHBondContact OE2-NH2 3.37Å; D2086-R2348 IonicContact OD2-CZ 3.54Å; D2086-R2348 IonicContact OD2-NH1 3.69Å; D2086-R2348 PolarHBondContact OD2-NH1 2.91Å; D2086-R2348 IonicContact OD2-NH2 3.33Å; D2086-R2348 PolarHBondContact OD2-NH2 2.97Å; L2122-R2348 HydrophobicContact CD2-CB 3.87Å; L2122-R2348 HydrophobicContact CD2-CG 4.4Å; F2125-R2348 HydrophobicContact CD2-CG 4.15Å; F2125-R2348 HydrophobicContact CE2-CG 4.13Å; F2125-R2348 HydrophobicContact CG-CG 4.42Å; F2125-R2348 HydrophobicContact CZ-CG 4.39Å; F2344-R2348 VanDerWaalsContact O-CB 3.3Å; F2344-R2348 WeakPolarHBondContact O-CB 3.36Å; F2344-R2348 PolarHBondContact O-N 2.99Å; Q2345-R2348 PolarHBondContact O-N 3.13Å; R2348-R2351 PolarHBondContact O-N 2.84Å; R2348-R2351 VanDerWaalsContact O-N 3.14Å; R2348-T2352 PolarHBondContact O-N 3.13Å
2349	M	89	Confident	90.9	Very high	17 Å²	17	11.6 Å²	11.6	8%	0.084	7%	0.067	C	C	.	.	H	α-helix	trans	-70.8	-25.7	174	-173.4	165.2	62.7	0	0	114	Y1951 Y1987 I1989 P1990 L1993 Q2345 T2346 T2352 Q2353	Y1951-M2349 HydrophobicContact CE2-CE 4.45Å; Y1951-M2349 HydrophobicContact CE2-SD 3.86Å; Y1987-M2349 HydrophobicContact CE2-CG 4.12Å; Y1987-M2349 HydrophobicContact CE2-SD 4.49Å; I1989-M2349 HydrophobicContact CD1-CB 4.49Å; I1989-M2349 HydrophobicContact CG2-CB 4.24Å; I1989-M2349 HydrophobicContact CG2-SD 4.21Å; P1990-M2349 HydrophobicContact CG-SD 4.09Å; L1993-M2349 HydrophobicContact CD1-CE 4.34Å; Q2345-M2349 VanDerWaalsContact O-CB 3.26Å; Q2345-M2349 WeakPolarHBondContact O-CB 3.31Å; Q2345-M2349 PolarHBondContact O-N 2.87Å; T2346-M2349 PolarHBondContact O-N 2.97Å; M2349-T2352 PolarHBondContact O-OG1 2.8Å; M2349-Q2353 PolarHBondContact O-NE2 2.85Å
2350	L	93.5	Very high	91.7	Very high	1 Å²	1	12.7 Å²	12.7	1%	0.005	7%	0.07	C	C	.	.	H	α-helix	trans	-70.2	-37.4	166.5	-71.3	171.9	0	0	0	111.2	V2176 L2326 A2327 I2330 T2346 I2347 T2352 Q2353 R2354 M2357	V2176-L2350 HydrophobicContact CG1-CD2 3.47Å; V2176-L2350 VanDerWaalsContact CG1-CD2 3.47Å; L2326-L2350 HydrophobicContact CB-CD1 3.95Å; L2326-L2350 HydrophobicContact CB-CD2 3.94Å; A2327-L2350 HydrophobicContact CB-CD1 3.92Å; I2330-L2350 HydrophobicContact CD1-CD2 3.9Å; I2330-L2350 HydrophobicContact CD1-CG 4.4Å; T2346-L2350 WeakPolarHBondContact O-CG 3.46Å; T2346-L2350 PolarHBondContact O-N 2.79Å; I2347-L2350 PolarHBondContact O-N 3.09Å; L2350-T2352 VanDerWaalsContact C-N 3.29Å; L2350-T2352 PolarHBondContact O-N 2.95Å; L2350-Q2353 PolarHBondContact O-N 2.89Å; L2350-R2354 PolarHBondContact O-N 2.85Å; L2350-M2357 HydrophobicContact CB-CB 3.89Å; L2350-M2357 HydrophobicContact CB-CG 4.13Å
2351	R	93.2	Very high	92.1	Very high	16 Å²	16	14.2 Å²	14.2	6%	0.06	8%	0.077	C	C	.	.	H	α-helix	trans	-71.4	-14.3	178.8	-73.5	-179.3	176.4	-137.9	-1.9	114.7	L2122 F2125 Y2152 I2347 R2348 R2354 M2357 V2358	L2122-R2351 VanDerWaalsContact C-NH1 3.31Å; L2122-R2351 PolarHBondContact O-NH1 2.84Å; F2125-R2351 HydrophobicContact CD1-CB 4Å; F2125-R2351 HydrophobicContact CE1-CB 4.16Å; Y2152-R2351 WeakPolarHBondContact CE2-O 3.47Å; Y2152-R2351 PolarHBondContact OH-O 3.14Å; I2347-R2351 WeakPolarHBondContact O-CG 3.24Å; I2347-R2351 PolarHBondContact O-N 2.87Å; R2348-R2351 PolarHBondContact O-N 2.84Å; R2348-R2351 VanDerWaalsContact O-N 3.14Å; R2351-R2354 WeakPolarHBondContact CA-O 3.16Å; R2351-M2357 HydrophobicContact CG-CB 4.11Å; R2351-M2357 PolarHBondContact NE-O 3.04Å; R2351-M2357 PolarHBondContact NH2-O 2.89Å; R2351-M2357 VanDerWaalsContact NH2-O 3.14Å; R2351-V2358 PolarHBondContact NH2-O 3.07Å
2352	T	89.2	Confident	92.3	Very high	2 Å²	2	18 Å²	18	1%	0.012	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-21.1	165.7	64.9	0	0	0	0	112.8	Y1987 F2125 L2127 Y2152 R2348 M2349 L2350	Y1987-T2352 HydrophobicContact CD1-CG2 4.2Å; Y1987-T2352 HydrophobicContact CD2-CG2 4.18Å; Y1987-T2352 HydrophobicContact CG-CG2 3.87Å; F2125-T2352 HydrophobicContact CE1-CG2 4.15Å; F2125-T2352 HydrophobicContact CZ-CG2 3.9Å; L2127-T2352 HydrophobicContact CD1-CG2 4.11Å; Y2152-T2352 WeakPolarHBondContact CD2-O 3.1Å; Y2152-T2352 VanDerWaalsContact CE2-O 3.26Å; Y2152-T2352 WeakPolarHBondContact CE2-O 3.35Å; R2348-T2352 PolarHBondContact O-N 3.13Å; M2349-T2352 PolarHBondContact O-OG1 2.8Å; L2350-T2352 VanDerWaalsContact C-N 3.29Å; L2350-T2352 PolarHBondContact O-N 2.95Å
2353	Q	91.8	Very high	92.6	Very high	5 Å²	5	18.8 Å²	18.8	2%	0.023	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	-29.7	-175.1	-65.3	173.6	77.1	0	0	113.5	T2155 M2349 L2350	T2155-Q2353 HydrophobicContact CG2-CB 4.41Å; T2155-Q2353 HydrophobicContact CG2-CG 4.47Å; T2155-Q2353 PolarHBondContact OG1-O 2.82Å; M2349-Q2353 PolarHBondContact O-NE2 2.85Å; L2350-Q2353 PolarHBondContact O-N 2.89Å
2354	R	94.3	Very high	92.7	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.101	C	C	.	.	S	Bend	trans	-147.7	138.3	167.2	-175.7	169	173.1	81.4	-2.2	109.2	N2172 N2174 A2317 G2318 V2319 L2350 R2351 M2357	N2172-R2354 PolarHBondContact OD1-NH1 2.8Å; N2172-R2354 PolarHBondContact OD1-NH2 2.87Å; N2174-R2354 HydrophobicContact CB-CB 4.16Å; N2174-R2354 HydrophobicContact CB-CG 4.45Å; N2174-R2354 WeakPolarHBondContact OD1-CD 3.2Å; N2174-R2354 WeakPolarHBondContact OD1-CG 3.12Å; N2174-R2354 PolarHBondContact OD1-NH1 3.37Å; A2317-R2354 PolarHBondContact O-NH2 3.34Å; G2318-R2354 PolarHBondContact O-NE 2.9Å; V2319-R2354 HydrophobicContact CG1-CG 4.13Å; L2350-R2354 PolarHBondContact O-N 2.85Å; R2351-R2354 WeakPolarHBondContact CA-O 3.16Å; R2354-M2357 HydrophobicContact CB-CG 4.1Å; R2354-M2357 HydrophobicContact CB-SD 3.95Å; R2354-M2357 HydrophobicContact CG-SD 4.11Å; R2354-M2357 VanDerWaalsContact O-CG 3.24Å; R2354-M2357 WeakPolarHBondContact O-CG 3.37Å
2355	P	91.8	Very high	92.7	Very high	18 Å²	18	21.9 Å²	21.9	12%	0.117	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	146.9	-179.2	26.7	-34.3	0	0	0	112	Y2132 L2150 Y2152 V2319 M2357	Y2132-P2355 HydrophobicContact CE1-CG 4.46Å; L2150-P2355 WeakPolarHBondContact O-CD 3.39Å; L2150-P2355 VanDerWaalsContact O-CG 3.23Å; L2150-P2355 WeakPolarHBondContact O-CG 3.38Å; Y2152-P2355 HydrophobicContact CE1-CB 4.17Å; Y2152-P2355 HydrophobicContact CE1-CG 4.23Å; V2319-P2355 VanDerWaalsContact CG1-O 3.23Å; V2319-P2355 WeakPolarHBondContact CG1-O 3.4Å; P2355-M2357 PolarHBondContact O-N 2.84Å
2356	G	90.8	Very high	93	Very high	24 Å²	24	21.9 Å²	21.9	25%	0.247	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.9	9.8	169.1	0	0	0	0	0	117.2	V2358	G2356-V2358 PolarHBondContact O-N 3.24Å
2357	M	95.9	Very high	93.2	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.114	C	C	.	.			trans	-57.8	132.4	179.9	-60.2	-64.7	-85.2	0	0	112.3	A2187 V2319 T2322 L2326 L2350 R2351 R2354 P2355	A2187-M2357 HydrophobicContact CB-CE 4.28Å; V2319-M2357 HydrophobicContact CB-SD 4.22Å; V2319-M2357 HydrophobicContact CG1-SD 4.15Å; V2319-M2357 WeakPolarHBondContact O-CA 3.47Å; T2322-M2357 HydrophobicContact CG2-CE 4.37Å; L2326-M2357 HydrophobicContact CD1-CE 3.39Å; L2350-M2357 HydrophobicContact CB-CB 3.89Å; L2350-M2357 HydrophobicContact CB-CG 4.13Å; R2351-M2357 HydrophobicContact CG-CB 4.11Å; R2351-M2357 PolarHBondContact NE-O 3.04Å; R2351-M2357 PolarHBondContact NH2-O 2.89Å; R2351-M2357 VanDerWaalsContact NH2-O 3.14Å; R2354-M2357 HydrophobicContact CB-CG 4.1Å; R2354-M2357 HydrophobicContact CB-SD 3.95Å; R2354-M2357 HydrophobicContact CG-SD 4.11Å; R2354-M2357 VanDerWaalsContact O-CG 3.24Å; R2354-M2357 WeakPolarHBondContact O-CG 3.37Å; P2355-M2357 PolarHBondContact O-N 2.84Å
2358	V	95.7	Very high	93.3	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.114	C	C	.	.	S	Bend	trans	57.3	92.3	-167.5	-177.6	0	0	0	0	110.2	V2319 G2323 V2324 A2327 I2347 R2351 G2356 Q2363	V2319-V2358 PolarHBondContact O-N 3.45Å; V2319-V2358 VanDerWaalsContact O-N 3.12Å; G2323-V2358 WeakPolarHBondContact O-CG2 3.36Å; V2324-V2358 HydrophobicContact CG2-CG1 4.36Å; V2324-V2358 HydrophobicContact CG2-CG2 4.18Å; A2327-V2358 HydrophobicContact CB-CG2 4.19Å; I2347-V2358 HydrophobicContact CD1-CB 4.08Å; I2347-V2358 HydrophobicContact CD1-CG1 4.08Å; I2347-V2358 HydrophobicContact CD1-CG2 3.74Å; I2347-V2358 HydrophobicContact CG1-CB 4.44Å; I2347-V2358 HydrophobicContact CG1-CG2 3.89Å; I2347-V2358 HydrophobicContact CG2-CB 4.02Å; I2347-V2358 HydrophobicContact CG2-CG2 4.26Å; R2351-V2358 PolarHBondContact NH2-O 3.07Å; G2356-V2358 PolarHBondContact O-N 3.24Å; V2358-Q2363 HydrophobicContact CG1-CB 3.76Å
2359	Q	92	Very high	93.3	Very high	99 Å²	99	23.6 Å²	23.6	46%	0.463	13%	0.125	S	C	.	.			trans	-90.2	-20.9	-156.9	-172.3	173.3	-2.8	0	0	114.6
2360	T	93.9	Very high	93.6	Very high	38 Å²	38	22.8 Å²	22.8	23%	0.233	12%	0.121	C	C	.	.	S	Bend	trans	-130.1	162.7	-179.5	67.7	0	0	0	0	112.2	F2119 D2362 Q2363 Y2364	F2119-T2360 WeakPolarHBondContact CE2-O 3.37Å; T2360-D2362 VanDerWaalsContact C-N 3.35Å; T2360-Q2363 WeakPolarHBondContact O-CB 3.35Å; T2360-Q2363 PolarHBondContact O-N 3.06Å; T2360-Q2363 WeakPolarHBondContact OG1-CG 3.1Å; T2360-Q2363 PolarHBondContact OG1-N 3.17Å; T2360-Y2364 PolarHBondContact O-N 3.13Å; T2360-Y2364 VanDerWaalsContact O-N 3.14Å
2361	E	93.2	Very high	93.5	Very high	56 Å²	56	22.8 Å²	22.8	26%	0.262	12%	0.121	S	C	.	.	H	α-helix	trans	-64	-39.2	175.4	-171	174.8	168.2	0	0	111.8	E2116 F2119 Q2363 Y2364 Q2365	E2116-E2361 VanDerWaalsContact CA-OE1 3.27Å; E2116-E2361 WeakPolarHBondContact CA-OE1 3.47Å; E2116-E2361 WeakPolarHBondContact CB-OE1 3.45Å; E2116-E2361 WeakPolarHBondContact CG-OE2 3.48Å; E2116-E2361 PolarHBondContact N-OE1 2.75Å; F2119-E2361 HydrophobicContact CB-CB 4.5Å; F2119-E2361 HydrophobicContact CB-CG 4.25Å; F2119-E2361 HydrophobicContact CD1-CB 3.81Å; F2119-E2361 HydrophobicContact CD1-CG 4.44Å; F2119-E2361 HydrophobicContact CE1-CB 4.29Å; F2119-E2361 HydrophobicContact CG-CB 4.08Å; F2119-E2361 HydrophobicContact CG-CG 4.35Å; E2361-Q2363 PolarHBondContact O-N 3.48Å; E2361-Y2364 CarbonylContact O-C 3.56Å; E2361-Y2364 WeakPolarHBondContact O-CA 3.42Å; E2361-Y2364 WeakPolarHBondContact O-CB 3.35Å; E2361-Y2364 PolarHBondContact O-N 3.31Å; E2361-Q2365 PolarHBondContact O-N 2.94Å
2362	D	92.4	Very high	93.4	Very high	82 Å²	82	24.4 Å²	24.4	44%	0.439	13%	0.13	S	C	.	.	H	α-helix	trans	-52.6	-41.2	172.6	-46.3	-46.8	0	0	0	111.5	V2284 T2360 F2366	V2284-D2362 HydrophobicContact CG1-CB 3.87Å; V2284-D2362 HydrophobicContact CG2-CB 4.37Å; T2360-D2362 VanDerWaalsContact C-N 3.35Å; D2362-F2366 WeakPolarHBondContact O-CB 3.26Å; D2362-F2366 PolarHBondContact O-N 2.99Å
2363	Q	95.8	Very high	93.4	Very high	18 Å²	18	27.4 Å²	27.4	8%	0.084	14%	0.144	C	C	.	.	H	α-helix	trans	-70	-35	178.5	-70.5	171.9	15.9	0	0	111.7	W2279 V2284 G2320 V2324 V2358 T2360 E2361 C2367	W2279-Q2363 HydrophobicContact CZ2-CG 4.3Å; V2284-Q2363 HydrophobicContact CG1-CB 4.48Å; V2284-Q2363 HydrophobicContact CG1-CG 3.79Å; G2320-Q2363 VanDerWaalsContact CA-OE1 3.22Å; V2324-Q2363 HydrophobicContact CG2-CB 3.62Å; V2324-Q2363 HydrophobicContact CG2-CG 4Å; V2358-Q2363 HydrophobicContact CG1-CB 3.76Å; T2360-Q2363 WeakPolarHBondContact O-CB 3.35Å; T2360-Q2363 PolarHBondContact O-N 3.06Å; T2360-Q2363 WeakPolarHBondContact OG1-CG 3.1Å; T2360-Q2363 PolarHBondContact OG1-N 3.17Å; E2361-Q2363 PolarHBondContact O-N 3.48Å; Q2363-C2367 PolarHBondContact O-N 2.89Å; Q2363-C2367 PolarHBondContact O-SG 3.45Å; Q2363-C2367 VanDerWaalsContact O-N 3.11Å
2364	Y	95.7	Very high	93.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-67.9	-47.6	173.5	-170.2	-122.5	0	0	0	111.5	M2115 E2118 F2119 L2122 M2343 I2347 T2360 E2361 F2366 C2367 Y2368	M2115-Y2364 HydrophobicContact CE-CD1 3.65Å; M2115-Y2364 HydrophobicContact CE-CE1 3.44Å; M2115-Y2364 VanDerWaalsContact CE-CE1 3.44Å; M2115-Y2364 HydrophobicContact CG-CD1 4.26Å; E2118-Y2364 HydrophobicContact CB-CE1 3.75Å; E2118-Y2364 PolarHBondContact OE2-OH 2.72Å; F2119-Y2364 HydrophobicContact CB-CD1 3.98Å; F2119-Y2364 HydrophobicContact CD2-CD1 4.3Å; F2119-Y2364 AromaticContact CD2-CG 3.98Å; F2119-Y2364 HydrophobicContact CD2-CG 3.98Å; L2122-Y2364 HydrophobicContact CD1-CD2 3.97Å; L2122-Y2364 HydrophobicContact CD1-CE2 3.48Å; L2122-Y2364 VanDerWaalsContact CD1-CE2 3.48Å; M2343-Y2364 HydrophobicContact CG-CD2 4.33Å; M2343-Y2364 HydrophobicContact CG-CE2 3.88Å; I2347-Y2364 HydrophobicContact CD1-CD2 3.57Å; I2347-Y2364 HydrophobicContact CD1-CE2 3.83Å; T2360-Y2364 PolarHBondContact O-N 3.13Å; T2360-Y2364 VanDerWaalsContact O-N 3.14Å; E2361-Y2364 CarbonylContact O-C 3.56Å; E2361-Y2364 WeakPolarHBondContact O-CA 3.42Å; E2361-Y2364 WeakPolarHBondContact O-CB 3.35Å; E2361-Y2364 PolarHBondContact O-N 3.31Å; Y2364-F2366 PolarHBondContact O-N 2.99Å; Y2364-C2367 WeakPolarHBondContact O-CB 3.29Å; Y2364-C2367 PolarHBondContact O-N 2.98Å; Y2364-Y2368 PolarHBondContact OH-OH 2.75Å; Y2364-Y2368 PolarHBondContact O-N 3.29Å; Y2364-Y2368 AromaticContact CZ-CE2 3.62Å; Y2364-Y2368 AromaticContact CE2-CE2 3.98Å; Y2364-Y2368 HydrophobicContact CE1-CE2 3.92Å; Y2364-Y2368 AromaticContact CE1-CE2 3.92Å; Y2364-Y2368 HydrophobicContact CE2-CE2 3.98Å
2365	Q	93.7	Very high	92.8	Very high	66 Å²	66	29.3 Å²	29.3	31%	0.308	15%	0.152	S	C	.	.	H	α-helix	trans	-64.5	-38.7	176.3	-178.7	172.8	-20.2	0	0	112.2	M2115 E2361 C2367 Y2368 N2369	M2115-Q2365 HydrophobicContact CG-CB 4.43Å; M2115-Q2365 HydrophobicContact SD-CB 4.11Å; M2115-Q2365 HydrophobicContact SD-CG 4.26Å; E2361-Q2365 PolarHBondContact O-N 2.94Å; Q2365-C2367 VanDerWaalsContact C-N 3.32Å; Q2365-C2367 PolarHBondContact O-N 2.59Å; Q2365-Y2368 PolarHBondContact O-N 2.66Å; Q2365-N2369 PolarHBondContact O-N 2.64Å
2366	F	95.3	Very high	92.3	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.018	18%	0.175	C	C	.	.	H	α-helix	trans	-60.7	-40	172.5	178.5	-93.3	0	0	0	111.5	V2284 P2285 C2288 F2291 V2324 L2328 D2362 Y2364 Y2368 N2369 A2370	V2284-F2366 HydrophobicContact CB-CB 4.14Å; V2284-F2366 HydrophobicContact CB-CD2 4.03Å; V2284-F2366 HydrophobicContact CB-CG 4.15Å; V2284-F2366 HydrophobicContact CG1-CB 4.08Å; V2284-F2366 HydrophobicContact CG1-CG 4.44Å; V2284-F2366 HydrophobicContact CG2-CB 4.2Å; V2284-F2366 HydrophobicContact CG2-CD2 4.14Å; V2284-F2366 HydrophobicContact CG2-CG 4.46Å; P2285-F2366 HydrophobicContact CB-CE2 3.95Å; P2285-F2366 HydrophobicContact CB-CZ 4.15Å; P2285-F2366 HydrophobicContact CG-CE2 4.18Å; P2285-F2366 HydrophobicContact CG-CZ 4.03Å; P2285-F2366 VanDerWaalsContact O-CE2 3.28Å; P2285-F2366 WeakPolarHBondContact O-CE2 3.32Å; C2288-F2366 HydrophobicContact CB-CE2 4.32Å; C2288-F2366 HydrophobicContact CB-CZ 4.42Å; F2291-F2366 HydrophobicContact CB-CE1 4.42Å; F2291-F2366 HydrophobicContact CB-CZ 3.92Å; F2291-F2366 AromaticContact CD1-CE1 3.9Å; F2291-F2366 HydrophobicContact CD1-CE1 3.9Å; F2291-F2366 HydrophobicContact CD1-CZ 4.27Å; F2291-F2366 HydrophobicContact CG-CE1 4.31Å; F2291-F2366 HydrophobicContact CG-CZ 4.26Å; V2324-F2366 HydrophobicContact CG1-CD1 3.68Å; V2324-F2366 HydrophobicContact CG1-CE1 3.81Å; L2328-F2366 HydrophobicContact CD1-CD1 4.42Å; L2328-F2366 HydrophobicContact CD1-CE1 4.01Å; D2362-F2366 WeakPolarHBondContact O-CB 3.26Å; D2362-F2366 PolarHBondContact O-N 2.99Å; Y2364-F2366 PolarHBondContact O-N 2.99Å; F2366-Y2368 VanDerWaalsContact C-N 3.35Å; F2366-Y2368 PolarHBondContact O-N 2.84Å; F2366-N2369 PolarHBondContact O-N 2.77Å; F2366-A2370 PolarHBondContact O-N 3.13Å; F2366-A2370 WeakPolarHBondContact O-CB 3.11Å
2367	C	95.9	Very high	91.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-60.4	-42.3	173.9	-70.2	0	0	0	0	112.2	L2328 M2343 Q2363 Y2364 Q2365 V2371	L2328-C2367 HydrophobicContact CD2-CB 4.27Å; L2328-C2367 WeakPolarHBondContact CD2-O 3.49Å; M2343-C2367 HydrophobicContact CE-CB 3.64Å; M2343-C2367 HydrophobicContact CG-CB 4.26Å; M2343-C2367 HydrophobicContact SD-CB 3.59Å; M2343-C2367 VanDerWaalsContact SD-CB 3.59Å; Q2363-C2367 PolarHBondContact O-N 2.89Å; Q2363-C2367 PolarHBondContact O-SG 3.45Å; Q2363-C2367 VanDerWaalsContact O-N 3.11Å; Y2364-C2367 WeakPolarHBondContact O-CB 3.29Å; Y2364-C2367 PolarHBondContact O-N 2.98Å; Q2365-C2367 VanDerWaalsContact C-N 3.32Å; Q2365-C2367 PolarHBondContact O-N 2.59Å; C2367-V2371 VanDerWaalsContact O-CG2 3.29Å; C2367-V2371 WeakPolarHBondContact O-CG2 3.46Å; C2367-V2371 PolarHBondContact O-N 2.94Å; C2367-V2371 VanDerWaalsContact O-N 3.17Å
2368	Y	94.8	Very high	90.2	Very high	1 Å²	1	33.2 Å²	33.2	0%	0.004	18%	0.175	C	C	.	.	H	α-helix	trans	-66.9	-40.3	174.6	-85.4	-93.1	0	0	0	113.1	L2097 H2100 I2101 L2104 M2115 E2118 M2343 Y2364 Q2365 F2366 V2371 L2372	L2097-Y2368 HydrophobicContact CD1-CD1 4.27Å; H2100-Y2368 AromaticContact CD2-CE1 3.78Å; H2100-Y2368 AromaticContact NE2-CE1 3.66Å; I2101-Y2368 HydrophobicContact CD1-CD1 3.96Å; I2101-Y2368 HydrophobicContact CG1-CD1 3.6Å; I2101-Y2368 HydrophobicContact CG1-CE1 4.41Å; I2101-Y2368 HydrophobicContact CG1-CG 4.32Å; L2104-Y2368 HydrophobicContact CD1-CE1 4.14Å; M2115-Y2368 HydrophobicContact CE-CD1 4.48Å; M2115-Y2368 HydrophobicContact CE-CD2 3.27Å; M2115-Y2368 HydrophobicContact CE-CE1 4.47Å; M2115-Y2368 HydrophobicContact CE-CE2 3.29Å; M2115-Y2368 HydrophobicContact CE-CG 3.9Å; M2115-Y2368 HydrophobicContact SD-CD2 4.33Å; E2118-Y2368 PolarHBondContact OE2-OH 2.78Å; M2343-Y2368 HydrophobicContact CB-CD2 4.1Å; M2343-Y2368 HydrophobicContact CB-CE1 4.23Å; M2343-Y2368 HydrophobicContact CB-CE2 3.42Å; M2343-Y2368 VanDerWaalsContact CB-CE2 3.42Å; M2343-Y2368 HydrophobicContact CG-CD2 3.84Å; M2343-Y2368 HydrophobicContact CG-CE2 3.5Å; M2343-Y2368 VanDerWaalsContact CG-CE2 3.5Å; Y2364-Y2368 PolarHBondContact OH-OH 2.75Å; Y2364-Y2368 PolarHBondContact O-N 3.29Å; Y2364-Y2368 AromaticContact CZ-CE2 3.62Å; Y2364-Y2368 AromaticContact CE2-CE2 3.98Å; Y2364-Y2368 HydrophobicContact CE1-CE2 3.92Å; Y2364-Y2368 AromaticContact CE1-CE2 3.92Å; Y2364-Y2368 HydrophobicContact CE2-CE2 3.98Å; Q2365-Y2368 PolarHBondContact O-N 2.66Å; F2366-Y2368 VanDerWaalsContact C-N 3.35Å; F2366-Y2368 PolarHBondContact O-N 2.84Å; Y2368-V2371 PolarHBondContact O-N 2.79Å; Y2368-L2372 WeakPolarHBondContact O-CB 3.32Å; Y2368-L2372 PolarHBondContact O-N 3.22Å
2369	N	92.5	Very high	88.1	Confident	49 Å²	49	38.1 Å²	38.1	26%	0.262	20%	0.201	S	C	.	.	H	α-helix	trans	-58.4	-50.8	174.2	-77.6	-17.9	0	0	0	110.9	R2105 Q2365 F2366 V2371 L2372 E2373	R2105-N2369 PolarHBondContact NH2-OD1 2.98Å; Q2365-N2369 PolarHBondContact O-N 2.64Å; F2366-N2369 PolarHBondContact O-N 2.77Å; N2369-V2371 VanDerWaalsContact C-N 3.31Å; N2369-V2371 PolarHBondContact O-N 2.85Å; N2369-L2372 PolarHBondContact O-N 2.65Å; N2369-L2372 VanDerWaalsContact O-N 3.11Å; N2369-E2373 PolarHBondContact O-N 2.68Å; N2369-E2373 WeakPolarHBondContact O-CB 3.27Å
2370	A	93.3	Very high	86	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64	-33.4	-176.9	0	0	0	0	0	113.1	C2288 I2292 L2328 F2366 Y2374	C2288-A2370 HydrophobicContact CB-CB 3.68Å; I2292-A2370 HydrophobicContact CD1-CB 4.1Å; I2292-A2370 VanDerWaalsContact CD1-O 3.32Å; I2292-A2370 WeakPolarHBondContact CD1-O 3.47Å; I2292-A2370 HydrophobicContact CG1-CB 4.2Å; L2328-A2370 HydrophobicContact CD1-CB 3.66Å; L2328-A2370 HydrophobicContact CD2-CB 3.74Å; L2328-A2370 HydrophobicContact CG-CB 4.38Å; F2366-A2370 PolarHBondContact O-N 3.13Å; F2366-A2370 WeakPolarHBondContact O-CB 3.11Å; A2370-Y2374 VanDerWaalsContact O-CB 3.25Å; A2370-Y2374 WeakPolarHBondContact O-CB 3.33Å; A2370-Y2374 PolarHBondContact O-N 2.92Å
2371	V	92.8	Very high	83.4	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-72	-38.5	173.3	-179.5	0	0	0	0	111.6	L2097 L2328 V2331 L2332 M2335 V2341 M2343 C2367 Y2368 N2369 L2375	L2097-V2371 HydrophobicContact CD2-CB 4.33Å; L2097-V2371 HydrophobicContact CD2-CG1 3.74Å; L2328-V2371 HydrophobicContact CD2-CG2 3.72Å; V2331-V2371 HydrophobicContact CB-CG2 4.22Å; V2331-V2371 HydrophobicContact CG1-CG1 4.06Å; V2331-V2371 HydrophobicContact CG1-CG2 3.61Å; L2332-V2371 HydrophobicContact CD2-CB 4.25Å; L2332-V2371 HydrophobicContact CD2-CG2 3.77Å; M2335-V2371 HydrophobicContact CE-CG1 4.21Å; M2335-V2371 HydrophobicContact SD-CG1 3.59Å; M2335-V2371 VanDerWaalsContact SD-CG1 3.59Å; V2341-V2371 HydrophobicContact CG1-CG1 4.19Å; V2341-V2371 HydrophobicContact CG2-CG1 3.69Å; M2343-V2371 HydrophobicContact CE-CG2 3.58Å; C2367-V2371 VanDerWaalsContact O-CG2 3.29Å; C2367-V2371 WeakPolarHBondContact O-CG2 3.46Å; C2367-V2371 PolarHBondContact O-N 2.94Å; C2367-V2371 VanDerWaalsContact O-N 3.17Å; Y2368-V2371 PolarHBondContact O-N 2.79Å; N2369-V2371 VanDerWaalsContact C-N 3.31Å; N2369-V2371 PolarHBondContact O-N 2.85Å; V2371-L2375 VanDerWaalsContact O-CB 3.25Å; V2371-L2375 WeakPolarHBondContact O-CB 3.12Å; V2371-L2375 PolarHBondContact O-N 3.1Å
2372	L	91.2	Very high	80.4	Confident	51 Å²	51	43.2 Å²	43.2	27%	0.267	23%	0.228	S	C	.	.	H	α-helix	trans	-67.3	-39.9	175.3	-178	66	0	0	0	112.2	L2097 I2101 Y2368 N2369 L2375 S2376	L2097-L2372 HydrophobicContact CD2-CB 4.22Å; L2097-L2372 HydrophobicContact CD2-CD1 4.32Å; L2097-L2372 HydrophobicContact CG-CD1 4.43Å; I2101-L2372 HydrophobicContact CD1-CB 3.85Å; I2101-L2372 HydrophobicContact CD1-CD1 4.49Å; I2101-L2372 HydrophobicContact CD1-CD2 3.98Å; I2101-L2372 HydrophobicContact CD1-CG 4.33Å; Y2368-L2372 WeakPolarHBondContact O-CB 3.32Å; Y2368-L2372 PolarHBondContact O-N 3.22Å; N2369-L2372 PolarHBondContact O-N 2.65Å; N2369-L2372 VanDerWaalsContact O-N 3.11Å; L2372-L2375 WeakPolarHBondContact O-CB 3.43Å; L2372-L2375 PolarHBondContact O-N 3.1Å; L2372-S2376 PolarHBondContact O-N 2.95Å
2373	E	88.6	Confident	77.4	Confident	64 Å²	64	47.7 Å²	47.7	30%	0.299	26%	0.258	S	S	.	.	H	α-helix	trans	-67.5	-44.2	176.5	-161.2	175.3	123.5	0	0	110.5	C2288 E2289 I2292 N2369 L2375 S2376 S2377	C2288-E2373 HydrophobicContact CB-CB 4.36Å; C2288-E2373 WeakPolarHBondContact CB-OE2 3.3Å; C2288-E2373 PolarHBondContact SG-OE2 3.08Å; E2289-E2373 WeakPolarHBondContact CA-OE1 3.45Å; E2289-E2373 WeakPolarHBondContact CB-OE1 3.44Å; E2289-E2373 PolarHBondContact N-OE1 3.16Å; I2292-E2373 HydrophobicContact CD1-CB 4.27Å; N2369-E2373 PolarHBondContact O-N 2.68Å; N2369-E2373 WeakPolarHBondContact O-CB 3.27Å; E2373-L2375 VanDerWaalsContact C-N 3.35Å; E2373-L2375 PolarHBondContact O-N 3.35Å; E2373-S2376 PolarHBondContact O-N 3.35Å; E2373-S2376 PolarHBondContact O-OG 3.07Å; E2373-S2377 PolarHBondContact O-N 2.92Å
2374	Y	87.2	Confident	76.4	Confident	29 Å²	29	49.2 Å²	49.2	11%	0.114	27%	0.267	C	S	.	.	H	α-helix	trans	-62.2	-40.6	172.5	-170.3	-127.3	0	0	0	112.5	I2292 L2332 M2335 R2336 A2370 S2376 S2377 F2378	I2292-Y2374 HydrophobicContact CG2-CD2 3.83Å; I2292-Y2374 HydrophobicContact CG2-CE2 4.37Å; I2292-Y2374 HydrophobicContact CG2-CG 4.49Å; L2332-Y2374 HydrophobicContact CB-CD1 3.99Å; L2332-Y2374 HydrophobicContact CB-CE1 4.01Å; L2332-Y2374 HydrophobicContact CD2-CD1 3.43Å; L2332-Y2374 VanDerWaalsContact CD2-CD1 3.43Å; L2332-Y2374 HydrophobicContact CD2-CE1 4.31Å; L2332-Y2374 HydrophobicContact CD2-CG 3.78Å; L2332-Y2374 HydrophobicContact CG-CD1 4.17Å; M2335-Y2374 HydrophobicContact CE-CD1 3.78Å; R2336-Y2374 WeakPolarHBondContact CD-OH 3.27Å; R2336-Y2374 HydrophobicContact CG-CE1 4.06Å; R2336-Y2374 PolarHBondContact NH1-OH 3.16Å; A2370-Y2374 VanDerWaalsContact O-CB 3.25Å; A2370-Y2374 WeakPolarHBondContact O-CB 3.33Å; A2370-Y2374 PolarHBondContact O-N 2.92Å; Y2374-S2376 VanDerWaalsContact C-N 3.28Å; Y2374-S2376 PolarHBondContact O-N 2.85Å; Y2374-S2377 WeakPolarHBondContact O-CB 3.43Å; Y2374-S2377 PolarHBondContact O-N 3.49Å; Y2374-S2377 PolarHBondContact O-OG 2.83Å; Y2374-F2378 WeakPolarHBondContact O-CE2 3.47Å; Y2374-F2378 WeakPolarHBondContact O-CD2 3.49Å; Y2374-F2378 VanDerWaalsContact O-CD2 3.26Å; Y2374-F2378 AromaticContact CE1-CE2 3.59Å; Y2374-F2378 AromaticContact CZ-CZ 3.58Å; Y2374-F2378 AromaticContact CZ-CE2 3.64Å; Y2374-F2378 HydrophobicContact CG-CE2 4.19Å; Y2374-F2378 HydrophobicContact CE2-CZ 4.14Å; Y2374-F2378 AromaticContact CE2-CE2 3.97Å; Y2374-F2378 HydrophobicContact CE1-CZ 3.83Å; Y2374-F2378 AromaticContact CE1-CZ 3.83Å; Y2374-F2378 HydrophobicContact CE1-CE2 3.59Å; Y2374-F2378 HydrophobicContact CD2-CE2 4.24Å; Y2374-F2378 HydrophobicContact CD1-CE2 3.86Å; Y2374-F2378 AromaticContact CD1-CE2 3.86Å; Y2374-F2378 HydrophobicContact CE2-CE2 3.97Å
2375	L	86.2	Confident	75.4	Confident	16 Å²	16	51.7 Å²	51.7	8%	0.084	28%	0.281	C	S	.	.	H	α-helix	trans	-58.3	-40.9	174.4	-178.5	63	0	0	0	111.7	A2094 L2097 M2335 V2371 L2372 E2373 S2377 F2378 Y2381	A2094-L2375 HydrophobicContact CB-CD1 3.87Å; A2094-L2375 HydrophobicContact CB-CD2 4.33Å; A2094-L2375 WeakPolarHBondContact O-CD2 3.38Å; L2097-L2375 HydrophobicContact CB-CD2 4.14Å; L2097-L2375 HydrophobicContact CD2-CD2 4.05Å; M2335-L2375 HydrophobicContact CE-CB 3.89Å; M2335-L2375 HydrophobicContact CE-CD1 4.08Å; M2335-L2375 HydrophobicContact SD-CB 4.22Å; M2335-L2375 HydrophobicContact SD-CD1 4.04Å; V2371-L2375 VanDerWaalsContact O-CB 3.25Å; V2371-L2375 WeakPolarHBondContact O-CB 3.12Å; V2371-L2375 PolarHBondContact O-N 3.1Å; L2372-L2375 WeakPolarHBondContact O-CB 3.43Å; L2372-L2375 PolarHBondContact O-N 3.1Å; E2373-L2375 VanDerWaalsContact C-N 3.35Å; E2373-L2375 PolarHBondContact O-N 3.35Å; L2375-S2377 PolarHBondContact O-N 2.94Å; L2375-F2378 PolarHBondContact O-N 2.82Å; L2375-Y2381 HydrophobicContact CD1-CG 4.24Å
2376	S	81.2	Confident	74.4	Confident	85 Å²	85	50.9 Å²	50.9	59%	0.594	28%	0.28	S	S	*	.	H	α-helix	trans	-65.7	-17.4	177.3	78.2	0	0	0	0	114.3	L2372 E2373 Y2374 F2378	L2372-S2376 PolarHBondContact O-N 2.95Å; E2373-S2376 PolarHBondContact O-N 3.35Å; E2373-S2376 PolarHBondContact O-OG 3.07Å; Y2374-S2376 VanDerWaalsContact C-N 3.28Å; Y2374-S2376 PolarHBondContact O-N 2.85Å; S2376-F2378 VanDerWaalsContact C-N 3.32Å; S2376-F2378 PolarHBondContact O-N 2.69Å
2377	S	75.2	Confident	73.2	Confident	26 Å²	26	53.7 Å²	53.7	18%	0.182	30%	0.295	C	S	.	.	H	α-helix	trans	-73.4	-20.2	174.8	77.3	0	0	0	0	113.6	K333 E2373 Y2374 L2375	K333-S2377 VanDerWaalsContact CD-O 3.32Å; K333-S2377 WeakPolarHBondContact CD-O 3.24Å; K333-S2377 VanDerWaalsContact CE-O 3.25Å; K333-S2377 WeakPolarHBondContact CE-O 3.35Å; K333-S2377 PolarHBondContact NZ-O 3.23Å; E2373-S2377 PolarHBondContact O-N 2.92Å; Y2374-S2377 WeakPolarHBondContact O-CB 3.43Å; Y2374-S2377 PolarHBondContact O-N 3.49Å; Y2374-S2377 PolarHBondContact O-OG 2.83Å; L2375-S2377 PolarHBondContact O-N 2.94Å
2378	F	68	Low	71.8	Confident	13 Å²	13	57.1 Å²	57.1	6%	0.057	31%	0.313	C	S	.	.			trans	-92.2	131	179.8	-64.3	-87.2	0	0	0	112.5	E247 R2336 Y2374 L2375 S2376 H2380 Y2381	E247-F2378 HydrophobicContact CB-CD1 3.8Å; E247-F2378 HydrophobicContact CB-CE1 3.95Å; E247-F2378 HydrophobicContact CG-CD1 4.43Å; E247-F2378 VanDerWaalsContact OE2-CA 3.32Å; E247-F2378 WeakPolarHBondContact OE2-CA 3.22Å; R2336-F2378 HydrophobicContact CG-CZ 4.19Å; Y2374-F2378 WeakPolarHBondContact O-CE2 3.47Å; Y2374-F2378 WeakPolarHBondContact O-CD2 3.49Å; Y2374-F2378 VanDerWaalsContact O-CD2 3.26Å; Y2374-F2378 AromaticContact CE1-CE2 3.59Å; Y2374-F2378 AromaticContact CZ-CZ 3.58Å; Y2374-F2378 AromaticContact CZ-CE2 3.64Å; Y2374-F2378 HydrophobicContact CG-CE2 4.19Å; Y2374-F2378 HydrophobicContact CE2-CZ 4.14Å; Y2374-F2378 AromaticContact CE2-CE2 3.97Å; Y2374-F2378 HydrophobicContact CE1-CZ 3.83Å; Y2374-F2378 AromaticContact CE1-CZ 3.83Å; Y2374-F2378 HydrophobicContact CE1-CE2 3.59Å; Y2374-F2378 HydrophobicContact CD2-CE2 4.24Å; Y2374-F2378 HydrophobicContact CD1-CE2 3.86Å; Y2374-F2378 AromaticContact CD1-CE2 3.86Å; Y2374-F2378 HydrophobicContact CE2-CE2 3.97Å; L2375-F2378 PolarHBondContact O-N 2.82Å; S2376-F2378 VanDerWaalsContact C-N 3.32Å; S2376-F2378 PolarHBondContact O-N 2.69Å; F2378-H2380 VanDerWaalsContact C-N 3.26Å; F2378-H2380 PolarHBondContact O-N 2.87Å; F2378-Y2381 HydrophobicContact CB-CD2 4.02Å; F2378-Y2381 HydrophobicContact CG-CD2 4.18Å
2379	D	50.5	Low	70.2	Confident	103 Å²	103	60.8 Å²	60.8	55%	0.551	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-12.9	176.8	-72.9	-44.6	0	0	0	113.5	E247 K333 S2382	E247-D2379 PolarHBondContact OE2-N 2.76Å; K333-D2379 VanDerWaalsContact CE-CG 3.47Å; K333-D2379 VanDerWaalsContact CE-OD1 3.24Å; K333-D2379 WeakPolarHBondContact CE-OD1 3.43Å; K333-D2379 WeakPolarHBondContact CE-OD2 3.14Å; K333-D2379 IonicContact NZ-OD1 3.14Å; K333-D2379 PolarHBondContact NZ-OD1 3.17Å; K333-D2379 IonicContact NZ-OD2 3.8Å; K333-D2379 PolarHBondContact NZ-OD2 3.47Å; D2379-S2382 PolarHBondContact O-OG 2.99Å
2380	H	48.3	Very low	68.6	Low	131 Å²	131	61.6 Å²	61.6	61%	0.606	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	1.8	-170	-73.7	-96.2	0	0	0	115.5	K245 E247 F2378	K245-H2380 PolarHBondContact NZ-CD2 3.45Å; K245-H2380 PolarHBondContact NZ-NE2 2.86Å; E247-H2380 IonicContact OE1-CD2 3.64Å; F2378-H2380 VanDerWaalsContact C-N 3.26Å; F2378-H2380 PolarHBondContact O-N 2.87Å
2381	Y	40.5	Very low	66.7	Low	83 Å²	83	66.4 Å²	66.4	33%	0.325	37%	0.365	S	S	.	.	S	Bend	trans	-115.6	3.5	177.9	-79.9	-77.2	0	0	0	113.6	A2094 R2336 L2375 F2378	A2094-Y2381 HydrophobicContact CB-CD1 4.44Å; R2336-Y2381 PolarHBondContact O-OH 3.08Å; L2375-Y2381 HydrophobicContact CD1-CG 4.24Å; F2378-Y2381 HydrophobicContact CB-CD2 4.02Å; F2378-Y2381 HydrophobicContact CG-CD2 4.18Å
2382	S	30.3	Very low	64.6	Low	86 Å²	86	71.9 Å²	71.9	60%	0.601	40%	0.396	S	S	*	.			trans	-99.3	23.7	-175.3	50.6	0	0	0	0	114	D2379	D2379-S2382 PolarHBondContact O-OG 2.99Å
2383	V	27.7	Very low	62.2	Low	176 Å²	176	73.8 Å²	73.8	100%	1.067	41%	0.407	S	S	*	.			trans	-133.5	0	178.1	-172	0	0	0	0	110

Retrieved 2,383 of 2,383 residues in 2844.6 ms (Link to these results)

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